NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12131 |
1skt   |
4232 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ALA 1 HT3 ALA 1 64.316 -4.319 -4.319
2 2H ALA 1 HT2 ALA 1 65.756 -4.283 -4.283
3 3H ALA 1 HT1 ALA 1 64.523 -5.378 -5.378
4 HA ALA 1 HA ALA 1 66.083 -6.692 -6.692
5 1HB ALA 1 HB2 ALA 1 66.533 -4.083 -4.083
6 2HB ALA 1 HB1 ALA 1 66.496 -5.345 -5.345
7 3HB ALA 1 HB3 ALA 1 67.634 -5.457 -5.457
8 H SER 2 HN SER 2 65.792 -7.816 -7.816
9 HA SER 2 HA SER 2 62.899 -8.127 -8.127
10 1HB SER 2 HB2 SER 2 65.254 -9.692 -9.692
11 2HB SER 2 HB1 SER 2 64.626 -9.617 -9.617
12 HG SER 2 HG SER 2 63.118 -10.276 -10.276
13 H MET 3 HN MET 3 64.921 -5.839 -5.839
14 HA MET 3 HA MET 3 64.522 -5.972 -5.972
15 1HB MET 3 HB2 MET 3 65.921 -4.372 -4.372
16 2HB MET 3 HB1 MET 3 65.248 -3.383 -3.383
17 1HG MET 3 HG2 MET 3 66.341 -4.835 -4.835
18 2HG MET 3 HG1 MET 3 67.026 -5.813 -5.813
19 1HE MET 3 HE3 MET 3 68.232 -5.115 -5.115
20 2HE MET 3 HE2 MET 3 68.169 -3.420 -3.420
21 3HE MET 3 HE1 MET 3 69.668 -4.094 -4.094
22 H THR 4 HN THR 4 62.895 -4.504 -4.504
23 HA THR 4 HA THR 4 61.342 -2.514 -2.514
24 HB THR 4 HB THR 4 61.580 -2.998 -2.998
25 HG1 THR 4 HG1 THR 4 58.857 -3.096 -3.096
26 1HG2 THR 4 HG23 THR 4 61.267 -5.471 -5.471
27 2HG2 THR 4 HG22 THR 4 59.560 -5.182 -5.182
28 3HG2 THR 4 HG21 THR 4 60.235 -4.755 -4.755
29 H ASP 5 HN ASP 5 61.213 -5.945 -5.945
30 HA ASP 5 HA ASP 5 58.400 -6.007 -6.007
31 1HB ASP 5 HB2 ASP 5 60.654 -7.917 -7.917
32 2HB ASP 5 HB1 ASP 5 59.349 -8.437 -8.437
33 H GLN 6 HN GLN 6 61.637 -6.485 -6.485
34 HA GLN 6 HA GLN 6 60.620 -6.788 -6.788
35 1HB GLN 6 HB2 GLN 6 63.255 -6.393 -6.393
36 2HB GLN 6 HB1 GLN 6 63.182 -6.197 -6.197
37 1HG GLN 6 HG2 GLN 6 62.305 -8.643 -8.643
38 2HG GLN 6 HG1 GLN 6 63.738 -8.518 -8.518
39 1HE2 GLN 6 HE22 GLN 6 61.464 -8.085 -8.085
40 2HE2 GLN 6 HE21 GLN 6 62.608 -7.088 -7.088
41 H GLN 7 HN GLN 7 60.887 -4.091 -4.091
42 HA GLN 7 HA GLN 7 61.603 -2.099 -2.099
43 1HB GLN 7 HB2 GLN 7 61.680 -2.219 -2.219
44 2HB GLN 7 HB1 GLN 7 60.127 -1.406 -1.406
45 1HG GLN 7 HG2 GLN 7 61.778 -0.101 -0.101
46 2HG GLN 7 HG1 GLN 7 62.824 -0.368 -0.368
47 1HE2 GLN 7 HE22 GLN 7 61.060 2.809 2.809
48 2HE2 GLN 7 HE21 GLN 7 62.237 2.256 2.256
49 H ALA 8 HN ALA 8 58.610 -3.387 -3.387
50 HA ALA 8 HA ALA 8 56.935 -1.460 -1.460
51 1HB ALA 8 HB2 ALA 8 56.762 -2.936 -2.936
52 2HB ALA 8 HB1 ALA 8 55.639 -3.755 -3.755
53 3HB ALA 8 HB3 ALA 8 55.443 -2.035 -2.035
54 H GLU 9 HN GLU 9 57.842 -4.888 -4.888
55 HA GLU 9 HA GLU 9 55.987 -5.465 -5.465
56 1HB GLU 9 HB2 GLU 9 56.675 -7.066 -7.066
57 2HB GLU 9 HB1 GLU 9 58.308 -7.053 -7.053
58 1HG GLU 9 HG2 GLU 9 57.583 -8.036 -8.036
59 2HG GLU 9 HG1 GLU 9 55.884 -7.755 -7.755
60 H ALA 10 HN ALA 10 59.049 -4.006 -4.006
61 HA ALA 10 HA ALA 10 60.242 -5.041 -5.041
62 1HB ALA 10 HB1 ALA 10 60.761 -3.011 -3.011
63 2HB ALA 10 HB3 ALA 10 61.462 -2.649 -2.649
64 3HB ALA 10 HB2 ALA 10 61.872 -4.155 -4.155
65 H ARG 11 HN ARG 11 58.163 -2.296 -2.296
66 HA ARG 11 HA ARG 11 58.272 -1.373 -1.373
67 1HB ARG 11 HB2 ARG 11 56.651 0.267 0.267
68 2HB ARG 11 HB1 ARG 11 58.119 0.702 0.702
69 1HG ARG 11 HG2 ARG 11 58.801 1.031 1.031
70 2HG ARG 11 HG1 ARG 11 59.291 -0.646 -0.646
71 1HD ARG 11 HD2 ARG 11 57.818 -1.359 -1.359
72 2HD ARG 11 HD1 ARG 11 56.495 -0.432 -0.432
73 HE ARG 11 HE ARG 11 58.463 1.244 1.244
74 1HH1 ARG 11 HH2 ARG 11 55.231 0.411 0.411
75 2HH1 ARG 11 HH2 ARG 11 54.801 0.777 0.777
76 1HH2 ARG 11 HH1 ARG 11 58.073 1.275 1.275
77 2HH2 ARG 11 HH1 ARG 11 56.409 1.267 1.267
78 H ALA 12 HN ALA 12 56.179 -2.830 -2.830
79 HA ALA 12 HA ALA 12 53.661 -2.295 -2.295
80 1HB ALA 12 HB3 ALA 12 54.177 -3.030 -3.030
81 2HB ALA 12 HB2 ALA 12 54.379 -4.656 -4.656
82 3HB ALA 12 HB1 ALA 12 52.821 -3.842 -3.842
83 H PHE 13 HN PHE 13 56.212 -4.633 -4.633
84 HA PHE 13 HA PHE 13 54.862 -6.743 -6.743
85 1HB PHE 13 HB2 PHE 13 57.010 -7.276 -7.276
86 2HB PHE 13 HB1 PHE 13 57.349 -6.368 -6.368
87 HD1 PHE 13 HD1 PHE 13 57.048 -3.608 -3.608
88 HD2 PHE 13 HD2 PHE 13 58.559 -6.767 -6.767
89 HE1 PHE 13 HE1 PHE 13 58.333 -1.951 -1.951
90 HE2 PHE 13 HE2 PHE 13 59.845 -5.107 -5.107
91 HZ PHE 13 HZ PHE 13 59.732 -2.701 -2.701
92 H LEU 14 HN LEU 14 55.238 -3.463 -3.463
93 HA LEU 14 HA LEU 14 54.062 -4.210 -4.210
94 1HB LEU 14 HB2 LEU 14 56.301 -2.331 -2.331
95 2HB LEU 14 HB1 LEU 14 55.423 -2.132 -2.132
96 HG LEU 14 HG LEU 14 56.942 -4.593 -4.593
97 HD1 LEU 14 HD1 LEU 14 57.383 -3.011 -3.011
98 HD1 LEU 14 HD1 LEU 14 58.103 -2.474 -2.474
99 HD1 LEU 14 HD1 LEU 14 58.510 -4.059 -4.059
100 HD2 LEU 14 HD2 LEU 14 56.207 -4.889 -4.889
101 HD2 LEU 14 HD2 LEU 14 55.477 -5.725 -5.725
102 HD2 LEU 14 HD2 LEU 14 54.757 -4.235 -4.235
103 H SER 15 HN SER 15 53.242 -1.949 -1.949
104 HA SER 15 HA SER 15 51.198 -0.956 -0.956
105 1HB SER 15 HB2 SER 15 51.984 -0.459 -0.459
106 2HB SER 15 HB1 SER 15 50.663 0.418 0.418
107 HG SER 15 HG SER 15 50.403 -1.813 -1.813
108 H GLU 16 HN GLU 16 51.002 1.256 1.256
109 HA GLU 16 HA GLU 16 53.310 2.593 2.593
110 1HB GLU 16 HB2 GLU 16 50.872 2.911 2.911
111 2HB GLU 16 HB1 GLU 16 50.687 3.871 3.871
112 1HG GLU 16 HG2 GLU 16 52.570 5.336 5.336
113 2HG GLU 16 HG1 GLU 16 52.530 4.449 4.449
114 H GLU 17 HN GLU 17 51.797 2.643 2.643
115 HA GLU 17 HA GLU 17 52.756 5.048 5.048
116 1HB GLU 17 HB2 GLU 17 51.275 3.096 3.096
117 2HB GLU 17 HB1 GLU 17 52.803 2.431 2.431
118 1HG GLU 17 HG2 GLU 17 53.261 4.604 4.604
119 2HG GLU 17 HG1 GLU 17 51.655 5.154 5.154
120 H MET 18 HN MET 18 54.408 1.863 1.863
121 HA MET 18 HA MET 18 56.808 2.657 2.657
122 1HB MET 18 HB2 MET 18 56.249 0.346 0.346
123 2HB MET 18 HB1 MET 18 56.178 0.603 0.603
124 1HG MET 18 HG2 MET 18 58.391 0.249 0.249
125 2HG MET 18 HG1 MET 18 58.735 1.475 1.475
126 1HE MET 18 HE1 MET 18 57.307 0.908 0.908
127 2HE MET 18 HE3 MET 18 57.463 -0.600 -0.600
128 3HE MET 18 HE2 MET 18 58.810 0.532 0.532
129 H ILE 19 HN ILE 19 56.050 2.580 2.580
130 HA ILE 19 HA ILE 19 58.448 3.408 3.408
131 HB ILE 19 HB ILE 19 55.621 4.352 4.352
132 1HG1 ILE 19 HG12 ILE 19 57.315 2.078 2.078
133 2HG1 ILE 19 HG11 ILE 19 55.877 1.920 1.920
134 1HG2 ILE 19 HG23 ILE 19 58.113 5.200 5.200
135 2HG2 ILE 19 HG22 ILE 19 57.287 4.214 4.214
136 3HG2 ILE 19 HG21 ILE 19 56.485 5.629 5.629
137 HD1 ILE 19 HD1 ILE 19 55.681 3.448 3.448
138 HD1 ILE 19 HD1 ILE 19 54.436 2.539 2.539
139 HD1 ILE 19 HD1 ILE 19 55.684 1.685 1.685
140 H ALA 20 HN ALA 20 56.007 5.506 5.506
141 HA ALA 20 HA ALA 20 57.315 8.002 8.002
142 1HB ALA 20 HB3 ALA 20 54.957 7.305 7.305
143 2HB ALA 20 HB2 ALA 20 55.774 7.328 7.328
144 3HB ALA 20 HB1 ALA 20 55.705 8.791 8.791
145 H GLU 21 HN GLU 21 57.905 5.406 5.406
146 HA GLU 21 HA GLU 21 59.510 6.904 6.904
147 1HB GLU 21 HB2 GLU 21 58.376 4.734 4.734
148 2HB GLU 21 HB1 GLU 21 59.451 3.953 3.953
149 1HG GLU 21 HG2 GLU 21 60.877 3.607 3.607
150 2HG GLU 21 HG1 GLU 21 61.174 5.346 5.346
151 H PHE 22 HN PHE 22 60.256 4.920 4.920
152 HA PHE 22 HA PHE 22 63.134 5.185 5.185
153 1HB PHE 22 HB2 PHE 22 61.352 4.546 4.546
154 2HB PHE 22 HB1 PHE 22 63.072 4.178 4.178
155 HD1 PHE 22 HD2 PHE 22 62.598 3.620 3.620
156 HD2 PHE 22 HD1 PHE 22 60.977 2.079 2.079
157 HE1 PHE 22 HE2 PHE 22 62.058 1.483 1.483
158 HE2 PHE 22 HE1 PHE 22 60.438 -0.060 -0.060
159 HZ PHE 22 HZ PHE 22 60.979 -0.357 -0.357
160 H LYS 23 HN LYS 23 60.644 7.296 7.296
161 HA LYS 23 HA LYS 23 61.970 8.766 8.766
162 1HB LYS 23 HB2 LYS 23 59.524 8.758 8.758
163 2HB LYS 23 HB1 LYS 23 60.067 9.891 9.891
164 1HG LYS 23 HG2 LYS 23 59.324 11.281 11.281
165 2HG LYS 23 HG1 LYS 23 61.078 11.245 11.245
166 1HD LYS 23 HD2 LYS 23 60.958 9.687 9.687
167 2HD LYS 23 HD1 LYS 23 59.272 9.300 9.300
168 1HE LYS 23 HE2 LYS 23 58.980 11.936 11.936
169 2HE LYS 23 HE1 LYS 23 60.409 11.657 11.657
170 1HZ LYS 23 HZ1 LYS 23 58.268 9.673 9.673
171 2HZ LYS 23 HZ3 LYS 23 57.971 11.162 11.162
172 3HZ LYS 23 HZ2 LYS 23 59.305 10.222 10.222
173 H ALA 24 HN ALA 24 61.426 9.951 9.951
174 HA ALA 24 HA ALA 24 63.400 11.981 11.981
175 1HB ALA 24 HB3 ALA 24 61.467 11.123 11.123
176 2HB ALA 24 HB2 ALA 24 62.895 10.534 10.534
177 3HB ALA 24 HB1 ALA 24 62.733 12.252 12.252
178 H ALA 25 HN ALA 25 63.683 8.526 8.526
179 HA ALA 25 HA ALA 25 66.408 8.697 8.697
180 1HB ALA 25 HB1 ALA 25 64.495 6.957 6.957
181 2HB ALA 25 HB3 ALA 25 65.064 6.247 6.247
182 3HB ALA 25 HB2 ALA 25 66.152 6.370 6.370
183 H PHE 26 HN PHE 26 64.921 7.619 7.619
184 HA PHE 26 HA PHE 26 67.414 6.978 6.978
185 1HB PHE 26 HB2 PHE 26 65.257 6.078 6.078
186 2HB PHE 26 HB1 PHE 26 64.651 7.701 7.701
187 HD1 PHE 26 HD2 PHE 26 65.578 9.035 9.035
188 HD2 PHE 26 HD1 PHE 26 66.730 4.951 4.951
189 HE1 PHE 26 HE2 PHE 26 66.510 8.920 8.920
190 HE2 PHE 26 HE1 PHE 26 67.664 4.837 4.837
191 HZ PHE 26 HZ PHE 26 67.554 6.821 6.821
192 H ASP 27 HN ASP 27 65.404 9.916 9.916
193 HA ASP 27 HA ASP 27 66.903 11.393 11.393
194 1HB ASP 27 HB2 ASP 27 64.745 11.776 11.776
195 2HB ASP 27 HB1 ASP 27 65.729 13.222 13.222
196 H MET 28 HN MET 28 67.770 10.352 10.352
197 HA MET 28 HA MET 28 69.136 12.541 12.541
198 1HB MET 28 HB2 MET 28 69.566 9.549 9.549
199 2HB MET 28 HB1 MET 28 70.599 10.601 10.601
200 1HG MET 28 HG2 MET 28 68.047 11.491 11.491
201 2HG MET 28 HG1 MET 28 67.845 9.743 9.743
202 1HE MET 28 HE1 MET 28 68.143 12.398 12.398
203 2HE MET 28 HE3 MET 28 67.476 11.149 11.149
204 3HE MET 28 HE2 MET 28 68.966 11.980 11.980
205 H PHE 29 HN PHE 29 69.875 10.717 10.717
206 HA PHE 29 HA PHE 29 72.528 12.117 12.117
207 1HB PHE 29 HB2 PHE 29 71.985 9.497 9.497
208 2HB PHE 29 HB1 PHE 29 73.505 10.130 10.130
209 HD1 PHE 29 HD1 PHE 29 74.018 10.027 10.027
210 HD2 PHE 29 HD2 PHE 29 70.407 8.346 8.346
211 HE1 PHE 29 HE1 PHE 29 73.654 8.782 8.782
212 HE2 PHE 29 HE2 PHE 29 70.044 7.103 7.103
213 HZ PHE 29 HZ PHE 29 71.667 7.319 7.319
214 H ASP 30 HN ASP 30 69.708 12.716 12.716
215 HA ASP 30 HA ASP 30 70.221 12.539 12.539
216 1HB ASP 30 HB2 ASP 30 67.922 12.622 12.622
217 2HB ASP 30 HB1 ASP 30 67.731 13.680 13.680
218 H ALA 31 HN ALA 31 71.707 14.431 14.431
219 HA ALA 31 HA ALA 31 70.659 17.082 17.082
220 1HB ALA 31 HB2 ALA 31 73.476 15.958 15.958
221 2HB ALA 31 HB1 ALA 31 73.105 17.662 17.662
222 3HB ALA 31 HB3 ALA 31 72.543 16.455 16.455
223 H ASP 32 HN ASP 32 72.126 15.049 15.049
224 HA ASP 32 HA ASP 32 71.988 17.346 17.346
225 1HB ASP 32 HB2 ASP 32 73.961 15.039 15.039
226 2HB ASP 32 HB1 ASP 32 73.978 16.341 16.341
227 H GLY 33 HN GLY 33 70.684 14.393 14.393
228 1HA GLY 33 HA2 GLY 33 70.110 13.666 13.666
229 2HA GLY 33 HA1 GLY 33 70.032 12.533 12.533
230 H GLY 34 HN GLY 34 68.607 14.146 14.146
231 1HA GLY 34 HA2 GLY 34 66.448 14.997 14.997
232 2HA GLY 34 HA1 GLY 34 66.165 15.118 15.118
233 H GLY 35 HN GLY 35 66.428 12.598 12.598
234 1HA GLY 35 HA2 GLY 35 64.527 10.990 10.990
235 2HA GLY 35 HA1 GLY 35 64.357 11.119 11.119
236 H ASP 36 HN ASP 36 67.607 11.065 11.065
237 HA ASP 36 HA ASP 36 67.914 8.149 8.149
238 1HB ASP 36 HB2 ASP 36 69.271 8.251 8.251
239 2HB ASP 36 HB1 ASP 36 67.520 8.383 8.383
240 H ILE 37 HN ILE 37 69.642 7.865 7.865
241 HA ILE 37 HA ILE 37 71.604 10.063 10.063
242 HB ILE 37 HB ILE 37 72.215 8.798 8.798
243 1HG1 ILE 37 HG12 ILE 37 70.433 6.630 6.630
244 2HG1 ILE 37 HG11 ILE 37 72.187 6.550 6.550
245 1HG2 ILE 37 HG21 ILE 37 69.223 8.779 8.779
246 2HG2 ILE 37 HG23 ILE 37 69.978 8.615 8.615
247 3HG2 ILE 37 HG22 ILE 37 70.164 10.111 10.111
248 HD1 ILE 37 HD1 ILE 37 71.728 5.549 5.549
249 HD1 ILE 37 HD1 ILE 37 70.090 6.204 6.204
250 HD1 ILE 37 HD1 ILE 37 71.456 7.201 7.201
251 H SER 38 HN SER 38 73.948 9.511 9.511
252 HA SER 38 HA SER 38 74.842 8.249 8.249
253 1HB SER 38 HB2 SER 38 75.893 9.544 9.544
254 2HB SER 38 HB1 SER 38 76.815 8.063 8.063
255 HG SER 38 HG SER 38 76.688 10.351 10.351
256 H THR 39 HN THR 39 75.200 6.114 6.114
257 HA THR 39 HA THR 39 74.176 3.932 3.932
258 HB THR 39 HB THR 39 76.015 2.693 2.693
259 HG1 THR 39 HG1 THR 39 76.822 4.222 4.222
260 1HG2 THR 39 HG23 THR 39 73.739 4.365 4.365
261 2HG2 THR 39 HG22 THR 39 74.841 3.807 3.807
262 3HG2 THR 39 HG21 THR 39 74.027 2.640 2.640
263 H LYS 40 HN LYS 40 77.242 5.592 5.592
264 HA LYS 40 HA LYS 40 78.549 3.574 3.574
265 1HB LYS 40 HB2 LYS 40 79.607 5.541 5.541
266 2HB LYS 40 HB1 LYS 40 78.799 6.599 6.599
267 1HG LYS 40 HG2 LYS 40 80.762 6.335 6.335
268 2HG LYS 40 HG1 LYS 40 79.957 4.871 4.871
269 1HD LYS 40 HD2 LYS 40 80.990 3.650 3.650
270 2HD LYS 40 HD1 LYS 40 81.937 5.103 5.103
271 1HE LYS 40 HE2 LYS 40 82.021 4.192 4.192
272 2HE LYS 40 HE1 LYS 40 82.786 3.095 3.095
273 1HZ LYS 40 HZ2 LYS 40 83.706 5.291 5.291
274 2HZ LYS 40 HZ1 LYS 40 83.397 5.919 5.919
275 3HZ LYS 40 HZ3 LYS 40 84.461 4.612 4.612
276 H GLU 41 HN GLU 41 76.275 6.176 6.176
277 HA GLU 41 HA GLU 41 76.487 5.657 5.657
278 1HB GLU 41 HB2 GLU 41 76.332 7.946 7.946
279 2HB GLU 41 HB1 GLU 41 74.791 7.541 7.541
280 1HG GLU 41 HG2 GLU 41 73.723 8.071 8.071
281 2HG GLU 41 HG1 GLU 41 74.617 6.806 6.806
282 H LEU 42 HN LEU 42 75.106 3.968 3.968
283 HA LEU 42 HA LEU 42 72.332 3.746 3.746
284 1HB LEU 42 HB2 LEU 42 73.127 3.187 3.187
285 2HB LEU 42 HB1 LEU 42 74.218 1.967 1.967
286 HG LEU 42 HG LEU 42 71.681 1.334 1.334
287 HD1 LEU 42 HD1 LEU 42 71.587 2.343 2.343
288 HD1 LEU 42 HD1 LEU 42 70.407 2.549 2.549
289 HD1 LEU 42 HD1 LEU 42 70.556 0.994 0.994
290 HD2 LEU 42 HD2 LEU 42 72.118 -0.364 -0.364
291 HD2 LEU 42 HD2 LEU 42 72.740 -0.596 -0.596
292 HD2 LEU 42 HD2 LEU 42 73.735 0.204 0.204
293 H GLY 43 HN GLY 43 75.295 2.457 2.457
294 1HA GLY 43 HA2 GLY 43 74.043 0.118 0.118
295 2HA GLY 43 HA1 GLY 43 75.711 0.646 0.646
296 H THR 44 HN THR 44 74.981 3.393 3.393
297 HA THR 44 HA THR 44 74.553 2.995 2.995
298 HB THR 44 HB THR 44 74.820 5.358 5.358
299 HG1 THR 44 HG1 THR 44 76.829 5.245 5.245
300 1HG2 THR 44 HG23 THR 44 73.837 5.277 5.277
301 2HG2 THR 44 HG22 THR 44 75.186 6.383 6.383
302 3HG2 THR 44 HG21 THR 44 73.709 6.560 6.560
303 H VAL 45 HN VAL 45 72.577 4.280 4.280
304 HA VAL 45 HA VAL 45 70.372 5.231 5.231
305 HB VAL 45 HB VAL 45 70.719 5.665 5.665
306 1HG1 VAL 45 HG11 VAL 45 71.622 3.238 3.238
307 2HG1 VAL 45 HG13 VAL 45 69.932 2.824 2.824
308 3HG1 VAL 45 HG12 VAL 45 70.742 3.996 3.996
309 1HG2 VAL 45 HG22 VAL 45 68.329 5.289 5.289
310 2HG2 VAL 45 HG21 VAL 45 68.481 5.644 5.644
311 3HG2 VAL 45 HG23 VAL 45 68.249 3.982 3.982
312 H MET 46 HN MET 46 70.890 1.965 1.965
313 HA MET 46 HA MET 46 68.426 0.935 0.935
314 1HB MET 46 HB2 MET 46 68.986 -1.028 -1.028
315 2HB MET 46 HB1 MET 46 69.639 0.272 0.272
316 1HG MET 46 HG2 MET 46 71.567 -0.931 -0.931
317 2HG MET 46 HG1 MET 46 71.740 -0.217 -0.217
318 1HE MET 46 HE2 MET 46 69.747 -2.537 -2.537
319 2HE MET 46 HE1 MET 46 70.194 -4.160 -4.160
320 3HE MET 46 HE3 MET 46 68.865 -3.305 -3.305
321 H ARG 47 HN ARG 47 71.805 1.131 1.131
322 HA ARG 47 HA ARG 47 71.669 -0.960 -0.960
323 1HB ARG 47 HB2 ARG 47 73.721 -0.283 -0.283
324 2HB ARG 47 HB1 ARG 47 73.653 1.293 1.293
325 1HG ARG 47 HG2 ARG 47 73.434 -0.666 -0.666
326 2HG ARG 47 HG1 ARG 47 74.766 -1.160 -1.160
327 1HD ARG 47 HD2 ARG 47 74.805 1.720 1.720
328 2HD ARG 47 HD1 ARG 47 74.923 0.770 0.770
329 HE ARG 47 HE ARG 47 76.590 -0.438 -0.438
330 1HH1 ARG 47 HH2 ARG 47 76.312 2.615 2.615
331 2HH1 ARG 47 HH2 ARG 47 78.015 2.790 2.790
332 1HH2 ARG 47 HH1 ARG 47 78.809 -0.325 -0.325
333 2HH2 ARG 47 HH1 ARG 47 79.428 1.125 1.125
334 H MET 48 HN MET 48 71.757 2.624 2.624
335 HA MET 48 HA MET 48 71.531 2.889 2.889
336 1HB MET 48 HB2 MET 48 72.138 4.518 4.518
337 2HB MET 48 HB1 MET 48 70.430 4.933 4.933
338 1HG MET 48 HG2 MET 48 71.854 4.782 4.782
339 2HG MET 48 HG1 MET 48 72.443 6.051 6.051
340 1HE MET 48 HE2 MET 48 71.846 8.094 8.094
341 2HE MET 48 HE1 MET 48 71.179 8.161 8.161
342 3HE MET 48 HE3 MET 48 70.261 8.816 8.816
343 H LEU 49 HN LEU 49 69.297 1.807 1.807
344 HA LEU 49 HA LEU 49 66.885 2.893 2.893
345 1HB LEU 49 HB2 LEU 49 67.584 1.056 1.056
346 2HB LEU 49 HB1 LEU 49 65.922 1.112 1.112
347 HG LEU 49 HG LEU 49 67.494 3.577 3.577
348 HD1 LEU 49 HD1 LEU 49 66.765 1.659 1.659
349 HD1 LEU 49 HD1 LEU 49 66.764 3.379 3.379
350 HD1 LEU 49 HD1 LEU 49 65.264 2.581 2.581
351 HD2 LEU 49 HD2 LEU 49 64.888 3.041 3.041
352 HD2 LEU 49 HD2 LEU 49 64.750 3.999 3.999
353 HD2 LEU 49 HD2 LEU 49 65.760 4.568 4.568
354 H GLY 50 HN GLY 50 68.969 0.174 0.174
355 1HA GLY 50 HA2 GLY 50 68.467 -0.951 -0.951
356 2HA GLY 50 HA1 GLY 50 66.856 -1.220 -1.220
357 H GLN 51 HN GLN 51 69.247 -1.462 -1.462
358 HA GLN 51 HA GLN 51 69.192 -4.452 -4.452
359 1HB GLN 51 HB2 GLN 51 69.500 -2.821 -2.821
360 2HB GLN 51 HB1 GLN 51 69.046 -4.519 -4.519
361 1HG GLN 51 HG2 GLN 51 66.875 -3.965 -3.965
362 2HG GLN 51 HG1 GLN 51 67.212 -2.912 -2.912
363 1HE2 GLN 51 HE22 GLN 51 66.255 -0.202 -0.202
364 2HE2 GLN 51 HE21 GLN 51 65.959 -1.086 -1.086
365 H ASN 52 HN ASN 52 71.110 -5.058 -5.058
366 HA ASN 52 HA ASN 52 73.566 -3.518 -3.518
367 1HB ASN 52 HB2 ASN 52 73.302 -6.476 -6.476
368 2HB ASN 52 HB1 ASN 52 74.646 -5.415 -5.415
369 HD2 ASN 52 HD2 ASN 52 74.053 -3.547 -3.547
370 HD2 ASN 52 HD2 ASN 52 72.865 -3.844 -3.844
371 HA PRO 53 HA PRO 53 73.644 -5.210 -5.210
372 1HB PRO 53 HB2 PRO 53 74.796 -3.002 -3.002
373 2HB PRO 53 HB1 PRO 53 73.050 -3.140 -3.140
374 1HG PRO 53 HG2 PRO 53 75.095 -1.624 -1.624
375 2HG PRO 53 HG1 PRO 53 73.390 -1.252 -1.252
376 1HD PRO 53 HD2 PRO 53 74.440 -2.296 -2.296
377 2HD PRO 53 HD1 PRO 53 72.730 -2.347 -2.347
378 H THR 54 HN THR 54 75.331 -6.647 -6.647
379 HA THR 54 HA THR 54 77.981 -6.134 -6.134
380 HB THR 54 HB THR 54 78.014 -8.308 -8.308
381 HG1 THR 54 HG1 THR 54 75.711 -8.526 -8.526
382 1HG2 THR 54 HG21 THR 54 78.291 -7.764 -7.764
383 2HG2 THR 54 HG23 THR 54 77.289 -9.202 -9.202
384 3HG2 THR 54 HG22 THR 54 78.899 -9.145 -9.145
385 H LYS 55 HN LYS 55 79.914 -5.787 -5.787
386 HA LYS 55 HA LYS 55 79.791 -4.041 -4.041
387 1HB LYS 55 HB2 LYS 55 81.701 -4.564 -4.564
388 2HB LYS 55 HB1 LYS 55 82.019 -5.996 -5.996
389 1HG LYS 55 HG2 LYS 55 81.923 -4.199 -4.199
390 2HG LYS 55 HG1 LYS 55 82.408 -3.114 -3.114
391 1HD LYS 55 HD2 LYS 55 84.341 -4.494 -4.494
392 2HD LYS 55 HD1 LYS 55 83.821 -5.714 -5.714
393 1HE LYS 55 HE2 LYS 55 84.497 -4.459 -4.459
394 2HE LYS 55 HE1 LYS 55 84.167 -2.916 -2.916
395 1HZ LYS 55 HZ2 LYS 55 86.014 -3.838 -3.838
396 2HZ LYS 55 HZ1 LYS 55 86.508 -4.662 -4.662
397 3HZ LYS 55 HZ3 LYS 55 86.423 -2.968 -2.968
398 H GLU 56 HN GLU 56 80.850 -7.473 -7.473
399 HA GLU 56 HA GLU 56 80.948 -7.833 -7.833
400 1HB GLU 56 HB2 GLU 56 80.388 -10.218 -10.218
401 2HB GLU 56 HB1 GLU 56 81.601 -9.516 -9.516
402 1HG GLU 56 HG2 GLU 56 79.598 -8.876 -8.876
403 2HG GLU 56 HG1 GLU 56 78.687 -10.047 -10.047
404 H GLU 57 HN GLU 57 78.060 -8.101 -8.101
405 HA GLU 57 HA GLU 57 76.257 -8.707 -8.707
406 1HB GLU 57 HB2 GLU 57 75.714 -7.612 -7.612
407 2HB GLU 57 HB1 GLU 57 74.570 -8.476 -8.476
408 1HG GLU 57 HG2 GLU 57 76.837 -10.135 -10.135
409 2HG GLU 57 HG1 GLU 57 76.576 -9.553 -9.553
410 H LEU 58 HN LEU 58 76.799 -5.776 -5.776
411 HA LEU 58 HA LEU 58 74.994 -4.041 -4.041
412 1HB LEU 58 HB2 LEU 58 75.985 -3.339 -3.339
413 2HB LEU 58 HB1 LEU 58 77.611 -3.733 -3.733
414 HG LEU 58 HG LEU 58 77.605 -1.870 -1.870
415 HD1 LEU 58 HD1 LEU 58 75.703 -0.474 -0.474
416 HD1 LEU 58 HD1 LEU 58 74.820 -1.185 -1.185
417 HD1 LEU 58 HD1 LEU 58 75.108 -2.131 -2.131
418 HD2 LEU 58 HD2 LEU 58 77.130 0.033 0.033
419 HD2 LEU 58 HD2 LEU 58 78.276 -1.197 -1.197
420 HD2 LEU 58 HD2 LEU 58 76.617 -1.221 -1.221
421 H ASP 59 HN ASP 59 78.252 -5.077 -5.077
422 HA ASP 59 HA ASP 59 78.668 -3.122 -3.122
423 1HB ASP 59 HB2 ASP 59 79.925 -5.470 -5.470
424 2HB ASP 59 HB1 ASP 59 80.064 -5.496 -5.496
425 H ALA 60 HN ALA 60 77.390 -6.457 -6.457
426 HA ALA 60 HA ALA 60 77.043 -6.752 -6.752
427 1HB ALA 60 HB1 ALA 60 75.998 -7.934 -7.934
428 2HB ALA 60 HB3 ALA 60 75.048 -8.242 -8.242
429 3HB ALA 60 HB2 ALA 60 76.742 -8.730 -8.730
430 H ILE 61 HN ILE 61 74.849 -5.434 -5.434
431 HA ILE 61 HA ILE 61 72.618 -4.975 -4.975
432 HB ILE 61 HB ILE 61 73.542 -3.731 -3.731
433 1HG1 ILE 61 HG12 ILE 61 71.143 -5.338 -5.338
434 2HG1 ILE 61 HG11 ILE 61 72.440 -6.255 -6.255
435 1HG2 ILE 61 HG22 ILE 61 71.518 -2.833 -2.833
436 2HG2 ILE 61 HG21 ILE 61 70.713 -3.543 -3.543
437 3HG2 ILE 61 HG23 ILE 61 71.873 -2.233 -2.233
438 HD1 ILE 61 HD1 ILE 61 73.469 -4.803 -4.803
439 HD1 ILE 61 HD1 ILE 61 73.476 -6.542 -6.542
440 HD1 ILE 61 HD1 ILE 61 72.087 -5.788 -5.788
441 H ILE 62 HN ILE 62 75.028 -2.658 -2.658
442 HA ILE 62 HA ILE 62 74.300 -0.356 -0.356
443 HB ILE 62 HB ILE 62 76.982 -1.533 -1.533
444 1HG1 ILE 62 HG12 ILE 62 75.392 0.763 0.763
445 2HG1 ILE 62 HG11 ILE 62 75.304 -0.896 -0.896
446 1HG2 ILE 62 HG23 ILE 62 76.379 0.803 0.803
447 2HG2 ILE 62 HG22 ILE 62 77.297 1.225 1.225
448 3HG2 ILE 62 HG21 ILE 62 77.930 0.028 0.028
449 HD1 ILE 62 HD1 ILE 62 78.019 0.301 0.301
450 HD1 ILE 62 HD1 ILE 62 77.425 -0.836 -0.836
451 HD1 ILE 62 HD1 ILE 62 77.029 0.878 0.878
452 H GLU 63 HN GLU 63 77.006 -2.417 -2.417
453 HA GLU 63 HA GLU 63 77.257 -1.486 -1.486
454 1HB GLU 63 HB2 GLU 63 78.742 -3.135 -3.135
455 2HB GLU 63 HB1 GLU 63 77.421 -4.289 -4.289
456 1HG GLU 63 HG2 GLU 63 77.384 -4.840 -4.840
457 2HG GLU 63 HG1 GLU 63 77.936 -3.244 -3.244
458 H GLU 64 HN GLU 64 74.794 -3.685 -3.685
459 HA GLU 64 HA GLU 64 73.646 -4.376 -4.376
460 1HB GLU 64 HB2 GLU 64 73.210 -5.899 -5.899
461 2HB GLU 64 HB1 GLU 64 72.958 -4.630 -4.630
462 1HG GLU 64 HG2 GLU 64 70.764 -4.262 -4.262
463 2HG GLU 64 HG1 GLU 64 71.050 -4.801 -4.801
464 H VAL 65 HN VAL 65 72.641 -2.152 -2.152
465 HA VAL 65 HA VAL 65 70.532 -0.976 -0.976
466 HB VAL 65 HB VAL 65 70.086 0.300 0.300
467 1HG1 VAL 65 HG11 VAL 65 69.977 -2.455 -2.455
468 2HG1 VAL 65 HG13 VAL 65 70.803 -2.230 -2.230
469 3HG1 VAL 65 HG12 VAL 65 69.213 -1.514 -1.514
470 1HG2 VAL 65 HG23 VAL 65 72.897 -0.111 -0.111
471 2HG2 VAL 65 HG22 VAL 65 71.800 0.897 0.897
472 3HG2 VAL 65 HG21 VAL 65 72.037 -0.795 -0.795
473 H ASP 66 HN ASP 66 73.823 -0.616 -0.616
474 HA ASP 66 HA ASP 66 73.826 2.340 2.340
475 1HB ASP 66 HB2 ASP 66 75.531 1.417 1.417
476 2HB ASP 66 HB1 ASP 66 75.941 0.183 0.183
477 H GLU 67 HN GLU 67 74.088 -0.634 -0.634
478 HA GLU 67 HA GLU 67 75.270 0.534 0.534
479 1HB GLU 67 HB2 GLU 67 75.332 -1.872 -1.872
480 2HB GLU 67 HB1 GLU 67 73.592 -1.966 -1.966
481 1HG GLU 67 HG2 GLU 67 73.892 -1.391 -1.391
482 2HG GLU 67 HG1 GLU 67 75.625 -1.170 -1.170
483 H ASP 68 HN ASP 68 72.284 1.027 1.027
484 HA ASP 68 HA ASP 68 70.471 0.878 0.878
485 1HB ASP 68 HB2 ASP 68 69.978 1.089 1.089
486 2HB ASP 68 HB1 ASP 68 70.439 2.787 2.787
487 H GLY 69 HN GLY 69 73.087 3.000 3.000
488 1HA GLY 69 HA2 GLY 69 73.874 4.592 4.592
489 2HA GLY 69 HA1 GLY 69 72.228 4.722 4.722
490 H SER 70 HN SER 70 72.392 4.753 4.753
491 HA SER 70 HA SER 70 71.952 7.717 7.717
492 1HB SER 70 HB2 SER 70 70.378 7.331 7.331
493 2HB SER 70 HB1 SER 70 70.253 5.829 5.829
494 HG SER 70 HG SER 70 70.529 5.609 5.609
495 H GLY 71 HN GLY 71 73.668 5.072 5.072
496 1HA GLY 71 HA2 GLY 71 75.834 5.276 5.276
497 2HA GLY 71 HA1 GLY 71 75.650 7.031 7.031
498 H THR 72 HN THR 72 72.869 6.708 6.708
499 HA THR 72 HA THR 72 73.733 6.175 6.175
500 HB THR 72 HB THR 72 72.134 7.952 7.952
501 HG1 THR 72 HG1 THR 72 71.468 9.083 9.083
502 1HG2 THR 72 HG22 THR 72 74.546 8.283 8.283
503 2HG2 THR 72 HG21 THR 72 73.447 9.370 9.370
504 3HG2 THR 72 HG23 THR 72 73.681 9.533 9.533
505 H ILE 73 HN ILE 73 71.252 6.188 6.188
506 HA ILE 73 HA ILE 73 69.830 3.898 3.898
507 HB ILE 73 HB ILE 73 71.167 3.312 3.312
508 1HG1 ILE 73 HG12 ILE 73 69.133 2.523 2.523
509 2HG1 ILE 73 HG11 ILE 73 68.157 3.230 3.230
510 1HG2 ILE 73 HG21 ILE 73 71.059 5.549 5.549
511 2HG2 ILE 73 HG23 ILE 73 69.349 5.287 5.287
512 3HG2 ILE 73 HG22 ILE 73 70.568 4.270 4.270
513 HD1 ILE 73 HD1 ILE 73 70.096 0.930 0.930
514 HD1 ILE 73 HD1 ILE 73 69.683 1.854 1.854
515 HD1 ILE 73 HD1 ILE 73 68.423 1.002 1.002
516 H ASP 74 HN ASP 74 67.553 3.989 3.989
517 HA ASP 74 HA ASP 74 66.375 6.638 6.638
518 1HB ASP 74 HB2 ASP 74 66.139 4.833 4.833
519 2HB ASP 74 HB1 ASP 74 64.695 4.488 4.488
520 H PHE 75 HN PHE 75 64.525 6.829 6.829
521 HA PHE 75 HA PHE 75 64.510 5.375 5.375
522 1HB PHE 75 HB2 PHE 75 63.421 7.589 7.589
523 2HB PHE 75 HB1 PHE 75 62.133 6.678 6.678
524 HD1 PHE 75 HD2 PHE 75 64.056 6.265 6.265
525 HD2 PHE 75 HD1 PHE 75 60.212 6.577 6.577
526 HE1 PHE 75 HE2 PHE 75 62.946 5.915 5.915
527 HE2 PHE 75 HE1 PHE 75 59.106 6.226 6.226
528 HZ PHE 75 HZ PHE 75 60.473 5.895 5.895
529 H GLU 76 HN GLU 76 61.949 5.110 5.110
530 HA GLU 76 HA GLU 76 60.704 2.783 2.783
531 1HB GLU 76 HB2 GLU 76 61.163 3.812 3.812
532 2HB GLU 76 HB1 GLU 76 59.984 2.568 2.568
533 1HG GLU 76 HG2 GLU 76 58.505 4.139 4.139
534 2HG GLU 76 HG1 GLU 76 59.666 4.793 4.793
535 H GLU 77 HN GLU 77 63.320 2.993 2.993
536 HA GLU 77 HA GLU 77 63.636 0.159 0.159
537 1HB GLU 77 HB2 GLU 77 64.467 2.286 2.286
538 2HB GLU 77 HB1 GLU 77 65.882 2.138 2.138
539 1HG GLU 77 HG2 GLU 77 66.255 -0.148 -0.148
540 2HG GLU 77 HG1 GLU 77 64.769 -0.113 -0.113
541 H PHE 78 HN PHE 78 64.880 2.445 2.445
542 HA PHE 78 HA PHE 78 66.963 0.702 0.702
543 1HB PHE 78 HB2 PHE 78 67.213 3.039 3.039
544 2HB PHE 78 HB1 PHE 78 65.553 3.227 3.227
545 HD1 PHE 78 HD1 PHE 78 68.806 1.599 1.599
546 HD2 PHE 78 HD2 PHE 78 65.068 3.176 3.176
547 HE1 PHE 78 HE1 PHE 78 69.566 1.306 1.306
548 HE2 PHE 78 HE2 PHE 78 65.828 2.881 2.881
549 HZ PHE 78 HZ PHE 78 68.078 1.946 1.946
550 H LEU 79 HN LEU 79 63.541 1.242 1.242
551 HA LEU 79 HA LEU 79 63.175 0.233 0.233
552 1HB LEU 79 HB2 LEU 79 61.713 0.123 0.123
553 2HB LEU 79 HB1 LEU 79 61.159 -1.005 -1.005
554 HG LEU 79 HG LEU 79 59.914 1.062 1.062
555 HD1 LEU 79 HD1 LEU 79 60.057 0.827 0.827
556 HD1 LEU 79 HD1 LEU 79 61.593 1.694 1.694
557 HD1 LEU 79 HD1 LEU 79 61.570 -0.056 -0.056
558 HD2 LEU 79 HD2 LEU 79 61.449 2.574 2.574
559 HD2 LEU 79 HD2 LEU 79 62.652 2.362 2.362
560 HD2 LEU 79 HD2 LEU 79 61.136 3.192 3.192
561 H VAL 80 HN VAL 80 63.472 -1.807 -1.807
562 HA VAL 80 HA VAL 80 63.286 -4.350 -4.350
563 HB VAL 80 HB VAL 80 63.598 -3.888 -3.888
564 1HG1 VAL 80 HG12 VAL 80 65.353 -2.020 -2.020
565 2HG1 VAL 80 HG11 VAL 80 66.510 -3.323 -3.323
566 3HG1 VAL 80 HG13 VAL 80 65.444 -2.807 -2.807
567 1HG2 VAL 80 HG21 VAL 80 64.414 -6.085 -6.085
568 2HG2 VAL 80 HG23 VAL 80 65.113 -5.662 -5.662
569 3HG2 VAL 80 HG22 VAL 80 66.042 -5.413 -5.413
570 H MET 81 HN MET 81 66.203 -2.275 -2.275
571 HA MET 81 HA MET 81 67.968 -4.099 -4.099
572 1HB MET 81 HB2 MET 81 67.808 -1.273 -1.273
573 2HB MET 81 HB1 MET 81 68.739 -1.522 -1.522
574 1HG MET 81 HG2 MET 81 69.290 -3.445 -3.445
575 2HG MET 81 HG1 MET 81 69.788 -1.783 -1.783
576 1HE MET 81 HE1 MET 81 69.945 -4.888 -4.888
577 2HE MET 81 HE3 MET 81 71.337 -4.836 -4.836
578 3HE MET 81 HE2 MET 81 69.808 -4.104 -4.104
579 H MET 82 HN MET 82 65.301 -2.248 -2.248
580 HA MET 82 HA MET 82 66.222 -2.167 -2.167
581 1HB MET 82 HB2 MET 82 63.455 -1.667 -1.667
582 2HB MET 82 HB1 MET 82 64.168 -0.982 -0.982
583 1HG MET 82 HG2 MET 82 65.919 0.094 0.094
584 2HG MET 82 HG1 MET 82 64.917 -0.390 -0.390
585 1HE MET 82 HE1 MET 82 65.248 1.108 1.108
586 2HE MET 82 HE3 MET 82 64.493 2.706 2.706
587 3HE MET 82 HE2 MET 82 63.553 1.313 1.313
588 H VAL 83 HN VAL 83 63.250 -3.546 -3.546
589 HA VAL 83 HA VAL 83 62.695 -5.323 -5.323
590 HB VAL 83 HB VAL 83 61.061 -4.630 -4.630
591 1HG1 VAL 83 HG11 VAL 83 62.939 -4.771 -4.771
592 2HG1 VAL 83 HG13 VAL 83 62.355 -6.423 -6.423
593 3HG1 VAL 83 HG12 VAL 83 61.257 -5.067 -5.067
594 1HG2 VAL 83 HG23 VAL 83 61.644 -7.607 -7.607
595 2HG2 VAL 83 HG22 VAL 83 60.703 -6.797 -6.797
596 3HG2 VAL 83 HG21 VAL 83 60.103 -6.851 -6.851
597 H ARG 84 HN ARG 84 64.336 -5.958 -5.958
598 HA ARG 84 HA ARG 84 64.813 -8.693 -8.693
599 1HB ARG 84 HB2 ARG 84 66.608 -6.430 -6.430
600 2HB ARG 84 HB1 ARG 84 66.904 -8.130 -8.130
601 1HG ARG 84 HG2 ARG 84 64.271 -6.796 -6.796
602 2HG ARG 84 HG1 ARG 84 65.627 -6.781 -6.781
603 1HD ARG 84 HD2 ARG 84 65.332 -9.463 -9.463
604 2HD ARG 84 HD1 ARG 84 63.739 -8.886 -8.886
605 HE ARG 84 HE ARG 84 64.730 -8.337 -8.337
606 1HH1 ARG 84 HH1 ARG 84 67.541 -7.898 -7.898
607 2HH1 ARG 84 HH1 ARG 84 68.296 -9.385 -9.385
608 1HH2 ARG 84 HH2 ARG 84 65.342 -11.199 -11.199
609 2HH2 ARG 84 HH2 ARG 84 67.051 -11.254 -11.254
610 H GLN 85 HN GLN 85 66.615 -6.050 -6.050
611 HA GLN 85 HA GLN 85 68.420 -7.929 -7.929
612 1HB GLN 85 HB2 GLN 85 69.156 -5.718 -5.718
613 2HB GLN 85 HB1 GLN 85 67.963 -4.933 -4.933
614 1HG GLN 85 HG2 GLN 85 69.945 -4.807 -4.807
615 2HG GLN 85 HG1 GLN 85 69.120 -6.214 -6.214
616 1HE2 GLN 85 HE22 GLN 85 72.465 -6.798 -6.798
617 2HE2 GLN 85 HE21 GLN 85 71.591 -5.351 -5.351
618 H MET 86 HN MET 86 65.664 -5.821 -5.821
619 HA MET 86 HA MET 86 65.701 -6.376 -6.376
620 1HB MET 86 HB2 MET 86 64.128 -4.942 -4.942
621 2HB MET 86 HB1 MET 86 63.084 -5.741 -5.741
622 1HG MET 86 HG2 MET 86 65.041 -4.708 -4.708
623 2HG MET 86 HG1 MET 86 64.933 -3.473 -3.473
624 1HE MET 86 HE1 MET 86 64.420 -2.378 -2.378
625 2HE MET 86 HE3 MET 86 62.851 -2.533 -2.533
626 3HE MET 86 HE2 MET 86 63.983 -3.882 -3.882
627 H LYS 87 HN LYS 87 64.687 -8.179 -8.179
628 HA LYS 87 HA LYS 87 62.543 -9.739 -9.739
629 1HB LYS 87 HB2 LYS 87 65.021 -10.345 -10.345
630 2HB LYS 87 HB1 LYS 87 63.735 -11.535 -11.535
631 1HG LYS 87 HG2 LYS 87 62.608 -8.964 -8.964
632 2HG LYS 87 HG1 LYS 87 63.823 -9.437 -9.437
633 1HD LYS 87 HD2 LYS 87 61.933 -10.499 -10.499
634 2HD LYS 87 HD1 LYS 87 62.618 -11.780 -11.780
635 1HE LYS 87 HE2 LYS 87 60.788 -11.791 -11.791
636 2HE LYS 87 HE1 LYS 87 60.896 -10.036 -10.036
637 1HZ LYS 87 HZ2 LYS 87 59.815 -11.373 -11.373
638 2HZ LYS 87 HZ1 LYS 87 58.873 -10.653 -10.653
639 3HZ LYS 87 HZ3 LYS 87 59.899 -9.696 -9.696
640 H GLU 88 HN GLU 88 65.874 -9.741 -9.741
641 HA GLU 88 HA GLU 88 65.489 -12.235 -12.235
642 1HB GLU 88 HB2 GLU 88 67.593 -11.064 -11.064
643 2HB GLU 88 HB1 GLU 88 67.982 -10.716 -10.716
644 1HG GLU 88 HG2 GLU 88 68.657 -12.840 -12.840
645 2HG GLU 88 HG1 GLU 88 67.047 -13.412 -13.412
646 H ASP 89 HN ASP 89 66.150 -8.756 -8.756
647 HA ASP 89 HA ASP 89 66.163 -8.944 -8.944
648 1HB ASP 89 HB2 ASP 89 66.104 -6.731 -6.731
649 2HB ASP 89 HB1 ASP 89 66.070 -6.388 -6.388
650 H ALA 90 HN ALA 90 63.748 -8.586 -8.586
651 HA ALA 90 HA ALA 90 61.726 -7.385 -7.385
652 1HB ALA 90 HB3 ALA 90 62.145 -7.287 -7.287
653 2HB ALA 90 HB2 ALA 90 61.139 -8.736 -8.736
654 3HB ALA 90 HB1 ALA 90 60.506 -7.217 -7.217
Start of MODEL 2
1 1H ALA 1 HT2 ALA 1 63.690 -2.786 -2.786
2 2H ALA 1 HT1 ALA 1 64.784 -2.515 -2.515
3 3H ALA 1 HT3 ALA 1 63.420 -3.492 -3.492
4 HA ALA 1 HA ALA 1 65.176 -5.015 -5.015
5 1HB ALA 1 HB2 ALA 1 65.940 -3.172 -3.172
6 2HB ALA 1 HB1 ALA 1 66.793 -4.664 -4.664
7 3HB ALA 1 HB3 ALA 1 66.775 -3.323 -3.323
8 H SER 2 HN SER 2 65.756 -6.208 -6.208
9 HA SER 2 HA SER 2 63.116 -7.245 -7.245
10 1HB SER 2 HB2 SER 2 65.853 -8.058 -8.058
11 2HB SER 2 HB1 SER 2 65.270 -8.165 -8.165
12 HG SER 2 HG SER 2 64.776 -9.790 -9.790
13 H MET 3 HN MET 3 65.302 -4.832 -4.832
14 HA MET 3 HA MET 3 64.721 -4.872 -4.872
15 1HB MET 3 HB2 MET 3 65.769 -2.975 -2.975
16 2HB MET 3 HB1 MET 3 65.269 -2.288 -2.288
17 1HG MET 3 HG2 MET 3 66.686 -4.499 -4.499
18 2HG MET 3 HG1 MET 3 67.581 -4.000 -4.000
19 1HE MET 3 HE2 MET 3 68.094 -1.876 -1.876
20 2HE MET 3 HE1 MET 3 68.420 -0.467 -0.467
21 3HE MET 3 HE3 MET 3 69.568 -1.814 -1.814
22 H THR 4 HN THR 4 63.237 -2.991 -2.991
23 HA THR 4 HA THR 4 61.369 -1.466 -1.466
24 HB THR 4 HB THR 4 61.307 -2.948 -2.948
25 HG1 THR 4 HG1 THR 4 61.856 -1.002 -1.002
26 1HG2 THR 4 HG23 THR 4 59.161 -1.289 -1.289
27 2HG2 THR 4 HG22 THR 4 59.360 -1.255 -1.255
28 3HG2 THR 4 HG21 THR 4 59.003 -2.777 -2.777
29 H ASP 5 HN ASP 5 61.411 -4.935 -4.935
30 HA ASP 5 HA ASP 5 58.597 -5.326 -5.326
31 1HB ASP 5 HB2 ASP 5 59.734 -6.880 -6.880
32 2HB ASP 5 HB1 ASP 5 61.013 -7.138 -7.138
33 H GLN 6 HN GLN 6 61.687 -6.248 -6.248
34 HA GLN 6 HA GLN 6 60.648 -7.002 -7.002
35 1HB GLN 6 HB2 GLN 6 63.105 -6.715 -6.715
36 2HB GLN 6 HB1 GLN 6 63.183 -5.503 -5.503
37 1HG GLN 6 HG2 GLN 6 63.952 -7.433 -7.433
38 2HG GLN 6 HG1 GLN 6 62.244 -7.406 -7.406
39 1HE2 GLN 6 HE22 GLN 6 61.619 -10.511 -10.511
40 2HE2 GLN 6 HE21 GLN 6 61.128 -9.318 -9.318
41 H GLN 7 HN GLN 7 60.862 -3.840 -3.840
42 HA GLN 7 HA GLN 7 61.046 -2.185 -2.185
43 1HB GLN 7 HB2 GLN 7 61.029 -1.737 -1.737
44 2HB GLN 7 HB1 GLN 7 59.288 -1.563 -1.563
45 1HG GLN 7 HG2 GLN 7 60.538 -0.109 -0.109
46 2HG GLN 7 HG1 GLN 7 61.365 0.331 0.331
47 1HE2 GLN 7 HE22 GLN 7 57.289 0.923 0.923
48 2HE2 GLN 7 HE21 GLN 7 57.913 -0.505 -0.505
49 H ALA 8 HN ALA 8 58.027 -2.927 -2.927
50 HA ALA 8 HA ALA 8 56.163 -1.975 -1.975
51 1HB ALA 8 HB2 ALA 8 56.283 -3.717 -3.717
52 2HB ALA 8 HB1 ALA 8 55.241 -4.471 -4.471
53 3HB ALA 8 HB3 ALA 8 54.882 -2.846 -2.846
54 H GLU 9 HN GLU 9 57.309 -5.377 -5.377
55 HA GLU 9 HA GLU 9 56.049 -6.192 -6.192
56 1HB GLU 9 HB2 GLU 9 57.341 -7.383 -7.383
57 2HB GLU 9 HB1 GLU 9 58.619 -7.433 -7.433
58 1HG GLU 9 HG2 GLU 9 56.887 -8.398 -8.398
59 2HG GLU 9 HG1 GLU 9 55.832 -8.592 -8.592
60 H ALA 10 HN ALA 10 58.909 -4.314 -4.314
61 HA ALA 10 HA ALA 10 60.202 -4.921 -4.921
62 1HB ALA 10 HB1 ALA 10 60.612 -3.213 -3.213
63 2HB ALA 10 HB3 ALA 10 61.350 -2.632 -2.632
64 3HB ALA 10 HB2 ALA 10 61.764 -4.228 -4.228
65 H ARG 11 HN ARG 11 58.252 -2.229 -2.229
66 HA ARG 11 HA ARG 11 58.329 -0.777 -0.777
67 1HB ARG 11 HB2 ARG 11 56.527 -0.235 -0.235
68 2HB ARG 11 HB1 ARG 11 57.220 0.921 0.921
69 1HG ARG 11 HG2 ARG 11 58.965 1.227 1.227
70 2HG ARG 11 HG1 ARG 11 59.379 -0.481 -0.481
71 1HD ARG 11 HD2 ARG 11 58.996 -0.244 -0.244
72 2HD ARG 11 HD1 ARG 11 57.411 -0.800 -0.800
73 HE ARG 11 HE ARG 11 57.867 1.753 1.753
74 1HH1 ARG 11 HH2 ARG 11 57.547 3.444 3.444
75 2HH1 ARG 11 HH2 ARG 11 55.928 3.331 3.331
76 1HH2 ARG 11 HH1 ARG 11 55.310 0.249 0.249
77 2HH2 ARG 11 HH1 ARG 11 54.663 1.522 1.522
78 H ALA 12 HN ALA 12 55.768 -2.270 -2.270
79 HA ALA 12 HA ALA 12 53.577 -1.972 -1.972
80 1HB ALA 12 HB2 ALA 12 54.204 -3.246 -3.246
81 2HB ALA 12 HB1 ALA 12 53.791 -4.596 -4.596
82 3HB ALA 12 HB3 ALA 12 52.626 -3.300 -3.300
83 H PHE 13 HN PHE 13 56.344 -4.088 -4.088
84 HA PHE 13 HA PHE 13 55.381 -6.118 -6.118
85 1HB PHE 13 HB2 PHE 13 57.610 -6.219 -6.219
86 2HB PHE 13 HB1 PHE 13 57.974 -4.587 -4.587
87 HD1 PHE 13 HD1 PHE 13 56.677 -7.797 -7.797
88 HD2 PHE 13 HD2 PHE 13 59.338 -4.447 -4.447
89 HE1 PHE 13 HE1 PHE 13 57.516 -8.716 -8.716
90 HE2 PHE 13 HE2 PHE 13 60.176 -5.365 -5.365
91 HZ PHE 13 HZ PHE 13 59.265 -7.500 -7.500
92 H LEU 14 HN LEU 14 56.195 -2.751 -2.751
93 HA LEU 14 HA LEU 14 55.463 -3.230 -3.230
94 1HB LEU 14 HB2 LEU 14 56.760 -0.847 -0.847
95 2HB LEU 14 HB1 LEU 14 56.657 -1.133 -1.133
96 HG LEU 14 HG LEU 14 57.854 -3.346 -3.346
97 HD1 LEU 14 HD1 LEU 14 58.746 -1.327 -1.327
98 HD1 LEU 14 HD1 LEU 14 59.997 -2.230 -2.230
99 HD1 LEU 14 HD1 LEU 14 59.358 -0.738 -0.738
100 HD2 LEU 14 HD2 LEU 14 58.694 -3.781 -3.781
101 HD2 LEU 14 HD2 LEU 14 57.738 -2.428 -2.428
102 HD2 LEU 14 HD2 LEU 14 59.410 -2.174 -2.174
103 H SER 15 HN SER 15 54.186 -1.363 -1.363
104 HA SER 15 HA SER 15 51.838 -0.784 -0.784
105 1HB SER 15 HB2 SER 15 52.601 -0.728 -0.728
106 2HB SER 15 HB1 SER 15 51.266 0.303 0.303
107 HG SER 15 HG SER 15 50.126 -1.454 -1.454
108 H GLU 16 HN GLU 16 51.158 1.342 1.342
109 HA GLU 16 HA GLU 16 52.943 3.310 3.310
110 1HB GLU 16 HB2 GLU 16 50.420 3.141 3.141
111 2HB GLU 16 HB1 GLU 16 50.247 3.862 3.862
112 1HG GLU 16 HG2 GLU 16 51.550 5.824 5.824
113 2HG GLU 16 HG1 GLU 16 51.719 5.106 5.106
114 H GLU 17 HN GLU 17 51.797 2.637 2.637
115 HA GLU 17 HA GLU 17 52.608 5.094 5.094
116 1HB GLU 17 HB2 GLU 17 51.149 3.022 3.022
117 2HB GLU 17 HB1 GLU 17 52.690 2.420 2.420
118 1HG GLU 17 HG2 GLU 17 52.443 3.729 3.729
119 2HG GLU 17 HG1 GLU 17 52.524 5.146 5.146
120 H MET 18 HN MET 18 54.290 1.964 1.964
121 HA MET 18 HA MET 18 56.698 2.753 2.753
122 1HB MET 18 HB2 MET 18 55.965 0.426 0.426
123 2HB MET 18 HB1 MET 18 56.177 0.671 0.671
124 1HG MET 18 HG2 MET 18 58.140 -0.466 -0.466
125 2HG MET 18 HG1 MET 18 58.576 1.124 1.124
126 1HE MET 18 HE2 MET 18 57.200 -0.838 -0.838
127 2HE MET 18 HE1 MET 18 58.502 -0.821 -0.821
128 3HE MET 18 HE3 MET 18 57.099 0.239 0.239
129 H ILE 19 HN ILE 19 55.815 2.656 2.656
130 HA ILE 19 HA ILE 19 58.176 3.364 3.364
131 HB ILE 19 HB ILE 19 55.319 4.279 4.279
132 1HG1 ILE 19 HG12 ILE 19 57.119 2.371 2.371
133 2HG1 ILE 19 HG11 ILE 19 55.866 1.892 1.892
134 1HG2 ILE 19 HG21 ILE 19 57.726 5.373 5.373
135 2HG2 ILE 19 HG23 ILE 19 56.697 4.624 4.624
136 3HG2 ILE 19 HG22 ILE 19 56.053 5.898 5.898
137 HD1 ILE 19 HD1 ILE 19 54.143 2.906 2.906
138 HD1 ILE 19 HD1 ILE 19 55.091 1.786 1.786
139 HD1 ILE 19 HD1 ILE 19 55.364 3.523 3.523
140 H ALA 20 HN ALA 20 56.012 5.544 5.544
141 HA ALA 20 HA ALA 20 57.454 7.971 7.971
142 1HB ALA 20 HB1 ALA 20 55.105 7.165 7.165
143 2HB ALA 20 HB3 ALA 20 56.071 7.832 7.832
144 3HB ALA 20 HB2 ALA 20 55.702 8.822 8.822
145 H GLU 21 HN GLU 21 57.825 5.432 5.432
146 HA GLU 21 HA GLU 21 59.518 6.814 6.814
147 1HB GLU 21 HB2 GLU 21 58.429 4.706 4.706
148 2HB GLU 21 HB1 GLU 21 59.254 3.908 3.908
149 1HG GLU 21 HG2 GLU 21 60.724 3.282 3.282
150 2HG GLU 21 HG1 GLU 21 61.389 4.892 4.892
151 H PHE 22 HN PHE 22 60.273 4.843 4.843
152 HA PHE 22 HA PHE 22 63.154 5.193 5.193
153 1HB PHE 22 HB2 PHE 22 61.437 4.328 4.328
154 2HB PHE 22 HB1 PHE 22 63.162 4.018 4.018
155 HD1 PHE 22 HD2 PHE 22 62.467 3.721 3.721
156 HD2 PHE 22 HD1 PHE 22 61.288 1.779 1.779
157 HE1 PHE 22 HE2 PHE 22 61.954 1.653 1.653
158 HE2 PHE 22 HE1 PHE 22 60.776 -0.290 -0.290
159 HZ PHE 22 HZ PHE 22 61.108 -0.352 -0.352
160 H LYS 23 HN LYS 23 60.550 6.983 6.983
161 HA LYS 23 HA LYS 23 61.896 8.418 8.418
162 1HB LYS 23 HB2 LYS 23 59.583 8.880 8.880
163 2HB LYS 23 HB1 LYS 23 60.123 10.208 10.208
164 1HG LYS 23 HG2 LYS 23 59.536 7.450 7.450
165 2HG LYS 23 HG1 LYS 23 58.309 8.714 8.714
166 1HD LYS 23 HD2 LYS 23 60.683 9.835 9.835
167 2HD LYS 23 HD1 LYS 23 60.282 8.354 8.354
168 1HE LYS 23 HE2 LYS 23 57.840 9.777 9.777
169 2HE LYS 23 HE1 LYS 23 59.011 10.899 10.899
170 1HZ LYS 23 HZ2 LYS 23 59.569 9.058 9.058
171 2HZ LYS 23 HZ1 LYS 23 58.200 8.229 8.229
172 3HZ LYS 23 HZ3 LYS 23 58.020 9.727 9.727
173 H ALA 24 HN ALA 24 61.212 9.658 9.658
174 HA ALA 24 HA ALA 24 62.955 11.892 11.892
175 1HB ALA 24 HB2 ALA 24 61.185 10.663 10.663
176 2HB ALA 24 HB1 ALA 24 62.728 10.682 10.682
177 3HB ALA 24 HB3 ALA 24 62.032 12.188 12.188
178 H ALA 25 HN ALA 25 63.650 8.509 8.509
179 HA ALA 25 HA ALA 25 66.344 9.053 9.053
180 1HB ALA 25 HB1 ALA 25 64.529 7.125 7.125
181 2HB ALA 25 HB3 ALA 25 65.421 6.348 6.348
182 3HB ALA 25 HB2 ALA 25 66.259 6.828 6.828
183 H PHE 26 HN PHE 26 64.816 8.045 8.045
184 HA PHE 26 HA PHE 26 67.216 7.168 7.168
185 1HB PHE 26 HB2 PHE 26 65.041 6.502 6.502
186 2HB PHE 26 HB1 PHE 26 64.508 8.179 8.179
187 HD1 PHE 26 HD2 PHE 26 66.642 5.558 5.558
188 HD2 PHE 26 HD1 PHE 26 65.195 9.586 9.586
189 HE1 PHE 26 HE2 PHE 26 67.490 5.650 5.650
190 HE2 PHE 26 HE1 PHE 26 66.042 9.678 9.678
191 HZ PHE 26 HZ PHE 26 67.191 7.711 7.711
192 H ASP 27 HN ASP 27 65.522 10.306 10.306
193 HA ASP 27 HA ASP 27 67.226 11.652 11.652
194 1HB ASP 27 HB2 ASP 27 66.082 13.626 13.626
195 2HB ASP 27 HB1 ASP 27 64.914 12.304 12.304
196 H MET 28 HN MET 28 67.907 10.461 10.461
197 HA MET 28 HA MET 28 69.429 12.462 12.462
198 1HB MET 28 HB2 MET 28 69.657 9.452 9.452
199 2HB MET 28 HB1 MET 28 70.694 10.392 10.392
200 1HG MET 28 HG2 MET 28 67.802 11.013 11.013
201 2HG MET 28 HG1 MET 28 68.266 9.411 9.411
202 1HE MET 28 HE3 MET 28 68.466 12.925 12.925
203 2HE MET 28 HE2 MET 28 68.198 13.277 13.277
204 3HE MET 28 HE1 MET 28 69.814 13.443 13.443
205 H PHE 29 HN PHE 29 70.080 10.778 10.778
206 HA PHE 29 HA PHE 29 72.866 11.905 11.905
207 1HB PHE 29 HB2 PHE 29 72.032 9.469 9.469
208 2HB PHE 29 HB1 PHE 29 73.632 9.904 9.904
209 HD1 PHE 29 HD2 PHE 29 70.351 8.493 8.493
210 HD2 PHE 29 HD1 PHE 29 74.273 9.498 9.498
211 HE1 PHE 29 HE2 PHE 29 69.942 7.162 7.162
212 HE2 PHE 29 HE1 PHE 29 73.864 8.167 8.167
213 HZ PHE 29 HZ PHE 29 71.700 6.996 6.996
214 H ASP 30 HN ASP 30 69.909 12.430 12.430
215 HA ASP 30 HA ASP 30 70.383 12.515 12.515
216 1HB ASP 30 HB2 ASP 30 68.293 12.943 12.943
217 2HB ASP 30 HB1 ASP 30 68.431 14.424 14.424
218 H ALA 31 HN ALA 31 72.558 13.619 13.619
219 HA ALA 31 HA ALA 31 73.124 16.168 16.168
220 1HB ALA 31 HB1 ALA 31 73.951 14.552 14.552
221 2HB ALA 31 HB3 ALA 31 74.535 16.212 16.212
222 3HB ALA 31 HB2 ALA 31 74.905 15.039 15.039
223 H ASP 32 HN ASP 32 71.753 15.417 15.417
224 HA ASP 32 HA ASP 32 71.084 18.287 18.287
225 1HB ASP 32 HB2 ASP 32 72.182 17.036 17.036
226 2HB ASP 32 HB1 ASP 32 70.900 15.824 15.824
227 H GLY 33 HN GLY 33 69.539 15.155 15.155
228 1HA GLY 33 HA2 GLY 33 67.354 14.825 14.825
229 2HA GLY 33 HA1 GLY 33 67.008 16.532 16.532
230 H GLY 34 HN GLY 34 68.314 14.311 14.311
231 1HA GLY 34 HA2 GLY 34 66.041 14.979 14.979
232 2HA GLY 34 HA1 GLY 34 67.499 14.108 14.108
233 H GLY 35 HN GLY 35 66.147 12.968 12.968
234 1HA GLY 35 HA2 GLY 35 64.701 11.145 11.145
235 2HA GLY 35 HA1 GLY 35 64.311 11.053 11.053
236 H ASP 36 HN ASP 36 67.645 11.124 11.124
237 HA ASP 36 HA ASP 36 68.011 8.241 8.241
238 1HB ASP 36 HB2 ASP 36 69.318 8.276 8.276
239 2HB ASP 36 HB1 ASP 36 67.558 8.322 8.322
240 H ILE 37 HN ILE 37 69.793 8.026 8.026
241 HA ILE 37 HA ILE 37 71.739 10.263 10.263
242 HB ILE 37 HB ILE 37 72.349 9.203 9.203
243 1HG1 ILE 37 HG12 ILE 37 70.799 6.804 6.804
244 2HG1 ILE 37 HG11 ILE 37 72.551 6.906 6.906
245 1HG2 ILE 37 HG21 ILE 37 69.809 10.059 10.059
246 2HG2 ILE 37 HG23 ILE 37 69.495 8.427 8.427
247 3HG2 ILE 37 HG22 ILE 37 70.380 9.574 9.574
248 HD1 ILE 37 HD1 ILE 37 72.285 6.143 6.143
249 HD1 ILE 37 HD1 ILE 37 70.531 6.286 6.286
250 HD1 ILE 37 HD1 ILE 37 71.497 7.673 7.673
251 H SER 38 HN SER 38 74.098 9.645 9.645
252 HA SER 38 HA SER 38 74.982 8.319 8.319
253 1HB SER 38 HB2 SER 38 76.037 9.676 9.676
254 2HB SER 38 HB1 SER 38 76.892 8.138 8.138
255 HG SER 38 HG SER 38 77.047 8.705 8.705
256 H THR 39 HN THR 39 75.208 6.161 6.161
257 HA THR 39 HA THR 39 74.136 4.024 4.024
258 HB THR 39 HB THR 39 75.929 2.688 2.688
259 HG1 THR 39 HG1 THR 39 77.370 4.647 4.647
260 1HG2 THR 39 HG21 THR 39 73.874 4.467 4.467
261 2HG2 THR 39 HG23 THR 39 75.158 4.224 4.224
262 3HG2 THR 39 HG22 THR 39 74.297 2.836 2.836
263 H LYS 40 HN LYS 40 77.215 5.618 5.618
264 HA LYS 40 HA LYS 40 78.404 3.638 3.638
265 1HB LYS 40 HB2 LYS 40 79.170 5.971 5.971
266 2HB LYS 40 HB1 LYS 40 78.709 6.566 6.566
267 1HG LYS 40 HG2 LYS 40 80.285 5.185 5.185
268 2HG LYS 40 HG1 LYS 40 80.496 4.156 4.156
269 1HD LYS 40 HD2 LYS 40 81.124 7.029 7.029
270 2HD LYS 40 HD1 LYS 40 82.226 6.135 6.135
271 1HE LYS 40 HE2 LYS 40 82.109 4.334 4.334
272 2HE LYS 40 HE1 LYS 40 81.673 5.756 5.756
273 1HZ LYS 40 HZ3 LYS 40 83.968 5.703 5.703
274 2HZ LYS 40 HZ2 LYS 40 84.119 5.366 5.366
275 3HZ LYS 40 HZ1 LYS 40 83.600 6.899 6.899
276 H GLU 41 HN GLU 41 75.736 5.806 5.806
277 HA GLU 41 HA GLU 41 75.876 5.477 5.477
278 1HB GLU 41 HB2 GLU 41 74.367 7.181 7.181
279 2HB GLU 41 HB1 GLU 41 73.788 7.036 7.036
280 1HG GLU 41 HG2 GLU 41 75.353 8.988 8.988
281 2HG GLU 41 HG1 GLU 41 75.855 7.895 7.895
282 H LEU 42 HN LEU 42 74.740 3.678 3.678
283 HA LEU 42 HA LEU 42 72.037 3.061 3.061
284 1HB LEU 42 HB2 LEU 42 73.092 2.483 2.483
285 2HB LEU 42 HB1 LEU 42 74.237 1.426 1.426
286 HG LEU 42 HG LEU 42 71.331 0.939 0.939
287 HD1 LEU 42 HD1 LEU 42 72.804 0.278 0.278
288 HD1 LEU 42 HD1 LEU 42 71.315 1.209 1.209
289 HD1 LEU 42 HD1 LEU 42 71.314 -0.523 -0.523
290 HD2 LEU 42 HD2 LEU 42 73.805 -0.336 -0.336
291 HD2 LEU 42 HD2 LEU 42 72.974 -1.340 -1.340
292 HD2 LEU 42 HD2 LEU 42 72.191 -0.954 -0.954
293 H GLY 43 HN GLY 43 75.128 1.948 1.948
294 1HA GLY 43 HA2 GLY 43 73.924 -0.253 -0.253
295 2HA GLY 43 HA1 GLY 43 75.601 0.286 0.286
296 H THR 44 HN THR 44 74.933 3.078 3.078
297 HA THR 44 HA THR 44 74.602 2.936 2.936
298 HB THR 44 HB THR 44 74.805 5.137 5.137
299 HG1 THR 44 HG1 THR 44 76.813 4.690 4.690
300 1HG2 THR 44 HG23 THR 44 73.425 5.838 5.838
301 2HG2 THR 44 HG22 THR 44 74.827 5.489 5.489
302 3HG2 THR 44 HG21 THR 44 74.916 6.755 6.755
303 H VAL 45 HN VAL 45 72.557 4.060 4.060
304 HA VAL 45 HA VAL 45 70.408 5.119 5.119
305 HB VAL 45 HB VAL 45 70.733 5.455 5.455
306 1HG1 VAL 45 HG11 VAL 45 71.515 2.969 2.969
307 2HG1 VAL 45 HG13 VAL 45 69.801 2.635 2.635
308 3HG1 VAL 45 HG12 VAL 45 70.655 3.723 3.723
309 1HG2 VAL 45 HG21 VAL 45 68.192 4.086 4.086
310 2HG2 VAL 45 HG23 VAL 45 68.480 5.808 5.808
311 3HG2 VAL 45 HG22 VAL 45 68.364 4.721 4.721
312 H MET 46 HN MET 46 70.923 1.814 1.814
313 HA MET 46 HA MET 46 68.465 0.803 0.803
314 1HB MET 46 HB2 MET 46 69.249 -1.307 -1.307
315 2HB MET 46 HB1 MET 46 69.481 -0.011 -0.011
316 1HG MET 46 HG2 MET 46 71.843 0.191 0.191
317 2HG MET 46 HG1 MET 46 71.615 -1.100 -1.100
318 1HE MET 46 HE1 MET 46 70.538 -3.261 -3.261
319 2HE MET 46 HE3 MET 46 69.460 -2.953 -2.953
320 3HE MET 46 HE2 MET 46 70.731 -4.166 -4.166
321 H ARG 47 HN ARG 47 71.937 0.768 0.768
322 HA ARG 47 HA ARG 47 71.692 -1.078 -1.078
323 1HB ARG 47 HB2 ARG 47 73.730 -0.663 -0.663
324 2HB ARG 47 HB1 ARG 47 73.850 0.942 0.942
325 1HG ARG 47 HG2 ARG 47 74.203 0.023 0.023
326 2HG ARG 47 HG1 ARG 47 73.805 -1.603 -1.603
327 1HD ARG 47 HD2 ARG 47 76.181 -1.590 -1.590
328 2HD ARG 47 HD1 ARG 47 75.805 -1.274 -1.274
329 HE ARG 47 HE ARG 47 75.990 1.120 1.120
330 1HH1 ARG 47 HH2 ARG 47 76.381 1.257 1.257
331 2HH1 ARG 47 HH2 ARG 47 78.104 1.349 1.349
332 1HH2 ARG 47 HH1 ARG 47 78.713 0.231 0.231
333 2HH2 ARG 47 HH1 ARG 47 79.425 0.769 0.769
334 H MET 48 HN MET 48 71.798 2.460 2.460
335 HA MET 48 HA MET 48 71.850 2.994 2.994
336 1HB MET 48 HB2 MET 48 72.713 4.497 4.497
337 2HB MET 48 HB1 MET 48 71.062 4.722 4.722
338 1HG MET 48 HG2 MET 48 71.523 6.595 6.595
339 2HG MET 48 HG1 MET 48 70.489 5.521 5.521
340 1HE MET 48 HE2 MET 48 70.948 6.764 6.764
341 2HE MET 48 HE1 MET 48 72.212 6.397 6.397
342 3HE MET 48 HE3 MET 48 72.449 7.688 7.688
343 H LEU 49 HN LEU 49 69.441 1.819 1.819
344 HA LEU 49 HA LEU 49 67.178 3.246 3.246
345 1HB LEU 49 HB2 LEU 49 67.682 1.217 1.217
346 2HB LEU 49 HB1 LEU 49 66.072 1.245 1.245
347 HG LEU 49 HG LEU 49 67.435 3.742 3.742
348 HD1 LEU 49 HD1 LEU 49 66.934 3.175 3.175
349 HD1 LEU 49 HD1 LEU 49 65.269 2.810 2.810
350 HD1 LEU 49 HD1 LEU 49 66.510 1.562 1.562
351 HD2 LEU 49 HD2 LEU 49 65.624 4.731 4.731
352 HD2 LEU 49 HD2 LEU 49 65.020 3.165 3.165
353 HD2 LEU 49 HD2 LEU 49 64.589 3.774 3.774
354 H GLY 50 HN GLY 50 68.929 0.232 0.232
355 1HA GLY 50 HA2 GLY 50 68.394 -0.423 -0.423
356 2HA GLY 50 HA1 GLY 50 66.837 -0.823 -0.823
357 H GLN 51 HN GLN 51 68.631 -1.482 -1.482
358 HA GLN 51 HA GLN 51 68.996 -4.333 -4.333
359 1HB GLN 51 HB2 GLN 51 69.230 -3.129 -3.129
360 2HB GLN 51 HB1 GLN 51 68.755 -4.769 -4.769
361 1HG GLN 51 HG2 GLN 51 67.156 -2.223 -2.223
362 2HG GLN 51 HG1 GLN 51 66.733 -3.652 -3.652
363 1HE2 GLN 51 HE22 GLN 51 65.042 -3.660 -3.660
364 2HE2 GLN 51 HE21 GLN 51 65.180 -2.442 -2.442
365 H ASN 52 HN ASN 52 70.905 -5.069 -5.069
366 HA ASN 52 HA ASN 52 73.281 -3.354 -3.354
367 1HB ASN 52 HB2 ASN 52 72.730 -4.844 -4.844
368 2HB ASN 52 HB1 ASN 52 73.518 -6.094 -6.094
369 HD2 ASN 52 HD2 ASN 52 75.680 -5.145 -5.145
370 HD2 ASN 52 HD2 ASN 52 76.685 -4.272 -4.272
371 HA PRO 53 HA PRO 53 73.367 -5.940 -5.940
372 1HB PRO 53 HB2 PRO 53 74.614 -4.062 -4.062
373 2HB PRO 53 HB1 PRO 53 72.862 -4.071 -4.071
374 1HG PRO 53 HG2 PRO 53 74.967 -2.388 -2.388
375 2HG PRO 53 HG1 PRO 53 73.312 -1.967 -1.967
376 1HD PRO 53 HD2 PRO 53 74.096 -2.502 -2.502
377 2HD PRO 53 HD1 PRO 53 72.435 -2.698 -2.698
378 H THR 54 HN THR 54 75.047 -7.376 -7.376
379 HA THR 54 HA THR 54 77.546 -7.161 -7.161
380 HB THR 54 HB THR 54 78.109 -9.128 -9.128
381 HG1 THR 54 HG1 THR 54 77.047 -9.512 -9.512
382 1HG2 THR 54 HG22 THR 54 75.311 -8.941 -8.941
383 2HG2 THR 54 HG21 THR 54 75.987 -10.456 -10.456
384 3HG2 THR 54 HG23 THR 54 76.744 -9.630 -9.630
385 H LYS 55 HN LYS 55 79.535 -6.345 -6.345
386 HA LYS 55 HA LYS 55 79.812 -4.281 -4.281
387 1HB LYS 55 HB2 LYS 55 81.416 -5.346 -5.346
388 2HB LYS 55 HB1 LYS 55 81.973 -6.342 -6.342
389 1HG LYS 55 HG2 LYS 55 82.062 -3.951 -3.951
390 2HG LYS 55 HG1 LYS 55 82.300 -3.414 -3.414
391 1HD LYS 55 HD2 LYS 55 84.230 -4.816 -4.816
392 2HD LYS 55 HD1 LYS 55 83.910 -5.649 -5.649
393 1HE LYS 55 HE2 LYS 55 85.646 -4.071 -4.071
394 2HE LYS 55 HE1 LYS 55 84.159 -3.326 -3.326
395 1HZ LYS 55 HZ3 LYS 55 83.900 -2.219 -2.219
396 2HZ LYS 55 HZ2 LYS 55 85.400 -2.849 -2.849
397 3HZ LYS 55 HZ1 LYS 55 85.322 -1.742 -1.742
398 H GLU 56 HN GLU 56 80.013 -7.772 -7.772
399 HA GLU 56 HA GLU 56 80.941 -7.586 -7.586
400 1HB GLU 56 HB2 GLU 56 80.274 -9.541 -9.541
401 2HB GLU 56 HB1 GLU 56 79.246 -9.872 -9.872
402 1HG GLU 56 HG2 GLU 56 81.071 -10.965 -10.965
403 2HG GLU 56 HG1 GLU 56 81.643 -9.348 -9.348
404 H GLU 57 HN GLU 57 77.690 -7.737 -7.737
405 HA GLU 57 HA GLU 57 76.204 -7.925 -7.925
406 1HB GLU 57 HB2 GLU 57 75.715 -7.016 -7.016
407 2HB GLU 57 HB1 GLU 57 74.454 -6.784 -6.784
408 1HG GLU 57 HG2 GLU 57 75.798 -9.435 -9.435
409 2HG GLU 57 HG1 GLU 57 74.212 -8.949 -8.949
410 H LEU 58 HN LEU 58 77.217 -5.097 -5.097
411 HA LEU 58 HA LEU 58 75.960 -3.037 -3.037
412 1HB LEU 58 HB2 LEU 58 78.726 -3.150 -3.150
413 2HB LEU 58 HB1 LEU 58 77.844 -1.669 -1.669
414 HG LEU 58 HG LEU 58 77.083 -3.816 -3.816
415 HD1 LEU 58 HD1 LEU 58 77.435 -2.182 -2.182
416 HD1 LEU 58 HD1 LEU 58 77.215 -0.854 -0.854
417 HD1 LEU 58 HD1 LEU 58 78.704 -1.799 -1.799
418 HD2 LEU 58 HD2 LEU 58 74.977 -3.330 -3.330
419 HD2 LEU 58 HD2 LEU 58 75.450 -1.719 -1.719
420 HD2 LEU 58 HD2 LEU 58 75.139 -2.021 -2.021
421 H ASP 59 HN ASP 59 79.331 -4.165 -4.165
422 HA ASP 59 HA ASP 59 79.723 -2.745 -2.745
423 1HB ASP 59 HB2 ASP 59 81.124 -4.455 -4.455
424 2HB ASP 59 HB1 ASP 59 81.205 -5.230 -5.230
425 H ALA 60 HN ALA 60 78.013 -5.674 -5.674
426 HA ALA 60 HA ALA 60 78.084 -6.706 -6.706
427 1HB ALA 60 HB2 ALA 60 78.072 -8.143 -8.143
428 2HB ALA 60 HB1 ALA 60 76.479 -7.510 -7.510
429 3HB ALA 60 HB3 ALA 60 76.694 -8.477 -8.477
430 H ILE 61 HN ILE 61 75.663 -5.274 -5.274
431 HA ILE 61 HA ILE 61 73.551 -5.246 -5.246
432 HB ILE 61 HB ILE 61 73.986 -3.913 -3.913
433 1HG1 ILE 61 HG12 ILE 61 71.884 -5.957 -5.957
434 2HG1 ILE 61 HG11 ILE 61 73.549 -6.534 -6.534
435 1HG2 ILE 61 HG21 ILE 61 72.383 -2.713 -2.713
436 2HG2 ILE 61 HG23 ILE 61 71.346 -4.129 -4.129
437 3HG2 ILE 61 HG22 ILE 61 71.744 -3.144 -3.144
438 HD1 ILE 61 HD1 ILE 61 73.989 -5.493 -5.493
439 HD1 ILE 61 HD1 ILE 61 72.727 -6.723 -6.723
440 HD1 ILE 61 HD1 ILE 61 72.295 -5.014 -5.014
441 H ILE 62 HN ILE 62 75.714 -2.758 -2.758
442 HA ILE 62 HA ILE 62 74.806 -0.448 -0.448
443 HB ILE 62 HB ILE 62 77.575 -1.528 -1.528
444 1HG1 ILE 62 HG12 ILE 62 76.064 0.725 0.725
445 2HG1 ILE 62 HG11 ILE 62 75.895 -0.956 -0.956
446 1HG2 ILE 62 HG22 ILE 62 76.724 1.057 1.057
447 2HG2 ILE 62 HG21 ILE 62 78.099 1.060 1.060
448 3HG2 ILE 62 HG23 ILE 62 78.136 0.059 0.059
449 HD1 ILE 62 HD1 ILE 62 77.765 0.702 0.702
450 HD1 ILE 62 HD1 ILE 62 78.675 0.040 0.040
451 HD1 ILE 62 HD1 ILE 62 78.003 -1.041 -1.041
452 H GLU 63 HN GLU 63 77.367 -2.544 -2.544
453 HA GLU 63 HA GLU 63 77.516 -1.393 -1.393
454 1HB GLU 63 HB2 GLU 63 78.882 -3.261 -3.261
455 2HB GLU 63 HB1 GLU 63 77.593 -4.364 -4.364
456 1HG GLU 63 HG2 GLU 63 78.523 -2.579 -2.579
457 2HG GLU 63 HG1 GLU 63 79.746 -3.709 -3.709
458 H GLU 64 HN GLU 64 75.155 -3.748 -3.748
459 HA GLU 64 HA GLU 64 73.859 -4.255 -4.255
460 1HB GLU 64 HB2 GLU 64 73.514 -5.840 -5.840
461 2HB GLU 64 HB1 GLU 64 73.240 -4.602 -4.602
462 1HG GLU 64 HG2 GLU 64 71.043 -4.227 -4.227
463 2HG GLU 64 HG1 GLU 64 71.338 -4.803 -4.803
464 H VAL 65 HN VAL 65 73.434 -1.828 -1.828
465 HA VAL 65 HA VAL 65 71.122 -0.666 -0.666
466 HB VAL 65 HB VAL 65 70.554 0.332 0.332
467 1HG1 VAL 65 HG13 VAL 65 70.179 -2.114 -2.114
468 2HG1 VAL 65 HG12 VAL 65 71.780 -2.382 -2.382
469 3HG1 VAL 65 HG11 VAL 65 70.529 -1.589 -1.589
470 1HG2 VAL 65 HG23 VAL 65 73.415 -0.327 -0.327
471 2HG2 VAL 65 HG22 VAL 65 72.638 1.257 1.257
472 3HG2 VAL 65 HG21 VAL 65 72.202 0.083 0.083
473 H ASP 66 HN ASP 66 74.402 -0.355 -0.355
474 HA ASP 66 HA ASP 66 74.422 2.625 2.625
475 1HB ASP 66 HB2 ASP 66 76.060 1.636 1.636
476 2HB ASP 66 HB1 ASP 66 76.526 0.458 0.458
477 H GLU 67 HN GLU 67 76.604 0.470 0.470
478 HA GLU 67 HA GLU 67 76.332 2.023 2.023
479 1HB GLU 67 HB2 GLU 67 77.990 0.343 0.343
480 2HB GLU 67 HB1 GLU 67 78.440 1.030 1.030
481 1HG GLU 67 HG2 GLU 67 78.307 -0.979 -0.979
482 2HG GLU 67 HG1 GLU 67 76.723 -1.302 -1.302
483 H ASP 68 HN ASP 68 74.218 -0.147 -0.147
484 HA ASP 68 HA ASP 68 73.748 -1.939 -1.939
485 1HB ASP 68 HB2 ASP 68 73.038 -2.428 -2.428
486 2HB ASP 68 HB1 ASP 68 72.041 -0.974 -0.974
487 H GLY 69 HN GLY 69 73.084 1.388 1.388
488 1HA GLY 69 HA2 GLY 69 72.307 2.696 2.696
489 2HA GLY 69 HA1 GLY 69 71.235 1.354 1.354
490 H SER 70 HN SER 70 71.586 2.319 2.319
491 HA SER 70 HA SER 70 68.870 3.593 3.593
492 1HB SER 70 HB2 SER 70 69.576 1.178 1.178
493 2HB SER 70 HB1 SER 70 69.686 2.270 2.270
494 HG SER 70 HG SER 70 67.483 1.650 1.650
495 H GLY 71 HN GLY 71 71.669 4.778 4.778
496 1HA GLY 71 HA2 GLY 71 72.737 6.595 6.595
497 2HA GLY 71 HA1 GLY 71 71.178 6.951 6.951
498 H THR 72 HN THR 72 71.773 7.303 7.303
499 HA THR 72 HA THR 72 73.711 5.567 5.567
500 HB THR 72 HB THR 72 73.271 7.100 7.100
501 HG1 THR 72 HG1 THR 72 71.599 8.597 8.597
502 1HG2 THR 72 HG23 THR 72 73.813 8.024 8.024
503 2HG2 THR 72 HG22 THR 72 73.254 9.300 9.300
504 3HG2 THR 72 HG21 THR 72 74.687 8.359 8.359
505 H ILE 73 HN ILE 73 70.575 6.536 6.536
506 HA ILE 73 HA ILE 73 69.627 3.736 3.736
507 HB ILE 73 HB ILE 73 71.153 3.858 3.858
508 1HG1 ILE 73 HG12 ILE 73 68.371 4.282 4.282
509 2HG1 ILE 73 HG11 ILE 73 68.841 2.802 2.802
510 1HG2 ILE 73 HG22 ILE 73 70.524 6.549 6.549
511 2HG2 ILE 73 HG21 ILE 73 69.718 5.962 5.962
512 3HG2 ILE 73 HG23 ILE 73 71.453 5.720 5.720
513 HD1 ILE 73 HD1 ILE 73 69.882 2.032 2.032
514 HD1 ILE 73 HD1 ILE 73 69.263 3.428 3.428
515 HD1 ILE 73 HD1 ILE 73 70.849 3.502 3.502
516 H ASP 74 HN ASP 74 67.560 4.111 4.111
517 HA ASP 74 HA ASP 74 66.108 6.580 6.580
518 1HB ASP 74 HB2 ASP 74 65.709 4.019 4.019
519 2HB ASP 74 HB1 ASP 74 64.279 4.976 4.976
520 H PHE 75 HN PHE 75 64.740 6.905 6.905
521 HA PHE 75 HA PHE 75 64.578 5.365 5.365
522 1HB PHE 75 HB2 PHE 75 63.646 7.674 7.674
523 2HB PHE 75 HB1 PHE 75 62.256 6.882 6.882
524 HD1 PHE 75 HD2 PHE 75 60.991 5.120 5.120
525 HD2 PHE 75 HD1 PHE 75 63.700 8.018 8.018
526 HE1 PHE 75 HE2 PHE 75 59.971 4.800 4.800
527 HE2 PHE 75 HE1 PHE 75 62.679 7.697 7.697
528 HZ PHE 75 HZ PHE 75 60.815 6.089 6.089
529 H GLU 76 HN GLU 76 62.032 5.303 5.303
530 HA GLU 76 HA GLU 76 60.565 3.110 3.110
531 1HB GLU 76 HB2 GLU 76 59.783 2.950 2.950
532 2HB GLU 76 HB1 GLU 76 59.933 4.639 4.639
533 1HG GLU 76 HG2 GLU 76 62.294 4.559 4.559
534 2HG GLU 76 HG1 GLU 76 61.813 3.032 3.032
535 H GLU 77 HN GLU 77 63.384 3.105 3.105
536 HA GLU 77 HA GLU 77 63.438 0.217 0.217
537 1HB GLU 77 HB2 GLU 77 64.384 2.057 2.057
538 2HB GLU 77 HB1 GLU 77 65.703 2.197 2.197
539 1HG GLU 77 HG2 GLU 77 66.720 0.521 0.521
540 2HG GLU 77 HG1 GLU 77 65.483 -0.551 -0.551
541 H PHE 78 HN PHE 78 64.785 2.514 2.514
542 HA PHE 78 HA PHE 78 66.783 0.763 0.763
543 1HB PHE 78 HB2 PHE 78 67.017 3.102 3.102
544 2HB PHE 78 HB1 PHE 78 65.336 3.287 3.287
545 HD1 PHE 78 HD1 PHE 78 68.376 1.327 1.327
546 HD2 PHE 78 HD2 PHE 78 64.940 3.583 3.583
547 HE1 PHE 78 HE1 PHE 78 69.048 1.042 1.042
548 HE2 PHE 78 HE2 PHE 78 65.611 3.297 3.297
549 HZ PHE 78 HZ PHE 78 67.665 2.026 2.026
550 H LEU 79 HN LEU 79 63.338 1.309 1.309
551 HA LEU 79 HA LEU 79 62.890 0.256 0.256
552 1HB LEU 79 HB2 LEU 79 61.504 0.258 0.258
553 2HB LEU 79 HB1 LEU 79 60.903 -0.921 -0.921
554 HG LEU 79 HG LEU 79 59.671 1.152 1.152
555 HD1 LEU 79 HD1 LEU 79 59.911 1.354 1.354
556 HD1 LEU 79 HD1 LEU 79 61.667 1.206 1.206
557 HD1 LEU 79 HD1 LEU 79 60.653 -0.217 -0.217
558 HD2 LEU 79 HD2 LEU 79 62.441 2.324 2.324
559 HD2 LEU 79 HD2 LEU 79 61.148 3.158 3.158
560 HD2 LEU 79 HD2 LEU 79 61.003 2.857 2.857
561 H VAL 80 HN VAL 80 63.680 -1.550 -1.550
562 HA VAL 80 HA VAL 80 63.295 -4.197 -4.197
563 HB VAL 80 HB VAL 80 65.337 -2.982 -2.982
564 1HG1 VAL 80 HG13 VAL 80 64.579 -5.832 -5.832
565 2HG1 VAL 80 HG12 VAL 80 65.176 -5.390 -5.390
566 3HG1 VAL 80 HG11 VAL 80 66.188 -5.131 -5.131
567 1HG2 VAL 80 HG21 VAL 80 62.776 -2.736 -2.736
568 2HG2 VAL 80 HG23 VAL 80 63.752 -3.351 -3.351
569 3HG2 VAL 80 HG22 VAL 80 62.810 -4.466 -4.466
570 H MET 81 HN MET 81 66.268 -2.198 -2.198
571 HA MET 81 HA MET 81 67.956 -4.021 -4.021
572 1HB MET 81 HB2 MET 81 67.753 -1.114 -1.114
573 2HB MET 81 HB1 MET 81 68.744 -1.545 -1.545
574 1HG MET 81 HG2 MET 81 70.088 -1.458 -1.458
575 2HG MET 81 HG1 MET 81 70.068 -3.078 -3.078
576 1HE MET 81 HE3 MET 81 68.339 -0.614 -0.614
577 2HE MET 81 HE2 MET 81 68.719 -1.157 -1.157
578 3HE MET 81 HE1 MET 81 67.126 -1.480 -1.480
579 H MET 82 HN MET 82 65.289 -2.106 -2.106
580 HA MET 82 HA MET 82 66.063 -2.233 -2.233
581 1HB MET 82 HB2 MET 82 63.338 -1.703 -1.703
582 2HB MET 82 HB1 MET 82 63.976 -1.094 -1.094
583 1HG MET 82 HG2 MET 82 65.813 0.025 0.025
584 2HG MET 82 HG1 MET 82 64.753 -0.294 -0.294
585 1HE MET 82 HE3 MET 82 65.051 0.961 0.961
586 2HE MET 82 HE2 MET 82 63.819 2.203 2.203
587 3HE MET 82 HE1 MET 82 63.352 0.505 0.505
588 H VAL 83 HN VAL 83 63.167 -3.564 -3.564
589 HA VAL 83 HA VAL 83 62.549 -5.464 -5.464
590 HB VAL 83 HB VAL 83 60.954 -4.744 -4.744
591 1HG1 VAL 83 HG13 VAL 83 63.056 -4.791 -4.791
592 2HG1 VAL 83 HG12 VAL 83 62.200 -6.254 -6.254
593 3HG1 VAL 83 HG11 VAL 83 61.370 -4.700 -4.700
594 1HG2 VAL 83 HG23 VAL 83 61.090 -7.239 -7.239
595 2HG2 VAL 83 HG22 VAL 83 59.948 -6.805 -6.805
596 3HG2 VAL 83 HG21 VAL 83 61.475 -7.584 -7.584
597 H ARG 84 HN ARG 84 64.564 -5.744 -5.744
598 HA ARG 84 HA ARG 84 65.007 -8.542 -8.542
599 1HB ARG 84 HB2 ARG 84 66.724 -6.171 -6.171
600 2HB ARG 84 HB1 ARG 84 67.141 -7.838 -7.838
601 1HG ARG 84 HG2 ARG 84 64.447 -6.675 -6.675
602 2HG ARG 84 HG1 ARG 84 65.841 -6.503 -6.503
603 1HD ARG 84 HD2 ARG 84 66.099 -8.943 -8.943
604 2HD ARG 84 HD1 ARG 84 64.748 -9.153 -9.153
605 HE ARG 84 HE ARG 84 64.317 -7.652 -7.652
606 1HH1 ARG 84 HH1 ARG 84 61.966 -8.078 -8.078
607 2HH1 ARG 84 HH1 ARG 84 61.286 -9.546 -9.546
608 1HH2 ARG 84 HH2 ARG 84 64.178 -10.496 -10.496
609 2HH2 ARG 84 HH2 ARG 84 62.538 -10.915 -10.915
610 H GLN 85 HN GLN 85 66.672 -5.930 -5.930
611 HA GLN 85 HA GLN 85 68.552 -7.784 -7.784
612 1HB GLN 85 HB2 GLN 85 69.049 -5.407 -5.407
613 2HB GLN 85 HB1 GLN 85 67.850 -4.883 -4.883
614 1HG GLN 85 HG2 GLN 85 70.094 -4.791 -4.791
615 2HG GLN 85 HG1 GLN 85 69.133 -6.037 -6.037
616 1HE2 GLN 85 HE22 GLN 85 72.196 -7.868 -7.868
617 2HE2 GLN 85 HE21 GLN 85 71.498 -6.817 -6.817
618 H MET 86 HN MET 86 65.613 -5.990 -5.990
619 HA MET 86 HA MET 86 65.618 -6.843 -6.843
620 1HB MET 86 HB2 MET 86 64.104 -5.191 -5.191
621 2HB MET 86 HB1 MET 86 63.007 -6.188 -6.188
622 1HG MET 86 HG2 MET 86 64.891 -5.334 -5.334
623 2HG MET 86 HG1 MET 86 64.649 -3.919 -3.919
624 1HE MET 86 HE1 MET 86 62.643 -3.311 -3.311
625 2HE MET 86 HE3 MET 86 61.001 -3.528 -3.528
626 3HE MET 86 HE2 MET 86 62.068 -2.321 -2.321
627 H LYS 87 HN LYS 87 64.667 -8.307 -8.307
628 HA LYS 87 HA LYS 87 62.570 -10.026 -10.026
629 1HB LYS 87 HB2 LYS 87 64.980 -10.137 -10.137
630 2HB LYS 87 HB1 LYS 87 64.035 -11.614 -11.614
631 1HG LYS 87 HG2 LYS 87 62.213 -9.446 -9.446
632 2HG LYS 87 HG1 LYS 87 63.444 -9.353 -9.353
633 1HD LYS 87 HD2 LYS 87 62.944 -12.041 -12.041
634 2HD LYS 87 HD1 LYS 87 61.351 -11.389 -11.389
635 1HE LYS 87 HE2 LYS 87 61.569 -9.861 -9.861
636 2HE LYS 87 HE1 LYS 87 63.048 -10.742 -10.742
637 1HZ LYS 87 HZ1 LYS 87 61.440 -12.774 -12.774
638 2HZ LYS 87 HZ3 LYS 87 60.276 -11.654 -11.654
639 3HZ LYS 87 HZ2 LYS 87 61.562 -12.076 -12.076
640 H GLU 88 HN GLU 88 65.947 -10.176 -10.176
641 HA GLU 88 HA GLU 88 65.533 -12.817 -12.817
642 1HB GLU 88 HB2 GLU 88 67.614 -11.595 -11.595
643 2HB GLU 88 HB1 GLU 88 68.112 -11.453 -11.453
644 1HG GLU 88 HG2 GLU 88 68.079 -13.786 -13.786
645 2HG GLU 88 HG1 GLU 88 67.073 -14.065 -14.065
646 H ASP 89 HN ASP 89 66.146 -9.409 -9.409
647 HA ASP 89 HA ASP 89 66.452 -9.908 -9.908
648 1HB ASP 89 HB2 ASP 89 66.183 -7.472 -7.472
649 2HB ASP 89 HB1 ASP 89 66.360 -7.348 -7.348
650 H ALA 90 HN ALA 90 63.845 -9.177 -9.177
651 HA ALA 90 HA ALA 90 61.978 -8.260 -8.260
652 1HB ALA 90 HB1 ALA 90 62.013 -7.593 -7.593
653 2HB ALA 90 HB3 ALA 90 61.481 -9.227 -9.227
654 3HB ALA 90 HB2 ALA 90 60.442 -8.168 -8.168
Start of MODEL 3
1 1H ALA 1 HT1 ALA 1 64.147 -5.151 -5.151
2 2H ALA 1 HT3 ALA 1 65.153 -5.716 -5.716
3 3H ALA 1 HT2 ALA 1 63.579 -6.335 -6.335
4 HA ALA 1 HA ALA 1 65.201 -7.927 -7.927
5 1HB ALA 1 HB1 ALA 1 65.933 -5.464 -5.464
6 2HB ALA 1 HB3 ALA 1 66.482 -7.081 -7.081
7 3HB ALA 1 HB2 ALA 1 66.964 -6.378 -6.378
8 H SER 2 HN SER 2 65.137 -8.581 -8.581
9 HA SER 2 HA SER 2 62.261 -8.714 -8.714
10 1HB SER 2 HB2 SER 2 64.652 -10.214 -10.214
11 2HB SER 2 HB1 SER 2 63.929 -9.843 -9.843
12 HG SER 2 HG SER 2 62.924 -11.320 -11.320
13 H MET 3 HN MET 3 64.870 -6.671 -6.671
14 HA MET 3 HA MET 3 64.463 -6.019 -6.019
15 1HB MET 3 HB2 MET 3 65.625 -4.873 -4.873
16 2HB MET 3 HB1 MET 3 64.935 -3.614 -3.614
17 1HG MET 3 HG2 MET 3 66.278 -5.444 -5.444
18 2HG MET 3 HG1 MET 3 67.372 -5.082 -5.082
19 1HE MET 3 HE3 MET 3 66.155 -4.527 -4.527
20 2HE MET 3 HE2 MET 3 67.730 -3.805 -3.805
21 3HE MET 3 HE1 MET 3 66.270 -2.834 -2.834
22 H THR 4 HN THR 4 62.793 -4.663 -4.663
23 HA THR 4 HA THR 4 61.105 -2.818 -2.818
24 HB THR 4 HB THR 4 60.845 -4.547 -4.547
25 HG1 THR 4 HG1 THR 4 62.375 -2.855 -2.855
26 1HG2 THR 4 HG21 THR 4 58.773 -3.038 -3.038
27 2HG2 THR 4 HG23 THR 4 59.076 -2.390 -2.390
28 3HG2 THR 4 HG22 THR 4 58.641 -4.087 -4.087
29 H ASP 5 HN ASP 5 60.942 -6.317 -6.317
30 HA ASP 5 HA ASP 5 58.152 -6.488 -6.488
31 1HB ASP 5 HB2 ASP 5 59.990 -8.123 -8.123
32 2HB ASP 5 HB1 ASP 5 59.947 -8.793 -8.793
33 H GLN 6 HN GLN 6 61.312 -7.253 -7.253
34 HA GLN 6 HA GLN 6 60.282 -7.787 -7.787
35 1HB GLN 6 HB2 GLN 6 62.716 -7.803 -7.803
36 2HB GLN 6 HB1 GLN 6 62.950 -6.590 -6.590
37 1HG GLN 6 HG2 GLN 6 62.513 -8.127 -8.127
38 2HG GLN 6 HG1 GLN 6 61.718 -9.265 -9.265
39 1HE2 GLN 6 HE22 GLN 6 64.939 -10.326 -10.326
40 2HE2 GLN 6 HE21 GLN 6 63.415 -9.828 -9.828
41 H GLN 7 HN GLN 7 60.552 -4.836 -4.836
42 HA GLN 7 HA GLN 7 60.991 -3.058 -3.058
43 1HB GLN 7 HB2 GLN 7 61.480 -2.597 -2.597
44 2HB GLN 7 HB1 GLN 7 59.742 -2.542 -2.542
45 1HG GLN 7 HG2 GLN 7 60.161 -0.863 -0.863
46 2HG GLN 7 HG1 GLN 7 61.473 -0.486 -0.486
47 1HE2 GLN 7 HE22 GLN 7 59.274 1.515 1.515
48 2HE2 GLN 7 HE21 GLN 7 60.793 1.347 1.347
49 H ALA 8 HN ALA 8 58.088 -3.436 -3.436
50 HA ALA 8 HA ALA 8 56.224 -2.107 -2.107
51 1HB ALA 8 HB1 ALA 8 56.277 -3.820 -3.820
52 2HB ALA 8 HB3 ALA 8 55.152 -4.578 -4.578
53 3HB ALA 8 HB2 ALA 8 54.883 -2.919 -2.919
54 H GLU 9 HN GLU 9 57.282 -5.503 -5.503
55 HA GLU 9 HA GLU 9 55.515 -6.033 -6.033
56 1HB GLU 9 HB2 GLU 9 57.905 -7.463 -7.463
57 2HB GLU 9 HB1 GLU 9 56.855 -8.157 -8.157
58 1HG GLU 9 HG2 GLU 9 56.104 -7.349 -7.349
59 2HG GLU 9 HG1 GLU 9 56.036 -8.961 -8.961
60 H ALA 10 HN ALA 10 58.588 -4.537 -4.537
61 HA ALA 10 HA ALA 10 59.661 -5.183 -5.183
62 1HB ALA 10 HB3 ALA 10 60.342 -3.368 -3.368
63 2HB ALA 10 HB2 ALA 10 61.208 -3.215 -3.215
64 3HB ALA 10 HB1 ALA 10 61.256 -4.735 -4.735
65 H ARG 11 HN ARG 11 57.341 -2.949 -2.949
66 HA ARG 11 HA ARG 11 57.756 -1.085 -1.085
67 1HB ARG 11 HB2 ARG 11 55.809 -0.757 -0.757
68 2HB ARG 11 HB1 ARG 11 56.586 0.495 0.495
69 1HG ARG 11 HG2 ARG 11 58.215 0.650 0.650
70 2HG ARG 11 HG1 ARG 11 58.657 -1.029 -1.029
71 1HD ARG 11 HD2 ARG 11 58.110 -0.781 -0.781
72 2HD ARG 11 HD1 ARG 11 56.823 -1.728 -1.728
73 HE ARG 11 HE ARG 11 55.541 0.440 0.440
74 1HH1 ARG 11 HH1 ARG 11 56.748 2.723 2.723
75 2HH1 ARG 11 HH1 ARG 11 56.819 2.851 2.851
76 1HH2 ARG 11 HH2 ARG 11 56.230 -0.520 -0.520
77 2HH2 ARG 11 HH2 ARG 11 56.526 1.017 1.017
78 H ALA 12 HN ALA 12 55.029 -2.643 -2.643
79 HA ALA 12 HA ALA 12 53.075 -2.157 -2.157
80 1HB ALA 12 HB2 ALA 12 53.184 -3.098 -3.098
81 2HB ALA 12 HB1 ALA 12 52.789 -4.569 -4.569
82 3HB ALA 12 HB3 ALA 12 51.743 -3.154 -3.154
83 H PHE 13 HN PHE 13 55.719 -4.322 -4.322
84 HA PHE 13 HA PHE 13 54.525 -6.565 -6.565
85 1HB PHE 13 HB2 PHE 13 56.756 -7.219 -7.219
86 2HB PHE 13 HB1 PHE 13 56.889 -6.156 -6.156
87 HD1 PHE 13 HD1 PHE 13 57.622 -3.774 -3.774
88 HD2 PHE 13 HD2 PHE 13 57.767 -6.660 -6.660
89 HE1 PHE 13 HE1 PHE 13 59.185 -2.314 -2.314
90 HE2 PHE 13 HE2 PHE 13 59.327 -5.200 -5.200
91 HZ PHE 13 HZ PHE 13 60.037 -3.026 -3.026
92 H LEU 14 HN LEU 14 55.041 -3.338 -3.338
93 HA LEU 14 HA LEU 14 54.490 -4.169 -4.169
94 1HB LEU 14 HB2 LEU 14 55.858 -2.010 -2.010
95 2HB LEU 14 HB1 LEU 14 56.744 -3.447 -3.447
96 HG LEU 14 HG LEU 14 56.738 -2.620 -2.620
97 HD1 LEU 14 HD1 LEU 14 55.168 -0.383 -0.383
98 HD1 LEU 14 HD1 LEU 14 54.793 -1.303 -1.303
99 HD1 LEU 14 HD1 LEU 14 56.094 -0.112 -0.112
100 HD2 LEU 14 HD2 LEU 14 57.717 -0.315 -0.315
101 HD2 LEU 14 HD2 LEU 14 58.511 -1.137 -1.137
102 HD2 LEU 14 HD2 LEU 14 58.438 -1.906 -1.906
103 H SER 15 HN SER 15 53.842 -1.887 -1.887
104 HA SER 15 HA SER 15 51.456 -0.943 -0.943
105 1HB SER 15 HB2 SER 15 51.146 0.132 0.132
106 2HB SER 15 HB1 SER 15 50.915 -1.602 -1.602
107 HG SER 15 HG SER 15 52.385 -1.695 -1.695
108 H GLU 16 HN GLU 16 51.151 1.248 1.248
109 HA GLU 16 HA GLU 16 53.339 2.892 2.892
110 1HB GLU 16 HB2 GLU 16 50.936 3.055 3.055
111 2HB GLU 16 HB1 GLU 16 50.555 3.764 3.764
112 1HG GLU 16 HG2 GLU 16 51.876 5.687 5.687
113 2HG GLU 16 HG1 GLU 16 52.714 4.916 4.916
114 H GLU 17 HN GLU 17 51.843 2.352 2.352
115 HA GLU 17 HA GLU 17 52.396 4.717 4.717
116 1HB GLU 17 HB2 GLU 17 51.179 2.678 2.678
117 2HB GLU 17 HB1 GLU 17 52.728 1.845 1.845
118 1HG GLU 17 HG2 GLU 17 53.204 4.181 4.181
119 2HG GLU 17 HG1 GLU 17 51.519 3.850 3.850
120 H MET 18 HN MET 18 54.564 1.876 1.876
121 HA MET 18 HA MET 18 56.816 3.283 3.283
122 1HB MET 18 HB2 MET 18 56.344 0.813 0.813
123 2HB MET 18 HB1 MET 18 56.730 0.720 0.720
124 1HG MET 18 HG2 MET 18 58.964 1.817 1.817
125 2HG MET 18 HG1 MET 18 58.568 1.500 1.500
126 1HE MET 18 HE3 MET 18 59.005 0.431 0.431
127 2HE MET 18 HE2 MET 18 59.767 -1.158 -1.158
128 3HE MET 18 HE1 MET 18 58.010 -1.030 -1.030
129 H ILE 19 HN ILE 19 55.642 2.704 2.704
130 HA ILE 19 HA ILE 19 57.861 3.084 3.084
131 HB ILE 19 HB ILE 19 55.036 4.155 4.155
132 1HG1 ILE 19 HG12 ILE 19 56.571 1.924 1.924
133 2HG1 ILE 19 HG11 ILE 19 55.215 1.765 1.765
134 1HG2 ILE 19 HG21 ILE 19 57.296 5.045 5.045
135 2HG2 ILE 19 HG23 ILE 19 56.175 4.171 4.171
136 3HG2 ILE 19 HG22 ILE 19 55.612 5.558 5.558
137 HD1 ILE 19 HD1 ILE 19 54.287 3.449 3.449
138 HD1 ILE 19 HD1 ILE 19 53.844 1.762 1.762
139 HD1 ILE 19 HD1 ILE 19 55.175 2.164 2.164
140 H ALA 20 HN ALA 20 56.248 5.488 5.488
141 HA ALA 20 HA ALA 20 57.778 7.749 7.749
142 1HB ALA 20 HB3 ALA 20 55.419 7.511 7.511
143 2HB ALA 20 HB2 ALA 20 56.421 7.752 7.752
144 3HB ALA 20 HB1 ALA 20 56.388 8.976 8.976
145 H GLU 21 HN GLU 21 58.054 5.449 5.449
146 HA GLU 21 HA GLU 21 59.936 6.753 6.753
147 1HB GLU 21 HB2 GLU 21 58.886 4.692 4.692
148 2HB GLU 21 HB1 GLU 21 59.483 3.860 3.860
149 1HG GLU 21 HG2 GLU 21 61.602 3.602 3.602
150 2HG GLU 21 HG1 GLU 21 61.520 5.097 5.097
151 H PHE 22 HN PHE 22 60.474 4.731 4.731
152 HA PHE 22 HA PHE 22 63.374 5.052 5.052
153 1HB PHE 22 HB2 PHE 22 61.448 4.129 4.129
154 2HB PHE 22 HB1 PHE 22 63.194 3.881 3.881
155 HD1 PHE 22 HD2 PHE 22 62.595 3.667 3.667
156 HD2 PHE 22 HD1 PHE 22 61.673 1.498 1.498
157 HE1 PHE 22 HE2 PHE 22 62.308 1.591 1.591
158 HE2 PHE 22 HE1 PHE 22 61.385 -0.576 -0.576
159 HZ PHE 22 HZ PHE 22 61.703 -0.529 -0.529
160 H LYS 23 HN LYS 23 60.675 6.807 6.807
161 HA LYS 23 HA LYS 23 61.914 8.214 8.214
162 1HB LYS 23 HB2 LYS 23 59.463 8.077 8.077
163 2HB LYS 23 HB1 LYS 23 59.919 9.412 9.412
164 1HG LYS 23 HG2 LYS 23 58.956 10.311 10.311
165 2HG LYS 23 HG1 LYS 23 60.676 10.695 10.695
166 1HD LYS 23 HD2 LYS 23 61.219 9.076 9.076
167 2HD LYS 23 HD1 LYS 23 59.717 8.187 8.187
168 1HE LYS 23 HE2 LYS 23 59.512 9.393 9.393
169 2HE LYS 23 HE1 LYS 23 58.483 10.221 10.221
170 1HZ LYS 23 HZ3 LYS 23 60.627 11.515 11.515
171 2HZ LYS 23 HZ2 LYS 23 61.153 10.995 10.995
172 3HZ LYS 23 HZ1 LYS 23 59.752 11.945 11.945
173 H ALA 24 HN ALA 24 61.279 9.577 9.577
174 HA ALA 24 HA ALA 24 63.008 11.804 11.804
175 1HB ALA 24 HB2 ALA 24 61.257 10.762 10.762
176 2HB ALA 24 HB1 ALA 24 62.795 10.494 10.494
177 3HB ALA 24 HB3 ALA 24 62.327 12.124 12.124
178 H ALA 25 HN ALA 25 63.727 8.436 8.436
179 HA ALA 25 HA ALA 25 66.428 8.945 8.945
180 1HB ALA 25 HB1 ALA 25 64.714 6.588 6.588
181 2HB ALA 25 HB3 ALA 25 66.442 6.351 6.351
182 3HB ALA 25 HB2 ALA 25 65.433 6.990 6.990
183 H PHE 26 HN PHE 26 65.000 7.753 7.753
184 HA PHE 26 HA PHE 26 67.432 7.251 7.251
185 1HB PHE 26 HB2 PHE 26 65.084 6.593 6.593
186 2HB PHE 26 HB1 PHE 26 64.790 8.271 8.271
187 HD1 PHE 26 HD1 PHE 26 66.780 5.237 5.237
188 HD2 PHE 26 HD2 PHE 26 65.692 9.195 9.195
189 HE1 PHE 26 HE1 PHE 26 67.816 4.816 4.816
190 HE2 PHE 26 HE2 PHE 26 66.728 8.773 8.773
191 HZ PHE 26 HZ PHE 26 67.790 6.584 6.584
192 H ASP 27 HN ASP 27 65.590 10.236 10.236
193 HA ASP 27 HA ASP 27 67.000 11.863 11.863
194 1HB ASP 27 HB2 ASP 27 65.215 12.203 12.203
195 2HB ASP 27 HB1 ASP 27 66.119 13.621 13.621
196 H MET 28 HN MET 28 68.066 10.424 10.424
197 HA MET 28 HA MET 28 69.743 12.435 12.435
198 1HB MET 28 HB2 MET 28 69.753 9.416 9.416
199 2HB MET 28 HB1 MET 28 70.991 10.300 10.300
200 1HG MET 28 HG2 MET 28 68.386 11.368 11.368
201 2HG MET 28 HG1 MET 28 68.396 9.624 9.624
202 1HE MET 28 HE3 MET 28 68.183 12.353 12.353
203 2HE MET 28 HE2 MET 28 68.851 12.123 12.123
204 3HE MET 28 HE1 MET 28 69.733 13.086 13.086
205 H PHE 29 HN PHE 29 70.110 10.413 10.413
206 HA PHE 29 HA PHE 29 72.827 11.611 11.611
207 1HB PHE 29 HB2 PHE 29 72.033 8.932 8.932
208 2HB PHE 29 HB1 PHE 29 73.632 9.516 9.516
209 HD1 PHE 29 HD2 PHE 29 70.452 8.124 8.124
210 HD2 PHE 29 HD1 PHE 29 74.403 9.431 9.431
211 HE1 PHE 29 HE2 PHE 29 70.204 7.059 7.059
212 HE2 PHE 29 HE1 PHE 29 74.155 8.366 8.366
213 HZ PHE 29 HZ PHE 29 72.056 7.180 7.180
214 H ASP 30 HN ASP 30 69.886 12.134 12.134
215 HA ASP 30 HA ASP 30 69.721 11.547 11.547
216 1HB ASP 30 HB2 ASP 30 68.283 12.914 12.914
217 2HB ASP 30 HB1 ASP 30 68.391 13.990 13.990
218 H ALA 31 HN ALA 31 71.937 12.104 12.104
219 HA ALA 31 HA ALA 31 73.327 14.483 14.483
220 1HB ALA 31 HB1 ALA 31 72.865 12.406 12.406
221 2HB ALA 31 HB3 ALA 31 73.650 13.890 13.890
222 3HB ALA 31 HB2 ALA 31 74.375 12.926 12.926
223 H ASP 32 HN ASP 32 70.319 13.909 13.909
224 HA ASP 32 HA ASP 32 70.389 16.613 16.613
225 1HB ASP 32 HB2 ASP 32 69.334 14.053 14.053
226 2HB ASP 32 HB1 ASP 32 67.949 15.117 15.117
227 H GLY 33 HN GLY 33 69.003 14.887 14.887
228 1HA GLY 33 HA2 GLY 33 68.106 16.138 16.138
229 2HA GLY 33 HA1 GLY 33 67.522 17.358 17.358
230 H GLY 34 HN GLY 34 67.102 14.065 14.065
231 1HA GLY 34 HA2 GLY 34 64.972 12.905 12.905
232 2HA GLY 34 HA1 GLY 34 64.173 14.367 14.367
233 H GLY 35 HN GLY 35 65.401 11.282 11.282
234 1HA GLY 35 HA2 GLY 35 64.019 10.865 10.865
235 2HA GLY 35 HA1 GLY 35 65.371 11.842 11.842
236 H ASP 36 HN ASP 36 67.479 10.909 10.909
237 HA ASP 36 HA ASP 36 67.621 8.029 8.029
238 1HB ASP 36 HB2 ASP 36 69.138 7.868 7.868
239 2HB ASP 36 HB1 ASP 36 67.407 8.047 8.047
240 H ILE 37 HN ILE 37 69.809 7.325 7.325
241 HA ILE 37 HA ILE 37 71.517 9.581 9.581
242 HB ILE 37 HB ILE 37 71.338 6.649 6.649
243 1HG1 ILE 37 HG12 ILE 37 70.491 9.071 9.071
244 2HG1 ILE 37 HG11 ILE 37 69.373 8.201 8.201
245 1HG2 ILE 37 HG21 ILE 37 72.904 8.965 8.965
246 2HG2 ILE 37 HG23 ILE 37 72.712 7.396 7.396
247 3HG2 ILE 37 HG22 ILE 37 73.572 7.516 7.516
248 HD1 ILE 37 HD1 ILE 37 69.565 6.201 6.201
249 HD1 ILE 37 HD1 ILE 37 69.438 7.481 7.481
250 HD1 ILE 37 HD1 ILE 37 71.010 6.773 6.773
251 H SER 38 HN SER 38 73.945 8.951 8.951
252 HA SER 38 HA SER 38 74.786 8.343 8.343
253 1HB SER 38 HB2 SER 38 76.199 8.673 8.673
254 2HB SER 38 HB1 SER 38 77.059 8.466 8.466
255 HG SER 38 HG SER 38 76.034 10.338 10.338
256 H THR 39 HN THR 39 75.331 6.355 6.355
257 HA THR 39 HA THR 39 74.677 3.890 3.890
258 HB THR 39 HB THR 39 76.288 2.992 2.992
259 HG1 THR 39 HG1 THR 39 77.062 5.716 5.716
260 1HG2 THR 39 HG23 THR 39 74.272 5.066 5.066
261 2HG2 THR 39 HG22 THR 39 75.427 4.849 4.849
262 3HG2 THR 39 HG21 THR 39 74.473 3.480 3.480
263 H LYS 40 HN LYS 40 77.543 5.842 5.842
264 HA LYS 40 HA LYS 40 78.984 3.691 3.691
265 1HB LYS 40 HB2 LYS 40 79.895 5.699 5.699
266 2HB LYS 40 HB1 LYS 40 79.537 6.661 6.661
267 1HG LYS 40 HG2 LYS 40 81.160 5.620 5.620
268 2HG LYS 40 HG1 LYS 40 81.069 4.118 4.118
269 1HD LYS 40 HD2 LYS 40 83.148 5.098 5.098
270 2HD LYS 40 HD1 LYS 40 82.056 5.444 5.444
271 1HE LYS 40 HE2 LYS 40 81.940 7.498 7.498
272 2HE LYS 40 HE1 LYS 40 83.548 7.348 7.348
273 1HZ LYS 40 HZ2 LYS 40 82.221 7.162 7.162
274 2HZ LYS 40 HZ1 LYS 40 80.958 7.889 7.889
275 3HZ LYS 40 HZ3 LYS 40 82.435 8.702 8.702
276 H GLU 41 HN GLU 41 76.388 5.661 5.661
277 HA GLU 41 HA GLU 41 77.089 5.543 5.543
278 1HB GLU 41 HB2 GLU 41 77.020 7.822 7.822
279 2HB GLU 41 HB1 GLU 41 75.464 7.530 7.530
280 1HG GLU 41 HG2 GLU 41 74.331 7.895 7.895
281 2HG GLU 41 HG1 GLU 41 75.418 6.857 6.857
282 H LEU 42 HN LEU 42 75.136 4.232 4.232
283 HA LEU 42 HA LEU 42 72.544 4.123 4.123
284 1HB LEU 42 HB2 LEU 42 73.098 3.474 3.474
285 2HB LEU 42 HB1 LEU 42 74.078 2.135 2.135
286 HG LEU 42 HG LEU 42 71.321 2.191 2.191
287 HD1 LEU 42 HD1 LEU 42 71.776 2.555 2.555
288 HD1 LEU 42 HD1 LEU 42 70.242 2.380 2.380
289 HD1 LEU 42 HD1 LEU 42 71.100 0.950 0.950
290 HD2 LEU 42 HD2 LEU 42 71.595 -0.114 -0.114
291 HD2 LEU 42 HD2 LEU 42 73.281 0.395 0.395
292 HD2 LEU 42 HD2 LEU 42 72.591 -0.077 -0.077
293 H GLY 43 HN GLY 43 75.468 2.224 2.224
294 1HA GLY 43 HA2 GLY 43 74.216 0.149 0.149
295 2HA GLY 43 HA1 GLY 43 75.924 0.586 0.586
296 H THR 44 HN THR 44 75.107 3.438 3.438
297 HA THR 44 HA THR 44 75.142 3.141 3.141
298 HB THR 44 HB THR 44 74.851 5.472 5.472
299 HG1 THR 44 HG1 THR 44 77.014 4.949 4.949
300 1HG2 THR 44 HG23 THR 44 73.805 5.993 5.993
301 2HG2 THR 44 HG22 THR 44 75.303 5.532 5.532
302 3HG2 THR 44 HG21 THR 44 75.275 6.930 6.930
303 H VAL 45 HN VAL 45 72.758 4.609 4.609
304 HA VAL 45 HA VAL 45 70.709 5.255 5.255
305 HB VAL 45 HB VAL 45 70.912 5.443 5.443
306 1HG1 VAL 45 HG11 VAL 45 70.931 2.711 2.711
307 2HG1 VAL 45 HG13 VAL 45 69.233 3.022 3.022
308 3HG1 VAL 45 HG12 VAL 45 70.487 3.641 3.641
309 1HG2 VAL 45 HG21 VAL 45 68.855 5.912 5.912
310 2HG2 VAL 45 HG23 VAL 45 68.617 5.861 5.861
311 3HG2 VAL 45 HG22 VAL 45 68.186 4.466 4.466
312 H MET 46 HN MET 46 71.779 2.049 2.049
313 HA MET 46 HA MET 46 69.411 0.648 0.648
314 1HB MET 46 HB2 MET 46 72.218 -0.076 -0.076
315 2HB MET 46 HB1 MET 46 71.111 -1.298 -1.298
316 1HG MET 46 HG2 MET 46 69.516 -0.855 -0.855
317 2HG MET 46 HG1 MET 46 70.432 0.549 0.549
318 1HE MET 46 HE3 MET 46 69.947 -3.168 -3.168
319 2HE MET 46 HE2 MET 46 69.413 -2.433 -2.433
320 3HE MET 46 HE1 MET 46 70.705 -3.631 -3.631
321 H ARG 47 HN ARG 47 72.758 1.034 1.034
322 HA ARG 47 HA ARG 47 72.265 -0.307 -0.307
323 1HB ARG 47 HB2 ARG 47 74.359 1.337 1.337
324 2HB ARG 47 HB1 ARG 47 74.413 1.299 1.299
325 1HG ARG 47 HG2 ARG 47 73.973 -1.341 -1.341
326 2HG ARG 47 HG1 ARG 47 74.975 -0.849 -0.849
327 1HD ARG 47 HD2 ARG 47 75.743 -0.125 -0.125
328 2HD ARG 47 HD1 ARG 47 76.224 -1.671 -1.671
329 HE ARG 47 HE ARG 47 77.089 -0.141 -0.141
330 1HH1 ARG 47 HH1 ARG 47 77.685 -0.021 -0.021
331 2HH1 ARG 47 HH1 ARG 47 78.699 1.382 1.382
332 1HH2 ARG 47 HH2 ARG 47 78.099 1.981 1.981
333 2HH2 ARG 47 HH2 ARG 47 78.932 2.516 2.516
334 H MET 48 HN MET 48 71.965 3.055 3.055
335 HA MET 48 HA MET 48 71.632 4.150 4.150
336 1HB MET 48 HB2 MET 48 71.638 5.007 5.007
337 2HB MET 48 HB1 MET 48 70.516 5.923 5.923
338 1HG MET 48 HG2 MET 48 73.233 5.410 5.410
339 2HG MET 48 HG1 MET 48 73.108 6.586 6.586
340 1HE MET 48 HE1 MET 48 72.563 5.563 5.563
341 2HE MET 48 HE3 MET 48 71.552 6.779 6.779
342 3HE MET 48 HE2 MET 48 70.824 5.588 5.588
343 H LEU 49 HN LEU 49 69.638 2.242 2.242
344 HA LEU 49 HA LEU 49 67.098 3.480 3.480
345 1HB LEU 49 HB2 LEU 49 67.967 1.341 1.341
346 2HB LEU 49 HB1 LEU 49 66.282 1.413 1.413
347 HG LEU 49 HG LEU 49 67.740 3.836 3.836
348 HD1 LEU 49 HD1 LEU 49 67.610 1.808 1.808
349 HD1 LEU 49 HD1 LEU 49 66.985 3.353 3.353
350 HD1 LEU 49 HD1 LEU 49 65.872 2.108 2.108
351 HD2 LEU 49 HD2 LEU 49 64.935 3.097 3.097
352 HD2 LEU 49 HD2 LEU 49 65.169 4.223 4.223
353 HD2 LEU 49 HD2 LEU 49 65.800 4.611 4.611
354 H GLY 50 HN GLY 50 69.099 0.616 0.616
355 1HA GLY 50 HA2 GLY 50 68.690 -0.082 -0.082
356 2HA GLY 50 HA1 GLY 50 67.072 -0.437 -0.437
357 H GLN 51 HN GLN 51 68.496 -1.180 -1.180
358 HA GLN 51 HA GLN 51 68.816 -4.033 -4.033
359 1HB GLN 51 HB2 GLN 51 69.123 -2.721 -2.721
360 2HB GLN 51 HB1 GLN 51 68.572 -4.356 -4.356
361 1HG GLN 51 HG2 GLN 51 67.095 -1.758 -1.758
362 2HG GLN 51 HG1 GLN 51 66.604 -3.118 -3.118
363 1HE2 GLN 51 HE22 GLN 51 65.311 -3.080 -3.080
364 2HE2 GLN 51 HE21 GLN 51 65.794 -1.715 -1.715
365 H ASN 52 HN ASN 52 70.688 -4.853 -4.853
366 HA ASN 52 HA ASN 52 73.161 -3.282 -3.282
367 1HB ASN 52 HB2 ASN 52 72.446 -4.850 -4.850
368 2HB ASN 52 HB1 ASN 52 73.343 -6.022 -6.022
369 HD2 ASN 52 HD2 ASN 52 75.046 -5.953 -5.953
370 HD2 ASN 52 HD2 ASN 52 76.148 -4.663 -4.663
371 HA PRO 53 HA PRO 53 73.053 -5.926 -5.926
372 1HB PRO 53 HB2 PRO 53 74.195 -4.062 -4.062
373 2HB PRO 53 HB1 PRO 53 72.456 -4.100 -4.100
374 1HG PRO 53 HG2 PRO 53 74.575 -2.346 -2.346
375 2HG PRO 53 HG1 PRO 53 72.896 -1.967 -1.967
376 1HD PRO 53 HD2 PRO 53 73.777 -2.417 -2.417
377 2HD PRO 53 HD1 PRO 53 72.102 -2.676 -2.676
378 H THR 54 HN THR 54 74.738 -7.361 -7.361
379 HA THR 54 HA THR 54 77.290 -7.060 -7.060
380 HB THR 54 HB THR 54 77.716 -8.904 -8.904
381 HG1 THR 54 HG1 THR 54 75.783 -9.754 -9.754
382 1HG2 THR 54 HG23 THR 54 76.641 -8.874 -8.874
383 2HG2 THR 54 HG22 THR 54 75.923 -10.186 -10.186
384 3HG2 THR 54 HG21 THR 54 77.675 -10.078 -10.078
385 H LYS 55 HN LYS 55 79.331 -6.477 -6.477
386 HA LYS 55 HA LYS 55 79.484 -4.338 -4.338
387 1HB LYS 55 HB2 LYS 55 81.182 -5.509 -5.509
388 2HB LYS 55 HB1 LYS 55 81.672 -6.386 -6.386
389 1HG LYS 55 HG2 LYS 55 82.962 -4.611 -4.611
390 2HG LYS 55 HG1 LYS 55 81.470 -3.722 -3.722
391 1HD LYS 55 HD2 LYS 55 81.449 -3.342 -3.342
392 2HD LYS 55 HD1 LYS 55 83.164 -3.747 -3.747
393 1HE LYS 55 HE2 LYS 55 81.841 -1.608 -1.608
394 2HE LYS 55 HE1 LYS 55 82.728 -1.276 -1.276
395 1HZ LYS 55 HZ3 LYS 55 84.442 -2.891 -2.891
396 2HZ LYS 55 HZ2 LYS 55 83.729 -2.196 -2.196
397 3HZ LYS 55 HZ1 LYS 55 84.476 -1.208 -1.208
398 H GLU 56 HN GLU 56 80.187 -7.790 -7.790
399 HA GLU 56 HA GLU 56 80.700 -7.578 -7.578
400 1HB GLU 56 HB2 GLU 56 80.936 -9.586 -9.586
401 2HB GLU 56 HB1 GLU 56 79.180 -9.757 -9.757
402 1HG GLU 56 HG2 GLU 56 79.130 -10.567 -10.567
403 2HG GLU 56 HG1 GLU 56 80.435 -9.510 -9.510
404 H GLU 57 HN GLU 57 77.633 -7.432 -7.432
405 HA GLU 57 HA GLU 57 75.981 -7.762 -7.762
406 1HB GLU 57 HB2 GLU 57 75.575 -6.970 -6.970
407 2HB GLU 57 HB1 GLU 57 74.245 -6.896 -6.896
408 1HG GLU 57 HG2 GLU 57 75.927 -9.371 -9.371
409 2HG GLU 57 HG1 GLU 57 74.368 -9.073 -9.073
410 H LEU 58 HN LEU 58 77.195 -5.036 -5.036
411 HA LEU 58 HA LEU 58 75.668 -2.945 -2.945
412 1HB LEU 58 HB2 LEU 58 78.458 -3.120 -3.120
413 2HB LEU 58 HB1 LEU 58 77.719 -1.585 -1.585
414 HG LEU 58 HG LEU 58 76.710 -3.563 -3.563
415 HD1 LEU 58 HD1 LEU 58 78.424 -2.118 -2.118
416 HD1 LEU 58 HD1 LEU 58 76.879 -1.490 -1.490
417 HD1 LEU 58 HD1 LEU 58 77.708 -0.705 -0.705
418 HD2 LEU 58 HD2 LEU 58 75.372 -1.285 -1.285
419 HD2 LEU 58 HD2 LEU 58 74.981 -1.577 -1.577
420 HD2 LEU 58 HD2 LEU 58 74.701 -2.839 -2.839
421 H ASP 59 HN ASP 59 78.897 -4.197 -4.197
422 HA ASP 59 HA ASP 59 79.125 -2.497 -2.497
423 1HB ASP 59 HB2 ASP 59 81.080 -3.842 -3.842
424 2HB ASP 59 HB1 ASP 59 80.949 -3.678 -3.678
425 H ALA 60 HN ALA 60 77.582 -5.568 -5.568
426 HA ALA 60 HA ALA 60 77.376 -6.394 -6.394
427 1HB ALA 60 HB1 ALA 60 75.950 -7.225 -7.225
428 2HB ALA 60 HB3 ALA 60 75.853 -8.096 -8.096
429 3HB ALA 60 HB2 ALA 60 77.393 -7.978 -7.978
430 H ILE 61 HN ILE 61 75.254 -4.760 -4.760
431 HA ILE 61 HA ILE 61 72.934 -4.679 -4.679
432 HB ILE 61 HB ILE 61 73.795 -3.021 -3.021
433 1HG1 ILE 61 HG12 ILE 61 71.856 -5.346 -5.346
434 2HG1 ILE 61 HG11 ILE 61 73.559 -5.541 -5.541
435 1HG2 ILE 61 HG22 ILE 61 71.738 -2.486 -2.486
436 2HG2 ILE 61 HG21 ILE 61 70.931 -3.382 -3.382
437 3HG2 ILE 61 HG23 ILE 61 71.825 -1.909 -1.909
438 HD1 ILE 61 HD1 ILE 61 72.977 -5.087 -5.087
439 HD1 ILE 61 HD1 ILE 61 71.361 -4.573 -4.573
440 HD1 ILE 61 HD1 ILE 61 72.699 -3.425 -3.425
441 H ILE 62 HN ILE 62 75.462 -2.280 -2.280
442 HA ILE 62 HA ILE 62 74.524 -0.101 -0.101
443 HB ILE 62 HB ILE 62 77.306 -1.120 -1.120
444 1HG1 ILE 62 HG12 ILE 62 75.805 1.213 1.213
445 2HG1 ILE 62 HG11 ILE 62 75.640 -0.425 -0.425
446 1HG2 ILE 62 HG21 ILE 62 76.440 1.074 1.074
447 2HG2 ILE 62 HG23 ILE 62 77.418 1.647 1.647
448 3HG2 ILE 62 HG22 ILE 62 78.062 0.426 0.426
449 HD1 ILE 62 HD1 ILE 62 78.041 -0.549 -0.549
450 HD1 ILE 62 HD1 ILE 62 77.393 0.895 0.895
451 HD1 ILE 62 HD1 ILE 62 78.279 1.034 1.034
452 H GLU 63 HN GLU 63 77.184 -2.254 -2.254
453 HA GLU 63 HA GLU 63 77.335 -1.604 -1.604
454 1HB GLU 63 HB2 GLU 63 78.615 -3.326 -3.326
455 2HB GLU 63 HB1 GLU 63 77.299 -4.448 -4.448
456 1HG GLU 63 HG2 GLU 63 77.722 -4.368 -4.368
457 2HG GLU 63 HG1 GLU 63 78.793 -2.977 -2.977
458 H GLU 64 HN GLU 64 74.902 -3.683 -3.683
459 HA GLU 64 HA GLU 64 73.595 -4.556 -4.556
460 1HB GLU 64 HB2 GLU 64 73.139 -5.790 -5.790
461 2HB GLU 64 HB1 GLU 64 72.965 -4.346 -4.346
462 1HG GLU 64 HG2 GLU 64 70.777 -4.000 -4.000
463 2HG GLU 64 HG1 GLU 64 71.014 -4.720 -4.720
464 H VAL 65 HN VAL 65 72.703 -2.002 -2.002
465 HA VAL 65 HA VAL 65 70.648 -0.902 -0.902
466 HB VAL 65 HB VAL 65 70.345 0.646 0.646
467 1HG1 VAL 65 HG12 VAL 65 69.712 -1.751 -1.751
468 2HG1 VAL 65 HG11 VAL 65 71.278 -1.999 -1.999
469 3HG1 VAL 65 HG13 VAL 65 70.107 -0.890 -0.890
470 1HG2 VAL 65 HG23 VAL 65 72.835 1.124 1.124
471 2HG2 VAL 65 HG22 VAL 65 71.982 0.981 0.981
472 3HG2 VAL 65 HG21 VAL 65 72.967 -0.359 -0.359
473 H ASP 66 HN ASP 66 74.022 -0.666 -0.666
474 HA ASP 66 HA ASP 66 74.134 2.128 2.128
475 1HB ASP 66 HB2 ASP 66 75.693 0.834 0.834
476 2HB ASP 66 HB1 ASP 66 76.470 0.255 0.255
477 H GLU 67 HN GLU 67 72.740 0.663 0.663
478 HA GLU 67 HA GLU 67 74.156 -0.831 -0.831
479 1HB GLU 67 HB2 GLU 67 72.251 -0.279 -0.279
480 2HB GLU 67 HB1 GLU 67 71.676 -0.492 -0.492
481 1HG GLU 67 HG2 GLU 67 71.791 1.971 1.971
482 2HG GLU 67 HG1 GLU 67 72.278 2.153 2.153
483 H ASP 68 HN ASP 68 74.381 2.523 2.523
484 HA ASP 68 HA ASP 68 75.678 3.109 3.109
485 1HB ASP 68 HB2 ASP 68 73.746 4.420 4.420
486 2HB ASP 68 HB1 ASP 68 75.218 5.382 5.382
487 H GLY 69 HN GLY 69 76.065 3.535 3.535
488 1HA GLY 69 HA2 GLY 69 78.478 2.887 2.887
489 2HA GLY 69 HA1 GLY 69 78.955 4.126 4.126
490 H SER 70 HN SER 70 77.001 6.068 6.068
491 HA SER 70 HA SER 70 77.678 6.841 6.841
492 1HB SER 70 HB2 SER 70 78.801 8.217 8.217
493 2HB SER 70 HB1 SER 70 77.306 8.434 8.434
494 HG SER 70 HG SER 70 77.989 9.422 9.422
495 H GLY 71 HN GLY 71 75.156 5.856 5.856
496 1HA GLY 71 HA2 GLY 71 73.049 7.657 7.657
497 2HA GLY 71 HA1 GLY 71 72.822 5.965 5.965
498 H THR 72 HN THR 72 71.911 7.925 7.925
499 HA THR 72 HA THR 72 72.755 6.465 6.465
500 HB THR 72 HB THR 72 71.054 8.045 8.045
501 HG1 THR 72 HG1 THR 72 70.590 9.723 9.723
502 1HG2 THR 72 HG23 THR 72 73.278 9.016 9.016
503 2HG2 THR 72 HG22 THR 72 72.343 10.139 10.139
504 3HG2 THR 72 HG21 THR 72 73.271 8.853 8.853
505 H ILE 73 HN ILE 73 70.814 5.765 5.765
506 HA ILE 73 HA ILE 73 69.184 3.831 3.831
507 HB ILE 73 HB ILE 73 70.571 3.150 3.150
508 1HG1 ILE 73 HG12 ILE 73 68.543 2.163 2.163
509 2HG1 ILE 73 HG11 ILE 73 67.573 2.891 2.891
510 1HG2 ILE 73 HG23 ILE 73 69.692 5.516 5.516
511 2HG2 ILE 73 HG22 ILE 73 68.717 4.325 4.325
512 3HG2 ILE 73 HG21 ILE 73 70.477 4.218 4.218
513 HD1 ILE 73 HD1 ILE 73 69.202 1.700 1.700
514 HD1 ILE 73 HD1 ILE 73 67.997 0.713 0.713
515 HD1 ILE 73 HD1 ILE 73 69.666 0.732 0.732
516 H ASP 74 HN ASP 74 67.004 4.134 4.134
517 HA ASP 74 HA ASP 74 65.730 6.587 6.587
518 1HB ASP 74 HB2 ASP 74 65.060 4.251 4.251
519 2HB ASP 74 HB1 ASP 74 63.763 5.320 5.320
520 H PHE 75 HN PHE 75 64.197 6.727 6.727
521 HA PHE 75 HA PHE 75 64.132 5.013 5.013
522 1HB PHE 75 HB2 PHE 75 63.051 7.349 7.349
523 2HB PHE 75 HB1 PHE 75 61.633 6.384 6.384
524 HD1 PHE 75 HD2 PHE 75 60.670 4.805 4.805
525 HD2 PHE 75 HD1 PHE 75 63.667 7.733 7.733
526 HE1 PHE 75 HE2 PHE 75 60.113 4.596 4.596
527 HE2 PHE 75 HE1 PHE 75 63.110 7.524 7.524
528 HZ PHE 75 HZ PHE 75 61.334 5.955 5.955
529 H GLU 76 HN GLU 76 61.794 4.987 4.987
530 HA GLU 76 HA GLU 76 60.213 2.801 2.801
531 1HB GLU 76 HB2 GLU 76 61.063 4.068 4.068
532 2HB GLU 76 HB1 GLU 76 60.163 2.553 2.553
533 1HG GLU 76 HG2 GLU 76 58.435 3.588 3.588
534 2HG GLU 76 HG1 GLU 76 59.291 5.121 5.121
535 H GLU 77 HN GLU 77 63.078 2.690 2.690
536 HA GLU 77 HA GLU 77 63.203 -0.200 -0.200
537 1HB GLU 77 HB2 GLU 77 64.116 1.302 1.302
538 2HB GLU 77 HB1 GLU 77 65.273 1.947 1.947
539 1HG GLU 77 HG2 GLU 77 66.268 -0.288 -0.288
540 2HG GLU 77 HG1 GLU 77 65.103 -0.950 -0.950
541 H PHE 78 HN PHE 78 64.583 2.309 2.309
542 HA PHE 78 HA PHE 78 66.577 0.688 0.688
543 1HB PHE 78 HB2 PHE 78 66.783 3.042 3.042
544 2HB PHE 78 HB1 PHE 78 65.091 3.253 3.253
545 HD1 PHE 78 HD1 PHE 78 68.363 1.937 1.937
546 HD2 PHE 78 HD2 PHE 78 64.410 3.247 3.247
547 HE1 PHE 78 HE1 PHE 78 68.986 1.888 1.888
548 HE2 PHE 78 HE2 PHE 78 65.032 3.197 3.197
549 HZ PHE 78 HZ PHE 78 67.319 2.518 2.518
550 H LEU 79 HN LEU 79 63.119 1.106 1.106
551 HA LEU 79 HA LEU 79 62.749 0.255 0.255
552 1HB LEU 79 HB2 LEU 79 61.243 0.241 0.241
553 2HB LEU 79 HB1 LEU 79 60.622 -0.818 -0.818
554 HG LEU 79 HG LEU 79 61.387 1.964 1.964
555 HD1 LEU 79 HD1 LEU 79 59.621 3.016 3.016
556 HD1 LEU 79 HD1 LEU 79 58.608 1.574 1.574
557 HD1 LEU 79 HD1 LEU 79 59.859 1.744 1.744
558 HD2 LEU 79 HD2 LEU 79 60.512 1.001 1.001
559 HD2 LEU 79 HD2 LEU 79 59.701 -0.264 -0.264
560 HD2 LEU 79 HD2 LEU 79 58.953 1.324 1.324
561 H VAL 80 HN VAL 80 63.625 -1.609 -1.609
562 HA VAL 80 HA VAL 80 63.020 -4.213 -4.213
563 HB VAL 80 HB VAL 80 63.237 -3.496 -3.496
564 1HG1 VAL 80 HG11 VAL 80 65.661 -2.556 -2.556
565 2HG1 VAL 80 HG13 VAL 80 66.129 -4.174 -4.174
566 3HG1 VAL 80 HG12 VAL 80 65.297 -3.092 -3.092
567 1HG2 VAL 80 HG21 VAL 80 63.834 -5.946 -5.946
568 2HG2 VAL 80 HG23 VAL 80 63.205 -5.727 -5.727
569 3HG2 VAL 80 HG22 VAL 80 64.947 -5.795 -5.795
570 H MET 81 HN MET 81 65.808 -2.054 -2.054
571 HA MET 81 HA MET 81 67.723 -4.031 -4.031
572 1HB MET 81 HB2 MET 81 67.521 -1.131 -1.131
573 2HB MET 81 HB1 MET 81 68.646 -1.555 -1.555
574 1HG MET 81 HG2 MET 81 69.697 -1.500 -1.500
575 2HG MET 81 HG1 MET 81 69.862 -3.050 -3.050
576 1HE MET 81 HE3 MET 81 69.293 -4.969 -4.969
577 2HE MET 81 HE2 MET 81 68.370 -5.578 -5.578
578 3HE MET 81 HE1 MET 81 69.967 -4.885 -4.885
579 H MET 82 HN MET 82 65.355 -1.927 -1.927
580 HA MET 82 HA MET 82 66.397 -2.251 -2.251
581 1HB MET 82 HB2 MET 82 63.861 -1.090 -1.090
582 2HB MET 82 HB1 MET 82 64.326 -0.932 -0.932
583 1HG MET 82 HG2 MET 82 65.887 0.094 0.094
584 2HG MET 82 HG1 MET 82 65.012 1.075 1.075
585 1HE MET 82 HE2 MET 82 65.297 0.347 0.347
586 2HE MET 82 HE1 MET 82 65.902 -1.302 -1.302
587 3HE MET 82 HE3 MET 82 66.843 -0.081 -0.081
588 H VAL 83 HN VAL 83 63.328 -3.106 -3.106
589 HA VAL 83 HA VAL 83 62.230 -4.726 -4.726
590 HB VAL 83 HB VAL 83 61.028 -3.905 -3.905
591 1HG1 VAL 83 HG12 VAL 83 63.191 -4.350 -4.350
592 2HG1 VAL 83 HG11 VAL 83 62.391 -5.887 -5.887
593 3HG1 VAL 83 HG13 VAL 83 61.595 -4.371 -4.371
594 1HG2 VAL 83 HG22 VAL 83 60.470 -6.189 -6.189
595 2HG2 VAL 83 HG21 VAL 83 59.721 -5.815 -5.815
596 3HG2 VAL 83 HG23 VAL 83 61.113 -6.895 -6.895
597 H ARG 84 HN ARG 84 64.306 -5.706 -5.706
598 HA ARG 84 HA ARG 84 64.338 -8.502 -8.502
599 1HB ARG 84 HB2 ARG 84 66.390 -6.687 -6.687
600 2HB ARG 84 HB1 ARG 84 66.345 -8.445 -8.445
601 1HG ARG 84 HG2 ARG 84 63.897 -6.831 -6.831
602 2HG ARG 84 HG1 ARG 84 65.198 -6.970 -6.970
603 1HD ARG 84 HD2 ARG 84 65.067 -9.475 -9.475
604 2HD ARG 84 HD1 ARG 84 63.638 -9.252 -9.252
605 HE ARG 84 HE ARG 84 63.734 -8.086 -8.086
606 1HH1 ARG 84 HH2 ARG 84 61.386 -7.747 -7.747
607 2HH1 ARG 84 HH2 ARG 84 60.291 -8.949 -8.949
608 1HH2 ARG 84 HH1 ARG 84 62.705 -10.606 -10.606
609 2HH2 ARG 84 HH1 ARG 84 61.038 -10.567 -10.567
610 H GLN 85 HN GLN 85 66.338 -5.800 -5.800
611 HA GLN 85 HA GLN 85 68.187 -7.510 -7.510
612 1HB GLN 85 HB2 GLN 85 68.788 -5.284 -5.284
613 2HB GLN 85 HB1 GLN 85 67.536 -4.544 -4.544
614 1HG GLN 85 HG2 GLN 85 69.586 -4.264 -4.264
615 2HG GLN 85 HG1 GLN 85 68.719 -5.567 -5.567
616 1HE2 GLN 85 HE22 GLN 85 71.458 -7.726 -7.726
617 2HE2 GLN 85 HE21 GLN 85 70.183 -7.180 -7.180
618 H MET 86 HN MET 86 65.213 -5.727 -5.727
619 HA MET 86 HA MET 86 65.333 -6.213 -6.213
620 1HB MET 86 HB2 MET 86 63.824 -4.679 -4.679
621 2HB MET 86 HB1 MET 86 62.719 -5.539 -5.539
622 1HG MET 86 HG2 MET 86 64.322 -4.674 -4.674
623 2HG MET 86 HG1 MET 86 64.798 -3.481 -3.481
624 1HE MET 86 HE3 MET 86 63.492 -3.366 -3.366
625 2HE MET 86 HE2 MET 86 63.694 -1.753 -1.753
626 3HE MET 86 HE1 MET 86 62.132 -2.235 -2.235
627 H LYS 87 HN LYS 87 64.079 -7.832 -7.832
628 HA LYS 87 HA LYS 87 62.008 -9.427 -9.427
629 1HB LYS 87 HB2 LYS 87 64.156 -9.641 -9.641
630 2HB LYS 87 HB1 LYS 87 63.354 -11.151 -11.151
631 1HG LYS 87 HG2 LYS 87 61.522 -8.875 -8.875
632 2HG LYS 87 HG1 LYS 87 62.393 -9.372 -9.372
633 1HD LYS 87 HD2 LYS 87 61.557 -11.745 -11.745
634 2HD LYS 87 HD1 LYS 87 60.165 -10.663 -10.663
635 1HE LYS 87 HE2 LYS 87 61.804 -10.907 -10.907
636 2HE LYS 87 HE1 LYS 87 60.745 -12.265 -12.265
637 1HZ LYS 87 HZ1 LYS 87 59.869 -9.428 -9.428
638 2HZ LYS 87 HZ3 LYS 87 59.627 -10.479 -10.479
639 3HZ LYS 87 HZ2 LYS 87 58.893 -10.805 -10.805
640 H GLU 88 HN GLU 88 65.431 -9.560 -9.560
641 HA GLU 88 HA GLU 88 65.183 -12.171 -12.171
642 1HB GLU 88 HB2 GLU 88 67.372 -10.277 -10.277
643 2HB GLU 88 HB1 GLU 88 67.701 -11.503 -11.503
644 1HG GLU 88 HG2 GLU 88 66.321 -12.874 -12.874
645 2HG GLU 88 HG1 GLU 88 67.434 -11.813 -11.813
646 H ASP 89 HN ASP 89 65.671 -8.724 -8.724
647 HA ASP 89 HA ASP 89 66.025 -9.127 -9.127
648 1HB ASP 89 HB2 ASP 89 66.248 -7.044 -7.044
649 2HB ASP 89 HB1 ASP 89 65.414 -6.445 -6.445
650 H ALA 90 HN ALA 90 63.387 -8.409 -8.409
651 HA ALA 90 HA ALA 90 61.520 -7.519 -7.519
652 1HB ALA 90 HB1 ALA 90 61.731 -7.382 -7.382
653 2HB ALA 90 HB3 ALA 90 60.494 -8.624 -8.624
654 3HB ALA 90 HB2 ALA 90 60.257 -7.025 -7.025
Start of MODEL 4
1 1H ALA 1 HT2 ALA 1 64.533 -7.255 -7.255
2 2H ALA 1 HT1 ALA 1 65.079 -5.805 -5.805
3 3H ALA 1 HT3 ALA 1 66.097 -6.685 -6.685
4 HA ALA 1 HA ALA 1 66.333 -8.446 -8.446
5 1HB ALA 1 HB3 ALA 1 67.567 -6.197 -6.197
6 2HB ALA 1 HB2 ALA 1 66.475 -5.813 -5.813
7 3HB ALA 1 HB1 ALA 1 67.571 -7.189 -7.189
8 H SER 2 HN SER 2 65.913 -8.999 -8.999
9 HA SER 2 HA SER 2 63.011 -8.999 -8.999
10 1HB SER 2 HB2 SER 2 65.286 -10.078 -10.078
11 2HB SER 2 HB1 SER 2 63.601 -10.588 -10.588
12 HG SER 2 HG SER 2 63.823 -11.476 -11.476
13 H MET 3 HN MET 3 65.572 -6.935 -6.935
14 HA MET 3 HA MET 3 64.714 -6.181 -6.181
15 1HB MET 3 HB2 MET 3 66.673 -5.328 -5.328
16 2HB MET 3 HB1 MET 3 66.234 -4.126 -4.126
17 1HG MET 3 HG2 MET 3 66.697 -6.715 -6.715
18 2HG MET 3 HG1 MET 3 68.103 -6.197 -6.197
19 1HE MET 3 HE1 MET 3 68.186 -6.837 -6.837
20 2HE MET 3 HE3 MET 3 68.562 -5.529 -5.529
21 3HE MET 3 HE2 MET 3 66.896 -6.056 -6.056
22 H THR 4 HN THR 4 64.494 -4.576 -4.576
23 HA THR 4 HA THR 4 63.044 -2.290 -2.290
24 HB THR 4 HB THR 4 62.999 -4.107 -4.107
25 HG1 THR 4 HG1 THR 4 64.340 -2.543 -2.543
26 1HG2 THR 4 HG23 THR 4 61.360 -1.705 -1.705
27 2HG2 THR 4 HG22 THR 4 62.071 -1.787 -1.787
28 3HG2 THR 4 HG21 THR 4 61.000 -3.072 -3.072
29 H ASP 5 HN ASP 5 61.947 -5.612 -5.612
30 HA ASP 5 HA ASP 5 59.089 -4.892 -4.892
31 1HB ASP 5 HB2 ASP 5 60.797 -7.211 -7.211
32 2HB ASP 5 HB1 ASP 5 59.466 -7.592 -7.592
33 H GLN 6 HN GLN 6 61.445 -6.364 -6.364
34 HA GLN 6 HA GLN 6 59.800 -6.773 -6.773
35 1HB GLN 6 HB2 GLN 6 62.493 -6.847 -6.847
36 2HB GLN 6 HB1 GLN 6 62.424 -5.601 -5.601
37 1HG GLN 6 HG2 GLN 6 61.146 -8.333 -8.333
38 2HG GLN 6 HG1 GLN 6 62.752 -7.934 -7.934
39 1HE2 GLN 6 HE22 GLN 6 61.463 -6.462 -6.462
40 2HE2 GLN 6 HE21 GLN 6 62.777 -7.185 -7.185
41 H GLN 7 HN GLN 7 60.913 -3.757 -3.757
42 HA GLN 7 HA GLN 7 60.852 -1.925 -1.925
43 1HB GLN 7 HB2 GLN 7 60.499 -1.987 -1.987
44 2HB GLN 7 HB1 GLN 7 59.312 -0.871 -0.871
45 1HG GLN 7 HG2 GLN 7 61.081 0.587 0.587
46 2HG GLN 7 HG1 GLN 7 61.460 -0.125 -0.125
47 1HE2 GLN 7 HE22 GLN 7 64.166 -2.125 -2.125
48 2HE2 GLN 7 HE21 GLN 7 62.955 -2.130 -2.130
49 H ALA 8 HN ALA 8 58.147 -3.764 -3.764
50 HA ALA 8 HA ALA 8 56.118 -2.081 -2.081
51 1HB ALA 8 HB2 ALA 8 56.294 -4.051 -4.051
52 2HB ALA 8 HB1 ALA 8 55.174 -4.659 -4.659
53 3HB ALA 8 HB3 ALA 8 54.886 -3.094 -3.094
54 H GLU 9 HN GLU 9 56.754 -5.597 -5.597
55 HA GLU 9 HA GLU 9 55.462 -6.071 -6.071
56 1HB GLU 9 HB2 GLU 9 56.519 -7.680 -7.680
57 2HB GLU 9 HB1 GLU 9 58.069 -7.326 -7.326
58 1HG GLU 9 HG2 GLU 9 57.573 -8.539 -8.539
59 2HG GLU 9 HG1 GLU 9 55.892 -8.007 -8.007
60 H ALA 10 HN ALA 10 58.760 -4.849 -4.849
61 HA ALA 10 HA ALA 10 59.814 -5.030 -5.030
62 1HB ALA 10 HB1 ALA 10 60.598 -4.046 -4.046
63 2HB ALA 10 HB3 ALA 10 60.288 -2.535 -2.535
64 3HB ALA 10 HB2 ALA 10 61.452 -3.691 -3.691
65 H ARG 11 HN ARG 11 58.508 -1.968 -1.968
66 HA ARG 11 HA ARG 11 58.130 -0.740 -0.740
67 1HB ARG 11 HB2 ARG 11 56.996 0.945 0.945
68 2HB ARG 11 HB1 ARG 11 58.262 0.286 0.286
69 1HG ARG 11 HG2 ARG 11 56.206 -1.411 -1.411
70 2HG ARG 11 HG1 ARG 11 55.325 0.085 0.085
71 1HD ARG 11 HD2 ARG 11 57.760 0.347 0.347
72 2HD ARG 11 HD1 ARG 11 56.372 -0.479 -0.479
73 HE ARG 11 HE ARG 11 55.126 1.642 1.642
74 1HH1 ARG 11 HH1 ARG 11 57.351 1.193 1.193
75 2HH1 ARG 11 HH1 ARG 11 57.589 2.879 2.879
76 1HH2 ARG 11 HH2 ARG 11 55.744 3.928 3.928
77 2HH2 ARG 11 HH2 ARG 11 56.678 4.428 4.428
78 H ALA 12 HN ALA 12 56.160 -3.002 -3.002
79 HA ALA 12 HA ALA 12 53.680 -2.425 -2.425
80 1HB ALA 12 HB2 ALA 12 54.204 -3.498 -3.498
81 2HB ALA 12 HB1 ALA 12 54.291 -4.994 -4.994
82 3HB ALA 12 HB3 ALA 12 52.804 -4.046 -4.046
83 H PHE 13 HN PHE 13 56.523 -4.304 -4.304
84 HA PHE 13 HA PHE 13 55.554 -6.438 -6.438
85 1HB PHE 13 HB2 PHE 13 57.850 -6.351 -6.351
86 2HB PHE 13 HB1 PHE 13 58.039 -4.720 -4.720
87 HD1 PHE 13 HD1 PHE 13 57.074 -8.168 -8.168
88 HD2 PHE 13 HD2 PHE 13 58.967 -4.443 -4.443
89 HE1 PHE 13 HE1 PHE 13 57.763 -9.105 -9.105
90 HE2 PHE 13 HE2 PHE 13 59.656 -5.380 -5.380
91 HZ PHE 13 HZ PHE 13 59.054 -7.711 -7.711
92 H LEU 14 HN LEU 14 56.035 -3.025 -3.025
93 HA LEU 14 HA LEU 14 54.908 -3.587 -3.587
94 1HB LEU 14 HB2 LEU 14 56.093 -1.329 -1.329
95 2HB LEU 14 HB1 LEU 14 57.119 -2.742 -2.742
96 HG LEU 14 HG LEU 14 56.361 -1.244 -1.244
97 HD1 LEU 14 HD1 LEU 14 58.592 0.155 0.155
98 HD1 LEU 14 HD1 LEU 14 57.636 0.043 0.043
99 HD1 LEU 14 HD1 LEU 14 56.939 0.770 0.770
100 HD2 LEU 14 HD2 LEU 14 58.785 -1.688 -1.688
101 HD2 LEU 14 HD2 LEU 14 57.874 -3.152 -3.152
102 HD2 LEU 14 HD2 LEU 14 58.918 -2.433 -2.433
103 H SER 15 HN SER 15 53.467 -1.868 -1.868
104 HA SER 15 HA SER 15 51.581 -0.929 -0.929
105 1HB SER 15 HB2 SER 15 50.861 0.192 0.192
106 2HB SER 15 HB1 SER 15 50.413 -1.432 -1.432
107 HG SER 15 HG SER 15 52.469 -0.587 -0.587
108 H GLU 16 HN GLU 16 50.856 1.432 1.432
109 HA GLU 16 HA GLU 16 52.981 3.203 3.203
110 1HB GLU 16 HB2 GLU 16 50.777 3.611 3.611
111 2HB GLU 16 HB1 GLU 16 50.089 3.542 3.542
112 1HG GLU 16 HG2 GLU 16 51.419 5.587 5.587
113 2HG GLU 16 HG1 GLU 16 51.921 5.690 5.690
114 H GLU 17 HN GLU 17 51.692 2.265 2.265
115 HA GLU 17 HA GLU 17 52.284 4.566 4.566
116 1HB GLU 17 HB2 GLU 17 51.027 2.342 2.342
117 2HB GLU 17 HB1 GLU 17 52.620 1.709 1.709
118 1HG GLU 17 HG2 GLU 17 51.582 2.553 2.553
119 2HG GLU 17 HG1 GLU 17 52.907 3.631 3.631
120 H MET 18 HN MET 18 54.305 1.731 1.731
121 HA MET 18 HA MET 18 56.632 2.815 2.815
122 1HB MET 18 HB2 MET 18 56.045 0.387 0.387
123 2HB MET 18 HB1 MET 18 56.356 0.506 0.506
124 1HG MET 18 HG2 MET 18 58.583 0.350 0.350
125 2HG MET 18 HG1 MET 18 58.557 1.619 1.619
126 1HE MET 18 HE1 MET 18 56.871 1.128 1.128
127 2HE MET 18 HE3 MET 18 56.766 -0.375 -0.375
128 3HE MET 18 HE2 MET 18 58.139 0.708 0.708
129 H ILE 19 HN ILE 19 55.565 2.477 2.477
130 HA ILE 19 HA ILE 19 57.810 3.129 3.129
131 HB ILE 19 HB ILE 19 54.965 4.160 4.160
132 1HG1 ILE 19 HG12 ILE 19 56.460 1.851 1.851
133 2HG1 ILE 19 HG11 ILE 19 55.159 1.729 1.729
134 1HG2 ILE 19 HG21 ILE 19 56.693 5.521 5.521
135 2HG2 ILE 19 HG23 ILE 19 57.047 4.057 4.057
136 3HG2 ILE 19 HG22 ILE 19 55.439 4.778 4.778
137 HD1 ILE 19 HD1 ILE 19 53.622 1.837 1.837
138 HD1 ILE 19 HD1 ILE 19 54.921 1.879 1.879
139 HD1 ILE 19 HD1 ILE 19 54.277 3.385 3.385
140 H ALA 20 HN ALA 20 55.810 5.386 5.386
141 HA ALA 20 HA ALA 20 57.251 7.768 7.768
142 1HB ALA 20 HB1 ALA 20 54.875 7.307 7.307
143 2HB ALA 20 HB3 ALA 20 55.779 7.506 7.506
144 3HB ALA 20 HB2 ALA 20 55.731 8.816 8.816
145 H GLU 21 HN GLU 21 57.660 5.372 5.372
146 HA GLU 21 HA GLU 21 59.397 6.854 6.854
147 1HB GLU 21 HB2 GLU 21 58.351 4.810 4.810
148 2HB GLU 21 HB1 GLU 21 59.039 3.915 3.915
149 1HG GLU 21 HG2 GLU 21 60.888 3.465 3.465
150 2HG GLU 21 HG1 GLU 21 61.167 5.189 5.189
151 H PHE 22 HN PHE 22 60.079 4.741 4.741
152 HA PHE 22 HA PHE 22 62.966 5.028 5.028
153 1HB PHE 22 HB2 PHE 22 61.197 4.193 4.193
154 2HB PHE 22 HB1 PHE 22 62.910 3.825 3.825
155 HD1 PHE 22 HD2 PHE 22 62.288 3.567 3.567
156 HD2 PHE 22 HD1 PHE 22 60.893 1.676 1.676
157 HE1 PHE 22 HE2 PHE 22 61.702 1.535 1.535
158 HE2 PHE 22 HE1 PHE 22 60.308 -0.356 -0.356
159 HZ PHE 22 HZ PHE 22 60.714 -0.427 -0.427
160 H LYS 23 HN LYS 23 60.389 6.818 6.818
161 HA LYS 23 HA LYS 23 61.783 8.189 8.189
162 1HB LYS 23 HB2 LYS 23 59.496 8.824 8.824
163 2HB LYS 23 HB1 LYS 23 60.050 10.032 10.032
164 1HG LYS 23 HG2 LYS 23 59.284 7.197 7.197
165 2HG LYS 23 HG1 LYS 23 58.190 8.577 8.577
166 1HD LYS 23 HD2 LYS 23 60.831 9.005 9.005
167 2HD LYS 23 HD1 LYS 23 59.853 7.756 7.756
168 1HE LYS 23 HE2 LYS 23 58.650 9.383 9.383
169 2HE LYS 23 HE1 LYS 23 58.115 9.947 9.947
170 1HZ LYS 23 HZ3 LYS 23 60.828 10.585 10.585
171 2HZ LYS 23 HZ2 LYS 23 59.514 11.523 11.523
172 3HZ LYS 23 HZ1 LYS 23 59.868 11.413 11.413
173 H ALA 24 HN ALA 24 61.021 9.717 9.717
174 HA ALA 24 HA ALA 24 62.869 11.820 11.820
175 1HB ALA 24 HB1 ALA 24 60.991 11.098 11.098
176 2HB ALA 24 HB3 ALA 24 62.340 10.365 10.365
177 3HB ALA 24 HB2 ALA 24 62.334 12.100 12.100
178 H ALA 25 HN ALA 25 63.379 8.552 8.552
179 HA ALA 25 HA ALA 25 66.084 8.957 8.957
180 1HB ALA 25 HB3 ALA 25 64.480 7.113 7.113
181 2HB ALA 25 HB2 ALA 25 64.739 6.416 6.416
182 3HB ALA 25 HB1 ALA 25 66.080 6.532 6.532
183 H PHE 26 HN PHE 26 64.700 7.824 7.824
184 HA PHE 26 HA PHE 26 67.217 7.146 7.146
185 1HB PHE 26 HB2 PHE 26 65.062 6.287 6.287
186 2HB PHE 26 HB1 PHE 26 64.494 7.923 7.923
187 HD1 PHE 26 HD2 PHE 26 65.473 9.246 9.246
188 HD2 PHE 26 HD1 PHE 26 66.579 5.153 5.153
189 HE1 PHE 26 HE2 PHE 26 66.469 9.133 9.133
190 HE2 PHE 26 HE1 PHE 26 67.575 5.040 5.040
191 HZ PHE 26 HZ PHE 26 67.521 7.030 7.030
192 H ASP 27 HN ASP 27 65.231 10.106 10.106
193 HA ASP 27 HA ASP 27 66.767 11.587 11.587
194 1HB ASP 27 HB2 ASP 27 64.968 12.311 12.311
195 2HB ASP 27 HB1 ASP 27 65.631 13.524 13.524
196 H MET 28 HN MET 28 67.588 10.518 10.518
197 HA MET 28 HA MET 28 69.061 12.636 12.636
198 1HB MET 28 HB2 MET 28 69.410 9.630 9.630
199 2HB MET 28 HB1 MET 28 70.424 10.664 10.664
200 1HG MET 28 HG2 MET 28 67.396 10.682 10.682
201 2HG MET 28 HG1 MET 28 68.404 9.730 9.730
202 1HE MET 28 HE2 MET 28 70.117 10.391 10.391
203 2HE MET 28 HE1 MET 28 70.920 11.948 11.948
204 3HE MET 28 HE3 MET 28 69.875 11.651 11.651
205 H PHE 29 HN PHE 29 69.795 10.660 10.660
206 HA PHE 29 HA PHE 29 72.486 11.986 11.986
207 1HB PHE 29 HB2 PHE 29 71.730 9.378 9.378
208 2HB PHE 29 HB1 PHE 29 73.333 9.958 9.958
209 HD1 PHE 29 HD2 PHE 29 70.198 8.466 8.466
210 HD2 PHE 29 HD1 PHE 29 74.143 9.795 9.795
211 HE1 PHE 29 HE2 PHE 29 70.003 7.305 7.305
212 HE2 PHE 29 HE1 PHE 29 73.949 8.632 8.632
213 HZ PHE 29 HZ PHE 29 71.878 7.387 7.387
214 H ASP 30 HN ASP 30 69.604 12.563 12.563
215 HA ASP 30 HA ASP 30 70.169 12.433 12.433
216 1HB ASP 30 HB2 ASP 30 67.841 12.968 12.968
217 2HB ASP 30 HB1 ASP 30 67.961 11.848 11.848
218 H ALA 31 HN ALA 31 71.986 14.132 14.132
219 HA ALA 31 HA ALA 31 71.001 16.897 16.897
220 1HB ALA 31 HB3 ALA 31 73.594 15.442 15.442
221 2HB ALA 31 HB2 ALA 31 73.613 17.188 17.188
222 3HB ALA 31 HB1 ALA 31 72.712 16.495 16.495
223 H ASP 32 HN ASP 32 72.371 14.664 14.664
224 HA ASP 32 HA ASP 32 72.659 16.904 16.904
225 1HB ASP 32 HB2 ASP 32 74.368 14.542 14.542
226 2HB ASP 32 HB1 ASP 32 74.387 15.130 15.130
227 H GLY 33 HN GLY 33 70.681 14.450 14.450
228 1HA GLY 33 HA2 GLY 33 70.107 13.819 13.819
229 2HA GLY 33 HA1 GLY 33 70.080 12.547 12.547
230 H GLY 34 HN GLY 34 68.834 13.960 13.960
231 1HA GLY 34 HA2 GLY 34 66.755 14.937 14.937
232 2HA GLY 34 HA1 GLY 34 66.306 15.043 15.043
233 H GLY 35 HN GLY 35 66.417 12.544 12.544
234 1HA GLY 35 HA2 GLY 35 64.634 10.986 10.986
235 2HA GLY 35 HA1 GLY 35 64.405 11.034 11.034
236 H ASP 36 HN ASP 36 67.652 11.034 11.034
237 HA ASP 36 HA ASP 36 68.004 8.135 8.135
238 1HB ASP 36 HB2 ASP 36 69.080 7.987 7.987
239 2HB ASP 36 HB1 ASP 36 67.321 8.110 8.110
240 H ILE 37 HN ILE 37 70.016 7.815 7.815
241 HA ILE 37 HA ILE 37 71.943 10.098 10.098
242 HB ILE 37 HB ILE 37 71.958 7.650 7.650
243 1HG1 ILE 37 HG12 ILE 37 70.855 9.885 9.885
244 2HG1 ILE 37 HG11 ILE 37 69.962 9.717 9.717
245 1HG2 ILE 37 HG22 ILE 37 73.276 10.331 10.331
246 2HG2 ILE 37 HG21 ILE 37 72.878 9.646 9.646
247 3HG2 ILE 37 HG23 ILE 37 73.937 8.766 8.766
248 HD1 ILE 37 HD1 ILE 37 70.481 7.460 7.460
249 HD1 ILE 37 HD1 ILE 37 69.510 7.366 7.366
250 HD1 ILE 37 HD1 ILE 37 68.970 8.361 8.361
251 H SER 38 HN SER 38 74.319 9.338 9.338
252 HA SER 38 HA SER 38 75.028 7.961 7.961
253 1HB SER 38 HB2 SER 38 76.360 9.486 9.486
254 2HB SER 38 HB1 SER 38 76.691 8.011 8.011
255 HG SER 38 HG SER 38 78.094 7.499 7.499
256 H THR 39 HN THR 39 75.103 5.795 5.795
257 HA THR 39 HA THR 39 73.955 3.731 3.731
258 HB THR 39 HB THR 39 75.522 2.275 2.275
259 HG1 THR 39 HG1 THR 39 76.515 4.737 4.737
260 1HG2 THR 39 HG23 THR 39 73.989 4.582 4.582
261 2HG2 THR 39 HG22 THR 39 74.846 3.466 3.466
262 3HG2 THR 39 HG21 THR 39 73.579 2.867 2.867
263 H LYS 40 HN LYS 40 77.122 5.162 5.162
264 HA LYS 40 HA LYS 40 78.203 3.049 3.049
265 1HB LYS 40 HB2 LYS 40 78.850 5.742 5.742
266 2HB LYS 40 HB1 LYS 40 79.382 5.475 5.475
267 1HG LYS 40 HG2 LYS 40 79.941 3.493 3.493
268 2HG LYS 40 HG1 LYS 40 81.046 4.812 4.812
269 1HD LYS 40 HD2 LYS 40 80.654 3.834 3.834
270 2HD LYS 40 HD1 LYS 40 80.408 2.355 2.355
271 1HE LYS 40 HE2 LYS 40 82.593 2.445 2.445
272 2HE LYS 40 HE1 LYS 40 82.809 4.142 4.142
273 1HZ LYS 40 HZ3 LYS 40 82.580 3.448 3.448
274 2HZ LYS 40 HZ2 LYS 40 82.505 1.825 1.825
275 3HZ LYS 40 HZ1 LYS 40 83.922 2.727 2.727
276 H GLU 41 HN GLU 41 75.748 5.366 5.366
277 HA GLU 41 HA GLU 41 76.144 5.337 5.337
278 1HB GLU 41 HB2 GLU 41 75.812 7.452 7.452
279 2HB GLU 41 HB1 GLU 41 74.159 6.903 6.903
280 1HG GLU 41 HG2 GLU 41 73.649 7.960 7.960
281 2HG GLU 41 HG1 GLU 41 74.472 6.624 6.624
282 H LEU 42 HN LEU 42 74.138 4.060 4.060
283 HA LEU 42 HA LEU 42 71.661 3.569 3.569
284 1HB LEU 42 HB2 LEU 42 72.499 2.832 2.832
285 2HB LEU 42 HB1 LEU 42 73.445 1.572 1.572
286 HG LEU 42 HG LEU 42 70.567 1.666 1.666
287 HD1 LEU 42 HD1 LEU 42 70.951 2.052 2.052
288 HD1 LEU 42 HD1 LEU 42 69.707 0.946 0.946
289 HD1 LEU 42 HD1 LEU 42 71.258 0.316 0.316
290 HD2 LEU 42 HD2 LEU 42 72.256 -0.663 -0.663
291 HD2 LEU 42 HD2 LEU 42 70.850 -0.688 -0.688
292 HD2 LEU 42 HD2 LEU 42 72.381 -0.029 -0.029
293 H GLY 43 HN GLY 43 74.693 1.859 1.859
294 1HA GLY 43 HA2 GLY 43 73.540 -0.117 -0.117
295 2HA GLY 43 HA1 GLY 43 75.224 0.410 0.410
296 H THR 44 HN THR 44 74.899 3.111 3.111
297 HA THR 44 HA THR 44 74.656 3.096 3.096
298 HB THR 44 HB THR 44 74.618 5.147 5.147
299 HG1 THR 44 HG1 THR 44 76.532 4.095 4.095
300 1HG2 THR 44 HG23 THR 44 73.993 5.618 5.618
301 2HG2 THR 44 HG22 THR 44 74.754 6.868 6.868
302 3HG2 THR 44 HG21 THR 44 73.160 6.249 6.249
303 H VAL 45 HN VAL 45 72.324 4.432 4.432
304 HA VAL 45 HA VAL 45 70.251 5.138 5.138
305 HB VAL 45 HB VAL 45 70.110 3.859 3.859
306 1HG1 VAL 45 HG11 VAL 45 68.133 5.246 5.246
307 2HG1 VAL 45 HG13 VAL 45 68.085 5.612 5.612
308 3HG1 VAL 45 HG12 VAL 45 67.880 3.950 3.950
309 1HG2 VAL 45 HG21 VAL 45 71.341 6.251 6.251
310 2HG2 VAL 45 HG23 VAL 45 71.003 5.768 5.768
311 3HG2 VAL 45 HG22 VAL 45 69.830 6.736 6.736
312 H MET 46 HN MET 46 70.330 2.030 2.030
313 HA MET 46 HA MET 46 68.227 0.790 0.790
314 1HB MET 46 HB2 MET 46 69.115 -1.257 -1.257
315 2HB MET 46 HB1 MET 46 69.136 0.082 0.082
316 1HG MET 46 HG2 MET 46 71.545 0.497 0.497
317 2HG MET 46 HG1 MET 46 71.468 -1.048 -1.048
318 1HE MET 46 HE1 MET 46 69.143 -2.108 -2.108
319 2HE MET 46 HE3 MET 46 70.123 -3.244 -3.244
320 3HE MET 46 HE2 MET 46 70.277 -3.182 -3.182
321 H ARG 47 HN ARG 47 71.742 0.841 0.841
322 HA ARG 47 HA ARG 47 71.658 -1.077 -1.077
323 1HB ARG 47 HB2 ARG 47 73.626 -0.575 -0.575
324 2HB ARG 47 HB1 ARG 47 73.694 1.047 1.047
325 1HG ARG 47 HG2 ARG 47 73.718 -1.349 -1.349
326 2HG ARG 47 HG1 ARG 47 75.205 -0.835 -0.835
327 1HD ARG 47 HD2 ARG 47 74.558 1.549 1.549
328 2HD ARG 47 HD1 ARG 47 73.559 0.634 0.634
329 HE ARG 47 HE ARG 47 76.189 -0.534 -0.534
330 1HH1 ARG 47 HH2 ARG 47 74.729 -0.189 -0.189
331 2HH1 ARG 47 HH2 ARG 47 75.647 1.051 1.051
332 1HH2 ARG 47 HH1 ARG 47 77.252 2.069 2.069
333 2HH2 ARG 47 HH1 ARG 47 77.075 2.330 2.330
334 H MET 48 HN MET 48 71.792 2.487 2.487
335 HA MET 48 HA MET 48 71.899 2.922 2.922
336 1HB MET 48 HB2 MET 48 72.563 4.484 4.484
337 2HB MET 48 HB1 MET 48 70.847 4.726 4.726
338 1HG MET 48 HG2 MET 48 71.305 6.508 6.508
339 2HG MET 48 HG1 MET 48 70.717 5.284 5.284
340 1HE MET 48 HE1 MET 48 71.711 7.282 7.282
341 2HE MET 48 HE3 MET 48 73.180 7.000 7.000
342 3HE MET 48 HE2 MET 48 73.253 7.938 7.938
343 H LEU 49 HN LEU 49 69.391 1.783 1.783
344 HA LEU 49 HA LEU 49 67.178 3.066 3.066
345 1HB LEU 49 HB2 LEU 49 67.556 1.074 1.074
346 2HB LEU 49 HB1 LEU 49 65.975 1.207 1.207
347 HG LEU 49 HG LEU 49 67.437 3.660 3.660
348 HD1 LEU 49 HD1 LEU 49 66.937 3.258 3.258
349 HD1 LEU 49 HD1 LEU 49 65.325 2.665 2.665
350 HD1 LEU 49 HD1 LEU 49 66.711 1.576 1.576
351 HD2 LEU 49 HD2 LEU 49 64.713 3.966 3.966
352 HD2 LEU 49 HD2 LEU 49 65.622 4.522 4.522
353 HD2 LEU 49 HD2 LEU 49 64.800 2.963 2.963
354 H GLY 50 HN GLY 50 69.038 0.098 0.098
355 1HA GLY 50 HA2 GLY 50 68.686 -0.730 -0.730
356 2HA GLY 50 HA1 GLY 50 67.077 -1.098 -1.098
357 H GLN 51 HN GLN 51 68.723 -1.566 -1.566
358 HA GLN 51 HA GLN 51 69.018 -4.474 -4.474
359 1HB GLN 51 HB2 GLN 51 69.367 -2.899 -2.899
360 2HB GLN 51 HB1 GLN 51 68.954 -4.606 -4.606
361 1HG GLN 51 HG2 GLN 51 66.769 -4.100 -4.100
362 2HG GLN 51 HG1 GLN 51 67.044 -3.038 -3.038
363 1HE2 GLN 51 HE22 GLN 51 67.379 -1.269 -1.269
364 2HE2 GLN 51 HE21 GLN 51 68.011 -2.827 -2.827
365 H ASN 52 HN ASN 52 70.973 -5.172 -5.172
366 HA ASN 52 HA ASN 52 73.408 -3.576 -3.576
367 1HB ASN 52 HB2 ASN 52 72.672 -5.164 -5.164
368 2HB ASN 52 HB1 ASN 52 73.524 -6.361 -6.361
369 HD2 ASN 52 HD2 ASN 52 74.994 -6.156 -6.156
370 HD2 ASN 52 HD2 ASN 52 76.244 -5.011 -5.011
371 HA PRO 53 HA PRO 53 73.370 -6.180 -6.180
372 1HB PRO 53 HB2 PRO 53 74.333 -4.215 -4.215
373 2HB PRO 53 HB1 PRO 53 72.606 -4.408 -4.408
374 1HG PRO 53 HG2 PRO 53 74.578 -2.487 -2.487
375 2HG PRO 53 HG1 PRO 53 72.873 -2.246 -2.246
376 1HD PRO 53 HD2 PRO 53 73.773 -2.624 -2.624
377 2HD PRO 53 HD1 PRO 53 72.137 -3.058 -3.058
378 H THR 54 HN THR 54 75.161 -7.466 -7.466
379 HA THR 54 HA THR 54 77.708 -6.912 -6.912
380 HB THR 54 HB THR 54 78.222 -8.812 -8.812
381 HG1 THR 54 HG1 THR 54 75.535 -9.319 -9.319
382 1HG2 THR 54 HG23 THR 54 77.975 -8.843 -8.843
383 2HG2 THR 54 HG22 THR 54 76.398 -9.549 -9.549
384 3HG2 THR 54 HG21 THR 54 77.868 -10.351 -10.351
385 H LYS 55 HN LYS 55 79.609 -6.069 -6.069
386 HA LYS 55 HA LYS 55 79.628 -4.060 -4.060
387 1HB LYS 55 HB2 LYS 55 81.465 -5.153 -5.153
388 2HB LYS 55 HB1 LYS 55 81.871 -6.062 -6.062
389 1HG LYS 55 HG2 LYS 55 82.887 -4.275 -4.275
390 2HG LYS 55 HG1 LYS 55 81.483 -3.252 -3.252
391 1HD LYS 55 HD2 LYS 55 82.413 -2.349 -2.349
392 2HD LYS 55 HD1 LYS 55 82.977 -3.916 -3.916
393 1HE LYS 55 HE2 LYS 55 84.410 -2.912 -2.912
394 2HE LYS 55 HE1 LYS 55 84.655 -1.958 -1.958
395 1HZ LYS 55 HZ1 LYS 55 84.631 -4.848 -4.848
396 2HZ LYS 55 HZ3 LYS 55 85.975 -4.214 -4.214
397 3HZ LYS 55 HZ2 LYS 55 85.608 -3.679 -3.679
398 H GLU 56 HN GLU 56 80.415 -7.486 -7.486
399 HA GLU 56 HA GLU 56 80.760 -7.354 -7.354
400 1HB GLU 56 HB2 GLU 56 80.784 -9.318 -9.318
401 2HB GLU 56 HB1 GLU 56 79.073 -9.485 -9.485
402 1HG GLU 56 HG2 GLU 56 79.502 -10.328 -10.328
403 2HG GLU 56 HG1 GLU 56 80.845 -9.218 -9.218
404 H GLU 57 HN GLU 57 77.613 -7.902 -7.902
405 HA GLU 57 HA GLU 57 75.911 -7.894 -7.894
406 1HB GLU 57 HB2 GLU 57 75.611 -6.731 -6.731
407 2HB GLU 57 HB1 GLU 57 74.256 -6.935 -6.935
408 1HG GLU 57 HG2 GLU 57 76.085 -9.236 -9.236
409 2HG GLU 57 HG1 GLU 57 74.692 -8.838 -8.838
410 H LEU 58 HN LEU 58 76.673 -4.992 -4.992
411 HA LEU 58 HA LEU 58 75.469 -3.007 -3.007
412 1HB LEU 58 HB2 LEU 58 78.245 -2.967 -2.967
413 2HB LEU 58 HB1 LEU 58 77.250 -1.550 -1.550
414 HG LEU 58 HG LEU 58 76.722 -3.756 -3.756
415 HD1 LEU 58 HD1 LEU 58 77.499 -2.240 -2.240
416 HD1 LEU 58 HD1 LEU 58 76.290 -1.076 -1.076
417 HD1 LEU 58 HD1 LEU 58 77.862 -1.150 -1.150
418 HD2 LEU 58 HD2 LEU 58 74.622 -2.128 -2.128
419 HD2 LEU 58 HD2 LEU 58 74.554 -3.496 -3.496
420 HD2 LEU 58 HD2 LEU 58 74.854 -1.872 -1.872
421 H ASP 59 HN ASP 59 78.825 -4.177 -4.177
422 HA ASP 59 HA ASP 59 79.343 -2.704 -2.704
423 1HB ASP 59 HB2 ASP 59 80.487 -4.815 -4.815
424 2HB ASP 59 HB1 ASP 59 80.656 -5.221 -5.221
425 H ALA 60 HN ALA 60 77.489 -5.635 -5.635
426 HA ALA 60 HA ALA 60 77.452 -6.458 -6.458
427 1HB ALA 60 HB2 ALA 60 75.817 -7.185 -7.185
428 2HB ALA 60 HB1 ALA 60 75.698 -8.023 -8.023
429 3HB ALA 60 HB3 ALA 60 77.207 -8.062 -8.062
430 H ILE 61 HN ILE 61 75.023 -5.002 -5.002
431 HA ILE 61 HA ILE 61 73.009 -4.621 -4.621
432 HB ILE 61 HB ILE 61 73.657 -3.442 -3.442
433 1HG1 ILE 61 HG12 ILE 61 71.456 -4.607 -4.607
434 2HG1 ILE 61 HG11 ILE 61 71.519 -5.271 -5.271
435 1HG2 ILE 61 HG23 ILE 61 71.517 -2.608 -2.608
436 2HG2 ILE 61 HG22 ILE 61 71.246 -2.482 -2.482
437 3HG2 ILE 61 HG21 ILE 61 72.568 -1.590 -1.590
438 HD1 ILE 61 HD1 ILE 61 72.492 -6.728 -6.728
439 HD1 ILE 61 HD1 ILE 61 73.827 -5.577 -5.577
440 HD1 ILE 61 HD1 ILE 61 73.495 -6.500 -6.500
441 H ILE 62 HN ILE 62 75.374 -2.303 -2.303
442 HA ILE 62 HA ILE 62 74.794 -0.003 -0.003
443 HB ILE 62 HB ILE 62 77.464 -1.278 -1.278
444 1HG1 ILE 62 HG12 ILE 62 76.050 0.980 0.980
445 2HG1 ILE 62 HG11 ILE 62 75.725 -0.707 -0.707
446 1HG2 ILE 62 HG21 ILE 62 76.844 1.108 1.108
447 2HG2 ILE 62 HG23 ILE 62 77.669 1.536 1.536
448 3HG2 ILE 62 HG22 ILE 62 78.421 0.411 0.411
449 HD1 ILE 62 HD1 ILE 62 77.661 -0.901 -0.901
450 HD1 ILE 62 HD1 ILE 62 77.803 0.853 0.853
451 HD1 ILE 62 HD1 ILE 62 78.584 -0.179 -0.179
452 H GLU 63 HN GLU 63 77.421 -2.158 -2.158
453 HA GLU 63 HA GLU 63 77.662 -1.260 -1.260
454 1HB GLU 63 HB2 GLU 63 78.710 -3.252 -3.252
455 2HB GLU 63 HB1 GLU 63 77.645 -4.211 -4.211
456 1HG GLU 63 HG2 GLU 63 79.592 -4.143 -4.143
457 2HG GLU 63 HG1 GLU 63 78.690 -2.775 -2.775
458 H GLU 64 HN GLU 64 75.273 -3.583 -3.583
459 HA GLU 64 HA GLU 64 74.051 -4.241 -4.241
460 1HB GLU 64 HB2 GLU 64 73.610 -5.657 -5.657
461 2HB GLU 64 HB1 GLU 64 73.295 -4.306 -4.306
462 1HG GLU 64 HG2 GLU 64 71.210 -5.513 -5.513
463 2HG GLU 64 HG1 GLU 64 71.195 -3.819 -3.819
464 H VAL 65 HN VAL 65 73.258 -1.775 -1.775
465 HA VAL 65 HA VAL 65 71.157 -0.639 -0.639
466 HB VAL 65 HB VAL 65 70.607 0.640 0.640
467 1HG1 VAL 65 HG11 VAL 65 70.015 -1.800 -1.800
468 2HG1 VAL 65 HG13 VAL 65 71.487 -2.128 -2.128
469 3HG1 VAL 65 HG12 VAL 65 70.201 -1.156 -1.156
470 1HG2 VAL 65 HG21 VAL 65 73.267 -0.385 -0.385
471 2HG2 VAL 65 HG23 VAL 65 72.858 1.291 1.291
472 3HG2 VAL 65 HG22 VAL 65 72.075 0.466 0.466
473 H ASP 66 HN ASP 66 74.428 -0.388 -0.388
474 HA ASP 66 HA ASP 66 74.534 2.572 2.572
475 1HB ASP 66 HB2 ASP 66 76.135 1.539 1.539
476 2HB ASP 66 HB1 ASP 66 76.624 0.388 0.388
477 H GLU 67 HN GLU 67 75.477 -0.433 -0.433
478 HA GLU 67 HA GLU 67 76.405 0.829 0.829
479 1HB GLU 67 HB2 GLU 67 75.175 -1.905 -1.905
480 2HB GLU 67 HB1 GLU 67 76.177 -1.462 -1.462
481 1HG GLU 67 HG2 GLU 67 78.113 -1.222 -1.222
482 2HG GLU 67 HG1 GLU 67 77.182 -1.104 -1.104
483 H ASP 68 HN ASP 68 73.262 0.569 0.569
484 HA ASP 68 HA ASP 68 71.754 0.292 0.292
485 1HB ASP 68 HB2 ASP 68 71.146 -0.049 -0.049
486 2HB ASP 68 HB1 ASP 68 70.794 1.679 1.679
487 H GLY 69 HN GLY 69 73.708 2.782 2.782
488 1HA GLY 69 HA2 GLY 69 74.042 4.826 4.826
489 2HA GLY 69 HA1 GLY 69 72.382 4.704 4.704
490 H SER 70 HN SER 70 72.695 4.034 4.034
491 HA SER 70 HA SER 70 71.803 6.821 6.821
492 1HB SER 70 HB2 SER 70 70.906 4.115 4.115
493 2HB SER 70 HB1 SER 70 70.372 5.654 5.654
494 HG SER 70 HG SER 70 69.704 4.396 4.396
495 H GLY 71 HN GLY 71 73.973 7.405 7.405
496 1HA GLY 71 HA2 GLY 71 75.737 5.996 5.996
497 2HA GLY 71 HA1 GLY 71 75.546 7.747 7.747
498 H THR 72 HN THR 72 72.643 7.347 7.347
499 HA THR 72 HA THR 72 73.144 6.580 6.580
500 HB THR 72 HB THR 72 71.422 8.289 8.289
501 HG1 THR 72 HG1 THR 72 71.506 9.091 9.091
502 1HG2 THR 72 HG21 THR 72 73.874 8.938 8.938
503 2HG2 THR 72 HG23 THR 72 72.752 10.252 10.252
504 3HG2 THR 72 HG22 THR 72 73.473 9.336 9.336
505 H ILE 73 HN ILE 73 71.068 5.838 5.838
506 HA ILE 73 HA ILE 73 69.576 4.008 4.008
507 HB ILE 73 HB ILE 73 70.925 3.233 3.233
508 1HG1 ILE 73 HG12 ILE 73 68.673 1.995 1.995
509 2HG1 ILE 73 HG11 ILE 73 68.107 2.594 2.594
510 1HG2 ILE 73 HG21 ILE 73 69.764 5.294 5.294
511 2HG2 ILE 73 HG23 ILE 73 68.629 4.015 4.015
512 3HG2 ILE 73 HG22 ILE 73 70.337 3.851 3.851
513 HD1 ILE 73 HD1 ILE 73 70.109 0.502 0.502
514 HD1 ILE 73 HD1 ILE 73 70.559 1.617 1.617
515 HD1 ILE 73 HD1 ILE 73 69.063 0.690 0.690
516 H ASP 74 HN ASP 74 67.323 4.133 4.133
517 HA ASP 74 HA ASP 74 66.053 6.602 6.602
518 1HB ASP 74 HB2 ASP 74 65.437 4.296 4.296
519 2HB ASP 74 HB1 ASP 74 64.079 5.234 5.234
520 H PHE 75 HN PHE 75 64.549 6.730 6.730
521 HA PHE 75 HA PHE 75 64.538 4.935 4.935
522 1HB PHE 75 HB2 PHE 75 63.664 7.284 7.284
523 2HB PHE 75 HB1 PHE 75 62.254 6.688 6.688
524 HD1 PHE 75 HD2 PHE 75 60.897 4.772 4.772
525 HD2 PHE 75 HD1 PHE 75 63.682 7.264 7.264
526 HE1 PHE 75 HE2 PHE 75 59.821 4.151 4.151
527 HE2 PHE 75 HE1 PHE 75 62.606 6.643 6.643
528 HZ PHE 75 HZ PHE 75 60.676 5.086 5.086
529 H GLU 76 HN GLU 76 62.083 5.151 5.151
530 HA GLU 76 HA GLU 76 60.430 3.010 3.010
531 1HB GLU 76 HB2 GLU 76 59.883 2.943 2.943
532 2HB GLU 76 HB1 GLU 76 59.943 4.589 4.589
533 1HG GLU 76 HG2 GLU 76 62.339 4.713 4.713
534 2HG GLU 76 HG1 GLU 76 62.095 3.159 3.159
535 H GLU 77 HN GLU 77 63.390 2.929 2.929
536 HA GLU 77 HA GLU 77 63.296 0.009 0.009
537 1HB GLU 77 HB2 GLU 77 64.186 1.408 1.408
538 2HB GLU 77 HB1 GLU 77 65.338 2.152 2.152
539 1HG GLU 77 HG2 GLU 77 66.638 0.201 0.201
540 2HG GLU 77 HG1 GLU 77 65.328 -0.830 -0.830
541 H PHE 78 HN PHE 78 64.677 2.333 2.333
542 HA PHE 78 HA PHE 78 66.762 0.618 0.618
543 1HB PHE 78 HB2 PHE 78 67.067 2.926 2.926
544 2HB PHE 78 HB1 PHE 78 65.378 3.190 3.190
545 HD1 PHE 78 HD1 PHE 78 68.487 1.486 1.486
546 HD2 PHE 78 HD2 PHE 78 64.742 3.309 3.309
547 HE1 PHE 78 HE1 PHE 78 69.066 1.293 1.293
548 HE2 PHE 78 HE2 PHE 78 65.320 3.115 3.115
549 HZ PHE 78 HZ PHE 78 67.482 2.107 2.107
550 H LEU 79 HN LEU 79 63.350 1.188 1.188
551 HA LEU 79 HA LEU 79 63.018 0.177 0.177
552 1HB LEU 79 HB2 LEU 79 61.486 0.002 0.002
553 2HB LEU 79 HB1 LEU 79 60.886 -0.889 -0.889
554 HG LEU 79 HG LEU 79 61.699 1.960 1.960
555 HD1 LEU 79 HD1 LEU 79 60.071 2.851 2.851
556 HD1 LEU 79 HD1 LEU 79 58.879 1.707 1.707
557 HD1 LEU 79 HD1 LEU 79 59.902 1.265 1.265
558 HD2 LEU 79 HD2 LEU 79 59.214 0.664 0.664
559 HD2 LEU 79 HD2 LEU 79 60.291 1.820 1.820
560 HD2 LEU 79 HD2 LEU 79 60.767 0.127 0.127
561 H VAL 80 HN VAL 80 63.724 -1.669 -1.669
562 HA VAL 80 HA VAL 80 63.313 -4.286 -4.286
563 HB VAL 80 HB VAL 80 64.474 -5.005 -5.005
564 1HG1 VAL 80 HG13 VAL 80 62.512 -2.760 -2.760
565 2HG1 VAL 80 HG12 VAL 80 63.282 -3.228 -3.228
566 3HG1 VAL 80 HG11 VAL 80 62.359 -4.415 -4.415
567 1HG2 VAL 80 HG21 VAL 80 65.594 -2.255 -2.255
568 2HG2 VAL 80 HG23 VAL 80 66.363 -3.740 -3.740
569 3HG2 VAL 80 HG22 VAL 80 65.274 -2.851 -2.851
570 H MET 81 HN MET 81 66.015 -2.026 -2.026
571 HA MET 81 HA MET 81 68.006 -3.958 -3.958
572 1HB MET 81 HB2 MET 81 67.966 -0.928 -0.928
573 2HB MET 81 HB1 MET 81 69.393 -1.967 -1.967
574 1HG MET 81 HG2 MET 81 67.427 -1.562 -1.562
575 2HG MET 81 HG1 MET 81 69.119 -1.066 -1.066
576 1HE MET 81 HE1 MET 81 69.170 -1.946 -1.946
577 2HE MET 81 HE3 MET 81 69.643 -3.599 -3.599
578 3HE MET 81 HE2 MET 81 67.938 -3.165 -3.165
579 H MET 82 HN MET 82 66.054 -1.424 -1.424
580 HA MET 82 HA MET 82 67.127 -1.999 -1.999
581 1HB MET 82 HB2 MET 82 65.185 -0.440 -0.440
582 2HB MET 82 HB1 MET 82 66.394 0.227 0.227
583 1HG MET 82 HG2 MET 82 64.872 0.476 0.476
584 2HG MET 82 HG1 MET 82 64.294 -1.177 -1.177
585 1HE MET 82 HE2 MET 82 64.855 1.776 1.776
586 2HE MET 82 HE1 MET 82 63.447 2.716 2.716
587 3HE MET 82 HE3 MET 82 63.482 1.928 1.928
588 H VAL 83 HN VAL 83 64.351 -3.036 -3.036
589 HA VAL 83 HA VAL 83 62.972 -4.233 -4.233
590 HB VAL 83 HB VAL 83 62.571 -4.336 -4.336
591 1HG1 VAL 83 HG11 VAL 83 61.396 -5.899 -5.899
592 2HG1 VAL 83 HG13 VAL 83 60.172 -4.791 -4.791
593 3HG1 VAL 83 HG12 VAL 83 60.997 -5.899 -5.899
594 1HG2 VAL 83 HG21 VAL 83 62.347 -2.175 -2.175
595 2HG2 VAL 83 HG23 VAL 83 61.289 -2.444 -2.444
596 3HG2 VAL 83 HG22 VAL 83 60.746 -2.882 -2.882
597 H ARG 84 HN ARG 84 64.206 -5.658 -5.658
598 HA ARG 84 HA ARG 84 64.093 -8.348 -8.348
599 1HB ARG 84 HB2 ARG 84 66.296 -6.750 -6.750
600 2HB ARG 84 HB1 ARG 84 66.156 -8.506 -8.506
601 1HG ARG 84 HG2 ARG 84 63.777 -8.134 -8.134
602 2HG ARG 84 HG1 ARG 84 64.200 -6.429 -6.429
603 1HD ARG 84 HD2 ARG 84 64.827 -7.124 -7.124
604 2HD ARG 84 HD1 ARG 84 66.327 -7.554 -7.554
605 HE ARG 84 HE ARG 84 64.105 -9.543 -9.543
606 1HH1 ARG 84 HH1 ARG 84 67.120 -9.628 -9.628
607 2HH1 ARG 84 HH1 ARG 84 67.778 -10.698 -10.698
608 1HH2 ARG 84 HH2 ARG 84 65.041 -10.454 -10.454
609 2HH2 ARG 84 HH2 ARG 84 66.602 -11.166 -11.166
610 H GLN 85 HN GLN 85 66.343 -5.976 -5.976
611 HA GLN 85 HA GLN 85 67.984 -8.015 -8.015
612 1HB GLN 85 HB2 GLN 85 68.953 -5.929 -5.929
613 2HB GLN 85 HB1 GLN 85 67.856 -4.983 -4.983
614 1HG GLN 85 HG2 GLN 85 69.925 -5.056 -5.056
615 2HG GLN 85 HG1 GLN 85 68.862 -6.205 -6.205
616 1HE2 GLN 85 HE22 GLN 85 71.943 -7.683 -7.683
617 2HE2 GLN 85 HE21 GLN 85 71.316 -6.146 -6.146
618 H MET 86 HN MET 86 65.308 -5.845 -5.845
619 HA MET 86 HA MET 86 65.463 -6.264 -6.264
620 1HB MET 86 HB2 MET 86 64.068 -4.623 -4.623
621 2HB MET 86 HB1 MET 86 62.931 -5.285 -5.285
622 1HG MET 86 HG2 MET 86 65.023 -4.550 -4.550
623 2HG MET 86 HG1 MET 86 65.073 -3.296 -3.296
624 1HE MET 86 HE3 MET 86 62.669 -3.166 -3.166
625 2HE MET 86 HE2 MET 86 61.192 -2.795 -2.795
626 3HE MET 86 HE1 MET 86 62.449 -1.571 -1.571
627 H LYS 87 HN LYS 87 63.825 -7.744 -7.744
628 HA LYS 87 HA LYS 87 61.651 -9.048 -9.048
629 1HB LYS 87 HB2 LYS 87 63.606 -9.595 -9.595
630 2HB LYS 87 HB1 LYS 87 62.593 -10.947 -10.947
631 1HG LYS 87 HG2 LYS 87 60.899 -8.677 -8.677
632 2HG LYS 87 HG1 LYS 87 61.877 -8.691 -8.691
633 1HD LYS 87 HD2 LYS 87 61.228 -11.344 -11.344
634 2HD LYS 87 HD1 LYS 87 59.774 -10.564 -10.564
635 1HE LYS 87 HE2 LYS 87 59.756 -9.117 -9.117
636 2HE LYS 87 HE1 LYS 87 61.062 -10.134 -10.134
637 1HZ LYS 87 HZ2 LYS 87 58.581 -11.304 -11.304
638 2HZ LYS 87 HZ1 LYS 87 58.688 -10.847 -10.847
639 3HZ LYS 87 HZ3 LYS 87 59.732 -12.033 -12.033
640 H GLU 88 HN GLU 88 65.071 -9.617 -9.617
641 HA GLU 88 HA GLU 88 64.560 -12.113 -12.113
642 1HB GLU 88 HB2 GLU 88 66.657 -10.991 -10.991
643 2HB GLU 88 HB1 GLU 88 67.302 -11.387 -11.387
644 1HG GLU 88 HG2 GLU 88 67.165 -13.606 -13.606
645 2HG GLU 88 HG1 GLU 88 65.517 -13.466 -13.466
646 H ASP 89 HN ASP 89 65.812 -8.805 -8.805
647 HA ASP 89 HA ASP 89 66.521 -9.106 -9.106
648 1HB ASP 89 HB2 ASP 89 67.155 -7.407 -7.407
649 2HB ASP 89 HB1 ASP 89 65.962 -6.436 -6.436
650 H ALA 90 HN ALA 90 63.673 -8.091 -8.091
651 HA ALA 90 HA ALA 90 62.273 -6.769 -6.769
652 1HB ALA 90 HB2 ALA 90 61.376 -8.275 -8.275
653 2HB ALA 90 HB1 ALA 90 60.305 -7.274 -7.274
654 3HB ALA 90 HB3 ALA 90 61.666 -6.541 -6.541
Start of MODEL 5
1 1H ALA 1 HT1 ALA 1 63.769 -3.295 -3.295
2 2H ALA 1 HT3 ALA 1 64.971 -2.637 -2.637
3 3H ALA 1 HT2 ALA 1 65.340 -3.059 -3.059
4 HA ALA 1 HA ALA 1 65.428 -5.300 -5.300
5 1HB ALA 1 HB2 ALA 1 66.123 -3.801 -3.801
6 2HB ALA 1 HB1 ALA 1 66.667 -5.437 -5.437
7 3HB ALA 1 HB3 ALA 1 67.194 -4.085 -4.085
8 H SER 2 HN SER 2 65.105 -6.910 -6.910
9 HA SER 2 HA SER 2 62.191 -7.008 -7.008
10 1HB SER 2 HB2 SER 2 64.504 -8.760 -8.760
11 2HB SER 2 HB1 SER 2 63.488 -9.007 -9.007
12 HG SER 2 HG SER 2 63.074 -9.775 -9.775
13 H MET 3 HN MET 3 64.569 -5.317 -5.317
14 HA MET 3 HA MET 3 64.113 -5.850 -5.850
15 1HB MET 3 HB2 MET 3 65.556 -4.044 -4.044
16 2HB MET 3 HB1 MET 3 64.752 -3.111 -3.111
17 1HG MET 3 HG2 MET 3 65.704 -5.197 -5.197
18 2HG MET 3 HG1 MET 3 66.951 -5.083 -5.083
19 1HE MET 3 HE1 MET 3 68.199 -4.950 -4.950
20 2HE MET 3 HE3 MET 3 68.781 -3.415 -3.415
21 3HE MET 3 HE2 MET 3 67.347 -4.182 -4.182
22 H THR 4 HN THR 4 62.324 -4.024 -4.024
23 HA THR 4 HA THR 4 60.833 -2.271 -2.271
24 HB THR 4 HB THR 4 60.990 -2.412 -2.412
25 HG1 THR 4 HG1 THR 4 59.409 -1.084 -1.084
26 1HG2 THR 4 HG22 THR 4 60.066 -4.986 -4.986
27 2HG2 THR 4 HG21 THR 4 58.634 -4.141 -4.141
28 3HG2 THR 4 HG23 THR 4 60.107 -4.160 -4.160
29 H ASP 5 HN ASP 5 60.783 -5.701 -5.701
30 HA ASP 5 HA ASP 5 58.000 -6.028 -6.028
31 1HB ASP 5 HB2 ASP 5 59.397 -7.585 -7.585
32 2HB ASP 5 HB1 ASP 5 60.268 -8.036 -8.036
33 H GLN 6 HN GLN 6 61.230 -6.633 -6.633
34 HA GLN 6 HA GLN 6 60.205 -7.213 -7.213
35 1HB GLN 6 HB2 GLN 6 62.472 -7.741 -7.741
36 2HB GLN 6 HB1 GLN 6 62.948 -6.128 -6.128
37 1HG GLN 6 HG2 GLN 6 63.268 -6.852 -6.852
38 2HG GLN 6 HG1 GLN 6 61.662 -7.579 -7.579
39 1HE2 GLN 6 HE22 GLN 6 62.983 -10.825 -10.825
40 2HE2 GLN 6 HE21 GLN 6 61.737 -9.801 -9.801
41 H GLN 7 HN GLN 7 60.416 -4.301 -4.301
42 HA GLN 7 HA GLN 7 61.028 -2.534 -2.534
43 1HB GLN 7 HB2 GLN 7 61.546 -2.077 -2.077
44 2HB GLN 7 HB1 GLN 7 59.815 -1.991 -1.991
45 1HG GLN 7 HG2 GLN 7 59.913 -0.256 -0.256
46 2HG GLN 7 HG1 GLN 7 61.567 -0.066 -0.066
47 1HE2 GLN 7 HE22 GLN 7 60.371 1.026 1.026
48 2HE2 GLN 7 HE21 GLN 7 61.466 -0.111 -0.111
49 H ALA 8 HN ALA 8 58.209 -4.097 -4.097
50 HA ALA 8 HA ALA 8 56.302 -2.175 -2.175
51 1HB ALA 8 HB1 ALA 8 56.351 -4.444 -4.444
52 2HB ALA 8 HB3 ALA 8 54.995 -4.544 -4.544
53 3HB ALA 8 HB2 ALA 8 55.190 -3.119 -3.119
54 H GLU 9 HN GLU 9 56.774 -5.705 -5.705
55 HA GLU 9 HA GLU 9 55.351 -5.918 -5.918
56 1HB GLU 9 HB2 GLU 9 57.752 -7.471 -7.471
57 2HB GLU 9 HB1 GLU 9 56.618 -8.039 -8.039
58 1HG GLU 9 HG2 GLU 9 54.952 -7.269 -7.269
59 2HG GLU 9 HG1 GLU 9 56.329 -7.981 -7.981
60 H ALA 10 HN ALA 10 58.709 -5.001 -5.001
61 HA ALA 10 HA ALA 10 59.935 -5.207 -5.207
62 1HB ALA 10 HB2 ALA 10 60.116 -3.575 -3.575
63 2HB ALA 10 HB1 ALA 10 60.640 -2.681 -2.681
64 3HB ALA 10 HB3 ALA 10 61.414 -4.210 -4.210
65 H ARG 11 HN ARG 11 58.605 -2.059 -2.059
66 HA ARG 11 HA ARG 11 58.355 -0.969 -0.969
67 1HB ARG 11 HB2 ARG 11 57.028 0.711 0.711
68 2HB ARG 11 HB1 ARG 11 58.260 0.164 0.164
69 1HG ARG 11 HG2 ARG 11 56.189 -1.626 -1.626
70 2HG ARG 11 HG1 ARG 11 55.347 -0.099 -0.099
71 1HD ARG 11 HD2 ARG 11 57.732 -0.045 -0.045
72 2HD ARG 11 HD1 ARG 11 56.238 -0.768 -0.768
73 HE ARG 11 HE ARG 11 55.598 1.673 1.673
74 1HH1 ARG 11 HH1 ARG 11 55.787 0.252 0.252
75 2HH1 ARG 11 HH1 ARG 11 56.022 1.719 1.719
76 1HH2 ARG 11 HH2 ARG 11 56.480 3.673 3.673
77 2HH2 ARG 11 HH2 ARG 11 56.416 3.655 3.655
78 H ALA 12 HN ALA 12 56.313 -3.216 -3.216
79 HA ALA 12 HA ALA 12 53.869 -2.798 -2.798
80 1HB ALA 12 HB1 ALA 12 54.500 -4.066 -4.066
81 2HB ALA 12 HB3 ALA 12 54.729 -5.439 -5.439
82 3HB ALA 12 HB2 ALA 12 53.156 -4.647 -4.647
83 H PHE 13 HN PHE 13 56.873 -4.254 -4.254
84 HA PHE 13 HA PHE 13 55.929 -6.229 -6.229
85 1HB PHE 13 HB2 PHE 13 58.157 -6.353 -6.353
86 2HB PHE 13 HB1 PHE 13 58.500 -4.684 -4.684
87 HD1 PHE 13 HD1 PHE 13 56.929 -7.531 -7.531
88 HD2 PHE 13 HD2 PHE 13 60.136 -4.682 -4.682
89 HE1 PHE 13 HE1 PHE 13 57.755 -8.298 -8.298
90 HE2 PHE 13 HE2 PHE 13 60.959 -5.446 -5.446
91 HZ PHE 13 HZ PHE 13 59.771 -7.256 -7.256
92 H LEU 14 HN LEU 14 56.849 -2.798 -2.798
93 HA LEU 14 HA LEU 14 56.263 -2.800 -2.800
94 1HB LEU 14 HB2 LEU 14 57.218 -0.753 -0.753
95 2HB LEU 14 HB1 LEU 14 56.938 -0.358 -0.358
96 HG LEU 14 HG LEU 14 59.252 -0.859 -0.859
97 HD1 LEU 14 HD1 LEU 14 57.783 -2.165 -2.165
98 HD1 LEU 14 HD1 LEU 14 59.469 -2.636 -2.636
99 HD1 LEU 14 HD1 LEU 14 58.185 -3.571 -3.571
100 HD2 LEU 14 HD2 LEU 14 60.191 -2.693 -2.693
101 HD2 LEU 14 HD2 LEU 14 59.012 -1.937 -1.937
102 HD2 LEU 14 HD2 LEU 14 58.607 -3.432 -3.432
103 H SER 15 HN SER 15 54.658 -1.266 -1.266
104 HA SER 15 HA SER 15 52.225 -1.145 -1.145
105 1HB SER 15 HB2 SER 15 51.620 -0.063 -0.063
106 2HB SER 15 HB1 SER 15 51.560 -1.786 -1.786
107 HG SER 15 HG SER 15 52.852 -1.200 -1.200
108 H GLU 16 HN GLU 16 51.004 0.907 0.907
109 HA GLU 16 HA GLU 16 52.395 3.103 3.103
110 1HB GLU 16 HB2 GLU 16 49.947 2.649 2.649
111 2HB GLU 16 HB1 GLU 16 49.803 3.108 3.108
112 1HG GLU 16 HG2 GLU 16 50.763 5.349 5.349
113 2HG GLU 16 HG1 GLU 16 50.722 4.880 4.880
114 H GLU 17 HN GLU 17 51.945 2.194 2.194
115 HA GLU 17 HA GLU 17 52.566 4.811 4.811
116 1HB GLU 17 HB2 GLU 17 51.242 3.292 3.292
117 2HB GLU 17 HB1 GLU 17 52.379 1.968 1.968
118 1HG GLU 17 HG2 GLU 17 53.355 4.448 4.448
119 2HG GLU 17 HG1 GLU 17 52.380 3.302 3.302
120 H MET 18 HN MET 18 54.385 1.821 1.821
121 HA MET 18 HA MET 18 56.856 2.809 2.809
122 1HB MET 18 HB2 MET 18 56.276 0.433 0.433
123 2HB MET 18 HB1 MET 18 56.195 0.508 0.508
124 1HG MET 18 HG2 MET 18 58.384 -0.029 -0.029
125 2HG MET 18 HG1 MET 18 58.710 1.566 1.566
126 1HE MET 18 HE3 MET 18 59.544 2.079 2.079
127 2HE MET 18 HE2 MET 18 57.925 1.833 1.833
128 3HE MET 18 HE1 MET 18 59.316 1.154 1.154
129 H ILE 19 HN ILE 19 55.644 2.397 2.397
130 HA ILE 19 HA ILE 19 57.876 3.106 3.106
131 HB ILE 19 HB ILE 19 54.938 3.784 3.784
132 1HG1 ILE 19 HG12 ILE 19 56.745 1.803 1.803
133 2HG1 ILE 19 HG11 ILE 19 55.612 1.401 1.401
134 1HG2 ILE 19 HG21 ILE 19 56.294 5.458 5.458
135 2HG2 ILE 19 HG23 ILE 19 57.101 4.141 4.141
136 3HG2 ILE 19 HG22 ILE 19 55.373 4.411 4.411
137 HD1 ILE 19 HD1 ILE 19 53.905 1.304 1.304
138 HD1 ILE 19 HD1 ILE 19 55.067 1.537 1.537
139 HD1 ILE 19 HD1 ILE 19 54.264 2.929 2.929
140 H ALA 20 HN ALA 20 55.678 5.285 5.285
141 HA ALA 20 HA ALA 20 56.896 7.737 7.737
142 1HB ALA 20 HB2 ALA 20 54.605 7.529 7.529
143 2HB ALA 20 HB1 ALA 20 55.261 7.072 7.072
144 3HB ALA 20 HB3 ALA 20 55.536 8.695 8.695
145 H GLU 21 HN GLU 21 57.740 5.410 5.410
146 HA GLU 21 HA GLU 21 59.338 7.194 7.194
147 1HB GLU 21 HB2 GLU 21 58.411 5.171 5.171
148 2HB GLU 21 HB1 GLU 21 59.126 4.192 4.192
149 1HG GLU 21 HG2 GLU 21 60.519 3.915 3.915
150 2HG GLU 21 HG1 GLU 21 61.399 4.962 4.962
151 H PHE 22 HN PHE 22 60.122 4.746 4.746
152 HA PHE 22 HA PHE 22 62.952 5.094 5.094
153 1HB PHE 22 HB2 PHE 22 61.002 4.306 4.306
154 2HB PHE 22 HB1 PHE 22 62.747 4.081 4.081
155 HD1 PHE 22 HD2 PHE 22 62.279 3.697 3.697
156 HD2 PHE 22 HD1 PHE 22 61.260 1.689 1.689
157 HE1 PHE 22 HE2 PHE 22 62.076 1.555 1.555
158 HE2 PHE 22 HE1 PHE 22 61.059 -0.453 -0.453
159 HZ PHE 22 HZ PHE 22 61.465 -0.520 -0.520
160 H LYS 23 HN LYS 23 60.381 6.911 6.911
161 HA LYS 23 HA LYS 23 61.672 8.356 8.356
162 1HB LYS 23 HB2 LYS 23 59.675 9.119 9.119
163 2HB LYS 23 HB1 LYS 23 60.156 10.269 10.269
164 1HG LYS 23 HG2 LYS 23 59.172 7.488 7.488
165 2HG LYS 23 HG1 LYS 23 58.082 8.867 8.867
166 1HD LYS 23 HD2 LYS 23 60.491 8.807 8.807
167 2HD LYS 23 HD1 LYS 23 58.847 8.433 8.433
168 1HE LYS 23 HE2 LYS 23 58.262 10.760 10.760
169 2HE LYS 23 HE1 LYS 23 59.996 11.075 11.075
170 1HZ LYS 23 HZ1 LYS 23 59.563 10.031 10.031
171 2HZ LYS 23 HZ3 LYS 23 57.951 10.470 10.470
172 3HZ LYS 23 HZ2 LYS 23 59.163 11.661 11.661
173 H ALA 24 HN ALA 24 61.223 10.116 10.116
174 HA ALA 24 HA ALA 24 63.299 11.923 11.923
175 1HB ALA 24 HB1 ALA 24 62.304 10.399 10.399
176 2HB ALA 24 HB3 ALA 24 63.251 11.883 11.883
177 3HB ALA 24 HB2 ALA 24 61.642 11.904 11.904
178 H ALA 25 HN ALA 25 63.552 8.538 8.538
179 HA ALA 25 HA ALA 25 66.268 8.603 8.603
180 1HB ALA 25 HB3 ALA 25 64.382 6.827 6.827
181 2HB ALA 25 HB2 ALA 25 64.928 6.273 6.273
182 3HB ALA 25 HB1 ALA 25 66.034 6.245 6.245
183 H PHE 26 HN PHE 26 64.939 7.532 7.532
184 HA PHE 26 HA PHE 26 67.526 7.249 7.249
185 1HB PHE 26 HB2 PHE 26 65.659 6.039 6.039
186 2HB PHE 26 HB1 PHE 26 64.665 7.493 7.493
187 HD1 PHE 26 HD1 PHE 26 65.081 9.202 9.202
188 HD2 PHE 26 HD2 PHE 26 67.289 5.520 5.520
189 HE1 PHE 26 HE1 PHE 26 65.858 9.593 9.593
190 HE2 PHE 26 HE2 PHE 26 68.066 5.910 5.910
191 HZ PHE 26 HZ PHE 26 67.351 7.947 7.947
192 H ASP 27 HN ASP 27 65.079 9.852 9.852
193 HA ASP 27 HA ASP 27 66.305 11.574 11.574
194 1HB ASP 27 HB2 ASP 27 64.076 11.532 11.532
195 2HB ASP 27 HB1 ASP 27 65.017 12.851 12.851
196 H MET 28 HN MET 28 67.362 10.671 10.671
197 HA MET 28 HA MET 28 68.654 12.950 12.950
198 1HB MET 28 HB2 MET 28 69.271 9.996 9.996
199 2HB MET 28 HB1 MET 28 70.319 11.127 11.127
200 1HG MET 28 HG2 MET 28 67.689 11.836 11.836
201 2HG MET 28 HG1 MET 28 67.745 10.075 10.075
202 1HE MET 28 HE3 MET 28 67.106 12.049 12.049
203 2HE MET 28 HE2 MET 28 67.679 11.191 11.191
204 3HE MET 28 HE1 MET 28 68.336 12.778 12.778
205 H PHE 29 HN PHE 29 69.512 10.971 10.971
206 HA PHE 29 HA PHE 29 71.985 12.637 12.637
207 1HB PHE 29 HB2 PHE 29 71.516 9.916 9.916
208 2HB PHE 29 HB1 PHE 29 73.048 10.713 10.713
209 HD1 PHE 29 HD2 PHE 29 70.208 8.841 8.841
210 HD2 PHE 29 HD1 PHE 29 73.970 10.733 10.733
211 HE1 PHE 29 HE2 PHE 29 70.275 7.717 7.717
212 HE2 PHE 29 HE1 PHE 29 74.037 9.607 9.607
213 HZ PHE 29 HZ PHE 29 72.190 8.099 8.099
214 H ASP 30 HN ASP 30 69.239 13.286 13.286
215 HA ASP 30 HA ASP 30 69.461 12.878 12.878
216 1HB ASP 30 HB2 ASP 30 67.116 13.380 13.380
217 2HB ASP 30 HB1 ASP 30 67.382 12.351 12.351
218 H ALA 31 HN ALA 31 70.732 14.998 14.998
219 HA ALA 31 HA ALA 31 69.860 17.595 17.595
220 1HB ALA 31 HB1 ALA 31 72.055 16.286 16.286
221 2HB ALA 31 HB3 ALA 31 72.684 17.591 17.591
222 3HB ALA 31 HB2 ALA 31 71.463 17.933 17.933
223 H ASP 32 HN ASP 32 71.700 15.253 15.253
224 HA ASP 32 HA ASP 32 72.079 17.292 17.292
225 1HB ASP 32 HB2 ASP 32 74.164 16.612 16.612
226 2HB ASP 32 HB1 ASP 32 73.844 14.936 14.936
227 H GLY 33 HN GLY 33 70.291 14.685 14.685
228 1HA GLY 33 HA2 GLY 33 70.190 13.669 13.669
229 2HA GLY 33 HA1 GLY 33 70.005 12.595 12.595
230 H GLY 34 HN GLY 34 68.372 14.231 14.231
231 1HA GLY 34 HA2 GLY 34 66.153 14.990 14.990
232 2HA GLY 34 HA1 GLY 34 66.060 15.150 15.150
233 H GLY 35 HN GLY 35 66.401 12.689 12.689
234 1HA GLY 35 HA2 GLY 35 64.388 11.002 11.002
235 2HA GLY 35 HA1 GLY 35 64.370 11.194 11.194
236 H ASP 36 HN ASP 36 67.549 11.143 11.143
237 HA ASP 36 HA ASP 36 67.906 8.254 8.254
238 1HB ASP 36 HB2 ASP 36 69.123 8.127 8.127
239 2HB ASP 36 HB1 ASP 36 67.390 8.417 8.417
240 H ILE 37 HN ILE 37 69.658 8.105 8.105
241 HA ILE 37 HA ILE 37 71.650 10.317 10.317
242 HB ILE 37 HB ILE 37 72.173 9.463 9.463
243 1HG1 ILE 37 HG12 ILE 37 70.552 6.995 6.995
244 2HG1 ILE 37 HG11 ILE 37 72.313 7.068 7.068
245 1HG2 ILE 37 HG22 ILE 37 69.553 10.115 10.115
246 2HG2 ILE 37 HG21 ILE 37 69.383 8.685 8.685
247 3HG2 ILE 37 HG23 ILE 37 70.205 10.117 10.117
248 HD1 ILE 37 HD1 ILE 37 70.497 7.288 7.288
249 HD1 ILE 37 HD1 ILE 37 72.154 7.892 7.892
250 HD1 ILE 37 HD1 ILE 37 71.847 6.182 6.182
251 H SER 38 HN SER 38 73.990 9.658 9.658
252 HA SER 38 HA SER 38 74.868 8.088 8.088
253 1HB SER 38 HB2 SER 38 77.057 8.180 8.180
254 2HB SER 38 HB1 SER 38 76.253 9.740 9.740
255 HG SER 38 HG SER 38 75.976 7.992 7.992
256 H THR 39 HN THR 39 74.943 5.892 5.892
257 HA THR 39 HA THR 39 73.876 3.943 3.943
258 HB THR 39 HB THR 39 75.596 2.443 2.443
259 HG1 THR 39 HG1 THR 39 77.076 4.286 4.286
260 1HG2 THR 39 HG23 THR 39 73.777 4.375 4.375
261 2HG2 THR 39 HG22 THR 39 74.554 3.004 3.004
262 3HG2 THR 39 HG21 THR 39 73.407 2.730 2.730
263 H LYS 40 HN LYS 40 77.044 5.464 5.464
264 HA LYS 40 HA LYS 40 78.284 3.607 3.607
265 1HB LYS 40 HB2 LYS 40 79.390 5.437 5.437
266 2HB LYS 40 HB1 LYS 40 78.579 6.620 6.620
267 1HG LYS 40 HG2 LYS 40 80.604 6.428 6.428
268 2HG LYS 40 HG1 LYS 40 79.669 5.185 5.185
269 1HD LYS 40 HD2 LYS 40 81.174 3.648 3.648
270 2HD LYS 40 HD1 LYS 40 80.756 3.982 3.982
271 1HE LYS 40 HE2 LYS 40 82.453 6.092 6.092
272 2HE LYS 40 HE1 LYS 40 83.231 4.507 4.507
273 1HZ LYS 40 HZ3 LYS 40 81.779 4.971 4.971
274 2HZ LYS 40 HZ2 LYS 40 83.227 5.840 5.840
275 3HZ LYS 40 HZ1 LYS 40 83.236 4.143 4.143
276 H GLU 41 HN GLU 41 75.887 6.124 6.124
277 HA GLU 41 HA GLU 41 76.197 6.030 6.030
278 1HB GLU 41 HB2 GLU 41 75.822 8.162 8.162
279 2HB GLU 41 HB1 GLU 41 74.356 7.529 7.529
280 1HG GLU 41 HG2 GLU 41 73.606 8.797 8.797
281 2HG GLU 41 HG1 GLU 41 73.502 7.112 7.112
282 H LEU 42 HN LEU 42 74.426 4.422 4.422
283 HA LEU 42 HA LEU 42 71.903 3.915 3.915
284 1HB LEU 42 HB2 LEU 42 72.469 3.127 3.127
285 2HB LEU 42 HB1 LEU 42 73.865 2.235 2.235
286 HG LEU 42 HG LEU 42 71.491 1.358 1.358
287 HD1 LEU 42 HD1 LEU 42 69.946 1.409 1.409
288 HD1 LEU 42 HD1 LEU 42 70.950 0.268 0.268
289 HD1 LEU 42 HD1 LEU 42 71.130 2.003 2.003
290 HD2 LEU 42 HD2 LEU 42 72.530 -0.577 -0.577
291 HD2 LEU 42 HD2 LEU 42 72.768 -0.496 -0.496
292 HD2 LEU 42 HD2 LEU 42 73.885 0.337 0.337
293 H GLY 43 HN GLY 43 75.015 2.352 2.352
294 1HA GLY 43 HA2 GLY 43 74.063 0.296 0.296
295 2HA GLY 43 HA1 GLY 43 75.638 1.075 1.075
296 H THR 44 HN THR 44 75.232 3.531 3.531
297 HA THR 44 HA THR 44 74.614 3.469 3.469
298 HB THR 44 HB THR 44 74.359 5.607 5.607
299 HG1 THR 44 HG1 THR 44 76.243 6.329 6.329
300 1HG2 THR 44 HG22 THR 44 73.945 5.851 5.851
301 2HG2 THR 44 HG21 THR 44 74.301 7.226 7.226
302 3HG2 THR 44 HG23 THR 44 72.817 6.303 6.303
303 H VAL 45 HN VAL 45 72.332 4.719 4.719
304 HA VAL 45 HA VAL 45 70.044 5.033 5.033
305 HB VAL 45 HB VAL 45 70.499 3.980 3.980
306 1HG1 VAL 45 HG13 VAL 45 68.285 3.203 3.203
307 2HG1 VAL 45 HG12 VAL 45 67.852 4.900 4.900
308 3HG1 VAL 45 HG11 VAL 45 68.146 4.249 4.249
309 1HG2 VAL 45 HG21 VAL 45 71.085 6.373 6.373
310 2HG2 VAL 45 HG23 VAL 45 70.020 6.218 6.218
311 3HG2 VAL 45 HG22 VAL 45 69.348 6.624 6.624
312 H MET 46 HN MET 46 70.733 2.015 2.015
313 HA MET 46 HA MET 46 68.729 0.393 0.393
314 1HB MET 46 HB2 MET 46 71.549 -0.138 -0.138
315 2HB MET 46 HB1 MET 46 70.446 -1.447 -1.447
316 1HG MET 46 HG2 MET 46 68.822 -0.656 -0.656
317 2HG MET 46 HG1 MET 46 69.869 0.706 0.706
318 1HE MET 46 HE1 MET 46 69.022 -2.696 -2.696
319 2HE MET 46 HE3 MET 46 69.464 -3.291 -3.291
320 3HE MET 46 HE2 MET 46 70.508 -3.615 -3.615
321 H ARG 47 HN ARG 47 71.923 1.201 1.201
322 HA ARG 47 HA ARG 47 71.652 -0.638 -0.638
323 1HB ARG 47 HB2 ARG 47 73.662 0.841 0.841
324 2HB ARG 47 HB1 ARG 47 73.617 1.457 1.457
325 1HG ARG 47 HG2 ARG 47 73.414 -1.236 -1.236
326 2HG ARG 47 HG1 ARG 47 74.444 -1.196 -1.196
327 1HD ARG 47 HD2 ARG 47 76.186 -0.176 -0.176
328 2HD ARG 47 HD1 ARG 47 75.099 0.732 0.732
329 HE ARG 47 HE ARG 47 74.600 -1.790 -1.790
330 1HH1 ARG 47 HH1 ARG 47 77.141 0.354 0.354
331 2HH1 ARG 47 HH1 ARG 47 78.276 -0.799 -0.799
332 1HH2 ARG 47 HH2 ARG 47 76.241 -3.535 -3.535
333 2HH2 ARG 47 HH2 ARG 47 77.766 -3.001 -3.001
334 H MET 48 HN MET 48 71.782 2.942 2.942
335 HA MET 48 HA MET 48 71.170 3.579 3.579
336 1HB MET 48 HB2 MET 48 70.948 4.836 4.836
337 2HB MET 48 HB1 MET 48 70.005 5.591 5.591
338 1HG MET 48 HG2 MET 48 72.555 4.996 4.996
339 2HG MET 48 HG1 MET 48 72.838 5.752 5.752
340 1HE MET 48 HE3 MET 48 70.487 5.569 5.569
341 2HE MET 48 HE2 MET 48 71.024 6.871 6.871
342 3HE MET 48 HE1 MET 48 69.641 7.122 7.122
343 H LEU 49 HN LEU 49 69.137 2.173 2.173
344 HA LEU 49 HA LEU 49 66.597 3.058 3.058
345 1HB LEU 49 HB2 LEU 49 67.562 1.191 1.191
346 2HB LEU 49 HB1 LEU 49 65.886 1.081 1.081
347 HG LEU 49 HG LEU 49 67.046 3.769 3.769
348 HD1 LEU 49 HD1 LEU 49 65.614 2.281 2.281
349 HD1 LEU 49 HD1 LEU 49 67.287 1.814 1.814
350 HD1 LEU 49 HD1 LEU 49 66.901 3.481 3.481
351 HD2 LEU 49 HD2 LEU 49 64.339 3.131 3.131
352 HD2 LEU 49 HD2 LEU 49 64.890 4.408 4.408
353 HD2 LEU 49 HD2 LEU 49 64.560 2.795 2.795
354 H GLY 50 HN GLY 50 68.591 0.103 0.103
355 1HA GLY 50 HA2 GLY 50 68.254 -0.794 -0.794
356 2HA GLY 50 HA1 GLY 50 66.658 -1.162 -1.162
357 H GLN 51 HN GLN 51 68.231 -1.551 -1.551
358 HA GLN 51 HA GLN 51 68.537 -4.456 -4.456
359 1HB GLN 51 HB2 GLN 51 69.161 -2.786 -2.786
360 2HB GLN 51 HB1 GLN 51 68.600 -4.457 -4.457
361 1HG GLN 51 HG2 GLN 51 66.483 -3.718 -3.718
362 2HG GLN 51 HG1 GLN 51 66.673 -2.905 -2.905
363 1HE2 GLN 51 HE22 GLN 51 66.032 0.073 0.073
364 2HE2 GLN 51 HE21 GLN 51 65.403 -1.039 -1.039
365 H ASN 52 HN ASN 52 70.572 -5.450 -5.450
366 HA ASN 52 HA ASN 52 73.009 -3.833 -3.833
367 1HB ASN 52 HB2 ASN 52 71.931 -6.078 -6.078
368 2HB ASN 52 HB1 ASN 52 73.346 -6.665 -6.665
369 HD2 ASN 52 HD2 ASN 52 72.318 -4.077 -4.077
370 HD2 ASN 52 HD2 ASN 52 73.851 -3.874 -3.874
371 HA PRO 53 HA PRO 53 73.234 -5.676 -5.676
372 1HB PRO 53 HB2 PRO 53 74.099 -3.386 -3.386
373 2HB PRO 53 HB1 PRO 53 72.381 -3.764 -3.764
374 1HG PRO 53 HG2 PRO 53 74.151 -1.941 -1.941
375 2HG PRO 53 HG1 PRO 53 72.451 -1.748 -1.748
376 1HD PRO 53 HD2 PRO 53 73.274 -2.513 -2.513
377 2HD PRO 53 HD1 PRO 53 71.701 -2.958 -2.958
378 H THR 54 HN THR 54 75.075 -6.921 -6.921
379 HA THR 54 HA THR 54 77.610 -5.855 -5.855
380 HB THR 54 HB THR 54 78.363 -8.151 -8.151
381 HG1 THR 54 HG1 THR 54 76.770 -9.546 -9.546
382 1HG2 THR 54 HG23 THR 54 75.745 -7.628 -7.628
383 2HG2 THR 54 HG22 THR 54 76.202 -9.312 -9.312
384 3HG2 THR 54 HG21 THR 54 77.248 -8.248 -8.248
385 H LYS 55 HN LYS 55 79.500 -5.455 -5.455
386 HA LYS 55 HA LYS 55 79.356 -4.157 -4.157
387 1HB LYS 55 HB2 LYS 55 81.301 -4.741 -4.741
388 2HB LYS 55 HB1 LYS 55 81.651 -6.010 -6.010
389 1HG LYS 55 HG2 LYS 55 82.666 -4.507 -4.507
390 2HG LYS 55 HG1 LYS 55 81.159 -3.597 -3.597
391 1HD LYS 55 HD2 LYS 55 82.204 -3.050 -3.050
392 2HD LYS 55 HD1 LYS 55 83.561 -2.925 -2.925
393 1HE LYS 55 HE2 LYS 55 82.629 -0.758 -0.758
394 2HE LYS 55 HE1 LYS 55 81.854 -1.550 -1.550
395 1HZ LYS 55 HZ1 LYS 55 80.727 -1.525 -1.525
396 2HZ LYS 55 HZ3 LYS 55 80.255 -0.449 -0.449
397 3HZ LYS 55 HZ2 LYS 55 79.977 -2.114 -2.114
398 H GLU 56 HN GLU 56 80.025 -7.655 -7.655
399 HA GLU 56 HA GLU 56 80.208 -8.383 -8.383
400 1HB GLU 56 HB2 GLU 56 79.308 -9.731 -9.731
401 2HB GLU 56 HB1 GLU 56 79.268 -10.608 -10.608
402 1HG GLU 56 HG2 GLU 56 81.697 -9.283 -9.283
403 2HG GLU 56 HG1 GLU 56 81.405 -11.018 -11.018
404 H GLU 57 HN GLU 57 77.313 -8.187 -8.187
405 HA GLU 57 HA GLU 57 75.488 -8.948 -8.948
406 1HB GLU 57 HB2 GLU 57 75.251 -7.853 -7.853
407 2HB GLU 57 HB1 GLU 57 73.828 -8.133 -8.133
408 1HG GLU 57 HG2 GLU 57 75.605 -10.421 -10.421
409 2HG GLU 57 HG1 GLU 57 75.177 -10.033 -10.033
410 H LEU 58 HN LEU 58 76.692 -5.933 -5.933
411 HA LEU 58 HA LEU 58 74.756 -4.216 -4.216
412 1HB LEU 58 HB2 LEU 58 75.776 -3.468 -3.468
413 2HB LEU 58 HB1 LEU 58 77.394 -3.845 -3.845
414 HG LEU 58 HG LEU 58 77.008 -2.108 -2.108
415 HD1 LEU 58 HD1 LEU 58 75.238 -0.364 -0.364
416 HD1 LEU 58 HD1 LEU 58 74.519 -1.811 -1.811
417 HD1 LEU 58 HD1 LEU 58 74.728 -1.693 -1.693
418 HD2 LEU 58 HD2 LEU 58 77.505 -1.729 -1.729
419 HD2 LEU 58 HD2 LEU 58 76.931 -0.262 -0.262
420 HD2 LEU 58 HD2 LEU 58 78.380 -1.075 -1.075
421 H ASP 59 HN ASP 59 78.169 -5.115 -5.115
422 HA ASP 59 HA ASP 59 78.787 -3.504 -3.504
423 1HB ASP 59 HB2 ASP 59 80.022 -5.444 -5.444
424 2HB ASP 59 HB1 ASP 59 79.461 -6.429 -6.429
425 H ALA 60 HN ALA 60 77.154 -6.695 -6.695
426 HA ALA 60 HA ALA 60 76.742 -6.826 -6.826
427 1HB ALA 60 HB3 ALA 60 76.297 -8.418 -8.418
428 2HB ALA 60 HB2 ALA 60 74.651 -7.842 -7.842
429 3HB ALA 60 HB1 ALA 60 75.503 -8.687 -8.687
430 H ILE 61 HN ILE 61 74.963 -5.105 -5.105
431 HA ILE 61 HA ILE 61 72.619 -4.496 -4.496
432 HB ILE 61 HB ILE 61 73.930 -3.134 -3.134
433 1HG1 ILE 61 HG12 ILE 61 73.298 -5.531 -5.531
434 2HG1 ILE 61 HG11 ILE 61 72.341 -4.442 -4.442
435 1HG2 ILE 61 HG22 ILE 61 71.179 -2.858 -2.858
436 2HG2 ILE 61 HG21 ILE 61 71.571 -2.295 -2.295
437 3HG2 ILE 61 HG23 ILE 61 72.382 -1.589 -1.589
438 HD1 ILE 61 HD1 ILE 61 70.703 -5.843 -5.843
439 HD1 ILE 61 HD1 ILE 61 71.520 -5.924 -5.924
440 HD1 ILE 61 HD1 ILE 61 70.673 -4.453 -4.453
441 H ILE 62 HN ILE 62 75.286 -2.308 -2.308
442 HA ILE 62 HA ILE 62 74.707 -0.116 -0.116
443 HB ILE 62 HB ILE 62 77.270 -1.407 -1.407
444 1HG1 ILE 62 HG12 ILE 62 77.231 0.909 0.909
445 2HG1 ILE 62 HG11 ILE 62 75.523 0.904 0.904
446 1HG2 ILE 62 HG21 ILE 62 76.956 0.627 0.627
447 2HG2 ILE 62 HG23 ILE 62 77.889 1.225 1.225
448 3HG2 ILE 62 HG22 ILE 62 78.411 -0.226 -0.226
449 HD1 ILE 62 HD1 ILE 62 76.716 -1.545 -1.545
450 HD1 ILE 62 HD1 ILE 62 75.051 -0.967 -0.967
451 HD1 ILE 62 HD1 ILE 62 76.288 -0.172 -0.172
452 H GLU 63 HN GLU 63 76.886 -2.827 -2.827
453 HA GLU 63 HA GLU 63 77.321 -2.080 -2.080
454 1HB GLU 63 HB2 GLU 63 78.217 -4.005 -4.005
455 2HB GLU 63 HB1 GLU 63 76.965 -4.952 -4.952
456 1HG GLU 63 HG2 GLU 63 77.936 -4.170 -4.170
457 2HG GLU 63 HG1 GLU 63 79.287 -3.500 -3.500
458 H GLU 64 HN GLU 64 74.634 -3.822 -3.822
459 HA GLU 64 HA GLU 64 73.317 -4.620 -4.620
460 1HB GLU 64 HB2 GLU 64 72.652 -5.807 -5.807
461 2HB GLU 64 HB1 GLU 64 72.715 -4.386 -4.386
462 1HG GLU 64 HG2 GLU 64 70.575 -3.741 -3.741
463 2HG GLU 64 HG1 GLU 64 70.682 -4.348 -4.348
464 H VAL 65 HN VAL 65 72.681 -1.942 -1.942
465 HA VAL 65 HA VAL 65 70.735 -0.684 -0.684
466 HB VAL 65 HB VAL 65 70.664 0.971 0.971
467 1HG1 VAL 65 HG11 VAL 65 70.467 -1.881 -1.881
468 2HG1 VAL 65 HG13 VAL 65 70.968 -1.086 -1.086
469 3HG1 VAL 65 HG12 VAL 65 69.479 -0.592 -0.592
470 1HG2 VAL 65 HG23 VAL 65 73.261 0.897 0.897
471 2HG2 VAL 65 HG22 VAL 65 72.322 1.173 1.173
472 3HG2 VAL 65 HG21 VAL 65 72.982 -0.427 -0.427
473 H ASP 66 HN ASP 66 74.153 -0.685 -0.685
474 HA ASP 66 HA ASP 66 74.584 2.029 2.029
475 1HB ASP 66 HB2 ASP 66 76.197 1.002 1.002
476 2HB ASP 66 HB1 ASP 66 76.331 -0.411 -0.411
477 H GLU 67 HN GLU 67 73.750 -1.000 -1.000
478 HA GLU 67 HA GLU 67 75.109 -1.184 -1.184
479 1HB GLU 67 HB2 GLU 67 73.534 -2.850 -2.850
480 2HB GLU 67 HB1 GLU 67 72.231 -1.666 -1.666
481 1HG GLU 67 HG2 GLU 67 72.361 -1.293 -1.293
482 2HG GLU 67 HG1 GLU 67 73.614 -2.531 -2.531
483 H ASP 68 HN ASP 68 72.830 1.251 1.251
484 HA ASP 68 HA ASP 68 71.963 2.194 2.194
485 1HB ASP 68 HB2 ASP 68 72.370 3.636 3.636
486 2HB ASP 68 HB1 ASP 68 71.353 4.198 4.198
487 H GLY 69 HN GLY 69 74.721 3.110 3.110
488 1HA GLY 69 HA2 GLY 69 76.850 3.643 3.643
489 2HA GLY 69 HA1 GLY 69 75.860 4.566 4.566
490 H SER 70 HN SER 70 74.318 5.232 5.232
491 HA SER 70 HA SER 70 75.945 7.684 7.684
492 1HB SER 70 HB2 SER 70 73.530 8.018 8.018
493 2HB SER 70 HB1 SER 70 73.840 8.460 8.460
494 HG SER 70 HG SER 70 72.267 7.085 7.085
495 H GLY 71 HN GLY 71 75.583 4.656 4.656
496 1HA GLY 71 HA2 GLY 71 75.847 3.758 3.758
497 2HA GLY 71 HA1 GLY 71 76.977 5.097 5.097
498 H THR 72 HN THR 72 73.439 5.149 5.149
499 HA THR 72 HA THR 72 73.228 6.488 6.488
500 HB THR 72 HB THR 72 71.393 7.821 7.821
501 HG1 THR 72 HG1 THR 72 72.587 6.651 6.651
502 1HG2 THR 72 HG21 THR 72 74.181 8.135 8.135
503 2HG2 THR 72 HG23 THR 72 73.657 8.516 8.516
504 3HG2 THR 72 HG22 THR 72 72.975 9.392 9.392
505 H ILE 73 HN ILE 73 71.089 6.204 6.204
506 HA ILE 73 HA ILE 73 69.723 3.684 3.684
507 HB ILE 73 HB ILE 73 71.080 3.700 3.700
508 1HG1 ILE 73 HG12 ILE 73 68.965 2.887 2.887
509 2HG1 ILE 73 HG11 ILE 73 68.158 3.053 3.053
510 1HG2 ILE 73 HG21 ILE 73 70.396 6.074 6.074
511 2HG2 ILE 73 HG23 ILE 73 68.812 5.435 5.435
512 3HG2 ILE 73 HG22 ILE 73 70.247 4.922 4.922
513 HD1 ILE 73 HD1 ILE 73 69.283 1.291 1.291
514 HD1 ILE 73 HD1 ILE 73 69.495 0.810 0.810
515 HD1 ILE 73 HD1 ILE 73 70.781 1.679 1.679
516 H ASP 74 HN ASP 74 67.468 3.743 3.743
517 HA ASP 74 HA ASP 74 66.198 6.430 6.430
518 1HB ASP 74 HB2 ASP 74 65.729 3.939 3.939
519 2HB ASP 74 HB1 ASP 74 64.401 5.074 5.074
520 H PHE 75 HN PHE 75 64.577 6.730 6.730
521 HA PHE 75 HA PHE 75 64.181 5.110 5.110
522 1HB PHE 75 HB2 PHE 75 63.370 7.492 7.492
523 2HB PHE 75 HB1 PHE 75 61.965 6.696 6.696
524 HD1 PHE 75 HD2 PHE 75 60.521 5.210 5.210
525 HD2 PHE 75 HD1 PHE 75 63.609 7.705 7.705
526 HE1 PHE 75 HE2 PHE 75 59.511 4.980 4.980
527 HE2 PHE 75 HE1 PHE 75 62.600 7.475 7.475
528 HZ PHE 75 HZ PHE 75 60.551 6.112 6.112
529 H GLU 76 HN GLU 76 62.144 5.134 5.134
530 HA GLU 76 HA GLU 76 60.314 3.116 3.116
531 1HB GLU 76 HB2 GLU 76 60.086 2.858 2.858
532 2HB GLU 76 HB1 GLU 76 60.203 4.558 4.558
533 1HG GLU 76 HG2 GLU 76 62.661 4.462 4.462
534 2HG GLU 76 HG1 GLU 76 62.438 2.819 2.819
535 H GLU 77 HN GLU 77 63.531 2.760 2.760
536 HA GLU 77 HA GLU 77 63.338 -0.170 -0.170
537 1HB GLU 77 HB2 GLU 77 64.557 1.461 1.461
538 2HB GLU 77 HB1 GLU 77 65.819 1.505 1.505
539 1HG GLU 77 HG2 GLU 77 66.636 -0.389 -0.389
540 2HG GLU 77 HG1 GLU 77 65.209 -1.213 -1.213
541 H PHE 78 HN PHE 78 65.135 2.309 2.309
542 HA PHE 78 HA PHE 78 66.790 0.728 0.728
543 1HB PHE 78 HB2 PHE 78 66.928 3.071 3.071
544 2HB PHE 78 HB1 PHE 78 65.190 3.245 3.245
545 HD1 PHE 78 HD1 PHE 78 67.857 1.155 1.155
546 HD2 PHE 78 HD2 PHE 78 64.683 4.001 4.001
547 HE1 PHE 78 HE1 PHE 78 68.173 1.058 1.058
548 HE2 PHE 78 HE2 PHE 78 64.998 3.906 3.906
549 HZ PHE 78 HZ PHE 78 66.742 2.433 2.433
550 H LEU 79 HN LEU 79 63.309 1.365 1.365
551 HA LEU 79 HA LEU 79 62.753 0.309 0.309
552 1HB LEU 79 HB2 LEU 79 61.368 -0.081 -0.081
553 2HB LEU 79 HB1 LEU 79 60.625 -0.520 -0.520
554 HG LEU 79 HG LEU 79 61.790 2.211 2.211
555 HD1 LEU 79 HD1 LEU 79 60.293 1.442 1.442
556 HD1 LEU 79 HD1 LEU 79 60.304 3.086 3.086
557 HD1 LEU 79 HD1 LEU 79 59.022 1.968 1.968
558 HD2 LEU 79 HD2 LEU 79 59.875 0.703 0.703
559 HD2 LEU 79 HD2 LEU 79 59.149 2.198 2.198
560 HD2 LEU 79 HD2 LEU 79 60.631 2.254 2.254
561 H VAL 80 HN VAL 80 63.656 -1.515 -1.515
562 HA VAL 80 HA VAL 80 63.090 -4.134 -4.134
563 HB VAL 80 HB VAL 80 64.190 -4.880 -4.880
564 1HG1 VAL 80 HG13 VAL 80 62.330 -2.744 -2.744
565 2HG1 VAL 80 HG12 VAL 80 63.504 -2.412 -2.412
566 3HG1 VAL 80 HG11 VAL 80 62.622 -3.939 -3.939
567 1HG2 VAL 80 HG23 VAL 80 65.733 -2.341 -2.341
568 2HG2 VAL 80 HG22 VAL 80 66.311 -3.953 -3.953
569 3HG2 VAL 80 HG21 VAL 80 65.516 -2.960 -2.960
570 H MET 81 HN MET 81 65.860 -1.959 -1.959
571 HA MET 81 HA MET 81 67.773 -3.915 -3.915
572 1HB MET 81 HB2 MET 81 67.519 -1.017 -1.017
573 2HB MET 81 HB1 MET 81 68.571 -1.430 -1.430
574 1HG MET 81 HG2 MET 81 69.750 -1.291 -1.291
575 2HG MET 81 HG1 MET 81 69.946 -2.831 -2.831
576 1HE MET 81 HE2 MET 81 69.426 -1.059 -1.059
577 2HE MET 81 HE1 MET 81 68.512 -2.010 -2.010
578 3HE MET 81 HE3 MET 81 67.665 -1.025 -1.025
579 H MET 82 HN MET 82 66.530 -1.126 -1.126
580 HA MET 82 HA MET 82 67.094 -2.001 -2.001
581 1HB MET 82 HB2 MET 82 64.888 -0.677 -0.677
582 2HB MET 82 HB1 MET 82 66.232 0.172 0.172
583 1HG MET 82 HG2 MET 82 65.200 0.175 0.175
584 2HG MET 82 HG1 MET 82 64.135 -1.168 -1.168
585 1HE MET 82 HE1 MET 82 62.088 -0.838 -0.838
586 2HE MET 82 HE3 MET 82 61.747 -0.780 -0.780
587 3HE MET 82 HE2 MET 82 61.020 0.403 0.403
588 H VAL 83 HN VAL 83 64.511 -3.124 -3.124
589 HA VAL 83 HA VAL 83 63.126 -4.582 -4.582
590 HB VAL 83 HB VAL 83 62.888 -4.448 -4.448
591 1HG1 VAL 83 HG13 VAL 83 61.125 -5.843 -5.843
592 2HG1 VAL 83 HG12 VAL 83 60.710 -5.609 -5.609
593 3HG1 VAL 83 HG11 VAL 83 62.083 -6.626 -6.626
594 1HG2 VAL 83 HG23 VAL 83 62.281 -2.512 -2.512
595 2HG2 VAL 83 HG22 VAL 83 61.236 -2.859 -2.859
596 3HG2 VAL 83 HG21 VAL 83 60.827 -3.488 -3.488
597 H ARG 84 HN ARG 84 64.444 -5.756 -5.756
598 HA ARG 84 HA ARG 84 64.652 -8.461 -8.461
599 1HB ARG 84 HB2 ARG 84 66.637 -6.666 -6.666
600 2HB ARG 84 HB1 ARG 84 66.527 -8.415 -8.415
601 1HG ARG 84 HG2 ARG 84 64.003 -6.876 -6.876
602 2HG ARG 84 HG1 ARG 84 65.220 -6.690 -6.690
603 1HD ARG 84 HD2 ARG 84 64.635 -9.471 -9.471
604 2HD ARG 84 HD1 ARG 84 63.445 -8.681 -8.681
605 HE ARG 84 HE ARG 84 65.681 -8.102 -8.102
606 1HH1 ARG 84 HH1 ARG 84 64.164 -10.983 -10.983
607 2HH1 ARG 84 HH1 ARG 84 65.315 -12.031 -12.031
608 1HH2 ARG 84 HH2 ARG 84 67.441 -9.454 -9.454
609 2HH2 ARG 84 HH2 ARG 84 67.171 -11.166 -11.166
610 H GLN 85 HN GLN 85 66.627 -5.856 -5.856
611 HA GLN 85 HA GLN 85 68.737 -7.572 -7.572
612 1HB GLN 85 HB2 GLN 85 68.841 -5.103 -5.103
613 2HB GLN 85 HB1 GLN 85 67.933 -4.771 -4.771
614 1HG GLN 85 HG2 GLN 85 70.448 -4.582 -4.582
615 2HG GLN 85 HG1 GLN 85 69.677 -5.687 -5.687
616 1HE2 GLN 85 HE22 GLN 85 71.525 -7.534 -7.534
617 2HE2 GLN 85 HE21 GLN 85 70.541 -6.179 -6.179
618 H MET 86 HN MET 86 65.933 -5.849 -5.849
619 HA MET 86 HA MET 86 66.354 -6.902 -6.902
620 1HB MET 86 HB2 MET 86 64.662 -5.057 -5.057
621 2HB MET 86 HB1 MET 86 63.647 -6.134 -6.134
622 1HG MET 86 HG2 MET 86 66.000 -5.320 -5.320
623 2HG MET 86 HG1 MET 86 65.085 -3.917 -3.917
624 1HE MET 86 HE2 MET 86 64.800 -3.306 -3.306
625 2HE MET 86 HE1 MET 86 63.372 -2.915 -2.915
626 3HE MET 86 HE3 MET 86 63.196 -3.595 -3.595
627 H LYS 87 HN LYS 87 64.729 -8.058 -8.058
628 HA LYS 87 HA LYS 87 62.800 -9.823 -9.823
629 1HB LYS 87 HB2 LYS 87 64.677 -9.706 -9.706
630 2HB LYS 87 HB1 LYS 87 63.877 -11.252 -11.252
631 1HG LYS 87 HG2 LYS 87 62.222 -8.758 -8.758
632 2HG LYS 87 HG1 LYS 87 62.721 -9.390 -9.390
633 1HD LYS 87 HD2 LYS 87 61.655 -11.494 -11.494
634 2HD LYS 87 HD1 LYS 87 61.404 -11.113 -11.113
635 1HE LYS 87 HE2 LYS 87 59.292 -10.586 -10.586
636 2HE LYS 87 HE1 LYS 87 60.090 -9.022 -9.022
637 1HZ LYS 87 HZ2 LYS 87 60.885 -10.261 -10.261
638 2HZ LYS 87 HZ1 LYS 87 59.441 -11.122 -11.122
639 3HZ LYS 87 HZ3 LYS 87 59.401 -9.438 -9.438
640 H GLU 88 HN GLU 88 66.289 -10.015 -10.015
641 HA GLU 88 HA GLU 88 66.175 -12.783 -12.783
642 1HB GLU 88 HB2 GLU 88 68.055 -11.079 -11.079
643 2HB GLU 88 HB1 GLU 88 68.807 -11.821 -11.821
644 1HG GLU 88 HG2 GLU 88 67.211 -13.357 -13.357
645 2HG GLU 88 HG1 GLU 88 68.970 -13.226 -13.226
646 H ASP 89 HN ASP 89 67.020 -9.445 -9.445
647 HA ASP 89 HA ASP 89 67.964 -10.120 -10.120
648 1HB ASP 89 HB2 ASP 89 67.747 -7.848 -7.848
649 2HB ASP 89 HB1 ASP 89 67.246 -7.402 -7.402
650 H ALA 90 HN ALA 90 64.891 -9.236 -9.236
651 HA ALA 90 HA ALA 90 63.536 -8.544 -8.544
652 1HB ALA 90 HB1 ALA 90 62.643 -9.346 -9.346
653 2HB ALA 90 HB3 ALA 90 61.526 -8.813 -8.813
654 3HB ALA 90 HB2 ALA 90 62.764 -7.712 -7.712
Start of MODEL 6
1 1H ALA 1 HT3 ALA 1 65.257 -2.606 -2.606
2 2H ALA 1 HT2 ALA 1 66.870 -2.357 -2.357
3 3H ALA 1 HT1 ALA 1 65.735 -2.947 -2.947
4 HA ALA 1 HA ALA 1 66.738 -4.915 -4.915
5 1HB ALA 1 HB3 ALA 1 67.995 -3.292 -3.292
6 2HB ALA 1 HB2 ALA 1 67.014 -4.215 -4.215
7 3HB ALA 1 HB1 ALA 1 68.148 -5.048 -5.048
8 H SER 2 HN SER 2 66.147 -6.719 -6.719
9 HA SER 2 HA SER 2 63.205 -6.742 -6.742
10 1HB SER 2 HB2 SER 2 65.182 -8.593 -8.593
11 2HB SER 2 HB1 SER 2 64.801 -8.889 -8.889
12 HG SER 2 HG SER 2 63.508 -9.893 -9.893
13 H MET 3 HN MET 3 65.749 -5.732 -5.732
14 HA MET 3 HA MET 3 64.999 -6.515 -6.515
15 1HB MET 3 HB2 MET 3 66.456 -4.314 -4.314
16 2HB MET 3 HB1 MET 3 65.872 -3.930 -3.930
17 1HG MET 3 HG2 MET 3 68.166 -4.941 -4.941
18 2HG MET 3 HG1 MET 3 66.996 -5.875 -5.875
19 1HE MET 3 HE2 MET 3 69.542 -6.861 -6.861
20 2HE MET 3 HE1 MET 3 68.573 -8.285 -8.285
21 3HE MET 3 HE3 MET 3 69.607 -8.263 -8.263
22 H THR 4 HN THR 4 63.589 -4.053 -4.053
23 HA THR 4 HA THR 4 62.059 -2.533 -2.533
24 HB THR 4 HB THR 4 62.258 -2.207 -2.207
25 HG1 THR 4 HG1 THR 4 60.473 -1.160 -1.160
26 1HG2 THR 4 HG23 THR 4 60.465 -4.648 -4.648
27 2HG2 THR 4 HG22 THR 4 60.856 -3.617 -3.617
28 3HG2 THR 4 HG21 THR 4 62.127 -4.542 -4.542
29 H ASP 5 HN ASP 5 61.710 -5.897 -5.897
30 HA ASP 5 HA ASP 5 58.931 -6.242 -6.242
31 1HB ASP 5 HB2 ASP 5 60.693 -7.738 -7.738
32 2HB ASP 5 HB1 ASP 5 61.074 -8.323 -8.323
33 H GLN 6 HN GLN 6 61.896 -6.997 -6.997
34 HA GLN 6 HA GLN 6 60.603 -7.667 -7.667
35 1HB GLN 6 HB2 GLN 6 63.232 -7.205 -7.205
36 2HB GLN 6 HB1 GLN 6 63.105 -6.395 -6.395
37 1HG GLN 6 HG2 GLN 6 63.688 -8.502 -8.502
38 2HG GLN 6 HG1 GLN 6 61.937 -8.706 -8.706
39 1HE2 GLN 6 HE22 GLN 6 64.193 -11.066 -11.066
40 2HE2 GLN 6 HE21 GLN 6 64.784 -10.174 -10.174
41 H GLN 7 HN GLN 7 60.934 -4.619 -4.619
42 HA GLN 7 HA GLN 7 61.025 -2.861 -2.861
43 1HB GLN 7 HB2 GLN 7 61.381 -2.482 -2.482
44 2HB GLN 7 HB1 GLN 7 59.627 -2.320 -2.320
45 1HG GLN 7 HG2 GLN 7 59.910 -0.622 -0.622
46 2HG GLN 7 HG1 GLN 7 61.608 -0.589 -0.589
47 1HE2 GLN 7 HE22 GLN 7 58.862 1.342 1.342
48 2HE2 GLN 7 HE21 GLN 7 58.425 0.535 0.535
49 H ALA 8 HN ALA 8 58.235 -3.929 -3.929
50 HA ALA 8 HA ALA 8 56.143 -2.659 -2.659
51 1HB ALA 8 HB3 ALA 8 56.525 -4.706 -4.706
52 2HB ALA 8 HB2 ALA 8 55.559 -5.455 -5.455
53 3HB ALA 8 HB1 ALA 8 54.976 -4.000 -4.000
54 H GLU 9 HN GLU 9 57.143 -6.022 -6.022
55 HA GLU 9 HA GLU 9 55.679 -6.079 -6.079
56 1HB GLU 9 HB2 GLU 9 57.122 -7.815 -7.815
57 2HB GLU 9 HB1 GLU 9 57.868 -7.954 -7.954
58 1HG GLU 9 HG2 GLU 9 55.414 -8.106 -8.106
59 2HG GLU 9 HG1 GLU 9 55.020 -8.508 -8.508
60 H ALA 10 HN ALA 10 58.596 -4.551 -4.551
61 HA ALA 10 HA ALA 10 59.987 -4.929 -4.929
62 1HB ALA 10 HB3 ALA 10 60.354 -3.599 -3.599
63 2HB ALA 10 HB2 ALA 10 61.092 -2.741 -2.741
64 3HB ALA 10 HB1 ALA 10 61.537 -4.415 -4.415
65 H ARG 11 HN ARG 11 57.771 -2.540 -2.540
66 HA ARG 11 HA ARG 11 58.153 -0.689 -0.689
67 1HB ARG 11 HB2 ARG 11 56.108 -0.532 -0.532
68 2HB ARG 11 HB1 ARG 11 56.829 0.793 0.793
69 1HG ARG 11 HG2 ARG 11 58.474 0.970 0.970
70 2HG ARG 11 HG1 ARG 11 58.932 -0.710 -0.710
71 1HD ARG 11 HD2 ARG 11 58.342 -0.766 -0.766
72 2HD ARG 11 HD1 ARG 11 56.790 -1.186 -1.186
73 HE ARG 11 HE ARG 11 57.484 1.439 1.439
74 1HH1 ARG 11 HH1 ARG 11 56.129 1.936 1.936
75 2HH1 ARG 11 HH1 ARG 11 54.455 1.935 1.935
76 1HH2 ARG 11 HH2 ARG 11 54.992 0.383 0.383
77 2HH2 ARG 11 HH2 ARG 11 53.811 1.057 1.057
78 H ALA 12 HN ALA 12 55.307 -2.240 -2.240
79 HA ALA 12 HA ALA 12 53.430 -1.802 -1.802
80 1HB ALA 12 HB1 ALA 12 53.656 -3.200 -3.200
81 2HB ALA 12 HB3 ALA 12 53.262 -4.454 -4.454
82 3HB ALA 12 HB2 ALA 12 52.194 -3.064 -3.064
83 H PHE 13 HN PHE 13 56.171 -3.947 -3.947
84 HA PHE 13 HA PHE 13 55.389 -5.946 -5.946
85 1HB PHE 13 HB2 PHE 13 57.497 -6.063 -6.063
86 2HB PHE 13 HB1 PHE 13 57.975 -4.467 -4.467
87 HD1 PHE 13 HD2 PHE 13 58.691 -4.130 -4.130
88 HD2 PHE 13 HD1 PHE 13 57.584 -8.019 -8.019
89 HE1 PHE 13 HE2 PHE 13 59.722 -5.171 -5.171
90 HE2 PHE 13 HE1 PHE 13 58.615 -9.060 -9.060
91 HZ PHE 13 HZ PHE 13 59.684 -7.635 -7.635
92 H LEU 14 HN LEU 14 56.100 -2.550 -2.550
93 HA LEU 14 HA LEU 14 55.687 -2.984 -2.984
94 1HB LEU 14 HB2 LEU 14 57.077 -0.813 -0.813
95 2HB LEU 14 HB1 LEU 14 57.932 -2.279 -2.279
96 HG LEU 14 HG LEU 14 56.672 -0.744 -0.744
97 HD1 LEU 14 HD1 LEU 14 59.207 0.238 0.238
98 HD1 LEU 14 HD1 LEU 14 57.636 1.019 1.019
99 HD1 LEU 14 HD1 LEU 14 58.410 0.943 0.943
100 HD2 LEU 14 HD2 LEU 14 58.853 -1.343 -1.343
101 HD2 LEU 14 HD2 LEU 14 57.998 -2.750 -2.750
102 HD2 LEU 14 HD2 LEU 14 59.363 -2.073 -2.073
103 H SER 15 HN SER 15 54.014 -1.820 -1.820
104 HA SER 15 HA SER 15 52.067 -0.483 -0.483
105 1HB SER 15 HB2 SER 15 52.683 -0.963 -0.963
106 2HB SER 15 HB1 SER 15 51.655 0.432 0.432
107 HG SER 15 HG SER 15 51.225 -2.146 -2.146
108 H GLU 16 HN GLU 16 51.507 1.841 1.841
109 HA GLU 16 HA GLU 16 53.581 3.620 3.620
110 1HB GLU 16 HB2 GLU 16 51.205 3.993 3.993
111 2HB GLU 16 HB1 GLU 16 50.866 4.107 4.107
112 1HG GLU 16 HG2 GLU 16 51.140 6.340 6.340
113 2HG GLU 16 HG1 GLU 16 52.863 5.961 5.961
114 H GLU 17 HN GLU 17 52.565 2.490 2.490
115 HA GLU 17 HA GLU 17 53.374 4.621 4.621
116 1HB GLU 17 HB2 GLU 17 52.267 2.193 2.193
117 2HB GLU 17 HB1 GLU 17 53.922 1.789 1.789
118 1HG GLU 17 HG2 GLU 17 53.765 2.906 2.906
119 2HG GLU 17 HG1 GLU 17 53.005 4.300 4.300
120 H MET 18 HN MET 18 55.288 1.749 1.749
121 HA MET 18 HA MET 18 57.755 2.704 2.704
122 1HB MET 18 HB2 MET 18 56.734 0.385 0.385
123 2HB MET 18 HB1 MET 18 57.957 0.900 0.900
124 1HG MET 18 HG2 MET 18 59.442 -0.110 -0.110
125 2HG MET 18 HG1 MET 18 59.233 1.308 1.308
126 1HE MET 18 HE3 MET 18 59.187 1.200 1.200
127 2HE MET 18 HE2 MET 18 57.999 0.458 0.458
128 3HE MET 18 HE1 MET 18 59.522 -0.368 -0.368
129 H ILE 19 HN ILE 19 56.423 2.797 2.797
130 HA ILE 19 HA ILE 19 58.544 3.807 3.807
131 HB ILE 19 HB ILE 19 55.578 4.241 4.241
132 1HG1 ILE 19 HG12 ILE 19 56.725 3.534 3.534
133 2HG1 ILE 19 HG11 ILE 19 57.464 2.537 2.537
134 1HG2 ILE 19 HG23 ILE 19 56.489 6.461 6.461
135 2HG2 ILE 19 HG22 ILE 19 57.457 5.694 5.694
136 3HG2 ILE 19 HG21 ILE 19 55.696 5.675 5.675
137 HD1 ILE 19 HD1 ILE 19 54.484 2.905 2.905
138 HD1 ILE 19 HD1 ILE 19 55.227 1.906 1.906
139 HD1 ILE 19 HD1 ILE 19 55.416 1.477 1.477
140 H ALA 20 HN ALA 20 56.350 5.716 5.716
141 HA ALA 20 HA ALA 20 57.473 8.278 8.278
142 1HB ALA 20 HB1 ALA 20 55.551 7.067 7.067
143 2HB ALA 20 HB3 ALA 20 56.722 7.680 7.680
144 3HB ALA 20 HB2 ALA 20 55.961 8.782 8.782
145 H GLU 21 HN GLU 21 58.581 5.579 5.579
146 HA GLU 21 HA GLU 21 60.683 7.127 7.127
147 1HB GLU 21 HB2 GLU 21 59.641 5.261 5.261
148 2HB GLU 21 HB1 GLU 21 59.963 4.188 4.188
149 1HG GLU 21 HG2 GLU 21 61.691 3.631 3.631
150 2HG GLU 21 HG1 GLU 21 62.472 4.818 4.818
151 H PHE 22 HN PHE 22 60.494 4.701 4.701
152 HA PHE 22 HA PHE 22 63.355 4.698 4.698
153 1HB PHE 22 HB2 PHE 22 60.870 3.736 3.736
154 2HB PHE 22 HB1 PHE 22 62.489 3.484 3.484
155 HD1 PHE 22 HD2 PHE 22 62.594 3.555 3.555
156 HD2 PHE 22 HD1 PHE 22 61.612 1.008 1.008
157 HE1 PHE 22 HE2 PHE 22 62.869 1.562 1.562
158 HE2 PHE 22 HE1 PHE 22 61.888 -0.984 -0.984
159 HZ PHE 22 HZ PHE 22 62.515 -0.708 -0.708
160 H LYS 23 HN LYS 23 60.518 6.163 6.163
161 HA LYS 23 HA LYS 23 61.955 7.434 7.434
162 1HB LYS 23 HB2 LYS 23 59.588 7.170 7.170
163 2HB LYS 23 HB1 LYS 23 59.338 7.935 7.935
164 1HG LYS 23 HG2 LYS 23 60.743 9.586 9.586
165 2HG LYS 23 HG1 LYS 23 59.044 9.249 9.249
166 1HD LYS 23 HD2 LYS 23 58.786 9.890 9.890
167 2HD LYS 23 HD1 LYS 23 60.266 10.794 10.794
168 1HE LYS 23 HE2 LYS 23 59.175 11.980 11.980
169 2HE LYS 23 HE1 LYS 23 57.695 11.030 11.030
170 1HZ LYS 23 HZ1 LYS 23 58.872 12.363 12.363
171 2HZ LYS 23 HZ3 LYS 23 58.045 13.333 13.333
172 3HZ LYS 23 HZ2 LYS 23 57.241 12.047 12.047
173 H ALA 24 HN ALA 24 60.923 8.658 8.658
174 HA ALA 24 HA ALA 24 62.045 11.291 11.291
175 1HB ALA 24 HB3 ALA 24 61.416 9.592 9.592
176 2HB ALA 24 HB2 ALA 24 61.731 11.327 11.327
177 3HB ALA 24 HB1 ALA 24 60.312 10.708 10.708
178 H ALA 25 HN ALA 25 63.331 8.233 8.233
179 HA ALA 25 HA ALA 25 65.838 9.425 9.425
180 1HB ALA 25 HB3 ALA 25 64.802 6.609 6.609
181 2HB ALA 25 HB2 ALA 25 66.399 6.949 6.949
182 3HB ALA 25 HB1 ALA 25 64.955 7.475 7.475
183 H PHE 26 HN PHE 26 64.673 7.823 7.823
184 HA PHE 26 HA PHE 26 67.174 7.213 7.213
185 1HB PHE 26 HB2 PHE 26 64.922 6.437 6.437
186 2HB PHE 26 HB1 PHE 26 64.537 8.079 8.079
187 HD1 PHE 26 HD1 PHE 26 65.691 9.098 9.098
188 HD2 PHE 26 HD2 PHE 26 66.453 5.042 5.042
189 HE1 PHE 26 HE1 PHE 26 66.793 8.667 8.667
190 HE2 PHE 26 HE2 PHE 26 67.556 4.611 4.611
191 HZ PHE 26 HZ PHE 26 67.726 6.424 6.424
192 H ASP 27 HN ASP 27 65.370 10.234 10.234
193 HA ASP 27 HA ASP 27 66.839 11.696 11.696
194 1HB ASP 27 HB2 ASP 27 64.635 12.039 12.039
195 2HB ASP 27 HB1 ASP 27 65.787 13.278 13.278
196 H MET 28 HN MET 28 67.829 10.444 10.444
197 HA MET 28 HA MET 28 69.360 12.451 12.451
198 1HB MET 28 HB2 MET 28 69.730 9.477 9.477
199 2HB MET 28 HB1 MET 28 70.824 10.415 10.415
200 1HG MET 28 HG2 MET 28 67.824 10.474 10.474
201 2HG MET 28 HG1 MET 28 68.857 9.308 9.308
202 1HE MET 28 HE2 MET 28 67.261 12.524 12.524
203 2HE MET 28 HE1 MET 28 66.914 11.688 11.688
204 3HE MET 28 HE3 MET 28 67.697 13.275 13.275
205 H PHE 29 HN PHE 29 70.003 10.664 10.664
206 HA PHE 29 HA PHE 29 72.541 12.239 12.239
207 1HB PHE 29 HB2 PHE 29 72.043 9.559 9.559
208 2HB PHE 29 HB1 PHE 29 73.579 10.312 10.312
209 HD1 PHE 29 HD2 PHE 29 70.632 8.507 8.507
210 HD2 PHE 29 HD1 PHE 29 74.471 10.184 10.184
211 HE1 PHE 29 HE2 PHE 29 70.613 7.314 7.314
212 HE2 PHE 29 HE1 PHE 29 74.450 8.990 8.990
213 HZ PHE 29 HZ PHE 29 72.522 7.554 7.554
214 H ASP 30 HN ASP 30 69.720 12.815 12.815
215 HA ASP 30 HA ASP 30 70.055 12.571 12.571
216 1HB ASP 30 HB2 ASP 30 67.773 12.928 12.928
217 2HB ASP 30 HB1 ASP 30 67.566 13.397 13.397
218 H ALA 31 HN ALA 31 71.409 14.590 14.590
219 HA ALA 31 HA ALA 31 70.307 17.168 17.168
220 1HB ALA 31 HB3 ALA 31 72.531 16.164 16.164
221 2HB ALA 31 HB2 ALA 31 73.212 16.635 16.635
222 3HB ALA 31 HB1 ALA 31 72.502 17.856 17.856
223 H ASP 32 HN ASP 32 71.999 15.334 15.334
224 HA ASP 32 HA ASP 32 71.213 17.470 17.470
225 1HB ASP 32 HB2 ASP 32 73.349 17.189 17.189
226 2HB ASP 32 HB1 ASP 32 73.675 17.273 17.273
227 H GLY 33 HN GLY 33 70.341 14.520 14.520
228 1HA GLY 33 HA2 GLY 33 70.232 13.364 13.364
229 2HA GLY 33 HA1 GLY 33 70.064 12.428 12.428
230 H GLY 34 HN GLY 34 68.306 14.568 14.568
231 1HA GLY 34 HA2 GLY 34 66.039 15.235 15.235
232 2HA GLY 34 HA1 GLY 34 65.948 14.664 14.664
233 H GLY 35 HN GLY 35 66.186 12.133 12.133
234 1HA GLY 35 HA2 GLY 35 64.773 10.859 10.859
235 2HA GLY 35 HA1 GLY 35 64.117 10.679 10.679
236 H ASP 36 HN ASP 36 67.570 10.802 10.802
237 HA ASP 36 HA ASP 36 67.887 7.878 7.878
238 1HB ASP 36 HB2 ASP 36 68.958 7.840 7.840
239 2HB ASP 36 HB1 ASP 36 67.269 8.341 8.341
240 H ILE 37 HN ILE 37 69.714 7.568 7.568
241 HA ILE 37 HA ILE 37 71.705 9.772 9.772
242 HB ILE 37 HB ILE 37 72.360 8.623 8.623
243 1HG1 ILE 37 HG12 ILE 37 70.604 6.365 6.365
244 2HG1 ILE 37 HG11 ILE 37 72.361 6.332 6.332
245 1HG2 ILE 37 HG22 ILE 37 70.041 9.819 9.819
246 2HG2 ILE 37 HG21 ILE 37 69.385 8.189 8.189
247 3HG2 ILE 37 HG23 ILE 37 70.378 8.853 8.853
248 HD1 ILE 37 HD1 ILE 37 70.484 5.600 5.600
249 HD1 ILE 37 HD1 ILE 37 71.160 7.138 7.138
250 HD1 ILE 37 HD1 ILE 37 72.227 5.773 5.773
251 H SER 38 HN SER 38 74.050 9.087 9.087
252 HA SER 38 HA SER 38 74.839 7.778 7.778
253 1HB SER 38 HB2 SER 38 76.036 8.746 8.746
254 2HB SER 38 HB1 SER 38 76.963 7.473 7.473
255 HG SER 38 HG SER 38 77.515 9.565 9.565
256 H THR 39 HN THR 39 74.945 5.629 5.629
257 HA THR 39 HA THR 39 73.864 3.504 3.504
258 HB THR 39 HB THR 39 75.537 2.136 2.136
259 HG1 THR 39 HG1 THR 39 77.026 4.083 4.083
260 1HG2 THR 39 HG21 THR 39 73.561 4.124 4.124
261 2HG2 THR 39 HG23 THR 39 74.677 3.552 3.552
262 3HG2 THR 39 HG22 THR 39 73.679 2.400 2.400
263 H LYS 40 HN LYS 40 77.046 4.952 4.952
264 HA LYS 40 HA LYS 40 78.173 2.856 2.856
265 1HB LYS 40 HB2 LYS 40 78.771 5.536 5.536
266 2HB LYS 40 HB1 LYS 40 79.252 5.349 5.349
267 1HG LYS 40 HG2 LYS 40 80.799 3.698 3.698
268 2HG LYS 40 HG1 LYS 40 79.926 3.145 3.145
269 1HD LYS 40 HD2 LYS 40 82.073 4.355 4.355
270 2HD LYS 40 HD1 LYS 40 80.645 5.080 5.080
271 1HE LYS 40 HE2 LYS 40 82.200 6.755 6.755
272 2HE LYS 40 HE1 LYS 40 80.546 6.787 6.787
273 1HZ LYS 40 HZ1 LYS 40 82.477 4.912 4.912
274 2HZ LYS 40 HZ3 LYS 40 82.585 6.547 6.547
275 3HZ LYS 40 HZ2 LYS 40 81.149 5.685 5.685
276 H GLU 41 HN GLU 41 75.732 5.203 5.203
277 HA GLU 41 HA GLU 41 76.075 4.914 4.914
278 1HB GLU 41 HB2 GLU 41 76.083 7.190 7.190
279 2HB GLU 41 HB1 GLU 41 74.440 6.888 6.888
280 1HG GLU 41 HG2 GLU 41 73.865 7.875 7.875
281 2HG GLU 41 HG1 GLU 41 74.163 6.263 6.263
282 H LEU 42 HN LEU 42 74.296 3.700 3.700
283 HA LEU 42 HA LEU 42 71.630 3.588 3.588
284 1HB LEU 42 HB2 LEU 42 72.069 3.028 3.028
285 2HB LEU 42 HB1 LEU 42 73.321 1.870 1.870
286 HG LEU 42 HG LEU 42 70.680 1.295 1.295
287 HD1 LEU 42 HD1 LEU 42 69.444 1.386 1.386
288 HD1 LEU 42 HD1 LEU 42 70.564 0.272 0.272
289 HD1 LEU 42 HD1 LEU 42 70.830 2.011 2.011
290 HD2 LEU 42 HD2 LEU 42 72.847 -0.217 -0.217
291 HD2 LEU 42 HD2 LEU 42 71.328 -0.980 -0.980
292 HD2 LEU 42 HD2 LEU 42 72.412 -0.332 -0.332
293 H GLY 43 HN GLY 43 74.507 1.816 1.816
294 1HA GLY 43 HA2 GLY 43 73.063 -0.358 -0.358
295 2HA GLY 43 HA1 GLY 43 74.793 -0.039 -0.039
296 H THR 44 HN THR 44 74.169 2.831 2.831
297 HA THR 44 HA THR 44 74.109 2.453 2.453
298 HB THR 44 HB THR 44 74.108 4.807 4.807
299 HG1 THR 44 HG1 THR 44 76.209 4.994 4.994
300 1HG2 THR 44 HG22 THR 44 73.817 4.731 4.731
301 2HG2 THR 44 HG21 THR 44 74.726 6.043 6.043
302 3HG2 THR 44 HG23 THR 44 73.030 5.792 5.792
303 H VAL 45 HN VAL 45 71.898 4.160 4.160
304 HA VAL 45 HA VAL 45 69.868 4.885 4.885
305 HB VAL 45 HB VAL 45 69.951 5.450 5.450
306 1HG1 VAL 45 HG13 VAL 45 70.741 3.053 3.053
307 2HG1 VAL 45 HG12 VAL 45 69.026 2.649 2.649
308 3HG1 VAL 45 HG11 VAL 45 69.670 3.865 3.865
309 1HG2 VAL 45 HG21 VAL 45 67.723 5.146 5.146
310 2HG2 VAL 45 HG23 VAL 45 67.645 5.470 5.470
311 3HG2 VAL 45 HG22 VAL 45 67.441 3.824 3.824
312 H MET 46 HN MET 46 70.242 1.714 1.714
313 HA MET 46 HA MET 46 67.900 0.562 0.562
314 1HB MET 46 HB2 MET 46 68.832 -1.526 -1.526
315 2HB MET 46 HB1 MET 46 68.801 -0.205 -0.205
316 1HG MET 46 HG2 MET 46 71.085 -0.022 -0.022
317 2HG MET 46 HG1 MET 46 71.271 -0.469 -0.469
318 1HE MET 46 HE3 MET 46 69.123 -1.968 -1.968
319 2HE MET 46 HE2 MET 46 70.520 -2.001 -2.001
320 3HE MET 46 HE1 MET 46 69.845 -3.513 -3.513
321 H ARG 47 HN ARG 47 71.293 0.881 0.881
322 HA ARG 47 HA ARG 47 71.215 -1.132 -1.132
323 1HB ARG 47 HB2 ARG 47 73.221 -0.537 -0.537
324 2HB ARG 47 HB1 ARG 47 73.213 1.064 1.064
325 1HG ARG 47 HG2 ARG 47 73.052 -0.824 -0.824
326 2HG ARG 47 HG1 ARG 47 74.332 -1.372 -1.372
327 1HD ARG 47 HD2 ARG 47 74.681 1.419 1.419
328 2HD ARG 47 HD1 ARG 47 74.366 0.863 0.863
329 HE ARG 47 HE ARG 47 76.742 0.271 0.271
330 1HH1 ARG 47 HH2 ARG 47 75.529 -0.139 -0.139
331 2HH1 ARG 47 HH2 ARG 47 76.094 -1.755 -1.755
332 1HH2 ARG 47 HH1 ARG 47 76.989 -2.252 -2.252
333 2HH2 ARG 47 HH1 ARG 47 76.922 -2.952 -2.952
334 H MET 48 HN MET 48 71.393 2.437 2.437
335 HA MET 48 HA MET 48 71.187 2.865 2.865
336 1HB MET 48 HB2 MET 48 71.884 4.336 4.336
337 2HB MET 48 HB1 MET 48 70.216 4.883 4.883
338 1HG MET 48 HG2 MET 48 71.261 6.376 6.376
339 2HG MET 48 HG1 MET 48 70.926 5.071 5.071
340 1HE MET 48 HE1 MET 48 72.192 4.615 4.615
341 2HE MET 48 HE3 MET 48 73.938 4.346 4.346
342 3HE MET 48 HE2 MET 48 73.291 5.981 5.981
343 H LEU 49 HN LEU 49 68.943 1.747 1.747
344 HA LEU 49 HA LEU 49 66.564 3.028 3.028
345 1HB LEU 49 HB2 LEU 49 67.346 1.471 1.471
346 2HB LEU 49 HB1 LEU 49 65.834 0.882 0.882
347 HG LEU 49 HG LEU 49 64.776 2.994 2.994
348 HD1 LEU 49 HD1 LEU 49 67.500 3.971 3.971
349 HD1 LEU 49 HD1 LEU 49 65.982 4.830 4.830
350 HD1 LEU 49 HD1 LEU 49 66.672 4.739 4.739
351 HD2 LEU 49 HD2 LEU 49 64.603 2.404 2.404
352 HD2 LEU 49 HD2 LEU 49 66.298 1.927 1.927
353 HD2 LEU 49 HD2 LEU 49 65.848 3.620 3.620
354 H GLY 50 HN GLY 50 68.535 0.313 0.313
355 1HA GLY 50 HA2 GLY 50 67.893 -0.697 -0.697
356 2HA GLY 50 HA1 GLY 50 66.310 -0.965 -0.965
357 H GLN 51 HN GLN 51 69.109 -1.382 -1.382
358 HA GLN 51 HA GLN 51 68.874 -4.355 -4.355
359 1HB GLN 51 HB2 GLN 51 69.145 -2.771 -2.771
360 2HB GLN 51 HB1 GLN 51 68.952 -4.519 -4.519
361 1HG GLN 51 HG2 GLN 51 66.734 -4.089 -4.089
362 2HG GLN 51 HG1 GLN 51 66.822 -3.611 -3.611
363 1HE2 GLN 51 HE22 GLN 51 66.169 -0.798 -0.798
364 2HE2 GLN 51 HE21 GLN 51 66.331 -2.441 -2.441
365 H ASN 52 HN ASN 52 70.829 -5.122 -5.122
366 HA ASN 52 HA ASN 52 73.289 -3.560 -3.560
367 1HB ASN 52 HB2 ASN 52 72.394 -5.431 -5.431
368 2HB ASN 52 HB1 ASN 52 73.667 -6.262 -6.262
369 HD2 ASN 52 HD2 ASN 52 73.010 -3.194 -3.194
370 HD2 ASN 52 HD2 ASN 52 74.626 -2.928 -2.928
371 HA PRO 53 HA PRO 53 73.330 -6.070 -6.070
372 1HB PRO 53 HB2 PRO 53 74.544 -4.155 -4.155
373 2HB PRO 53 HB1 PRO 53 72.792 -4.196 -4.196
374 1HG PRO 53 HG2 PRO 53 74.871 -2.493 -2.493
375 2HG PRO 53 HG1 PRO 53 73.212 -2.092 -2.092
376 1HD PRO 53 HD2 PRO 53 74.000 -2.642 -2.642
377 2HD PRO 53 HD1 PRO 53 72.343 -2.862 -2.862
378 H THR 54 HN THR 54 75.034 -7.478 -7.478
379 HA THR 54 HA THR 54 77.543 -7.209 -7.209
380 HB THR 54 HB THR 54 78.136 -9.158 -9.158
381 HG1 THR 54 HG1 THR 54 77.239 -9.170 -9.170
382 1HG2 THR 54 HG21 THR 54 76.430 -9.161 -9.161
383 2HG2 THR 54 HG23 THR 54 75.255 -9.526 -9.526
384 3HG2 THR 54 HG22 THR 54 76.625 -10.605 -10.605
385 H LYS 55 HN LYS 55 79.496 -6.323 -6.323
386 HA LYS 55 HA LYS 55 79.677 -4.259 -4.259
387 1HB LYS 55 HB2 LYS 55 81.381 -4.986 -4.986
388 2HB LYS 55 HB1 LYS 55 81.803 -6.335 -6.335
389 1HG LYS 55 HG2 LYS 55 82.499 -4.820 -4.820
390 2HG LYS 55 HG1 LYS 55 81.916 -3.428 -3.428
391 1HD LYS 55 HD2 LYS 55 83.544 -4.107 -4.107
392 2HD LYS 55 HD1 LYS 55 84.244 -5.236 -5.236
393 1HE LYS 55 HE2 LYS 55 85.568 -3.277 -3.277
394 2HE LYS 55 HE1 LYS 55 84.402 -3.157 -3.157
395 1HZ LYS 55 HZ1 LYS 55 83.570 -2.137 -2.137
396 2HZ LYS 55 HZ3 LYS 55 84.713 -1.214 -1.214
397 3HZ LYS 55 HZ2 LYS 55 83.207 -1.558 -1.558
398 H GLU 56 HN GLU 56 80.066 -7.742 -7.742
399 HA GLU 56 HA GLU 56 80.845 -7.437 -7.437
400 1HB GLU 56 HB2 GLU 56 80.167 -9.539 -9.539
401 2HB GLU 56 HB1 GLU 56 79.723 -9.945 -9.945
402 1HG GLU 56 HG2 GLU 56 82.293 -8.742 -8.742
403 2HG GLU 56 HG1 GLU 56 82.336 -9.927 -9.927
404 H GLU 57 HN GLU 57 77.836 -7.141 -7.141
405 HA GLU 57 HA GLU 57 76.183 -7.879 -7.879
406 1HB GLU 57 HB2 GLU 57 75.873 -7.197 -7.197
407 2HB GLU 57 HB1 GLU 57 74.552 -6.643 -6.643
408 1HG GLU 57 HG2 GLU 57 75.460 -9.387 -9.387
409 2HG GLU 57 HG1 GLU 57 74.753 -9.177 -9.177
410 H LEU 58 HN LEU 58 77.359 -4.945 -4.945
411 HA LEU 58 HA LEU 58 75.707 -3.066 -3.066
412 1HB LEU 58 HB2 LEU 58 78.483 -2.794 -2.794
413 2HB LEU 58 HB1 LEU 58 77.390 -1.460 -1.460
414 HG LEU 58 HG LEU 58 77.014 -3.644 -3.644
415 HD1 LEU 58 HD1 LEU 58 77.899 -2.036 -2.036
416 HD1 LEU 58 HD1 LEU 58 76.421 -1.115 -1.115
417 HD1 LEU 58 HD1 LEU 58 77.829 -0.848 -0.848
418 HD2 LEU 58 HD2 LEU 58 75.034 -1.869 -1.869
419 HD2 LEU 58 HD2 LEU 58 74.822 -2.167 -2.167
420 HD2 LEU 58 HD2 LEU 58 74.836 -3.518 -3.518
421 H ASP 59 HN ASP 59 79.107 -4.085 -4.085
422 HA ASP 59 HA ASP 59 79.428 -2.641 -2.641
423 1HB ASP 59 HB2 ASP 59 81.481 -3.913 -3.913
424 2HB ASP 59 HB1 ASP 59 81.194 -3.561 -3.561
425 H ALA 60 HN ALA 60 77.888 -5.651 -5.651
426 HA ALA 60 HA ALA 60 78.022 -6.746 -6.746
427 1HB ALA 60 HB2 ALA 60 77.072 -7.513 -7.513
428 2HB ALA 60 HB1 ALA 60 76.170 -8.215 -8.215
429 3HB ALA 60 HB3 ALA 60 77.907 -8.483 -8.483
430 H ILE 61 HN ILE 61 75.525 -5.309 -5.309
431 HA ILE 61 HA ILE 61 73.415 -5.489 -5.489
432 HB ILE 61 HB ILE 61 73.861 -4.017 -4.017
433 1HG1 ILE 61 HG12 ILE 61 71.587 -5.839 -5.839
434 2HG1 ILE 61 HG11 ILE 61 73.131 -6.626 -6.626
435 1HG2 ILE 61 HG23 ILE 61 71.705 -3.682 -3.682
436 2HG2 ILE 61 HG22 ILE 61 71.214 -3.749 -3.749
437 3HG2 ILE 61 HG21 ILE 61 72.353 -2.515 -2.515
438 HD1 ILE 61 HD1 ILE 61 73.549 -6.715 -6.715
439 HD1 ILE 61 HD1 ILE 61 72.019 -5.904 -5.904
440 HD1 ILE 61 HD1 ILE 61 73.484 -4.955 -4.955
441 H ILE 62 HN ILE 62 75.340 -2.732 -2.732
442 HA ILE 62 HA ILE 62 74.401 -0.622 -0.622
443 HB ILE 62 HB ILE 62 77.195 -1.511 -1.511
444 1HG1 ILE 62 HG12 ILE 62 75.333 0.647 0.647
445 2HG1 ILE 62 HG11 ILE 62 75.653 -0.904 -0.904
446 1HG2 ILE 62 HG21 ILE 62 76.388 0.626 0.626
447 2HG2 ILE 62 HG23 ILE 62 77.280 1.243 1.243
448 3HG2 ILE 62 HG22 ILE 62 78.002 0.010 0.010
449 HD1 ILE 62 HD1 ILE 62 77.519 1.433 1.433
450 HD1 ILE 62 HD1 ILE 62 78.150 -0.191 -0.191
451 HD1 ILE 62 HD1 ILE 62 77.121 0.564 0.564
452 H GLU 63 HN GLU 63 77.028 -2.788 -2.788
453 HA GLU 63 HA GLU 63 77.311 -1.842 -1.842
454 1HB GLU 63 HB2 GLU 63 78.472 -3.724 -3.724
455 2HB GLU 63 HB1 GLU 63 77.312 -4.784 -4.784
456 1HG GLU 63 HG2 GLU 63 78.092 -3.972 -3.972
457 2HG GLU 63 HG1 GLU 63 79.262 -2.927 -2.927
458 H GLU 64 HN GLU 64 74.890 -4.156 -4.156
459 HA GLU 64 HA GLU 64 73.758 -4.764 -4.764
460 1HB GLU 64 HB2 GLU 64 72.579 -6.240 -6.240
461 2HB GLU 64 HB1 GLU 64 73.606 -5.702 -5.702
462 1HG GLU 64 HG2 GLU 64 71.927 -3.998 -3.998
463 2HG GLU 64 HG1 GLU 64 70.901 -4.526 -4.526
464 H VAL 65 HN VAL 65 73.001 -2.345 -2.345
465 HA VAL 65 HA VAL 65 70.745 -1.294 -1.294
466 HB VAL 65 HB VAL 65 70.462 0.153 0.153
467 1HG1 VAL 65 HG11 VAL 65 70.240 -2.681 -2.681
468 2HG1 VAL 65 HG13 VAL 65 70.795 -2.294 -2.294
469 3HG1 VAL 65 HG12 VAL 65 69.304 -1.581 -1.581
470 1HG2 VAL 65 HG22 VAL 65 73.034 0.124 0.124
471 2HG2 VAL 65 HG21 VAL 65 71.974 0.100 0.100
472 3HG2 VAL 65 HG23 VAL 65 72.732 -1.392 -1.392
473 H ASP 66 HN ASP 66 74.076 -0.891 -0.891
474 HA ASP 66 HA ASP 66 74.313 1.980 1.980
475 1HB ASP 66 HB2 ASP 66 75.998 -0.074 -0.074
476 2HB ASP 66 HB1 ASP 66 76.242 0.115 0.115
477 H GLU 67 HN GLU 67 73.042 -0.378 -0.378
478 HA GLU 67 HA GLU 67 73.872 0.805 0.805
479 1HB GLU 67 HB2 GLU 67 72.293 -1.434 -1.434
480 2HB GLU 67 HB1 GLU 67 71.588 -0.724 -0.724
481 1HG GLU 67 HG2 GLU 67 74.064 -0.798 -0.798
482 2HG GLU 67 HG1 GLU 67 74.268 -2.029 -2.029
483 H ASP 68 HN ASP 68 72.937 2.939 2.939
484 HA ASP 68 HA ASP 68 70.161 3.427 3.427
485 1HB ASP 68 HB2 ASP 68 69.963 4.958 4.958
486 2HB ASP 68 HB1 ASP 68 70.679 3.476 3.476
487 H GLY 69 HN GLY 69 73.459 4.280 4.280
488 1HA GLY 69 HA2 GLY 69 73.785 5.643 5.643
489 2HA GLY 69 HA1 GLY 69 72.695 6.810 6.810
490 H SER 70 HN SER 70 73.550 7.040 7.040
491 HA SER 70 HA SER 70 76.369 8.004 8.004
492 1HB SER 70 HB2 SER 70 74.902 9.813 9.813
493 2HB SER 70 HB1 SER 70 73.955 8.880 8.880
494 HG SER 70 HG SER 70 76.253 10.328 10.328
495 H GLY 71 HN GLY 71 74.233 6.960 6.960
496 1HA GLY 71 HA2 GLY 71 75.433 4.673 4.673
497 2HA GLY 71 HA1 GLY 71 76.547 5.911 5.911
498 H THR 72 HN THR 72 73.018 6.174 6.174
499 HA THR 72 HA THR 72 72.929 6.516 6.516
500 HB THR 72 HB THR 72 70.820 7.915 7.915
501 HG1 THR 72 HG1 THR 72 71.216 8.799 8.799
502 1HG2 THR 72 HG22 THR 72 73.594 8.502 8.502
503 2HG2 THR 72 HG21 THR 72 72.969 9.604 9.604
504 3HG2 THR 72 HG23 THR 72 72.181 9.498 9.498
505 H ILE 73 HN ILE 73 70.607 6.083 6.083
506 HA ILE 73 HA ILE 73 69.422 3.741 3.741
507 HB ILE 73 HB ILE 73 70.770 3.179 3.179
508 1HG1 ILE 73 HG12 ILE 73 68.616 2.206 2.206
509 2HG1 ILE 73 HG11 ILE 73 67.839 2.682 2.682
510 1HG2 ILE 73 HG22 ILE 73 69.702 5.506 5.506
511 2HG2 ILE 73 HG21 ILE 73 68.763 4.269 4.269
512 3HG2 ILE 73 HG23 ILE 73 70.523 4.272 4.272
513 HD1 ILE 73 HD1 ILE 73 70.237 1.433 1.433
514 HD1 ILE 73 HD1 ILE 73 68.609 0.769 0.769
515 HD1 ILE 73 HD1 ILE 73 69.583 0.424 0.424
516 H ASP 74 HN ASP 74 67.196 3.819 3.819
517 HA ASP 74 HA ASP 74 65.800 6.290 6.290
518 1HB ASP 74 HB2 ASP 74 65.165 3.772 3.772
519 2HB ASP 74 HB1 ASP 74 63.920 4.976 4.976
520 H PHE 75 HN PHE 75 64.482 6.498 6.498
521 HA PHE 75 HA PHE 75 64.401 4.823 4.823
522 1HB PHE 75 HB2 PHE 75 63.409 7.147 7.147
523 2HB PHE 75 HB1 PHE 75 61.997 6.342 6.342
524 HD1 PHE 75 HD1 PHE 75 64.107 6.597 6.597
525 HD2 PHE 75 HD2 PHE 75 60.362 5.319 5.319
526 HE1 PHE 75 HE1 PHE 75 63.233 6.176 6.176
527 HE2 PHE 75 HE2 PHE 75 59.487 4.899 4.899
528 HZ PHE 75 HZ PHE 75 60.924 5.327 5.327
529 H GLU 76 HN GLU 76 61.969 4.788 4.788
530 HA GLU 76 HA GLU 76 60.415 2.614 2.614
531 1HB GLU 76 HB2 GLU 76 59.792 2.431 2.431
532 2HB GLU 76 HB1 GLU 76 59.946 4.129 4.129
533 1HG GLU 76 HG2 GLU 76 62.304 4.076 4.076
534 2HG GLU 76 HG1 GLU 76 61.988 2.448 2.448
535 H GLU 77 HN GLU 77 63.380 2.567 2.567
536 HA GLU 77 HA GLU 77 63.462 -0.336 -0.336
537 1HB GLU 77 HB2 GLU 77 64.476 1.547 1.547
538 2HB GLU 77 HB1 GLU 77 65.789 1.558 1.558
539 1HG GLU 77 HG2 GLU 77 66.407 -0.662 -0.662
540 2HG GLU 77 HG1 GLU 77 64.854 -1.026 -1.026
541 H PHE 78 HN PHE 78 64.645 2.091 2.091
542 HA PHE 78 HA PHE 78 66.611 0.431 0.431
543 1HB PHE 78 HB2 PHE 78 66.838 2.776 2.776
544 2HB PHE 78 HB1 PHE 78 65.124 2.999 2.999
545 HD1 PHE 78 HD1 PHE 78 68.098 1.167 1.167
546 HD2 PHE 78 HD2 PHE 78 64.511 3.383 3.383
547 HE1 PHE 78 HE1 PHE 78 68.575 1.034 1.034
548 HE2 PHE 78 HE2 PHE 78 64.988 3.248 3.248
549 HZ PHE 78 HZ PHE 78 67.022 2.074 2.074
550 H LEU 79 HN LEU 79 63.143 0.987 0.987
551 HA LEU 79 HA LEU 79 62.557 0.087 0.087
552 1HB LEU 79 HB2 LEU 79 61.314 -0.040 -0.040
553 2HB LEU 79 HB1 LEU 79 60.645 -1.161 -1.161
554 HG LEU 79 HG LEU 79 59.412 0.929 0.929
555 HD1 LEU 79 HD1 LEU 79 60.885 1.500 1.500
556 HD1 LEU 79 HD1 LEU 79 60.835 -0.246 -0.246
557 HD1 LEU 79 HD1 LEU 79 59.334 0.679 0.679
558 HD2 LEU 79 HD2 LEU 79 60.917 2.519 2.519
559 HD2 LEU 79 HD2 LEU 79 62.182 2.117 2.117
560 HD2 LEU 79 HD2 LEU 79 60.748 2.996 2.996
561 H VAL 80 HN VAL 80 63.573 -1.871 -1.871
562 HA VAL 80 HA VAL 80 63.091 -4.456 -4.456
563 HB VAL 80 HB VAL 80 65.174 -3.546 -3.546
564 1HG1 VAL 80 HG11 VAL 80 64.080 -6.192 -6.192
565 2HG1 VAL 80 HG13 VAL 80 64.476 -5.972 -5.972
566 3HG1 VAL 80 HG12 VAL 80 65.723 -5.761 -5.761
567 1HG2 VAL 80 HG22 VAL 80 62.609 -2.976 -2.976
568 2HG2 VAL 80 HG21 VAL 80 63.539 -3.617 -3.617
569 3HG2 VAL 80 HG23 VAL 80 62.494 -4.685 -4.685
570 H MET 81 HN MET 81 66.037 -2.433 -2.433
571 HA MET 81 HA MET 81 67.810 -4.167 -4.167
572 1HB MET 81 HB2 MET 81 67.533 -1.248 -1.248
573 2HB MET 81 HB1 MET 81 68.713 -1.722 -1.722
574 1HG MET 81 HG2 MET 81 69.678 -1.605 -1.605
575 2HG MET 81 HG1 MET 81 69.829 -3.198 -3.198
576 1HE MET 81 HE3 MET 81 68.238 -0.922 -0.922
577 2HE MET 81 HE2 MET 81 69.554 -1.851 -1.851
578 3HE MET 81 HE1 MET 81 67.914 -2.043 -2.043
579 H MET 82 HN MET 82 66.399 -1.240 -1.240
580 HA MET 82 HA MET 82 66.899 -1.835 -1.835
581 1HB MET 82 HB2 MET 82 64.687 -0.492 -0.492
582 2HB MET 82 HB1 MET 82 66.017 0.285 0.285
583 1HG MET 82 HG2 MET 82 64.751 0.496 0.496
584 2HG MET 82 HG1 MET 82 64.429 -1.237 -1.237
585 1HE MET 82 HE1 MET 82 63.614 2.039 2.039
586 2HE MET 82 HE3 MET 82 63.038 2.169 2.169
587 3HE MET 82 HE2 MET 82 61.889 2.177 2.177
588 H VAL 83 HN VAL 83 64.217 -3.049 -3.049
589 HA VAL 83 HA VAL 83 62.914 -4.399 -4.399
590 HB VAL 83 HB VAL 83 62.609 -4.416 -4.416
591 1HG1 VAL 83 HG12 VAL 83 61.903 -6.591 -6.591
592 2HG1 VAL 83 HG11 VAL 83 60.764 -5.678 -5.678
593 3HG1 VAL 83 HG13 VAL 83 60.581 -5.708 -5.708
594 1HG2 VAL 83 HG21 VAL 83 61.924 -2.515 -2.515
595 2HG2 VAL 83 HG23 VAL 83 61.099 -2.739 -2.739
596 3HG2 VAL 83 HG22 VAL 83 60.447 -3.477 -3.477
597 H ARG 84 HN ARG 84 64.418 -5.641 -5.641
598 HA ARG 84 HA ARG 84 64.512 -8.349 -8.349
599 1HB ARG 84 HB2 ARG 84 66.616 -6.498 -6.498
600 2HB ARG 84 HB1 ARG 84 66.682 -8.254 -8.254
601 1HG ARG 84 HG2 ARG 84 64.212 -6.733 -6.733
602 2HG ARG 84 HG1 ARG 84 65.575 -6.908 -6.908
603 1HD ARG 84 HD2 ARG 84 65.091 -9.480 -9.480
604 2HD ARG 84 HD1 ARG 84 63.532 -8.834 -8.834
605 HE ARG 84 HE ARG 84 65.150 -8.173 -8.173
606 1HH1 ARG 84 HH2 ARG 84 67.173 -10.128 -10.128
607 2HH1 ARG 84 HH2 ARG 84 66.519 -11.586 -11.586
608 1HH2 ARG 84 HH1 ARG 84 63.239 -10.465 -10.465
609 2HH2 ARG 84 HH1 ARG 84 64.291 -11.776 -11.776
610 H GLN 85 HN GLN 85 66.610 -5.857 -5.857
611 HA GLN 85 HA GLN 85 68.309 -7.775 -7.775
612 1HB GLN 85 HB2 GLN 85 68.992 -5.487 -5.487
613 2HB GLN 85 HB1 GLN 85 67.837 -4.803 -4.803
614 1HG GLN 85 HG2 GLN 85 70.145 -4.873 -4.873
615 2HG GLN 85 HG1 GLN 85 69.023 -5.860 -5.860
616 1HE2 GLN 85 HE22 GLN 85 70.637 -8.917 -8.917
617 2HE2 GLN 85 HE21 GLN 85 69.291 -8.179 -8.179
618 H MET 86 HN MET 86 65.703 -5.525 -5.525
619 HA MET 86 HA MET 86 65.651 -6.334 -6.334
620 1HB MET 86 HB2 MET 86 64.230 -4.624 -4.624
621 2HB MET 86 HB1 MET 86 63.083 -5.473 -5.473
622 1HG MET 86 HG2 MET 86 65.163 -4.707 -4.707
623 2HG MET 86 HG1 MET 86 64.904 -3.310 -3.310
624 1HE MET 86 HE1 MET 86 64.623 -2.174 -2.174
625 2HE MET 86 HE3 MET 86 62.987 -1.531 -1.531
626 3HE MET 86 HE2 MET 86 63.662 -2.625 -2.625
627 H LYS 87 HN LYS 87 64.336 -7.761 -7.761
628 HA LYS 87 HA LYS 87 62.167 -9.272 -9.272
629 1HB LYS 87 HB2 LYS 87 64.398 -9.683 -9.683
630 2HB LYS 87 HB1 LYS 87 63.256 -10.996 -10.996
631 1HG LYS 87 HG2 LYS 87 61.943 -8.397 -8.397
632 2HG LYS 87 HG1 LYS 87 62.868 -8.883 -8.883
633 1HD LYS 87 HD2 LYS 87 61.270 -11.044 -11.044
634 2HD LYS 87 HD1 LYS 87 60.322 -9.728 -9.728
635 1HE LYS 87 HE2 LYS 87 60.617 -10.875 -10.875
636 2HE LYS 87 HE1 LYS 87 62.226 -10.124 -10.124
637 1HZ LYS 87 HZ3 LYS 87 62.841 -12.048 -12.048
638 2HZ LYS 87 HZ2 LYS 87 61.435 -12.804 -12.804
639 3HZ LYS 87 HZ1 LYS 87 62.684 -12.392 -12.392
640 H GLU 88 HN GLU 88 65.557 -9.609 -9.609
641 HA GLU 88 HA GLU 88 65.112 -12.239 -12.239
642 1HB GLU 88 HB2 GLU 88 67.623 -10.576 -10.576
643 2HB GLU 88 HB1 GLU 88 67.552 -12.274 -12.274
644 1HG GLU 88 HG2 GLU 88 66.176 -11.480 -11.480
645 2HG GLU 88 HG1 GLU 88 67.938 -11.548 -11.548
646 H ASP 89 HN ASP 89 65.993 -8.870 -8.870
647 HA ASP 89 HA ASP 89 66.423 -9.324 -9.324
648 1HB ASP 89 HB2 ASP 89 67.296 -7.505 -7.505
649 2HB ASP 89 HB1 ASP 89 65.835 -6.654 -6.654
650 H ALA 90 HN ALA 90 63.731 -8.432 -8.432
651 HA ALA 90 HA ALA 90 62.031 -7.464 -7.464
652 1HB ALA 90 HB1 ALA 90 61.548 -8.269 -8.269
653 2HB ALA 90 HB3 ALA 90 60.333 -7.510 -7.510
654 3HB ALA 90 HB2 ALA 90 61.804 -6.633 -6.633
Start of MODEL 7
1 1H ALA 1 HT3 ALA 1 65.197 -5.843 -5.843
2 2H ALA 1 HT2 ALA 1 66.496 -4.991 -4.991
3 3H ALA 1 HT1 ALA 1 66.745 -5.963 -5.963
4 HA ALA 1 HA ALA 1 66.831 -7.882 -7.882
5 1HB ALA 1 HB3 ALA 1 68.194 -5.767 -5.767
6 2HB ALA 1 HB2 ALA 1 67.255 -6.214 -6.214
7 3HB ALA 1 HB1 ALA 1 68.330 -7.392 -7.392
8 H SER 2 HN SER 2 66.357 -8.523 -8.523
9 HA SER 2 HA SER 2 63.414 -8.686 -8.686
10 1HB SER 2 HB2 SER 2 65.675 -10.194 -10.194
11 2HB SER 2 HB1 SER 2 64.705 -9.812 -9.812
12 HG SER 2 HG SER 2 64.232 -11.720 -11.720
13 H MET 3 HN MET 3 65.749 -6.554 -6.554
14 HA MET 3 HA MET 3 64.980 -5.908 -5.908
15 1HB MET 3 HB2 MET 3 66.207 -4.594 -4.594
16 2HB MET 3 HB1 MET 3 65.526 -3.484 -3.484
17 1HG MET 3 HG2 MET 3 67.071 -4.035 -4.035
18 2HG MET 3 HG1 MET 3 67.113 -5.730 -5.730
19 1HE MET 3 HE1 MET 3 68.773 -2.534 -2.534
20 2HE MET 3 HE3 MET 3 69.763 -2.291 -2.291
21 3HE MET 3 HE2 MET 3 68.014 -2.094 -2.094
22 H THR 4 HN THR 4 63.555 -4.774 -4.774
23 HA THR 4 HA THR 4 61.654 -2.951 -2.951
24 HB THR 4 HB THR 4 61.769 -4.858 -4.858
25 HG1 THR 4 HG1 THR 4 61.679 -2.043 -2.043
26 1HG2 THR 4 HG23 THR 4 59.540 -2.979 -2.979
27 2HG2 THR 4 HG22 THR 4 59.824 -3.430 -3.430
28 3HG2 THR 4 HG21 THR 4 59.425 -4.668 -4.668
29 H ASP 5 HN ASP 5 61.692 -6.447 -6.447
30 HA ASP 5 HA ASP 5 58.843 -6.708 -6.708
31 1HB ASP 5 HB2 ASP 5 60.903 -8.329 -8.329
32 2HB ASP 5 HB1 ASP 5 60.661 -8.889 -8.889
33 H GLN 6 HN GLN 6 61.928 -6.876 -6.876
34 HA GLN 6 HA GLN 6 60.637 -7.307 -7.307
35 1HB GLN 6 HB2 GLN 6 63.047 -7.836 -7.836
36 2HB GLN 6 HB1 GLN 6 63.404 -6.200 -6.200
37 1HG GLN 6 HG2 GLN 6 63.878 -7.355 -7.355
38 2HG GLN 6 HG1 GLN 6 62.155 -7.072 -7.072
39 1HE2 GLN 6 HE22 GLN 6 61.449 -10.512 -10.512
40 2HE2 GLN 6 HE21 GLN 6 61.011 -8.933 -8.933
41 H GLN 7 HN GLN 7 60.909 -4.597 -4.597
42 HA GLN 7 HA GLN 7 61.335 -2.564 -2.564
43 1HB GLN 7 HB2 GLN 7 61.478 -2.753 -2.753
44 2HB GLN 7 HB1 GLN 7 60.002 -1.816 -1.816
45 1HG GLN 7 HG2 GLN 7 61.485 -0.473 -0.473
46 2HG GLN 7 HG1 GLN 7 62.819 -1.137 -1.137
47 1HE2 GLN 7 HE22 GLN 7 60.993 0.477 0.477
48 2HE2 GLN 7 HE21 GLN 7 61.007 -1.143 -1.143
49 H ALA 8 HN ALA 8 58.614 -4.344 -4.344
50 HA ALA 8 HA ALA 8 56.614 -2.393 -2.393
51 1HB ALA 8 HB1 ALA 8 56.799 -4.575 -4.575
52 2HB ALA 8 HB3 ALA 8 55.521 -4.944 -4.944
53 3HB ALA 8 HB2 ALA 8 55.458 -3.450 -3.450
54 H GLU 9 HN GLU 9 57.684 -5.711 -5.711
55 HA GLU 9 HA GLU 9 55.952 -5.820 -5.820
56 1HB GLU 9 HB2 GLU 9 58.023 -7.565 -7.565
57 2HB GLU 9 HB1 GLU 9 57.386 -7.986 -7.986
58 1HG GLU 9 HG2 GLU 9 55.051 -7.576 -7.576
59 2HG GLU 9 HG1 GLU 9 55.957 -7.856 -7.856
60 H ALA 10 HN ALA 10 58.814 -4.243 -4.243
61 HA ALA 10 HA ALA 10 60.258 -4.857 -4.857
62 1HB ALA 10 HB2 ALA 10 60.558 -3.282 -3.282
63 2HB ALA 10 HB1 ALA 10 61.235 -2.480 -2.480
64 3HB ALA 10 HB3 ALA 10 61.792 -4.092 -4.092
65 H ARG 11 HN ARG 11 57.814 -2.545 -2.545
66 HA ARG 11 HA ARG 11 58.233 -0.947 -0.947
67 1HB ARG 11 HB2 ARG 11 56.014 -0.126 -0.126
68 2HB ARG 11 HB1 ARG 11 57.437 0.786 0.786
69 1HG ARG 11 HG2 ARG 11 57.796 0.687 0.687
70 2HG ARG 11 HG1 ARG 11 58.611 -0.802 -0.802
71 1HD ARG 11 HD2 ARG 11 57.220 -1.730 -1.730
72 2HD ARG 11 HD1 ARG 11 56.034 -1.691 -1.691
73 HE ARG 11 HE ARG 11 56.291 0.428 0.428
74 1HH1 ARG 11 HH1 ARG 11 55.083 1.530 1.530
75 2HH1 ARG 11 HH1 ARG 11 53.398 1.184 1.184
76 1HH2 ARG 11 HH2 ARG 11 53.903 -1.206 -1.206
77 2HH2 ARG 11 HH2 ARG 11 52.730 -0.366 -0.366
78 H ALA 12 HN ALA 12 55.791 -2.938 -2.938
79 HA ALA 12 HA ALA 12 53.579 -2.596 -2.596
80 1HB ALA 12 HB2 ALA 12 54.732 -4.987 -4.987
81 2HB ALA 12 HB1 ALA 12 53.157 -5.042 -5.042
82 3HB ALA 12 HB3 ALA 12 53.438 -3.916 -3.916
83 H PHE 13 HN PHE 13 56.401 -4.733 -4.733
84 HA PHE 13 HA PHE 13 55.577 -6.123 -6.123
85 1HB PHE 13 HB2 PHE 13 57.598 -6.687 -6.687
86 2HB PHE 13 HB1 PHE 13 58.250 -5.062 -5.062
87 HD1 PHE 13 HD1 PHE 13 57.245 -8.148 -8.148
88 HD2 PHE 13 HD2 PHE 13 59.446 -4.462 -4.462
89 HE1 PHE 13 HE1 PHE 13 58.277 -8.842 -8.842
90 HE2 PHE 13 HE2 PHE 13 60.478 -5.155 -5.155
91 HZ PHE 13 HZ PHE 13 59.894 -7.346 -7.346
92 H LEU 14 HN LEU 14 56.836 -2.826 -2.826
93 HA LEU 14 HA LEU 14 56.822 -2.460 -2.460
94 1HB LEU 14 HB2 LEU 14 57.552 -0.575 -0.575
95 2HB LEU 14 HB1 LEU 14 57.959 -0.375 -0.375
96 HG LEU 14 HG LEU 14 58.855 -2.728 -2.728
97 HD1 LEU 14 HD1 LEU 14 60.382 -1.322 -1.322
98 HD1 LEU 14 HD1 LEU 14 61.063 -1.158 -1.158
99 HD1 LEU 14 HD1 LEU 14 59.857 -0.005 -0.005
100 HD2 LEU 14 HD2 LEU 14 59.931 -1.731 -1.731
101 HD2 LEU 14 HD2 LEU 14 60.241 -3.282 -3.282
102 HD2 LEU 14 HD2 LEU 14 58.649 -2.938 -2.938
103 H SER 15 HN SER 15 54.836 -1.941 -1.941
104 HA SER 15 HA SER 15 52.598 -0.944 -0.944
105 1HB SER 15 HB2 SER 15 51.595 -0.990 -0.990
106 2HB SER 15 HB1 SER 15 52.995 -2.010 -2.010
107 HG SER 15 HG SER 15 52.722 0.772 0.772
108 H GLU 16 HN GLU 16 51.557 1.270 1.270
109 HA GLU 16 HA GLU 16 53.073 3.417 3.417
110 1HB GLU 16 HB2 GLU 16 50.578 3.227 3.227
111 2HB GLU 16 HB1 GLU 16 50.840 3.539 3.539
112 1HG GLU 16 HG2 GLU 16 51.818 5.710 5.710
113 2HG GLU 16 HG1 GLU 16 51.736 5.395 5.395
114 H GLU 17 HN GLU 17 52.376 2.680 2.680
115 HA GLU 17 HA GLU 17 53.742 4.712 4.712
116 1HB GLU 17 HB2 GLU 17 52.475 2.689 2.689
117 2HB GLU 17 HB1 GLU 17 53.973 1.777 1.777
118 1HG GLU 17 HG2 GLU 17 53.684 2.712 2.712
119 2HG GLU 17 HG1 GLU 17 55.145 3.288 3.288
120 H MET 18 HN MET 18 55.162 1.836 1.836
121 HA MET 18 HA MET 18 57.884 2.437 2.437
122 1HB MET 18 HB2 MET 18 56.717 0.209 0.209
123 2HB MET 18 HB1 MET 18 57.070 0.731 0.731
124 1HG MET 18 HG2 MET 18 59.155 -0.077 -0.077
125 2HG MET 18 HG1 MET 18 59.441 1.159 1.159
126 1HE MET 18 HE3 MET 18 59.987 0.755 0.755
127 2HE MET 18 HE2 MET 18 58.241 0.798 0.798
128 3HE MET 18 HE1 MET 18 59.203 -0.435 -0.435
129 H ILE 19 HN ILE 19 56.360 2.436 2.436
130 HA ILE 19 HA ILE 19 58.346 3.627 3.627
131 HB ILE 19 HB ILE 19 55.353 4.125 4.125
132 1HG1 ILE 19 HG12 ILE 19 57.025 2.328 2.328
133 2HG1 ILE 19 HG11 ILE 19 56.235 1.763 1.763
134 1HG2 ILE 19 HG23 ILE 19 57.242 5.608 5.608
135 2HG2 ILE 19 HG22 ILE 19 56.765 4.382 4.382
136 3HG2 ILE 19 HG21 ILE 19 55.547 5.436 5.436
137 HD1 ILE 19 HD1 ILE 19 54.058 2.281 2.281
138 HD1 ILE 19 HD1 ILE 19 54.909 1.401 1.401
139 HD1 ILE 19 HD1 ILE 19 54.744 3.154 3.154
140 H ALA 20 HN ALA 20 56.035 5.307 5.307
141 HA ALA 20 HA ALA 20 57.051 7.965 7.965
142 1HB ALA 20 HB3 ALA 20 54.866 6.776 6.776
143 2HB ALA 20 HB2 ALA 20 55.732 7.588 7.588
144 3HB ALA 20 HB1 ALA 20 55.189 8.507 8.507
145 H GLU 21 HN GLU 21 57.834 5.440 5.440
146 HA GLU 21 HA GLU 21 59.365 7.073 7.073
147 1HB GLU 21 HB2 GLU 21 58.557 4.960 4.960
148 2HB GLU 21 HB1 GLU 21 59.189 4.134 4.134
149 1HG GLU 21 HG2 GLU 21 61.151 3.761 3.761
150 2HG GLU 21 HG1 GLU 21 61.341 5.483 5.483
151 H PHE 22 HN PHE 22 60.342 4.882 4.882
152 HA PHE 22 HA PHE 22 63.147 5.500 5.500
153 1HB PHE 22 HB2 PHE 22 61.425 4.540 4.540
154 2HB PHE 22 HB1 PHE 22 63.176 4.367 4.367
155 HD1 PHE 22 HD2 PHE 22 62.554 3.996 3.996
156 HD2 PHE 22 HD1 PHE 22 61.554 1.974 1.974
157 HE1 PHE 22 HE2 PHE 22 62.257 1.875 1.875
158 HE2 PHE 22 HE1 PHE 22 61.258 -0.145 -0.145
159 HZ PHE 22 HZ PHE 22 61.610 -0.195 -0.195
160 H LYS 23 HN LYS 23 60.428 6.965 6.965
161 HA LYS 23 HA LYS 23 61.674 8.546 8.546
162 1HB LYS 23 HB2 LYS 23 59.206 8.293 8.293
163 2HB LYS 23 HB1 LYS 23 59.544 9.576 9.576
164 1HG LYS 23 HG2 LYS 23 58.619 10.469 10.469
165 2HG LYS 23 HG1 LYS 23 60.246 11.070 11.070
166 1HD LYS 23 HD2 LYS 23 61.220 9.639 9.639
167 2HD LYS 23 HD1 LYS 23 59.798 8.597 8.597
168 1HE LYS 23 HE2 LYS 23 58.547 10.716 10.716
169 2HE LYS 23 HE1 LYS 23 60.172 11.333 11.333
170 1HZ LYS 23 HZ2 LYS 23 59.191 8.655 8.655
171 2HZ LYS 23 HZ1 LYS 23 59.191 10.017 10.017
172 3HZ LYS 23 HZ3 LYS 23 60.658 9.389 9.389
173 H ALA 24 HN ALA 24 61.169 9.434 9.434
174 HA ALA 24 HA ALA 24 62.659 11.902 11.902
175 1HB ALA 24 HB3 ALA 24 61.376 10.161 10.161
176 2HB ALA 24 HB2 ALA 24 62.675 11.187 11.187
177 3HB ALA 24 HB1 ALA 24 61.283 11.911 11.911
178 H ALA 25 HN ALA 25 63.527 8.559 8.559
179 HA ALA 25 HA ALA 25 66.208 9.231 9.231
180 1HB ALA 25 HB3 ALA 25 64.540 6.816 6.816
181 2HB ALA 25 HB2 ALA 25 66.288 6.591 6.591
182 3HB ALA 25 HB1 ALA 25 65.435 7.247 7.247
183 H PHE 26 HN PHE 26 64.762 8.160 8.160
184 HA PHE 26 HA PHE 26 67.244 7.607 7.607
185 1HB PHE 26 HB2 PHE 26 65.013 6.771 6.771
186 2HB PHE 26 HB1 PHE 26 64.501 8.423 8.423
187 HD1 PHE 26 HD1 PHE 26 66.630 5.619 5.619
188 HD2 PHE 26 HD2 PHE 26 65.368 9.636 9.636
189 HE1 PHE 26 HE1 PHE 26 67.608 5.444 5.444
190 HE2 PHE 26 HE2 PHE 26 66.346 9.460 9.460
191 HZ PHE 26 HZ PHE 26 67.467 7.365 7.365
192 H ASP 27 HN ASP 27 65.320 10.529 10.529
193 HA ASP 27 HA ASP 27 66.646 12.159 12.159
194 1HB ASP 27 HB2 ASP 27 64.468 12.742 12.742
195 2HB ASP 27 HB1 ASP 27 65.048 12.716 12.716
196 H MET 28 HN MET 28 67.804 10.811 10.811
197 HA MET 28 HA MET 28 69.298 12.874 12.874
198 1HB MET 28 HB2 MET 28 69.591 9.894 9.894
199 2HB MET 28 HB1 MET 28 70.797 10.807 10.807
200 1HG MET 28 HG2 MET 28 68.545 11.808 11.808
201 2HG MET 28 HG1 MET 28 67.972 10.195 10.195
202 1HE MET 28 HE1 MET 28 67.588 10.855 10.855
203 2HE MET 28 HE3 MET 28 67.958 9.223 9.223
204 3HE MET 28 HE2 MET 28 68.718 10.621 10.621
205 H PHE 29 HN PHE 29 69.832 11.210 11.210
206 HA PHE 29 HA PHE 29 72.431 12.691 12.691
207 1HB PHE 29 HB2 PHE 29 71.863 10.064 10.064
208 2HB PHE 29 HB1 PHE 29 73.416 10.763 10.763
209 HD1 PHE 29 HD2 PHE 29 70.403 9.027 9.027
210 HD2 PHE 29 HD1 PHE 29 74.308 10.518 10.518
211 HE1 PHE 29 HE2 PHE 29 70.339 7.774 7.774
212 HE2 PHE 29 HE1 PHE 29 74.244 9.263 9.263
213 HZ PHE 29 HZ PHE 29 72.260 7.891 7.891
214 H ASP 30 HN ASP 30 69.485 13.121 13.121
215 HA ASP 30 HA ASP 30 70.010 13.161 13.161
216 1HB ASP 30 HB2 ASP 30 67.651 13.099 13.099
217 2HB ASP 30 HB1 ASP 30 67.977 12.039 12.039
218 H ALA 31 HN ALA 31 71.283 15.131 15.131
219 HA ALA 31 HA ALA 31 69.868 17.593 17.593
220 1HB ALA 31 HB3 ALA 31 72.332 16.615 16.615
221 2HB ALA 31 HB2 ALA 31 72.744 17.656 17.656
222 3HB ALA 31 HB1 ALA 31 71.928 18.331 18.331
223 H ASP 32 HN ASP 32 71.506 16.078 16.078
224 HA ASP 32 HA ASP 32 70.452 18.277 18.277
225 1HB ASP 32 HB2 ASP 32 73.202 17.364 17.364
226 2HB ASP 32 HB1 ASP 32 72.812 17.480 17.480
227 H GLY 33 HN GLY 33 69.809 15.289 15.289
228 1HA GLY 33 HA2 GLY 33 70.009 14.230 14.230
229 2HA GLY 33 HA1 GLY 33 69.789 13.229 13.229
230 H GLY 34 HN GLY 34 67.813 15.367 15.367
231 1HA GLY 34 HA2 GLY 34 65.515 15.858 15.858
232 2HA GLY 34 HA1 GLY 34 65.591 15.222 15.222
233 H GLY 35 HN GLY 35 66.253 12.659 12.659
234 1HA GLY 35 HA2 GLY 35 64.773 11.356 11.356
235 2HA GLY 35 HA1 GLY 35 64.078 11.157 11.157
236 H ASP 36 HN ASP 36 67.535 11.426 11.426
237 HA ASP 36 HA ASP 36 67.966 8.511 8.511
238 1HB ASP 36 HB2 ASP 36 69.168 8.753 8.753
239 2HB ASP 36 HB1 ASP 36 67.405 8.795 8.795
240 H ILE 37 HN ILE 37 69.800 8.255 8.255
241 HA ILE 37 HA ILE 37 71.736 10.517 10.517
242 HB ILE 37 HB ILE 37 72.385 9.438 9.438
243 1HG1 ILE 37 HG12 ILE 37 70.684 7.143 7.143
244 2HG1 ILE 37 HG11 ILE 37 72.421 7.122 7.122
245 1HG2 ILE 37 HG21 ILE 37 69.622 10.064 10.064
246 2HG2 ILE 37 HG23 ILE 37 69.712 8.870 8.870
247 3HG2 ILE 37 HG22 ILE 37 70.529 10.423 10.423
248 HD1 ILE 37 HD1 ILE 37 71.566 7.913 7.913
249 HD1 ILE 37 HD1 ILE 37 71.735 6.212 6.212
250 HD1 ILE 37 HD1 ILE 37 70.153 6.988 6.988
251 H SER 38 HN SER 38 74.109 9.744 9.744
252 HA SER 38 HA SER 38 74.987 8.493 8.493
253 1HB SER 38 HB2 SER 38 76.473 9.844 9.844
254 2HB SER 38 HB1 SER 38 76.193 8.894 8.894
255 HG SER 38 HG SER 38 78.176 8.558 8.558
256 H THR 39 HN THR 39 75.076 6.367 6.367
257 HA THR 39 HA THR 39 73.834 4.227 4.227
258 HB THR 39 HB THR 39 75.604 2.868 2.868
259 HG1 THR 39 HG1 THR 39 76.755 4.379 4.379
260 1HG2 THR 39 HG21 THR 39 73.756 4.958 4.958
261 2HG2 THR 39 HG23 THR 39 74.822 4.131 4.131
262 3HG2 THR 39 HG22 THR 39 73.679 3.203 3.203
263 H LYS 40 HN LYS 40 77.023 5.543 5.543
264 HA LYS 40 HA LYS 40 77.995 3.362 3.362
265 1HB LYS 40 HB2 LYS 40 79.501 5.027 5.027
266 2HB LYS 40 HB1 LYS 40 78.526 6.336 6.336
267 1HG LYS 40 HG2 LYS 40 79.555 4.283 4.283
268 2HG LYS 40 HG1 LYS 40 80.712 5.445 5.445
269 1HD LYS 40 HD2 LYS 40 79.781 7.200 7.200
270 2HD LYS 40 HD1 LYS 40 78.138 6.592 6.592
271 1HE LYS 40 HE2 LYS 40 78.656 6.443 6.443
272 2HE LYS 40 HE1 LYS 40 78.717 4.790 4.790
273 1HZ LYS 40 HZ1 LYS 40 81.137 6.435 6.435
274 2HZ LYS 40 HZ3 LYS 40 80.724 5.777 5.777
275 3HZ LYS 40 HZ2 LYS 40 80.984 4.752 4.752
276 H GLU 41 HN GLU 41 75.809 6.037 6.037
277 HA GLU 41 HA GLU 41 75.904 5.765 5.765
278 1HB GLU 41 HB2 GLU 41 74.911 7.539 7.539
279 2HB GLU 41 HB1 GLU 41 73.534 7.044 7.044
280 1HG GLU 41 HG2 GLU 41 76.141 8.182 8.182
281 2HG GLU 41 HG1 GLU 41 74.600 9.037 9.037
282 H LEU 42 HN LEU 42 74.331 4.101 4.101
283 HA LEU 42 HA LEU 42 71.836 3.340 3.340
284 1HB LEU 42 HB2 LEU 42 72.878 2.752 2.752
285 2HB LEU 42 HB1 LEU 42 73.908 1.589 1.589
286 HG LEU 42 HG LEU 42 71.159 1.186 1.186
287 HD1 LEU 42 HD1 LEU 42 70.005 1.226 1.226
288 HD1 LEU 42 HD1 LEU 42 71.292 0.378 0.378
289 HD1 LEU 42 HD1 LEU 42 71.358 2.131 2.131
290 HD2 LEU 42 HD2 LEU 42 71.658 -1.095 -1.095
291 HD2 LEU 42 HD2 LEU 42 72.971 -0.477 -0.477
292 HD2 LEU 42 HD2 LEU 42 73.132 -0.490 -0.490
293 H GLY 43 HN GLY 43 75.040 2.089 2.089
294 1HA GLY 43 HA2 GLY 43 74.012 -0.030 -0.030
295 2HA GLY 43 HA1 GLY 43 75.664 0.590 0.590
296 H THR 44 HN THR 44 74.921 3.345 3.345
297 HA THR 44 HA THR 44 74.707 3.213 3.213
298 HB THR 44 HB THR 44 74.849 5.351 5.351
299 HG1 THR 44 HG1 THR 44 76.862 5.556 5.556
300 1HG2 THR 44 HG23 THR 44 73.766 5.644 5.644
301 2HG2 THR 44 HG22 THR 44 75.258 6.569 6.569
302 3HG2 THR 44 HG21 THR 44 73.919 6.852 6.852
303 H VAL 45 HN VAL 45 72.578 4.567 4.567
304 HA VAL 45 HA VAL 45 70.444 5.431 5.431
305 HB VAL 45 HB VAL 45 70.673 5.861 5.861
306 1HG1 VAL 45 HG11 VAL 45 71.615 3.579 3.579
307 2HG1 VAL 45 HG13 VAL 45 69.976 2.937 2.937
308 3HG1 VAL 45 HG12 VAL 45 70.376 4.115 4.115
309 1HG2 VAL 45 HG23 VAL 45 68.199 4.308 4.308
310 2HG2 VAL 45 HG22 VAL 45 68.421 6.058 6.058
311 3HG2 VAL 45 HG21 VAL 45 68.325 5.195 5.195
312 H MET 46 HN MET 46 70.986 2.179 2.179
313 HA MET 46 HA MET 46 68.572 1.075 1.075
314 1HB MET 46 HB2 MET 46 69.371 -0.974 -0.974
315 2HB MET 46 HB1 MET 46 69.684 0.348 0.348
316 1HG MET 46 HG2 MET 46 72.012 0.500 0.500
317 2HG MET 46 HG1 MET 46 71.658 -1.034 -1.034
318 1HE MET 46 HE3 MET 46 70.115 -2.626 -2.626
319 2HE MET 46 HE2 MET 46 69.603 -1.857 -1.857
320 3HE MET 46 HE1 MET 46 70.650 -3.273 -3.273
321 H ARG 47 HN ARG 47 72.071 0.951 0.951
322 HA ARG 47 HA ARG 47 71.800 -0.845 -0.845
323 1HB ARG 47 HB2 ARG 47 73.833 -0.450 -0.450
324 2HB ARG 47 HB1 ARG 47 73.999 1.130 1.130
325 1HG ARG 47 HG2 ARG 47 73.725 -1.254 -1.254
326 2HG ARG 47 HG1 ARG 47 75.268 -1.012 -1.012
327 1HD ARG 47 HD2 ARG 47 75.799 0.485 0.485
328 2HD ARG 47 HD1 ARG 47 74.511 1.533 1.533
329 HE ARG 47 HE ARG 47 73.391 -0.572 -0.572
330 1HH1 ARG 47 HH2 ARG 47 75.465 2.143 2.143
331 2HH1 ARG 47 HH2 ARG 47 74.729 2.705 2.705
332 1HH2 ARG 47 HH1 ARG 47 72.272 0.258 0.258
333 2HH2 ARG 47 HH1 ARG 47 72.920 1.637 1.637
334 H MET 48 HN MET 48 72.113 2.692 2.692
335 HA MET 48 HA MET 48 72.165 3.265 3.265
336 1HB MET 48 HB2 MET 48 73.008 4.764 4.764
337 2HB MET 48 HB1 MET 48 71.383 4.915 4.915
338 1HG MET 48 HG2 MET 48 71.835 6.858 6.858
339 2HG MET 48 HG1 MET 48 70.626 5.856 5.856
340 1HE MET 48 HE3 MET 48 74.177 7.006 7.006
341 2HE MET 48 HE2 MET 48 75.072 6.302 6.302
342 3HE MET 48 HE1 MET 48 74.572 5.281 5.281
343 H LEU 49 HN LEU 49 69.686 2.092 2.092
344 HA LEU 49 HA LEU 49 67.479 3.549 3.549
345 1HB LEU 49 HB2 LEU 49 67.894 1.546 1.546
346 2HB LEU 49 HB1 LEU 49 66.306 1.577 1.577
347 HG LEU 49 HG LEU 49 67.662 4.079 4.079
348 HD1 LEU 49 HD1 LEU 49 66.528 3.857 3.857
349 HD1 LEU 49 HD1 LEU 49 65.492 2.567 2.567
350 HD1 LEU 49 HD1 LEU 49 67.198 2.252 2.252
351 HD2 LEU 49 HD2 LEU 49 65.949 4.821 4.821
352 HD2 LEU 49 HD2 LEU 49 65.019 3.334 3.334
353 HD2 LEU 49 HD2 LEU 49 65.018 4.542 4.542
354 H GLY 50 HN GLY 50 68.998 0.338 0.338
355 1HA GLY 50 HA2 GLY 50 68.631 -0.306 -0.306
356 2HA GLY 50 HA1 GLY 50 67.015 -0.602 -0.602
357 H GLN 51 HN GLN 51 68.477 -1.337 -1.337
358 HA GLN 51 HA GLN 51 68.717 -4.207 -4.207
359 1HB GLN 51 HB2 GLN 51 69.082 -2.941 -2.941
360 2HB GLN 51 HB1 GLN 51 68.422 -4.529 -4.529
361 1HG GLN 51 HG2 GLN 51 67.114 -1.826 -1.826
362 2HG GLN 51 HG1 GLN 51 66.524 -3.222 -3.222
363 1HE2 GLN 51 HE22 GLN 51 66.081 -4.897 -4.897
364 2HE2 GLN 51 HE21 GLN 51 67.223 -5.148 -5.148
365 H ASN 52 HN ASN 52 70.570 -4.939 -4.939
366 HA ASN 52 HA ASN 52 73.083 -3.477 -3.477
367 1HB ASN 52 HB2 ASN 52 74.136 -5.399 -5.399
368 2HB ASN 52 HB1 ASN 52 72.755 -4.789 -4.789
369 HD2 ASN 52 HD2 ASN 52 70.584 -5.974 -5.974
370 HD2 ASN 52 HD2 ASN 52 70.687 -7.652 -7.652
371 HA PRO 53 HA PRO 53 72.980 -5.662 -5.662
372 1HB PRO 53 HB2 PRO 53 74.455 -3.774 -3.774
373 2HB PRO 53 HB1 PRO 53 72.703 -3.627 -3.627
374 1HG PRO 53 HG2 PRO 53 74.939 -2.340 -2.340
375 2HG PRO 53 HG1 PRO 53 73.374 -1.669 -1.669
376 1HD PRO 53 HD2 PRO 53 73.918 -2.525 -2.525
377 2HD PRO 53 HD1 PRO 53 72.289 -2.539 -2.539
378 H THR 54 HN THR 54 74.437 -7.345 -7.345
379 HA THR 54 HA THR 54 77.060 -7.218 -7.218
380 HB THR 54 HB THR 54 77.245 -9.478 -9.478
381 HG1 THR 54 HG1 THR 54 76.127 -9.873 -9.873
382 1HG2 THR 54 HG23 THR 54 75.279 -8.558 -8.558
383 2HG2 THR 54 HG22 THR 54 74.507 -9.772 -9.772
384 3HG2 THR 54 HG21 THR 54 75.969 -10.177 -10.177
385 H LYS 55 HN LYS 55 79.111 -7.189 -7.189
386 HA LYS 55 HA LYS 55 79.567 -5.402 -5.402
387 1HB LYS 55 HB2 LYS 55 81.085 -6.876 -6.876
388 2HB LYS 55 HB1 LYS 55 81.245 -7.873 -7.873
389 1HG LYS 55 HG2 LYS 55 82.350 -6.219 -6.219
390 2HG LYS 55 HG1 LYS 55 81.604 -4.913 -4.913
391 1HD LYS 55 HD2 LYS 55 82.949 -5.751 -5.751
392 2HD LYS 55 HD1 LYS 55 83.854 -6.740 -6.740
393 1HE LYS 55 HE2 LYS 55 83.506 -3.812 -3.812
394 2HE LYS 55 HE1 LYS 55 84.732 -4.319 -4.319
395 1HZ LYS 55 HZ3 LYS 55 85.170 -6.126 -6.126
396 2HZ LYS 55 HZ2 LYS 55 84.550 -4.912 -4.912
397 3HZ LYS 55 HZ1 LYS 55 85.921 -4.607 -4.607
398 H GLU 56 HN GLU 56 79.213 -8.956 -8.956
399 HA GLU 56 HA GLU 56 79.495 -9.150 -9.150
400 1HB GLU 56 HB2 GLU 56 79.147 -10.854 -10.854
401 2HB GLU 56 HB1 GLU 56 77.492 -10.836 -10.836
402 1HG GLU 56 HG2 GLU 56 78.214 -11.529 -11.529
403 2HG GLU 56 HG1 GLU 56 79.910 -11.330 -11.330
404 H GLU 57 HN GLU 57 76.476 -8.841 -8.841
405 HA GLU 57 HA GLU 57 74.758 -8.573 -8.573
406 1HB GLU 57 HB2 GLU 57 74.463 -7.766 -7.766
407 2HB GLU 57 HB1 GLU 57 73.133 -7.857 -7.857
408 1HG GLU 57 HG2 GLU 57 74.867 -10.264 -10.264
409 2HG GLU 57 HG1 GLU 57 73.809 -9.927 -9.927
410 H LEU 58 HN LEU 58 76.288 -6.209 -6.209
411 HA LEU 58 HA LEU 58 75.081 -3.857 -3.857
412 1HB LEU 58 HB2 LEU 58 76.215 -3.763 -3.763
413 2HB LEU 58 HB1 LEU 58 77.670 -4.501 -4.501
414 HG LEU 58 HG LEU 58 78.073 -2.512 -2.512
415 HD1 LEU 58 HD1 LEU 58 76.648 -0.596 -0.596
416 HD1 LEU 58 HD1 LEU 58 75.732 -1.232 -1.232
417 HD1 LEU 58 HD1 LEU 58 75.575 -1.979 -1.979
418 HD2 LEU 58 HD2 LEU 58 77.537 -1.248 -1.248
419 HD2 LEU 58 HD2 LEU 58 79.044 -1.352 -1.352
420 HD2 LEU 58 HD2 LEU 58 78.497 -2.728 -2.728
421 H ASP 59 HN ASP 59 78.151 -5.498 -5.498
422 HA ASP 59 HA ASP 59 78.898 -3.632 -3.632
423 1HB ASP 59 HB2 ASP 59 80.090 -5.636 -5.636
424 2HB ASP 59 HB1 ASP 59 79.776 -6.469 -6.469
425 H ALA 60 HN ALA 60 77.090 -6.693 -6.693
426 HA ALA 60 HA ALA 60 76.873 -6.898 -6.898
427 1HB ALA 60 HB2 ALA 60 76.576 -8.584 -8.584
428 2HB ALA 60 HB1 ALA 60 74.885 -8.134 -8.134
429 3HB ALA 60 HB3 ALA 60 75.782 -8.867 -8.867
430 H ILE 61 HN ILE 61 74.877 -5.506 -5.506
431 HA ILE 61 HA ILE 61 72.530 -5.002 -5.002
432 HB ILE 61 HB ILE 61 73.736 -3.797 -3.797
433 1HG1 ILE 61 HG12 ILE 61 71.206 -5.420 -5.420
434 2HG1 ILE 61 HG11 ILE 61 72.781 -6.202 -6.202
435 1HG2 ILE 61 HG23 ILE 61 71.270 -3.050 -3.050
436 2HG2 ILE 61 HG22 ILE 61 71.235 -2.974 -2.974
437 3HG2 ILE 61 HG21 ILE 61 72.405 -2.010 -2.010
438 HD1 ILE 61 HD1 ILE 61 71.173 -4.844 -4.844
439 HD1 ILE 61 HD1 ILE 61 72.854 -4.316 -4.316
440 HD1 ILE 61 HD1 ILE 61 72.470 -6.023 -6.023
441 H ILE 62 HN ILE 62 75.186 -2.795 -2.795
442 HA ILE 62 HA ILE 62 74.389 -0.527 -0.527
443 HB ILE 62 HB ILE 62 77.086 -1.664 -1.664
444 1HG1 ILE 62 HG12 ILE 62 75.391 0.604 0.604
445 2HG1 ILE 62 HG11 ILE 62 75.558 -0.995 -0.995
446 1HG2 ILE 62 HG22 ILE 62 76.490 0.489 0.489
447 2HG2 ILE 62 HG21 ILE 62 77.256 1.137 1.137
448 3HG2 ILE 62 HG23 ILE 62 78.065 -0.119 -0.119
449 HD1 ILE 62 HD1 ILE 62 78.052 -0.582 -0.582
450 HD1 ILE 62 HD1 ILE 62 77.089 0.470 0.470
451 HD1 ILE 62 HD1 ILE 62 77.729 1.083 1.083
452 H GLU 63 HN GLU 63 76.959 -2.823 -2.823
453 HA GLU 63 HA GLU 63 77.264 -2.036 -2.036
454 1HB GLU 63 HB2 GLU 63 78.569 -3.766 -3.766
455 2HB GLU 63 HB1 GLU 63 77.184 -4.855 -4.855
456 1HG GLU 63 HG2 GLU 63 77.553 -5.353 -5.353
457 2HG GLU 63 HG1 GLU 63 78.002 -3.695 -3.695
458 H GLU 64 HN GLU 64 74.687 -3.979 -3.979
459 HA GLU 64 HA GLU 64 73.451 -4.797 -4.797
460 1HB GLU 64 HB2 GLU 64 72.866 -6.105 -6.105
461 2HB GLU 64 HB1 GLU 64 72.826 -4.728 -4.728
462 1HG GLU 64 HG2 GLU 64 70.644 -4.230 -4.230
463 2HG GLU 64 HG1 GLU 64 70.801 -4.718 -4.718
464 H VAL 65 HN VAL 65 72.694 -2.224 -2.224
465 HA VAL 65 HA VAL 65 70.639 -1.058 -1.058
466 HB VAL 65 HB VAL 65 70.406 0.496 0.496
467 1HG1 VAL 65 HG12 VAL 65 70.892 -2.392 -2.392
468 2HG1 VAL 65 HG11 VAL 65 70.540 -1.265 -1.265
469 3HG1 VAL 65 HG13 VAL 65 69.379 -1.487 -1.487
470 1HG2 VAL 65 HG22 VAL 65 73.194 0.151 0.151
471 2HG2 VAL 65 HG21 VAL 65 72.172 1.165 1.165
472 3HG2 VAL 65 HG23 VAL 65 72.524 -0.495 -0.495
473 H ASP 66 HN ASP 66 74.035 -0.877 -0.877
474 HA ASP 66 HA ASP 66 74.265 1.919 1.919
475 1HB ASP 66 HB2 ASP 66 75.876 0.783 0.783
476 2HB ASP 66 HB1 ASP 66 76.301 -0.323 -0.323
477 H GLU 67 HN GLU 67 74.003 -1.261 -1.261
478 HA GLU 67 HA GLU 67 75.310 -0.859 -0.859
479 1HB GLU 67 HB2 GLU 67 74.023 -2.875 -2.875
480 2HB GLU 67 HB1 GLU 67 72.829 -2.478 -2.478
481 1HG GLU 67 HG2 GLU 67 74.080 -3.892 -3.892
482 2HG GLU 67 HG1 GLU 67 75.100 -2.467 -2.467
483 H ASP 68 HN ASP 68 72.439 0.544 0.544
484 HA ASP 68 HA ASP 68 71.005 0.935 0.935
485 1HB ASP 68 HB2 ASP 68 69.639 2.411 2.411
486 2HB ASP 68 HB1 ASP 68 70.043 0.958 0.958
487 H GLY 69 HN GLY 69 73.925 2.175 2.175
488 1HA GLY 69 HA2 GLY 69 75.235 3.967 3.967
489 2HA GLY 69 HA1 GLY 69 74.088 4.124 4.124
490 H SER 70 HN SER 70 73.295 4.387 4.387
491 HA SER 70 HA SER 70 72.377 7.187 7.187
492 1HB SER 70 HB2 SER 70 70.587 5.804 5.804
493 2HB SER 70 HB1 SER 70 71.591 4.962 4.962
494 HG SER 70 HG SER 70 70.347 6.429 6.429
495 H GLY 71 HN GLY 71 74.308 5.170 5.170
496 1HA GLY 71 HA2 GLY 71 76.223 5.931 5.931
497 2HA GLY 71 HA1 GLY 71 75.717 7.596 7.596
498 H THR 72 HN THR 72 72.983 7.232 7.232
499 HA THR 72 HA THR 72 73.465 6.890 6.890
500 HB THR 72 HB THR 72 71.658 8.603 8.603
501 HG1 THR 72 HG1 THR 72 70.620 9.262 9.262
502 1HG2 THR 72 HG23 THR 72 74.066 9.231 9.231
503 2HG2 THR 72 HG22 THR 72 72.987 10.485 10.485
504 3HG2 THR 72 HG21 THR 72 73.881 9.464 9.464
505 H ILE 73 HN ILE 73 71.077 6.619 6.619
506 HA ILE 73 HA ILE 73 69.811 4.321 4.321
507 HB ILE 73 HB ILE 73 70.948 3.800 3.800
508 1HG1 ILE 73 HG12 ILE 73 68.637 3.240 3.240
509 2HG1 ILE 73 HG11 ILE 73 68.000 3.589 3.589
510 1HG2 ILE 73 HG22 ILE 73 69.216 6.063 6.063
511 2HG2 ILE 73 HG21 ILE 73 69.792 4.821 4.821
512 3HG2 ILE 73 HG23 ILE 73 70.948 5.818 5.818
513 HD1 ILE 73 HD1 ILE 73 69.114 1.173 1.173
514 HD1 ILE 73 HD1 ILE 73 70.399 1.933 1.933
515 HD1 ILE 73 HD1 ILE 73 68.816 1.661 1.661
516 H ASP 74 HN ASP 74 67.535 4.317 4.317
517 HA ASP 74 HA ASP 74 66.200 6.929 6.929
518 1HB ASP 74 HB2 ASP 74 65.252 4.488 4.488
519 2HB ASP 74 HB1 ASP 74 64.617 6.130 6.130
520 H PHE 75 HN PHE 75 64.594 7.119 7.119
521 HA PHE 75 HA PHE 75 64.207 5.425 5.425
522 1HB PHE 75 HB2 PHE 75 63.223 7.769 7.769
523 2HB PHE 75 HB1 PHE 75 61.852 6.815 6.815
524 HD1 PHE 75 HD1 PHE 75 63.895 7.708 7.708
525 HD2 PHE 75 HD2 PHE 75 60.372 5.699 5.699
526 HE1 PHE 75 HE1 PHE 75 63.073 7.506 7.506
527 HE2 PHE 75 HE2 PHE 75 59.549 5.497 5.497
528 HZ PHE 75 HZ PHE 75 60.900 6.401 6.401
529 H GLU 76 HN GLU 76 62.292 5.353 5.353
530 HA GLU 76 HA GLU 76 60.579 3.196 3.196
531 1HB GLU 76 HB2 GLU 76 61.663 4.552 4.552
532 2HB GLU 76 HB1 GLU 76 61.054 2.921 2.921
533 1HG GLU 76 HG2 GLU 76 59.422 4.874 4.874
534 2HG GLU 76 HG1 GLU 76 59.393 4.936 4.936
535 H GLU 77 HN GLU 77 63.379 2.846 2.846
536 HA GLU 77 HA GLU 77 63.610 0.032 0.032
537 1HB GLU 77 HB2 GLU 77 64.635 1.587 1.587
538 2HB GLU 77 HB1 GLU 77 65.813 2.061 2.061
539 1HG GLU 77 HG2 GLU 77 67.065 0.295 0.295
540 2HG GLU 77 HG1 GLU 77 65.800 -0.753 -0.753
541 H PHE 78 HN PHE 78 64.638 2.588 2.588
542 HA PHE 78 HA PHE 78 66.634 1.055 1.055
543 1HB PHE 78 HB2 PHE 78 66.740 3.439 3.439
544 2HB PHE 78 HB1 PHE 78 65.037 3.580 3.580
545 HD1 PHE 78 HD1 PHE 78 68.177 1.961 1.961
546 HD2 PHE 78 HD2 PHE 78 64.506 3.975 3.975
547 HE1 PHE 78 HE1 PHE 78 68.779 1.915 1.915
548 HE2 PHE 78 HE2 PHE 78 65.108 3.930 3.930
549 HZ PHE 78 HZ PHE 78 67.244 2.899 2.899
550 H LEU 79 HN LEU 79 63.161 1.684 1.684
551 HA LEU 79 HA LEU 79 62.587 0.819 0.819
552 1HB LEU 79 HB2 LEU 79 61.288 0.405 0.405
553 2HB LEU 79 HB1 LEU 79 60.542 -0.277 -0.277
554 HG LEU 79 HG LEU 79 61.417 2.591 2.591
555 HD1 LEU 79 HD1 LEU 79 58.656 1.866 1.866
556 HD1 LEU 79 HD1 LEU 79 59.969 1.948 1.948
557 HD1 LEU 79 HD1 LEU 79 59.547 3.372 3.372
558 HD2 LEU 79 HD2 LEU 79 60.161 0.861 0.861
559 HD2 LEU 79 HD2 LEU 79 58.829 1.814 1.814
560 HD2 LEU 79 HD2 LEU 79 60.191 2.620 2.620
561 H VAL 80 HN VAL 80 63.811 -1.147 -1.147
562 HA VAL 80 HA VAL 80 63.150 -3.721 -3.721
563 HB VAL 80 HB VAL 80 64.485 -4.565 -4.565
564 1HG1 VAL 80 HG13 VAL 80 62.716 -2.298 -2.298
565 2HG1 VAL 80 HG12 VAL 80 63.931 -2.419 -2.419
566 3HG1 VAL 80 HG11 VAL 80 62.874 -3.788 -3.788
567 1HG2 VAL 80 HG22 VAL 80 65.810 -1.847 -1.847
568 2HG2 VAL 80 HG21 VAL 80 66.557 -3.425 -3.425
569 3HG2 VAL 80 HG23 VAL 80 66.006 -2.947 -2.947
570 H MET 81 HN MET 81 65.989 -1.580 -1.580
571 HA MET 81 HA MET 81 67.770 -3.379 -3.379
572 1HB MET 81 HB2 MET 81 67.537 -0.552 -0.552
573 2HB MET 81 HB1 MET 81 68.381 -0.780 -0.780
574 1HG MET 81 HG2 MET 81 69.875 -0.827 -0.827
575 2HG MET 81 HG1 MET 81 69.992 -2.253 -2.253
576 1HE MET 81 HE3 MET 81 67.496 -0.866 -0.866
577 2HE MET 81 HE2 MET 81 69.062 -0.769 -0.769
578 3HE MET 81 HE1 MET 81 67.830 -1.863 -1.863
579 H MET 82 HN MET 82 64.988 -1.636 -1.636
580 HA MET 82 HA MET 82 65.764 -1.629 -1.629
581 1HB MET 82 HB2 MET 82 63.056 -1.150 -1.150
582 2HB MET 82 HB1 MET 82 63.648 -0.521 -0.521
583 1HG MET 82 HG2 MET 82 65.523 0.578 0.578
584 2HG MET 82 HG1 MET 82 64.438 0.287 0.287
585 1HE MET 82 HE2 MET 82 65.549 1.962 1.962
586 2HE MET 82 HE1 MET 82 64.756 3.535 3.535
587 3HE MET 82 HE3 MET 82 64.130 2.250 2.250
588 H VAL 83 HN VAL 83 63.359 -3.339 -3.339
589 HA VAL 83 HA VAL 83 62.573 -5.104 -5.104
590 HB VAL 83 HB VAL 83 60.981 -4.353 -4.353
591 1HG1 VAL 83 HG13 VAL 83 63.081 -5.415 -5.415
592 2HG1 VAL 83 HG12 VAL 83 61.397 -5.506 -5.506
593 3HG1 VAL 83 HG11 VAL 83 62.119 -3.943 -3.943
594 1HG2 VAL 83 HG22 VAL 83 60.964 -6.767 -6.767
595 2HG2 VAL 83 HG21 VAL 83 59.949 -6.430 -6.430
596 3HG2 VAL 83 HG23 VAL 83 61.494 -7.255 -7.255
597 H ARG 84 HN ARG 84 64.764 -5.230 -5.230
598 HA ARG 84 HA ARG 84 65.142 -8.083 -8.083
599 1HB ARG 84 HB2 ARG 84 66.720 -5.656 -5.656
600 2HB ARG 84 HB1 ARG 84 67.323 -7.292 -7.292
601 1HG ARG 84 HG2 ARG 84 65.157 -7.826 -7.826
602 2HG ARG 84 HG1 ARG 84 64.719 -6.123 -6.123
603 1HD ARG 84 HD2 ARG 84 65.745 -5.988 -5.988
604 2HD ARG 84 HD1 ARG 84 67.225 -5.915 -5.915
605 HE ARG 84 HE ARG 84 66.263 -8.636 -8.636
606 1HH1 ARG 84 HH1 ARG 84 69.109 -8.123 -8.123
607 2HH1 ARG 84 HH1 ARG 84 69.824 -8.155 -8.155
608 1HH2 ARG 84 HH2 ARG 84 66.807 -7.758 -7.758
609 2HH2 ARG 84 HH2 ARG 84 68.520 -7.948 -7.948
610 H GLN 85 HN GLN 85 66.539 -5.491 -5.491
611 HA GLN 85 HA GLN 85 68.633 -7.224 -7.224
612 1HB GLN 85 HB2 GLN 85 68.818 -4.742 -4.742
613 2HB GLN 85 HB1 GLN 85 67.663 -4.475 -4.475
614 1HG GLN 85 HG2 GLN 85 69.939 -4.230 -4.230
615 2HG GLN 85 HG1 GLN 85 69.192 -5.666 -5.666
616 1HE2 GLN 85 HE22 GLN 85 71.726 -6.554 -6.554
617 2HE2 GLN 85 HE21 GLN 85 70.509 -5.391 -5.391
618 H MET 86 HN MET 86 65.521 -5.814 -5.814
619 HA MET 86 HA MET 86 65.667 -6.909 -6.909
620 1HB MET 86 HB2 MET 86 64.024 -5.152 -5.152
621 2HB MET 86 HB1 MET 86 62.999 -6.315 -6.315
622 1HG MET 86 HG2 MET 86 64.872 -5.590 -5.590
623 2HG MET 86 HG1 MET 86 64.536 -4.076 -4.076
624 1HE MET 86 HE2 MET 86 62.182 -3.660 -3.660
625 2HE MET 86 HE1 MET 86 60.833 -3.537 -3.537
626 3HE MET 86 HE3 MET 86 62.319 -2.621 -2.621
627 H LYS 87 HN LYS 87 64.508 -8.025 -8.025
628 HA LYS 87 HA LYS 87 62.624 -9.983 -9.983
629 1HB LYS 87 HB2 LYS 87 64.727 -9.580 -9.580
630 2HB LYS 87 HB1 LYS 87 64.050 -11.206 -11.206
631 1HG LYS 87 HG2 LYS 87 62.050 -9.037 -9.037
632 2HG LYS 87 HG1 LYS 87 62.911 -9.168 -9.168
633 1HD LYS 87 HD2 LYS 87 60.995 -10.605 -10.605
634 2HD LYS 87 HD1 LYS 87 62.395 -11.655 -11.655
635 1HE LYS 87 HE2 LYS 87 61.895 -11.927 -11.927
636 2HE LYS 87 HE1 LYS 87 60.578 -10.743 -10.743
637 1HZ LYS 87 HZ1 LYS 87 60.545 -12.909 -12.909
638 2HZ LYS 87 HZ3 LYS 87 60.188 -13.344 -13.344
639 3HZ LYS 87 HZ2 LYS 87 59.254 -12.164 -12.164
640 H GLU 88 HN GLU 88 66.047 -9.905 -9.905
641 HA GLU 88 HA GLU 88 66.067 -12.759 -12.759
642 1HB GLU 88 HB2 GLU 88 68.039 -10.616 -10.616
643 2HB GLU 88 HB1 GLU 88 68.560 -11.872 -11.872
644 1HG GLU 88 HG2 GLU 88 67.257 -12.501 -12.501
645 2HG GLU 88 HG1 GLU 88 69.004 -12.351 -12.351
646 H ASP 89 HN ASP 89 66.406 -9.460 -9.460
647 HA ASP 89 HA ASP 89 66.945 -10.346 -10.346
648 1HB ASP 89 HB2 ASP 89 66.587 -7.826 -7.826
649 2HB ASP 89 HB1 ASP 89 66.241 -7.739 -7.739
650 H ALA 90 HN ALA 90 64.115 -9.454 -9.454
651 HA ALA 90 HA ALA 90 62.309 -9.139 -9.139
652 1HB ALA 90 HB2 ALA 90 62.018 -8.162 -8.162
653 2HB ALA 90 HB1 ALA 90 61.791 -9.789 -9.789
654 3HB ALA 90 HB3 ALA 90 60.621 -9.119 -9.119
Start of MODEL 8
1 1H ALA 1 HT3 ALA 1 66.186 -5.399 -5.399
2 2H ALA 1 HT2 ALA 1 67.818 -5.611 -5.611
3 3H ALA 1 HT1 ALA 1 66.594 -6.297 -6.297
4 HA ALA 1 HA ALA 1 67.261 -8.135 -8.135
5 1HB ALA 1 HB2 ALA 1 68.446 -6.066 -6.066
6 2HB ALA 1 HB1 ALA 1 67.446 -6.937 -6.937
7 3HB ALA 1 HB3 ALA 1 68.684 -7.797 -7.797
8 H SER 2 HN SER 2 66.252 -9.137 -9.137
9 HA SER 2 HA SER 2 63.349 -8.808 -8.808
10 1HB SER 2 HB2 SER 2 65.308 -10.654 -10.654
11 2HB SER 2 HB1 SER 2 63.776 -10.529 -10.529
12 HG SER 2 HG SER 2 64.114 -11.056 -11.056
13 H MET 3 HN MET 3 65.753 -7.280 -7.280
14 HA MET 3 HA MET 3 64.601 -6.946 -6.946
15 1HB MET 3 HB2 MET 3 66.583 -5.666 -5.666
16 2HB MET 3 HB1 MET 3 65.863 -4.560 -4.560
17 1HG MET 3 HG2 MET 3 67.924 -5.751 -5.751
18 2HG MET 3 HG1 MET 3 66.493 -5.990 -5.990
19 1HE MET 3 HE2 MET 3 68.558 -7.466 -7.466
20 2HE MET 3 HE1 MET 3 67.315 -8.613 -8.613
21 3HE MET 3 HE3 MET 3 68.689 -9.156 -9.156
22 H THR 4 HN THR 4 64.066 -5.131 -5.131
23 HA THR 4 HA THR 4 62.491 -3.004 -3.004
24 HB THR 4 HB THR 4 63.290 -3.392 -3.392
25 HG1 THR 4 HG1 THR 4 61.530 -1.986 -1.986
26 1HG2 THR 4 HG23 THR 4 61.626 -5.790 -5.790
27 2HG2 THR 4 HG22 THR 4 61.358 -4.952 -4.952
28 3HG2 THR 4 HG21 THR 4 62.977 -5.505 -5.505
29 H ASP 5 HN ASP 5 61.726 -6.395 -6.395
30 HA ASP 5 HA ASP 5 58.814 -5.974 -5.974
31 1HB ASP 5 HB2 ASP 5 60.203 -7.894 -7.894
32 2HB ASP 5 HB1 ASP 5 60.300 -8.542 -8.542
33 H GLN 6 HN GLN 6 61.403 -7.332 -7.332
34 HA GLN 6 HA GLN 6 59.790 -7.672 -7.672
35 1HB GLN 6 HB2 GLN 6 62.566 -7.810 -7.810
36 2HB GLN 6 HB1 GLN 6 62.440 -7.149 -7.149
37 1HG GLN 6 HG2 GLN 6 62.605 -9.668 -9.668
38 2HG GLN 6 HG1 GLN 6 61.178 -9.063 -9.063
39 1HE2 GLN 6 HE22 GLN 6 59.623 -11.511 -11.511
40 2HE2 GLN 6 HE21 GLN 6 60.358 -11.351 -11.351
41 H GLN 7 HN GLN 7 60.897 -4.814 -4.814
42 HA GLN 7 HA GLN 7 61.321 -3.135 -3.135
43 1HB GLN 7 HB2 GLN 7 62.151 -2.525 -2.525
44 2HB GLN 7 HB1 GLN 7 60.536 -2.634 -2.634
45 1HG GLN 7 HG2 GLN 7 60.446 -0.837 -0.837
46 2HG GLN 7 HG1 GLN 7 61.771 -0.356 -0.356
47 1HE2 GLN 7 HE22 GLN 7 57.943 0.208 0.208
48 2HE2 GLN 7 HE21 GLN 7 58.306 -0.448 -0.448
49 H ALA 8 HN ALA 8 58.579 -3.002 -3.002
50 HA ALA 8 HA ALA 8 56.809 -1.477 -1.477
51 1HB ALA 8 HB3 ALA 8 56.796 -3.122 -3.122
52 2HB ALA 8 HB2 ALA 8 55.411 -3.616 -3.616
53 3HB ALA 8 HB1 ALA 8 55.582 -1.934 -1.934
54 H GLU 9 HN GLU 9 57.452 -4.963 -4.963
55 HA GLU 9 HA GLU 9 55.384 -5.361 -5.361
56 1HB GLU 9 HB2 GLU 9 56.720 -6.895 -6.895
57 2HB GLU 9 HB1 GLU 9 57.404 -7.446 -7.446
58 1HG GLU 9 HG2 GLU 9 55.263 -8.036 -8.036
59 2HG GLU 9 HG1 GLU 9 54.424 -7.159 -7.159
60 H ALA 10 HN ALA 10 58.718 -4.461 -4.461
61 HA ALA 10 HA ALA 10 59.545 -5.492 -5.492
62 1HB ALA 10 HB2 ALA 10 60.492 -3.547 -3.547
63 2HB ALA 10 HB1 ALA 10 61.226 -3.458 -3.458
64 3HB ALA 10 HB3 ALA 10 61.316 -4.954 -4.954
65 H ARG 11 HN ARG 11 57.752 -2.671 -2.671
66 HA ARG 11 HA ARG 11 58.113 -1.288 -1.288
67 1HB ARG 11 HB2 ARG 11 56.220 -0.468 -0.468
68 2HB ARG 11 HB1 ARG 11 57.164 0.552 0.552
69 1HG ARG 11 HG2 ARG 11 58.681 0.754 0.754
70 2HG ARG 11 HG1 ARG 11 59.064 -0.953 -0.953
71 1HD ARG 11 HD2 ARG 11 58.474 -0.661 -0.661
72 2HD ARG 11 HD1 ARG 11 57.090 -1.460 -1.460
73 HE ARG 11 HE ARG 11 56.779 1.368 1.368
74 1HH1 ARG 11 HH1 ARG 11 54.852 -0.800 -0.800
75 2HH1 ARG 11 HH1 ARG 11 54.559 -0.161 -0.161
76 1HH2 ARG 11 HH2 ARG 11 57.220 2.058 2.058
77 2HH2 ARG 11 HH2 ARG 11 55.901 1.457 1.457
78 H ALA 12 HN ALA 12 55.562 -2.909 -2.909
79 HA ALA 12 HA ALA 12 53.308 -2.379 -2.379
80 1HB ALA 12 HB1 ALA 12 54.064 -4.036 -4.036
81 2HB ALA 12 HB3 ALA 12 53.526 -5.166 -5.166
82 3HB ALA 12 HB2 ALA 12 52.437 -3.902 -3.902
83 H PHE 13 HN PHE 13 56.094 -4.326 -4.326
84 HA PHE 13 HA PHE 13 55.007 -6.067 -6.067
85 1HB PHE 13 HB2 PHE 13 57.241 -6.350 -6.350
86 2HB PHE 13 HB1 PHE 13 57.686 -4.705 -4.705
87 HD1 PHE 13 HD1 PHE 13 55.967 -7.538 -7.538
88 HD2 PHE 13 HD2 PHE 13 59.176 -4.683 -4.683
89 HE1 PHE 13 HE1 PHE 13 56.664 -8.346 -8.346
90 HE2 PHE 13 HE2 PHE 13 59.874 -5.493 -5.493
91 HZ PHE 13 HZ PHE 13 58.619 -7.324 -7.324
92 H LEU 14 HN LEU 14 56.360 -2.771 -2.771
93 HA LEU 14 HA LEU 14 55.273 -2.664 -2.664
94 1HB LEU 14 HB2 LEU 14 57.246 -0.847 -0.847
95 2HB LEU 14 HB1 LEU 14 56.936 -0.926 -0.926
96 HG LEU 14 HG LEU 14 58.037 -3.205 -3.205
97 HD1 LEU 14 HD1 LEU 14 59.448 -1.020 -1.020
98 HD1 LEU 14 HD1 LEU 14 60.164 -2.629 -2.629
99 HD1 LEU 14 HD1 LEU 14 59.583 -1.828 -1.828
100 HD2 LEU 14 HD2 LEU 14 57.031 -2.938 -2.938
101 HD2 LEU 14 HD2 LEU 14 58.591 -3.747 -3.747
102 HD2 LEU 14 HD2 LEU 14 57.188 -4.378 -4.378
103 H SER 15 HN SER 15 53.517 -1.362 -1.362
104 HA SER 15 HA SER 15 52.261 0.106 0.106
105 1HB SER 15 HB2 SER 15 50.585 0.572 0.572
106 2HB SER 15 HB1 SER 15 51.067 -1.121 -1.121
107 HG SER 15 HG SER 15 51.982 1.011 1.011
108 H GLU 16 HN GLU 16 51.557 2.473 2.473
109 HA GLU 16 HA GLU 16 53.684 4.255 4.255
110 1HB GLU 16 HB2 GLU 16 51.449 4.938 4.938
111 2HB GLU 16 HB1 GLU 16 50.857 4.504 4.504
112 1HG GLU 16 HG2 GLU 16 51.992 6.321 6.321
113 2HG GLU 16 HG1 GLU 16 52.989 6.606 6.606
114 H GLU 17 HN GLU 17 52.049 2.909 2.909
115 HA GLU 17 HA GLU 17 52.978 4.487 4.487
116 1HB GLU 17 HB2 GLU 17 51.537 2.535 2.535
117 2HB GLU 17 HB1 GLU 17 52.845 1.464 1.464
118 1HG GLU 17 HG2 GLU 17 53.928 1.609 1.609
119 2HG GLU 17 HG1 GLU 17 53.441 3.285 3.285
120 H MET 18 HN MET 18 54.748 1.612 1.612
121 HA MET 18 HA MET 18 57.208 2.430 2.430
122 1HB MET 18 HB2 MET 18 56.575 0.086 0.086
123 2HB MET 18 HB1 MET 18 56.512 0.264 0.264
124 1HG MET 18 HG2 MET 18 58.701 -0.243 -0.243
125 2HG MET 18 HG1 MET 18 59.058 1.205 1.205
126 1HE MET 18 HE1 MET 18 58.556 1.394 1.394
127 2HE MET 18 HE3 MET 18 59.108 0.221 0.221
128 3HE MET 18 HE2 MET 18 60.261 0.963 0.963
129 H ILE 19 HN ILE 19 56.141 2.184 2.184
130 HA ILE 19 HA ILE 19 58.421 2.939 2.939
131 HB ILE 19 HB ILE 19 55.539 3.831 3.831
132 1HG1 ILE 19 HG12 ILE 19 57.217 1.561 1.561
133 2HG1 ILE 19 HG11 ILE 19 55.727 1.450 1.450
134 1HG2 ILE 19 HG22 ILE 19 57.393 5.226 5.226
135 2HG2 ILE 19 HG21 ILE 19 57.603 3.795 3.795
136 3HG2 ILE 19 HG23 ILE 19 56.048 4.627 4.627
137 HD1 ILE 19 HD1 ILE 19 56.102 1.948 1.948
138 HD1 ILE 19 HD1 ILE 19 54.895 2.970 2.970
139 HD1 ILE 19 HD1 ILE 19 54.742 1.214 1.214
140 H ALA 20 HN ALA 20 56.249 5.066 5.066
141 HA ALA 20 HA ALA 20 57.544 7.542 7.542
142 1HB ALA 20 HB1 ALA 20 55.617 6.541 6.541
143 2HB ALA 20 HB3 ALA 20 56.333 8.136 8.136
144 3HB ALA 20 HB2 ALA 20 55.392 7.795 7.795
145 H GLU 21 HN GLU 21 58.188 5.063 5.063
146 HA GLU 21 HA GLU 21 59.859 6.606 6.606
147 1HB GLU 21 HB2 GLU 21 58.867 4.479 4.479
148 2HB GLU 21 HB1 GLU 21 59.689 3.658 3.658
149 1HG GLU 21 HG2 GLU 21 61.770 3.768 3.768
150 2HG GLU 21 HG1 GLU 21 61.322 5.164 5.164
151 H PHE 22 HN PHE 22 60.589 4.540 4.540
152 HA PHE 22 HA PHE 22 63.460 4.981 4.981
153 1HB PHE 22 HB2 PHE 22 61.682 4.045 4.045
154 2HB PHE 22 HB1 PHE 22 63.420 3.781 3.781
155 HD1 PHE 22 HD2 PHE 22 62.621 3.557 3.557
156 HD2 PHE 22 HD1 PHE 22 61.817 1.430 1.430
157 HE1 PHE 22 HE2 PHE 22 62.203 1.487 1.487
158 HE2 PHE 22 HE1 PHE 22 61.400 -0.639 -0.639
159 HZ PHE 22 HZ PHE 22 61.592 -0.611 -0.611
160 H LYS 23 HN LYS 23 60.794 6.793 6.793
161 HA LYS 23 HA LYS 23 62.061 8.191 8.191
162 1HB LYS 23 HB2 LYS 23 59.773 8.704 8.704
163 2HB LYS 23 HB1 LYS 23 60.225 9.907 9.907
164 1HG LYS 23 HG2 LYS 23 59.720 7.021 7.021
165 2HG LYS 23 HG1 LYS 23 58.421 8.214 8.214
166 1HD LYS 23 HD2 LYS 23 60.645 9.340 9.340
167 2HD LYS 23 HD1 LYS 23 60.294 7.750 7.750
168 1HE LYS 23 HE2 LYS 23 58.188 9.888 9.888
169 2HE LYS 23 HE1 LYS 23 58.956 9.569 9.569
170 1HZ LYS 23 HZ1 LYS 23 58.258 7.260 7.260
171 2HZ LYS 23 HZ3 LYS 23 57.509 7.567 7.567
172 3HZ LYS 23 HZ2 LYS 23 56.909 8.291 8.291
173 H ALA 24 HN ALA 24 61.289 9.546 9.546
174 HA ALA 24 HA ALA 24 63.019 11.780 11.780
175 1HB ALA 24 HB3 ALA 24 61.161 11.251 11.251
176 2HB ALA 24 HB2 ALA 24 62.302 10.192 10.192
177 3HB ALA 24 HB1 ALA 24 62.622 11.923 11.923
178 H ALA 25 HN ALA 25 63.734 8.424 8.424
179 HA ALA 25 HA ALA 25 66.390 8.974 8.974
180 1HB ALA 25 HB2 ALA 25 64.739 6.554 6.554
181 2HB ALA 25 HB1 ALA 25 66.431 6.383 6.383
182 3HB ALA 25 HB3 ALA 25 65.270 7.079 7.079
183 H PHE 26 HN PHE 26 65.070 7.539 7.539
184 HA PHE 26 HA PHE 26 67.615 7.107 7.107
185 1HB PHE 26 HB2 PHE 26 65.697 5.936 5.936
186 2HB PHE 26 HB1 PHE 26 64.752 7.419 7.419
187 HD1 PHE 26 HD2 PHE 26 67.518 5.451 5.451
188 HD2 PHE 26 HD1 PHE 26 64.947 8.865 8.865
189 HE1 PHE 26 HE2 PHE 26 68.262 5.711 5.711
190 HE2 PHE 26 HE1 PHE 26 65.693 9.125 9.125
191 HZ PHE 26 HZ PHE 26 67.351 7.549 7.549
192 H ASP 27 HN ASP 27 65.397 9.873 9.873
193 HA ASP 27 HA ASP 27 66.666 11.413 11.413
194 1HB ASP 27 HB2 ASP 27 64.772 11.850 11.850
195 2HB ASP 27 HB1 ASP 27 65.466 13.267 13.267
196 H MET 28 HN MET 28 67.805 10.495 10.495
197 HA MET 28 HA MET 28 69.103 12.820 12.820
198 1HB MET 28 HB2 MET 28 69.650 9.848 9.848
199 2HB MET 28 HB1 MET 28 70.679 10.996 10.996
200 1HG MET 28 HG2 MET 28 67.936 11.656 11.656
201 2HG MET 28 HG1 MET 28 68.175 9.937 9.937
202 1HE MET 28 HE3 MET 28 68.538 9.174 9.174
203 2HE MET 28 HE2 MET 28 70.275 9.040 9.040
204 3HE MET 28 HE1 MET 28 69.667 9.699 9.699
205 H PHE 29 HN PHE 29 69.850 10.794 10.794
206 HA PHE 29 HA PHE 29 72.450 12.260 12.260
207 1HB PHE 29 HB2 PHE 29 71.764 9.581 9.581
208 2HB PHE 29 HB1 PHE 29 73.357 10.254 10.254
209 HD1 PHE 29 HD1 PHE 29 74.263 10.265 10.265
210 HD2 PHE 29 HD2 PHE 29 70.395 8.603 8.603
211 HE1 PHE 29 HE1 PHE 29 74.231 9.185 9.185
212 HE2 PHE 29 HE2 PHE 29 70.363 7.526 7.526
213 HZ PHE 29 HZ PHE 29 72.281 7.816 7.816
214 H ASP 30 HN ASP 30 69.618 12.899 12.899
215 HA ASP 30 HA ASP 30 70.048 12.719 12.719
216 1HB ASP 30 HB2 ASP 30 67.780 12.691 12.691
217 2HB ASP 30 HB1 ASP 30 67.521 13.742 13.742
218 H ALA 31 HN ALA 31 71.729 14.565 14.565
219 HA ALA 31 HA ALA 31 70.758 17.181 17.181
220 1HB ALA 31 HB2 ALA 31 73.129 16.028 16.028
221 2HB ALA 31 HB1 ALA 31 73.282 16.655 16.655
222 3HB ALA 31 HB3 ALA 31 73.015 17.764 17.764
223 H ASP 32 HN ASP 32 71.564 15.589 15.589
224 HA ASP 32 HA ASP 32 70.121 17.813 17.813
225 1HB ASP 32 HB2 ASP 32 72.881 17.058 17.058
226 2HB ASP 32 HB1 ASP 32 72.166 16.679 16.679
227 H GLY 33 HN GLY 33 70.126 14.575 14.575
228 1HA GLY 33 HA2 GLY 33 69.399 13.555 13.555
229 2HA GLY 33 HA1 GLY 33 69.355 12.642 12.642
230 H GLY 34 HN GLY 34 67.747 14.512 14.512
231 1HA GLY 34 HA2 GLY 34 65.465 14.822 14.822
232 2HA GLY 34 HA1 GLY 34 65.370 15.346 15.346
233 H GLY 35 HN GLY 35 66.296 12.101 12.101
234 1HA GLY 35 HA2 GLY 35 64.088 10.581 10.581
235 2HA GLY 35 HA1 GLY 35 64.089 11.014 11.014
236 H ASP 36 HN ASP 36 67.212 11.049 11.049
237 HA ASP 36 HA ASP 36 67.708 8.124 8.124
238 1HB ASP 36 HB2 ASP 36 68.803 8.265 8.265
239 2HB ASP 36 HB1 ASP 36 67.055 8.500 8.500
240 H ILE 37 HN ILE 37 69.582 7.876 7.876
241 HA ILE 37 HA ILE 37 71.481 10.173 10.173
242 HB ILE 37 HB ILE 37 72.199 9.092 9.092
243 1HG1 ILE 37 HG12 ILE 37 70.519 6.778 6.778
244 2HG1 ILE 37 HG11 ILE 37 72.256 6.783 6.783
245 1HG2 ILE 37 HG22 ILE 37 69.540 9.905 9.905
246 2HG2 ILE 37 HG21 ILE 37 69.424 8.459 8.459
247 3HG2 ILE 37 HG23 ILE 37 70.358 9.847 9.847
248 HD1 ILE 37 HD1 ILE 37 71.308 7.591 7.591
249 HD1 ILE 37 HD1 ILE 37 71.671 5.914 5.914
250 HD1 ILE 37 HD1 ILE 37 70.015 6.511 6.511
251 H SER 38 HN SER 38 73.859 9.495 9.495
252 HA SER 38 HA SER 38 74.695 8.201 8.201
253 1HB SER 38 HB2 SER 38 76.317 8.208 8.208
254 2HB SER 38 HB1 SER 38 76.850 8.522 8.522
255 HG SER 38 HG SER 38 76.678 10.509 10.509
256 H THR 39 HN THR 39 75.059 6.055 6.055
257 HA THR 39 HA THR 39 73.894 3.923 3.923
258 HB THR 39 HB THR 39 75.473 2.560 2.560
259 HG1 THR 39 HG1 THR 39 76.596 3.898 3.898
260 1HG2 THR 39 HG23 THR 39 73.500 4.612 4.612
261 2HG2 THR 39 HG22 THR 39 74.497 3.917 3.917
262 3HG2 THR 39 HG21 THR 39 73.500 2.869 2.869
263 H LYS 40 HN LYS 40 76.889 5.572 5.572
264 HA LYS 40 HA LYS 40 78.144 3.371 3.371
265 1HB LYS 40 HB2 LYS 40 79.930 4.960 4.960
266 2HB LYS 40 HB1 LYS 40 79.280 5.207 5.207
267 1HG LYS 40 HG2 LYS 40 79.221 7.394 7.394
268 2HG LYS 40 HG1 LYS 40 77.689 6.898 6.898
269 1HD LYS 40 HD2 LYS 40 78.486 7.335 7.335
270 2HD LYS 40 HD1 LYS 40 79.819 6.210 6.210
271 1HE LYS 40 HE2 LYS 40 80.018 8.884 8.884
272 2HE LYS 40 HE1 LYS 40 80.285 8.809 8.809
273 1HZ LYS 40 HZ3 LYS 40 81.550 6.937 6.937
274 2HZ LYS 40 HZ2 LYS 40 82.308 8.357 8.357
275 3HZ LYS 40 HZ1 LYS 40 81.914 7.127 7.127
276 H GLU 41 HN GLU 41 75.641 5.494 5.494
277 HA GLU 41 HA GLU 41 76.335 5.751 5.751
278 1HB GLU 41 HB2 GLU 41 75.666 7.735 7.735
279 2HB GLU 41 HB1 GLU 41 74.091 6.978 6.978
280 1HG GLU 41 HG2 GLU 41 73.513 8.137 8.137
281 2HG GLU 41 HG1 GLU 41 74.327 6.818 6.818
282 H LEU 42 HN LEU 42 74.875 3.526 3.526
283 HA LEU 42 HA LEU 42 72.318 3.042 3.042
284 1HB LEU 42 HB2 LEU 42 74.134 1.874 1.874
285 2HB LEU 42 HB1 LEU 42 73.695 0.609 0.609
286 HG LEU 42 HG LEU 42 71.273 1.276 1.276
287 HD1 LEU 42 HD1 LEU 42 72.658 3.092 3.092
288 HD1 LEU 42 HD1 LEU 42 71.222 3.384 3.384
289 HD1 LEU 42 HD1 LEU 42 71.108 2.401 2.401
290 HD2 LEU 42 HD2 LEU 42 71.951 -0.710 -0.710
291 HD2 LEU 42 HD2 LEU 42 73.004 0.160 0.160
292 HD2 LEU 42 HD2 LEU 42 71.252 0.261 0.261
293 H GLY 43 HN GLY 43 75.402 1.349 1.349
294 1HA GLY 43 HA2 GLY 43 74.614 -0.195 -0.195
295 2HA GLY 43 HA1 GLY 43 76.205 0.566 0.566
296 H THR 44 HN THR 44 75.669 3.223 3.223
297 HA THR 44 HA THR 44 75.363 3.647 3.647
298 HB THR 44 HB THR 44 74.887 5.334 5.334
299 HG1 THR 44 HG1 THR 44 76.863 6.101 6.101
300 1HG2 THR 44 HG21 THR 44 74.650 6.146 6.146
301 2HG2 THR 44 HG23 THR 44 74.926 7.302 7.302
302 3HG2 THR 44 HG22 THR 44 73.446 6.343 6.343
303 H VAL 45 HN VAL 45 72.846 4.612 4.612
304 HA VAL 45 HA VAL 45 70.718 5.047 5.047
305 HB VAL 45 HB VAL 45 70.696 3.612 3.612
306 1HG1 VAL 45 HG13 VAL 45 68.588 5.034 5.034
307 2HG1 VAL 45 HG12 VAL 45 68.451 4.897 4.897
308 3HG1 VAL 45 HG11 VAL 45 68.504 3.443 3.443
309 1HG2 VAL 45 HG21 VAL 45 71.482 6.276 6.276
310 2HG2 VAL 45 HG23 VAL 45 71.480 5.555 5.555
311 3HG2 VAL 45 HG22 VAL 45 70.032 6.359 6.359
312 H MET 46 HN MET 46 71.282 1.893 1.893
313 HA MET 46 HA MET 46 69.394 0.328 0.328
314 1HB MET 46 HB2 MET 46 72.221 -0.177 -0.177
315 2HB MET 46 HB1 MET 46 71.224 -1.485 -1.485
316 1HG MET 46 HG2 MET 46 69.511 -1.054 -1.054
317 2HG MET 46 HG1 MET 46 70.420 0.332 0.332
318 1HE MET 46 HE2 MET 46 69.169 -2.331 -2.331
319 2HE MET 46 HE1 MET 46 70.285 -3.303 -3.303
320 3HE MET 46 HE3 MET 46 70.048 -3.655 -3.655
321 H ARG 47 HN ARG 47 72.632 1.238 1.238
322 HA ARG 47 HA ARG 47 72.303 -0.243 -0.243
323 1HB ARG 47 HB2 ARG 47 74.311 1.603 1.603
324 2HB ARG 47 HB1 ARG 47 74.454 1.208 1.208
325 1HG ARG 47 HG2 ARG 47 74.038 -1.270 -1.270
326 2HG ARG 47 HG1 ARG 47 74.860 -0.521 -0.521
327 1HD ARG 47 HD2 ARG 47 76.858 -0.435 -0.435
328 2HD ARG 47 HD1 ARG 47 76.093 0.059 0.059
329 HE ARG 47 HE ARG 47 75.335 -2.371 -2.371
330 1HH1 ARG 47 HH2 ARG 47 78.385 -1.304 -1.304
331 2HH1 ARG 47 HH2 ARG 47 79.015 -2.888 -2.888
332 1HH2 ARG 47 HH1 ARG 47 75.987 -4.486 -4.486
333 2HH2 ARG 47 HH1 ARG 47 77.656 -4.689 -4.689
334 H MET 48 HN MET 48 71.758 3.036 3.036
335 HA MET 48 HA MET 48 71.586 4.266 4.266
336 1HB MET 48 HB2 MET 48 70.917 4.965 4.965
337 2HB MET 48 HB1 MET 48 70.361 6.015 6.015
338 1HG MET 48 HG2 MET 48 73.125 5.289 5.289
339 2HG MET 48 HG1 MET 48 72.924 5.983 5.983
340 1HE MET 48 HE1 MET 48 74.276 6.783 6.783
341 2HE MET 48 HE3 MET 48 73.496 8.150 8.150
342 3HE MET 48 HE2 MET 48 72.786 6.540 6.540
343 H LEU 49 HN LEU 49 69.612 2.041 2.041
344 HA LEU 49 HA LEU 49 67.085 3.172 3.172
345 1HB LEU 49 HB2 LEU 49 67.707 0.885 0.885
346 2HB LEU 49 HB1 LEU 49 66.079 1.373 1.373
347 HG LEU 49 HG LEU 49 68.027 3.348 3.348
348 HD1 LEU 49 HD1 LEU 49 67.758 1.426 1.426
349 HD1 LEU 49 HD1 LEU 49 67.033 2.908 2.908
350 HD1 LEU 49 HD1 LEU 49 66.008 1.650 1.650
351 HD2 LEU 49 HD2 LEU 49 65.122 3.224 3.224
352 HD2 LEU 49 HD2 LEU 49 65.577 4.129 4.129
353 HD2 LEU 49 HD2 LEU 49 66.247 4.578 4.578
354 H GLY 50 HN GLY 50 69.409 0.577 0.577
355 1HA GLY 50 HA2 GLY 50 69.476 -0.379 -0.379
356 2HA GLY 50 HA1 GLY 50 67.719 -0.496 -0.496
357 H GLN 51 HN GLN 51 69.808 -1.261 -1.261
358 HA GLN 51 HA GLN 51 68.988 -4.132 -4.132
359 1HB GLN 51 HB2 GLN 51 69.637 -2.513 -2.513
360 2HB GLN 51 HB1 GLN 51 69.025 -4.168 -4.168
361 1HG GLN 51 HG2 GLN 51 67.597 -1.638 -1.638
362 2HG GLN 51 HG1 GLN 51 67.111 -2.813 -2.813
363 1HE2 GLN 51 HE22 GLN 51 65.554 -3.297 -3.297
364 2HE2 GLN 51 HE21 GLN 51 66.028 -1.830 -1.830
365 H ASN 52 HN ASN 52 70.701 -5.172 -5.172
366 HA ASN 52 HA ASN 52 73.470 -4.358 -4.358
367 1HB ASN 52 HB2 ASN 52 72.199 -6.960 -6.960
368 2HB ASN 52 HB1 ASN 52 73.939 -6.669 -6.669
369 HD2 ASN 52 HD2 ASN 52 74.753 -4.955 -4.955
370 HD2 ASN 52 HD2 ASN 52 73.823 -4.460 -4.460
371 HA PRO 53 HA PRO 53 72.792 -6.324 -6.324
372 1HB PRO 53 HB2 PRO 53 73.968 -4.330 -4.330
373 2HB PRO 53 HB1 PRO 53 72.255 -4.302 -4.302
374 1HG PRO 53 HG2 PRO 53 74.558 -2.853 -2.853
375 2HG PRO 53 HG1 PRO 53 72.884 -2.325 -2.325
376 1HD PRO 53 HD2 PRO 53 73.927 -3.189 -3.189
377 2HD PRO 53 HD1 PRO 53 72.200 -3.235 -3.235
378 H THR 54 HN THR 54 74.352 -7.909 -7.909
379 HA THR 54 HA THR 54 77.051 -7.713 -7.713
380 HB THR 54 HB THR 54 77.299 -9.755 -9.755
381 HG1 THR 54 HG1 THR 54 74.986 -10.318 -10.318
382 1HG2 THR 54 HG22 THR 54 75.984 -9.473 -9.473
383 2HG2 THR 54 HG21 THR 54 74.702 -10.158 -10.158
384 3HG2 THR 54 HG23 THR 54 76.224 -11.026 -11.026
385 H LYS 55 HN LYS 55 78.919 -7.004 -7.004
386 HA LYS 55 HA LYS 55 78.919 -5.072 -5.072
387 1HB LYS 55 HB2 LYS 55 80.772 -6.239 -6.239
388 2HB LYS 55 HB1 LYS 55 81.109 -7.111 -7.111
389 1HG LYS 55 HG2 LYS 55 81.644 -5.139 -5.139
390 2HG LYS 55 HG1 LYS 55 80.836 -4.110 -4.110
391 1HD LYS 55 HD2 LYS 55 82.734 -5.433 -5.433
392 2HD LYS 55 HD1 LYS 55 83.577 -5.146 -5.146
393 1HE LYS 55 HE2 LYS 55 83.998 -3.105 -3.105
394 2HE LYS 55 HE1 LYS 55 82.402 -2.722 -2.722
395 1HZ LYS 55 HZ1 LYS 55 81.382 -3.523 -3.523
396 2HZ LYS 55 HZ3 LYS 55 82.909 -3.861 -3.861
397 3HZ LYS 55 HZ2 LYS 55 82.462 -2.254 -2.254
398 H GLU 56 HN GLU 56 79.144 -8.609 -8.609
399 HA GLU 56 HA GLU 56 79.544 -8.694 -8.694
400 1HB GLU 56 HB2 GLU 56 78.560 -10.402 -10.402
401 2HB GLU 56 HB1 GLU 56 77.814 -10.791 -10.791
402 1HG GLU 56 HG2 GLU 56 79.801 -12.106 -12.106
403 2HG GLU 56 HG1 GLU 56 80.176 -10.759 -10.759
404 H GLU 57 HN GLU 57 76.575 -8.131 -8.131
405 HA GLU 57 HA GLU 57 74.769 -8.327 -8.327
406 1HB GLU 57 HB2 GLU 57 74.741 -7.479 -7.479
407 2HB GLU 57 HB1 GLU 57 73.445 -6.853 -6.853
408 1HG GLU 57 HG2 GLU 57 74.182 -9.787 -9.787
409 2HG GLU 57 HG1 GLU 57 72.920 -9.055 -9.055
410 H LEU 58 HN LEU 58 75.995 -5.507 -5.507
411 HA LEU 58 HA LEU 58 74.898 -3.473 -3.473
412 1HB LEU 58 HB2 LEU 58 77.556 -3.492 -3.492
413 2HB LEU 58 HB1 LEU 58 76.584 -2.074 -2.074
414 HG LEU 58 HG LEU 58 75.963 -4.283 -4.283
415 HD1 LEU 58 HD1 LEU 58 75.409 -2.047 -2.047
416 HD1 LEU 58 HD1 LEU 58 76.458 -1.327 -1.327
417 HD1 LEU 58 HD1 LEU 58 77.078 -2.593 -2.593
418 HD2 LEU 58 HD2 LEU 58 73.787 -2.718 -2.718
419 HD2 LEU 58 HD2 LEU 58 73.838 -4.111 -4.111
420 HD2 LEU 58 HD2 LEU 58 74.123 -2.492 -2.492
421 H ASP 59 HN ASP 59 78.043 -5.153 -5.153
422 HA ASP 59 HA ASP 59 79.050 -3.665 -3.665
423 1HB ASP 59 HB2 ASP 59 80.299 -5.186 -5.186
424 2HB ASP 59 HB1 ASP 59 79.542 -6.560 -6.560
425 H ALA 60 HN ALA 60 77.219 -6.733 -6.733
426 HA ALA 60 HA ALA 60 77.136 -7.112 -7.112
427 1HB ALA 60 HB3 ALA 60 75.537 -8.212 -8.212
428 2HB ALA 60 HB2 ALA 60 75.415 -8.827 -8.827
429 3HB ALA 60 HB1 ALA 60 76.937 -8.960 -8.960
430 H ILE 61 HN ILE 61 74.994 -5.595 -5.595
431 HA ILE 61 HA ILE 61 72.799 -5.186 -5.186
432 HB ILE 61 HB ILE 61 73.533 -4.124 -4.124
433 1HG1 ILE 61 HG12 ILE 61 71.333 -6.012 -6.012
434 2HG1 ILE 61 HG11 ILE 61 72.898 -6.551 -6.551
435 1HG2 ILE 61 HG22 ILE 61 71.430 -3.287 -3.287
436 2HG2 ILE 61 HG21 ILE 61 70.847 -3.670 -3.670
437 3HG2 ILE 61 HG23 ILE 61 72.087 -2.436 -2.436
438 HD1 ILE 61 HD1 ILE 61 72.319 -4.935 -4.935
439 HD1 ILE 61 HD1 ILE 61 71.648 -6.565 -6.565
440 HD1 ILE 61 HD1 ILE 61 70.663 -5.190 -5.190
441 H ILE 62 HN ILE 62 75.061 -2.909 -2.909
442 HA ILE 62 HA ILE 62 74.442 -0.529 -0.529
443 HB ILE 62 HB ILE 62 77.091 -1.812 -1.812
444 1HG1 ILE 62 HG12 ILE 62 75.401 0.335 0.335
445 2HG1 ILE 62 HG11 ILE 62 75.559 -1.335 -1.335
446 1HG2 ILE 62 HG21 ILE 62 76.616 0.554 0.554
447 2HG2 ILE 62 HG23 ILE 62 77.339 1.010 1.010
448 3HG2 ILE 62 HG22 ILE 62 78.156 -0.149 -0.149
449 HD1 ILE 62 HD1 ILE 62 77.070 -0.015 -0.015
450 HD1 ILE 62 HD1 ILE 62 77.728 0.776 0.776
451 HD1 ILE 62 HD1 ILE 62 78.053 -0.933 -0.933
452 H GLU 63 HN GLU 63 76.808 -2.900 -2.900
453 HA GLU 63 HA GLU 63 77.216 -1.631 -1.631
454 1HB GLU 63 HB2 GLU 63 78.632 -3.410 -3.410
455 2HB GLU 63 HB1 GLU 63 77.279 -4.542 -4.542
456 1HG GLU 63 HG2 GLU 63 77.916 -5.122 -5.122
457 2HG GLU 63 HG1 GLU 63 77.392 -3.522 -3.522
458 H GLU 64 HN GLU 64 74.835 -4.088 -4.088
459 HA GLU 64 HA GLU 64 73.616 -4.457 -4.457
460 1HB GLU 64 HB2 GLU 64 73.196 -6.112 -6.112
461 2HB GLU 64 HB1 GLU 64 72.923 -4.935 -4.935
462 1HG GLU 64 HG2 GLU 64 70.805 -6.000 -6.000
463 2HG GLU 64 HG1 GLU 64 70.793 -4.271 -4.271
464 H VAL 65 HN VAL 65 72.642 -2.468 -2.468
465 HA VAL 65 HA VAL 65 70.522 -1.139 -1.139
466 HB VAL 65 HB VAL 65 70.148 -0.012 -0.012
467 1HG1 VAL 65 HG12 VAL 65 70.705 -2.973 -2.973
468 2HG1 VAL 65 HG11 VAL 65 70.110 -2.167 -2.167
469 3HG1 VAL 65 HG13 VAL 65 69.149 -2.143 -2.143
470 1HG2 VAL 65 HG21 VAL 65 72.900 -0.297 -0.297
471 2HG2 VAL 65 HG23 VAL 65 71.787 0.260 0.260
472 3HG2 VAL 65 HG22 VAL 65 72.245 -1.441 -1.441
473 H ASP 66 HN ASP 66 73.830 -0.785 -0.785
474 HA ASP 66 HA ASP 66 74.166 2.065 2.065
475 1HB ASP 66 HB2 ASP 66 75.675 -0.336 -0.336
476 2HB ASP 66 HB1 ASP 66 76.172 1.067 1.067
477 H GLU 67 HN GLU 67 72.684 3.188 3.188
478 HA GLU 67 HA GLU 67 71.949 2.583 2.583
479 1HB GLU 67 HB2 GLU 67 71.380 4.496 4.496
480 2HB GLU 67 HB1 GLU 67 72.429 5.427 5.427
481 1HG GLU 67 HG2 GLU 67 71.035 4.746 4.746
482 2HG GLU 67 HG1 GLU 67 69.965 3.871 3.871
483 H ASP 68 HN ASP 68 73.434 2.137 2.137
484 HA ASP 68 HA ASP 68 76.123 3.126 3.126
485 1HB ASP 68 HB2 ASP 68 75.406 1.098 1.098
486 2HB ASP 68 HB1 ASP 68 74.243 2.004 2.004
487 H GLY 69 HN GLY 69 75.378 5.487 5.487
488 1HA GLY 69 HA2 GLY 69 75.895 7.141 7.141
489 2HA GLY 69 HA1 GLY 69 74.138 6.998 6.998
490 H SER 70 HN SER 70 73.910 6.806 6.806
491 HA SER 70 HA SER 70 74.814 9.551 9.551
492 1HB SER 70 HB2 SER 70 72.212 8.060 8.060
493 2HB SER 70 HB1 SER 70 72.597 9.299 9.299
494 HG SER 70 HG SER 70 73.150 10.556 10.556
495 H GLY 71 HN GLY 71 74.425 6.182 6.182
496 1HA GLY 71 HA2 GLY 71 75.317 4.963 4.963
497 2HA GLY 71 HA1 GLY 71 76.340 6.360 6.360
498 H THR 72 HN THR 72 72.783 6.185 6.185
499 HA THR 72 HA THR 72 72.830 6.833 6.833
500 HB THR 72 HB THR 72 70.587 8.071 8.071
501 HG1 THR 72 HG1 THR 72 71.132 7.799 7.799
502 1HG2 THR 72 HG21 THR 72 73.267 8.838 8.838
503 2HG2 THR 72 HG23 THR 72 72.505 10.040 10.040
504 3HG2 THR 72 HG22 THR 72 71.692 9.505 9.505
505 H ILE 73 HN ILE 73 70.810 6.213 6.213
506 HA ILE 73 HA ILE 73 69.522 3.834 3.834
507 HB ILE 73 HB ILE 73 70.871 3.617 3.617
508 1HG1 ILE 73 HG12 ILE 73 68.969 2.430 2.430
509 2HG1 ILE 73 HG11 ILE 73 67.916 2.973 2.973
510 1HG2 ILE 73 HG22 ILE 73 69.886 5.932 5.932
511 2HG2 ILE 73 HG21 ILE 73 68.575 4.939 4.939
512 3HG2 ILE 73 HG23 ILE 73 70.229 4.682 4.682
513 HD1 ILE 73 HD1 ILE 73 70.177 1.904 1.904
514 HD1 ILE 73 HD1 ILE 73 68.576 1.169 1.169
515 HD1 ILE 73 HD1 ILE 73 69.809 0.775 0.775
516 H ASP 74 HN ASP 74 67.214 3.631 3.631
517 HA ASP 74 HA ASP 74 65.795 6.234 6.234
518 1HB ASP 74 HB2 ASP 74 65.230 3.628 3.628
519 2HB ASP 74 HB1 ASP 74 63.998 4.877 4.877
520 H PHE 75 HN PHE 75 64.474 6.495 6.495
521 HA PHE 75 HA PHE 75 64.301 4.785 4.785
522 1HB PHE 75 HB2 PHE 75 63.487 7.217 7.217
523 2HB PHE 75 HB1 PHE 75 61.977 6.466 6.466
524 HD1 PHE 75 HD2 PHE 75 61.188 4.477 4.477
525 HD2 PHE 75 HD1 PHE 75 63.619 7.851 7.851
526 HE1 PHE 75 HE2 PHE 75 60.516 4.206 4.206
527 HE2 PHE 75 HE1 PHE 75 62.947 7.580 7.580
528 HZ PHE 75 HZ PHE 75 61.395 5.757 5.757
529 H GLU 76 HN GLU 76 61.957 4.992 4.992
530 HA GLU 76 HA GLU 76 60.156 2.991 2.991
531 1HB GLU 76 HB2 GLU 76 59.788 2.767 2.767
532 2HB GLU 76 HB1 GLU 76 59.731 4.420 4.420
533 1HG GLU 76 HG2 GLU 76 61.219 4.839 4.839
534 2HG GLU 76 HG1 GLU 76 62.396 4.161 4.161
535 H GLU 77 HN GLU 77 63.241 2.651 2.651
536 HA GLU 77 HA GLU 77 62.987 -0.277 -0.277
537 1HB GLU 77 HB2 GLU 77 64.055 1.244 1.244
538 2HB GLU 77 HB1 GLU 77 65.358 1.527 1.527
539 1HG GLU 77 HG2 GLU 77 66.289 -0.505 -0.505
540 2HG GLU 77 HG1 GLU 77 64.723 -1.317 -1.317
541 H PHE 78 HN PHE 78 65.178 2.050 2.050
542 HA PHE 78 HA PHE 78 66.796 0.339 0.339
543 1HB PHE 78 HB2 PHE 78 67.037 2.741 2.741
544 2HB PHE 78 HB1 PHE 78 65.432 2.943 2.943
545 HD1 PHE 78 HD1 PHE 78 68.718 1.275 1.275
546 HD2 PHE 78 HD2 PHE 78 65.201 3.108 3.108
547 HE1 PHE 78 HE1 PHE 78 69.692 1.101 1.101
548 HE2 PHE 78 HE2 PHE 78 66.173 2.934 2.934
549 HZ PHE 78 HZ PHE 78 68.419 1.930 1.930
550 H LEU 79 HN LEU 79 63.393 1.111 1.111
551 HA LEU 79 HA LEU 79 62.939 0.248 0.248
552 1HB LEU 79 HB2 LEU 79 61.486 0.342 0.342
553 2HB LEU 79 HB1 LEU 79 60.830 -0.823 -0.823
554 HG LEU 79 HG LEU 79 61.551 1.837 1.837
555 HD1 LEU 79 HD1 LEU 79 58.872 1.717 1.717
556 HD1 LEU 79 HD1 LEU 79 60.228 1.910 1.910
557 HD1 LEU 79 HD1 LEU 79 59.972 3.084 3.084
558 HD2 LEU 79 HD2 LEU 79 60.075 -0.445 -0.445
559 HD2 LEU 79 HD2 LEU 79 58.881 0.829 0.829
560 HD2 LEU 79 HD2 LEU 79 60.208 1.073 1.073
561 H VAL 80 HN VAL 80 63.291 -1.802 -1.802
562 HA VAL 80 HA VAL 80 62.778 -4.316 -4.316
563 HB VAL 80 HB VAL 80 63.122 -3.620 -3.620
564 1HG1 VAL 80 HG13 VAL 80 65.404 -2.626 -2.626
565 2HG1 VAL 80 HG12 VAL 80 66.004 -4.272 -4.272
566 3HG1 VAL 80 HG11 VAL 80 65.358 -3.748 -3.748
567 1HG2 VAL 80 HG21 VAL 80 63.092 -6.033 -6.033
568 2HG2 VAL 80 HG23 VAL 80 63.340 -5.845 -5.845
569 3HG2 VAL 80 HG22 VAL 80 64.724 -6.079 -6.079
570 H MET 81 HN MET 81 65.757 -2.381 -2.381
571 HA MET 81 HA MET 81 67.519 -4.339 -4.339
572 1HB MET 81 HB2 MET 81 67.437 -1.392 -1.392
573 2HB MET 81 HB1 MET 81 68.645 -1.985 -1.985
574 1HG MET 81 HG2 MET 81 69.797 -2.118 -2.118
575 2HG MET 81 HG1 MET 81 69.153 -3.752 -3.752
576 1HE MET 81 HE2 MET 81 68.667 -4.803 -4.803
577 2HE MET 81 HE1 MET 81 67.984 -4.241 -4.241
578 3HE MET 81 HE3 MET 81 69.630 -3.782 -3.782
579 H MET 82 HN MET 82 65.115 -2.203 -2.203
580 HA MET 82 HA MET 82 66.143 -2.369 -2.369
581 1HB MET 82 HB2 MET 82 63.453 -1.428 -1.428
582 2HB MET 82 HB1 MET 82 64.235 -0.963 -0.963
583 1HG MET 82 HG2 MET 82 66.101 0.041 0.041
584 2HG MET 82 HG1 MET 82 65.182 -0.308 -0.308
585 1HE MET 82 HE3 MET 82 65.880 1.464 1.464
586 2HE MET 82 HE2 MET 82 65.051 3.015 3.015
587 3HE MET 82 HE1 MET 82 64.272 1.658 1.658
588 H VAL 83 HN VAL 83 63.024 -3.337 -3.337
589 HA VAL 83 HA VAL 83 62.119 -5.010 -5.010
590 HB VAL 83 HB VAL 83 60.717 -4.320 -4.320
591 1HG1 VAL 83 HG12 VAL 83 62.864 -4.588 -4.588
592 2HG1 VAL 83 HG11 VAL 83 62.082 -6.128 -6.128
593 3HG1 VAL 83 HG13 VAL 83 61.222 -4.616 -4.616
594 1HG2 VAL 83 HG22 VAL 83 60.499 -6.690 -6.690
595 2HG2 VAL 83 HG21 VAL 83 59.580 -6.340 -6.340
596 3HG2 VAL 83 HG23 VAL 83 61.073 -7.272 -7.272
597 H ARG 84 HN ARG 84 64.070 -5.897 -5.897
598 HA ARG 84 HA ARG 84 64.328 -8.675 -8.675
599 1HB ARG 84 HB2 ARG 84 66.222 -6.749 -6.749
600 2HB ARG 84 HB1 ARG 84 66.238 -8.504 -8.504
601 1HG ARG 84 HG2 ARG 84 63.695 -6.997 -6.997
602 2HG ARG 84 HG1 ARG 84 64.955 -7.036 -7.036
603 1HD ARG 84 HD2 ARG 84 64.597 -9.695 -9.695
604 2HD ARG 84 HD1 ARG 84 63.036 -9.051 -9.051
605 HE ARG 84 HE ARG 84 64.402 -8.357 -8.357
606 1HH1 ARG 84 HH1 ARG 84 66.526 -10.179 -10.179
607 2HH1 ARG 84 HH1 ARG 84 66.578 -11.517 -11.517
608 1HH2 ARG 84 HH2 ARG 84 63.802 -10.487 -10.487
609 2HH2 ARG 84 HH2 ARG 84 65.035 -11.693 -11.693
610 H GLN 85 HN GLN 85 66.019 -5.830 -5.830
611 HA GLN 85 HA GLN 85 68.154 -7.353 -7.353
612 1HB GLN 85 HB2 GLN 85 68.648 -5.138 -5.138
613 2HB GLN 85 HB1 GLN 85 67.178 -4.490 -4.490
614 1HG GLN 85 HG2 GLN 85 68.108 -5.156 -5.156
615 2HG GLN 85 HG1 GLN 85 69.626 -5.538 -5.538
616 1HE2 GLN 85 HE22 GLN 85 68.511 -1.595 -1.595
617 2HE2 GLN 85 HE21 GLN 85 67.368 -2.810 -2.810
618 H MET 86 HN MET 86 65.330 -5.455 -5.455
619 HA MET 86 HA MET 86 65.600 -6.215 -6.215
620 1HB MET 86 HB2 MET 86 63.787 -4.759 -4.759
621 2HB MET 86 HB1 MET 86 62.914 -5.636 -5.636
622 1HG MET 86 HG2 MET 86 64.572 -4.647 -4.647
623 2HG MET 86 HG1 MET 86 65.109 -3.587 -3.587
624 1HE MET 86 HE1 MET 86 62.752 -4.340 -4.340
625 2HE MET 86 HE3 MET 86 63.707 -2.868 -2.868
626 3HE MET 86 HE2 MET 86 61.948 -2.782 -2.782
627 H LYS 87 HN LYS 87 64.287 -7.838 -7.838
628 HA LYS 87 HA LYS 87 62.353 -9.562 -9.562
629 1HB LYS 87 HB2 LYS 87 64.440 -9.652 -9.652
630 2HB LYS 87 HB1 LYS 87 63.687 -11.188 -11.188
631 1HG LYS 87 HG2 LYS 87 61.627 -9.214 -9.214
632 2HG LYS 87 HG1 LYS 87 62.619 -9.102 -9.102
633 1HD LYS 87 HD2 LYS 87 62.069 -11.870 -11.870
634 2HD LYS 87 HD1 LYS 87 60.604 -10.955 -10.955
635 1HE LYS 87 HE2 LYS 87 61.235 -11.774 -11.774
636 2HE LYS 87 HE1 LYS 87 61.963 -10.154 -10.154
637 1HZ LYS 87 HZ2 LYS 87 63.853 -11.504 -11.504
638 2HZ LYS 87 HZ1 LYS 87 63.242 -12.761 -12.761
639 3HZ LYS 87 HZ3 LYS 87 63.826 -11.344 -11.344
640 H GLU 88 HN GLU 88 65.789 -9.476 -9.476
641 HA GLU 88 HA GLU 88 65.729 -12.112 -12.112
642 1HB GLU 88 HB2 GLU 88 67.522 -11.516 -11.516
643 2HB GLU 88 HB1 GLU 88 67.981 -10.162 -10.162
644 1HG GLU 88 HG2 GLU 88 69.466 -11.820 -11.820
645 2HG GLU 88 HG1 GLU 88 68.148 -12.004 -12.004
646 H ASP 89 HN ASP 89 66.335 -8.655 -8.655
647 HA ASP 89 HA ASP 89 66.871 -9.058 -9.058
648 1HB ASP 89 HB2 ASP 89 66.509 -6.732 -6.732
649 2HB ASP 89 HB1 ASP 89 66.665 -6.470 -6.470
650 H ALA 90 HN ALA 90 64.101 -8.219 -8.219
651 HA ALA 90 HA ALA 90 62.421 -7.384 -7.384
652 1HB ALA 90 HB3 ALA 90 62.320 -6.595 -6.595
653 2HB ALA 90 HB2 ALA 90 61.650 -8.174 -8.174
654 3HB ALA 90 HB1 ALA 90 60.772 -7.098 -7.098
Start of MODEL 9
1 1H ALA 1 HT3 ALA 1 65.348 -3.226 -3.226
2 2H ALA 1 HT2 ALA 1 66.264 -2.131 -2.131
3 3H ALA 1 HT1 ALA 1 67.005 -3.038 -3.038
4 HA ALA 1 HA ALA 1 67.183 -4.900 -4.900
5 1HB ALA 1 HB3 ALA 1 67.659 -2.449 -2.449
6 2HB ALA 1 HB2 ALA 1 66.779 -3.381 -3.381
7 3HB ALA 1 HB1 ALA 1 68.276 -4.015 -4.015
8 H SER 2 HN SER 2 66.207 -6.390 -6.390
9 HA SER 2 HA SER 2 63.260 -6.283 -6.283
10 1HB SER 2 HB2 SER 2 64.948 -8.359 -8.359
11 2HB SER 2 HB1 SER 2 63.435 -8.569 -8.569
12 HG SER 2 HG SER 2 65.499 -9.214 -9.214
13 H MET 3 HN MET 3 65.554 -4.949 -4.949
14 HA MET 3 HA MET 3 64.747 -5.623 -5.623
15 1HB MET 3 HB2 MET 3 66.274 -3.559 -3.559
16 2HB MET 3 HB1 MET 3 65.603 -3.010 -3.010
17 1HG MET 3 HG2 MET 3 67.865 -3.992 -3.992
18 2HG MET 3 HG1 MET 3 66.639 -4.911 -4.911
19 1HE MET 3 HE3 MET 3 68.587 -4.344 -4.344
20 2HE MET 3 HE2 MET 3 69.723 -5.443 -5.443
21 3HE MET 3 HE1 MET 3 68.933 -5.921 -5.921
22 H THR 4 HN THR 4 63.170 -3.739 -3.739
23 HA THR 4 HA THR 4 61.657 -1.938 -1.938
24 HB THR 4 HB THR 4 62.036 -1.934 -1.934
25 HG1 THR 4 HG1 THR 4 59.958 -1.104 -1.104
26 1HG2 THR 4 HG22 THR 4 60.886 -4.483 -4.483
27 2HG2 THR 4 HG21 THR 4 59.657 -3.495 -3.495
28 3HG2 THR 4 HG23 THR 4 61.270 -3.628 -3.628
29 H ASP 5 HN ASP 5 61.546 -5.326 -5.326
30 HA ASP 5 HA ASP 5 58.654 -5.578 -5.578
31 1HB ASP 5 HB2 ASP 5 60.959 -7.261 -7.261
32 2HB ASP 5 HB1 ASP 5 59.834 -8.040 -8.040
33 H GLN 6 HN GLN 6 61.748 -6.119 -6.119
34 HA GLN 6 HA GLN 6 60.563 -6.986 -6.986
35 1HB GLN 6 HB2 GLN 6 63.035 -6.955 -6.955
36 2HB GLN 6 HB1 GLN 6 63.182 -5.585 -5.585
37 1HG GLN 6 HG2 GLN 6 63.854 -7.469 -7.469
38 2HG GLN 6 HG1 GLN 6 62.200 -7.138 -7.138
39 1HE2 GLN 6 HE22 GLN 6 62.965 -10.500 -10.500
40 2HE2 GLN 6 HE21 GLN 6 64.099 -9.236 -9.236
41 H GLN 7 HN GLN 7 60.561 -3.959 -3.959
42 HA GLN 7 HA GLN 7 60.882 -2.251 -2.251
43 1HB GLN 7 HB2 GLN 7 61.171 -1.711 -1.711
44 2HB GLN 7 HB1 GLN 7 59.410 -1.678 -1.678
45 1HG GLN 7 HG2 GLN 7 59.666 -0.068 -0.068
46 2HG GLN 7 HG1 GLN 7 61.264 0.203 0.203
47 1HE2 GLN 7 HE22 GLN 7 58.453 2.398 2.398
48 2HE2 GLN 7 HE21 GLN 7 58.648 1.906 1.906
49 H ALA 8 HN ALA 8 57.946 -2.685 -2.685
50 HA ALA 8 HA ALA 8 56.050 -1.708 -1.708
51 1HB ALA 8 HB2 ALA 8 56.102 -3.795 -3.795
52 2HB ALA 8 HB1 ALA 8 54.627 -3.610 -3.610
53 3HB ALA 8 HB3 ALA 8 55.260 -2.246 -2.246
54 H GLU 9 HN GLU 9 57.547 -4.927 -4.927
55 HA GLU 9 HA GLU 9 55.838 -5.902 -5.902
56 1HB GLU 9 HB2 GLU 9 56.879 -7.166 -7.166
57 2HB GLU 9 HB1 GLU 9 58.358 -7.172 -7.172
58 1HG GLU 9 HG2 GLU 9 55.760 -8.086 -8.086
59 2HG GLU 9 HG1 GLU 9 56.715 -9.188 -9.188
60 H ALA 10 HN ALA 10 58.722 -4.080 -4.080
61 HA ALA 10 HA ALA 10 60.008 -5.027 -5.027
62 1HB ALA 10 HB2 ALA 10 60.443 -3.098 -3.098
63 2HB ALA 10 HB1 ALA 10 61.078 -2.567 -2.567
64 3HB ALA 10 HB3 ALA 10 61.611 -4.099 -4.099
65 H ARG 11 HN ARG 11 57.790 -2.419 -2.419
66 HA ARG 11 HA ARG 11 57.999 -1.125 -1.125
67 1HB ARG 11 HB2 ARG 11 55.912 -0.582 -0.582
68 2HB ARG 11 HB1 ARG 11 56.677 0.554 0.554
69 1HG ARG 11 HG2 ARG 11 58.084 1.087 1.087
70 2HG ARG 11 HG1 ARG 11 58.800 -0.514 -0.514
71 1HD ARG 11 HD2 ARG 11 58.173 -0.447 -0.447
72 2HD ARG 11 HD1 ARG 11 56.840 -1.329 -1.329
73 HE ARG 11 HE ARG 11 56.710 1.428 1.428
74 1HH1 ARG 11 HH1 ARG 11 55.313 2.414 2.414
75 2HH1 ARG 11 HH1 ARG 11 53.777 1.620 1.620
76 1HH2 ARG 11 HH2 ARG 11 54.758 -1.089 -1.089
77 2HH2 ARG 11 HH2 ARG 11 53.462 -0.363 -0.363
78 H ALA 12 HN ALA 12 55.850 -3.325 -3.325
79 HA ALA 12 HA ALA 12 53.576 -3.137 -3.137
80 1HB ALA 12 HB3 ALA 12 54.288 -4.378 -4.378
81 2HB ALA 12 HB2 ALA 12 54.167 -5.743 -5.743
82 3HB ALA 12 HB1 ALA 12 52.783 -4.675 -4.675
83 H PHE 13 HN PHE 13 56.694 -4.344 -4.344
84 HA PHE 13 HA PHE 13 56.139 -6.622 -6.622
85 1HB PHE 13 HB2 PHE 13 58.343 -6.245 -6.245
86 2HB PHE 13 HB1 PHE 13 58.376 -4.597 -4.597
87 HD1 PHE 13 HD1 PHE 13 57.267 -7.770 -7.770
88 HD2 PHE 13 HD2 PHE 13 60.114 -4.553 -4.553
89 HE1 PHE 13 HE1 PHE 13 58.248 -8.598 -8.598
90 HE2 PHE 13 HE2 PHE 13 61.094 -5.381 -5.381
91 HZ PHE 13 HZ PHE 13 60.162 -7.404 -7.404
92 H LEU 14 HN LEU 14 56.670 -3.175 -3.175
93 HA LEU 14 HA LEU 14 55.647 -3.736 -3.736
94 1HB LEU 14 HB2 LEU 14 57.097 -1.315 -1.315
95 2HB LEU 14 HB1 LEU 14 56.846 -1.706 -1.706
96 HG LEU 14 HG LEU 14 58.293 -3.614 -3.614
97 HD1 LEU 14 HD1 LEU 14 59.507 -1.518 -1.518
98 HD1 LEU 14 HD1 LEU 14 60.411 -2.593 -2.593
99 HD1 LEU 14 HD1 LEU 14 59.449 -1.280 -1.280
100 HD2 LEU 14 HD2 LEU 14 57.699 -4.609 -4.609
101 HD2 LEU 14 HD2 LEU 14 58.083 -3.144 -3.144
102 HD2 LEU 14 HD2 LEU 14 59.380 -4.118 -4.118
103 H SER 15 HN SER 15 53.975 -2.366 -2.366
104 HA SER 15 HA SER 15 51.879 -1.623 -1.623
105 1HB SER 15 HB2 SER 15 52.604 -1.123 -1.123
106 2HB SER 15 HB1 SER 15 51.212 -0.295 -0.295
107 HG SER 15 HG SER 15 51.697 -3.075 -3.075
108 H GLU 16 HN GLU 16 50.982 0.741 0.741
109 HA GLU 16 HA GLU 16 52.844 2.472 2.472
110 1HB GLU 16 HB2 GLU 16 50.411 2.486 2.486
111 2HB GLU 16 HB1 GLU 16 50.168 2.982 2.982
112 1HG GLU 16 HG2 GLU 16 50.196 5.095 5.095
113 2HG GLU 16 HG1 GLU 16 51.945 4.878 4.878
114 H GLU 17 HN GLU 17 52.174 1.933 1.933
115 HA GLU 17 HA GLU 17 52.883 4.501 4.501
116 1HB GLU 17 HB2 GLU 17 51.711 2.860 2.860
117 2HB GLU 17 HB1 GLU 17 52.976 1.660 1.660
118 1HG GLU 17 HG2 GLU 17 54.572 3.018 3.018
119 2HG GLU 17 HG1 GLU 17 53.350 4.270 4.270
120 H MET 18 HN MET 18 54.813 1.619 1.619
121 HA MET 18 HA MET 18 57.297 2.644 2.644
122 1HB MET 18 HB2 MET 18 56.318 0.245 0.245
123 2HB MET 18 HB1 MET 18 57.343 0.696 0.696
124 1HG MET 18 HG2 MET 18 58.685 -0.560 -0.560
125 2HG MET 18 HG1 MET 18 59.210 1.123 1.123
126 1HE MET 18 HE1 MET 18 60.242 -0.372 -0.372
127 2HE MET 18 HE3 MET 18 60.192 0.959 0.959
128 3HE MET 18 HE2 MET 18 59.591 -0.635 -0.635
129 H ILE 19 HN ILE 19 56.077 2.324 2.324
130 HA ILE 19 HA ILE 19 58.146 3.432 3.432
131 HB ILE 19 HB ILE 19 55.143 3.748 3.748
132 1HG1 ILE 19 HG12 ILE 19 56.857 2.311 2.311
133 2HG1 ILE 19 HG11 ILE 19 56.607 1.560 1.560
134 1HG2 ILE 19 HG22 ILE 19 57.204 5.200 5.200
135 2HG2 ILE 19 HG21 ILE 19 56.160 4.262 4.262
136 3HG2 ILE 19 HG23 ILE 19 55.460 5.455 5.455
137 HD1 ILE 19 HD1 ILE 19 54.209 1.602 1.602
138 HD1 ILE 19 HD1 ILE 19 54.903 0.893 0.893
139 HD1 ILE 19 HD1 ILE 19 54.349 2.568 2.568
140 H ALA 20 HN ALA 20 55.676 5.239 5.239
141 HA ALA 20 HA ALA 20 56.679 7.859 7.859
142 1HB ALA 20 HB3 ALA 20 54.376 7.130 7.130
143 2HB ALA 20 HB2 ALA 20 55.114 7.058 7.058
144 3HB ALA 20 HB1 ALA 20 55.047 8.590 8.590
145 H GLU 21 HN GLU 21 57.511 5.494 5.494
146 HA GLU 21 HA GLU 21 58.931 7.320 7.320
147 1HB GLU 21 HB2 GLU 21 58.033 5.228 5.228
148 2HB GLU 21 HB1 GLU 21 58.910 4.317 4.317
149 1HG GLU 21 HG2 GLU 21 60.583 4.083 4.083
150 2HG GLU 21 HG1 GLU 21 60.879 5.815 5.815
151 H PHE 22 HN PHE 22 60.088 4.783 4.783
152 HA PHE 22 HA PHE 22 62.848 5.389 5.389
153 1HB PHE 22 HB2 PHE 22 61.102 4.352 4.352
154 2HB PHE 22 HB1 PHE 22 62.862 4.268 4.268
155 HD1 PHE 22 HD2 PHE 22 61.909 4.006 4.006
156 HD2 PHE 22 HD1 PHE 22 61.919 1.729 1.729
157 HE1 PHE 22 HE2 PHE 22 61.811 1.905 1.905
158 HE2 PHE 22 HE1 PHE 22 61.821 -0.371 -0.371
159 HZ PHE 22 HZ PHE 22 61.767 -0.284 -0.284
160 H LYS 23 HN LYS 23 60.255 6.934 6.934
161 HA LYS 23 HA LYS 23 61.619 8.391 8.391
162 1HB LYS 23 HB2 LYS 23 59.137 8.302 8.302
163 2HB LYS 23 HB1 LYS 23 59.490 9.528 9.528
164 1HG LYS 23 HG2 LYS 23 58.818 10.786 10.786
165 2HG LYS 23 HG1 LYS 23 60.580 10.855 10.855
166 1HD LYS 23 HD2 LYS 23 60.700 9.597 9.597
167 2HD LYS 23 HD1 LYS 23 59.388 8.533 8.533
168 1HE LYS 23 HE2 LYS 23 57.792 10.474 10.474
169 2HE LYS 23 HE1 LYS 23 59.162 11.263 11.263
170 1HZ LYS 23 HZ3 LYS 23 59.390 8.833 8.833
171 2HZ LYS 23 HZ2 LYS 23 57.710 8.842 8.842
172 3HZ LYS 23 HZ1 LYS 23 58.429 10.023 10.023
173 H ALA 24 HN ALA 24 60.776 9.873 9.873
174 HA ALA 24 HA ALA 24 62.533 12.060 12.060
175 1HB ALA 24 HB3 ALA 24 61.580 10.382 10.382
176 2HB ALA 24 HB2 ALA 24 62.319 11.975 11.975
177 3HB ALA 24 HB1 ALA 24 60.778 11.801 11.801
178 H ALA 25 HN ALA 25 63.239 8.696 8.696
179 HA ALA 25 HA ALA 25 65.900 9.238 9.238
180 1HB ALA 25 HB1 ALA 25 64.241 7.297 7.297
181 2HB ALA 25 HB3 ALA 25 64.832 6.613 6.613
182 3HB ALA 25 HB2 ALA 25 65.946 6.885 6.885
183 H PHE 26 HN PHE 26 64.558 8.009 8.009
184 HA PHE 26 HA PHE 26 67.057 7.470 7.470
185 1HB PHE 26 HB2 PHE 26 64.809 6.667 6.667
186 2HB PHE 26 HB1 PHE 26 64.370 8.319 8.319
187 HD1 PHE 26 HD2 PHE 26 66.011 9.537 9.537
188 HD2 PHE 26 HD1 PHE 26 65.765 5.275 5.275
189 HE1 PHE 26 HE2 PHE 26 67.053 9.225 9.225
190 HE2 PHE 26 HE1 PHE 26 66.807 4.963 4.963
191 HZ PHE 26 HZ PHE 26 67.451 6.939 6.939
192 H ASP 27 HN ASP 27 65.066 10.404 10.404
193 HA ASP 27 HA ASP 27 66.604 11.968 11.968
194 1HB ASP 27 HB2 ASP 27 64.215 12.281 12.281
195 2HB ASP 27 HB1 ASP 27 64.954 12.956 12.956
196 H MET 28 HN MET 28 67.438 10.765 10.765
197 HA MET 28 HA MET 28 68.801 13.006 13.006
198 1HB MET 28 HB2 MET 28 69.061 9.993 9.993
199 2HB MET 28 HB1 MET 28 69.954 11.101 11.101
200 1HG MET 28 HG2 MET 28 66.934 11.063 11.063
201 2HG MET 28 HG1 MET 28 67.830 10.304 10.304
202 1HE MET 28 HE1 MET 28 65.925 11.772 11.772
203 2HE MET 28 HE3 MET 28 67.333 11.576 11.576
204 3HE MET 28 HE2 MET 28 66.533 13.141 13.141
205 H PHE 29 HN PHE 29 69.565 10.978 10.978
206 HA PHE 29 HA PHE 29 72.401 11.969 11.969
207 1HB PHE 29 HB2 PHE 29 71.498 9.527 9.527
208 2HB PHE 29 HB1 PHE 29 73.075 9.872 9.872
209 HD1 PHE 29 HD1 PHE 29 73.400 9.719 9.719
210 HD2 PHE 29 HD2 PHE 29 69.734 8.533 8.533
211 HE1 PHE 29 HE1 PHE 29 72.731 8.503 8.503
212 HE2 PHE 29 HE2 PHE 29 69.065 7.317 7.317
213 HZ PHE 29 HZ PHE 29 70.564 7.300 7.300
214 H ASP 30 HN ASP 30 69.448 12.298 12.298
215 HA ASP 30 HA ASP 30 70.206 12.367 12.367
216 1HB ASP 30 HB2 ASP 30 67.907 12.476 12.476
217 2HB ASP 30 HB1 ASP 30 68.098 14.188 14.188
218 H ALA 31 HN ALA 31 72.323 13.550 13.550
219 HA ALA 31 HA ALA 31 72.548 16.232 16.232
220 1HB ALA 31 HB3 ALA 31 74.210 14.306 14.306
221 2HB ALA 31 HB2 ALA 31 74.144 15.332 15.332
222 3HB ALA 31 HB1 ALA 31 74.691 15.999 15.999
223 H ASP 32 HN ASP 32 71.566 14.919 14.919
224 HA ASP 32 HA ASP 32 71.304 17.655 17.655
225 1HB ASP 32 HB2 ASP 32 72.312 15.571 15.571
226 2HB ASP 32 HB1 ASP 32 70.648 15.007 15.007
227 H GLY 33 HN GLY 33 69.324 14.917 14.917
228 1HA GLY 33 HA2 GLY 33 67.056 15.062 15.062
229 2HA GLY 33 HA1 GLY 33 66.961 16.683 16.683
230 H GLY 34 HN GLY 34 68.244 14.012 14.012
231 1HA GLY 34 HA2 GLY 34 66.044 14.373 14.373
232 2HA GLY 34 HA1 GLY 34 67.529 13.464 13.464
233 H GLY 35 HN GLY 35 66.196 12.701 12.701
234 1HA GLY 35 HA2 GLY 35 64.847 10.910 10.910
235 2HA GLY 35 HA1 GLY 35 64.296 10.686 10.686
236 H ASP 36 HN ASP 36 67.709 10.792 10.792
237 HA ASP 36 HA ASP 36 67.981 7.863 7.863
238 1HB ASP 36 HB2 ASP 36 69.370 7.926 7.926
239 2HB ASP 36 HB1 ASP 36 67.630 8.123 8.123
240 H ILE 37 HN ILE 37 69.807 7.441 7.441
241 HA ILE 37 HA ILE 37 71.699 9.679 9.679
242 HB ILE 37 HB ILE 37 71.485 6.940 6.940
243 1HG1 ILE 37 HG12 ILE 37 70.369 9.237 9.237
244 2HG1 ILE 37 HG11 ILE 37 69.487 8.860 8.860
245 1HG2 ILE 37 HG23 ILE 37 73.567 8.323 8.323
246 2HG2 ILE 37 HG22 ILE 37 72.543 9.560 9.560
247 3HG2 ILE 37 HG21 ILE 37 72.667 7.966 7.966
248 HD1 ILE 37 HD1 ILE 37 69.874 7.195 7.195
249 HD1 ILE 37 HD1 ILE 37 69.732 6.370 6.370
250 HD1 ILE 37 HD1 ILE 37 68.429 7.416 7.416
251 H SER 38 HN SER 38 74.056 9.132 9.132
252 HA SER 38 HA SER 38 74.987 8.007 8.007
253 1HB SER 38 HB2 SER 38 76.079 9.565 9.565
254 2HB SER 38 HB1 SER 38 76.562 8.074 8.074
255 HG SER 38 HG SER 38 77.827 9.239 9.239
256 H THR 39 HN THR 39 75.263 5.894 5.894
257 HA THR 39 HA THR 39 74.344 3.641 3.641
258 HB THR 39 HB THR 39 76.222 2.505 2.505
259 HG1 THR 39 HG1 THR 39 77.453 3.811 3.811
260 1HG2 THR 39 HG21 THR 39 73.941 4.209 4.209
261 2HG2 THR 39 HG23 THR 39 74.994 3.465 3.465
262 3HG2 THR 39 HG22 THR 39 74.119 2.455 2.455
263 H LYS 40 HN LYS 40 77.361 5.362 5.362
264 HA LYS 40 HA LYS 40 78.639 3.260 3.260
265 1HB LYS 40 HB2 LYS 40 79.275 5.734 5.734
266 2HB LYS 40 HB1 LYS 40 79.506 5.979 5.979
267 1HG LYS 40 HG2 LYS 40 81.450 4.859 4.859
268 2HG LYS 40 HG1 LYS 40 80.568 3.418 3.418
269 1HD LYS 40 HD2 LYS 40 81.868 3.659 3.659
270 2HD LYS 40 HD1 LYS 40 80.575 4.768 4.768
271 1HE LYS 40 HE2 LYS 40 82.883 5.760 5.760
272 2HE LYS 40 HE1 LYS 40 81.857 6.675 6.675
273 1HZ LYS 40 HZ1 LYS 40 83.358 4.426 4.426
274 2HZ LYS 40 HZ3 LYS 40 84.255 5.805 5.805
275 3HZ LYS 40 HZ2 LYS 40 82.980 5.925 5.925
276 H GLU 41 HN GLU 41 76.116 5.478 5.478
277 HA GLU 41 HA GLU 41 76.594 5.317 5.317
278 1HB GLU 41 HB2 GLU 41 76.484 7.567 7.567
279 2HB GLU 41 HB1 GLU 41 74.930 7.186 7.186
280 1HG GLU 41 HG2 GLU 41 74.399 8.387 8.387
281 2HG GLU 41 HG1 GLU 41 74.087 6.692 6.692
282 H LEU 42 HN LEU 42 74.657 4.114 4.114
283 HA LEU 42 HA LEU 42 72.076 3.848 3.848
284 1HB LEU 42 HB2 LEU 42 72.694 3.117 3.117
285 2HB LEU 42 HB1 LEU 42 73.831 1.936 1.936
286 HG LEU 42 HG LEU 42 71.053 1.690 1.690
287 HD1 LEU 42 HD1 LEU 42 71.028 2.281 2.281
288 HD1 LEU 42 HD1 LEU 42 70.065 0.927 0.927
289 HD1 LEU 42 HD1 LEU 42 71.618 0.630 0.630
290 HD2 LEU 42 HD2 LEU 42 71.634 -0.546 -0.546
291 HD2 LEU 42 HD2 LEU 42 73.243 0.174 0.174
292 HD2 LEU 42 HD2 LEU 42 72.638 -0.492 -0.492
293 H GLY 43 HN GLY 43 75.022 2.393 2.393
294 1HA GLY 43 HA2 GLY 43 73.812 0.167 0.167
295 2HA GLY 43 HA1 GLY 43 75.428 0.808 0.808
296 H THR 44 HN THR 44 74.471 3.535 3.535
297 HA THR 44 HA THR 44 73.929 3.255 3.255
298 HB THR 44 HB THR 44 74.141 5.519 5.519
299 HG1 THR 44 HG1 THR 44 75.682 4.445 4.445
300 1HG2 THR 44 HG22 THR 44 72.476 6.150 6.150
301 2HG2 THR 44 HG21 THR 44 73.652 5.760 5.760
302 3HG2 THR 44 HG23 THR 44 73.958 7.093 7.093
303 H VAL 45 HN VAL 45 72.049 4.878 4.878
304 HA VAL 45 HA VAL 45 69.698 5.446 5.446
305 HB VAL 45 HB VAL 45 70.323 5.875 5.875
306 1HG1 VAL 45 HG11 VAL 45 70.994 3.523 3.523
307 2HG1 VAL 45 HG13 VAL 45 69.299 3.046 3.046
308 3HG1 VAL 45 HG12 VAL 45 69.825 4.149 4.149
309 1HG2 VAL 45 HG23 VAL 45 67.846 5.695 5.695
310 2HG2 VAL 45 HG22 VAL 45 68.135 6.300 6.300
311 3HG2 VAL 45 HG21 VAL 45 67.659 4.619 4.619
312 H MET 46 HN MET 46 70.595 2.281 2.281
313 HA MET 46 HA MET 46 68.113 1.010 1.010
314 1HB MET 46 HB2 MET 46 69.108 -0.946 -0.946
315 2HB MET 46 HB1 MET 46 69.480 0.440 0.440
316 1HG MET 46 HG2 MET 46 71.685 0.636 0.636
317 2HG MET 46 HG1 MET 46 71.313 -0.906 -0.906
318 1HE MET 46 HE3 MET 46 70.048 -2.537 -2.537
319 2HE MET 46 HE2 MET 46 69.817 -2.364 -2.364
320 3HE MET 46 HE1 MET 46 71.051 -3.462 -3.462
321 H ARG 47 HN ARG 47 71.535 0.972 0.972
322 HA ARG 47 HA ARG 47 71.097 -0.937 -0.937
323 1HB ARG 47 HB2 ARG 47 73.250 -0.332 -0.332
324 2HB ARG 47 HB1 ARG 47 73.280 1.148 1.148
325 1HG ARG 47 HG2 ARG 47 72.887 -0.631 -0.631
326 2HG ARG 47 HG1 ARG 47 73.748 -1.669 -1.669
327 1HD ARG 47 HD2 ARG 47 75.493 0.200 0.200
328 2HD ARG 47 HD1 ARG 47 74.709 0.926 0.926
329 HE ARG 47 HE ARG 47 75.103 -1.821 -1.821
330 1HH1 ARG 47 HH1 ARG 47 76.099 0.527 0.527
331 2HH1 ARG 47 HH1 ARG 47 77.811 0.271 0.271
332 1HH2 ARG 47 HH2 ARG 47 77.682 -1.942 -1.942
333 2HH2 ARG 47 HH2 ARG 47 78.707 -1.124 -1.124
334 H MET 48 HN MET 48 71.628 2.617 2.617
335 HA MET 48 HA MET 48 71.284 3.036 3.036
336 1HB MET 48 HB2 MET 48 71.458 4.523 4.523
337 2HB MET 48 HB1 MET 48 70.116 5.181 5.181
338 1HG MET 48 HG2 MET 48 71.986 4.849 4.849
339 2HG MET 48 HG1 MET 48 73.017 5.225 5.225
340 1HE MET 48 HE1 MET 48 72.921 6.779 6.779
341 2HE MET 48 HE3 MET 48 72.027 8.305 8.305
342 3HE MET 48 HE2 MET 48 71.204 6.789 6.789
343 H LEU 49 HN LEU 49 68.936 2.080 2.080
344 HA LEU 49 HA LEU 49 66.605 3.151 3.151
345 1HB LEU 49 HB2 LEU 49 67.229 1.469 1.469
346 2HB LEU 49 HB1 LEU 49 65.607 1.337 1.337
347 HG LEU 49 HG LEU 49 66.925 3.970 3.970
348 HD1 LEU 49 HD1 LEU 49 64.632 3.082 3.082
349 HD1 LEU 49 HD1 LEU 49 66.048 2.047 2.047
350 HD1 LEU 49 HD1 LEU 49 66.166 3.775 3.775
351 HD2 LEU 49 HD2 LEU 49 64.048 3.952 3.952
352 HD2 LEU 49 HD2 LEU 49 65.151 4.891 4.891
353 HD2 LEU 49 HD2 LEU 49 64.646 3.282 3.282
354 H GLY 50 HN GLY 50 68.698 0.586 0.586
355 1HA GLY 50 HA2 GLY 50 68.216 -0.684 -0.684
356 2HA GLY 50 HA1 GLY 50 66.557 -0.846 -0.846
357 H GLN 51 HN GLN 51 69.178 -1.154 -1.154
358 HA GLN 51 HA GLN 51 68.722 -4.122 -4.122
359 1HB GLN 51 HB2 GLN 51 69.160 -2.130 -2.130
360 2HB GLN 51 HB1 GLN 51 69.031 -3.876 -3.876
361 1HG GLN 51 HG2 GLN 51 66.793 -3.697 -3.697
362 2HG GLN 51 HG1 GLN 51 66.821 -3.055 -3.055
363 1HE2 GLN 51 HE22 GLN 51 66.475 -0.474 -0.474
364 2HE2 GLN 51 HE21 GLN 51 66.956 -2.079 -2.079
365 H ASN 52 HN ASN 52 70.655 -5.043 -5.043
366 HA ASN 52 HA ASN 52 73.234 -3.700 -3.700
367 1HB ASN 52 HB2 ASN 52 72.074 -5.617 -5.617
368 2HB ASN 52 HB1 ASN 52 73.439 -6.398 -6.398
369 HD2 ASN 52 HD2 ASN 52 72.875 -4.912 -4.912
370 HD2 ASN 52 HD2 ASN 52 74.311 -4.031 -4.031
371 HA PRO 53 HA PRO 53 73.070 -6.201 -6.201
372 1HB PRO 53 HB2 PRO 53 74.285 -4.304 -4.304
373 2HB PRO 53 HB1 PRO 53 72.537 -4.330 -4.330
374 1HG PRO 53 HG2 PRO 53 74.647 -2.652 -2.652
375 2HG PRO 53 HG1 PRO 53 72.998 -2.221 -2.221
376 1HD PRO 53 HD2 PRO 53 73.728 -2.748 -2.748
377 2HD PRO 53 HD1 PRO 53 72.087 -3.013 -3.013
378 H THR 54 HN THR 54 74.711 -7.701 -7.701
379 HA THR 54 HA THR 54 77.273 -7.363 -7.363
380 HB THR 54 HB THR 54 77.724 -9.502 -9.502
381 HG1 THR 54 HG1 THR 54 77.021 -9.979 -9.979
382 1HG2 THR 54 HG22 THR 54 75.345 -8.941 -8.941
383 2HG2 THR 54 HG21 THR 54 74.859 -9.978 -9.978
384 3HG2 THR 54 HG23 THR 54 76.090 -10.527 -10.527
385 H LYS 55 HN LYS 55 79.299 -6.814 -6.814
386 HA LYS 55 HA LYS 55 79.589 -4.841 -4.841
387 1HB LYS 55 HB2 LYS 55 81.275 -6.031 -6.031
388 2HB LYS 55 HB1 LYS 55 81.523 -7.151 -7.151
389 1HG LYS 55 HG2 LYS 55 82.641 -5.610 -5.610
390 2HG LYS 55 HG1 LYS 55 81.604 -4.284 -4.284
391 1HD LYS 55 HD2 LYS 55 83.598 -3.722 -3.722
392 2HD LYS 55 HD1 LYS 55 82.807 -4.670 -4.670
393 1HE LYS 55 HE2 LYS 55 84.085 -6.644 -6.644
394 2HE LYS 55 HE1 LYS 55 84.757 -5.841 -5.841
395 1HZ LYS 55 HZ2 LYS 55 85.648 -4.111 -4.111
396 2HZ LYS 55 HZ1 LYS 55 85.134 -5.025 -5.025
397 3HZ LYS 55 HZ3 LYS 55 86.323 -5.642 -5.642
398 H GLU 56 HN GLU 56 79.474 -8.355 -8.355
399 HA GLU 56 HA GLU 56 80.039 -8.315 -8.315
400 1HB GLU 56 HB2 GLU 56 78.650 -10.093 -10.093
401 2HB GLU 56 HB1 GLU 56 78.438 -10.447 -10.447
402 1HG GLU 56 HG2 GLU 56 80.363 -11.688 -11.688
403 2HG GLU 56 HG1 GLU 56 80.926 -10.417 -10.417
404 H GLU 57 HN GLU 57 76.849 -8.392 -8.392
405 HA GLU 57 HA GLU 57 75.170 -8.187 -8.187
406 1HB GLU 57 HB2 GLU 57 75.053 -7.074 -7.074
407 2HB GLU 57 HB1 GLU 57 73.695 -6.916 -6.916
408 1HG GLU 57 HG2 GLU 57 74.998 -9.574 -9.574
409 2HG GLU 57 HG1 GLU 57 73.615 -8.950 -8.950
410 H LEU 58 HN LEU 58 76.856 -5.577 -5.577
411 HA LEU 58 HA LEU 58 75.768 -3.332 -3.332
412 1HB LEU 58 HB2 LEU 58 77.916 -4.013 -4.013
413 2HB LEU 58 HB1 LEU 58 78.594 -3.027 -3.027
414 HG LEU 58 HG LEU 58 77.809 -1.596 -1.596
415 HD1 LEU 58 HD1 LEU 58 75.655 -1.017 -1.017
416 HD1 LEU 58 HD1 LEU 58 77.201 -1.323 -1.323
417 HD1 LEU 58 HD1 LEU 58 77.067 -0.050 -0.050
418 HD2 LEU 58 HD2 LEU 58 75.834 -1.923 -1.923
419 HD2 LEU 58 HD2 LEU 58 75.809 -3.490 -3.490
420 HD2 LEU 58 HD2 LEU 58 74.954 -2.117 -2.117
421 H ASP 59 HN ASP 59 79.007 -4.648 -4.648
422 HA ASP 59 HA ASP 59 79.381 -3.442 -3.442
423 1HB ASP 59 HB2 ASP 59 80.604 -5.360 -5.360
424 2HB ASP 59 HB1 ASP 59 80.269 -6.232 -6.232
425 H ALA 60 HN ALA 60 77.823 -6.603 -6.603
426 HA ALA 60 HA ALA 60 77.203 -7.260 -7.260
427 1HB ALA 60 HB2 ALA 60 77.064 -8.555 -8.555
428 2HB ALA 60 HB1 ALA 60 75.416 -7.929 -7.929
429 3HB ALA 60 HB3 ALA 60 75.935 -8.964 -8.964
430 H ILE 61 HN ILE 61 75.372 -5.416 -5.416
431 HA ILE 61 HA ILE 61 73.018 -5.019 -5.019
432 HB ILE 61 HB ILE 61 74.268 -3.627 -3.627
433 1HG1 ILE 61 HG12 ILE 61 71.692 -5.196 -5.196
434 2HG1 ILE 61 HG11 ILE 61 73.243 -6.015 -6.015
435 1HG2 ILE 61 HG23 ILE 61 72.022 -2.798 -2.798
436 2HG2 ILE 61 HG22 ILE 61 71.617 -2.891 -2.891
437 3HG2 ILE 61 HG21 ILE 61 72.943 -1.861 -1.861
438 HD1 ILE 61 HD1 ILE 61 73.653 -4.324 -4.324
439 HD1 ILE 61 HD1 ILE 61 72.563 -5.681 -5.681
440 HD1 ILE 61 HD1 ILE 61 71.908 -4.080 -4.080
441 H ILE 62 HN ILE 62 75.702 -2.764 -2.764
442 HA ILE 62 HA ILE 62 75.044 -0.578 -0.578
443 HB ILE 62 HB ILE 62 77.712 -1.958 -1.958
444 1HG1 ILE 62 HG12 ILE 62 76.448 0.434 0.434
445 2HG1 ILE 62 HG11 ILE 62 76.452 -1.205 -1.205
446 1HG2 ILE 62 HG22 ILE 62 77.034 0.780 0.780
447 2HG2 ILE 62 HG21 ILE 62 78.625 0.373 0.373
448 3HG2 ILE 62 HG23 ILE 62 78.002 -0.480 -0.480
449 HD1 ILE 62 HD1 ILE 62 78.872 -1.228 -1.228
450 HD1 ILE 62 HD1 ILE 62 78.308 0.243 0.243
451 HD1 ILE 62 HD1 ILE 62 78.964 0.318 0.318
452 H GLU 63 HN GLU 63 77.300 -3.080 -3.080
453 HA GLU 63 HA GLU 63 77.296 -2.440 -2.440
454 1HB GLU 63 HB2 GLU 63 78.367 -4.368 -4.368
455 2HB GLU 63 HB1 GLU 63 77.049 -5.313 -5.313
456 1HG GLU 63 HG2 GLU 63 77.784 -4.588 -4.588
457 2HG GLU 63 HG1 GLU 63 79.163 -3.775 -3.775
458 H GLU 64 HN GLU 64 74.929 -4.515 -4.515
459 HA GLU 64 HA GLU 64 73.312 -5.196 -5.196
460 1HB GLU 64 HB2 GLU 64 72.939 -6.371 -6.371
461 2HB GLU 64 HB1 GLU 64 72.943 -4.903 -4.903
462 1HG GLU 64 HG2 GLU 64 70.739 -4.434 -4.434
463 2HG GLU 64 HG1 GLU 64 70.807 -5.134 -5.134
464 H VAL 65 HN VAL 65 72.977 -2.486 -2.486
465 HA VAL 65 HA VAL 65 70.842 -1.263 -1.263
466 HB VAL 65 HB VAL 65 70.694 0.250 0.250
467 1HG1 VAL 65 HG13 VAL 65 71.450 -2.533 -2.533
468 2HG1 VAL 65 HG12 VAL 65 70.554 -1.349 -1.349
469 3HG1 VAL 65 HG11 VAL 65 69.847 -2.015 -2.015
470 1HG2 VAL 65 HG22 VAL 65 73.381 -0.898 -0.898
471 2HG2 VAL 65 HG21 VAL 65 73.097 0.734 0.734
472 3HG2 VAL 65 HG23 VAL 65 72.428 0.242 0.242
473 H ASP 66 HN ASP 66 74.115 -1.391 -1.391
474 HA ASP 66 HA ASP 66 74.549 1.474 1.474
475 1HB ASP 66 HB2 ASP 66 76.240 0.184 0.184
476 2HB ASP 66 HB1 ASP 66 76.314 -0.996 -0.996
477 H GLU 67 HN GLU 67 73.690 -1.479 -1.479
478 HA GLU 67 HA GLU 67 74.786 -1.096 -1.096
479 1HB GLU 67 HB2 GLU 67 72.566 -2.575 -2.575
480 2HB GLU 67 HB1 GLU 67 72.426 -2.369 -2.369
481 1HG GLU 67 HG2 GLU 67 74.546 -3.426 -3.426
482 2HG GLU 67 HG1 GLU 67 74.937 -3.401 -3.401
483 H ASP 68 HN ASP 68 72.410 0.729 0.729
484 HA ASP 68 HA ASP 68 70.725 1.560 1.560
485 1HB ASP 68 HB2 ASP 68 70.598 1.820 1.820
486 2HB ASP 68 HB1 ASP 68 71.503 3.307 3.307
487 H GLY 69 HN GLY 69 73.986 2.399 2.399
488 1HA GLY 69 HA2 GLY 69 75.533 3.625 3.625
489 2HA GLY 69 HA1 GLY 69 74.203 4.110 4.110
490 H SER 70 HN SER 70 73.533 4.546 4.546
491 HA SER 70 HA SER 70 73.946 7.493 7.493
492 1HB SER 70 HB2 SER 70 72.170 5.830 5.830
493 2HB SER 70 HB1 SER 70 72.204 7.590 7.590
494 HG SER 70 HG SER 70 71.518 7.520 7.520
495 H GLY 71 HN GLY 71 74.000 5.054 5.054
496 1HA GLY 71 HA2 GLY 71 76.138 4.759 4.759
497 2HA GLY 71 HA1 GLY 71 76.370 6.502 6.502
498 H THR 72 HN THR 72 73.151 6.193 6.193
499 HA THR 72 HA THR 72 73.408 6.298 6.298
500 HB THR 72 HB THR 72 71.317 7.902 7.902
501 HG1 THR 72 HG1 THR 72 71.328 7.615 7.615
502 1HG2 THR 72 HG21 THR 72 74.222 8.671 8.671
503 2HG2 THR 72 HG23 THR 72 72.916 9.804 9.804
504 3HG2 THR 72 HG22 THR 72 73.366 8.586 8.586
505 H ILE 73 HN ILE 73 71.152 5.943 5.943
506 HA ILE 73 HA ILE 73 69.749 3.735 3.735
507 HB ILE 73 HB ILE 73 71.028 3.126 3.126
508 1HG1 ILE 73 HG12 ILE 73 68.864 2.326 2.326
509 2HG1 ILE 73 HG11 ILE 73 68.040 2.916 2.916
510 1HG2 ILE 73 HG23 ILE 73 69.105 5.046 5.046
511 2HG2 ILE 73 HG22 ILE 73 70.244 3.989 3.989
512 3HG2 ILE 73 HG21 ILE 73 70.841 5.292 5.292
513 HD1 ILE 73 HD1 ILE 73 70.045 0.689 0.689
514 HD1 ILE 73 HD1 ILE 73 69.858 1.535 1.535
515 HD1 ILE 73 HD1 ILE 73 68.484 0.690 0.690
516 H ASP 74 HN ASP 74 67.561 3.998 3.998
517 HA ASP 74 HA ASP 74 66.303 6.543 6.543
518 1HB ASP 74 HB2 ASP 74 65.746 4.186 4.186
519 2HB ASP 74 HB1 ASP 74 64.378 5.185 5.185
520 H PHE 75 HN PHE 75 64.929 6.785 6.785
521 HA PHE 75 HA PHE 75 64.645 5.065 5.065
522 1HB PHE 75 HB2 PHE 75 63.830 7.453 7.453
523 2HB PHE 75 HB1 PHE 75 62.410 6.784 6.784
524 HD1 PHE 75 HD2 PHE 75 60.908 5.189 5.189
525 HD2 PHE 75 HD1 PHE 75 64.037 7.413 7.413
526 HE1 PHE 75 HE2 PHE 75 59.859 4.753 4.753
527 HE2 PHE 75 HE1 PHE 75 62.988 6.976 6.976
528 HZ PHE 75 HZ PHE 75 60.899 5.645 5.645
529 H GLU 76 HN GLU 76 62.363 5.242 5.242
530 HA GLU 76 HA GLU 76 60.606 3.177 3.177
531 1HB GLU 76 HB2 GLU 76 61.525 4.492 4.492
532 2HB GLU 76 HB1 GLU 76 60.682 2.955 2.955
533 1HG GLU 76 HG2 GLU 76 58.744 3.763 3.763
534 2HG GLU 76 HG1 GLU 76 59.597 5.203 5.203
535 H GLU 77 HN GLU 77 63.490 2.877 2.877
536 HA GLU 77 HA GLU 77 63.394 -0.020 -0.020
537 1HB GLU 77 HB2 GLU 77 64.484 1.806 1.806
538 2HB GLU 77 HB1 GLU 77 65.865 1.623 1.623
539 1HG GLU 77 HG2 GLU 77 66.455 -0.165 -0.165
540 2HG GLU 77 HG1 GLU 77 65.073 -0.999 -0.999
541 H PHE 78 HN PHE 78 64.831 2.364 2.364
542 HA PHE 78 HA PHE 78 66.793 0.660 0.660
543 1HB PHE 78 HB2 PHE 78 67.026 3.007 3.007
544 2HB PHE 78 HB1 PHE 78 65.335 3.216 3.216
545 HD1 PHE 78 HD1 PHE 78 68.497 1.582 1.582
546 HD2 PHE 78 HD2 PHE 78 64.728 3.329 3.329
547 HE1 PHE 78 HE1 PHE 78 69.107 1.400 1.400
548 HE2 PHE 78 HE2 PHE 78 65.336 3.145 3.145
549 HZ PHE 78 HZ PHE 78 67.526 2.180 2.180
550 H LEU 79 HN LEU 79 63.363 1.330 1.330
551 HA LEU 79 HA LEU 79 62.921 0.312 0.312
552 1HB LEU 79 HB2 LEU 79 61.459 0.192 0.192
553 2HB LEU 79 HB1 LEU 79 60.791 -0.681 -0.681
554 HG LEU 79 HG LEU 79 61.680 2.039 2.039
555 HD1 LEU 79 HD1 LEU 79 59.206 2.560 2.560
556 HD1 LEU 79 HD1 LEU 79 60.047 1.588 1.588
557 HD1 LEU 79 HD1 LEU 79 60.773 3.082 3.082
558 HD2 LEU 79 HD2 LEU 79 59.338 2.038 2.038
559 HD2 LEU 79 HD2 LEU 79 60.387 0.748 0.748
560 HD2 LEU 79 HD2 LEU 79 59.156 0.399 0.399
561 H VAL 80 HN VAL 80 63.877 -1.491 -1.491
562 HA VAL 80 HA VAL 80 63.251 -4.126 -4.126
563 HB VAL 80 HB VAL 80 64.421 -4.857 -4.857
564 1HG1 VAL 80 HG13 VAL 80 62.584 -2.649 -2.649
565 2HG1 VAL 80 HG12 VAL 80 63.737 -2.488 -2.488
566 3HG1 VAL 80 HG11 VAL 80 62.781 -3.959 -3.959
567 1HG2 VAL 80 HG22 VAL 80 65.854 -2.231 -2.231
568 2HG2 VAL 80 HG21 VAL 80 66.530 -3.844 -3.844
569 3HG2 VAL 80 HG23 VAL 80 65.778 -2.999 -2.999
570 H MET 81 HN MET 81 66.043 -1.972 -1.972
571 HA MET 81 HA MET 81 67.859 -3.977 -3.977
572 1HB MET 81 HB2 MET 81 67.782 -1.099 -1.099
573 2HB MET 81 HB1 MET 81 68.827 -1.499 -1.499
574 1HG MET 81 HG2 MET 81 70.225 -1.702 -1.702
575 2HG MET 81 HG1 MET 81 69.785 -3.359 -3.359
576 1HE MET 81 HE3 MET 81 69.637 -4.777 -4.777
577 2HE MET 81 HE2 MET 81 68.980 -4.688 -4.688
578 3HE MET 81 HE1 MET 81 70.525 -3.922 -3.922
579 H MET 82 HN MET 82 66.228 -1.132 -1.132
580 HA MET 82 HA MET 82 66.905 -1.666 -1.666
581 1HB MET 82 HB2 MET 82 64.722 -0.320 -0.320
582 2HB MET 82 HB1 MET 82 65.995 0.451 0.451
583 1HG MET 82 HG2 MET 82 64.648 0.578 0.578
584 2HG MET 82 HG1 MET 82 64.318 -1.152 -1.152
585 1HE MET 82 HE1 MET 82 63.395 2.087 2.087
586 2HE MET 82 HE3 MET 82 61.653 2.125 2.125
587 3HE MET 82 HE2 MET 82 62.788 2.462 2.462
588 H VAL 83 HN VAL 83 64.335 -2.995 -2.995
589 HA VAL 83 HA VAL 83 62.980 -4.312 -4.312
590 HB VAL 83 HB VAL 83 62.729 -4.396 -4.396
591 1HG1 VAL 83 HG11 VAL 83 61.775 -6.278 -6.278
592 2HG1 VAL 83 HG13 VAL 83 60.387 -5.297 -5.297
593 3HG1 VAL 83 HG12 VAL 83 61.327 -6.147 -6.147
594 1HG2 VAL 83 HG23 VAL 83 62.086 -2.383 -2.383
595 2HG2 VAL 83 HG22 VAL 83 61.162 -2.736 -2.736
596 3HG2 VAL 83 HG21 VAL 83 60.606 -3.340 -3.340
597 H ARG 84 HN ARG 84 64.367 -5.661 -5.661
598 HA ARG 84 HA ARG 84 64.560 -8.329 -8.329
599 1HB ARG 84 HB2 ARG 84 66.594 -6.563 -6.563
600 2HB ARG 84 HB1 ARG 84 66.552 -8.324 -8.324
601 1HG ARG 84 HG2 ARG 84 64.026 -6.837 -6.837
602 2HG ARG 84 HG1 ARG 84 65.303 -6.789 -6.789
603 1HD ARG 84 HD2 ARG 84 64.538 -8.809 -8.809
604 2HD ARG 84 HD1 ARG 84 65.184 -9.482 -9.482
605 HE ARG 84 HE ARG 84 62.626 -8.198 -8.198
606 1HH1 ARG 84 HH2 ARG 84 63.542 -10.774 -10.774
607 2HH1 ARG 84 HH2 ARG 84 62.491 -11.930 -11.930
608 1HH2 ARG 84 HH1 ARG 84 61.531 -9.796 -9.796
609 2HH2 ARG 84 HH1 ARG 84 61.352 -11.376 -11.376
610 H GLN 85 HN GLN 85 66.524 -5.681 -5.681
611 HA GLN 85 HA GLN 85 68.494 -7.409 -7.409
612 1HB GLN 85 HB2 GLN 85 68.847 -5.043 -5.043
613 2HB GLN 85 HB1 GLN 85 67.775 -4.499 -4.499
614 1HG GLN 85 HG2 GLN 85 70.228 -4.394 -4.394
615 2HG GLN 85 HG1 GLN 85 69.262 -5.368 -5.368
616 1HE2 GLN 85 HE22 GLN 85 71.279 -7.659 -7.659
617 2HE2 GLN 85 HE21 GLN 85 70.298 -6.380 -6.380
618 H MET 86 HN MET 86 65.773 -5.366 -5.366
619 HA MET 86 HA MET 86 65.907 -6.140 -6.140
620 1HB MET 86 HB2 MET 86 64.239 -4.625 -4.625
621 2HB MET 86 HB1 MET 86 63.228 -5.591 -5.591
622 1HG MET 86 HG2 MET 86 65.171 -4.616 -4.616
623 2HG MET 86 HG1 MET 86 64.897 -3.261 -3.261
624 1HE MET 86 HE2 MET 86 64.701 -3.574 -3.574
625 2HE MET 86 HE1 MET 86 63.440 -2.374 -2.374
626 3HE MET 86 HE3 MET 86 63.193 -4.050 -4.050
627 H LYS 87 HN LYS 87 64.478 -7.662 -7.662
628 HA LYS 87 HA LYS 87 62.615 -9.433 -9.433
629 1HB LYS 87 HB2 LYS 87 64.579 -9.452 -9.452
630 2HB LYS 87 HB1 LYS 87 63.786 -10.980 -10.980
631 1HG LYS 87 HG2 LYS 87 62.068 -8.547 -8.547
632 2HG LYS 87 HG1 LYS 87 62.682 -9.219 -9.219
633 1HD LYS 87 HD2 LYS 87 61.733 -11.399 -11.399
634 2HD LYS 87 HD1 LYS 87 61.220 -10.825 -10.825
635 1HE LYS 87 HE2 LYS 87 59.601 -9.334 -9.334
636 2HE LYS 87 HE1 LYS 87 60.266 -9.559 -9.559
637 1HZ LYS 87 HZ1 LYS 87 59.852 -12.063 -12.063
638 2HZ LYS 87 HZ3 LYS 87 58.688 -11.417 -11.417
639 3HZ LYS 87 HZ2 LYS 87 58.594 -11.100 -11.100
640 H GLU 88 HN GLU 88 66.108 -9.433 -9.433
641 HA GLU 88 HA GLU 88 66.107 -12.073 -12.073
642 1HB GLU 88 HB2 GLU 88 68.131 -10.220 -10.220
643 2HB GLU 88 HB1 GLU 88 68.661 -11.473 -11.473
644 1HG GLU 88 HG2 GLU 88 68.354 -13.107 -13.107
645 2HG GLU 88 HG1 GLU 88 66.764 -12.489 -12.489
646 H ASP 89 HN ASP 89 66.807 -8.629 -8.629
647 HA ASP 89 HA ASP 89 67.756 -8.990 -8.990
648 1HB ASP 89 HB2 ASP 89 68.248 -7.135 -7.135
649 2HB ASP 89 HB1 ASP 89 66.685 -6.466 -6.466
650 H ALA 90 HN ALA 90 64.659 -8.334 -8.334
651 HA ALA 90 HA ALA 90 63.192 -7.377 -7.377
652 1HB ALA 90 HB3 ALA 90 62.400 -9.050 -9.050
653 2HB ALA 90 HB2 ALA 90 61.252 -8.230 -8.230
654 3HB ALA 90 HB1 ALA 90 62.396 -7.289 -7.289
Start of MODEL 10
1 1H ALA 1 HT1 ALA 1 64.584 -4.571 -4.571
2 2H ALA 1 HT3 ALA 1 65.567 -4.684 -4.684
3 3H ALA 1 HT2 ALA 1 63.977 -5.280 -5.280
4 HA ALA 1 HA ALA 1 65.342 -7.182 -7.182
5 1HB ALA 1 HB1 ALA 1 66.966 -5.190 -5.190
6 2HB ALA 1 HB3 ALA 1 66.769 -6.504 -6.504
7 3HB ALA 1 HB2 ALA 1 67.427 -6.834 -6.834
8 H SER 2 HN SER 2 65.825 -8.249 -8.249
9 HA SER 2 HA SER 2 63.077 -8.703 -8.703
10 1HB SER 2 HB2 SER 2 64.868 -10.434 -10.434
11 2HB SER 2 HB1 SER 2 65.756 -9.578 -9.578
12 HG SER 2 HG SER 2 64.427 -10.347 -10.347
13 H MET 3 HN MET 3 65.701 -6.614 -6.614
14 HA MET 3 HA MET 3 65.103 -6.191 -6.191
15 1HB MET 3 HB2 MET 3 66.544 -4.849 -4.849
16 2HB MET 3 HB1 MET 3 66.096 -3.810 -3.810
17 1HG MET 3 HG2 MET 3 67.089 -6.242 -6.242
18 2HG MET 3 HG1 MET 3 68.231 -5.718 -5.718
19 1HE MET 3 HE2 MET 3 67.866 -2.900 -2.900
20 2HE MET 3 HE1 MET 3 68.727 -1.972 -1.972
21 3HE MET 3 HE3 MET 3 69.547 -3.281 -3.281
22 H THR 4 HN THR 4 64.055 -4.324 -4.324
23 HA THR 4 HA THR 4 62.410 -2.434 -2.434
24 HB THR 4 HB THR 4 63.111 -2.624 -2.624
25 HG1 THR 4 HG1 THR 4 60.863 -1.965 -1.965
26 1HG2 THR 4 HG22 THR 4 62.116 -5.085 -5.085
27 2HG2 THR 4 HG21 THR 4 60.641 -4.249 -4.249
28 3HG2 THR 4 HG23 THR 4 62.093 -4.122 -4.122
29 H ASP 5 HN ASP 5 61.910 -5.849 -5.849
30 HA ASP 5 HA ASP 5 59.002 -5.747 -5.747
31 1HB ASP 5 HB2 ASP 5 60.457 -7.422 -7.422
32 2HB ASP 5 HB1 ASP 5 60.811 -8.156 -8.156
33 H GLN 6 HN GLN 6 61.905 -6.575 -6.575
34 HA GLN 6 HA GLN 6 60.553 -7.529 -7.529
35 1HB GLN 6 HB2 GLN 6 63.161 -7.144 -7.144
36 2HB GLN 6 HB1 GLN 6 63.065 -6.137 -6.137
37 1HG GLN 6 HG2 GLN 6 63.174 -7.954 -7.954
38 2HG GLN 6 HG1 GLN 6 61.768 -8.653 -8.653
39 1HE2 GLN 6 HE21 GLN 6 62.391 -10.763 -10.763
40 2HE2 GLN 6 HE22 GLN 6 63.825 -11.164 -11.164
41 H GLN 7 HN GLN 7 60.980 -4.343 -4.343
42 HA GLN 7 HA GLN 7 60.898 -2.784 -2.784
43 1HB GLN 7 HB2 GLN 7 61.163 -2.350 -2.350
44 2HB GLN 7 HB1 GLN 7 59.506 -1.798 -1.798
45 1HG GLN 7 HG2 GLN 7 61.231 -0.845 -0.845
46 2HG GLN 7 HG1 GLN 7 61.858 -0.359 -0.359
47 1HE2 GLN 7 HE21 GLN 7 59.634 0.154 0.154
48 2HE2 GLN 7 HE22 GLN 7 58.661 1.344 1.344
49 H ALA 8 HN ALA 8 58.241 -3.745 -3.745
50 HA ALA 8 HA ALA 8 56.051 -2.622 -2.622
51 1HB ALA 8 HB3 ALA 8 56.308 -4.123 -4.123
52 2HB ALA 8 HB2 ALA 8 56.037 -5.466 -5.466
53 3HB ALA 8 HB1 ALA 8 54.801 -4.225 -4.225
54 H GLU 9 HN GLU 9 57.198 -5.973 -5.973
55 HA GLU 9 HA GLU 9 55.599 -6.288 -6.288
56 1HB GLU 9 HB2 GLU 9 57.264 -7.808 -7.808
57 2HB GLU 9 HB1 GLU 9 57.912 -8.006 -8.006
58 1HG GLU 9 HG2 GLU 9 54.990 -8.128 -8.128
59 2HG GLU 9 HG1 GLU 9 55.741 -9.382 -9.382
60 H ALA 10 HN ALA 10 58.545 -4.642 -4.642
61 HA ALA 10 HA ALA 10 59.729 -5.020 -5.020
62 1HB ALA 10 HB2 ALA 10 60.216 -3.144 -3.144
63 2HB ALA 10 HB1 ALA 10 61.227 -3.172 -3.172
64 3HB ALA 10 HB3 ALA 10 61.130 -4.596 -4.596
65 H ARG 11 HN ARG 11 57.948 -2.384 -2.384
66 HA ARG 11 HA ARG 11 58.006 -0.594 -0.594
67 1HB ARG 11 HB2 ARG 11 55.965 -0.648 -0.648
68 2HB ARG 11 HB1 ARG 11 56.599 0.755 0.755
69 1HG ARG 11 HG2 ARG 11 58.262 0.965 0.965
70 2HG ARG 11 HG1 ARG 11 58.784 -0.693 -0.693
71 1HD ARG 11 HD2 ARG 11 58.184 -0.872 -0.872
72 2HD ARG 11 HD1 ARG 11 56.608 -1.218 -1.218
73 HE ARG 11 HE ARG 11 57.283 1.198 1.198
74 1HH1 ARG 11 HH1 ARG 11 54.786 -0.468 -0.468
75 2HH1 ARG 11 HH1 ARG 11 53.891 0.917 0.917
76 1HH2 ARG 11 HH2 ARG 11 56.440 3.161 3.161
77 2HH2 ARG 11 HH2 ARG 11 54.827 2.971 2.971
78 H ALA 12 HN ALA 12 55.529 -2.783 -2.783
79 HA ALA 12 HA ALA 12 53.576 -2.240 -2.240
80 1HB ALA 12 HB1 ALA 12 53.700 -3.435 -3.435
81 2HB ALA 12 HB3 ALA 12 53.396 -4.794 -4.794
82 3HB ALA 12 HB2 ALA 12 52.288 -3.423 -3.423
83 H PHE 13 HN PHE 13 56.499 -3.814 -3.814
84 HA PHE 13 HA PHE 13 55.975 -6.252 -6.252
85 1HB PHE 13 HB2 PHE 13 58.183 -5.683 -5.683
86 2HB PHE 13 HB1 PHE 13 58.171 -4.173 -4.173
87 HD1 PHE 13 HD1 PHE 13 57.716 -7.857 -7.857
88 HD2 PHE 13 HD2 PHE 13 59.272 -4.136 -4.136
89 HE1 PHE 13 HE1 PHE 13 58.675 -9.036 -9.036
90 HE2 PHE 13 HE2 PHE 13 60.232 -5.316 -5.316
91 HZ PHE 13 HZ PHE 13 59.933 -7.766 -7.766
92 H LEU 14 HN LEU 14 55.911 -2.914 -2.914
93 HA LEU 14 HA LEU 14 54.917 -3.919 -3.919
94 1HB LEU 14 HB2 LEU 14 56.120 -1.737 -1.737
95 2HB LEU 14 HB1 LEU 14 57.096 -3.163 -3.163
96 HG LEU 14 HG LEU 14 57.482 -2.272 -2.272
97 HD1 LEU 14 HD1 LEU 14 57.011 0.330 0.330
98 HD1 LEU 14 HD1 LEU 14 55.754 -0.089 -0.089
99 HD1 LEU 14 HD1 LEU 14 55.741 -0.810 -0.810
100 HD2 LEU 14 HD2 LEU 14 59.367 -1.429 -1.429
101 HD2 LEU 14 HD2 LEU 14 58.579 -1.385 -1.385
102 HD2 LEU 14 HD2 LEU 14 58.492 0.016 0.016
103 H SER 15 HN SER 15 53.587 -2.220 -2.220
104 HA SER 15 HA SER 15 51.557 -1.134 -1.134
105 1HB SER 15 HB2 SER 15 50.652 -0.307 -0.307
106 2HB SER 15 HB1 SER 15 51.324 -1.912 -1.912
107 HG SER 15 HG SER 15 53.298 -0.733 -0.733
108 H GLU 16 HN GLU 16 50.948 1.298 1.298
109 HA GLU 16 HA GLU 16 53.046 2.912 2.912
110 1HB GLU 16 HB2 GLU 16 50.651 3.242 3.242
111 2HB GLU 16 HB1 GLU 16 50.386 3.613 3.613
112 1HG GLU 16 HG2 GLU 16 51.704 5.618 5.618
113 2HG GLU 16 HG1 GLU 16 52.272 5.195 5.195
114 H GLU 17 HN GLU 17 52.217 2.153 2.153
115 HA GLU 17 HA GLU 17 53.057 4.510 4.510
116 1HB GLU 17 HB2 GLU 17 51.962 2.190 2.190
117 2HB GLU 17 HB1 GLU 17 53.639 1.773 1.773
118 1HG GLU 17 HG2 GLU 17 53.346 2.825 2.825
119 2HG GLU 17 HG1 GLU 17 53.361 4.331 4.331
120 H MET 18 HN MET 18 54.968 1.505 1.505
121 HA MET 18 HA MET 18 57.463 2.521 2.521
122 1HB MET 18 HB2 MET 18 56.794 0.144 0.144
123 2HB MET 18 HB1 MET 18 56.910 0.515 0.515
124 1HG MET 18 HG2 MET 18 59.157 0.338 0.338
125 2HG MET 18 HG1 MET 18 59.284 1.387 1.387
126 1HE MET 18 HE1 MET 18 59.253 1.017 1.017
127 2HE MET 18 HE3 MET 18 58.323 -0.284 -0.284
128 3HE MET 18 HE2 MET 18 60.083 -0.359 -0.359
129 H ILE 19 HN ILE 19 56.054 2.484 2.484
130 HA ILE 19 HA ILE 19 58.143 3.493 3.493
131 HB ILE 19 HB ILE 19 55.190 4.192 4.192
132 1HG1 ILE 19 HG12 ILE 19 56.873 2.103 2.103
133 2HG1 ILE 19 HG11 ILE 19 55.538 1.828 1.828
134 1HG2 ILE 19 HG23 ILE 19 57.115 5.574 5.574
135 2HG2 ILE 19 HG22 ILE 19 56.723 4.301 4.301
136 3HG2 ILE 19 HG21 ILE 19 55.455 5.374 5.374
137 HD1 ILE 19 HD1 ILE 19 54.594 1.494 1.494
138 HD1 ILE 19 HD1 ILE 19 55.417 2.904 2.904
139 HD1 ILE 19 HD1 ILE 19 54.083 3.115 3.115
140 H ALA 20 HN ALA 20 55.946 5.359 5.359
141 HA ALA 20 HA ALA 20 57.080 7.941 7.941
142 1HB ALA 20 HB1 ALA 20 55.070 6.735 6.735
143 2HB ALA 20 HB3 ALA 20 55.900 8.088 8.088
144 3HB ALA 20 HB2 ALA 20 55.070 8.321 8.321
145 H GLU 21 HN GLU 21 58.124 5.339 5.339
146 HA GLU 21 HA GLU 21 59.677 6.976 6.976
147 1HB GLU 21 HB2 GLU 21 58.722 4.825 4.825
148 2HB GLU 21 HB1 GLU 21 59.586 4.016 4.016
149 1HG GLU 21 HG2 GLU 21 61.070 3.597 3.597
150 2HG GLU 21 HG1 GLU 21 61.686 5.167 5.167
151 H PHE 22 HN PHE 22 60.478 4.737 4.737
152 HA PHE 22 HA PHE 22 63.307 5.377 5.377
153 1HB PHE 22 HB2 PHE 22 61.572 4.174 4.174
154 2HB PHE 22 HB1 PHE 22 63.320 4.003 4.003
155 HD1 PHE 22 HD2 PHE 22 62.971 3.899 3.899
156 HD2 PHE 22 HD1 PHE 22 61.375 1.678 1.678
157 HE1 PHE 22 HE2 PHE 22 62.646 1.932 1.932
158 HE2 PHE 22 HE1 PHE 22 61.051 -0.289 -0.289
159 HZ PHE 22 HZ PHE 22 61.686 -0.162 -0.162
160 H LYS 23 HN LYS 23 60.522 6.929 6.929
161 HA LYS 23 HA LYS 23 61.638 8.214 8.214
162 1HB LYS 23 HB2 LYS 23 59.212 8.006 8.006
163 2HB LYS 23 HB1 LYS 23 59.620 9.468 9.468
164 1HG LYS 23 HG2 LYS 23 58.522 9.967 9.967
165 2HG LYS 23 HG1 LYS 23 60.148 10.643 10.643
166 1HD LYS 23 HD2 LYS 23 61.045 9.081 9.081
167 2HD LYS 23 HD1 LYS 23 59.780 7.897 7.897
168 1HE LYS 23 HE2 LYS 23 59.210 8.713 8.713
169 2HE LYS 23 HE1 LYS 23 58.184 9.686 9.686
170 1HZ LYS 23 HZ1 LYS 23 60.020 11.326 11.326
171 2HZ LYS 23 HZ3 LYS 23 60.844 10.438 10.438
172 3HZ LYS 23 HZ2 LYS 23 59.353 11.164 11.164
173 H ALA 24 HN ALA 24 60.953 9.813 9.813
174 HA ALA 24 HA ALA 24 62.630 12.064 12.064
175 1HB ALA 24 HB2 ALA 24 60.794 11.353 11.353
176 2HB ALA 24 HB1 ALA 24 62.234 10.955 10.955
177 3HB ALA 24 HB3 ALA 24 61.991 12.600 12.600
178 H ALA 25 HN ALA 25 63.393 8.810 8.810
179 HA ALA 25 HA ALA 25 66.039 9.511 9.511
180 1HB ALA 25 HB1 ALA 25 64.478 6.986 6.986
181 2HB ALA 25 HB3 ALA 25 66.153 6.926 6.926
182 3HB ALA 25 HB2 ALA 25 64.919 7.670 7.670
183 H PHE 26 HN PHE 26 64.713 8.045 8.045
184 HA PHE 26 HA PHE 26 67.188 7.315 7.315
185 1HB PHE 26 HB2 PHE 26 65.059 6.506 6.506
186 2HB PHE 26 HB1 PHE 26 64.477 8.148 8.148
187 HD1 PHE 26 HD1 PHE 26 65.726 9.605 9.605
188 HD2 PHE 26 HD2 PHE 26 66.225 5.347 5.347
189 HE1 PHE 26 HE1 PHE 26 66.665 9.559 9.559
190 HE2 PHE 26 HE2 PHE 26 67.163 5.302 5.302
191 HZ PHE 26 HZ PHE 26 67.383 7.407 7.407
192 H ASP 27 HN ASP 27 65.404 10.382 10.382
193 HA ASP 27 HA ASP 27 67.012 11.736 11.736
194 1HB ASP 27 HB2 ASP 27 64.715 12.173 12.173
195 2HB ASP 27 HB1 ASP 27 65.846 13.448 13.448
196 H MET 28 HN MET 28 67.797 10.639 10.639
197 HA MET 28 HA MET 28 69.279 12.724 12.724
198 1HB MET 28 HB2 MET 28 69.586 9.717 9.717
199 2HB MET 28 HB1 MET 28 70.632 10.712 10.712
200 1HG MET 28 HG2 MET 28 67.608 10.810 10.810
201 2HG MET 28 HG1 MET 28 68.592 9.785 9.785
202 1HE MET 28 HE3 MET 28 67.995 10.636 10.636
203 2HE MET 28 HE2 MET 28 67.797 12.327 12.327
204 3HE MET 28 HE1 MET 28 66.724 11.613 11.613
205 H PHE 29 HN PHE 29 69.988 10.823 10.823
206 HA PHE 29 HA PHE 29 72.678 12.150 12.150
207 1HB PHE 29 HB2 PHE 29 71.986 9.555 9.555
208 2HB PHE 29 HB1 PHE 29 73.561 10.136 10.136
209 HD1 PHE 29 HD1 PHE 29 74.224 9.990 9.990
210 HD2 PHE 29 HD2 PHE 29 70.423 8.519 8.519
211 HE1 PHE 29 HE1 PHE 29 73.931 8.772 8.772
212 HE2 PHE 29 HE2 PHE 29 70.131 7.299 7.299
213 HZ PHE 29 HZ PHE 29 71.886 7.423 7.423
214 H ASP 30 HN ASP 30 70.173 13.250 13.250
215 HA ASP 30 HA ASP 30 69.785 12.692 12.692
216 1HB ASP 30 HB2 ASP 30 68.472 14.737 14.737
217 2HB ASP 30 HB1 ASP 30 68.240 13.874 13.874
218 H ALA 31 HN ALA 31 72.341 12.640 12.640
219 HA ALA 31 HA ALA 31 74.033 14.832 14.832
220 1HB ALA 31 HB3 ALA 31 74.298 12.363 12.363
221 2HB ALA 31 HB2 ALA 31 73.779 12.958 12.958
222 3HB ALA 31 HB1 ALA 31 75.248 13.593 13.593
223 H ASP 32 HN ASP 32 71.466 14.073 14.073
224 HA ASP 32 HA ASP 32 72.065 16.551 16.551
225 1HB ASP 32 HB2 ASP 32 70.467 14.041 14.041
226 2HB ASP 32 HB1 ASP 32 70.009 15.459 15.459
227 H GLY 33 HN GLY 33 69.410 15.068 15.068
228 1HA GLY 33 HA2 GLY 33 68.094 16.540 16.540
229 2HA GLY 33 HA1 GLY 33 68.235 17.804 17.804
230 H GLY 34 HN GLY 34 67.552 14.428 14.428
231 1HA GLY 34 HA2 GLY 34 64.754 15.221 15.221
232 2HA GLY 34 HA1 GLY 34 65.742 14.277 14.277
233 H GLY 35 HN GLY 35 65.963 12.066 12.066
234 1HA GLY 35 HA2 GLY 35 64.971 10.913 10.913
235 2HA GLY 35 HA1 GLY 35 64.118 10.445 10.445
236 H ASP 36 HN ASP 36 67.549 11.098 11.098
237 HA ASP 36 HA ASP 36 68.177 8.186 8.186
238 1HB ASP 36 HB2 ASP 36 69.448 8.616 8.616
239 2HB ASP 36 HB1 ASP 36 67.688 8.541 8.541
240 H ILE 37 HN ILE 37 69.964 7.986 7.986
241 HA ILE 37 HA ILE 37 71.753 10.340 10.340
242 HB ILE 37 HB ILE 37 72.399 9.195 9.195
243 1HG1 ILE 37 HG12 ILE 37 70.851 6.812 6.812
244 2HG1 ILE 37 HG11 ILE 37 72.610 6.941 6.941
245 1HG2 ILE 37 HG21 ILE 37 70.161 10.259 10.259
246 2HG2 ILE 37 HG23 ILE 37 69.441 8.735 8.735
247 3HG2 ILE 37 HG22 ILE 37 70.218 8.853 8.853
248 HD1 ILE 37 HD1 ILE 37 71.708 7.591 7.591
249 HD1 ILE 37 HD1 ILE 37 72.610 6.162 6.162
250 HD1 ILE 37 HD1 ILE 37 70.847 6.131 6.131
251 H SER 38 HN SER 38 74.159 9.747 9.747
252 HA SER 38 HA SER 38 75.182 8.669 8.669
253 1HB SER 38 HB2 SER 38 76.679 8.503 8.503
254 2HB SER 38 HB1 SER 38 77.256 9.038 9.038
255 HG SER 38 HG SER 38 76.036 10.913 10.913
256 H THR 39 HN THR 39 75.567 6.573 6.573
257 HA THR 39 HA THR 39 74.435 4.309 4.309
258 HB THR 39 HB THR 39 76.346 3.170 3.170
259 HG1 THR 39 HG1 THR 39 77.762 4.722 4.722
260 1HG2 THR 39 HG21 THR 39 73.917 4.654 4.654
261 2HG2 THR 39 HG23 THR 39 75.039 4.444 4.444
262 3HG2 THR 39 HG22 THR 39 74.428 3.036 3.036
263 H LYS 40 HN LYS 40 77.452 5.927 5.927
264 HA LYS 40 HA LYS 40 78.695 3.743 3.743
265 1HB LYS 40 HB2 LYS 40 80.290 5.458 5.458
266 2HB LYS 40 HB1 LYS 40 79.771 5.791 5.791
267 1HG LYS 40 HG2 LYS 40 78.248 7.506 7.506
268 2HG LYS 40 HG1 LYS 40 78.510 7.075 7.075
269 1HD LYS 40 HD2 LYS 40 81.060 7.583 7.583
270 2HD LYS 40 HD1 LYS 40 79.990 8.928 8.928
271 1HE LYS 40 HE2 LYS 40 79.325 8.760 8.760
272 2HE LYS 40 HE1 LYS 40 80.917 7.986 7.986
273 1HZ LYS 40 HZ1 LYS 40 80.657 10.409 10.409
274 2HZ LYS 40 HZ3 LYS 40 80.707 10.580 10.580
275 3HZ LYS 40 HZ2 LYS 40 81.997 9.835 9.835
276 H GLU 41 HN GLU 41 76.206 6.039 6.039
277 HA GLU 41 HA GLU 41 76.511 5.663 5.663
278 1HB GLU 41 HB2 GLU 41 76.222 7.924 7.924
279 2HB GLU 41 HB1 GLU 41 74.672 7.412 7.412
280 1HG GLU 41 HG2 GLU 41 73.754 8.128 8.128
281 2HG GLU 41 HG1 GLU 41 74.488 6.712 6.712
282 H LEU 42 HN LEU 42 75.011 4.116 4.116
283 HA LEU 42 HA LEU 42 72.339 3.669 3.669
284 1HB LEU 42 HB2 LEU 42 73.162 3.048 3.048
285 2HB LEU 42 HB1 LEU 42 74.351 1.955 1.955
286 HG LEU 42 HG LEU 42 71.474 1.528 1.528
287 HD1 LEU 42 HD1 LEU 42 71.007 0.342 0.342
288 HD1 LEU 42 HD1 LEU 42 72.683 0.459 0.459
289 HD1 LEU 42 HD1 LEU 42 71.667 1.900 1.900
290 HD2 LEU 42 HD2 LEU 42 72.219 -0.561 -0.561
291 HD2 LEU 42 HD2 LEU 42 73.786 0.246 0.246
292 HD2 LEU 42 HD2 LEU 42 73.317 -0.657 -0.657
293 H GLY 43 HN GLY 43 75.305 2.674 2.674
294 1HA GLY 43 HA2 GLY 43 74.164 0.301 0.301
295 2HA GLY 43 HA1 GLY 43 75.798 0.925 0.925
296 H THR 44 HN THR 44 75.218 3.581 3.581
297 HA THR 44 HA THR 44 74.657 3.349 3.349
298 HB THR 44 HB THR 44 74.715 5.670 5.670
299 HG1 THR 44 HG1 THR 44 76.749 5.949 5.949
300 1HG2 THR 44 HG23 THR 44 73.377 6.142 6.142
301 2HG2 THR 44 HG22 THR 44 74.829 5.791 5.791
302 3HG2 THR 44 HG21 THR 44 74.812 7.151 7.151
303 H VAL 45 HN VAL 45 72.652 4.537 4.537
304 HA VAL 45 HA VAL 45 70.385 5.374 5.374
305 HB VAL 45 HB VAL 45 70.851 5.713 5.713
306 1HG1 VAL 45 HG13 VAL 45 71.646 3.352 3.352
307 2HG1 VAL 45 HG12 VAL 45 69.964 2.829 2.829
308 3HG1 VAL 45 HG11 VAL 45 70.482 3.912 3.912
309 1HG2 VAL 45 HG23 VAL 45 68.301 4.801 4.801
310 2HG2 VAL 45 HG22 VAL 45 68.641 6.219 6.219
311 3HG2 VAL 45 HG21 VAL 45 68.373 4.652 4.652
312 H MET 46 HN MET 46 71.190 2.129 2.129
313 HA MET 46 HA MET 46 68.735 0.936 0.936
314 1HB MET 46 HB2 MET 46 69.821 -1.140 -1.140
315 2HB MET 46 HB1 MET 46 69.861 0.144 0.144
316 1HG MET 46 HG2 MET 46 72.163 0.640 0.640
317 2HG MET 46 HG1 MET 46 72.148 -0.395 -0.395
318 1HE MET 46 HE3 MET 46 70.921 -0.445 -0.445
319 2HE MET 46 HE2 MET 46 71.248 -2.079 -2.079
320 3HE MET 46 HE1 MET 46 70.028 -1.818 -1.818
321 H ARG 47 HN ARG 47 72.133 1.151 1.151
322 HA ARG 47 HA ARG 47 71.772 -0.695 -0.695
323 1HB ARG 47 HB2 ARG 47 73.868 0.189 0.189
324 2HB ARG 47 HB1 ARG 47 74.028 1.233 1.233
325 1HG ARG 47 HG2 ARG 47 73.522 -1.213 -1.213
326 2HG ARG 47 HG1 ARG 47 74.489 -1.663 -1.663
327 1HD ARG 47 HD2 ARG 47 76.347 -0.410 -0.410
328 2HD ARG 47 HD1 ARG 47 75.364 0.616 0.616
329 HE ARG 47 HE ARG 47 74.944 -1.585 -1.585
330 1HH1 ARG 47 HH2 ARG 47 76.780 -3.126 -3.126
331 2HH1 ARG 47 HH2 ARG 47 78.238 -3.196 -3.196
332 1HH2 ARG 47 HH1 ARG 47 77.253 -0.715 -0.715
333 2HH2 ARG 47 HH1 ARG 47 78.504 -1.833 -1.833
334 H MET 48 HN MET 48 71.630 2.792 2.792
335 HA MET 48 HA MET 48 71.675 3.479 3.479
336 1HB MET 48 HB2 MET 48 72.312 4.868 4.868
337 2HB MET 48 HB1 MET 48 70.579 5.128 5.128
338 1HG MET 48 HG2 MET 48 70.662 5.816 5.816
339 2HG MET 48 HG1 MET 48 72.386 6.041 6.041
340 1HE MET 48 HE2 MET 48 72.162 8.163 8.163
341 2HE MET 48 HE1 MET 48 73.091 8.701 8.701
342 3HE MET 48 HE3 MET 48 71.665 9.609 9.609
343 H LEU 49 HN LEU 49 69.410 1.860 1.860
344 HA LEU 49 HA LEU 49 67.056 3.182 3.182
345 1HB LEU 49 HB2 LEU 49 67.528 1.231 1.231
346 2HB LEU 49 HB1 LEU 49 65.912 1.458 1.458
347 HG LEU 49 HG LEU 49 67.668 3.686 3.686
348 HD1 LEU 49 HD1 LEU 49 66.696 1.970 1.970
349 HD1 LEU 49 HD1 LEU 49 66.330 3.669 3.669
350 HD1 LEU 49 HD1 LEU 49 65.118 2.622 2.622
351 HD2 LEU 49 HD2 LEU 49 64.826 4.217 4.217
352 HD2 LEU 49 HD2 LEU 49 66.173 5.104 5.104
353 HD2 LEU 49 HD2 LEU 49 65.475 3.727 3.727
354 H GLY 50 HN GLY 50 68.565 -0.056 -0.056
355 1HA GLY 50 HA2 GLY 50 68.575 -1.070 -1.070
356 2HA GLY 50 HA1 GLY 50 66.831 -1.035 -1.035
357 H GLN 51 HN GLN 51 69.536 -1.916 -1.916
358 HA GLN 51 HA GLN 51 68.247 -4.612 -4.612
359 1HB GLN 51 HB2 GLN 51 69.557 -2.926 -2.926
360 2HB GLN 51 HB1 GLN 51 68.724 -4.464 -4.464
361 1HG GLN 51 HG2 GLN 51 66.676 -3.497 -3.497
362 2HG GLN 51 HG1 GLN 51 67.108 -2.452 -2.452
363 1HE2 GLN 51 HE22 GLN 51 66.864 0.128 0.128
364 2HE2 GLN 51 HE21 GLN 51 66.049 -0.634 -0.634
365 H ASN 52 HN ASN 52 70.292 -5.497 -5.497
366 HA ASN 52 HA ASN 52 72.874 -5.207 -5.207
367 1HB ASN 52 HB2 ASN 52 71.367 -7.838 -7.838
368 2HB ASN 52 HB1 ASN 52 72.966 -7.614 -7.614
369 HD2 ASN 52 HD2 ASN 52 73.078 -6.190 -6.190
370 HD2 ASN 52 HD2 ASN 52 71.712 -6.056 -6.056
371 HA PRO 53 HA PRO 53 72.962 -6.154 -6.154
372 1HB PRO 53 HB2 PRO 53 74.306 -3.891 -3.891
373 2HB PRO 53 HB1 PRO 53 72.536 -3.974 -3.974
374 1HG PRO 53 HG2 PRO 53 74.497 -2.818 -2.818
375 2HG PRO 53 HG1 PRO 53 72.893 -2.232 -2.232
376 1HD PRO 53 HD2 PRO 53 73.400 -3.565 -3.565
377 2HD PRO 53 HD1 PRO 53 71.821 -3.572 -3.572
378 H THR 54 HN THR 54 74.514 -7.811 -7.811
379 HA THR 54 HA THR 54 77.133 -7.398 -7.398
380 HB THR 54 HB THR 54 77.509 -9.664 -9.664
381 HG1 THR 54 HG1 THR 54 74.836 -9.483 -9.483
382 1HG2 THR 54 HG21 THR 54 75.779 -8.911 -8.911
383 2HG2 THR 54 HG23 THR 54 74.831 -10.042 -10.042
384 3HG2 THR 54 HG22 THR 54 76.388 -10.540 -10.540
385 H LYS 55 HN LYS 55 79.168 -7.276 -7.276
386 HA LYS 55 HA LYS 55 79.476 -5.489 -5.489
387 1HB LYS 55 HB2 LYS 55 81.125 -6.880 -6.880
388 2HB LYS 55 HB1 LYS 55 81.240 -7.911 -7.911
389 1HG LYS 55 HG2 LYS 55 82.539 -6.413 -6.413
390 2HG LYS 55 HG1 LYS 55 81.408 -5.104 -5.104
391 1HD LYS 55 HD2 LYS 55 82.358 -4.943 -4.943
392 2HD LYS 55 HD1 LYS 55 83.552 -6.163 -6.163
393 1HE LYS 55 HE2 LYS 55 84.565 -4.729 -4.729
394 2HE LYS 55 HE1 LYS 55 83.209 -3.585 -3.585
395 1HZ LYS 55 HZ2 LYS 55 83.755 -3.517 -3.517
396 2HZ LYS 55 HZ1 LYS 55 85.272 -4.127 -4.127
397 3HZ LYS 55 HZ3 LYS 55 84.740 -2.634 -2.634
398 H GLU 56 HN GLU 56 79.359 -9.057 -9.057
399 HA GLU 56 HA GLU 56 79.493 -9.181 -9.181
400 1HB GLU 56 HB2 GLU 56 79.662 -11.155 -11.155
401 2HB GLU 56 HB1 GLU 56 78.108 -10.847 -10.847
402 1HG GLU 56 HG2 GLU 56 76.943 -11.791 -11.791
403 2HG GLU 56 HG1 GLU 56 77.940 -11.012 -11.012
404 H GLU 57 HN GLU 57 76.529 -9.129 -9.129
405 HA GLU 57 HA GLU 57 74.702 -8.917 -8.917
406 1HB GLU 57 HB2 GLU 57 74.502 -8.105 -8.105
407 2HB GLU 57 HB1 GLU 57 73.127 -8.280 -8.280
408 1HG GLU 57 HG2 GLU 57 75.098 -10.511 -10.511
409 2HG GLU 57 HG1 GLU 57 73.588 -10.307 -10.307
410 H LEU 58 HN LEU 58 76.320 -6.488 -6.488
411 HA LEU 58 HA LEU 58 74.895 -4.215 -4.215
412 1HB LEU 58 HB2 LEU 58 75.880 -4.026 -4.026
413 2HB LEU 58 HB1 LEU 58 77.426 -4.656 -4.656
414 HG LEU 58 HG LEU 58 77.688 -2.635 -2.635
415 HD1 LEU 58 HD1 LEU 58 75.823 -1.446 -1.446
416 HD1 LEU 58 HD1 LEU 58 75.899 -0.841 -0.841
417 HD1 LEU 58 HD1 LEU 58 74.931 -2.267 -2.267
418 HD2 LEU 58 HD2 LEU 58 77.734 -1.002 -1.002
419 HD2 LEU 58 HD2 LEU 58 78.865 -2.350 -2.350
420 HD2 LEU 58 HD2 LEU 58 77.420 -2.497 -2.497
421 H ASP 59 HN ASP 59 78.101 -5.667 -5.667
422 HA ASP 59 HA ASP 59 78.896 -3.751 -3.751
423 1HB ASP 59 HB2 ASP 59 79.716 -6.626 -6.626
424 2HB ASP 59 HB1 ASP 59 80.623 -5.483 -5.483
425 H ALA 60 HN ALA 60 77.278 -6.924 -6.924
426 HA ALA 60 HA ALA 60 77.268 -7.060 -7.060
427 1HB ALA 60 HB3 ALA 60 76.920 -8.821 -8.821
428 2HB ALA 60 HB2 ALA 60 75.223 -8.420 -8.420
429 3HB ALA 60 HB1 ALA 60 76.190 -9.079 -9.079
430 H ILE 61 HN ILE 61 75.115 -5.670 -5.670
431 HA ILE 61 HA ILE 61 72.866 -5.281 -5.281
432 HB ILE 61 HB ILE 61 73.688 -4.245 -4.245
433 1HG1 ILE 61 HG12 ILE 61 71.337 -5.977 -5.977
434 2HG1 ILE 61 HG11 ILE 61 72.918 -6.658 -6.658
435 1HG2 ILE 61 HG23 ILE 61 71.417 -3.440 -3.440
436 2HG2 ILE 61 HG22 ILE 61 71.116 -3.578 -3.578
437 3HG2 ILE 61 HG21 ILE 61 72.347 -2.464 -2.464
438 HD1 ILE 61 HD1 ILE 61 72.655 -5.078 -5.078
439 HD1 ILE 61 HD1 ILE 61 71.989 -6.711 -6.711
440 HD1 ILE 61 HD1 ILE 61 70.943 -5.325 -5.325
441 H ILE 62 HN ILE 62 75.034 -2.907 -2.907
442 HA ILE 62 HA ILE 62 74.370 -0.584 -0.584
443 HB ILE 62 HB ILE 62 77.081 -1.721 -1.721
444 1HG1 ILE 62 HG12 ILE 62 75.089 0.105 0.105
445 2HG1 ILE 62 HG11 ILE 62 75.644 -1.479 -1.479
446 1HG2 ILE 62 HG22 ILE 62 77.264 0.115 0.115
447 2HG2 ILE 62 HG21 ILE 62 76.353 1.161 1.161
448 3HG2 ILE 62 HG23 ILE 62 77.940 0.559 0.559
449 HD1 ILE 62 HD1 ILE 62 77.975 0.067 0.067
450 HD1 ILE 62 HD1 ILE 62 77.269 -0.445 -0.445
451 HD1 ILE 62 HD1 ILE 62 76.830 1.115 1.115
452 H GLU 63 HN GLU 63 77.065 -2.658 -2.658
453 HA GLU 63 HA GLU 63 77.326 -1.471 -1.471
454 1HB GLU 63 HB2 GLU 63 79.005 -2.946 -2.946
455 2HB GLU 63 HB1 GLU 63 77.836 -4.236 -4.236
456 1HG GLU 63 HG2 GLU 63 77.730 -3.446 -3.446
457 2HG GLU 63 HG1 GLU 63 79.398 -3.813 -3.813
458 H GLU 64 HN GLU 64 75.022 -3.837 -3.837
459 HA GLU 64 HA GLU 64 74.031 -4.643 -4.643
460 1HB GLU 64 HB2 GLU 64 73.713 -6.224 -6.224
461 2HB GLU 64 HB1 GLU 64 73.312 -4.999 -4.999
462 1HG GLU 64 HG2 GLU 64 71.297 -6.253 -6.253
463 2HG GLU 64 HG1 GLU 64 71.156 -4.587 -4.587
464 H VAL 65 HN VAL 65 73.179 -2.213 -2.213
465 HA VAL 65 HA VAL 65 70.842 -1.358 -1.358
466 HB VAL 65 HB VAL 65 70.162 -0.228 -0.228
467 1HG1 VAL 65 HG13 VAL 65 71.016 -3.061 -3.061
468 2HG1 VAL 65 HG12 VAL 65 70.700 -2.347 -2.347
469 3HG1 VAL 65 HG11 VAL 65 69.439 -2.354 -2.354
470 1HG2 VAL 65 HG21 VAL 65 72.533 0.495 0.495
471 2HG2 VAL 65 HG23 VAL 65 71.578 -0.062 -0.062
472 3HG2 VAL 65 HG22 VAL 65 72.787 -1.124 -1.124
473 H ASP 66 HN ASP 66 74.101 -0.628 -0.628
474 HA ASP 66 HA ASP 66 74.008 2.272 2.272
475 1HB ASP 66 HB2 ASP 66 75.985 0.070 0.070
476 2HB ASP 66 HB1 ASP 66 76.410 1.624 1.624
477 H GLU 67 HN GLU 67 72.209 2.145 2.145
478 HA GLU 67 HA GLU 67 72.548 1.355 1.355
479 1HB GLU 67 HB2 GLU 67 71.210 3.434 3.434
480 2HB GLU 67 HB1 GLU 67 70.562 2.486 2.486
481 1HG GLU 67 HG2 GLU 67 72.348 4.159 4.159
482 2HG GLU 67 HG1 GLU 67 71.687 5.199 5.199
483 H ASP 68 HN ASP 68 74.590 1.476 1.476
484 HA ASP 68 HA ASP 68 76.455 3.619 3.619
485 1HB ASP 68 HB2 ASP 68 77.637 2.479 2.479
486 2HB ASP 68 HB1 ASP 68 76.861 1.253 1.253
487 H GLY 69 HN GLY 69 74.482 5.276 5.276
488 1HA GLY 69 HA2 GLY 69 74.997 7.009 7.009
489 2HA GLY 69 HA1 GLY 69 74.051 5.801 5.801
490 H SER 70 HN SER 70 72.270 5.221 5.221
491 HA SER 70 HA SER 70 70.432 7.484 7.484
492 1HB SER 70 HB2 SER 70 70.162 4.937 4.937
493 2HB SER 70 HB1 SER 70 68.848 5.994 5.994
494 HG SER 70 HG SER 70 70.567 5.041 5.041
495 H GLY 71 HN GLY 71 72.985 7.265 7.265
496 1HA GLY 71 HA2 GLY 71 73.204 9.059 9.059
497 2HA GLY 71 HA1 GLY 71 71.564 8.664 8.664
498 H THR 72 HN THR 72 71.776 7.826 7.826
499 HA THR 72 HA THR 72 73.880 5.731 5.731
500 HB THR 72 HB THR 72 73.763 6.488 6.488
501 HG1 THR 72 HG1 THR 72 72.510 8.624 8.624
502 1HG2 THR 72 HG21 THR 72 74.729 7.958 7.958
503 2HG2 THR 72 HG23 THR 72 74.060 9.128 9.128
504 3HG2 THR 72 HG22 THR 72 75.317 8.007 8.007
505 H ILE 73 HN ILE 73 71.244 6.407 6.407
506 HA ILE 73 HA ILE 73 69.976 3.790 3.790
507 HB ILE 73 HB ILE 73 71.318 3.533 3.533
508 1HG1 ILE 73 HG12 ILE 73 68.380 3.912 3.912
509 2HG1 ILE 73 HG11 ILE 73 69.144 2.427 2.427
510 1HG2 ILE 73 HG22 ILE 73 71.517 5.937 5.937
511 2HG2 ILE 73 HG21 ILE 73 69.828 5.961 5.961
512 3HG2 ILE 73 HG23 ILE 73 71.007 5.012 5.012
513 HD1 ILE 73 HD1 ILE 73 70.585 3.391 3.391
514 HD1 ILE 73 HD1 ILE 73 69.704 1.875 1.875
515 HD1 ILE 73 HD1 ILE 73 68.867 3.315 3.315
516 H ASP 74 HN ASP 74 67.683 3.744 3.744
517 HA ASP 74 HA ASP 74 66.403 6.433 6.433
518 1HB ASP 74 HB2 ASP 74 65.875 3.936 3.936
519 2HB ASP 74 HB1 ASP 74 64.538 5.033 5.033
520 H PHE 75 HN PHE 75 64.731 6.683 6.683
521 HA PHE 75 HA PHE 75 64.561 5.038 5.038
522 1HB PHE 75 HB2 PHE 75 63.775 7.430 7.430
523 2HB PHE 75 HB1 PHE 75 62.347 6.745 6.745
524 HD1 PHE 75 HD2 PHE 75 60.925 5.078 5.078
525 HD2 PHE 75 HD1 PHE 75 63.902 7.604 7.604
526 HE1 PHE 75 HE2 PHE 75 59.879 4.734 4.734
527 HE2 PHE 75 HE1 PHE 75 62.855 7.259 7.259
528 HZ PHE 75 HZ PHE 75 60.844 5.824 5.824
529 H GLU 76 HN GLU 76 62.348 5.153 5.153
530 HA GLU 76 HA GLU 76 60.520 3.161 3.161
531 1HB GLU 76 HB2 GLU 76 61.535 4.395 4.395
532 2HB GLU 76 HB1 GLU 76 60.780 2.816 2.816
533 1HG GLU 76 HG2 GLU 76 59.144 4.271 4.271
534 2HG GLU 76 HG1 GLU 76 59.510 5.349 5.349
535 H GLU 77 HN GLU 77 63.578 2.746 2.746
536 HA GLU 77 HA GLU 77 63.385 -0.160 -0.160
537 1HB GLU 77 HB2 GLU 77 64.577 1.442 1.442
538 2HB GLU 77 HB1 GLU 77 65.846 1.551 1.551
539 1HG GLU 77 HG2 GLU 77 66.601 -0.558 -0.558
540 2HG GLU 77 HG1 GLU 77 64.974 -1.199 -1.199
541 H PHE 78 HN PHE 78 65.349 2.216 2.216
542 HA PHE 78 HA PHE 78 66.926 0.487 0.487
543 1HB PHE 78 HB2 PHE 78 67.296 2.822 2.822
544 2HB PHE 78 HB1 PHE 78 65.605 3.159 3.159
545 HD1 PHE 78 HD1 PHE 78 68.610 1.393 1.393
546 HD2 PHE 78 HD2 PHE 78 64.930 3.441 3.441
547 HE1 PHE 78 HE1 PHE 78 69.119 1.309 1.309
548 HE2 PHE 78 HE2 PHE 78 65.438 3.357 3.357
549 HZ PHE 78 HZ PHE 78 67.533 2.291 2.291
550 H LEU 79 HN LEU 79 63.494 1.226 1.226
551 HA LEU 79 HA LEU 79 62.855 0.479 0.479
552 1HB LEU 79 HB2 LEU 79 61.610 0.256 0.256
553 2HB LEU 79 HB1 LEU 79 60.859 -0.693 -0.693
554 HG LEU 79 HG LEU 79 61.556 2.186 2.186
555 HD1 LEU 79 HD1 LEU 79 60.094 1.669 1.669
556 HD1 LEU 79 HD1 LEU 79 59.695 3.007 3.007
557 HD1 LEU 79 HD1 LEU 79 58.820 1.481 1.481
558 HD2 LEU 79 HD2 LEU 79 60.046 0.026 0.026
559 HD2 LEU 79 HD2 LEU 79 59.112 1.517 1.517
560 HD2 LEU 79 HD2 LEU 79 60.670 1.520 1.520
561 H VAL 80 HN VAL 80 63.869 -1.627 -1.627
562 HA VAL 80 HA VAL 80 63.187 -4.134 -4.134
563 HB VAL 80 HB VAL 80 64.494 -5.053 -5.053
564 1HG1 VAL 80 HG11 VAL 80 62.659 -2.872 -2.872
565 2HG1 VAL 80 HG13 VAL 80 63.881 -2.852 -2.852
566 3HG1 VAL 80 HG12 VAL 80 62.912 -4.301 -4.301
567 1HG2 VAL 80 HG23 VAL 80 65.801 -2.319 -2.319
568 2HG2 VAL 80 HG22 VAL 80 66.570 -3.865 -3.865
569 3HG2 VAL 80 HG21 VAL 80 66.009 -3.518 -3.518
570 H MET 81 HN MET 81 66.041 -2.034 -2.034
571 HA MET 81 HA MET 81 67.851 -3.852 -3.852
572 1HB MET 81 HB2 MET 81 67.524 -0.922 -0.922
573 2HB MET 81 HB1 MET 81 68.627 -1.411 -1.411
574 1HG MET 81 HG2 MET 81 69.959 -1.270 -1.270
575 2HG MET 81 HG1 MET 81 69.695 -2.990 -2.990
576 1HE MET 81 HE3 MET 81 69.127 0.088 0.088
577 2HE MET 81 HE2 MET 81 69.959 -0.749 -0.749
578 3HE MET 81 HE1 MET 81 68.284 -0.247 -0.247
579 H MET 82 HN MET 82 66.461 -1.023 -1.023
580 HA MET 82 HA MET 82 66.798 -1.851 -1.851
581 1HB MET 82 HB2 MET 82 64.592 -0.475 -0.475
582 2HB MET 82 HB1 MET 82 65.998 0.332 0.332
583 1HG MET 82 HG2 MET 82 64.926 0.696 0.696
584 2HG MET 82 HG1 MET 82 64.433 -0.993 -0.993
585 1HE MET 82 HE1 MET 82 63.545 2.447 2.447
586 2HE MET 82 HE3 MET 82 62.077 2.631 2.631
587 3HE MET 82 HE2 MET 82 63.631 2.378 2.378
588 H VAL 83 HN VAL 83 64.333 -2.930 -2.930
589 HA VAL 83 HA VAL 83 62.801 -4.380 -4.380
590 HB VAL 83 HB VAL 83 62.738 -4.247 -4.247
591 1HG1 VAL 83 HG11 VAL 83 61.198 -5.871 -5.871
592 2HG1 VAL 83 HG13 VAL 83 60.304 -5.167 -5.167
593 3HG1 VAL 83 HG12 VAL 83 61.654 -6.258 -6.258
594 1HG2 VAL 83 HG23 VAL 83 62.104 -2.258 -2.258
595 2HG2 VAL 83 HG22 VAL 83 61.067 -2.640 -2.640
596 3HG2 VAL 83 HG21 VAL 83 60.630 -3.198 -3.198
597 H ARG 84 HN ARG 84 64.367 -5.505 -5.505
598 HA ARG 84 HA ARG 84 64.471 -8.238 -8.238
599 1HB ARG 84 HB2 ARG 84 66.511 -6.444 -6.444
600 2HB ARG 84 HB1 ARG 84 66.443 -8.197 -8.197
601 1HG ARG 84 HG2 ARG 84 64.040 -6.461 -6.461
602 2HG ARG 84 HG1 ARG 84 65.264 -6.782 -6.782
603 1HD ARG 84 HD2 ARG 84 64.647 -9.287 -9.287
604 2HD ARG 84 HD1 ARG 84 63.105 -8.489 -8.489
605 HE ARG 84 HE ARG 84 64.974 -8.157 -8.157
606 1HH1 ARG 84 HH1 ARG 84 61.945 -8.924 -8.924
607 2HH1 ARG 84 HH1 ARG 84 62.006 -10.457 -10.457
608 1HH2 ARG 84 HH2 ARG 84 65.448 -10.770 -10.770
609 2HH2 ARG 84 HH2 ARG 84 63.989 -11.502 -11.502
610 H GLN 85 HN GLN 85 66.500 -5.660 -5.660
611 HA GLN 85 HA GLN 85 68.522 -7.389 -7.389
612 1HB GLN 85 HB2 GLN 85 68.583 -4.876 -4.876
613 2HB GLN 85 HB1 GLN 85 67.697 -4.628 -4.628
614 1HG GLN 85 HG2 GLN 85 70.144 -4.399 -4.399
615 2HG GLN 85 HG1 GLN 85 69.479 -5.744 -5.744
616 1HE2 GLN 85 HE22 GLN 85 71.698 -8.010 -8.010
617 2HE2 GLN 85 HE21 GLN 85 70.813 -7.545 -7.545
618 H MET 86 HN MET 86 66.138 -5.321 -5.321
619 HA MET 86 HA MET 86 66.279 -6.655 -6.655
620 1HB MET 86 HB2 MET 86 64.803 -4.585 -4.585
621 2HB MET 86 HB1 MET 86 63.634 -5.655 -5.655
622 1HG MET 86 HG2 MET 86 65.239 -5.543 -5.543
623 2HG MET 86 HG1 MET 86 65.894 -4.112 -4.112
624 1HE MET 86 HE1 MET 86 64.418 -5.060 -5.060
625 2HE MET 86 HE3 MET 86 63.222 -3.857 -3.857
626 3HE MET 86 HE2 MET 86 62.705 -5.336 -5.336
627 H LYS 87 HN LYS 87 64.710 -7.596 -7.596
628 HA LYS 87 HA LYS 87 62.598 -9.233 -9.233
629 1HB LYS 87 HB2 LYS 87 64.562 -9.117 -9.117
630 2HB LYS 87 HB1 LYS 87 63.800 -10.693 -10.693
631 1HG LYS 87 HG2 LYS 87 61.809 -8.627 -8.627
632 2HG LYS 87 HG1 LYS 87 62.695 -8.413 -8.413
633 1HD LYS 87 HD2 LYS 87 62.159 -11.216 -11.216
634 2HD LYS 87 HD1 LYS 87 60.656 -10.299 -10.299
635 1HE LYS 87 HE2 LYS 87 61.759 -9.097 -9.097
636 2HE LYS 87 HE1 LYS 87 62.420 -10.735 -10.735
637 1HZ LYS 87 HZ2 LYS 87 59.595 -10.362 -10.362
638 2HZ LYS 87 HZ1 LYS 87 60.052 -10.233 -10.233
639 3HZ LYS 87 HZ3 LYS 87 60.332 -11.676 -11.676
640 H GLU 88 HN GLU 88 66.025 -9.643 -9.643
641 HA GLU 88 HA GLU 88 65.687 -12.455 -12.455
642 1HB GLU 88 HB2 GLU 88 67.904 -10.631 -10.631
643 2HB GLU 88 HB1 GLU 88 68.303 -11.949 -11.949
644 1HG GLU 88 HG2 GLU 88 66.753 -13.269 -13.269
645 2HG GLU 88 HG1 GLU 88 67.492 -12.049 -12.049
646 H ASP 89 HN ASP 89 66.680 -9.235 -9.235
647 HA ASP 89 HA ASP 89 67.185 -10.191 -10.191
648 1HB ASP 89 HB2 ASP 89 68.327 -8.273 -8.273
649 2HB ASP 89 HB1 ASP 89 66.809 -7.380 -7.380
650 H ALA 90 HN ALA 90 64.538 -8.618 -8.618
651 HA ALA 90 HA ALA 90 62.959 -8.060 -8.060
652 1HB ALA 90 HB3 ALA 90 62.975 -6.930 -6.930
653 2HB ALA 90 HB2 ALA 90 61.971 -8.287 -8.287
654 3HB ALA 90 HB1 ALA 90 61.406 -7.201 -7.201
Start of MODEL 11
1 1H ALA 1 HT1 ALA 1 63.862 -3.772 -3.772
2 2H ALA 1 HT3 ALA 1 65.387 -3.363 -3.363
3 3H ALA 1 HT2 ALA 1 64.369 -4.409 -4.409
4 HA ALA 1 HA ALA 1 65.720 -5.972 -5.972
5 1HB ALA 1 HB1 ALA 1 66.066 -3.710 -3.710
6 2HB ALA 1 HB3 ALA 1 66.496 -5.330 -5.330
7 3HB ALA 1 HB2 ALA 1 67.291 -4.637 -4.637
8 H SER 2 HN SER 2 65.503 -7.399 -7.399
9 HA SER 2 HA SER 2 62.628 -7.849 -7.849
10 1HB SER 2 HB2 SER 2 64.596 -9.531 -9.531
11 2HB SER 2 HB1 SER 2 64.910 -9.249 -9.249
12 HG SER 2 HG SER 2 63.069 -10.214 -10.214
13 H MET 3 HN MET 3 65.075 -6.052 -6.052
14 HA MET 3 HA MET 3 64.414 -6.327 -6.327
15 1HB MET 3 HB2 MET 3 65.745 -4.406 -4.406
16 2HB MET 3 HB1 MET 3 65.137 -3.701 -3.701
17 1HG MET 3 HG2 MET 3 66.374 -6.206 -6.206
18 2HG MET 3 HG1 MET 3 67.490 -5.266 -5.266
19 1HE MET 3 HE1 MET 3 65.811 -6.080 -6.080
20 2HE MET 3 HE3 MET 3 67.126 -5.634 -5.634
21 3HE MET 3 HE2 MET 3 65.630 -4.703 -4.703
22 H THR 4 HN THR 4 62.700 -4.771 -4.771
23 HA THR 4 HA THR 4 61.150 -2.847 -2.847
24 HB THR 4 HB THR 4 61.354 -3.315 -3.315
25 HG1 THR 4 HG1 THR 4 59.009 -2.920 -2.920
26 1HG2 THR 4 HG21 THR 4 60.955 -5.748 -5.748
27 2HG2 THR 4 HG23 THR 4 59.306 -5.443 -5.443
28 3HG2 THR 4 HG22 THR 4 59.799 -4.972 -4.972
29 H ASP 5 HN ASP 5 61.126 -6.279 -6.279
30 HA ASP 5 HA ASP 5 58.332 -6.446 -6.446
31 1HB ASP 5 HB2 ASP 5 60.104 -8.134 -8.134
32 2HB ASP 5 HB1 ASP 5 60.190 -8.702 -8.702
33 H GLN 6 HN GLN 6 61.608 -6.919 -6.919
34 HA GLN 6 HA GLN 6 60.636 -7.290 -7.290
35 1HB GLN 6 HB2 GLN 6 62.793 -8.124 -8.124
36 2HB GLN 6 HB1 GLN 6 63.387 -6.465 -6.465
37 1HG GLN 6 HG2 GLN 6 63.900 -6.704 -6.704
38 2HG GLN 6 HG1 GLN 6 62.252 -7.214 -7.214
39 1HE2 GLN 6 HE22 GLN 6 65.109 -9.954 -9.954
40 2HE2 GLN 6 HE21 GLN 6 65.362 -8.279 -8.279
41 H GLN 7 HN GLN 7 60.855 -4.552 -4.552
42 HA GLN 7 HA GLN 7 61.643 -2.632 -2.632
43 1HB GLN 7 HB2 GLN 7 62.012 -2.520 -2.520
44 2HB GLN 7 HB1 GLN 7 60.301 -2.111 -2.111
45 1HG GLN 7 HG2 GLN 7 61.269 -0.438 -0.438
46 2HG GLN 7 HG1 GLN 7 62.539 -0.429 -0.429
47 1HE2 GLN 7 HE22 GLN 7 60.652 1.447 1.447
48 2HE2 GLN 7 HE21 GLN 7 62.118 0.660 0.660
49 H ALA 8 HN ALA 8 58.684 -4.064 -4.064
50 HA ALA 8 HA ALA 8 56.963 -1.987 -1.987
51 1HB ALA 8 HB1 ALA 8 56.770 -4.275 -4.275
52 2HB ALA 8 HB3 ALA 8 55.378 -4.111 -4.111
53 3HB ALA 8 HB2 ALA 8 55.846 -2.773 -2.773
54 H GLU 9 HN GLU 9 57.318 -5.538 -5.538
55 HA GLU 9 HA GLU 9 55.768 -5.725 -5.725
56 1HB GLU 9 HB2 GLU 9 56.261 -7.660 -7.660
57 2HB GLU 9 HB1 GLU 9 57.998 -7.370 -7.370
58 1HG GLU 9 HG2 GLU 9 57.795 -7.688 -7.688
59 2HG GLU 9 HG1 GLU 9 56.138 -8.225 -8.225
60 H ALA 10 HN ALA 10 58.901 -4.412 -4.412
61 HA ALA 10 HA ALA 10 60.123 -5.023 -5.023
62 1HB ALA 10 HB1 ALA 10 60.679 -3.626 -3.626
63 2HB ALA 10 HB3 ALA 10 60.922 -2.477 -2.477
64 3HB ALA 10 HB2 ALA 10 61.808 -4.002 -4.002
65 H ARG 11 HN ARG 11 57.661 -2.746 -2.746
66 HA ARG 11 HA ARG 11 58.002 -1.171 -1.171
67 1HB ARG 11 HB2 ARG 11 55.946 -0.736 -0.736
68 2HB ARG 11 HB1 ARG 11 56.684 0.457 0.457
69 1HG ARG 11 HG2 ARG 11 58.076 0.902 0.902
70 2HG ARG 11 HG1 ARG 11 58.867 -0.621 -0.621
71 1HD ARG 11 HD2 ARG 11 57.999 -1.703 -1.703
72 2HD ARG 11 HD1 ARG 11 56.430 -0.886 -0.886
73 HE ARG 11 HE ARG 11 58.784 0.700 0.700
74 1HH1 ARG 11 HH1 ARG 11 55.761 1.440 1.440
75 2HH1 ARG 11 HH1 ARG 11 55.421 1.365 1.365
76 1HH2 ARG 11 HH2 ARG 11 58.336 -0.346 -0.346
77 2HH2 ARG 11 HH2 ARG 11 56.879 0.354 0.354
78 H ALA 12 HN ALA 12 55.478 -2.994 -2.994
79 HA ALA 12 HA ALA 12 53.381 -2.817 -2.817
80 1HB ALA 12 HB1 ALA 12 54.202 -4.411 -4.411
81 2HB ALA 12 HB3 ALA 12 53.391 -5.429 -5.429
82 3HB ALA 12 HB2 ALA 12 52.569 -4.013 -4.013
83 H PHE 13 HN PHE 13 56.405 -4.488 -4.488
84 HA PHE 13 HA PHE 13 55.817 -6.634 -6.634
85 1HB PHE 13 HB2 PHE 13 58.024 -6.326 -6.326
86 2HB PHE 13 HB1 PHE 13 58.113 -4.679 -4.679
87 HD1 PHE 13 HD1 PHE 13 57.137 -7.983 -7.983
88 HD2 PHE 13 HD2 PHE 13 59.658 -4.513 -4.513
89 HE1 PHE 13 HE1 PHE 13 58.111 -8.833 -8.833
90 HE2 PHE 13 HE2 PHE 13 60.631 -5.363 -5.363
91 HZ PHE 13 HZ PHE 13 59.858 -7.523 -7.523
92 H LEU 14 HN LEU 14 56.147 -3.175 -3.175
93 HA LEU 14 HA LEU 14 55.334 -3.783 -3.783
94 1HB LEU 14 HB2 LEU 14 56.630 -1.296 -1.296
95 2HB LEU 14 HB1 LEU 14 56.495 -1.735 -1.735
96 HG LEU 14 HG LEU 14 57.746 -3.874 -3.874
97 HD1 LEU 14 HD1 LEU 14 59.845 -2.003 -2.003
98 HD1 LEU 14 HD1 LEU 14 58.487 -1.176 -1.176
99 HD1 LEU 14 HD1 LEU 14 59.060 -2.712 -2.712
100 HD2 LEU 14 HD2 LEU 14 57.782 -2.852 -2.852
101 HD2 LEU 14 HD2 LEU 14 59.327 -2.278 -2.278
102 HD2 LEU 14 HD2 LEU 14 58.963 -4.004 -4.004
103 H SER 15 HN SER 15 54.042 -1.847 -1.847
104 HA SER 15 HA SER 15 51.710 -1.370 -1.370
105 1HB SER 15 HB2 SER 15 52.478 -1.140 -1.140
106 2HB SER 15 HB1 SER 15 51.174 -0.095 -0.095
107 HG SER 15 HG SER 15 50.429 -2.151 -2.151
108 H GLU 16 HN GLU 16 50.811 0.880 0.880
109 HA GLU 16 HA GLU 16 52.763 2.753 2.753
110 1HB GLU 16 HB2 GLU 16 50.426 2.556 2.556
111 2HB GLU 16 HB1 GLU 16 49.852 3.080 3.080
112 1HG GLU 16 HG2 GLU 16 51.396 5.155 5.155
113 2HG GLU 16 HG1 GLU 16 51.280 4.672 4.672
114 H GLU 17 HN GLU 17 51.644 2.060 2.060
115 HA GLU 17 HA GLU 17 51.896 4.694 4.694
116 1HB GLU 17 HB2 GLU 17 50.779 2.410 2.410
117 2HB GLU 17 HB1 GLU 17 52.357 2.144 2.144
118 1HG GLU 17 HG2 GLU 17 52.175 4.258 4.258
119 2HG GLU 17 HG1 GLU 17 50.637 4.605 4.605
120 H MET 18 HN MET 18 54.076 1.850 1.850
121 HA MET 18 HA MET 18 56.253 3.252 3.252
122 1HB MET 18 HB2 MET 18 55.822 0.787 0.787
123 2HB MET 18 HB1 MET 18 56.227 0.722 0.722
124 1HG MET 18 HG2 MET 18 58.402 2.033 2.033
125 2HG MET 18 HG1 MET 18 58.007 1.097 1.097
126 1HE MET 18 HE2 MET 18 58.727 1.454 1.454
127 2HE MET 18 HE1 MET 18 59.929 0.207 0.207
128 3HE MET 18 HE3 MET 18 58.232 -0.063 -0.063
129 H ILE 19 HN ILE 19 55.377 2.551 2.551
130 HA ILE 19 HA ILE 19 57.712 3.150 3.150
131 HB ILE 19 HB ILE 19 54.795 3.777 3.777
132 1HG1 ILE 19 HG12 ILE 19 56.694 1.848 1.848
133 2HG1 ILE 19 HG11 ILE 19 55.668 1.407 1.407
134 1HG2 ILE 19 HG22 ILE 19 57.164 4.700 4.700
135 2HG2 ILE 19 HG21 ILE 19 55.923 3.914 3.914
136 3HG2 ILE 19 HG23 ILE 19 55.514 5.325 5.325
137 HD1 ILE 19 HD1 ILE 19 54.027 0.975 0.975
138 HD1 ILE 19 HD1 ILE 19 54.966 1.671 1.671
139 HD1 ILE 19 HD1 ILE 19 53.954 2.709 2.709
140 H ALA 20 HN ALA 20 55.667 5.348 5.348
141 HA ALA 20 HA ALA 20 56.815 7.790 7.790
142 1HB ALA 20 HB2 ALA 20 54.540 7.104 7.104
143 2HB ALA 20 HB1 ALA 20 55.493 7.802 7.802
144 3HB ALA 20 HB3 ALA 20 55.133 8.760 8.760
145 H GLU 21 HN GLU 21 57.853 5.479 5.479
146 HA GLU 21 HA GLU 21 59.403 7.354 7.354
147 1HB GLU 21 HB2 GLU 21 58.454 5.443 5.443
148 2HB GLU 21 HB1 GLU 21 59.040 4.356 4.356
149 1HG GLU 21 HG2 GLU 21 60.484 4.108 4.108
150 2HG GLU 21 HG1 GLU 21 61.389 4.957 4.957
151 H PHE 22 HN PHE 22 60.118 4.721 4.721
152 HA PHE 22 HA PHE 22 62.950 4.964 4.964
153 1HB PHE 22 HB2 PHE 22 60.854 4.044 4.044
154 2HB PHE 22 HB1 PHE 22 62.563 4.005 4.005
155 HD1 PHE 22 HD2 PHE 22 61.817 3.617 3.617
156 HD2 PHE 22 HD1 PHE 22 62.272 1.492 1.492
157 HE1 PHE 22 HE2 PHE 22 62.088 1.492 1.492
158 HE2 PHE 22 HE1 PHE 22 62.542 -0.632 -0.632
159 HZ PHE 22 HZ PHE 22 62.450 -0.632 -0.632
160 H LYS 23 HN LYS 23 60.468 6.739 6.739
161 HA LYS 23 HA LYS 23 61.906 8.051 8.051
162 1HB LYS 23 HB2 LYS 23 59.439 8.235 8.235
163 2HB LYS 23 HB1 LYS 23 60.130 9.689 9.689
164 1HG LYS 23 HG2 LYS 23 59.123 10.265 10.265
165 2HG LYS 23 HG1 LYS 23 60.876 10.411 10.411
166 1HD LYS 23 HD2 LYS 23 61.075 8.423 8.423
167 2HD LYS 23 HD1 LYS 23 59.492 7.836 7.836
168 1HE LYS 23 HE2 LYS 23 58.351 9.165 9.165
169 2HE LYS 23 HE1 LYS 23 59.626 10.399 10.399
170 1HZ LYS 23 HZ1 LYS 23 61.081 8.554 8.554
171 2HZ LYS 23 HZ3 LYS 23 59.638 7.718 7.718
172 3HZ LYS 23 HZ2 LYS 23 59.919 9.225 9.225
173 H ALA 24 HN ALA 24 61.368 9.641 9.641
174 HA ALA 24 HA ALA 24 63.312 11.633 11.633
175 1HB ALA 24 HB1 ALA 24 61.526 10.957 10.957
176 2HB ALA 24 HB3 ALA 24 62.887 10.122 10.122
177 3HB ALA 24 HB2 ALA 24 62.957 11.865 11.865
178 H ALA 25 HN ALA 25 63.749 8.236 8.236
179 HA ALA 25 HA ALA 25 66.469 8.417 8.417
180 1HB ALA 25 HB3 ALA 25 64.479 6.390 6.390
181 2HB ALA 25 HB2 ALA 25 66.147 5.889 5.889
182 3HB ALA 25 HB1 ALA 25 65.633 6.372 6.372
183 H PHE 26 HN PHE 26 65.097 7.538 7.538
184 HA PHE 26 HA PHE 26 67.654 7.253 7.253
185 1HB PHE 26 HB2 PHE 26 65.486 6.275 6.275
186 2HB PHE 26 HB1 PHE 26 64.905 7.898 7.898
187 HD1 PHE 26 HD2 PHE 26 65.818 9.172 9.172
188 HD2 PHE 26 HD1 PHE 26 67.217 5.210 5.210
189 HE1 PHE 26 HE2 PHE 26 66.923 9.061 9.061
190 HE2 PHE 26 HE1 PHE 26 68.322 5.100 5.100
191 HZ PHE 26 HZ PHE 26 68.176 7.026 7.026
192 H ASP 27 HN ASP 27 65.306 9.943 9.943
193 HA ASP 27 HA ASP 27 66.678 11.748 11.748
194 1HB ASP 27 HB2 ASP 27 64.318 11.681 11.681
195 2HB ASP 27 HB1 ASP 27 65.206 12.776 12.776
196 H MET 28 HN MET 28 67.548 10.576 10.576
197 HA MET 28 HA MET 28 68.811 12.794 12.794
198 1HB MET 28 HB2 MET 28 69.403 9.823 9.823
199 2HB MET 28 HB1 MET 28 70.247 10.931 10.931
200 1HG MET 28 HG2 MET 28 67.638 11.631 11.631
201 2HG MET 28 HG1 MET 28 67.487 9.900 9.900
202 1HE MET 28 HE3 MET 28 69.185 12.699 12.699
203 2HE MET 28 HE2 MET 28 67.873 12.364 12.364
204 3HE MET 28 HE1 MET 28 69.544 12.133 12.133
205 H PHE 29 HN PHE 29 69.787 10.874 10.874
206 HA PHE 29 HA PHE 29 72.360 12.420 12.420
207 1HB PHE 29 HB2 PHE 29 71.950 9.748 9.748
208 2HB PHE 29 HB1 PHE 29 73.441 10.466 10.466
209 HD1 PHE 29 HD1 PHE 29 73.979 10.430 10.430
210 HD2 PHE 29 HD2 PHE 29 70.400 8.605 8.605
211 HE1 PHE 29 HE1 PHE 29 73.676 9.231 9.231
212 HE2 PHE 29 HE2 PHE 29 70.098 7.406 7.406
213 HZ PHE 29 HZ PHE 29 71.736 7.718 7.718
214 H ASP 30 HN ASP 30 69.360 12.052 12.052
215 HA ASP 30 HA ASP 30 70.300 12.459 12.459
216 1HB ASP 30 HB2 ASP 30 68.317 10.980 10.980
217 2HB ASP 30 HB1 ASP 30 67.430 12.496 12.496
218 H ALA 31 HN ALA 31 70.466 14.506 14.506
219 HA ALA 31 HA ALA 31 68.605 16.620 16.620
220 1HB ALA 31 HB2 ALA 31 70.294 16.282 16.282
221 2HB ALA 31 HB1 ALA 31 71.539 16.828 16.828
222 3HB ALA 31 HB3 ALA 31 70.243 17.923 17.923
223 H ASP 32 HN ASP 32 71.211 15.485 15.485
224 HA ASP 32 HA ASP 32 70.882 17.886 17.886
225 1HB ASP 32 HB2 ASP 32 73.024 17.676 17.676
226 2HB ASP 32 HB1 ASP 32 73.446 16.327 16.327
227 H GLY 33 HN GLY 33 70.252 14.688 14.688
228 1HA GLY 33 HA2 GLY 33 71.208 13.868 13.868
229 2HA GLY 33 HA1 GLY 33 70.311 12.858 12.858
230 H GLY 34 HN GLY 34 68.088 14.453 14.453
231 1HA GLY 34 HA2 GLY 34 66.179 15.457 15.457
232 2HA GLY 34 HA1 GLY 34 66.925 15.164 15.164
233 H GLY 35 HN GLY 35 66.825 12.601 12.601
234 1HA GLY 35 HA2 GLY 35 64.676 11.159 11.159
235 2HA GLY 35 HA1 GLY 35 64.844 11.193 11.193
236 H ASP 36 HN ASP 36 67.936 11.212 11.212
237 HA ASP 36 HA ASP 36 68.224 8.365 8.365
238 1HB ASP 36 HB2 ASP 36 69.555 7.966 7.966
239 2HB ASP 36 HB1 ASP 36 67.830 8.221 8.221
240 H ILE 37 HN ILE 37 70.255 7.989 7.989
241 HA ILE 37 HA ILE 37 72.046 10.375 10.375
242 HB ILE 37 HB ILE 37 72.734 9.356 9.356
243 1HG1 ILE 37 HG12 ILE 37 71.062 6.987 6.987
244 2HG1 ILE 37 HG11 ILE 37 72.819 7.020 7.020
245 1HG2 ILE 37 HG23 ILE 37 70.382 10.460 10.460
246 2HG2 ILE 37 HG22 ILE 37 69.775 8.818 8.818
247 3HG2 ILE 37 HG21 ILE 37 70.724 9.578 9.578
248 HD1 ILE 37 HD1 ILE 37 71.345 7.861 7.861
249 HD1 ILE 37 HD1 ILE 37 72.767 6.829 6.829
250 HD1 ILE 37 HD1 ILE 37 71.159 6.164 6.164
251 H SER 38 HN SER 38 74.446 9.737 9.737
252 HA SER 38 HA SER 38 75.408 8.475 8.475
253 1HB SER 38 HB2 SER 38 77.471 8.219 8.219
254 2HB SER 38 HB1 SER 38 77.001 9.766 9.766
255 HG SER 38 HG SER 38 76.436 10.387 10.387
256 H THR 39 HN THR 39 75.629 6.343 6.343
257 HA THR 39 HA THR 39 74.497 4.164 4.164
258 HB THR 39 HB THR 39 76.204 2.847 2.847
259 HG1 THR 39 HG1 THR 39 77.783 4.674 4.674
260 1HG2 THR 39 HG21 THR 39 74.795 5.212 5.212
261 2HG2 THR 39 HG23 THR 39 75.678 4.049 4.049
262 3HG2 THR 39 HG22 THR 39 74.307 3.518 3.518
263 H LYS 40 HN LYS 40 77.537 5.732 5.732
264 HA LYS 40 HA LYS 40 78.588 3.602 3.602
265 1HB LYS 40 HB2 LYS 40 79.106 6.501 6.501
266 2HB LYS 40 HB1 LYS 40 79.846 5.780 5.780
267 1HG LYS 40 HG2 LYS 40 81.066 4.213 4.213
268 2HG LYS 40 HG1 LYS 40 80.042 4.436 4.436
269 1HD LYS 40 HD2 LYS 40 81.649 6.733 6.733
270 2HD LYS 40 HD1 LYS 40 82.389 5.560 5.560
271 1HE LYS 40 HE2 LYS 40 81.202 6.309 6.309
272 2HE LYS 40 HE1 LYS 40 79.747 6.633 6.633
273 1HZ LYS 40 HZ3 LYS 40 82.260 8.219 8.219
274 2HZ LYS 40 HZ2 LYS 40 80.841 8.694 8.694
275 3HZ LYS 40 HZ1 LYS 40 80.847 8.529 8.529
276 H GLU 41 HN GLU 41 76.122 5.979 5.979
277 HA GLU 41 HA GLU 41 76.288 5.800 5.800
278 1HB GLU 41 HB2 GLU 41 76.026 7.971 7.971
279 2HB GLU 41 HB1 GLU 41 74.436 7.404 7.404
280 1HG GLU 41 HG2 GLU 41 74.030 8.737 8.737
281 2HG GLU 41 HG1 GLU 41 73.921 7.066 7.066
282 H LEU 42 HN LEU 42 74.562 4.481 4.481
283 HA LEU 42 HA LEU 42 71.997 3.947 3.947
284 1HB LEU 42 HB2 LEU 42 72.566 3.348 3.348
285 2HB LEU 42 HB1 LEU 42 73.959 2.402 2.402
286 HG LEU 42 HG LEU 42 71.401 1.500 1.500
287 HD1 LEU 42 HD1 LEU 42 71.548 0.406 0.406
288 HD1 LEU 42 HD1 LEU 42 71.450 2.164 2.164
289 HD1 LEU 42 HD1 LEU 42 70.208 1.262 1.262
290 HD2 LEU 42 HD2 LEU 42 73.865 0.469 0.469
291 HD2 LEU 42 HD2 LEU 42 73.228 -0.186 -0.186
292 HD2 LEU 42 HD2 LEU 42 72.436 -0.564 -0.564
293 H GLY 43 HN GLY 43 75.066 2.487 2.487
294 1HA GLY 43 HA2 GLY 43 73.820 0.298 0.298
295 2HA GLY 43 HA1 GLY 43 75.530 0.729 0.729
296 H THR 44 HN THR 44 74.623 3.606 3.606
297 HA THR 44 HA THR 44 74.817 3.415 3.415
298 HB THR 44 HB THR 44 74.495 5.564 5.564
299 HG1 THR 44 HG1 THR 44 76.479 6.198 6.198
300 1HG2 THR 44 HG21 THR 44 74.194 5.866 5.866
301 2HG2 THR 44 HG23 THR 44 74.711 7.202 7.202
302 3HG2 THR 44 HG22 THR 44 73.126 6.464 6.464
303 H VAL 45 HN VAL 45 72.255 4.740 4.740
304 HA VAL 45 HA VAL 45 70.268 5.303 5.303
305 HB VAL 45 HB VAL 45 70.137 3.986 3.986
306 1HG1 VAL 45 HG11 VAL 45 67.968 5.001 5.001
307 2HG1 VAL 45 HG13 VAL 45 67.765 5.079 5.079
308 3HG1 VAL 45 HG12 VAL 45 68.002 3.521 3.521
309 1HG2 VAL 45 HG22 VAL 45 71.164 6.309 6.309
310 2HG2 VAL 45 HG21 VAL 45 69.829 6.209 6.209
311 3HG2 VAL 45 HG23 VAL 45 69.553 6.846 6.846
312 H MET 46 HN MET 46 70.185 2.193 2.193
313 HA MET 46 HA MET 46 68.448 0.807 0.807
314 1HB MET 46 HB2 MET 46 69.539 -1.202 -1.202
315 2HB MET 46 HB1 MET 46 69.308 0.042 0.042
316 1HG MET 46 HG2 MET 46 71.657 0.805 0.805
317 2HG MET 46 HG1 MET 46 71.869 -0.554 -0.554
318 1HE MET 46 HE3 MET 46 70.613 -2.791 -2.791
319 2HE MET 46 HE2 MET 46 69.574 -2.356 -2.356
320 3HE MET 46 HE1 MET 46 70.871 -3.525 -3.525
321 H ARG 47 HN ARG 47 71.811 1.636 1.636
322 HA ARG 47 HA ARG 47 72.209 -0.246 -0.246
323 1HB ARG 47 HB2 ARG 47 73.695 1.865 1.865
324 2HB ARG 47 HB1 ARG 47 74.221 1.561 1.561
325 1HG ARG 47 HG2 ARG 47 74.336 -0.888 -0.888
326 2HG ARG 47 HG1 ARG 47 74.010 -0.466 -0.466
327 1HD ARG 47 HD2 ARG 47 76.120 0.377 0.377
328 2HD ARG 47 HD1 ARG 47 76.215 1.045 1.045
329 HE ARG 47 HE ARG 47 76.188 -1.673 -1.673
330 1HH1 ARG 47 HH1 ARG 47 78.572 0.434 0.434
331 2HH1 ARG 47 HH1 ARG 47 79.755 -0.532 -0.532
332 1HH2 ARG 47 HH2 ARG 47 77.476 -2.939 -2.939
333 2HH2 ARG 47 HH2 ARG 47 79.135 -2.443 -2.443
334 H MET 48 HN MET 48 71.797 3.295 3.295
335 HA MET 48 HA MET 48 71.749 3.773 3.773
336 1HB MET 48 HB2 MET 48 71.987 5.223 5.223
337 2HB MET 48 HB1 MET 48 70.419 5.728 5.728
338 1HG MET 48 HG2 MET 48 72.243 5.604 5.604
339 2HG MET 48 HG1 MET 48 73.015 6.518 6.518
340 1HE MET 48 HE3 MET 48 72.687 7.490 7.490
341 2HE MET 48 HE2 MET 48 71.837 9.032 9.032
342 3HE MET 48 HE1 MET 48 71.055 7.595 7.595
343 H LEU 49 HN LEU 49 69.536 2.255 2.255
344 HA LEU 49 HA LEU 49 67.096 3.384 3.384
345 1HB LEU 49 HB2 LEU 49 67.893 1.670 1.670
346 2HB LEU 49 HB1 LEU 49 66.420 1.124 1.124
347 HG LEU 49 HG LEU 49 66.482 4.026 4.026
348 HD1 LEU 49 HD1 LEU 49 67.656 2.703 2.703
349 HD1 LEU 49 HD1 LEU 49 66.761 4.214 4.214
350 HD1 LEU 49 HD1 LEU 49 65.960 2.676 2.676
351 HD2 LEU 49 HD2 LEU 49 64.434 2.409 2.409
352 HD2 LEU 49 HD2 LEU 49 64.242 3.676 3.676
353 HD2 LEU 49 HD2 LEU 49 64.611 2.024 2.024
354 H GLY 50 HN GLY 50 69.097 0.461 0.461
355 1HA GLY 50 HA2 GLY 50 68.980 -0.401 -0.401
356 2HA GLY 50 HA1 GLY 50 67.262 -0.581 -0.581
357 H GLN 51 HN GLN 51 69.850 -1.230 -1.230
358 HA GLN 51 HA GLN 51 69.196 -4.152 -4.152
359 1HB GLN 51 HB2 GLN 51 69.805 -2.678 -2.678
360 2HB GLN 51 HB1 GLN 51 69.029 -4.251 -4.251
361 1HG GLN 51 HG2 GLN 51 67.880 -1.532 -1.532
362 2HG GLN 51 HG1 GLN 51 67.283 -2.686 -2.686
363 1HE2 GLN 51 HE22 GLN 51 66.297 -4.971 -4.971
364 2HE2 GLN 51 HE21 GLN 51 67.388 -5.089 -5.089
365 H ASN 52 HN ASN 52 71.036 -4.929 -4.929
366 HA ASN 52 HA ASN 52 73.681 -3.826 -3.826
367 1HB ASN 52 HB2 ASN 52 72.590 -5.690 -5.690
368 2HB ASN 52 HB1 ASN 52 73.466 -6.725 -6.725
369 HD2 ASN 52 HD2 ASN 52 75.839 -6.026 -6.026
370 HD2 ASN 52 HD2 ASN 52 76.692 -5.390 -5.390
371 HA PRO 53 HA PRO 53 73.353 -5.731 -5.731
372 1HB PRO 53 HB2 PRO 53 74.538 -3.649 -3.649
373 2HB PRO 53 HB1 PRO 53 72.801 -3.695 -3.695
374 1HG PRO 53 HG2 PRO 53 74.983 -2.216 -2.216
375 2HG PRO 53 HG1 PRO 53 73.311 -1.732 -1.732
376 1HD PRO 53 HD2 PRO 53 74.228 -2.640 -2.640
377 2HD PRO 53 HD1 PRO 53 72.534 -2.740 -2.740
378 H THR 54 HN THR 54 74.968 -7.298 -7.298
379 HA THR 54 HA THR 54 77.652 -6.869 -6.869
380 HB THR 54 HB THR 54 77.816 -9.068 -9.068
381 HG1 THR 54 HG1 THR 54 75.603 -9.955 -9.955
382 1HG2 THR 54 HG21 THR 54 76.983 -8.475 -8.475
383 2HG2 THR 54 HG23 THR 54 76.268 -9.974 -9.974
384 3HG2 THR 54 HG22 THR 54 78.020 -9.770 -9.770
385 H LYS 55 HN LYS 55 79.541 -6.386 -6.386
386 HA LYS 55 HA LYS 55 79.554 -4.700 -4.700
387 1HB LYS 55 HB2 LYS 55 81.472 -5.305 -5.305
388 2HB LYS 55 HB1 LYS 55 81.569 -6.872 -6.872
389 1HG LYS 55 HG2 LYS 55 81.507 -4.867 -4.867
390 2HG LYS 55 HG1 LYS 55 82.715 -4.386 -4.386
391 1HD LYS 55 HD2 LYS 55 83.985 -6.328 -6.328
392 2HD LYS 55 HD1 LYS 55 82.624 -7.229 -7.229
393 1HE LYS 55 HE2 LYS 55 82.984 -6.437 -6.437
394 2HE LYS 55 HE1 LYS 55 83.417 -4.816 -4.816
395 1HZ LYS 55 HZ1 LYS 55 85.145 -7.161 -7.161
396 2HZ LYS 55 HZ3 LYS 55 85.295 -6.253 -6.253
397 3HZ LYS 55 HZ2 LYS 55 85.550 -5.513 -5.513
398 H GLU 56 HN GLU 56 80.056 -8.252 -8.252
399 HA GLU 56 HA GLU 56 80.196 -8.565 -8.565
400 1HB GLU 56 HB2 GLU 56 80.605 -10.407 -10.407
401 2HB GLU 56 HB1 GLU 56 79.033 -10.236 -10.236
402 1HG GLU 56 HG2 GLU 56 77.877 -11.136 -11.136
403 2HG GLU 56 HG1 GLU 56 79.207 -10.815 -10.815
404 H GLU 57 HN GLU 57 77.248 -8.601 -8.601
405 HA GLU 57 HA GLU 57 75.411 -8.868 -8.868
406 1HB GLU 57 HB2 GLU 57 75.141 -7.840 -7.840
407 2HB GLU 57 HB1 GLU 57 73.773 -8.191 -8.191
408 1HG GLU 57 HG2 GLU 57 75.876 -10.291 -10.291
409 2HG GLU 57 HG1 GLU 57 74.633 -10.040 -10.040
410 H LEU 58 HN LEU 58 76.229 -6.038 -6.038
411 HA LEU 58 HA LEU 58 74.742 -4.073 -4.073
412 1HB LEU 58 HB2 LEU 58 75.794 -3.498 -3.498
413 2HB LEU 58 HB1 LEU 58 77.353 -4.139 -4.139
414 HG LEU 58 HG LEU 58 77.582 -2.314 -2.314
415 HD1 LEU 58 HD1 LEU 58 75.612 -0.479 -0.479
416 HD1 LEU 58 HD1 LEU 58 74.754 -2.009 -2.009
417 HD1 LEU 58 HD1 LEU 58 75.685 -1.350 -1.350
418 HD2 LEU 58 HD2 LEU 58 77.495 -0.376 -0.376
419 HD2 LEU 58 HD2 LEU 58 78.562 -1.743 -1.743
420 HD2 LEU 58 HD2 LEU 58 77.000 -1.633 -1.633
421 H ASP 59 HN ASP 59 77.973 -5.356 -5.356
422 HA ASP 59 HA ASP 59 78.593 -3.555 -3.555
423 1HB ASP 59 HB2 ASP 59 80.163 -5.084 -5.084
424 2HB ASP 59 HB1 ASP 59 79.368 -6.461 -6.461
425 H ALA 60 HN ALA 60 76.928 -6.712 -6.712
426 HA ALA 60 HA ALA 60 76.605 -6.993 -6.993
427 1HB ALA 60 HB1 ALA 60 75.044 -7.969 -7.969
428 2HB ALA 60 HB3 ALA 60 74.739 -8.537 -8.537
429 3HB ALA 60 HB2 ALA 60 76.300 -8.839 -8.839
430 H ILE 61 HN ILE 61 74.961 -5.024 -5.024
431 HA ILE 61 HA ILE 61 72.549 -4.570 -4.570
432 HB ILE 61 HB ILE 61 73.790 -3.038 -3.038
433 1HG1 ILE 61 HG12 ILE 61 73.387 -5.487 -5.487
434 2HG1 ILE 61 HG11 ILE 61 72.411 -4.426 -4.426
435 1HG2 ILE 61 HG23 ILE 61 71.559 -2.457 -2.457
436 2HG2 ILE 61 HG22 ILE 61 70.903 -3.084 -3.084
437 3HG2 ILE 61 HG21 ILE 61 71.987 -1.694 -1.694
438 HD1 ILE 61 HD1 ILE 61 70.883 -6.056 -6.056
439 HD1 ILE 61 HD1 ILE 61 71.548 -6.000 -6.000
440 HD1 ILE 61 HD1 ILE 61 70.598 -4.647 -4.647
441 H ILE 62 HN ILE 62 75.224 -2.366 -2.366
442 HA ILE 62 HA ILE 62 74.638 -0.206 -0.206
443 HB ILE 62 HB ILE 62 77.249 -1.471 -1.471
444 1HG1 ILE 62 HG12 ILE 62 76.253 1.169 1.169
445 2HG1 ILE 62 HG11 ILE 62 75.374 -0.260 -0.260
446 1HG2 ILE 62 HG22 ILE 62 76.769 0.673 0.673
447 2HG2 ILE 62 HG21 ILE 62 77.713 1.232 1.232
448 3HG2 ILE 62 HG23 ILE 62 78.281 -0.132 -0.132
449 HD1 ILE 62 HD1 ILE 62 77.674 -1.240 -1.240
450 HD1 ILE 62 HD1 ILE 62 77.068 0.058 0.058
451 HD1 ILE 62 HD1 ILE 62 78.292 0.400 0.400
452 H GLU 63 HN GLU 63 77.045 -2.728 -2.728
453 HA GLU 63 HA GLU 63 77.357 -2.105 -2.105
454 1HB GLU 63 HB2 GLU 63 78.350 -3.937 -3.937
455 2HB GLU 63 HB1 GLU 63 77.148 -4.965 -4.965
456 1HG GLU 63 HG2 GLU 63 78.611 -3.339 -3.339
457 2HG GLU 63 HG1 GLU 63 79.686 -4.374 -4.374
458 H GLU 64 HN GLU 64 74.753 -3.899 -3.899
459 HA GLU 64 HA GLU 64 73.464 -4.806 -4.806
460 1HB GLU 64 HB2 GLU 64 72.935 -6.021 -6.021
461 2HB GLU 64 HB1 GLU 64 72.838 -4.574 -4.574
462 1HG GLU 64 HG2 GLU 64 70.669 -4.108 -4.108
463 2HG GLU 64 HG1 GLU 64 70.862 -4.853 -4.853
464 H VAL 65 HN VAL 65 72.512 -2.292 -2.292
465 HA VAL 65 HA VAL 65 70.549 -1.099 -1.099
466 HB VAL 65 HB VAL 65 70.412 0.547 0.547
467 1HG1 VAL 65 HG13 VAL 65 70.622 -2.357 -2.357
468 2HG1 VAL 65 HG12 VAL 65 70.624 -1.297 -1.297
469 3HG1 VAL 65 HG11 VAL 65 69.276 -1.251 -1.251
470 1HG2 VAL 65 HG23 VAL 65 73.167 -0.472 -0.472
471 2HG2 VAL 65 HG22 VAL 65 72.533 1.169 1.169
472 3HG2 VAL 65 HG21 VAL 65 72.194 -0.009 -0.009
473 H ASP 66 HN ASP 66 73.931 -0.996 -0.996
474 HA ASP 66 HA ASP 66 74.224 1.786 1.786
475 1HB ASP 66 HB2 ASP 66 75.926 0.687 0.687
476 2HB ASP 66 HB1 ASP 66 76.105 -0.591 -0.591
477 H GLU 67 HN GLU 67 72.909 -0.805 -0.805
478 HA GLU 67 HA GLU 67 74.133 -1.399 -1.399
479 1HB GLU 67 HB2 GLU 67 71.991 -2.302 -2.302
480 2HB GLU 67 HB1 GLU 67 71.260 -0.698 -0.698
481 1HG GLU 67 HG2 GLU 67 71.703 -0.439 -0.439
482 2HG GLU 67 HG1 GLU 67 72.317 -2.092 -2.092
483 H ASP 68 HN ASP 68 72.363 1.614 1.614
484 HA ASP 68 HA ASP 68 72.561 2.775 2.775
485 1HB ASP 68 HB2 ASP 68 72.407 4.029 4.029
486 2HB ASP 68 HB1 ASP 68 72.029 4.852 4.852
487 H GLY 69 HN GLY 69 74.706 2.864 2.864
488 1HA GLY 69 HA2 GLY 69 77.070 3.185 3.185
489 2HA GLY 69 HA1 GLY 69 76.938 3.680 3.680
490 H SER 70 HN SER 70 74.966 5.677 5.677
491 HA SER 70 HA SER 70 76.566 7.799 7.799
492 1HB SER 70 HB2 SER 70 75.589 7.668 7.668
493 2HB SER 70 HB1 SER 70 74.131 8.270 8.270
494 HG SER 70 HG SER 70 75.812 9.807 9.807
495 H GLY 71 HN GLY 71 73.279 6.432 6.432
496 1HA GLY 71 HA2 GLY 71 72.388 8.250 8.250
497 2HA GLY 71 HA1 GLY 71 71.397 7.030 7.030
498 H THR 72 HN THR 72 72.201 7.659 7.659
499 HA THR 72 HA THR 72 73.552 5.205 5.205
500 HB THR 72 HB THR 72 73.873 7.313 7.313
501 HG1 THR 72 HG1 THR 72 72.741 6.573 6.573
502 1HG2 THR 72 HG22 THR 72 70.888 7.315 7.315
503 2HG2 THR 72 HG21 THR 72 71.686 8.076 8.076
504 3HG2 THR 72 HG23 THR 72 72.015 8.645 8.645
505 H ILE 73 HN ILE 73 71.353 5.488 5.488
506 HA ILE 73 HA ILE 73 69.550 3.437 3.437
507 HB ILE 73 HB ILE 73 70.957 2.721 2.721
508 1HG1 ILE 73 HG12 ILE 73 68.730 2.603 2.603
509 2HG1 ILE 73 HG11 ILE 73 68.034 2.778 2.778
510 1HG2 ILE 73 HG22 ILE 73 70.387 5.342 5.342
511 2HG2 ILE 73 HG21 ILE 73 69.716 4.216 4.216
512 3HG2 ILE 73 HG23 ILE 73 71.424 4.130 4.130
513 HD1 ILE 73 HD1 ILE 73 68.687 0.702 0.702
514 HD1 ILE 73 HD1 ILE 73 68.918 0.401 0.401
515 HD1 ILE 73 HD1 ILE 73 70.285 0.895 0.895
516 H ASP 74 HN ASP 74 67.363 3.867 3.867
517 HA ASP 74 HA ASP 74 66.433 6.535 6.535
518 1HB ASP 74 HB2 ASP 74 65.229 4.251 4.251
519 2HB ASP 74 HB1 ASP 74 64.392 5.774 5.774
520 H PHE 75 HN PHE 75 64.712 6.803 6.803
521 HA PHE 75 HA PHE 75 64.605 5.118 5.118
522 1HB PHE 75 HB2 PHE 75 63.776 7.513 7.513
523 2HB PHE 75 HB1 PHE 75 62.312 6.798 6.798
524 HD1 PHE 75 HD2 PHE 75 60.956 5.194 5.194
525 HD2 PHE 75 HD1 PHE 75 64.125 7.605 7.605
526 HE1 PHE 75 HE2 PHE 75 60.075 4.824 4.824
527 HE2 PHE 75 HE1 PHE 75 63.246 7.234 7.234
528 HZ PHE 75 HZ PHE 75 61.221 5.843 5.843
529 H GLU 76 HN GLU 76 62.158 5.307 5.307
530 HA GLU 76 HA GLU 76 60.485 3.211 3.211
531 1HB GLU 76 HB2 GLU 76 59.962 3.058 3.058
532 2HB GLU 76 HB1 GLU 76 59.918 4.695 4.695
533 1HG GLU 76 HG2 GLU 76 62.505 4.619 4.619
534 2HG GLU 76 HG1 GLU 76 61.872 3.455 3.455
535 H GLU 77 HN GLU 77 63.324 2.970 2.970
536 HA GLU 77 HA GLU 77 63.189 0.064 0.064
537 1HB GLU 77 HB2 GLU 77 64.107 1.424 1.424
538 2HB GLU 77 HB1 GLU 77 65.306 2.118 2.118
539 1HG GLU 77 HG2 GLU 77 66.315 -0.095 -0.095
540 2HG GLU 77 HG1 GLU 77 65.098 -0.820 -0.820
541 H PHE 78 HN PHE 78 64.604 2.404 2.404
542 HA PHE 78 HA PHE 78 66.665 0.689 0.689
543 1HB PHE 78 HB2 PHE 78 66.938 3.040 3.040
544 2HB PHE 78 HB1 PHE 78 65.281 3.268 3.268
545 HD1 PHE 78 HD1 PHE 78 68.373 1.375 1.375
546 HD2 PHE 78 HD2 PHE 78 64.941 3.615 3.615
547 HE1 PHE 78 HE1 PHE 78 69.131 1.185 1.185
548 HE2 PHE 78 HE2 PHE 78 65.700 3.427 3.427
549 HZ PHE 78 HZ PHE 78 67.794 2.211 2.211
550 H LEU 79 HN LEU 79 63.248 1.230 1.230
551 HA LEU 79 HA LEU 79 62.794 0.403 0.403
552 1HB LEU 79 HB2 LEU 79 61.456 0.120 0.120
553 2HB LEU 79 HB1 LEU 79 60.885 -0.993 -0.993
554 HG LEU 79 HG LEU 79 59.573 1.066 1.066
555 HD1 LEU 79 HD1 LEU 79 61.446 1.300 1.300
556 HD1 LEU 79 HD1 LEU 79 60.507 -0.177 -0.177
557 HD1 LEU 79 HD1 LEU 79 59.684 1.372 1.372
558 HD2 LEU 79 HD2 LEU 79 60.855 3.179 3.179
559 HD2 LEU 79 HD2 LEU 79 61.023 2.688 2.688
560 HD2 LEU 79 HD2 LEU 79 62.309 2.337 2.337
561 H VAL 80 HN VAL 80 63.796 -1.640 -1.640
562 HA VAL 80 HA VAL 80 63.421 -4.199 -4.199
563 HB VAL 80 HB VAL 80 64.977 -4.916 -4.916
564 1HG1 VAL 80 HG11 VAL 80 62.913 -2.921 -2.921
565 2HG1 VAL 80 HG13 VAL 80 64.151 -2.916 -2.916
566 3HG1 VAL 80 HG12 VAL 80 63.278 -4.402 -4.402
567 1HG2 VAL 80 HG23 VAL 80 65.846 -2.012 -2.012
568 2HG2 VAL 80 HG22 VAL 80 66.824 -3.415 -3.415
569 3HG2 VAL 80 HG21 VAL 80 66.314 -3.169 -3.169
570 H MET 81 HN MET 81 66.207 -1.966 -1.966
571 HA MET 81 HA MET 81 67.928 -3.666 -3.666
572 1HB MET 81 HB2 MET 81 67.715 -0.857 -0.857
573 2HB MET 81 HB1 MET 81 68.612 -1.070 -1.070
574 1HG MET 81 HG2 MET 81 69.177 -2.843 -2.843
575 2HG MET 81 HG1 MET 81 69.906 -1.241 -1.241
576 1HE MET 81 HE3 MET 81 69.804 -4.647 -4.647
577 2HE MET 81 HE2 MET 81 71.091 -5.067 -5.067
578 3HE MET 81 HE1 MET 81 69.499 -4.632 -4.632
579 H MET 82 HN MET 82 65.140 -1.771 -1.771
580 HA MET 82 HA MET 82 65.789 -1.561 -1.561
581 1HB MET 82 HB2 MET 82 63.258 -1.050 -1.050
582 2HB MET 82 HB1 MET 82 63.538 -0.531 -0.531
583 1HG MET 82 HG2 MET 82 65.655 0.255 0.255
584 2HG MET 82 HG1 MET 82 64.086 1.002 1.002
585 1HE MET 82 HE1 MET 82 66.828 0.126 0.126
586 2HE MET 82 HE3 MET 82 67.232 1.605 1.605
587 3HE MET 82 HE2 MET 82 66.235 0.367 0.367
588 H VAL 83 HN VAL 83 63.460 -3.391 -3.391
589 HA VAL 83 HA VAL 83 62.524 -4.956 -4.956
590 HB VAL 83 HB VAL 83 60.989 -5.855 -5.855
591 1HG1 VAL 83 HG11 VAL 83 61.277 -3.154 -3.154
592 2HG1 VAL 83 HG13 VAL 83 61.358 -3.309 -3.309
593 3HG1 VAL 83 HG12 VAL 83 59.950 -3.913 -3.913
594 1HG2 VAL 83 HG21 VAL 83 62.940 -4.923 -4.923
595 2HG2 VAL 83 HG23 VAL 83 62.643 -6.597 -6.597
596 3HG2 VAL 83 HG22 VAL 83 61.370 -5.664 -5.664
597 H ARG 84 HN ARG 84 64.508 -5.548 -5.548
598 HA ARG 84 HA ARG 84 64.968 -8.318 -8.318
599 1HB ARG 84 HB2 ARG 84 66.760 -6.096 -6.096
600 2HB ARG 84 HB1 ARG 84 67.013 -7.814 -7.814
601 1HG ARG 84 HG2 ARG 84 64.333 -6.630 -6.630
602 2HG ARG 84 HG1 ARG 84 65.669 -6.312 -6.312
603 1HD ARG 84 HD2 ARG 84 65.363 -8.363 -8.363
604 2HD ARG 84 HD1 ARG 84 65.742 -9.095 -9.095
605 HE ARG 84 HE ARG 84 63.065 -8.035 -8.035
606 1HH1 ARG 84 HH1 ARG 84 64.816 -10.839 -10.839
607 2HH1 ARG 84 HH1 ARG 84 63.612 -11.877 -11.877
608 1HH2 ARG 84 HH2 ARG 84 61.579 -9.269 -9.269
609 2HH2 ARG 84 HH2 ARG 84 61.781 -10.987 -10.987
610 H GLN 85 HN GLN 85 66.624 -5.528 -5.528
611 HA GLN 85 HA GLN 85 68.619 -7.152 -7.152
612 1HB GLN 85 HB2 GLN 85 69.006 -4.818 -4.818
613 2HB GLN 85 HB1 GLN 85 67.624 -4.303 -4.303
614 1HG GLN 85 HG2 GLN 85 69.457 -3.887 -3.887
615 2HG GLN 85 HG1 GLN 85 68.865 -5.452 -5.452
616 1HE2 GLN 85 HE22 GLN 85 72.002 -6.928 -6.928
617 2HE2 GLN 85 HE21 GLN 85 70.597 -6.836 -6.836
618 H MET 86 HN MET 86 65.629 -5.454 -5.454
619 HA MET 86 HA MET 86 65.740 -6.394 -6.394
620 1HB MET 86 HB2 MET 86 64.091 -4.755 -4.755
621 2HB MET 86 HB1 MET 86 63.091 -5.769 -5.769
622 1HG MET 86 HG2 MET 86 64.667 -4.988 -4.988
623 2HG MET 86 HG1 MET 86 65.138 -3.707 -3.707
624 1HE MET 86 HE1 MET 86 63.559 -4.177 -4.177
625 2HE MET 86 HE3 MET 86 63.976 -2.486 -2.486
626 3HE MET 86 HE2 MET 86 62.319 -2.929 -2.929
627 H LYS 87 HN LYS 87 64.470 -7.672 -7.672
628 HA LYS 87 HA LYS 87 62.536 -9.511 -9.511
629 1HB LYS 87 HB2 LYS 87 64.544 -9.227 -9.227
630 2HB LYS 87 HB1 LYS 87 63.985 -10.882 -10.882
631 1HG LYS 87 HG2 LYS 87 61.716 -9.141 -9.141
632 2HG LYS 87 HG1 LYS 87 62.631 -8.761 -8.761
633 1HD LYS 87 HD2 LYS 87 62.447 -10.960 -10.960
634 2HD LYS 87 HD1 LYS 87 62.023 -11.619 -11.619
635 1HE LYS 87 HE2 LYS 87 59.940 -11.554 -11.554
636 2HE LYS 87 HE1 LYS 87 59.929 -10.038 -10.038
637 1HZ LYS 87 HZ3 LYS 87 61.256 -9.242 -9.242
638 2HZ LYS 87 HZ2 LYS 87 60.333 -10.467 -10.467
639 3HZ LYS 87 HZ1 LYS 87 59.563 -9.184 -9.184
640 H GLU 88 HN GLU 88 65.979 -9.526 -9.526
641 HA GLU 88 HA GLU 88 65.897 -12.301 -12.301
642 1HB GLU 88 HB2 GLU 88 67.768 -10.642 -10.642
643 2HB GLU 88 HB1 GLU 88 68.440 -10.980 -10.980
644 1HG GLU 88 HG2 GLU 88 69.174 -12.856 -12.856
645 2HG GLU 88 HG1 GLU 88 67.616 -13.447 -13.447
646 H ASP 89 HN ASP 89 66.512 -8.931 -8.931
647 HA ASP 89 HA ASP 89 67.158 -9.571 -9.571
648 1HB ASP 89 HB2 ASP 89 66.281 -7.002 -7.002
649 2HB ASP 89 HB1 ASP 89 67.055 -7.112 -7.112
650 H ALA 90 HN ALA 90 64.227 -8.801 -8.801
651 HA ALA 90 HA ALA 90 62.606 -8.391 -8.391
652 1HB ALA 90 HB1 ALA 90 62.247 -7.214 -7.214
653 2HB ALA 90 HB3 ALA 90 61.868 -8.762 -8.762
654 3HB ALA 90 HB2 ALA 90 60.816 -8.114 -8.114
Start of MODEL 12
1 1H ALA 1 HT1 ALA 1 63.590 -6.019 -6.019
2 2H ALA 1 HT3 ALA 1 64.247 -4.693 -4.693
3 3H ALA 1 HT2 ALA 1 65.081 -5.368 -5.368
4 HA ALA 1 HA ALA 1 65.580 -7.347 -7.347
5 1HB ALA 1 HB1 ALA 1 66.438 -4.766 -4.766
6 2HB ALA 1 HB3 ALA 1 66.102 -5.439 -5.439
7 3HB ALA 1 HB2 ALA 1 67.242 -6.247 -6.247
8 H SER 2 HN SER 2 65.650 -8.089 -8.089
9 HA SER 2 HA SER 2 62.844 -8.481 -8.481
10 1HB SER 2 HB2 SER 2 65.059 -10.028 -10.028
11 2HB SER 2 HB1 SER 2 65.136 -9.420 -9.420
12 HG SER 2 HG SER 2 63.877 -11.376 -11.376
13 H MET 3 HN MET 3 65.227 -6.176 -6.176
14 HA MET 3 HA MET 3 64.776 -5.735 -5.735
15 1HB MET 3 HB2 MET 3 66.185 -4.542 -4.542
16 2HB MET 3 HB1 MET 3 65.612 -3.342 -3.342
17 1HG MET 3 HG2 MET 3 66.665 -5.468 -5.468
18 2HG MET 3 HG1 MET 3 67.829 -5.174 -5.174
19 1HE MET 3 HE1 MET 3 67.992 -2.722 -2.722
20 2HE MET 3 HE3 MET 3 68.657 -1.493 -1.493
21 3HE MET 3 HE2 MET 3 69.495 -3.028 -3.028
22 H THR 4 HN THR 4 63.413 -4.276 -4.276
23 HA THR 4 HA THR 4 61.822 -2.263 -2.263
24 HB THR 4 HB THR 4 62.372 -2.679 -2.679
25 HG1 THR 4 HG1 THR 4 60.734 -1.217 -1.217
26 1HG2 THR 4 HG23 THR 4 61.240 -5.141 -5.141
27 2HG2 THR 4 HG22 THR 4 59.942 -4.293 -4.293
28 3HG2 THR 4 HG21 THR 4 61.524 -4.459 -4.459
29 H ASP 5 HN ASP 5 61.431 -5.718 -5.718
30 HA ASP 5 HA ASP 5 58.550 -5.687 -5.687
31 1HB ASP 5 HB2 ASP 5 60.708 -7.570 -7.570
32 2HB ASP 5 HB1 ASP 5 59.632 -8.170 -8.170
33 H GLN 6 HN GLN 6 61.476 -6.564 -6.564
34 HA GLN 6 HA GLN 6 60.290 -7.079 -7.079
35 1HB GLN 6 HB2 GLN 6 62.869 -6.469 -6.469
36 2HB GLN 6 HB1 GLN 6 62.692 -5.606 -5.606
37 1HG GLN 6 HG2 GLN 6 63.134 -7.530 -7.530
38 2HG GLN 6 HG1 GLN 6 61.623 -8.181 -8.181
39 1HE2 GLN 6 HE22 GLN 6 64.873 -8.885 -8.885
40 2HE2 GLN 6 HE21 GLN 6 64.604 -7.321 -7.321
41 H GLN 7 HN GLN 7 60.574 -4.044 -4.044
42 HA GLN 7 HA GLN 7 60.517 -2.179 -2.179
43 1HB GLN 7 HB2 GLN 7 60.018 -2.316 -2.316
44 2HB GLN 7 HB1 GLN 7 58.869 -1.221 -1.221
45 1HG GLN 7 HG2 GLN 7 60.790 -0.090 -0.090
46 2HG GLN 7 HG1 GLN 7 61.891 -1.116 -1.116
47 1HE2 GLN 7 HE22 GLN 7 59.919 1.936 1.936
48 2HE2 GLN 7 HE21 GLN 7 59.411 1.437 1.437
49 H ALA 8 HN ALA 8 57.613 -2.947 -2.947
50 HA ALA 8 HA ALA 8 55.669 -2.009 -2.009
51 1HB ALA 8 HB1 ALA 8 55.856 -4.143 -4.143
52 2HB ALA 8 HB3 ALA 8 54.394 -4.098 -4.098
53 3HB ALA 8 HB2 ALA 8 54.854 -2.691 -2.691
54 H GLU 9 HN GLU 9 57.410 -5.092 -5.092
55 HA GLU 9 HA GLU 9 55.745 -6.081 -6.081
56 1HB GLU 9 HB2 GLU 9 56.971 -7.322 -7.322
57 2HB GLU 9 HB1 GLU 9 58.348 -7.281 -7.281
58 1HG GLU 9 HG2 GLU 9 56.321 -8.091 -8.091
59 2HG GLU 9 HG1 GLU 9 55.878 -8.875 -8.875
60 H ALA 10 HN ALA 10 58.599 -4.176 -4.176
61 HA ALA 10 HA ALA 10 59.842 -4.894 -4.894
62 1HB ALA 10 HB1 ALA 10 60.279 -3.121 -3.121
63 2HB ALA 10 HB3 ALA 10 60.848 -2.447 -2.447
64 3HB ALA 10 HB2 ALA 10 61.455 -4.007 -4.007
65 H ARG 11 HN ARG 11 57.727 -2.280 -2.280
66 HA ARG 11 HA ARG 11 57.769 -0.852 -0.852
67 1HB ARG 11 HB2 ARG 11 55.739 -0.559 -0.559
68 2HB ARG 11 HB1 ARG 11 56.377 0.686 0.686
69 1HG ARG 11 HG2 ARG 11 57.902 1.190 1.190
70 2HG ARG 11 HG1 ARG 11 58.613 -0.408 -0.408
71 1HD ARG 11 HD2 ARG 11 58.078 -0.444 -0.444
72 2HD ARG 11 HD1 ARG 11 56.629 -1.184 -1.184
73 HE ARG 11 HE ARG 11 55.978 1.454 1.454
74 1HH1 ARG 11 HH2 ARG 11 58.195 1.311 1.311
75 2HH1 ARG 11 HH2 ARG 11 57.155 1.440 1.440
76 1HH2 ARG 11 HH1 ARG 11 54.253 0.835 0.835
77 2HH2 ARG 11 HH1 ARG 11 54.922 1.168 1.168
78 H ALA 12 HN ALA 12 55.327 -2.758 -2.758
79 HA ALA 12 HA ALA 12 53.213 -2.691 -2.691
80 1HB ALA 12 HB2 ALA 12 53.702 -3.850 -3.850
81 2HB ALA 12 HB1 ALA 12 53.902 -5.269 -5.269
82 3HB ALA 12 HB3 ALA 12 52.377 -4.383 -4.383
83 H PHE 13 HN PHE 13 56.222 -4.524 -4.524
84 HA PHE 13 HA PHE 13 55.628 -6.513 -6.513
85 1HB PHE 13 HB2 PHE 13 57.781 -6.342 -6.342
86 2HB PHE 13 HB1 PHE 13 58.041 -4.725 -4.725
87 HD1 PHE 13 HD1 PHE 13 57.978 -8.328 -8.328
88 HD2 PHE 13 HD2 PHE 13 58.643 -4.388 -4.388
89 HE1 PHE 13 HE1 PHE 13 59.024 -9.313 -9.313
90 HE2 PHE 13 HE2 PHE 13 59.687 -5.372 -5.372
91 HZ PHE 13 HZ PHE 13 59.878 -7.835 -7.835
92 H LEU 14 HN LEU 14 55.906 -3.043 -3.043
93 HA LEU 14 HA LEU 14 55.250 -3.429 -3.429
94 1HB LEU 14 HB2 LEU 14 56.644 -1.316 -1.316
95 2HB LEU 14 HB1 LEU 14 57.555 -2.746 -2.746
96 HG LEU 14 HG LEU 14 56.461 -1.136 -1.136
97 HD1 LEU 14 HD1 LEU 14 57.114 0.707 0.707
98 HD1 LEU 14 HD1 LEU 14 58.387 0.493 0.493
99 HD1 LEU 14 HD1 LEU 14 58.619 -0.097 -0.097
100 HD2 LEU 14 HD2 LEU 14 58.680 -1.643 -1.643
101 HD2 LEU 14 HD2 LEU 14 57.943 -3.108 -3.108
102 HD2 LEU 14 HD2 LEU 14 59.205 -2.279 -2.279
103 H SER 15 HN SER 15 53.478 -2.240 -2.240
104 HA SER 15 HA SER 15 51.722 -0.971 -0.971
105 1HB SER 15 HB2 SER 15 52.101 -0.766 -0.766
106 2HB SER 15 HB1 SER 15 50.724 -0.062 -0.062
107 HG SER 15 HG SER 15 50.189 -2.132 -2.132
108 H GLU 16 HN GLU 16 51.066 1.419 1.419
109 HA GLU 16 HA GLU 16 53.140 3.150 3.150
110 1HB GLU 16 HB2 GLU 16 51.451 4.830 4.830
111 2HB GLU 16 HB1 GLU 16 50.577 3.330 3.330
112 1HG GLU 16 HG2 GLU 16 50.376 3.101 3.101
113 2HG GLU 16 HG1 GLU 16 50.884 4.789 4.789
114 H GLU 17 HN GLU 17 51.938 2.415 2.415
115 HA GLU 17 HA GLU 17 52.974 4.465 4.465
116 1HB GLU 17 HB2 GLU 17 53.057 1.464 1.464
117 2HB GLU 17 HB1 GLU 17 53.223 2.674 2.674
118 1HG GLU 17 HG2 GLU 17 50.965 3.602 3.602
119 2HG GLU 17 HG1 GLU 17 50.807 1.988 1.988
120 H MET 18 HN MET 18 54.793 1.491 1.491
121 HA MET 18 HA MET 18 57.316 2.451 2.451
122 1HB MET 18 HB2 MET 18 56.418 0.071 0.071
123 2HB MET 18 HB1 MET 18 56.957 0.444 0.444
124 1HG MET 18 HG2 MET 18 58.950 -0.387 -0.387
125 2HG MET 18 HG1 MET 18 59.141 1.219 1.219
126 1HE MET 18 HE3 MET 18 59.806 1.636 1.636
127 2HE MET 18 HE2 MET 18 59.466 0.972 0.972
128 3HE MET 18 HE1 MET 18 60.737 0.260 0.260
129 H ILE 19 HN ILE 19 55.879 2.398 2.398
130 HA ILE 19 HA ILE 19 58.007 3.296 3.296
131 HB ILE 19 HB ILE 19 55.094 4.147 4.147
132 1HG1 ILE 19 HG12 ILE 19 56.597 1.773 1.773
133 2HG1 ILE 19 HG11 ILE 19 55.216 1.753 1.753
134 1HG2 ILE 19 HG23 ILE 19 56.726 5.481 5.481
135 2HG2 ILE 19 HG22 ILE 19 57.056 3.984 3.984
136 3HG2 ILE 19 HG21 ILE 19 55.432 4.676 4.676
137 HD1 ILE 19 HD1 ILE 19 53.989 3.030 3.030
138 HD1 ILE 19 HD1 ILE 19 54.218 1.288 1.288
139 HD1 ILE 19 HD1 ILE 19 55.282 2.393 2.393
140 H ALA 20 HN ALA 20 55.748 5.330 5.330
141 HA ALA 20 HA ALA 20 57.000 7.835 7.835
142 1HB ALA 20 HB1 ALA 20 55.283 6.918 6.918
143 2HB ALA 20 HB3 ALA 20 55.644 8.607 8.607
144 3HB ALA 20 HB2 ALA 20 54.712 7.642 7.642
145 H GLU 21 HN GLU 21 57.790 5.314 5.314
146 HA GLU 21 HA GLU 21 59.385 6.956 6.956
147 1HB GLU 21 HB2 GLU 21 58.332 4.849 4.849
148 2HB GLU 21 HB1 GLU 21 59.249 3.975 3.975
149 1HG GLU 21 HG2 GLU 21 61.220 4.090 4.090
150 2HG GLU 21 HG1 GLU 21 60.794 5.623 5.623
151 H PHE 22 HN PHE 22 60.143 4.691 4.691
152 HA PHE 22 HA PHE 22 62.997 5.042 5.042
153 1HB PHE 22 HB2 PHE 22 61.128 4.225 4.225
154 2HB PHE 22 HB1 PHE 22 62.871 3.973 3.973
155 HD1 PHE 22 HD2 PHE 22 62.448 3.586 3.586
156 HD2 PHE 22 HD1 PHE 22 61.125 1.657 1.657
157 HE1 PHE 22 HE2 PHE 22 62.141 1.465 1.465
158 HE2 PHE 22 HE1 PHE 22 60.820 -0.463 -0.463
159 HZ PHE 22 HZ PHE 22 61.327 -0.559 -0.559
160 H LYS 23 HN LYS 23 60.409 6.833 6.833
161 HA LYS 23 HA LYS 23 61.715 8.276 8.276
162 1HB LYS 23 HB2 LYS 23 59.617 8.954 8.954
163 2HB LYS 23 HB1 LYS 23 60.130 10.164 10.164
164 1HG LYS 23 HG2 LYS 23 59.170 7.387 7.387
165 2HG LYS 23 HG1 LYS 23 58.136 8.817 8.817
166 1HD LYS 23 HD2 LYS 23 60.622 9.304 9.304
167 2HD LYS 23 HD1 LYS 23 59.729 7.946 7.946
168 1HE LYS 23 HE2 LYS 23 57.696 9.732 9.732
169 2HE LYS 23 HE1 LYS 23 59.038 10.820 10.820
170 1HZ LYS 23 HZ2 LYS 23 58.687 8.344 8.344
171 2HZ LYS 23 HZ1 LYS 23 57.681 9.668 9.668
172 3HZ LYS 23 HZ3 LYS 23 59.365 9.826 9.826
173 H ALA 24 HN ALA 24 61.276 9.694 9.694
174 HA ALA 24 HA ALA 24 63.259 11.691 11.691
175 1HB ALA 24 HB3 ALA 24 61.675 10.348 10.348
176 2HB ALA 24 HB2 ALA 24 63.223 10.938 10.938
177 3HB ALA 24 HB1 ALA 24 62.091 12.055 12.055
178 H ALA 25 HN ALA 25 63.559 8.270 8.270
179 HA ALA 25 HA ALA 25 66.258 8.363 8.363
180 1HB ALA 25 HB2 ALA 25 64.483 6.555 6.555
181 2HB ALA 25 HB1 ALA 25 64.835 6.091 6.091
182 3HB ALA 25 HB3 ALA 25 66.087 5.964 5.964
183 H PHE 26 HN PHE 26 64.959 7.397 7.397
184 HA PHE 26 HA PHE 26 67.552 7.124 7.124
185 1HB PHE 26 HB2 PHE 26 65.743 5.981 5.981
186 2HB PHE 26 HB1 PHE 26 64.688 7.392 7.392
187 HD1 PHE 26 HD2 PHE 26 65.116 9.360 9.360
188 HD2 PHE 26 HD1 PHE 26 67.202 5.631 5.631
189 HE1 PHE 26 HE2 PHE 26 65.808 10.022 10.022
190 HE2 PHE 26 HE1 PHE 26 67.894 6.295 6.295
191 HZ PHE 26 HZ PHE 26 67.198 8.491 8.491
192 H ASP 27 HN ASP 27 65.262 9.810 9.810
193 HA ASP 27 HA ASP 27 66.467 11.594 11.594
194 1HB ASP 27 HB2 ASP 27 64.739 11.843 11.843
195 2HB ASP 27 HB1 ASP 27 65.289 13.285 13.285
196 H MET 28 HN MET 28 67.647 10.390 10.390
197 HA MET 28 HA MET 28 69.012 12.580 12.580
198 1HB MET 28 HB2 MET 28 69.544 9.616 9.616
199 2HB MET 28 HB1 MET 28 70.618 10.662 10.662
200 1HG MET 28 HG2 MET 28 67.914 11.282 11.282
201 2HG MET 28 HG1 MET 28 68.134 9.536 9.536
202 1HE MET 28 HE3 MET 28 68.025 12.533 12.533
203 2HE MET 28 HE2 MET 28 68.531 12.278 12.278
204 3HE MET 28 HE1 MET 28 69.622 13.072 13.072
205 H PHE 29 HN PHE 29 69.674 10.802 10.802
206 HA PHE 29 HA PHE 29 72.183 12.417 12.417
207 1HB PHE 29 HB2 PHE 29 71.734 9.738 9.738
208 2HB PHE 29 HB1 PHE 29 73.253 10.511 10.511
209 HD1 PHE 29 HD2 PHE 29 70.339 8.616 8.616
210 HD2 PHE 29 HD1 PHE 29 74.113 10.386 10.386
211 HE1 PHE 29 HE2 PHE 29 70.321 7.390 7.390
212 HE2 PHE 29 HE1 PHE 29 74.096 9.159 9.159
213 HZ PHE 29 HZ PHE 29 72.200 7.662 7.662
214 H ASP 30 HN ASP 30 69.228 12.718 12.718
215 HA ASP 30 HA ASP 30 69.576 12.598 12.598
216 1HB ASP 30 HB2 ASP 30 67.179 12.782 12.782
217 2HB ASP 30 HB1 ASP 30 67.571 11.673 11.673
218 H ALA 31 HN ALA 31 70.359 14.743 14.743
219 HA ALA 31 HA ALA 31 69.183 17.219 17.219
220 1HB ALA 31 HB3 ALA 31 71.929 16.296 16.296
221 2HB ALA 31 HB2 ALA 31 71.620 18.015 18.015
222 3HB ALA 31 HB1 ALA 31 70.704 17.115 17.115
223 H ASP 32 HN ASP 32 71.386 15.345 15.345
224 HA ASP 32 HA ASP 32 71.286 17.513 17.513
225 1HB ASP 32 HB2 ASP 32 73.571 16.176 16.176
226 2HB ASP 32 HB1 ASP 32 73.727 16.384 16.384
227 H GLY 33 HN GLY 33 70.168 14.579 14.579
228 1HA GLY 33 HA2 GLY 33 70.883 13.406 13.406
229 2HA GLY 33 HA1 GLY 33 70.283 12.476 12.476
230 H GLY 34 HN GLY 34 68.350 14.884 14.884
231 1HA GLY 34 HA2 GLY 34 66.183 15.483 15.483
232 2HA GLY 34 HA1 GLY 34 66.571 14.809 14.809
233 H GLY 35 HN GLY 35 66.733 12.297 12.297
234 1HA GLY 35 HA2 GLY 35 64.781 11.124 11.124
235 2HA GLY 35 HA1 GLY 35 64.495 10.929 10.929
236 H ASP 36 HN ASP 36 67.792 10.986 10.986
237 HA ASP 36 HA ASP 36 68.061 8.114 8.114
238 1HB ASP 36 HB2 ASP 36 69.346 7.811 7.811
239 2HB ASP 36 HB1 ASP 36 67.604 8.034 8.034
240 H ILE 37 HN ILE 37 69.908 7.882 7.882
241 HA ILE 37 HA ILE 37 71.858 10.129 10.129
242 HB ILE 37 HB ILE 37 72.473 9.190 9.190
243 1HG1 ILE 37 HG12 ILE 37 70.930 6.748 6.748
244 2HG1 ILE 37 HG11 ILE 37 72.666 6.852 6.852
245 1HG2 ILE 37 HG23 ILE 37 69.730 9.700 9.700
246 2HG2 ILE 37 HG22 ILE 37 69.785 8.449 8.449
247 3HG2 ILE 37 HG21 ILE 37 70.550 10.011 10.011
248 HD1 ILE 37 HD1 ILE 37 72.363 7.095 7.095
249 HD1 ILE 37 HD1 ILE 37 71.253 5.811 5.811
250 HD1 ILE 37 HD1 ILE 37 70.642 7.439 7.439
251 H SER 38 HN SER 38 74.211 9.516 9.516
252 HA SER 38 HA SER 38 75.042 8.021 8.021
253 1HB SER 38 HB2 SER 38 76.275 9.732 9.732
254 2HB SER 38 HB1 SER 38 76.624 8.386 8.386
255 HG SER 38 HG SER 38 78.285 8.260 8.260
256 H THR 39 HN THR 39 75.341 5.833 5.833
257 HA THR 39 HA THR 39 74.255 3.810 3.810
258 HB THR 39 HB THR 39 76.005 2.375 2.375
259 HG1 THR 39 HG1 THR 39 77.637 3.945 3.945
260 1HG2 THR 39 HG23 THR 39 74.310 4.409 4.409
261 2HG2 THR 39 HG22 THR 39 75.160 3.114 3.114
262 3HG2 THR 39 HG21 THR 39 73.923 2.725 2.725
263 H LYS 40 HN LYS 40 77.372 5.415 5.415
264 HA LYS 40 HA LYS 40 78.516 3.546 3.546
265 1HB LYS 40 HB2 LYS 40 79.045 6.136 6.136
266 2HB LYS 40 HB1 LYS 40 79.434 6.168 6.168
267 1HG LYS 40 HG2 LYS 40 81.211 4.788 4.788
268 2HG LYS 40 HG1 LYS 40 80.328 3.718 3.718
269 1HD LYS 40 HD2 LYS 40 80.728 5.180 5.180
270 2HD LYS 40 HD1 LYS 40 81.414 6.421 6.421
271 1HE LYS 40 HE2 LYS 40 83.452 5.477 5.477
272 2HE LYS 40 HE1 LYS 40 82.850 4.004 4.004
273 1HZ LYS 40 HZ3 LYS 40 82.462 4.705 4.705
274 2HZ LYS 40 HZ2 LYS 40 83.569 3.557 3.557
275 3HZ LYS 40 HZ1 LYS 40 81.899 3.299 3.299
276 H GLU 41 HN GLU 41 75.965 5.833 5.833
277 HA GLU 41 HA GLU 41 76.177 5.990 5.990
278 1HB GLU 41 HB2 GLU 41 75.718 7.880 7.880
279 2HB GLU 41 HB1 GLU 41 74.055 7.369 7.369
280 1HG GLU 41 HG2 GLU 41 74.174 8.891 8.891
281 2HG GLU 41 HG1 GLU 41 74.949 7.558 7.558
282 H LEU 42 HN LEU 42 74.814 3.992 3.992
283 HA LEU 42 HA LEU 42 72.113 3.674 3.674
284 1HB LEU 42 HB2 LEU 42 73.009 2.952 2.952
285 2HB LEU 42 HB1 LEU 42 74.001 1.743 1.743
286 HG LEU 42 HG LEU 42 71.401 1.359 1.359
287 HD1 LEU 42 HD1 LEU 42 70.048 2.200 2.200
288 HD1 LEU 42 HD1 LEU 42 70.596 0.844 0.844
289 HD1 LEU 42 HD1 LEU 42 71.387 2.414 2.414
290 HD2 LEU 42 HD2 LEU 42 72.665 -0.191 -0.191
291 HD2 LEU 42 HD2 LEU 42 71.639 -0.805 -0.805
292 HD2 LEU 42 HD2 LEU 42 73.283 -0.277 -0.277
293 H GLY 43 HN GLY 43 74.898 1.449 1.449
294 1HA GLY 43 HA2 GLY 43 73.847 -0.289 -0.289
295 2HA GLY 43 HA1 GLY 43 75.537 0.217 0.217
296 H THR 44 HN THR 44 74.741 3.058 3.058
297 HA THR 44 HA THR 44 74.677 2.971 2.971
298 HB THR 44 HB THR 44 74.696 5.046 5.046
299 HG1 THR 44 HG1 THR 44 76.409 4.976 4.976
300 1HG2 THR 44 HG21 THR 44 73.981 5.441 5.441
301 2HG2 THR 44 HG23 THR 44 74.963 6.663 6.663
302 3HG2 THR 44 HG22 THR 44 73.359 6.266 6.266
303 H VAL 45 HN VAL 45 72.376 4.121 4.121
304 HA VAL 45 HA VAL 45 70.292 4.962 4.962
305 HB VAL 45 HB VAL 45 70.452 3.846 3.846
306 1HG1 VAL 45 HG13 VAL 45 68.220 3.284 3.284
307 2HG1 VAL 45 HG12 VAL 45 67.975 5.001 5.001
308 3HG1 VAL 45 HG11 VAL 45 68.113 4.421 4.421
309 1HG2 VAL 45 HG21 VAL 45 69.938 6.580 6.580
310 2HG2 VAL 45 HG23 VAL 45 71.369 6.067 6.067
311 3HG2 VAL 45 HG22 VAL 45 69.823 6.231 6.231
312 H MET 46 HN MET 46 70.507 1.805 1.805
313 HA MET 46 HA MET 46 68.310 0.586 0.586
314 1HB MET 46 HB2 MET 46 69.330 -1.490 -1.490
315 2HB MET 46 HB1 MET 46 69.363 -0.201 -0.201
316 1HG MET 46 HG2 MET 46 71.708 0.338 0.338
317 2HG MET 46 HG1 MET 46 71.653 -1.124 -1.124
318 1HE MET 46 HE1 MET 46 70.396 -3.225 -3.225
319 2HE MET 46 HE3 MET 46 69.476 -2.483 -2.483
320 3HE MET 46 HE2 MET 46 70.658 -3.743 -3.743
321 H ARG 47 HN ARG 47 71.809 0.530 0.530
322 HA ARG 47 HA ARG 47 71.546 -1.203 -1.203
323 1HB ARG 47 HB2 ARG 47 73.572 -0.709 -0.709
324 2HB ARG 47 HB1 ARG 47 73.736 0.799 0.799
325 1HG ARG 47 HG2 ARG 47 73.394 -1.612 -1.612
326 2HG ARG 47 HG1 ARG 47 74.897 -1.555 -1.555
327 1HD ARG 47 HD2 ARG 47 74.980 0.944 0.944
328 2HD ARG 47 HD1 ARG 47 73.946 0.277 0.277
329 HE ARG 47 HE ARG 47 76.228 -1.433 -1.433
330 1HH1 ARG 47 HH1 ARG 47 75.856 -1.790 -1.790
331 2HH1 ARG 47 HH1 ARG 47 76.708 -0.550 -0.550
332 1HH2 ARG 47 HH2 ARG 47 77.011 1.521 1.521
333 2HH2 ARG 47 HH2 ARG 47 77.362 1.324 1.324
334 H MET 48 HN MET 48 72.052 2.332 2.332
335 HA MET 48 HA MET 48 71.979 2.943 2.943
336 1HB MET 48 HB2 MET 48 72.805 4.427 4.427
337 2HB MET 48 HB1 MET 48 71.170 4.564 4.564
338 1HG MET 48 HG2 MET 48 71.692 6.515 6.515
339 2HG MET 48 HG1 MET 48 70.413 5.555 5.555
340 1HE MET 48 HE1 MET 48 70.410 6.114 6.114
341 2HE MET 48 HE3 MET 48 71.747 6.206 6.206
342 3HE MET 48 HE2 MET 48 71.583 7.425 7.425
343 H LEU 49 HN LEU 49 69.477 1.896 1.896
344 HA LEU 49 HA LEU 49 67.274 3.271 3.271
345 1HB LEU 49 HB2 LEU 49 67.758 1.458 1.458
346 2HB LEU 49 HB1 LEU 49 66.247 1.122 1.122
347 HG LEU 49 HG LEU 49 66.950 3.963 3.963
348 HD1 LEU 49 HD1 LEU 49 66.827 1.963 1.963
349 HD1 LEU 49 HD1 LEU 49 66.668 3.699 3.699
350 HD1 LEU 49 HD1 LEU 49 65.229 2.708 2.708
351 HD2 LEU 49 HD2 LEU 49 65.014 3.702 3.702
352 HD2 LEU 49 HD2 LEU 49 64.434 2.336 2.336
353 HD2 LEU 49 HD2 LEU 49 64.396 3.963 3.963
354 H GLY 50 HN GLY 50 69.118 0.378 0.378
355 1HA GLY 50 HA2 GLY 50 68.645 -0.389 -0.389
356 2HA GLY 50 HA1 GLY 50 67.024 -0.691 -0.691
357 H GLN 51 HN GLN 51 68.667 -1.367 -1.367
358 HA GLN 51 HA GLN 51 68.761 -4.265 -4.265
359 1HB GLN 51 HB2 GLN 51 69.125 -2.634 -2.634
360 2HB GLN 51 HB1 GLN 51 68.997 -4.393 -4.393
361 1HG GLN 51 HG2 GLN 51 66.785 -3.869 -3.869
362 2HG GLN 51 HG1 GLN 51 66.780 -3.821 -3.821
363 1HE2 GLN 51 HE22 GLN 51 66.237 -0.386 -0.386
364 2HE2 GLN 51 HE21 GLN 51 66.563 -1.852 -1.852
365 H ASN 52 HN ASN 52 70.708 -5.282 -5.282
366 HA ASN 52 HA ASN 52 73.242 -3.802 -3.802
367 1HB ASN 52 HB2 ASN 52 72.291 -5.292 -5.292
368 2HB ASN 52 HB1 ASN 52 73.155 -6.543 -6.543
369 HD2 ASN 52 HD2 ASN 52 73.628 -4.403 -4.403
370 HD2 ASN 52 HD2 ASN 52 75.293 -4.117 -4.117
371 HA PRO 53 HA PRO 53 73.131 -6.564 -6.564
372 1HB PRO 53 HB2 PRO 53 74.152 -4.705 -4.705
373 2HB PRO 53 HB1 PRO 53 72.420 -4.833 -4.833
374 1HG PRO 53 HG2 PRO 53 74.438 -2.914 -2.914
375 2HG PRO 53 HG1 PRO 53 72.740 -2.648 -2.648
376 1HD PRO 53 HD2 PRO 53 73.644 -2.936 -2.936
377 2HD PRO 53 HD1 PRO 53 71.990 -3.329 -3.329
378 H THR 54 HN THR 54 74.885 -7.926 -7.926
379 HA THR 54 HA THR 54 77.436 -7.370 -7.370
380 HB THR 54 HB THR 54 78.049 -9.414 -9.414
381 HG1 THR 54 HG1 THR 54 76.691 -9.902 -9.902
382 1HG2 THR 54 HG22 THR 54 76.154 -9.128 -9.128
383 2HG2 THR 54 HG21 THR 54 75.842 -10.580 -10.580
384 3HG2 THR 54 HG23 THR 54 77.429 -10.325 -10.325
385 H LYS 55 HN LYS 55 79.371 -6.626 -6.626
386 HA LYS 55 HA LYS 55 79.448 -4.699 -4.699
387 1HB LYS 55 HB2 LYS 55 81.252 -5.729 -5.729
388 2HB LYS 55 HB1 LYS 55 81.634 -6.759 -6.759
389 1HG LYS 55 HG2 LYS 55 82.870 -5.081 -5.081
390 2HG LYS 55 HG1 LYS 55 81.389 -4.140 -4.140
391 1HD LYS 55 HD2 LYS 55 82.311 -4.157 -4.157
392 2HD LYS 55 HD1 LYS 55 83.541 -3.521 -3.521
393 1HE LYS 55 HE2 LYS 55 82.400 -1.561 -1.561
394 2HE LYS 55 HE1 LYS 55 81.092 -2.395 -2.395
395 1HZ LYS 55 HZ1 LYS 55 81.435 -2.624 -2.624
396 2HZ LYS 55 HZ3 LYS 55 80.509 -1.383 -1.383
397 3HZ LYS 55 HZ2 LYS 55 80.068 -3.005 -3.005
398 H GLU 56 HN GLU 56 80.058 -8.192 -8.192
399 HA GLU 56 HA GLU 56 80.461 -8.178 -8.178
400 1HB GLU 56 HB2 GLU 56 80.635 -10.127 -10.127
401 2HB GLU 56 HB1 GLU 56 78.882 -10.139 -10.139
402 1HG GLU 56 HG2 GLU 56 79.366 -10.102 -10.102
403 2HG GLU 56 HG1 GLU 56 80.485 -11.289 -11.289
404 H GLU 57 HN GLU 57 77.353 -8.202 -8.202
405 HA GLU 57 HA GLU 57 75.646 -8.383 -8.383
406 1HB GLU 57 HB2 GLU 57 75.478 -7.557 -7.557
407 2HB GLU 57 HB1 GLU 57 74.143 -7.083 -7.083
408 1HG GLU 57 HG2 GLU 57 75.072 -9.888 -9.888
409 2HG GLU 57 HG1 GLU 57 74.264 -9.489 -9.489
410 H LEU 58 HN LEU 58 76.871 -5.552 -5.552
411 HA LEU 58 HA LEU 58 75.530 -3.510 -3.510
412 1HB LEU 58 HB2 LEU 58 78.299 -3.627 -3.627
413 2HB LEU 58 HB1 LEU 58 77.475 -2.134 -2.134
414 HG LEU 58 HG LEU 58 76.619 -4.160 -4.160
415 HD1 LEU 58 HD1 LEU 58 77.322 -2.629 -2.629
416 HD1 LEU 58 HD1 LEU 58 76.632 -1.284 -1.284
417 HD1 LEU 58 HD1 LEU 58 78.222 -1.916 -1.916
418 HD2 LEU 58 HD2 LEU 58 75.096 -1.854 -1.854
419 HD2 LEU 58 HD2 LEU 58 74.643 -2.589 -2.589
420 HD2 LEU 58 HD2 LEU 58 74.613 -3.549 -3.549
421 H ASP 59 HN ASP 59 78.879 -4.678 -4.678
422 HA ASP 59 HA ASP 59 79.419 -3.272 -3.272
423 1HB ASP 59 HB2 ASP 59 80.474 -5.421 -5.421
424 2HB ASP 59 HB1 ASP 59 80.471 -5.943 -5.943
425 H ALA 60 HN ALA 60 77.742 -6.397 -6.397
426 HA ALA 60 HA ALA 60 77.416 -6.938 -6.938
427 1HB ALA 60 HB1 ALA 60 75.882 -7.786 -7.786
428 2HB ALA 60 HB3 ALA 60 75.695 -8.533 -8.533
429 3HB ALA 60 HB2 ALA 60 77.237 -8.640 -8.640
430 H ILE 61 HN ILE 61 75.360 -5.301 -5.301
431 HA ILE 61 HA ILE 61 73.132 -4.878 -4.878
432 HB ILE 61 HB ILE 61 74.024 -3.587 -3.587
433 1HG1 ILE 61 HG12 ILE 61 71.850 -5.631 -5.631
434 2HG1 ILE 61 HG11 ILE 61 73.479 -6.058 -6.058
435 1HG2 ILE 61 HG21 ILE 61 71.627 -3.177 -3.177
436 2HG2 ILE 61 HG23 ILE 61 71.406 -3.133 -3.133
437 3HG2 ILE 61 HG22 ILE 61 72.516 -2.005 -2.005
438 HD1 ILE 61 HD1 ILE 61 72.720 -5.792 -5.792
439 HD1 ILE 61 HD1 ILE 61 71.254 -4.982 -4.982
440 HD1 ILE 61 HD1 ILE 61 72.741 -4.060 -4.060
441 H ILE 62 HN ILE 62 75.613 -2.632 -2.632
442 HA ILE 62 HA ILE 62 74.991 -0.301 -0.301
443 HB ILE 62 HB ILE 62 77.644 -1.632 -1.632
444 1HG1 ILE 62 HG12 ILE 62 76.465 0.788 0.788
445 2HG1 ILE 62 HG11 ILE 62 75.898 -0.824 -0.824
446 1HG2 ILE 62 HG23 ILE 62 77.045 0.826 0.826
447 2HG2 ILE 62 HG22 ILE 62 78.131 1.081 1.081
448 3HG2 ILE 62 HG21 ILE 62 78.552 -0.084 -0.084
449 HD1 ILE 62 HD1 ILE 62 78.793 0.081 0.081
450 HD1 ILE 62 HD1 ILE 62 78.200 -1.510 -1.510
451 HD1 ILE 62 HD1 ILE 62 77.760 -0.086 -0.086
452 H GLU 63 HN GLU 63 77.442 -2.594 -2.594
453 HA GLU 63 HA GLU 63 77.698 -1.633 -1.633
454 1HB GLU 63 HB2 GLU 63 78.787 -3.622 -3.622
455 2HB GLU 63 HB1 GLU 63 77.450 -4.578 -4.578
456 1HG GLU 63 HG2 GLU 63 78.181 -3.380 -3.380
457 2HG GLU 63 HG1 GLU 63 79.735 -3.315 -3.315
458 H GLU 64 HN GLU 64 75.215 -3.916 -3.916
459 HA GLU 64 HA GLU 64 73.862 -4.363 -4.363
460 1HB GLU 64 HB2 GLU 64 73.286 -5.768 -5.768
461 2HB GLU 64 HB1 GLU 64 73.212 -4.440 -4.440
462 1HG GLU 64 HG2 GLU 64 71.090 -3.729 -3.729
463 2HG GLU 64 HG1 GLU 64 71.236 -4.651 -4.651
464 H VAL 65 HN VAL 65 73.283 -1.892 -1.892
465 HA VAL 65 HA VAL 65 71.209 -0.582 -0.582
466 HB VAL 65 HB VAL 65 71.032 0.848 0.848
467 1HG1 VAL 65 HG13 VAL 65 70.066 -1.423 -1.423
468 2HG1 VAL 65 HG12 VAL 65 71.593 -2.029 -2.029
469 3HG1 VAL 65 HG11 VAL 65 70.637 -0.878 -0.878
470 1HG2 VAL 65 HG22 VAL 65 73.695 0.724 0.724
471 2HG2 VAL 65 HG21 VAL 65 72.682 1.068 1.068
472 3HG2 VAL 65 HG23 VAL 65 73.299 -0.562 -0.562
473 H ASP 66 HN ASP 66 74.621 -0.439 -0.439
474 HA ASP 66 HA ASP 66 74.973 2.394 2.394
475 1HB ASP 66 HB2 ASP 66 76.518 0.150 0.150
476 2HB ASP 66 HB1 ASP 66 77.127 0.648 0.648
477 H GLU 67 HN GLU 67 73.785 -0.151 -0.151
478 HA GLU 67 HA GLU 67 75.013 0.477 0.477
479 1HB GLU 67 HB2 GLU 67 74.140 -1.713 -1.713
480 2HB GLU 67 HB1 GLU 67 72.601 -1.082 -1.082
481 1HG GLU 67 HG2 GLU 67 72.024 -0.263 -0.263
482 2HG GLU 67 HG1 GLU 67 73.619 -0.692 -0.692
483 H ASP 68 HN ASP 68 72.900 2.225 2.225
484 HA ASP 68 HA ASP 68 70.912 3.119 3.119
485 1HB ASP 68 HB2 ASP 68 71.379 3.384 3.384
486 2HB ASP 68 HB1 ASP 68 72.000 4.943 4.943
487 H GLY 69 HN GLY 69 74.294 3.756 3.756
488 1HA GLY 69 HA2 GLY 69 75.535 4.903 4.903
489 2HA GLY 69 HA1 GLY 69 74.052 5.726 5.726
490 H SER 70 HN SER 70 73.570 6.234 6.234
491 HA SER 70 HA SER 70 75.382 8.619 8.619
492 1HB SER 70 HB2 SER 70 72.507 8.057 8.057
493 2HB SER 70 HB1 SER 70 73.360 9.359 9.359
494 HG SER 70 HG SER 70 73.481 9.121 9.121
495 H GLY 71 HN GLY 71 74.487 5.656 5.656
496 1HA GLY 71 HA2 GLY 71 75.410 4.630 4.630
497 2HA GLY 71 HA1 GLY 71 76.384 6.080 6.080
498 H THR 72 HN THR 72 72.881 6.145 6.145
499 HA THR 72 HA THR 72 72.684 6.903 6.903
500 HB THR 72 HB THR 72 70.711 8.315 8.315
501 HG1 THR 72 HG1 THR 72 72.321 8.371 8.371
502 1HG2 THR 72 HG22 THR 72 73.047 9.042 9.042
503 2HG2 THR 72 HG21 THR 72 73.460 9.229 9.229
504 3HG2 THR 72 HG23 THR 72 72.142 10.171 10.171
505 H ILE 73 HN ILE 73 71.021 5.913 5.913
506 HA ILE 73 HA ILE 73 69.488 3.794 3.794
507 HB ILE 73 HB ILE 73 70.742 3.150 3.150
508 1HG1 ILE 73 HG12 ILE 73 68.769 2.570 2.570
509 2HG1 ILE 73 HG11 ILE 73 67.754 3.366 3.366
510 1HG2 ILE 73 HG23 ILE 73 69.486 5.633 5.633
511 2HG2 ILE 73 HG22 ILE 73 69.857 4.316 4.316
512 3HG2 ILE 73 HG21 ILE 73 71.143 5.053 5.053
513 HD1 ILE 73 HD1 ILE 73 68.117 0.808 0.808
514 HD1 ILE 73 HD1 ILE 73 69.728 1.234 1.234
515 HD1 ILE 73 HD1 ILE 73 68.302 1.798 1.798
516 H ASP 74 HN ASP 74 67.260 3.909 3.909
517 HA ASP 74 HA ASP 74 65.932 6.455 6.455
518 1HB ASP 74 HB2 ASP 74 65.461 3.998 3.998
519 2HB ASP 74 HB1 ASP 74 64.020 4.848 4.848
520 H PHE 75 HN PHE 75 64.532 6.761 6.761
521 HA PHE 75 HA PHE 75 64.429 5.238 5.238
522 1HB PHE 75 HB2 PHE 75 63.433 7.519 7.519
523 2HB PHE 75 HB1 PHE 75 62.056 6.677 6.677
524 HD1 PHE 75 HD1 PHE 75 63.895 7.361 7.361
525 HD2 PHE 75 HD2 PHE 75 60.473 5.450 5.450
526 HE1 PHE 75 HE1 PHE 75 62.911 7.051 7.051
527 HE2 PHE 75 HE2 PHE 75 59.488 5.140 5.140
528 HZ PHE 75 HZ PHE 75 60.708 5.940 5.940
529 H GLU 76 HN GLU 76 61.899 5.080 5.080
530 HA GLU 76 HA GLU 76 60.457 2.881 2.881
531 1HB GLU 76 HB2 GLU 76 61.061 3.969 3.969
532 2HB GLU 76 HB1 GLU 76 60.001 2.574 2.574
533 1HG GLU 76 HG2 GLU 76 58.371 4.147 4.147
534 2HG GLU 76 HG1 GLU 76 58.990 4.267 4.267
535 H GLU 77 HN GLU 77 63.133 2.808 2.808
536 HA GLU 77 HA GLU 77 63.301 -0.054 -0.054
537 1HB GLU 77 HB2 GLU 77 64.207 1.542 1.542
538 2HB GLU 77 HB1 GLU 77 65.369 2.121 2.121
539 1HG GLU 77 HG2 GLU 77 66.777 0.447 0.447
540 2HG GLU 77 HG1 GLU 77 65.532 -0.742 -0.742
541 H PHE 78 HN PHE 78 64.533 2.299 2.299
542 HA PHE 78 HA PHE 78 66.588 0.614 0.614
543 1HB PHE 78 HB2 PHE 78 66.894 2.903 2.903
544 2HB PHE 78 HB1 PHE 78 65.174 3.198 3.198
545 HD1 PHE 78 HD1 PHE 78 68.048 1.366 1.366
546 HD2 PHE 78 HD2 PHE 78 64.381 3.520 3.520
547 HE1 PHE 78 HE1 PHE 78 68.372 1.235 1.235
548 HE2 PHE 78 HE2 PHE 78 64.704 3.390 3.390
549 HZ PHE 78 HZ PHE 78 66.700 2.246 2.246
550 H LEU 79 HN LEU 79 63.160 1.253 1.253
551 HA LEU 79 HA LEU 79 62.757 0.194 0.194
552 1HB LEU 79 HB2 LEU 79 61.270 0.253 0.253
553 2HB LEU 79 HB1 LEU 79 60.634 -0.819 -0.819
554 HG LEU 79 HG LEU 79 61.373 1.695 1.695
555 HD1 LEU 79 HD1 LEU 79 59.686 1.798 1.798
556 HD1 LEU 79 HD1 LEU 79 61.029 2.844 2.844
557 HD1 LEU 79 HD1 LEU 79 59.479 2.979 2.979
558 HD2 LEU 79 HD2 LEU 79 59.375 1.373 1.373
559 HD2 LEU 79 HD2 LEU 79 59.544 -0.253 -0.253
560 HD2 LEU 79 HD2 LEU 79 58.524 0.932 0.932
561 H VAL 80 HN VAL 80 63.749 -1.551 -1.551
562 HA VAL 80 HA VAL 80 63.080 -4.206 -4.206
563 HB VAL 80 HB VAL 80 64.300 -4.910 -4.910
564 1HG1 VAL 80 HG12 VAL 80 62.614 -2.426 -2.426
565 2HG1 VAL 80 HG11 VAL 80 63.295 -3.178 -3.178
566 3HG1 VAL 80 HG13 VAL 80 62.195 -4.090 -4.090
567 1HG2 VAL 80 HG22 VAL 80 65.549 -2.219 -2.219
568 2HG2 VAL 80 HG21 VAL 80 66.292 -3.745 -3.745
569 3HG2 VAL 80 HG23 VAL 80 65.349 -2.816 -2.816
570 H MET 81 HN MET 81 65.889 -2.074 -2.074
571 HA MET 81 HA MET 81 67.719 -4.128 -4.128
572 1HB MET 81 HB2 MET 81 67.656 -1.126 -1.126
573 2HB MET 81 HB1 MET 81 68.963 -1.909 -1.909
574 1HG MET 81 HG2 MET 81 69.923 -1.978 -1.978
575 2HG MET 81 HG1 MET 81 68.963 -3.451 -3.451
576 1HE MET 81 HE2 MET 81 69.907 -2.377 -2.377
577 2HE MET 81 HE1 MET 81 68.628 -3.589 -3.589
578 3HE MET 81 HE3 MET 81 68.501 -2.153 -2.153
579 H MET 82 HN MET 82 66.159 -1.321 -1.321
580 HA MET 82 HA MET 82 66.924 -1.983 -1.983
581 1HB MET 82 HB2 MET 82 64.841 -0.547 -0.547
582 2HB MET 82 HB1 MET 82 66.095 0.195 0.195
583 1HG MET 82 HG2 MET 82 64.840 -0.046 -0.046
584 2HG MET 82 HG1 MET 82 63.816 -1.303 -1.303
585 1HE MET 82 HE3 MET 82 61.720 -0.770 -0.770
586 2HE MET 82 HE2 MET 82 61.563 -0.763 -0.763
587 3HE MET 82 HE1 MET 82 60.777 0.494 0.494
588 H VAL 83 HN VAL 83 64.238 -3.128 -3.128
589 HA VAL 83 HA VAL 83 62.896 -4.456 -4.456
590 HB VAL 83 HB VAL 83 62.535 -4.424 -4.424
591 1HG1 VAL 83 HG12 VAL 83 61.544 -6.307 -6.307
592 2HG1 VAL 83 HG11 VAL 83 60.197 -5.253 -5.253
593 3HG1 VAL 83 HG13 VAL 83 61.075 -6.125 -6.125
594 1HG2 VAL 83 HG23 VAL 83 62.067 -2.434 -2.434
595 2HG2 VAL 83 HG22 VAL 83 61.047 -2.707 -2.707
596 3HG2 VAL 83 HG21 VAL 83 60.550 -3.321 -3.321
597 H ARG 84 HN ARG 84 64.160 -5.744 -5.744
598 HA ARG 84 HA ARG 84 64.216 -8.444 -8.444
599 1HB ARG 84 HB2 ARG 84 66.287 -6.686 -6.686
600 2HB ARG 84 HB1 ARG 84 66.259 -8.445 -8.445
601 1HG ARG 84 HG2 ARG 84 63.973 -8.338 -8.338
602 2HG ARG 84 HG1 ARG 84 63.996 -6.579 -6.579
603 1HD ARG 84 HD2 ARG 84 64.563 -7.207 -7.207
604 2HD ARG 84 HD1 ARG 84 66.018 -6.560 -6.560
605 HE ARG 84 HE ARG 84 66.962 -8.709 -8.709
606 1HH1 ARG 84 HH1 ARG 84 63.525 -8.814 -8.814
607 2HH1 ARG 84 HH1 ARG 84 63.454 -10.540 -10.540
608 1HH2 ARG 84 HH2 ARG 84 66.877 -10.973 -10.973
609 2HH2 ARG 84 HH2 ARG 84 65.349 -11.761 -11.761
610 H GLN 85 HN GLN 85 66.351 -5.980 -5.980
611 HA GLN 85 HA GLN 85 68.142 -7.942 -7.942
612 1HB GLN 85 HB2 GLN 85 68.940 -5.754 -5.754
613 2HB GLN 85 HB1 GLN 85 67.789 -4.935 -4.935
614 1HG GLN 85 HG2 GLN 85 69.843 -4.890 -4.890
615 2HG GLN 85 HG1 GLN 85 68.921 -6.201 -6.201
616 1HE2 GLN 85 HE22 GLN 85 71.891 -7.353 -7.353
617 2HE2 GLN 85 HE21 GLN 85 70.938 -6.002 -6.002
618 H MET 86 HN MET 86 65.490 -5.766 -5.766
619 HA MET 86 HA MET 86 65.606 -6.336 -6.336
620 1HB MET 86 HB2 MET 86 64.005 -4.866 -4.866
621 2HB MET 86 HB1 MET 86 62.981 -5.642 -5.642
622 1HG MET 86 HG2 MET 86 64.984 -4.660 -4.660
623 2HG MET 86 HG1 MET 86 64.916 -3.432 -3.432
624 1HE MET 86 HE3 MET 86 63.611 -5.342 -5.342
625 2HE MET 86 HE2 MET 86 62.741 -4.130 -4.130
626 3HE MET 86 HE1 MET 86 61.846 -5.258 -5.258
627 H LYS 87 HN LYS 87 64.190 -7.953 -7.953
628 HA LYS 87 HA LYS 87 62.163 -9.526 -9.526
629 1HB LYS 87 HB2 LYS 87 64.126 -9.663 -9.663
630 2HB LYS 87 HB1 LYS 87 63.525 -11.241 -11.241
631 1HG LYS 87 HG2 LYS 87 61.636 -8.946 -8.946
632 2HG LYS 87 HG1 LYS 87 62.187 -9.970 -9.970
633 1HD LYS 87 HD2 LYS 87 61.492 -11.911 -11.911
634 2HD LYS 87 HD1 LYS 87 60.429 -10.652 -10.652
635 1HE LYS 87 HE2 LYS 87 59.390 -10.348 -10.348
636 2HE LYS 87 HE1 LYS 87 60.562 -11.444 -11.444
637 1HZ LYS 87 HZ3 LYS 87 58.963 -12.317 -12.317
638 2HZ LYS 87 HZ2 LYS 87 58.318 -12.411 -12.411
639 3HZ LYS 87 HZ1 LYS 87 59.733 -13.265 -13.265
640 H GLU 88 HN GLU 88 65.628 -9.726 -9.726
641 HA GLU 88 HA GLU 88 65.380 -12.271 -12.271
642 1HB GLU 88 HB2 GLU 88 67.461 -10.744 -10.744
643 2HB GLU 88 HB1 GLU 88 68.019 -11.540 -11.540
644 1HG GLU 88 HG2 GLU 88 68.306 -13.164 -13.164
645 2HG GLU 88 HG1 GLU 88 66.824 -13.640 -13.640
646 H ASP 89 HN ASP 89 66.238 -8.847 -8.847
647 HA ASP 89 HA ASP 89 67.013 -9.079 -9.079
648 1HB ASP 89 HB2 ASP 89 67.618 -7.347 -7.347
649 2HB ASP 89 HB1 ASP 89 66.117 -6.562 -6.562
650 H ALA 90 HN ALA 90 64.044 -8.419 -8.419
651 HA ALA 90 HA ALA 90 62.568 -7.434 -7.434
652 1HB ALA 90 HB3 ALA 90 62.274 -7.043 -7.043
653 2HB ALA 90 HB2 ALA 90 61.367 -8.554 -8.554
654 3HB ALA 90 HB1 ALA 90 60.836 -7.171 -7.171
Start of MODEL 13
1 1H ALA 1 HT2 ALA 1 65.824 -5.280 -5.280
2 2H ALA 1 HT1 ALA 1 67.275 -5.416 -5.416
3 3H ALA 1 HT3 ALA 1 65.904 -6.281 -6.281
4 HA ALA 1 HA ALA 1 67.305 -7.842 -7.842
5 1HB ALA 1 HB1 ALA 1 68.095 -5.475 -5.475
6 2HB ALA 1 HB3 ALA 1 67.427 -6.481 -6.481
7 3HB ALA 1 HB2 ALA 1 68.749 -7.087 -7.087
8 H SER 2 HN SER 2 66.773 -8.738 -8.738
9 HA SER 2 HA SER 2 63.904 -9.316 -9.316
10 1HB SER 2 HB2 SER 2 66.344 -10.366 -10.366
11 2HB SER 2 HB1 SER 2 65.064 -10.314 -10.314
12 HG SER 2 HG SER 2 63.731 -11.323 -11.323
13 H MET 3 HN MET 3 65.896 -6.991 -6.991
14 HA MET 3 HA MET 3 64.488 -6.575 -6.575
15 1HB MET 3 HB2 MET 3 66.362 -5.150 -5.150
16 2HB MET 3 HB1 MET 3 65.397 -4.100 -4.100
17 1HG MET 3 HG2 MET 3 66.138 -6.100 -6.100
18 2HG MET 3 HG1 MET 3 67.564 -5.961 -5.961
19 1HE MET 3 HE2 MET 3 67.441 -5.676 -5.676
20 2HE MET 3 HE1 MET 3 68.971 -4.893 -4.893
21 3HE MET 3 HE3 MET 3 67.807 -4.091 -4.091
22 H THR 4 HN THR 4 63.927 -5.284 -5.284
23 HA THR 4 HA THR 4 61.995 -3.334 -3.334
24 HB THR 4 HB THR 4 62.909 -4.005 -4.005
25 HG1 THR 4 HG1 THR 4 61.149 -3.089 -3.089
26 1HG2 THR 4 HG21 THR 4 62.668 -6.518 -6.518
27 2HG2 THR 4 HG23 THR 4 61.054 -6.369 -6.369
28 3HG2 THR 4 HG22 THR 4 62.476 -6.069 -6.069
29 H ASP 5 HN ASP 5 61.707 -6.787 -6.787
30 HA ASP 5 HA ASP 5 58.768 -6.746 -6.746
31 1HB ASP 5 HB2 ASP 5 61.018 -8.684 -8.684
32 2HB ASP 5 HB1 ASP 5 59.584 -9.150 -9.150
33 H GLN 6 HN GLN 6 61.452 -7.450 -7.450
34 HA GLN 6 HA GLN 6 59.748 -7.404 -7.404
35 1HB GLN 6 HB2 GLN 6 62.054 -8.509 -8.509
36 2HB GLN 6 HB1 GLN 6 62.729 -6.922 -6.922
37 1HG GLN 6 HG2 GLN 6 62.698 -7.684 -7.684
38 2HG GLN 6 HG1 GLN 6 60.994 -7.232 -7.232
39 1HE2 GLN 6 HE22 GLN 6 62.040 -11.178 -11.178
40 2HE2 GLN 6 HE21 GLN 6 63.230 -9.977 -9.977
41 H GLN 7 HN GLN 7 60.851 -4.927 -4.927
42 HA GLN 7 HA GLN 7 61.497 -2.874 -2.874
43 1HB GLN 7 HB2 GLN 7 62.112 -2.781 -2.781
44 2HB GLN 7 HB1 GLN 7 60.410 -2.799 -2.799
45 1HG GLN 7 HG2 GLN 7 60.606 -0.697 -0.697
46 2HG GLN 7 HG1 GLN 7 62.059 -0.555 -0.555
47 1HE2 GLN 7 HE22 GLN 7 58.411 0.221 0.221
48 2HE2 GLN 7 HE21 GLN 7 58.538 -0.363 -0.363
49 H ALA 8 HN ALA 8 58.466 -4.071 -4.071
50 HA ALA 8 HA ALA 8 56.891 -1.851 -1.851
51 1HB ALA 8 HB3 ALA 8 56.574 -4.113 -4.113
52 2HB ALA 8 HB2 ALA 8 55.148 -3.801 -3.801
53 3HB ALA 8 HB1 ALA 8 55.812 -2.523 -2.523
54 H GLU 9 HN GLU 9 57.365 -5.345 -5.345
55 HA GLU 9 HA GLU 9 55.504 -5.432 -5.432
56 1HB GLU 9 HB2 GLU 9 56.442 -7.270 -7.270
57 2HB GLU 9 HB1 GLU 9 57.758 -7.370 -7.370
58 1HG GLU 9 HG2 GLU 9 56.354 -8.883 -8.883
59 2HG GLU 9 HG1 GLU 9 55.657 -7.421 -7.421
60 H ALA 10 HN ALA 10 58.610 -4.146 -4.146
61 HA ALA 10 HA ALA 10 59.671 -4.800 -4.800
62 1HB ALA 10 HB3 ALA 10 60.397 -2.972 -2.972
63 2HB ALA 10 HB2 ALA 10 61.300 -2.932 -2.932
64 3HB ALA 10 HB1 ALA 10 61.242 -4.415 -4.415
65 H ARG 11 HN ARG 11 57.502 -2.422 -2.422
66 HA ARG 11 HA ARG 11 57.931 -0.556 -0.556
67 1HB ARG 11 HB2 ARG 11 55.843 -0.307 -0.307
68 2HB ARG 11 HB1 ARG 11 56.701 0.973 0.973
69 1HG ARG 11 HG2 ARG 11 58.132 1.065 1.065
70 2HG ARG 11 HG1 ARG 11 58.703 -0.540 -0.540
71 1HD ARG 11 HD2 ARG 11 57.488 -1.589 -1.589
72 2HD ARG 11 HD1 ARG 11 56.159 -0.417 -0.417
73 HE ARG 11 HE ARG 11 58.710 -0.010 -0.010
74 1HH1 ARG 11 HH2 ARG 11 57.767 2.511 2.511
75 2HH1 ARG 11 HH2 ARG 11 56.763 3.214 3.214
76 1HH2 ARG 11 HH1 ARG 11 56.495 0.282 0.282
77 2HH2 ARG 11 HH1 ARG 11 56.043 1.951 1.951
78 H ALA 12 HN ALA 12 55.289 -2.461 -2.461
79 HA ALA 12 HA ALA 12 53.217 -1.926 -1.926
80 1HB ALA 12 HB1 ALA 12 53.674 -3.559 -3.559
81 2HB ALA 12 HB3 ALA 12 53.553 -4.744 -4.744
82 3HB ALA 12 HB2 ALA 12 52.219 -3.632 -3.632
83 H PHE 13 HN PHE 13 55.814 -4.369 -4.369
84 HA PHE 13 HA PHE 13 55.010 -5.674 -5.674
85 1HB PHE 13 HB2 PHE 13 56.929 -6.368 -6.368
86 2HB PHE 13 HB1 PHE 13 57.725 -4.813 -4.813
87 HD1 PHE 13 HD2 PHE 13 58.561 -4.167 -4.167
88 HD2 PHE 13 HD1 PHE 13 56.987 -8.078 -8.078
89 HE1 PHE 13 HE2 PHE 13 59.601 -5.020 -5.020
90 HE2 PHE 13 HE1 PHE 13 58.026 -8.932 -8.932
91 HZ PHE 13 HZ PHE 13 59.333 -7.402 -7.402
92 H LEU 14 HN LEU 14 56.068 -2.388 -2.388
93 HA LEU 14 HA LEU 14 56.484 -2.048 -2.048
94 1HB LEU 14 HB2 LEU 14 56.932 -0.166 -0.166
95 2HB LEU 14 HB1 LEU 14 57.514 0.063 0.063
96 HG LEU 14 HG LEU 14 58.239 -2.451 -2.451
97 HD1 LEU 14 HD1 LEU 14 60.397 -1.042 -1.042
98 HD1 LEU 14 HD1 LEU 14 59.279 0.321 0.321
99 HD1 LEU 14 HD1 LEU 14 58.999 -0.989 -0.989
100 HD2 LEU 14 HD2 LEU 14 60.349 -2.014 -2.014
101 HD2 LEU 14 HD2 LEU 14 58.882 -2.399 -2.399
102 HD2 LEU 14 HD2 LEU 14 59.433 -0.728 -0.728
103 H SER 15 HN SER 15 54.553 -1.625 -1.625
104 HA SER 15 HA SER 15 52.177 -0.620 -0.620
105 1HB SER 15 HB2 SER 15 53.322 -1.068 -1.068
106 2HB SER 15 HB1 SER 15 52.038 0.138 0.138
107 HG SER 15 HG SER 15 51.082 -1.850 -1.850
108 H GLU 16 HN GLU 16 51.214 1.576 1.576
109 HA GLU 16 HA GLU 16 52.472 3.772 3.772
110 1HB GLU 16 HB2 GLU 16 50.140 3.760 3.760
111 2HB GLU 16 HB1 GLU 16 50.570 3.561 3.561
112 1HG GLU 16 HG2 GLU 16 50.036 5.890 5.890
113 2HG GLU 16 HG1 GLU 16 51.782 5.767 5.767
114 H GLU 17 HN GLU 17 52.217 3.416 3.416
115 HA GLU 17 HA GLU 17 54.080 5.292 5.292
116 1HB GLU 17 HB2 GLU 17 52.622 3.660 3.660
117 2HB GLU 17 HB1 GLU 17 53.928 2.490 2.490
118 1HG GLU 17 HG2 GLU 17 55.478 3.878 3.878
119 2HG GLU 17 HG1 GLU 17 54.380 5.258 5.258
120 H MET 18 HN MET 18 54.745 2.031 2.031
121 HA MET 18 HA MET 18 57.536 1.899 1.899
122 1HB MET 18 HB2 MET 18 55.597 0.353 0.353
123 2HB MET 18 HB1 MET 18 56.526 0.838 0.838
124 1HG MET 18 HG2 MET 18 57.991 -0.793 -0.793
125 2HG MET 18 HG1 MET 18 58.464 0.200 0.200
126 1HE MET 18 HE2 MET 18 56.725 0.538 0.538
127 2HE MET 18 HE1 MET 18 56.011 -0.793 -0.793
128 3HE MET 18 HE3 MET 18 57.766 -0.580 -0.580
129 H ILE 19 HN ILE 19 56.008 2.742 2.742
130 HA ILE 19 HA ILE 19 58.221 3.690 3.690
131 HB ILE 19 HB ILE 19 55.308 4.410 4.410
132 1HG1 ILE 19 HG12 ILE 19 56.354 3.765 3.765
133 2HG1 ILE 19 HG11 ILE 19 56.991 2.606 2.606
134 1HG2 ILE 19 HG22 ILE 19 56.556 6.543 6.543
135 2HG2 ILE 19 HG21 ILE 19 57.272 5.747 5.747
136 3HG2 ILE 19 HG23 ILE 19 55.529 6.006 6.006
137 HD1 ILE 19 HD1 ILE 19 54.944 1.638 1.638
138 HD1 ILE 19 HD1 ILE 19 54.122 3.197 3.197
139 HD1 ILE 19 HD1 ILE 19 54.533 2.491 2.491
140 H ALA 20 HN ALA 20 56.077 5.759 5.759
141 HA ALA 20 HA ALA 20 57.723 8.089 8.089
142 1HB ALA 20 HB1 ALA 20 55.278 7.325 7.325
143 2HB ALA 20 HB3 ALA 20 56.225 7.595 7.595
144 3HB ALA 20 HB2 ALA 20 56.038 8.891 8.891
145 H GLU 21 HN GLU 21 57.806 5.215 5.215
146 HA GLU 21 HA GLU 21 59.662 6.250 6.250
147 1HB GLU 21 HB2 GLU 21 58.210 4.350 4.350
148 2HB GLU 21 HB1 GLU 21 58.891 3.466 3.466
149 1HG GLU 21 HG2 GLU 21 59.958 2.603 2.603
150 2HG GLU 21 HG1 GLU 21 61.145 3.630 3.630
151 H PHE 22 HN PHE 22 60.041 4.285 4.285
152 HA PHE 22 HA PHE 22 62.947 4.125 4.125
153 1HB PHE 22 HB2 PHE 22 60.856 3.451 3.451
154 2HB PHE 22 HB1 PHE 22 62.573 3.300 3.300
155 HD1 PHE 22 HD2 PHE 22 61.607 2.796 2.796
156 HD2 PHE 22 HD1 PHE 22 62.157 0.836 0.836
157 HE1 PHE 22 HE2 PHE 22 61.668 0.600 0.600
158 HE2 PHE 22 HE1 PHE 22 62.217 -1.361 -1.361
159 HZ PHE 22 HZ PHE 22 61.973 -1.479 -1.479
160 H LYS 23 HN LYS 23 60.760 5.778 5.778
161 HA LYS 23 HA LYS 23 62.605 7.244 7.244
162 1HB LYS 23 HB2 LYS 23 60.324 7.338 7.338
163 2HB LYS 23 HB1 LYS 23 59.823 7.771 7.771
164 1HG LYS 23 HG2 LYS 23 61.659 9.752 9.752
165 2HG LYS 23 HG1 LYS 23 60.301 9.531 9.531
166 1HD LYS 23 HD2 LYS 23 59.048 9.527 9.527
167 2HD LYS 23 HD1 LYS 23 60.346 10.694 10.694
168 1HE LYS 23 HE2 LYS 23 59.558 11.605 11.605
169 2HE LYS 23 HE1 LYS 23 58.031 10.828 10.828
170 1HZ LYS 23 HZ3 LYS 23 58.482 11.938 11.938
171 2HZ LYS 23 HZ2 LYS 23 59.523 12.961 12.961
172 3HZ LYS 23 HZ1 LYS 23 57.870 12.896 12.896
173 H ALA 24 HN ALA 24 61.367 7.955 7.955
174 HA ALA 24 HA ALA 24 62.501 10.563 10.563
175 1HB ALA 24 HB2 ALA 24 61.344 8.405 8.405
176 2HB ALA 24 HB1 ALA 24 62.482 9.433 9.433
177 3HB ALA 24 HB3 ALA 24 61.073 10.145 10.145
178 H ALA 25 HN ALA 25 63.894 7.359 7.359
179 HA ALA 25 HA ALA 25 66.386 8.318 8.318
180 1HB ALA 25 HB3 ALA 25 65.168 6.100 6.100
181 2HB ALA 25 HB2 ALA 25 65.741 5.598 5.598
182 3HB ALA 25 HB1 ALA 25 66.899 5.981 5.981
183 H PHE 26 HN PHE 26 65.251 7.085 7.085
184 HA PHE 26 HA PHE 26 67.817 7.055 7.055
185 1HB PHE 26 HB2 PHE 26 65.991 5.829 5.829
186 2HB PHE 26 HB1 PHE 26 64.938 7.245 7.245
187 HD1 PHE 26 HD1 PHE 26 65.432 9.185 9.185
188 HD2 PHE 26 HD2 PHE 26 67.465 5.414 5.414
189 HE1 PHE 26 HE1 PHE 26 66.174 9.776 9.776
190 HE2 PHE 26 HE2 PHE 26 68.207 6.005 6.005
191 HZ PHE 26 HZ PHE 26 67.563 8.187 8.187
192 H ASP 27 HN ASP 27 65.384 9.574 9.574
193 HA ASP 27 HA ASP 27 66.438 11.491 11.491
194 1HB ASP 27 HB2 ASP 27 64.782 11.658 11.658
195 2HB ASP 27 HB1 ASP 27 65.102 13.058 13.058
196 H MET 28 HN MET 28 67.733 10.263 10.263
197 HA MET 28 HA MET 28 68.959 12.586 12.586
198 1HB MET 28 HB2 MET 28 69.842 9.678 9.678
199 2HB MET 28 HB1 MET 28 70.380 10.886 10.886
200 1HG MET 28 HG2 MET 28 67.438 10.477 10.477
201 2HG MET 28 HG1 MET 28 68.351 9.247 9.247
202 1HE MET 28 HE2 MET 28 70.567 10.397 10.397
203 2HE MET 28 HE1 MET 28 70.073 11.137 11.137
204 3HE MET 28 HE3 MET 28 69.425 9.561 9.561
205 H PHE 29 HN PHE 29 69.747 10.636 10.636
206 HA PHE 29 HA PHE 29 72.334 12.133 12.133
207 1HB PHE 29 HB2 PHE 29 71.621 9.542 9.542
208 2HB PHE 29 HB1 PHE 29 73.219 10.181 10.181
209 HD1 PHE 29 HD1 PHE 29 74.114 10.067 10.067
210 HD2 PHE 29 HD2 PHE 29 70.274 8.418 8.418
211 HE1 PHE 29 HE1 PHE 29 74.091 8.828 8.828
212 HE2 PHE 29 HE2 PHE 29 70.250 7.179 7.179
213 HZ PHE 29 HZ PHE 29 72.159 7.384 7.384
214 H ASP 30 HN ASP 30 69.338 12.532 12.532
215 HA ASP 30 HA ASP 30 69.755 12.568 12.568
216 1HB ASP 30 HB2 ASP 30 67.384 13.137 13.137
217 2HB ASP 30 HB1 ASP 30 67.640 11.825 11.825
218 H ALA 31 HN ALA 31 70.803 14.531 14.531
219 HA ALA 31 HA ALA 31 69.983 17.142 17.142
220 1HB ALA 31 HB3 ALA 31 72.770 15.958 15.958
221 2HB ALA 31 HB2 ALA 31 72.445 17.680 17.680
222 3HB ALA 31 HB1 ALA 31 71.771 16.515 16.515
223 H ASP 32 HN ASP 32 71.749 15.179 15.179
224 HA ASP 32 HA ASP 32 71.475 17.409 17.409
225 1HB ASP 32 HB2 ASP 32 73.789 17.180 17.180
226 2HB ASP 32 HB1 ASP 32 73.824 15.518 15.518
227 H GLY 33 HN GLY 33 70.334 14.496 14.496
228 1HA GLY 33 HA2 GLY 33 70.647 13.242 13.242
229 2HA GLY 33 HA1 GLY 33 69.947 12.471 12.471
230 H GLY 34 HN GLY 34 68.124 14.510 14.510
231 1HA GLY 34 HA2 GLY 34 65.877 15.045 15.045
232 2HA GLY 34 HA1 GLY 34 66.483 15.565 15.565
233 H GLY 35 HN GLY 35 66.794 12.244 12.244
234 1HA GLY 35 HA2 GLY 35 64.565 10.906 10.906
235 2HA GLY 35 HA1 GLY 35 65.185 11.383 11.383
236 H ASP 36 HN ASP 36 67.992 11.166 11.166
237 HA ASP 36 HA ASP 36 68.297 8.296 8.296
238 1HB ASP 36 HB2 ASP 36 69.703 8.048 8.048
239 2HB ASP 36 HB1 ASP 36 67.964 8.207 8.207
240 H ILE 37 HN ILE 37 70.259 7.914 7.914
241 HA ILE 37 HA ILE 37 72.093 10.261 10.261
242 HB ILE 37 HB ILE 37 72.716 9.182 9.182
243 1HG1 ILE 37 HG12 ILE 37 71.011 6.893 6.893
244 2HG1 ILE 37 HG11 ILE 37 72.745 6.860 6.860
245 1HG2 ILE 37 HG23 ILE 37 69.722 9.061 9.061
246 2HG2 ILE 37 HG22 ILE 37 70.499 9.106 9.106
247 3HG2 ILE 37 HG21 ILE 37 70.636 10.485 10.485
248 HD1 ILE 37 HD1 ILE 37 70.620 6.306 6.306
249 HD1 ILE 37 HD1 ILE 37 71.410 7.788 7.788
250 HD1 ILE 37 HD1 ILE 37 72.352 6.312 6.312
251 H SER 38 HN SER 38 74.470 9.634 9.634
252 HA SER 38 HA SER 38 75.419 8.305 8.305
253 1HB SER 38 HB2 SER 38 76.495 9.835 9.835
254 2HB SER 38 HB1 SER 38 76.989 8.279 8.279
255 HG SER 38 HG SER 38 77.773 7.861 7.861
256 H THR 39 HN THR 39 75.702 6.158 6.158
257 HA THR 39 HA THR 39 74.513 4.009 4.009
258 HB THR 39 HB THR 39 76.254 2.656 2.656
259 HG1 THR 39 HG1 THR 39 77.941 4.218 4.218
260 1HG2 THR 39 HG21 THR 39 74.799 4.937 4.937
261 2HG2 THR 39 HG23 THR 39 76.056 4.215 4.215
262 3HG2 THR 39 HG22 THR 39 74.731 3.220 3.220
263 H LYS 40 HN LYS 40 77.491 5.601 5.601
264 HA LYS 40 HA LYS 40 78.466 3.534 3.534
265 1HB LYS 40 HB2 LYS 40 79.402 5.863 5.863
266 2HB LYS 40 HB1 LYS 40 78.963 6.404 6.404
267 1HG LYS 40 HG2 LYS 40 80.222 4.259 4.259
268 2HG LYS 40 HG1 LYS 40 80.959 4.302 4.302
269 1HD LYS 40 HD2 LYS 40 80.996 6.949 6.949
270 2HD LYS 40 HD1 LYS 40 81.698 5.817 5.817
271 1HE LYS 40 HE2 LYS 40 82.519 5.566 5.566
272 2HE LYS 40 HE1 LYS 40 83.213 6.883 6.883
273 1HZ LYS 40 HZ3 LYS 40 83.440 5.005 5.005
274 2HZ LYS 40 HZ2 LYS 40 83.400 3.979 3.979
275 3HZ LYS 40 HZ1 LYS 40 84.610 5.164 5.164
276 H GLU 41 HN GLU 41 75.763 5.601 5.601
277 HA GLU 41 HA GLU 41 75.718 5.467 5.467
278 1HB GLU 41 HB2 GLU 41 74.239 7.098 7.098
279 2HB GLU 41 HB1 GLU 41 73.860 7.164 7.164
280 1HG GLU 41 HG2 GLU 41 76.530 7.512 7.512
281 2HG GLU 41 HG1 GLU 41 76.226 8.217 8.217
282 H LEU 42 HN LEU 42 74.352 4.047 4.047
283 HA LEU 42 HA LEU 42 71.724 3.396 3.396
284 1HB LEU 42 HB2 LEU 42 73.018 2.787 2.787
285 2HB LEU 42 HB1 LEU 42 73.834 1.530 1.530
286 HG LEU 42 HG LEU 42 70.880 1.514 1.514
287 HD1 LEU 42 HD1 LEU 42 71.474 2.093 2.093
288 HD1 LEU 42 HD1 LEU 42 70.470 0.667 0.667
289 HD1 LEU 42 HD1 LEU 42 72.191 0.485 0.485
290 HD2 LEU 42 HD2 LEU 42 71.634 -0.985 -0.985
291 HD2 LEU 42 HD2 LEU 42 71.778 -0.362 -0.362
292 HD2 LEU 42 HD2 LEU 42 73.184 -0.378 -0.378
293 H GLY 43 HN GLY 43 74.704 1.751 1.751
294 1HA GLY 43 HA2 GLY 43 73.270 -0.139 -0.139
295 2HA GLY 43 HA1 GLY 43 75.010 0.160 0.160
296 H THR 44 HN THR 44 74.675 3.059 3.059
297 HA THR 44 HA THR 44 74.711 3.174 3.174
298 HB THR 44 HB THR 44 74.418 5.142 5.142
299 HG1 THR 44 HG1 THR 44 76.465 4.537 4.537
300 1HG2 THR 44 HG22 THR 44 73.099 6.004 6.004
301 2HG2 THR 44 HG21 THR 44 74.547 5.876 5.876
302 3HG2 THR 44 HG23 THR 44 74.513 6.994 6.994
303 H VAL 45 HN VAL 45 72.142 4.205 4.205
304 HA VAL 45 HA VAL 45 70.201 5.008 5.008
305 HB VAL 45 HB VAL 45 70.121 3.747 3.747
306 1HG1 VAL 45 HG12 VAL 45 67.812 4.572 4.572
307 2HG1 VAL 45 HG11 VAL 45 67.673 4.545 4.545
308 3HG1 VAL 45 HG13 VAL 45 68.026 3.057 3.057
309 1HG2 VAL 45 HG22 VAL 45 69.671 6.515 6.515
310 2HG2 VAL 45 HG21 VAL 45 70.929 6.004 6.004
311 3HG2 VAL 45 HG23 VAL 45 69.250 6.090 6.090
312 H MET 46 HN MET 46 70.746 1.752 1.752
313 HA MET 46 HA MET 46 68.661 0.385 0.385
314 1HB MET 46 HB2 MET 46 71.407 -0.406 -0.406
315 2HB MET 46 HB1 MET 46 70.255 -1.587 -1.587
316 1HG MET 46 HG2 MET 46 68.685 -1.129 -1.129
317 2HG MET 46 HG1 MET 46 69.502 0.365 0.365
318 1HE MET 46 HE2 MET 46 70.335 -3.352 -3.352
319 2HE MET 46 HE1 MET 46 69.094 -3.358 -3.358
320 3HE MET 46 HE3 MET 46 70.720 -3.956 -3.956
321 H ARG 47 HN ARG 47 72.020 1.065 1.065
322 HA ARG 47 HA ARG 47 71.784 -0.359 -0.359
323 1HB ARG 47 HB2 ARG 47 73.738 1.284 1.284
324 2HB ARG 47 HB1 ARG 47 73.928 1.308 1.308
325 1HG ARG 47 HG2 ARG 47 74.521 -0.901 -0.901
326 2HG ARG 47 HG1 ARG 47 73.454 -1.354 -1.354
327 1HD ARG 47 HD2 ARG 47 75.016 -0.674 -0.674
328 2HD ARG 47 HD1 ARG 47 75.943 0.297 0.297
329 HE ARG 47 HE ARG 47 75.908 -2.684 -2.684
330 1HH1 ARG 47 HH1 ARG 47 76.284 -1.858 -1.858
331 2HH1 ARG 47 HH1 ARG 47 77.993 -1.605 -1.605
332 1HH2 ARG 47 HH2 ARG 47 78.472 -1.420 -1.420
333 2HH2 ARG 47 HH2 ARG 47 79.232 -1.357 -1.357
334 H MET 48 HN MET 48 71.611 3.050 3.050
335 HA MET 48 HA MET 48 71.416 4.212 4.212
336 1HB MET 48 HB2 MET 48 71.839 5.220 5.220
337 2HB MET 48 HB1 MET 48 70.081 5.252 5.252
338 1HG MET 48 HG2 MET 48 70.894 7.401 7.401
339 2HG MET 48 HG1 MET 48 69.946 6.570 6.570
340 1HE MET 48 HE1 MET 48 70.505 7.533 7.533
341 2HE MET 48 HE3 MET 48 72.046 7.570 7.570
342 3HE MET 48 HE2 MET 48 71.721 8.742 8.742
343 H LEU 49 HN LEU 49 69.234 2.207 2.207
344 HA LEU 49 HA LEU 49 66.812 3.373 3.373
345 1HB LEU 49 HB2 LEU 49 67.528 1.566 1.566
346 2HB LEU 49 HB1 LEU 49 66.098 1.054 1.054
347 HG LEU 49 HG LEU 49 65.850 3.848 3.848
348 HD1 LEU 49 HD1 LEU 49 65.790 3.560 3.560
349 HD1 LEU 49 HD1 LEU 49 67.140 2.488 2.488
350 HD1 LEU 49 HD1 LEU 49 67.200 4.183 4.183
351 HD2 LEU 49 HD2 LEU 49 63.794 2.930 2.930
352 HD2 LEU 49 HD2 LEU 49 64.469 1.370 1.370
353 HD2 LEU 49 HD2 LEU 49 64.214 2.623 2.623
354 H GLY 50 HN GLY 50 68.685 0.321 0.321
355 1HA GLY 50 HA2 GLY 50 68.699 -0.307 -0.307
356 2HA GLY 50 HA1 GLY 50 67.034 -0.709 -0.709
357 H GLN 51 HN GLN 51 68.211 -1.384 -1.384
358 HA GLN 51 HA GLN 51 68.568 -4.241 -4.241
359 1HB GLN 51 HB2 GLN 51 68.902 -2.802 -2.802
360 2HB GLN 51 HB1 GLN 51 68.354 -4.455 -4.455
361 1HG GLN 51 HG2 GLN 51 66.252 -3.645 -3.645
362 2HG GLN 51 HG1 GLN 51 66.558 -2.908 -2.908
363 1HE2 GLN 51 HE22 GLN 51 66.155 -0.546 -0.546
364 2HE2 GLN 51 HE21 GLN 51 65.862 -2.217 -2.217
365 H ASN 52 HN ASN 52 70.434 -5.111 -5.111
366 HA ASN 52 HA ASN 52 72.923 -3.559 -3.559
367 1HB ASN 52 HB2 ASN 52 72.109 -5.680 -5.680
368 2HB ASN 52 HB1 ASN 52 73.729 -5.893 -5.893
369 HD2 ASN 52 HD2 ASN 52 72.303 -4.621 -4.621
370 HD2 ASN 52 HD2 ASN 52 73.330 -3.305 -3.305
371 HA PRO 53 HA PRO 53 72.711 -6.422 -6.422
372 1HB PRO 53 HB2 PRO 53 73.765 -4.632 -4.632
373 2HB PRO 53 HB1 PRO 53 72.036 -4.698 -4.698
374 1HG PRO 53 HG2 PRO 53 74.132 -2.827 -2.827
375 2HG PRO 53 HG1 PRO 53 72.439 -2.511 -2.511
376 1HD PRO 53 HD2 PRO 53 73.342 -2.771 -2.771
377 2HD PRO 53 HD1 PRO 53 71.678 -3.146 -3.146
378 H THR 54 HN THR 54 74.441 -7.798 -7.798
379 HA THR 54 HA THR 54 76.976 -7.458 -7.458
380 HB THR 54 HB THR 54 77.581 -9.354 -9.354
381 HG1 THR 54 HG1 THR 54 75.898 -10.086 -10.086
382 1HG2 THR 54 HG21 THR 54 75.594 -9.230 -9.230
383 2HG2 THR 54 HG23 THR 54 75.117 -10.440 -10.440
384 3HG2 THR 54 HG22 THR 54 76.689 -10.554 -10.554
385 H LYS 55 HN LYS 55 78.902 -6.550 -6.550
386 HA LYS 55 HA LYS 55 79.010 -4.493 -4.493
387 1HB LYS 55 HB2 LYS 55 80.697 -5.511 -5.511
388 2HB LYS 55 HB1 LYS 55 81.352 -6.335 -6.335
389 1HG LYS 55 HG2 LYS 55 81.338 -3.999 -3.999
390 2HG LYS 55 HG1 LYS 55 81.158 -3.370 -3.370
391 1HD LYS 55 HD2 LYS 55 83.333 -3.737 -3.737
392 2HD LYS 55 HD1 LYS 55 83.237 -5.398 -5.398
393 1HE LYS 55 HE2 LYS 55 83.340 -3.085 -3.085
394 2HE LYS 55 HE1 LYS 55 84.825 -3.796 -3.796
395 1HZ LYS 55 HZ1 LYS 55 82.760 -5.637 -5.637
396 2HZ LYS 55 HZ3 LYS 55 83.625 -4.802 -4.802
397 3HZ LYS 55 HZ2 LYS 55 84.451 -5.778 -5.778
398 H GLU 56 HN GLU 56 79.922 -7.918 -7.918
399 HA GLU 56 HA GLU 56 80.652 -7.780 -7.780
400 1HB GLU 56 HB2 GLU 56 79.264 -9.851 -9.851
401 2HB GLU 56 HB1 GLU 56 79.698 -10.189 -10.189
402 1HG GLU 56 HG2 GLU 56 81.836 -10.563 -10.563
403 2HG GLU 56 HG1 GLU 56 81.938 -8.969 -8.969
404 H GLU 57 HN GLU 57 77.413 -7.850 -7.850
405 HA GLU 57 HA GLU 57 75.982 -8.220 -8.220
406 1HB GLU 57 HB2 GLU 57 75.438 -7.558 -7.558
407 2HB GLU 57 HB1 GLU 57 74.202 -7.068 -7.068
408 1HG GLU 57 HG2 GLU 57 75.365 -9.852 -9.852
409 2HG GLU 57 HG1 GLU 57 74.010 -9.441 -9.441
410 H LEU 58 HN LEU 58 76.856 -5.368 -5.368
411 HA LEU 58 HA LEU 58 75.477 -3.385 -3.385
412 1HB LEU 58 HB2 LEU 58 78.116 -3.338 -3.338
413 2HB LEU 58 HB1 LEU 58 77.232 -1.895 -1.895
414 HG LEU 58 HG LEU 58 76.289 -4.044 -4.044
415 HD1 LEU 58 HD1 LEU 58 76.403 -1.090 -1.090
416 HD1 LEU 58 HD1 LEU 58 77.879 -2.047 -2.047
417 HD1 LEU 58 HD1 LEU 58 76.500 -2.431 -2.431
418 HD2 LEU 58 HD2 LEU 58 74.337 -3.481 -3.481
419 HD2 LEU 58 HD2 LEU 58 74.833 -1.800 -1.800
420 HD2 LEU 58 HD2 LEU 58 74.295 -2.386 -2.386
421 H ASP 59 HN ASP 59 78.835 -4.580 -4.580
422 HA ASP 59 HA ASP 59 79.548 -2.953 -2.953
423 1HB ASP 59 HB2 ASP 59 80.408 -5.706 -5.706
424 2HB ASP 59 HB1 ASP 59 81.249 -4.807 -4.807
425 H ALA 60 HN ALA 60 77.912 -6.104 -6.104
426 HA ALA 60 HA ALA 60 77.909 -6.531 -6.531
427 1HB ALA 60 HB2 ALA 60 76.759 -7.775 -7.775
428 2HB ALA 60 HB1 ALA 60 76.060 -8.225 -8.225
429 3HB ALA 60 HB3 ALA 60 77.774 -8.501 -8.501
430 H ILE 61 HN ILE 61 75.454 -5.496 -5.496
431 HA ILE 61 HA ILE 61 73.309 -5.168 -5.168
432 HB ILE 61 HB ILE 61 73.995 -4.037 -4.037
433 1HG1 ILE 61 HG12 ILE 61 71.595 -5.704 -5.704
434 2HG1 ILE 61 HG11 ILE 61 73.132 -6.519 -6.519
435 1HG2 ILE 61 HG22 ILE 61 71.556 -3.547 -3.547
436 2HG2 ILE 61 HG21 ILE 61 71.539 -3.338 -3.338
437 3HG2 ILE 61 HG23 ILE 61 72.605 -2.347 -2.347
438 HD1 ILE 61 HD1 ILE 61 73.318 -6.815 -6.815
439 HD1 ILE 61 HD1 ILE 61 71.915 -5.791 -5.791
440 HD1 ILE 61 HD1 ILE 61 73.517 -5.070 -5.070
441 H ILE 62 HN ILE 62 75.470 -2.715 -2.715
442 HA ILE 62 HA ILE 62 74.639 -0.403 -0.403
443 HB ILE 62 HB ILE 62 77.394 -1.498 -1.498
444 1HG1 ILE 62 HG12 ILE 62 75.854 0.713 0.713
445 2HG1 ILE 62 HG11 ILE 62 75.641 -0.982 -0.982
446 1HG2 ILE 62 HG22 ILE 62 76.641 0.899 0.899
447 2HG2 ILE 62 HG21 ILE 62 77.573 1.283 1.283
448 3HG2 ILE 62 HG23 ILE 62 78.236 0.184 0.184
449 HD1 ILE 62 HD1 ILE 62 78.335 -0.861 -0.861
450 HD1 ILE 62 HD1 ILE 62 77.352 -0.501 -0.501
451 HD1 ILE 62 HD1 ILE 62 77.969 0.813 0.813
452 H GLU 63 HN GLU 63 77.434 -2.194 -2.194
453 HA GLU 63 HA GLU 63 77.436 -1.090 -1.090
454 1HB GLU 63 HB2 GLU 63 78.807 -3.011 -3.011
455 2HB GLU 63 HB1 GLU 63 77.935 -4.008 -4.008
456 1HG GLU 63 HG2 GLU 63 79.846 -3.475 -3.475
457 2HG GLU 63 HG1 GLU 63 78.754 -2.185 -2.185
458 H GLU 64 HN GLU 64 75.431 -3.734 -3.734
459 HA GLU 64 HA GLU 64 74.269 -4.518 -4.518
460 1HB GLU 64 HB2 GLU 64 74.099 -6.061 -6.061
461 2HB GLU 64 HB1 GLU 64 73.658 -4.818 -4.818
462 1HG GLU 64 HG2 GLU 64 71.436 -4.708 -4.708
463 2HG GLU 64 HG1 GLU 64 71.833 -5.455 -5.455
464 H VAL 65 HN VAL 65 73.179 -2.308 -2.308
465 HA VAL 65 HA VAL 65 70.827 -1.490 -1.490
466 HB VAL 65 HB VAL 65 70.253 -0.307 -0.307
467 1HG1 VAL 65 HG11 VAL 65 70.027 -2.768 -2.768
468 2HG1 VAL 65 HG13 VAL 65 71.675 -2.899 -2.899
469 3HG1 VAL 65 HG12 VAL 65 70.429 -2.121 -2.121
470 1HG2 VAL 65 HG23 VAL 65 73.137 -0.828 -0.828
471 2HG2 VAL 65 HG22 VAL 65 72.412 0.743 0.743
472 3HG2 VAL 65 HG21 VAL 65 71.910 -0.166 -0.166
473 H ASP 66 HN ASP 66 74.097 -0.565 -0.565
474 HA ASP 66 HA ASP 66 73.850 2.299 2.299
475 1HB ASP 66 HB2 ASP 66 75.860 0.299 0.299
476 2HB ASP 66 HB1 ASP 66 76.182 1.220 1.220
477 H GLU 67 HN GLU 67 72.065 2.290 2.290
478 HA GLU 67 HA GLU 67 72.118 1.264 1.264
479 1HB GLU 67 HB2 GLU 67 70.944 3.432 3.432
480 2HB GLU 67 HB1 GLU 67 70.314 2.640 2.640
481 1HG GLU 67 HG2 GLU 67 72.150 4.147 4.147
482 2HG GLU 67 HG1 GLU 67 71.933 5.144 5.144
483 H ASP 68 HN ASP 68 74.053 1.125 1.125
484 HA ASP 68 HA ASP 68 76.155 3.070 3.070
485 1HB ASP 68 HB2 ASP 68 76.447 0.732 0.732
486 2HB ASP 68 HB1 ASP 68 75.358 0.956 0.956
487 H GLY 69 HN GLY 69 74.419 4.931 4.931
488 1HA GLY 69 HA2 GLY 69 74.883 6.252 6.252
489 2HA GLY 69 HA1 GLY 69 73.355 5.398 5.398
490 H SER 70 HN SER 70 72.419 5.669 5.669
491 HA SER 70 HA SER 70 71.458 8.447 8.447
492 1HB SER 70 HB2 SER 70 70.610 5.909 5.909
493 2HB SER 70 HB1 SER 70 70.606 7.061 7.061
494 HG SER 70 HG SER 70 68.857 6.823 6.823
495 H GLY 71 HN GLY 71 72.321 6.730 6.730
496 1HA GLY 71 HA2 GLY 71 74.610 8.403 8.403
497 2HA GLY 71 HA1 GLY 71 73.170 8.962 8.962
498 H THR 72 HN THR 72 72.215 7.568 7.568
499 HA THR 72 HA THR 72 73.995 5.312 5.312
500 HB THR 72 HB THR 72 74.338 7.112 7.112
501 HG1 THR 72 HG1 THR 72 72.825 6.436 6.436
502 1HG2 THR 72 HG21 THR 72 71.337 7.521 7.521
503 2HG2 THR 72 HG23 THR 72 72.447 8.432 8.432
504 3HG2 THR 72 HG22 THR 72 72.552 8.568 8.568
505 H ILE 73 HN ILE 73 71.459 5.622 5.622
506 HA ILE 73 HA ILE 73 69.811 3.615 3.615
507 HB ILE 73 HB ILE 73 71.026 2.621 2.621
508 1HG1 ILE 73 HG12 ILE 73 68.993 2.244 2.244
509 2HG1 ILE 73 HG11 ILE 73 68.094 3.136 3.136
510 1HG2 ILE 73 HG22 ILE 73 70.361 5.193 5.193
511 2HG2 ILE 73 HG21 ILE 73 70.152 3.805 3.805
512 3HG2 ILE 73 HG23 ILE 73 71.715 4.106 4.106
513 HD1 ILE 73 HD1 ILE 73 69.202 0.410 0.410
514 HD1 ILE 73 HD1 ILE 73 69.542 1.376 1.376
515 HD1 ILE 73 HD1 ILE 73 67.875 1.118 1.118
516 H ASP 74 HN ASP 74 67.510 3.777 3.777
517 HA ASP 74 HA ASP 74 66.592 6.486 6.486
518 1HB ASP 74 HB2 ASP 74 64.544 5.763 5.763
519 2HB ASP 74 HB1 ASP 74 66.023 5.795 5.795
520 H PHE 75 HN PHE 75 65.223 6.696 6.696
521 HA PHE 75 HA PHE 75 65.039 4.908 4.908
522 1HB PHE 75 HB2 PHE 75 64.177 7.277 7.277
523 2HB PHE 75 HB1 PHE 75 62.755 6.647 6.647
524 HD1 PHE 75 HD2 PHE 75 61.144 5.191 5.191
525 HD2 PHE 75 HD1 PHE 75 64.529 6.869 6.869
526 HE1 PHE 75 HE2 PHE 75 60.118 4.607 4.607
527 HE2 PHE 75 HE1 PHE 75 63.504 6.284 6.284
528 HZ PHE 75 HZ PHE 75 61.298 5.153 5.153
529 H GLU 76 HN GLU 76 62.761 5.073 5.073
530 HA GLU 76 HA GLU 76 60.963 3.044 3.044
531 1HB GLU 76 HB2 GLU 76 61.904 4.402 4.402
532 2HB GLU 76 HB1 GLU 76 61.279 2.783 2.783
533 1HG GLU 76 HG2 GLU 76 59.166 3.302 3.302
534 2HG GLU 76 HG1 GLU 76 59.783 4.801 4.801
535 H GLU 77 HN GLU 77 63.386 2.403 2.403
536 HA GLU 77 HA GLU 77 63.433 -0.379 -0.379
537 1HB GLU 77 HB2 GLU 77 64.541 1.106 1.106
538 2HB GLU 77 HB1 GLU 77 65.795 1.457 1.457
539 1HG GLU 77 HG2 GLU 77 66.871 -0.366 -0.366
540 2HG GLU 77 HG1 GLU 77 65.630 -1.321 -1.321
541 H PHE 78 HN PHE 78 64.853 1.953 1.953
542 HA PHE 78 HA PHE 78 66.696 0.107 0.107
543 1HB PHE 78 HB2 PHE 78 67.119 2.463 2.463
544 2HB PHE 78 HB1 PHE 78 65.496 2.802 2.802
545 HD1 PHE 78 HD1 PHE 78 68.638 0.965 0.965
546 HD2 PHE 78 HD2 PHE 78 65.097 2.939 2.939
547 HE1 PHE 78 HE1 PHE 78 69.453 0.749 0.749
548 HE2 PHE 78 HE2 PHE 78 65.914 2.723 2.723
549 HZ PHE 78 HZ PHE 78 68.090 1.628 1.628
550 H LEU 79 HN LEU 79 63.292 0.874 0.874
551 HA LEU 79 HA LEU 79 62.651 0.216 0.216
552 1HB LEU 79 HB2 LEU 79 61.432 -0.152 -0.152
553 2HB LEU 79 HB1 LEU 79 60.749 -1.163 -1.163
554 HG LEU 79 HG LEU 79 59.516 0.927 0.927
555 HD1 LEU 79 HD1 LEU 79 61.081 1.642 1.642
556 HD1 LEU 79 HD1 LEU 79 60.808 -0.097 -0.097
557 HD1 LEU 79 HD1 LEU 79 59.437 1.010 1.010
558 HD2 LEU 79 HD2 LEU 79 60.563 3.073 3.073
559 HD2 LEU 79 HD2 LEU 79 61.469 2.183 2.183
560 HD2 LEU 79 HD2 LEU 79 62.123 2.360 2.360
561 H VAL 80 HN VAL 80 63.521 -2.070 -2.070
562 HA VAL 80 HA VAL 80 63.012 -4.503 -4.503
563 HB VAL 80 HB VAL 80 64.635 -5.407 -5.407
564 1HG1 VAL 80 HG12 VAL 80 62.648 -3.311 -3.311
565 2HG1 VAL 80 HG11 VAL 80 63.648 -4.080 -4.080
566 3HG1 VAL 80 HG13 VAL 80 62.580 -5.058 -5.058
567 1HG2 VAL 80 HG21 VAL 80 65.449 -2.523 -2.523
568 2HG2 VAL 80 HG23 VAL 80 66.457 -3.970 -3.970
569 3HG2 VAL 80 HG22 VAL 80 65.599 -3.470 -3.470
570 H MET 81 HN MET 81 65.805 -2.314 -2.314
571 HA MET 81 HA MET 81 67.544 -4.039 -4.039
572 1HB MET 81 HB2 MET 81 67.299 -1.142 -1.142
573 2HB MET 81 HB1 MET 81 68.406 -1.575 -1.575
574 1HG MET 81 HG2 MET 81 68.441 -2.923 -2.923
575 2HG MET 81 HG1 MET 81 69.446 -1.528 -1.528
576 1HE MET 81 HE2 MET 81 68.460 -4.861 -4.861
577 2HE MET 81 HE1 MET 81 70.072 -5.538 -5.538
578 3HE MET 81 HE3 MET 81 69.251 -5.684 -5.684
579 H MET 82 HN MET 82 65.044 -1.699 -1.699
580 HA MET 82 HA MET 82 65.677 -1.772 -1.772
581 1HB MET 82 HB2 MET 82 63.144 -0.944 -0.944
582 2HB MET 82 HB1 MET 82 63.650 -0.428 -0.428
583 1HG MET 82 HG2 MET 82 65.294 0.984 0.984
584 2HG MET 82 HG1 MET 82 65.520 0.038 0.038
585 1HE MET 82 HE3 MET 82 64.089 2.546 2.546
586 2HE MET 82 HE2 MET 82 64.318 3.693 3.693
587 3HE MET 82 HE1 MET 82 62.688 3.275 3.275
588 H VAL 83 HN VAL 83 63.308 -3.394 -3.394
589 HA VAL 83 HA VAL 83 62.044 -4.797 -4.797
590 HB VAL 83 HB VAL 83 61.824 -4.928 -4.928
591 1HG1 VAL 83 HG12 VAL 83 60.644 -6.606 -6.606
592 2HG1 VAL 83 HG11 VAL 83 59.530 -6.047 -6.047
593 3HG1 VAL 83 HG13 VAL 83 60.948 -6.995 -6.995
594 1HG2 VAL 83 HG23 VAL 83 60.614 -3.328 -3.328
595 2HG2 VAL 83 HG22 VAL 83 60.682 -3.010 -3.010
596 3HG2 VAL 83 HG21 VAL 83 59.429 -4.065 -4.065
597 H ARG 84 HN ARG 84 63.791 -5.910 -5.910
598 HA ARG 84 HA ARG 84 64.065 -8.609 -8.609
599 1HB ARG 84 HB2 ARG 84 66.117 -6.658 -6.658
600 2HB ARG 84 HB1 ARG 84 66.195 -8.407 -8.407
601 1HG ARG 84 HG2 ARG 84 63.746 -6.851 -6.851
602 2HG ARG 84 HG1 ARG 84 65.129 -7.034 -7.034
603 1HD ARG 84 HD2 ARG 84 64.042 -9.495 -9.495
604 2HD ARG 84 HD1 ARG 84 63.167 -8.817 -8.817
605 HE ARG 84 HE ARG 84 65.425 -8.875 -8.875
606 1HH1 ARG 84 HH1 ARG 84 65.794 -10.279 -10.279
607 2HH1 ARG 84 HH1 ARG 84 66.440 -11.779 -11.779
608 1HH2 ARG 84 HH2 ARG 84 65.786 -11.089 -11.089
609 2HH2 ARG 84 HH2 ARG 84 66.435 -12.238 -12.238
610 H GLN 85 HN GLN 85 66.049 -5.970 -5.970
611 HA GLN 85 HA GLN 85 67.801 -7.761 -7.761
612 1HB GLN 85 HB2 GLN 85 68.358 -5.450 -5.450
613 2HB GLN 85 HB1 GLN 85 67.174 -4.815 -4.815
614 1HG GLN 85 HG2 GLN 85 69.401 -4.714 -4.714
615 2HG GLN 85 HG1 GLN 85 68.428 -5.914 -5.914
616 1HE2 GLN 85 HE22 GLN 85 71.306 -7.977 -7.977
617 2HE2 GLN 85 HE21 GLN 85 70.496 -6.998 -6.998
618 H MET 86 HN MET 86 65.394 -5.379 -5.379
619 HA MET 86 HA MET 86 65.294 -6.343 -6.343
620 1HB MET 86 HB2 MET 86 63.906 -4.507 -4.507
621 2HB MET 86 HB1 MET 86 62.742 -5.356 -5.356
622 1HG MET 86 HG2 MET 86 65.164 -4.502 -4.502
623 2HG MET 86 HG1 MET 86 64.212 -3.164 -3.164
624 1HE MET 86 HE3 MET 86 61.744 -3.485 -3.485
625 2HE MET 86 HE2 MET 86 60.689 -3.925 -3.925
626 3HE MET 86 HE1 MET 86 61.656 -2.455 -2.455
627 H LYS 87 HN LYS 87 64.023 -7.745 -7.745
628 HA LYS 87 HA LYS 87 61.742 -9.137 -9.137
629 1HB LYS 87 HB2 LYS 87 64.037 -9.629 -9.629
630 2HB LYS 87 HB1 LYS 87 62.929 -10.969 -10.969
631 1HG LYS 87 HG2 LYS 87 61.786 -8.272 -8.272
632 2HG LYS 87 HG1 LYS 87 62.437 -9.246 -9.246
633 1HD LYS 87 HD2 LYS 87 60.918 -11.037 -11.037
634 2HD LYS 87 HD1 LYS 87 59.945 -9.568 -9.568
635 1HE LYS 87 HE2 LYS 87 59.384 -10.915 -10.915
636 2HE LYS 87 HE1 LYS 87 60.373 -9.558 -9.558
637 1HZ LYS 87 HZ2 LYS 87 62.299 -11.207 -11.207
638 2HZ LYS 87 HZ1 LYS 87 61.103 -12.375 -12.375
639 3HZ LYS 87 HZ3 LYS 87 61.550 -11.283 -11.283
640 H GLU 88 HN GLU 88 65.131 -9.796 -9.796
641 HA GLU 88 HA GLU 88 64.380 -12.207 -12.207
642 1HB GLU 88 HB2 GLU 88 66.943 -10.975 -10.975
643 2HB GLU 88 HB1 GLU 88 66.960 -12.304 -12.304
644 1HG GLU 88 HG2 GLU 88 65.576 -12.365 -12.365
645 2HG GLU 88 HG1 GLU 88 67.123 -13.130 -13.130
646 H ASP 89 HN ASP 89 65.662 -8.931 -8.931
647 HA ASP 89 HA ASP 89 66.320 -9.188 -9.188
648 1HB ASP 89 HB2 ASP 89 67.280 -7.623 -7.623
649 2HB ASP 89 HB1 ASP 89 65.826 -6.655 -6.655
650 H ALA 90 HN ALA 90 63.475 -8.391 -8.391
651 HA ALA 90 HA ALA 90 62.085 -7.035 -7.035
652 1HB ALA 90 HB2 ALA 90 61.886 -6.858 -6.858
653 2HB ALA 90 HB1 ALA 90 60.777 -8.216 -8.216
654 3HB ALA 90 HB3 ALA 90 60.442 -6.684 -6.684
Start of MODEL 14
1 1H ALA 1 HT1 ALA 1 63.308 -4.249 -4.249
2 2H ALA 1 HT3 ALA 1 64.064 -4.184 -4.184
3 3H ALA 1 HT2 ALA 1 62.485 -4.794 -4.794
4 HA ALA 1 HA ALA 1 63.909 -6.672 -6.672
5 1HB ALA 1 HB1 ALA 1 65.898 -5.237 -5.237
6 2HB ALA 1 HB3 ALA 1 65.460 -5.429 -5.429
7 3HB ALA 1 HB2 ALA 1 65.929 -6.836 -6.836
8 H SER 2 HN SER 2 64.740 -7.975 -7.975
9 HA SER 2 HA SER 2 62.112 -8.716 -8.716
10 1HB SER 2 HB2 SER 2 64.956 -9.495 -9.495
11 2HB SER 2 HB1 SER 2 63.515 -10.309 -10.309
12 HG SER 2 HG SER 2 63.815 -11.448 -11.448
13 H MET 3 HN MET 3 64.551 -6.432 -6.432
14 HA MET 3 HA MET 3 64.272 -6.336 -6.336
15 1HB MET 3 HB2 MET 3 65.267 -4.660 -4.660
16 2HB MET 3 HB1 MET 3 64.826 -3.767 -3.767
17 1HG MET 3 HG2 MET 3 66.204 -5.988 -5.988
18 2HG MET 3 HG1 MET 3 67.111 -5.520 -5.520
19 1HE MET 3 HE2 MET 3 68.480 -4.170 -4.170
20 2HE MET 3 HE1 MET 3 68.342 -2.453 -2.453
21 3HE MET 3 HE3 MET 3 69.426 -3.480 -3.480
22 H THR 4 HN THR 4 62.394 -4.832 -4.832
23 HA THR 4 HA THR 4 60.847 -2.964 -2.964
24 HB THR 4 HB THR 4 60.841 -3.587 -3.587
25 HG1 THR 4 HG1 THR 4 59.121 -2.418 -2.418
26 1HG2 THR 4 HG21 THR 4 60.497 -6.076 -6.076
27 2HG2 THR 4 HG23 THR 4 58.791 -5.657 -5.657
28 3HG2 THR 4 HG22 THR 4 59.606 -5.443 -5.443
29 H ASP 5 HN ASP 5 60.804 -6.439 -6.439
30 HA ASP 5 HA ASP 5 58.176 -6.546 -6.546
31 1HB ASP 5 HB2 ASP 5 59.977 -8.295 -8.295
32 2HB ASP 5 HB1 ASP 5 59.942 -8.817 -8.817
33 H GLN 6 HN GLN 6 61.549 -7.157 -7.157
34 HA GLN 6 HA GLN 6 61.143 -7.519 -7.519
35 1HB GLN 6 HB2 GLN 6 63.253 -6.931 -6.931
36 2HB GLN 6 HB1 GLN 6 63.420 -5.818 -5.818
37 1HG GLN 6 HG2 GLN 6 64.268 -7.484 -7.484
38 2HG GLN 6 HG1 GLN 6 62.753 -8.370 -8.370
39 1HE2 GLN 6 HE22 GLN 6 64.214 -10.787 -10.787
40 2HE2 GLN 6 HE21 GLN 6 62.970 -10.368 -10.368
41 H GLN 7 HN GLN 7 60.811 -4.569 -4.569
42 HA GLN 7 HA GLN 7 60.963 -2.739 -2.739
43 1HB GLN 7 HB2 GLN 7 60.323 -2.713 -2.713
44 2HB GLN 7 HB1 GLN 7 59.611 -1.412 -1.412
45 1HG GLN 7 HG2 GLN 7 61.594 -0.346 -0.346
46 2HG GLN 7 HG1 GLN 7 62.302 -1.701 -1.701
47 1HE2 GLN 7 HE22 GLN 7 64.118 -2.852 -2.852
48 2HE2 GLN 7 HE21 GLN 7 63.838 -2.943 -2.943
49 H ALA 8 HN ALA 8 58.166 -3.533 -3.533
50 HA ALA 8 HA ALA 8 56.111 -2.498 -2.498
51 1HB ALA 8 HB2 ALA 8 56.182 -3.741 -3.741
52 2HB ALA 8 HB1 ALA 8 55.884 -5.189 -5.189
53 3HB ALA 8 HB3 ALA 8 54.720 -3.865 -3.865
54 H GLU 9 HN GLU 9 57.887 -5.522 -5.522
55 HA GLU 9 HA GLU 9 56.114 -6.406 -6.406
56 1HB GLU 9 HB2 GLU 9 57.068 -8.100 -8.100
57 2HB GLU 9 HB1 GLU 9 58.672 -7.375 -7.375
58 1HG GLU 9 HG2 GLU 9 59.132 -8.327 -8.327
59 2HG GLU 9 HG1 GLU 9 57.485 -8.103 -8.103
60 H ALA 10 HN ALA 10 59.065 -4.582 -4.582
61 HA ALA 10 HA ALA 10 59.972 -4.898 -4.898
62 1HB ALA 10 HB1 ALA 10 60.679 -3.029 -3.029
63 2HB ALA 10 HB3 ALA 10 61.561 -3.093 -3.093
64 3HB ALA 10 HB2 ALA 10 61.533 -4.502 -4.502
65 H ARG 11 HN ARG 11 58.303 -2.352 -2.352
66 HA ARG 11 HA ARG 11 58.120 -0.514 -0.514
67 1HB ARG 11 HB2 ARG 11 56.371 -0.568 -0.568
68 2HB ARG 11 HB1 ARG 11 56.926 0.835 0.835
69 1HG ARG 11 HG2 ARG 11 58.736 1.002 1.002
70 2HG ARG 11 HG1 ARG 11 59.220 -0.641 -0.641
71 1HD ARG 11 HD2 ARG 11 58.911 -0.793 -0.793
72 2HD ARG 11 HD1 ARG 11 57.328 -1.316 -1.316
73 HE ARG 11 HE ARG 11 57.882 1.220 1.220
74 1HH1 ARG 11 HH2 ARG 11 56.650 2.838 2.838
75 2HH1 ARG 11 HH2 ARG 11 54.969 2.433 2.433
76 1HH2 ARG 11 HH1 ARG 11 55.386 -0.744 -0.744
77 2HH2 ARG 11 HH1 ARG 11 54.254 0.405 0.405
78 H ALA 12 HN ALA 12 55.914 -2.846 -2.846
79 HA ALA 12 HA ALA 12 53.708 -2.218 -2.218
80 1HB ALA 12 HB2 ALA 12 54.016 -3.280 -3.280
81 2HB ALA 12 HB1 ALA 12 53.627 -4.705 -4.705
82 3HB ALA 12 HB3 ALA 12 52.523 -3.330 -3.330
83 H PHE 13 HN PHE 13 56.528 -3.699 -3.699
84 HA PHE 13 HA PHE 13 55.633 -6.196 -6.196
85 1HB PHE 13 HB2 PHE 13 57.855 -6.164 -6.164
86 2HB PHE 13 HB1 PHE 13 58.152 -4.548 -4.548
87 HD1 PHE 13 HD1 PHE 13 57.589 -8.099 -8.099
88 HD2 PHE 13 HD2 PHE 13 58.985 -4.227 -4.227
89 HE1 PHE 13 HE1 PHE 13 58.505 -9.089 -9.089
90 HE2 PHE 13 HE2 PHE 13 59.902 -5.216 -5.216
91 HZ PHE 13 HZ PHE 13 59.661 -7.647 -7.647
92 H LEU 14 HN LEU 14 56.097 -2.865 -2.865
93 HA LEU 14 HA LEU 14 55.280 -3.666 -3.666
94 1HB LEU 14 HB2 LEU 14 56.576 -1.395 -1.395
95 2HB LEU 14 HB1 LEU 14 57.464 -2.905 -2.905
96 HG LEU 14 HG LEU 14 57.775 -2.364 -2.364
97 HD1 LEU 14 HD1 LEU 14 56.170 0.023 0.023
98 HD1 LEU 14 HD1 LEU 14 56.059 -0.927 -0.927
99 HD1 LEU 14 HD1 LEU 14 57.383 0.217 0.217
100 HD2 LEU 14 HD2 LEU 14 58.772 0.048 0.048
101 HD2 LEU 14 HD2 LEU 14 59.649 -1.094 -1.094
102 HD2 LEU 14 HD2 LEU 14 59.243 -1.526 -1.526
103 H SER 15 HN SER 15 53.802 -2.230 -2.230
104 HA SER 15 HA SER 15 51.728 -1.104 -1.104
105 1HB SER 15 HB2 SER 15 52.432 0.066 0.066
106 2HB SER 15 HB1 SER 15 50.880 -0.532 -0.532
107 HG SER 15 HG SER 15 51.405 -2.495 -2.495
108 H GLU 16 HN GLU 16 51.133 1.362 1.362
109 HA GLU 16 HA GLU 16 53.112 2.900 2.900
110 1HB GLU 16 HB2 GLU 16 50.765 3.288 3.288
111 2HB GLU 16 HB1 GLU 16 50.494 3.521 3.521
112 1HG GLU 16 HG2 GLU 16 51.802 5.572 5.572
113 2HG GLU 16 HG1 GLU 16 52.237 5.316 5.316
114 H GLU 17 HN GLU 17 52.118 2.731 2.731
115 HA GLU 17 HA GLU 17 53.307 5.038 5.038
116 1HB GLU 17 HB2 GLU 17 53.166 2.196 2.196
117 2HB GLU 17 HB1 GLU 17 53.531 3.605 3.605
118 1HG GLU 17 HG2 GLU 17 51.048 3.520 3.520
119 2HG GLU 17 HG1 GLU 17 51.067 2.798 2.798
120 H MET 18 HN MET 18 54.854 1.948 1.948
121 HA MET 18 HA MET 18 57.469 2.645 2.645
122 1HB MET 18 HB2 MET 18 56.369 0.363 0.363
123 2HB MET 18 HB1 MET 18 56.894 0.726 0.726
124 1HG MET 18 HG2 MET 18 58.909 -0.118 -0.118
125 2HG MET 18 HG1 MET 18 59.125 1.298 1.298
126 1HE MET 18 HE1 MET 18 56.816 0.962 0.962
127 2HE MET 18 HE3 MET 18 57.627 0.155 0.155
128 3HE MET 18 HE2 MET 18 58.447 1.438 1.438
129 H ILE 19 HN ILE 19 56.190 2.484 2.484
130 HA ILE 19 HA ILE 19 58.347 3.420 3.420
131 HB ILE 19 HB ILE 19 55.408 4.154 4.154
132 1HG1 ILE 19 HG12 ILE 19 57.104 2.018 2.018
133 2HG1 ILE 19 HG11 ILE 19 55.845 1.750 1.750
134 1HG2 ILE 19 HG21 ILE 19 57.352 5.499 5.499
135 2HG2 ILE 19 HG23 ILE 19 57.146 4.138 4.138
136 3HG2 ILE 19 HG22 ILE 19 55.772 5.173 5.173
137 HD1 ILE 19 HD1 ILE 19 54.236 1.800 1.800
138 HD1 ILE 19 HD1 ILE 19 55.511 1.838 1.838
139 HD1 ILE 19 HD1 ILE 19 54.823 3.346 3.346
140 H ALA 20 HN ALA 20 56.115 5.362 5.362
141 HA ALA 20 HA ALA 20 57.290 7.921 7.921
142 1HB ALA 20 HB1 ALA 20 55.054 6.889 6.889
143 2HB ALA 20 HB3 ALA 20 55.948 7.834 7.834
144 3HB ALA 20 HB2 ALA 20 55.412 8.589 8.589
145 H GLU 21 HN GLU 21 58.002 5.436 5.436
146 HA GLU 21 HA GLU 21 59.550 7.074 7.074
147 1HB GLU 21 HB2 GLU 21 58.665 5.003 5.003
148 2HB GLU 21 HB1 GLU 21 59.298 4.124 4.124
149 1HG GLU 21 HG2 GLU 21 61.404 3.968 3.968
150 2HG GLU 21 HG1 GLU 21 61.304 5.548 5.548
151 H PHE 22 HN PHE 22 60.451 4.837 4.837
152 HA PHE 22 HA PHE 22 63.288 5.424 5.424
153 1HB PHE 22 HB2 PHE 22 61.613 4.241 4.241
154 2HB PHE 22 HB1 PHE 22 63.358 4.067 4.067
155 HD1 PHE 22 HD2 PHE 22 62.745 4.009 4.009
156 HD2 PHE 22 HD1 PHE 22 61.613 1.683 1.683
157 HE1 PHE 22 HE2 PHE 22 62.388 2.034 2.034
158 HE2 PHE 22 HE1 PHE 22 61.257 -0.291 -0.291
159 HZ PHE 22 HZ PHE 22 61.644 -0.116 -0.116
160 H LYS 23 HN LYS 23 60.595 7.032 7.032
161 HA LYS 23 HA LYS 23 61.829 8.301 8.301
162 1HB LYS 23 HB2 LYS 23 59.366 8.153 8.153
163 2HB LYS 23 HB1 LYS 23 59.752 9.545 9.545
164 1HG LYS 23 HG2 LYS 23 58.820 10.304 10.304
165 2HG LYS 23 HG1 LYS 23 60.516 10.776 10.776
166 1HD LYS 23 HD2 LYS 23 61.107 9.476 9.476
167 2HD LYS 23 HD1 LYS 23 60.156 8.112 8.112
168 1HE LYS 23 HE2 LYS 23 58.912 10.538 10.538
169 2HE LYS 23 HE1 LYS 23 59.338 9.049 9.049
170 1HZ LYS 23 HZ3 LYS 23 57.845 8.818 8.818
171 2HZ LYS 23 HZ2 LYS 23 56.996 9.316 9.316
172 3HZ LYS 23 HZ1 LYS 23 57.805 7.823 7.823
173 H ALA 24 HN ALA 24 61.150 9.774 9.774
174 HA ALA 24 HA ALA 24 62.817 12.057 12.057
175 1HB ALA 24 HB3 ALA 24 61.454 10.613 10.613
176 2HB ALA 24 HB2 ALA 24 62.734 11.731 11.731
177 3HB ALA 24 HB1 ALA 24 61.355 12.313 12.313
178 H ALA 25 HN ALA 25 63.540 8.789 8.789
179 HA ALA 25 HA ALA 25 66.226 9.490 9.490
180 1HB ALA 25 HB1 ALA 25 64.395 7.509 7.509
181 2HB ALA 25 HB3 ALA 25 65.524 6.679 6.679
182 3HB ALA 25 HB2 ALA 25 66.101 7.401 7.401
183 H PHE 26 HN PHE 26 64.780 8.066 8.066
184 HA PHE 26 HA PHE 26 67.212 7.167 7.167
185 1HB PHE 26 HB2 PHE 26 65.018 6.411 6.411
186 2HB PHE 26 HB1 PHE 26 64.516 8.062 8.062
187 HD1 PHE 26 HD2 PHE 26 65.413 9.254 9.254
188 HD2 PHE 26 HD1 PHE 26 66.496 5.183 5.183
189 HE1 PHE 26 HE2 PHE 26 66.309 9.021 9.021
190 HE2 PHE 26 HE1 PHE 26 67.393 4.950 4.950
191 HZ PHE 26 HZ PHE 26 67.299 6.870 6.870
192 H ASP 27 HN ASP 27 65.504 10.284 10.284
193 HA ASP 27 HA ASP 27 67.135 11.516 11.516
194 1HB ASP 27 HB2 ASP 27 64.859 12.072 12.072
195 2HB ASP 27 HB1 ASP 27 66.017 13.354 13.354
196 H MET 28 HN MET 28 67.937 10.508 10.508
197 HA MET 28 HA MET 28 69.438 12.609 12.609
198 1HB MET 28 HB2 MET 28 69.757 9.598 9.598
199 2HB MET 28 HB1 MET 28 70.760 10.626 10.626
200 1HG MET 28 HG2 MET 28 67.759 10.868 10.868
201 2HG MET 28 HG1 MET 28 68.579 9.622 9.622
202 1HE MET 28 HE2 MET 28 66.715 12.003 12.003
203 2HE MET 28 HE1 MET 28 67.255 11.125 11.125
204 3HE MET 28 HE3 MET 28 67.393 12.887 12.887
205 H PHE 29 HN PHE 29 70.039 10.836 10.836
206 HA PHE 29 HA PHE 29 72.804 12.004 12.004
207 1HB PHE 29 HB2 PHE 29 72.002 9.498 9.498
208 2HB PHE 29 HB1 PHE 29 73.594 9.980 9.980
209 HD1 PHE 29 HD2 PHE 29 70.327 8.555 8.555
210 HD2 PHE 29 HD1 PHE 29 74.255 9.625 9.625
211 HE1 PHE 29 HE2 PHE 29 69.949 7.268 7.268
212 HE2 PHE 29 HE1 PHE 29 73.876 8.337 8.337
213 HZ PHE 29 HZ PHE 29 71.722 7.159 7.159
214 H ASP 30 HN ASP 30 69.942 12.727 12.727
215 HA ASP 30 HA ASP 30 70.272 12.577 12.577
216 1HB ASP 30 HB2 ASP 30 68.244 13.103 13.103
217 2HB ASP 30 HB1 ASP 30 68.318 14.492 14.492
218 H ALA 31 HN ALA 31 72.477 13.709 13.709
219 HA ALA 31 HA ALA 31 73.063 16.275 16.275
220 1HB ALA 31 HB3 ALA 31 74.509 14.649 14.649
221 2HB ALA 31 HB2 ALA 31 73.669 15.118 15.118
222 3HB ALA 31 HB1 ALA 31 74.637 16.302 16.302
223 H ASP 32 HN ASP 32 71.171 15.386 15.386
224 HA ASP 32 HA ASP 32 70.571 18.281 18.281
225 1HB ASP 32 HB2 ASP 32 70.419 15.759 15.759
226 2HB ASP 32 HB1 ASP 32 69.727 17.288 17.288
227 H GLY 33 HN GLY 33 69.057 15.112 15.112
228 1HA GLY 33 HA2 GLY 33 66.984 14.905 14.905
229 2HA GLY 33 HA1 GLY 33 66.548 16.534 16.534
230 H GLY 34 HN GLY 34 67.847 14.093 14.093
231 1HA GLY 34 HA2 GLY 34 65.402 14.332 14.332
232 2HA GLY 34 HA1 GLY 34 66.902 13.542 13.542
233 H GLY 35 HN GLY 35 65.667 12.759 12.759
234 1HA GLY 35 HA2 GLY 35 64.576 10.837 10.837
235 2HA GLY 35 HA1 GLY 35 64.004 10.530 10.530
236 H ASP 36 HN ASP 36 67.395 11.006 11.006
237 HA ASP 36 HA ASP 36 67.945 8.097 8.097
238 1HB ASP 36 HB2 ASP 36 69.217 8.194 8.194
239 2HB ASP 36 HB1 ASP 36 67.488 8.477 8.477
240 H ILE 37 HN ILE 37 70.121 7.689 7.689
241 HA ILE 37 HA ILE 37 71.734 10.136 10.136
242 HB ILE 37 HB ILE 37 72.478 8.849 8.849
243 1HG1 ILE 37 HG12 ILE 37 70.619 6.716 6.716
244 2HG1 ILE 37 HG11 ILE 37 72.377 6.605 6.605
245 1HG2 ILE 37 HG22 ILE 37 70.383 10.205 10.205
246 2HG2 ILE 37 HG21 ILE 37 69.462 8.760 8.760
247 3HG2 ILE 37 HG23 ILE 37 70.356 8.826 8.826
248 HD1 ILE 37 HD1 ILE 37 71.131 7.325 7.325
249 HD1 ILE 37 HD1 ILE 37 72.316 6.068 6.068
250 HD1 ILE 37 HD1 ILE 37 70.598 5.756 5.756
251 H SER 38 HN SER 38 74.151 9.497 9.497
252 HA SER 38 HA SER 38 75.218 8.529 8.529
253 1HB SER 38 HB2 SER 38 76.168 9.775 9.775
254 2HB SER 38 HB1 SER 38 76.716 8.145 8.145
255 HG SER 38 HG SER 38 77.827 9.866 9.866
256 H THR 39 HN THR 39 75.663 6.465 6.465
257 HA THR 39 HA THR 39 74.443 4.156 4.156
258 HB THR 39 HB THR 39 76.269 3.034 3.034
259 HG1 THR 39 HG1 THR 39 77.586 5.049 5.049
260 1HG2 THR 39 HG23 THR 39 73.971 4.651 4.651
261 2HG2 THR 39 HG22 THR 39 75.171 4.805 4.805
262 3HG2 THR 39 HG21 THR 39 74.568 3.212 3.212
263 H LYS 40 HN LYS 40 77.470 5.692 5.692
264 HA LYS 40 HA LYS 40 78.587 3.388 3.388
265 1HB LYS 40 HB2 LYS 40 80.309 4.995 4.995
266 2HB LYS 40 HB1 LYS 40 79.843 5.296 5.296
267 1HG LYS 40 HG2 LYS 40 78.548 7.198 7.198
268 2HG LYS 40 HG1 LYS 40 78.551 6.774 6.774
269 1HD LYS 40 HD2 LYS 40 81.214 7.153 7.153
270 2HD LYS 40 HD1 LYS 40 80.236 8.605 8.605
271 1HE LYS 40 HE2 LYS 40 80.347 6.755 6.755
272 2HE LYS 40 HE1 LYS 40 81.832 7.656 7.656
273 1HZ LYS 40 HZ3 LYS 40 79.307 9.109 9.109
274 2HZ LYS 40 HZ2 LYS 40 79.857 8.727 8.727
275 3HZ LYS 40 HZ1 LYS 40 80.829 9.647 9.647
276 H GLU 41 HN GLU 41 76.083 5.554 5.554
277 HA GLU 41 HA GLU 41 76.475 5.288 5.288
278 1HB GLU 41 HB2 GLU 41 76.341 7.567 7.567
279 2HB GLU 41 HB1 GLU 41 74.766 7.173 7.173
280 1HG GLU 41 HG2 GLU 41 73.810 7.812 7.812
281 2HG GLU 41 HG1 GLU 41 74.630 6.472 6.472
282 H LEU 42 HN LEU 42 75.118 3.497 3.497
283 HA LEU 42 HA LEU 42 72.316 3.372 3.372
284 1HB LEU 42 HB2 LEU 42 73.314 2.627 2.627
285 2HB LEU 42 HB1 LEU 42 74.171 1.344 1.344
286 HG LEU 42 HG LEU 42 71.725 0.780 0.780
287 HD1 LEU 42 HD1 LEU 42 70.219 1.114 1.114
288 HD1 LEU 42 HD1 LEU 42 71.339 2.423 2.423
289 HD1 LEU 42 HD1 LEU 42 70.417 2.457 2.457
290 HD2 LEU 42 HD2 LEU 42 72.904 0.088 0.088
291 HD2 LEU 42 HD2 LEU 42 71.491 -0.730 -0.730
292 HD2 LEU 42 HD2 LEU 42 73.042 -0.830 -0.830
293 H GLY 43 HN GLY 43 75.234 1.634 1.634
294 1HA GLY 43 HA2 GLY 43 73.840 -0.319 -0.319
295 2HA GLY 43 HA1 GLY 43 75.541 0.113 0.113
296 H THR 44 HN THR 44 74.871 2.985 2.985
297 HA THR 44 HA THR 44 74.551 2.923 2.923
298 HB THR 44 HB THR 44 74.776 5.044 5.044
299 HG1 THR 44 HG1 THR 44 76.415 3.864 3.864
300 1HG2 THR 44 HG22 THR 44 73.339 5.894 5.894
301 2HG2 THR 44 HG21 THR 44 74.614 5.493 5.493
302 3HG2 THR 44 HG23 THR 44 74.889 6.729 6.729
303 H VAL 45 HN VAL 45 72.622 4.563 4.563
304 HA VAL 45 HA VAL 45 70.437 5.409 5.409
305 HB VAL 45 HB VAL 45 70.794 5.803 5.803
306 1HG1 VAL 45 HG12 VAL 45 70.050 2.879 2.879
307 2HG1 VAL 45 HG11 VAL 45 70.323 4.013 4.013
308 3HG1 VAL 45 HG13 VAL 45 71.655 3.564 3.564
309 1HG2 VAL 45 HG21 VAL 45 68.319 5.143 5.143
310 2HG2 VAL 45 HG23 VAL 45 68.581 6.194 6.194
311 3HG2 VAL 45 HG22 VAL 45 68.274 4.473 4.473
312 H MET 46 HN MET 46 70.961 2.103 2.103
313 HA MET 46 HA MET 46 68.421 1.129 1.129
314 1HB MET 46 HB2 MET 46 69.189 -0.981 -0.981
315 2HB MET 46 HB1 MET 46 69.599 0.300 0.300
316 1HG MET 46 HG2 MET 46 71.891 0.391 0.391
317 2HG MET 46 HG1 MET 46 71.463 -0.999 -0.999
318 1HE MET 46 HE2 MET 46 69.490 -2.481 -2.481
319 2HE MET 46 HE1 MET 46 70.555 -3.686 -3.686
320 3HE MET 46 HE3 MET 46 70.685 -3.300 -3.300
321 H ARG 47 HN ARG 47 71.872 0.799 0.799
322 HA ARG 47 HA ARG 47 71.331 -0.884 -0.884
323 1HB ARG 47 HB2 ARG 47 73.439 -0.686 -0.686
324 2HB ARG 47 HB1 ARG 47 73.779 0.800 0.800
325 1HG ARG 47 HG2 ARG 47 73.088 -1.563 -1.563
326 2HG ARG 47 HG1 ARG 47 74.639 -1.636 -1.636
327 1HD ARG 47 HD2 ARG 47 73.726 0.644 0.644
328 2HD ARG 47 HD1 ARG 47 74.921 -0.596 -0.596
329 HE ARG 47 HE ARG 47 75.697 0.531 0.531
330 1HH1 ARG 47 HH1 ARG 47 74.742 2.194 2.194
331 2HH1 ARG 47 HH1 ARG 47 76.241 3.035 3.035
332 1HH2 ARG 47 HH2 ARG 47 77.904 1.266 1.266
333 2HH2 ARG 47 HH2 ARG 47 78.031 2.509 2.509
334 H MET 48 HN MET 48 71.317 2.541 2.541
335 HA MET 48 HA MET 48 71.817 3.359 3.359
336 1HB MET 48 HB2 MET 48 72.264 4.714 4.714
337 2HB MET 48 HB1 MET 48 70.523 4.822 4.822
338 1HG MET 48 HG2 MET 48 71.323 5.556 5.556
339 2HG MET 48 HG1 MET 48 72.016 6.607 6.607
340 1HE MET 48 HE3 MET 48 69.920 6.382 6.382
341 2HE MET 48 HE2 MET 48 69.596 8.075 8.075
342 3HE MET 48 HE1 MET 48 68.275 6.911 6.911
343 H LEU 49 HN LEU 49 69.171 1.917 1.917
344 HA LEU 49 HA LEU 49 67.094 3.317 3.317
345 1HB LEU 49 HB2 LEU 49 67.049 0.946 0.946
346 2HB LEU 49 HB1 LEU 49 65.619 1.763 1.763
347 HG LEU 49 HG LEU 49 67.795 3.144 3.144
348 HD1 LEU 49 HD1 LEU 49 66.599 1.499 1.499
349 HD1 LEU 49 HD1 LEU 49 66.151 3.141 3.141
350 HD1 LEU 49 HD1 LEU 49 65.055 2.170 2.170
351 HD2 LEU 49 HD2 LEU 49 65.140 3.963 3.963
352 HD2 LEU 49 HD2 LEU 49 65.803 4.809 4.809
353 HD2 LEU 49 HD2 LEU 49 66.698 4.781 4.781
354 H GLY 50 HN GLY 50 68.402 -0.021 -0.021
355 1HA GLY 50 HA2 GLY 50 68.636 -0.619 -0.619
356 2HA GLY 50 HA1 GLY 50 66.914 -0.849 -0.849
357 H GLN 51 HN GLN 51 69.455 -1.540 -1.540
358 HA GLN 51 HA GLN 51 68.848 -4.460 -4.460
359 1HB GLN 51 HB2 GLN 51 69.449 -3.098 -3.098
360 2HB GLN 51 HB1 GLN 51 68.691 -4.667 -4.667
361 1HG GLN 51 HG2 GLN 51 67.508 -1.927 -1.927
362 2HG GLN 51 HG1 GLN 51 66.912 -3.199 -3.199
363 1HE2 GLN 51 HE22 GLN 51 66.027 -5.203 -5.203
364 2HE2 GLN 51 HE21 GLN 51 67.131 -5.430 -5.430
365 H ASN 52 HN ASN 52 70.694 -5.391 -5.391
366 HA ASN 52 HA ASN 52 73.325 -4.181 -4.181
367 1HB ASN 52 HB2 ASN 52 72.488 -5.590 -5.590
368 2HB ASN 52 HB1 ASN 52 72.829 -6.983 -6.983
369 HD2 ASN 52 HD2 ASN 52 74.243 -5.614 -5.614
370 HD2 ASN 52 HD2 ASN 52 75.873 -5.603 -5.603
371 HA PRO 53 HA PRO 53 72.986 -6.647 -6.647
372 1HB PRO 53 HB2 PRO 53 74.014 -4.712 -4.712
373 2HB PRO 53 HB1 PRO 53 72.293 -4.801 -4.801
374 1HG PRO 53 HG2 PRO 53 74.411 -3.015 -3.015
375 2HG PRO 53 HG1 PRO 53 72.700 -2.683 -2.683
376 1HD PRO 53 HD2 PRO 53 73.765 -3.186 -3.186
377 2HD PRO 53 HD1 PRO 53 72.060 -3.435 -3.435
378 H THR 54 HN THR 54 74.694 -8.060 -8.060
379 HA THR 54 HA THR 54 77.294 -7.651 -7.651
380 HB THR 54 HB THR 54 77.825 -9.670 -9.670
381 HG1 THR 54 HG1 THR 54 76.464 -10.340 -10.340
382 1HG2 THR 54 HG23 THR 54 75.261 -9.423 -9.423
383 2HG2 THR 54 HG22 THR 54 75.598 -10.943 -10.943
384 3HG2 THR 54 HG21 THR 54 76.714 -10.339 -10.339
385 H LYS 55 HN LYS 55 79.169 -6.779 -6.779
386 HA LYS 55 HA LYS 55 79.181 -4.808 -4.808
387 1HB LYS 55 HB2 LYS 55 81.006 -5.565 -5.565
388 2HB LYS 55 HB1 LYS 55 81.411 -6.814 -6.814
389 1HG LYS 55 HG2 LYS 55 82.532 -5.337 -5.337
390 2HG LYS 55 HG1 LYS 55 81.154 -4.236 -4.236
391 1HD LYS 55 HD2 LYS 55 82.362 -2.852 -2.852
392 2HD LYS 55 HD1 LYS 55 82.175 -4.037 -4.037
393 1HE LYS 55 HE2 LYS 55 84.246 -5.145 -5.145
394 2HE LYS 55 HE1 LYS 55 84.408 -4.106 -4.106
395 1HZ LYS 55 HZ3 LYS 55 84.239 -3.112 -3.112
396 2HZ LYS 55 HZ2 LYS 55 85.689 -3.279 -3.279
397 3HZ LYS 55 HZ1 LYS 55 84.504 -2.177 -2.177
398 H GLU 56 HN GLU 56 79.660 -8.308 -8.308
399 HA GLU 56 HA GLU 56 80.257 -8.263 -8.263
400 1HB GLU 56 HB2 GLU 56 79.760 -10.111 -10.111
401 2HB GLU 56 HB1 GLU 56 78.596 -10.503 -10.503
402 1HG GLU 56 HG2 GLU 56 80.234 -11.056 -11.056
403 2HG GLU 56 HG1 GLU 56 81.416 -9.954 -9.954
404 H GLU 57 HN GLU 57 77.152 -8.219 -8.219
405 HA GLU 57 HA GLU 57 75.460 -8.562 -8.562
406 1HB GLU 57 HB2 GLU 57 75.297 -7.860 -7.860
407 2HB GLU 57 HB1 GLU 57 74.060 -7.064 -7.064
408 1HG GLU 57 HG2 GLU 57 74.336 -9.809 -9.809
409 2HG GLU 57 HG1 GLU 57 74.071 -9.748 -9.748
410 H LEU 58 HN LEU 58 76.484 -5.610 -5.610
411 HA LEU 58 HA LEU 58 75.172 -3.691 -3.691
412 1HB LEU 58 HB2 LEU 58 77.907 -3.540 -3.540
413 2HB LEU 58 HB1 LEU 58 76.871 -2.170 -2.170
414 HG LEU 58 HG LEU 58 76.375 -4.331 -4.331
415 HD1 LEU 58 HD1 LEU 58 75.963 -2.193 -2.193
416 HD1 LEU 58 HD1 LEU 58 76.711 -1.331 -1.331
417 HD1 LEU 58 HD1 LEU 58 77.632 -2.543 -2.543
418 HD2 LEU 58 HD2 LEU 58 74.206 -4.181 -4.181
419 HD2 LEU 58 HD2 LEU 58 74.472 -2.627 -2.627
420 HD2 LEU 58 HD2 LEU 58 74.223 -2.699 -2.699
421 H ASP 59 HN ASP 59 78.570 -4.807 -4.807
422 HA ASP 59 HA ASP 59 79.221 -3.459 -3.459
423 1HB ASP 59 HB2 ASP 59 80.058 -5.977 -5.977
424 2HB ASP 59 HB1 ASP 59 80.685 -5.674 -5.674
425 H ALA 60 HN ALA 60 77.516 -6.547 -6.547
426 HA ALA 60 HA ALA 60 77.432 -7.283 -7.283
427 1HB ALA 60 HB1 ALA 60 76.374 -8.137 -8.137
428 2HB ALA 60 HB3 ALA 60 75.236 -8.421 -8.421
429 3HB ALA 60 HB2 ALA 60 76.856 -9.116 -9.116
430 H ILE 61 HN ILE 61 74.979 -5.795 -5.795
431 HA ILE 61 HA ILE 61 73.053 -5.346 -5.346
432 HB ILE 61 HB ILE 61 73.484 -4.109 -4.109
433 1HG1 ILE 61 HG12 ILE 61 71.237 -5.928 -5.928
434 2HG1 ILE 61 HG11 ILE 61 72.766 -6.709 -6.709
435 1HG2 ILE 61 HG21 ILE 61 71.390 -3.741 -3.741
436 2HG2 ILE 61 HG23 ILE 61 70.841 -3.879 -3.879
437 3HG2 ILE 61 HG22 ILE 61 71.975 -2.606 -2.606
438 HD1 ILE 61 HD1 ILE 61 73.317 -5.236 -5.236
439 HD1 ILE 61 HD1 ILE 61 73.115 -6.984 -6.984
440 HD1 ILE 61 HD1 ILE 61 71.736 -5.961 -5.961
441 H ILE 62 HN ILE 62 75.410 -3.199 -3.199
442 HA ILE 62 HA ILE 62 74.871 -0.751 -0.751
443 HB ILE 62 HB ILE 62 77.445 -2.176 -2.176
444 1HG1 ILE 62 HG12 ILE 62 75.980 0.133 0.133
445 2HG1 ILE 62 HG11 ILE 62 75.818 -1.553 -1.553
446 1HG2 ILE 62 HG22 ILE 62 77.036 0.680 0.680
447 2HG2 ILE 62 HG21 ILE 62 78.488 0.123 0.123
448 3HG2 ILE 62 HG23 ILE 62 78.064 -0.544 -0.544
449 HD1 ILE 62 HD1 ILE 62 78.155 -1.683 -1.683
450 HD1 ILE 62 HD1 ILE 62 77.497 -0.238 -0.238
451 HD1 ILE 62 HD1 ILE 62 78.470 -0.094 -0.094
452 H GLU 63 HN GLU 63 77.375 -2.966 -2.966
453 HA GLU 63 HA GLU 63 77.772 -1.762 -1.762
454 1HB GLU 63 HB2 GLU 63 79.117 -3.602 -3.602
455 2HB GLU 63 HB1 GLU 63 77.713 -4.668 -4.668
456 1HG GLU 63 HG2 GLU 63 77.455 -4.292 -4.292
457 2HG GLU 63 HG1 GLU 63 79.064 -3.568 -3.568
458 H GLU 64 HN GLU 64 75.221 -4.078 -4.078
459 HA GLU 64 HA GLU 64 74.066 -4.303 -4.303
460 1HB GLU 64 HB2 GLU 64 73.597 -6.022 -6.022
461 2HB GLU 64 HB1 GLU 64 73.246 -4.883 -4.883
462 1HG GLU 64 HG2 GLU 64 71.139 -4.297 -4.297
463 2HG GLU 64 HG1 GLU 64 71.535 -5.037 -5.037
464 H VAL 65 HN VAL 65 73.056 -2.460 -2.460
465 HA VAL 65 HA VAL 65 70.997 -1.004 -1.004
466 HB VAL 65 HB VAL 65 70.563 -0.029 -0.029
467 1HG1 VAL 65 HG13 VAL 65 69.981 -2.425 -2.425
468 2HG1 VAL 65 HG12 VAL 65 71.567 -2.869 -2.869
469 3HG1 VAL 65 HG11 VAL 65 70.404 -2.039 -2.039
470 1HG2 VAL 65 HG21 VAL 65 73.439 -0.569 -0.569
471 2HG2 VAL 65 HG23 VAL 65 72.434 0.677 0.677
472 3HG2 VAL 65 HG22 VAL 65 72.463 -0.949 -0.949
473 H ASP 66 HN ASP 66 74.321 -0.718 -0.718
474 HA ASP 66 HA ASP 66 74.708 2.117 2.117
475 1HB ASP 66 HB2 ASP 66 76.191 -0.261 -0.261
476 2HB ASP 66 HB1 ASP 66 76.605 0.910 0.910
477 H GLU 67 HN GLU 67 73.037 3.117 3.117
478 HA GLU 67 HA GLU 67 72.304 2.682 2.682
479 1HB GLU 67 HB2 GLU 67 72.261 4.783 4.783
480 2HB GLU 67 HB1 GLU 67 72.819 5.492 5.492
481 1HG GLU 67 HG2 GLU 67 70.734 3.769 3.769
482 2HG GLU 67 HG1 GLU 67 70.160 4.578 4.578
483 H ASP 68 HN ASP 68 73.668 2.193 2.193
484 HA ASP 68 HA ASP 68 76.415 3.026 3.026
485 1HB ASP 68 HB2 ASP 68 74.480 1.413 1.413
486 2HB ASP 68 HB1 ASP 68 75.360 2.403 2.403
487 H GLY 69 HN GLY 69 75.466 5.426 5.426
488 1HA GLY 69 HA2 GLY 69 76.201 7.130 7.130
489 2HA GLY 69 HA1 GLY 69 74.463 6.901 6.901
490 H SER 70 HN SER 70 73.593 6.782 6.782
491 HA SER 70 HA SER 70 73.901 9.604 9.604
492 1HB SER 70 HB2 SER 70 72.195 7.312 7.312
493 2HB SER 70 HB1 SER 70 72.012 9.001 9.001
494 HG SER 70 HG SER 70 71.723 9.409 9.409
495 H GLY 71 HN GLY 71 73.747 6.610 6.610
496 1HA GLY 71 HA2 GLY 71 75.676 5.886 5.886
497 2HA GLY 71 HA1 GLY 71 76.140 7.583 7.583
498 H THR 72 HN THR 72 72.770 7.039 7.039
499 HA THR 72 HA THR 72 72.904 7.169 7.169
500 HB THR 72 HB THR 72 70.924 8.719 8.719
501 HG1 THR 72 HG1 THR 72 70.081 8.655 8.655
502 1HG2 THR 72 HG22 THR 72 73.591 9.413 9.413
503 2HG2 THR 72 HG21 THR 72 72.331 10.623 10.623
504 3HG2 THR 72 HG23 THR 72 73.017 9.770 9.770
505 H ILE 73 HN ILE 73 71.180 6.087 6.087
506 HA ILE 73 HA ILE 73 69.875 3.952 3.952
507 HB ILE 73 HB ILE 73 71.074 3.516 3.516
508 1HG1 ILE 73 HG12 ILE 73 69.086 2.386 2.386
509 2HG1 ILE 73 HG11 ILE 73 68.087 3.058 3.058
510 1HG2 ILE 73 HG21 ILE 73 69.884 5.875 5.875
511 2HG2 ILE 73 HG23 ILE 73 68.964 4.649 4.649
512 3HG2 ILE 73 HG22 ILE 73 70.716 4.732 4.732
513 HD1 ILE 73 HD1 ILE 73 70.029 0.837 0.837
514 HD1 ILE 73 HD1 ILE 73 70.144 1.968 1.968
515 HD1 ILE 73 HD1 ILE 73 68.621 1.144 1.144
516 H ASP 74 HN ASP 74 67.589 3.701 3.701
517 HA ASP 74 HA ASP 74 66.049 6.207 6.207
518 1HB ASP 74 HB2 ASP 74 65.798 3.617 3.617
519 2HB ASP 74 HB1 ASP 74 64.323 4.522 4.522
520 H PHE 75 HN PHE 75 64.495 6.439 6.439
521 HA PHE 75 HA PHE 75 64.412 4.897 4.897
522 1HB PHE 75 HB2 PHE 75 63.385 7.190 7.190
523 2HB PHE 75 HB1 PHE 75 61.987 6.256 6.256
524 HD1 PHE 75 HD2 PHE 75 60.954 4.588 4.588
525 HD2 PHE 75 HD1 PHE 75 63.662 7.723 7.723
526 HE1 PHE 75 HE2 PHE 75 60.166 4.419 4.419
527 HE2 PHE 75 HE1 PHE 75 62.874 7.556 7.556
528 HZ PHE 75 HZ PHE 75 61.126 5.903 5.903
529 H GLU 76 HN GLU 76 62.023 4.716 4.716
530 HA GLU 76 HA GLU 76 60.524 2.529 2.529
531 1HB GLU 76 HB2 GLU 76 60.168 2.182 2.182
532 2HB GLU 76 HB1 GLU 76 59.742 3.755 3.755
533 1HG GLU 76 HG2 GLU 76 61.177 4.734 4.734
534 2HG GLU 76 HG1 GLU 76 62.507 3.850 3.850
535 H GLU 77 HN GLU 77 63.580 2.528 2.528
536 HA GLU 77 HA GLU 77 63.638 -0.399 -0.399
537 1HB GLU 77 HB2 GLU 77 64.554 1.110 1.110
538 2HB GLU 77 HB1 GLU 77 65.684 1.777 1.777
539 1HG GLU 77 HG2 GLU 77 66.756 -0.400 -0.400
540 2HG GLU 77 HG1 GLU 77 65.575 -1.141 -1.141
541 H PHE 78 HN PHE 78 65.114 2.113 2.113
542 HA PHE 78 HA PHE 78 67.040 0.441 0.441
543 1HB PHE 78 HB2 PHE 78 67.290 2.801 2.801
544 2HB PHE 78 HB1 PHE 78 65.619 3.038 3.038
545 HD1 PHE 78 HD1 PHE 78 68.768 1.323 1.323
546 HD2 PHE 78 HD2 PHE 78 65.165 3.355 3.355
547 HE1 PHE 78 HE1 PHE 78 69.480 1.231 1.231
548 HE2 PHE 78 HE2 PHE 78 65.878 3.261 3.261
549 HZ PHE 78 HZ PHE 78 68.034 2.200 2.200
550 H LEU 79 HN LEU 79 63.614 1.120 1.120
551 HA LEU 79 HA LEU 79 63.225 0.240 0.240
552 1HB LEU 79 HB2 LEU 79 61.729 0.312 0.312
553 2HB LEU 79 HB1 LEU 79 61.122 -0.883 -0.883
554 HG LEU 79 HG LEU 79 61.779 1.852 1.852
555 HD1 LEU 79 HD1 LEU 79 60.429 2.131 2.131
556 HD1 LEU 79 HD1 LEU 79 59.636 2.735 2.735
557 HD1 LEU 79 HD1 LEU 79 59.153 1.185 1.185
558 HD2 LEU 79 HD2 LEU 79 59.291 0.423 0.423
559 HD2 LEU 79 HD2 LEU 79 60.490 1.191 1.191
560 HD2 LEU 79 HD2 LEU 79 60.781 -0.429 -0.429
561 H VAL 80 HN VAL 80 64.020 -1.698 -1.698
562 HA VAL 80 HA VAL 80 63.400 -4.285 -4.285
563 HB VAL 80 HB VAL 80 64.675 -5.069 -5.069
564 1HG1 VAL 80 HG12 VAL 80 62.771 -2.897 -2.897
565 2HG1 VAL 80 HG11 VAL 80 63.903 -2.839 -2.839
566 3HG1 VAL 80 HG13 VAL 80 62.961 -4.300 -4.300
567 1HG2 VAL 80 HG21 VAL 80 66.023 -2.424 -2.424
568 2HG2 VAL 80 HG23 VAL 80 66.724 -3.998 -3.998
569 3HG2 VAL 80 HG22 VAL 80 65.900 -3.072 -3.072
570 H MET 81 HN MET 81 66.154 -2.117 -2.117
571 HA MET 81 HA MET 81 68.006 -4.087 -4.087
572 1HB MET 81 HB2 MET 81 67.809 -1.146 -1.146
573 2HB MET 81 HB1 MET 81 68.949 -1.684 -1.684
574 1HG MET 81 HG2 MET 81 68.869 -2.694 -2.694
575 2HG MET 81 HG1 MET 81 70.026 -1.521 -1.521
576 1HE MET 81 HE3 MET 81 71.843 -1.806 -1.806
577 2HE MET 81 HE2 MET 81 72.715 -3.305 -3.305
578 3HE MET 81 HE1 MET 81 72.422 -2.788 -2.788
579 H MET 82 HN MET 82 65.523 -1.998 -1.998
580 HA MET 82 HA MET 82 66.422 -2.355 -2.355
581 1HB MET 82 HB2 MET 82 63.901 -1.219 -1.219
582 2HB MET 82 HB1 MET 82 64.349 -1.052 -1.052
583 1HG MET 82 HG2 MET 82 66.580 -0.071 -0.071
584 2HG MET 82 HG1 MET 82 65.645 0.173 0.173
585 1HE MET 82 HE2 MET 82 63.135 0.934 0.934
586 2HE MET 82 HE1 MET 82 62.902 2.573 2.573
587 3HE MET 82 HE3 MET 82 64.139 2.245 2.245
588 H VAL 83 HN VAL 83 63.660 -3.457 -3.457
589 HA VAL 83 HA VAL 83 62.489 -5.118 -5.118
590 HB VAL 83 HB VAL 83 62.333 -5.014 -5.014
591 1HG1 VAL 83 HG11 VAL 83 60.637 -6.594 -6.594
592 2HG1 VAL 83 HG13 VAL 83 60.288 -6.402 -6.402
593 3HG1 VAL 83 HG12 VAL 83 61.733 -7.273 -7.273
594 1HG2 VAL 83 HG22 VAL 83 60.983 -3.691 -3.691
595 2HG2 VAL 83 HG21 VAL 83 61.207 -3.127 -3.127
596 3HG2 VAL 83 HG23 VAL 83 59.910 -4.260 -4.260
597 H ARG 84 HN ARG 84 64.126 -6.142 -6.142
598 HA ARG 84 HA ARG 84 64.475 -8.839 -8.839
599 1HB ARG 84 HB2 ARG 84 66.455 -6.837 -6.837
600 2HB ARG 84 HB1 ARG 84 66.530 -8.581 -8.581
601 1HG ARG 84 HG2 ARG 84 64.156 -8.419 -8.419
602 2HG ARG 84 HG1 ARG 84 64.371 -6.668 -6.668
603 1HD ARG 84 HD2 ARG 84 65.293 -6.932 -6.932
604 2HD ARG 84 HD1 ARG 84 66.694 -7.634 -7.634
605 HE ARG 84 HE ARG 84 64.366 -9.261 -9.261
606 1HH1 ARG 84 HH2 ARG 84 65.336 -11.283 -11.283
607 2HH1 ARG 84 HH2 ARG 84 66.840 -11.789 -11.789
608 1HH2 ARG 84 HH1 ARG 84 67.328 -8.837 -8.837
609 2HH2 ARG 84 HH1 ARG 84 67.968 -10.404 -10.404
610 H GLN 85 HN GLN 85 66.129 -6.166 -6.166
611 HA GLN 85 HA GLN 85 68.073 -7.952 -7.952
612 1HB GLN 85 HB2 GLN 85 68.731 -5.728 -5.728
613 2HB GLN 85 HB1 GLN 85 67.473 -4.982 -4.982
614 1HG GLN 85 HG2 GLN 85 69.649 -4.826 -4.826
615 2HG GLN 85 HG1 GLN 85 68.557 -5.877 -5.877
616 1HE2 GLN 85 HE22 GLN 85 71.428 -7.822 -7.822
617 2HE2 GLN 85 HE21 GLN 85 70.631 -6.484 -6.484
618 H MET 86 HN MET 86 65.216 -5.987 -5.987
619 HA MET 86 HA MET 86 65.325 -6.615 -6.615
620 1HB MET 86 HB2 MET 86 63.698 -5.106 -5.106
621 2HB MET 86 HB1 MET 86 62.732 -5.854 -5.854
622 1HG MET 86 HG2 MET 86 64.405 -4.898 -4.898
623 2HG MET 86 HG1 MET 86 65.060 -3.952 -3.952
624 1HE MET 86 HE3 MET 86 61.952 -5.324 -5.324
625 2HE MET 86 HE2 MET 86 61.761 -4.093 -4.093
626 3HE MET 86 HE1 MET 86 60.694 -4.090 -4.090
627 H LYS 87 HN LYS 87 64.055 -8.194 -8.194
628 HA LYS 87 HA LYS 87 61.950 -9.759 -9.759
629 1HB LYS 87 HB2 LYS 87 64.218 -10.214 -10.214
630 2HB LYS 87 HB1 LYS 87 63.038 -11.492 -11.492
631 1HG LYS 87 HG2 LYS 87 61.567 -9.092 -9.092
632 2HG LYS 87 HG1 LYS 87 62.766 -9.147 -9.147
633 1HD LYS 87 HD2 LYS 87 61.634 -11.772 -11.772
634 2HD LYS 87 HD1 LYS 87 60.339 -10.596 -10.596
635 1HE LYS 87 HE2 LYS 87 61.541 -9.744 -9.744
636 2HE LYS 87 HE1 LYS 87 62.713 -11.063 -11.063
637 1HZ LYS 87 HZ3 LYS 87 60.681 -12.558 -12.558
638 2HZ LYS 87 HZ2 LYS 87 59.803 -11.255 -11.255
639 3HZ LYS 87 HZ1 LYS 87 61.073 -11.953 -11.953
640 H GLU 88 HN GLU 88 65.370 -9.955 -9.955
641 HA GLU 88 HA GLU 88 65.010 -12.525 -12.525
642 1HB GLU 88 HB2 GLU 88 67.047 -11.292 -11.292
643 2HB GLU 88 HB1 GLU 88 67.643 -11.327 -11.327
644 1HG GLU 88 HG2 GLU 88 67.219 -13.723 -13.723
645 2HG GLU 88 HG1 GLU 88 66.495 -13.723 -13.723
646 H ASP 89 HN ASP 89 65.886 -9.112 -9.112
647 HA ASP 89 HA ASP 89 66.379 -9.396 -9.396
648 1HB ASP 89 HB2 ASP 89 66.016 -7.191 -7.191
649 2HB ASP 89 HB1 ASP 89 66.013 -6.794 -6.794
650 H ALA 90 HN ALA 90 63.553 -8.787 -8.787
651 HA ALA 90 HA ALA 90 61.860 -7.791 -7.791
652 1HB ALA 90 HB1 ALA 90 61.414 -8.898 -8.898
653 2HB ALA 90 HB3 ALA 90 60.093 -8.302 -8.302
654 3HB ALA 90 HB2 ALA 90 61.382 -7.208 -7.208
Start of MODEL 15
1 1H ALA 1 HT3 ALA 1 63.932 -6.872 -6.872
2 2H ALA 1 HT2 ALA 1 65.385 -7.080 -7.080
3 3H ALA 1 HT1 ALA 1 64.069 -8.110 -8.110
4 HA ALA 1 HA ALA 1 65.258 -9.476 -9.476
5 1HB ALA 1 HB2 ALA 1 66.546 -6.948 -6.948
6 2HB ALA 1 HB1 ALA 1 66.291 -7.691 -7.691
7 3HB ALA 1 HB3 ALA 1 67.186 -8.558 -8.558
8 H SER 2 HN SER 2 65.356 -9.461 -9.461
9 HA SER 2 HA SER 2 62.492 -9.455 -9.455
10 1HB SER 2 HB2 SER 2 63.837 -10.227 -10.227
11 2HB SER 2 HB1 SER 2 63.481 -11.322 -11.322
12 HG SER 2 HG SER 2 65.635 -11.485 -11.485
13 H MET 3 HN MET 3 65.259 -7.413 -7.413
14 HA MET 3 HA MET 3 64.666 -6.096 -6.096
15 1HB MET 3 HB2 MET 3 66.062 -5.437 -5.437
16 2HB MET 3 HB1 MET 3 65.844 -4.164 -4.164
17 1HG MET 3 HG2 MET 3 67.221 -5.195 -5.195
18 2HG MET 3 HG1 MET 3 66.885 -6.811 -6.811
19 1HE MET 3 HE3 MET 3 68.050 -3.394 -3.394
20 2HE MET 3 HE2 MET 3 69.455 -3.847 -3.847
21 3HE MET 3 HE1 MET 3 69.627 -3.609 -3.609
22 H THR 4 HN THR 4 63.812 -5.035 -5.035
23 HA THR 4 HA THR 4 62.200 -2.832 -2.832
24 HB THR 4 HB THR 4 62.972 -3.686 -3.686
25 HG1 THR 4 HG1 THR 4 61.419 -2.048 -2.048
26 1HG2 THR 4 HG22 THR 4 60.632 -5.550 -5.550
27 2HG2 THR 4 HG21 THR 4 61.360 -5.268 -5.268
28 3HG2 THR 4 HG23 THR 4 62.313 -6.000 -6.000
29 H ASP 5 HN ASP 5 61.462 -6.271 -6.271
30 HA ASP 5 HA ASP 5 58.589 -5.822 -5.822
31 1HB ASP 5 HB2 ASP 5 59.513 -7.792 -7.792
32 2HB ASP 5 HB1 ASP 5 60.363 -8.273 -8.273
33 H GLN 6 HN GLN 6 61.438 -6.822 -6.822
34 HA GLN 6 HA GLN 6 60.041 -7.149 -7.149
35 1HB GLN 6 HB2 GLN 6 62.402 -7.894 -7.894
36 2HB GLN 6 HB1 GLN 6 62.920 -6.306 -6.306
37 1HG GLN 6 HG2 GLN 6 63.253 -7.579 -7.579
38 2HG GLN 6 HG1 GLN 6 61.609 -6.997 -6.997
39 1HE2 GLN 6 HE22 GLN 6 62.172 -10.918 -10.918
40 2HE2 GLN 6 HE21 GLN 6 63.377 -9.765 -9.765
41 H GLN 7 HN GLN 7 60.733 -4.369 -4.369
42 HA GLN 7 HA GLN 7 61.266 -2.492 -2.492
43 1HB GLN 7 HB2 GLN 7 61.858 -2.196 -2.196
44 2HB GLN 7 HB1 GLN 7 60.141 -2.103 -2.103
45 1HG GLN 7 HG2 GLN 7 60.417 -0.264 -0.264
46 2HG GLN 7 HG1 GLN 7 61.901 -0.054 -0.054
47 1HE2 GLN 7 HE22 GLN 7 59.837 0.579 0.579
48 2HE2 GLN 7 HE21 GLN 7 60.990 -0.586 -0.586
49 H ALA 8 HN ALA 8 58.393 -3.962 -3.962
50 HA ALA 8 HA ALA 8 56.577 -1.918 -1.918
51 1HB ALA 8 HB2 ALA 8 56.336 -3.258 -3.258
52 2HB ALA 8 HB1 ALA 8 55.895 -4.625 -4.625
53 3HB ALA 8 HB3 ALA 8 54.908 -3.164 -3.164
54 H GLU 9 HN GLU 9 56.991 -5.460 -5.460
55 HA GLU 9 HA GLU 9 55.391 -5.609 -5.609
56 1HB GLU 9 HB2 GLU 9 56.089 -7.430 -7.430
57 2HB GLU 9 HB1 GLU 9 57.655 -7.436 -7.436
58 1HG GLU 9 HG2 GLU 9 55.610 -7.524 -7.524
59 2HG GLU 9 HG1 GLU 9 55.266 -8.770 -8.770
60 H ALA 10 HN ALA 10 58.451 -4.243 -4.243
61 HA ALA 10 HA ALA 10 59.737 -5.004 -5.004
62 1HB ALA 10 HB2 ALA 10 60.173 -3.314 -3.314
63 2HB ALA 10 HB1 ALA 10 60.759 -2.548 -2.548
64 3HB ALA 10 HB3 ALA 10 61.357 -4.142 -4.142
65 H ARG 11 HN ARG 11 57.492 -2.448 -2.448
66 HA ARG 11 HA ARG 11 57.834 -1.027 -1.027
67 1HB ARG 11 HB2 ARG 11 55.704 -0.448 -0.448
68 2HB ARG 11 HB1 ARG 11 56.616 0.681 0.681
69 1HG ARG 11 HG2 ARG 11 57.878 1.037 1.037
70 2HG ARG 11 HG1 ARG 11 58.594 -0.539 -0.539
71 1HD ARG 11 HD2 ARG 11 57.492 -1.548 -1.548
72 2HD ARG 11 HD1 ARG 11 56.006 -0.621 -0.621
73 HE ARG 11 HE ARG 11 58.303 0.926 0.926
74 1HH1 ARG 11 HH2 ARG 11 55.007 0.409 0.409
75 2HH1 ARG 11 HH2 ARG 11 54.867 0.670 0.670
76 1HH2 ARG 11 HH1 ARG 11 58.290 0.768 0.768
77 2HH2 ARG 11 HH1 ARG 11 56.724 0.873 0.873
78 H ALA 12 HN ALA 12 55.441 -3.040 -3.040
79 HA ALA 12 HA ALA 12 53.211 -2.791 -2.791
80 1HB ALA 12 HB3 ALA 12 53.822 -4.221 -4.221
81 2HB ALA 12 HB2 ALA 12 54.097 -5.489 -5.489
82 3HB ALA 12 HB1 ALA 12 52.512 -4.725 -4.725
83 H PHE 13 HN PHE 13 56.292 -4.302 -4.302
84 HA PHE 13 HA PHE 13 55.604 -6.105 -6.105
85 1HB PHE 13 HB2 PHE 13 57.828 -5.889 -5.889
86 2HB PHE 13 HB1 PHE 13 58.001 -4.271 -4.271
87 HD1 PHE 13 HD1 PHE 13 56.664 -7.440 -7.440
88 HD2 PHE 13 HD2 PHE 13 59.670 -4.375 -4.375
89 HE1 PHE 13 HE1 PHE 13 57.551 -8.417 -8.417
90 HE2 PHE 13 HE2 PHE 13 60.557 -5.353 -5.353
91 HZ PHE 13 HZ PHE 13 59.497 -7.374 -7.374
92 H LEU 14 HN LEU 14 56.499 -2.643 -2.643
93 HA LEU 14 HA LEU 14 55.373 -2.636 -2.636
94 1HB LEU 14 HB2 LEU 14 57.080 -0.560 -0.560
95 2HB LEU 14 HB1 LEU 14 56.824 -0.745 -0.745
96 HG LEU 14 HG LEU 14 58.226 -2.741 -2.741
97 HD1 LEU 14 HD1 LEU 14 60.247 -1.977 -1.977
98 HD1 LEU 14 HD1 LEU 14 59.483 -1.287 -1.287
99 HD1 LEU 14 HD1 LEU 14 59.337 -0.471 -0.471
100 HD2 LEU 14 HD2 LEU 14 57.299 -2.787 -2.787
101 HD2 LEU 14 HD2 LEU 14 58.829 -3.573 -3.573
102 HD2 LEU 14 HD2 LEU 14 57.341 -4.094 -4.094
103 H SER 15 HN SER 15 53.698 -1.189 -1.189
104 HA SER 15 HA SER 15 51.997 -0.271 -0.271
105 1HB SER 15 HB2 SER 15 52.077 -0.020 -0.020
106 2HB SER 15 HB1 SER 15 50.844 0.817 0.817
107 HG SER 15 HG SER 15 50.191 -1.171 -1.171
108 H GLU 16 HN GLU 16 51.153 2.170 2.170
109 HA GLU 16 HA GLU 16 53.209 3.923 3.923
110 1HB GLU 16 HB2 GLU 16 50.888 4.308 4.308
111 2HB GLU 16 HB1 GLU 16 50.462 4.336 4.336
112 1HG GLU 16 HG2 GLU 16 52.536 6.268 6.268
113 2HG GLU 16 HG1 GLU 16 51.205 6.535 6.535
114 H GLU 17 HN GLU 17 52.003 3.190 3.190
115 HA GLU 17 HA GLU 17 53.036 5.410 5.410
116 1HB GLU 17 HB2 GLU 17 51.517 3.768 3.768
117 2HB GLU 17 HB1 GLU 17 52.699 2.480 2.480
118 1HG GLU 17 HG2 GLU 17 54.246 4.036 4.036
119 2HG GLU 17 HG1 GLU 17 52.708 4.706 4.706
120 H MET 18 HN MET 18 54.561 2.166 2.166
121 HA MET 18 HA MET 18 57.111 3.018 3.018
122 1HB MET 18 HB2 MET 18 56.298 0.696 0.696
123 2HB MET 18 HB1 MET 18 56.296 0.702 0.702
124 1HG MET 18 HG2 MET 18 58.332 -0.386 -0.386
125 2HG MET 18 HG1 MET 18 58.741 1.115 1.115
126 1HE MET 18 HE3 MET 18 57.551 -0.441 -0.441
127 2HE MET 18 HE2 MET 18 58.735 -0.096 -0.096
128 3HE MET 18 HE1 MET 18 57.372 0.993 0.993
129 H ILE 19 HN ILE 19 55.994 2.410 2.410
130 HA ILE 19 HA ILE 19 58.270 2.930 2.930
131 HB ILE 19 HB ILE 19 55.375 3.725 3.725
132 1HG1 ILE 19 HG12 ILE 19 57.073 1.729 1.729
133 2HG1 ILE 19 HG11 ILE 19 56.178 1.305 1.305
134 1HG2 ILE 19 HG23 ILE 19 57.662 4.716 4.716
135 2HG2 ILE 19 HG22 ILE 19 56.615 3.752 3.752
136 3HG2 ILE 19 HG21 ILE 19 55.958 5.139 5.139
137 HD1 ILE 19 HD1 ILE 19 54.159 1.378 1.378
138 HD1 ILE 19 HD1 ILE 19 55.134 1.136 1.136
139 HD1 ILE 19 HD1 ILE 19 54.620 2.760 2.760
140 H ALA 20 HN ALA 20 56.196 5.328 5.328
141 HA ALA 20 HA ALA 20 57.558 7.658 7.658
142 1HB ALA 20 HB1 ALA 20 55.256 7.114 7.114
143 2HB ALA 20 HB3 ALA 20 56.262 7.752 7.752
144 3HB ALA 20 HB2 ALA 20 55.949 8.730 8.730
145 H GLU 21 HN GLU 21 58.018 5.569 5.569
146 HA GLU 21 HA GLU 21 59.825 7.192 7.192
147 1HB GLU 21 HB2 GLU 21 58.781 5.194 5.194
148 2HB GLU 21 HB1 GLU 21 59.525 4.193 4.193
149 1HG GLU 21 HG2 GLU 21 61.501 4.080 4.080
150 2HG GLU 21 HG1 GLU 21 61.460 5.792 5.792
151 H PHE 22 HN PHE 22 60.427 4.780 4.780
152 HA PHE 22 HA PHE 22 63.304 5.062 5.062
153 1HB PHE 22 HB2 PHE 22 61.321 4.088 4.088
154 2HB PHE 22 HB1 PHE 22 63.064 3.846 3.846
155 HD1 PHE 22 HD2 PHE 22 62.393 3.785 3.785
156 HD2 PHE 22 HD1 PHE 22 61.792 1.405 1.405
157 HE1 PHE 22 HE2 PHE 22 62.194 1.751 1.751
158 HE2 PHE 22 HE1 PHE 22 61.593 -0.626 -0.626
159 HZ PHE 22 HZ PHE 22 61.794 -0.454 -0.454
160 H LYS 23 HN LYS 23 60.684 6.805 6.805
161 HA LYS 23 HA LYS 23 62.117 8.094 8.094
162 1HB LYS 23 HB2 LYS 23 59.588 7.959 7.959
163 2HB LYS 23 HB1 LYS 23 59.921 9.369 9.369
164 1HG LYS 23 HG2 LYS 23 59.184 10.178 10.178
165 2HG LYS 23 HG1 LYS 23 60.920 10.476 10.476
166 1HD LYS 23 HD2 LYS 23 61.443 8.748 8.748
167 2HD LYS 23 HD1 LYS 23 59.920 7.907 7.907
168 1HE LYS 23 HE2 LYS 23 59.238 10.475 10.475
169 2HE LYS 23 HE1 LYS 23 60.518 9.829 9.829
170 1HZ LYS 23 HZ3 LYS 23 59.246 7.657 7.657
171 2HZ LYS 23 HZ2 LYS 23 57.947 8.561 8.561
172 3HZ LYS 23 HZ1 LYS 23 58.547 8.883 8.883
173 H ALA 24 HN ALA 24 61.108 9.655 9.655
174 HA ALA 24 HA ALA 24 62.849 11.872 11.872
175 1HB ALA 24 HB3 ALA 24 60.895 11.390 11.390
176 2HB ALA 24 HB2 ALA 24 62.012 10.411 10.411
177 3HB ALA 24 HB1 ALA 24 62.299 12.141 12.141
178 H ALA 25 HN ALA 25 63.490 8.555 8.555
179 HA ALA 25 HA ALA 25 66.083 9.142 9.142
180 1HB ALA 25 HB3 ALA 25 64.637 6.619 6.619
181 2HB ALA 25 HB2 ALA 25 66.172 6.617 6.617
182 3HB ALA 25 HB1 ALA 25 64.726 7.279 7.279
183 H PHE 26 HN PHE 26 64.892 7.873 7.873
184 HA PHE 26 HA PHE 26 67.484 7.246 7.246
185 1HB PHE 26 HB2 PHE 26 65.548 6.233 6.233
186 2HB PHE 26 HB1 PHE 26 64.712 7.779 7.779
187 HD1 PHE 26 HD2 PHE 26 65.679 9.535 9.535
188 HD2 PHE 26 HD1 PHE 26 66.861 5.405 5.405
189 HE1 PHE 26 HE2 PHE 26 66.575 9.811 9.811
190 HE2 PHE 26 HE1 PHE 26 67.756 5.683 5.683
191 HZ PHE 26 HZ PHE 26 67.615 7.886 7.886
192 H ASP 27 HN ASP 27 65.412 10.137 10.137
193 HA ASP 27 HA ASP 27 66.868 11.653 11.653
194 1HB ASP 27 HB2 ASP 27 64.803 11.991 11.991
195 2HB ASP 27 HB1 ASP 27 65.838 13.417 13.417
196 H MET 28 HN MET 28 67.766 10.648 10.648
197 HA MET 28 HA MET 28 69.314 12.748 12.748
198 1HB MET 28 HB2 MET 28 69.581 9.741 9.741
199 2HB MET 28 HB1 MET 28 70.726 10.744 10.744
200 1HG MET 28 HG2 MET 28 67.927 11.488 11.488
201 2HG MET 28 HG1 MET 28 68.303 9.841 9.841
202 1HE MET 28 HE3 MET 28 70.203 9.150 9.150
203 2HE MET 28 HE2 MET 28 70.518 9.990 9.990
204 3HE MET 28 HE1 MET 28 68.871 9.517 9.517
205 H PHE 29 HN PHE 29 69.926 10.734 10.734
206 HA PHE 29 HA PHE 29 72.559 12.132 12.132
207 1HB PHE 29 HB2 PHE 29 71.949 9.394 9.394
208 2HB PHE 29 HB1 PHE 29 73.513 10.097 10.097
209 HD1 PHE 29 HD2 PHE 29 70.437 8.569 8.569
210 HD2 PHE 29 HD1 PHE 29 74.361 10.062 10.062
211 HE1 PHE 29 HE2 PHE 29 70.306 7.542 7.542
212 HE2 PHE 29 HE1 PHE 29 74.232 9.035 9.035
213 HZ PHE 29 HZ PHE 29 72.205 7.774 7.774
214 H ASP 30 HN ASP 30 70.144 13.198 13.198
215 HA ASP 30 HA ASP 30 69.482 12.347 12.347
216 1HB ASP 30 HB2 ASP 30 68.433 14.595 14.595
217 2HB ASP 30 HB1 ASP 30 68.097 13.793 13.793
218 H ALA 31 HN ALA 31 71.543 12.016 12.016
219 HA ALA 31 HA ALA 31 73.561 14.053 14.053
220 1HB ALA 31 HB3 ALA 31 72.881 11.404 11.404
221 2HB ALA 31 HB2 ALA 31 73.705 12.416 12.416
222 3HB ALA 31 HB1 ALA 31 74.465 12.085 12.085
223 H ASP 32 HN ASP 32 70.626 13.293 13.293
224 HA ASP 32 HA ASP 32 71.247 15.367 15.367
225 1HB ASP 32 HB2 ASP 32 69.477 13.015 13.015
226 2HB ASP 32 HB1 ASP 32 68.772 14.353 14.353
227 H GLY 33 HN GLY 33 69.628 15.058 15.058
228 1HA GLY 33 HA2 GLY 33 68.889 17.277 17.277
229 2HA GLY 33 HA1 GLY 33 68.034 17.524 17.524
230 H GLY 34 HN GLY 34 67.386 14.516 14.516
231 1HA GLY 34 HA2 GLY 34 65.951 13.541 13.541
232 2HA GLY 34 HA1 GLY 34 64.889 14.845 14.845
233 H GLY 35 HN GLY 35 66.040 11.654 11.654
234 1HA GLY 35 HA2 GLY 35 63.970 10.677 10.677
235 2HA GLY 35 HA1 GLY 35 64.828 11.602 11.602
236 H ASP 36 HN ASP 36 67.482 11.081 11.081
237 HA ASP 36 HA ASP 36 67.828 8.162 8.162
238 1HB ASP 36 HB2 ASP 36 69.155 8.242 8.242
239 2HB ASP 36 HB1 ASP 36 67.429 8.536 8.536
240 H ILE 37 HN ILE 37 69.532 7.882 7.882
241 HA ILE 37 HA ILE 37 71.490 10.089 10.089
242 HB ILE 37 HB ILE 37 72.037 8.853 8.853
243 1HG1 ILE 37 HG12 ILE 37 70.037 6.756 6.756
244 2HG1 ILE 37 HG11 ILE 37 71.766 6.587 6.587
245 1HG2 ILE 37 HG23 ILE 37 69.422 9.803 9.803
246 2HG2 ILE 37 HG22 ILE 37 69.246 8.419 8.419
247 3HG2 ILE 37 HG21 ILE 37 70.205 9.812 9.812
248 HD1 ILE 37 HD1 ILE 37 72.237 6.153 6.153
249 HD1 ILE 37 HD1 ILE 37 70.524 5.748 5.748
250 HD1 ILE 37 HD1 ILE 37 71.083 7.351 7.351
251 H SER 38 HN SER 38 73.839 9.425 9.425
252 HA SER 38 HA SER 38 74.808 8.165 8.165
253 1HB SER 38 HB2 SER 38 76.442 9.389 9.389
254 2HB SER 38 HB1 SER 38 75.820 9.032 9.032
255 HG SER 38 HG SER 38 77.929 8.040 8.040
256 H THR 39 HN THR 39 74.743 6.037 6.037
257 HA THR 39 HA THR 39 73.703 3.893 3.893
258 HB THR 39 HB THR 39 75.123 2.518 2.518
259 HG1 THR 39 HG1 THR 39 76.990 3.687 3.687
260 1HG2 THR 39 HG22 THR 39 73.220 4.568 4.568
261 2HG2 THR 39 HG21 THR 39 74.397 4.439 4.439
262 3HG2 THR 39 HG23 THR 39 73.483 3.019 3.019
263 H LYS 40 HN LYS 40 76.884 5.348 5.348
264 HA LYS 40 HA LYS 40 78.136 3.194 3.194
265 1HB LYS 40 HB2 LYS 40 78.573 6.109 6.109
266 2HB LYS 40 HB1 LYS 40 79.505 5.355 5.355
267 1HG LYS 40 HG2 LYS 40 80.546 3.834 3.834
268 2HG LYS 40 HG1 LYS 40 79.329 4.076 4.076
269 1HD LYS 40 HD2 LYS 40 80.142 6.505 6.505
270 2HD LYS 40 HD1 LYS 40 81.524 5.972 5.972
271 1HE LYS 40 HE2 LYS 40 81.728 4.090 4.090
272 2HE LYS 40 HE1 LYS 40 80.785 5.226 5.226
273 1HZ LYS 40 HZ3 LYS 40 83.195 6.004 6.004
274 2HZ LYS 40 HZ2 LYS 40 83.238 5.587 5.587
275 3HZ LYS 40 HZ1 LYS 40 82.355 6.944 6.944
276 H GLU 41 HN GLU 41 75.727 5.504 5.504
277 HA GLU 41 HA GLU 41 76.293 5.408 5.408
278 1HB GLU 41 HB2 GLU 41 75.646 7.504 7.504
279 2HB GLU 41 HB1 GLU 41 74.138 6.750 6.750
280 1HG GLU 41 HG2 GLU 41 73.406 7.829 7.829
281 2HG GLU 41 HG1 GLU 41 73.880 6.277 6.277
282 H LEU 42 HN LEU 42 74.516 3.663 3.663
283 HA LEU 42 HA LEU 42 72.101 2.922 2.922
284 1HB LEU 42 HB2 LEU 42 73.755 2.064 2.064
285 2HB LEU 42 HB1 LEU 42 73.765 0.670 0.670
286 HG LEU 42 HG LEU 42 71.081 1.699 1.699
287 HD1 LEU 42 HD1 LEU 42 72.312 0.828 0.828
288 HD1 LEU 42 HD1 LEU 42 72.026 2.518 2.518
289 HD1 LEU 42 HD1 LEU 42 70.667 1.402 1.402
290 HD2 LEU 42 HD2 LEU 42 71.561 -0.827 -0.827
291 HD2 LEU 42 HD2 LEU 42 70.727 -0.520 -0.520
292 HD2 LEU 42 HD2 LEU 42 72.476 -0.750 -0.750
293 H GLY 43 HN GLY 43 75.338 1.877 1.877
294 1HA GLY 43 HA2 GLY 43 74.443 -0.143 -0.143
295 2HA GLY 43 HA1 GLY 43 76.022 0.641 0.641
296 H THR 44 HN THR 44 75.154 3.324 3.324
297 HA THR 44 HA THR 44 74.769 3.408 3.408
298 HB THR 44 HB THR 44 74.501 5.507 5.507
299 HG1 THR 44 HG1 THR 44 76.669 5.968 5.968
300 1HG2 THR 44 HG23 THR 44 73.424 6.186 6.186
301 2HG2 THR 44 HG22 THR 44 74.917 5.819 5.819
302 3HG2 THR 44 HG21 THR 44 74.882 7.129 7.129
303 H VAL 45 HN VAL 45 72.606 4.366 4.366
304 HA VAL 45 HA VAL 45 70.332 5.064 5.064
305 HB VAL 45 HB VAL 45 70.730 5.373 5.373
306 1HG1 VAL 45 HG13 VAL 45 70.214 2.391 2.391
307 2HG1 VAL 45 HG12 VAL 45 70.070 3.382 3.382
308 3HG1 VAL 45 HG11 VAL 45 71.625 3.240 3.240
309 1HG2 VAL 45 HG21 VAL 45 68.442 5.538 5.538
310 2HG2 VAL 45 HG23 VAL 45 68.413 5.037 5.037
311 3HG2 VAL 45 HG22 VAL 45 68.182 3.842 3.842
312 H MET 46 HN MET 46 71.580 1.878 1.878
313 HA MET 46 HA MET 46 69.153 0.441 0.441
314 1HB MET 46 HB2 MET 46 71.994 -0.218 -0.218
315 2HB MET 46 HB1 MET 46 70.930 -1.479 -1.479
316 1HG MET 46 HG2 MET 46 69.356 -1.149 -1.149
317 2HG MET 46 HG1 MET 46 70.166 0.328 0.328
318 1HE MET 46 HE3 MET 46 69.216 -2.639 -2.639
319 2HE MET 46 HE2 MET 46 70.354 -3.362 -3.362
320 3HE MET 46 HE1 MET 46 70.430 -3.790 -3.790
321 H ARG 47 HN ARG 47 72.405 0.883 0.883
322 HA ARG 47 HA ARG 47 71.780 -0.541 -0.541
323 1HB ARG 47 HB2 ARG 47 73.946 1.136 1.136
324 2HB ARG 47 HB1 ARG 47 73.905 1.026 1.026
325 1HG ARG 47 HG2 ARG 47 73.675 -1.522 -1.522
326 2HG ARG 47 HG1 ARG 47 74.198 -1.206 -1.206
327 1HD ARG 47 HD2 ARG 47 76.048 0.236 0.236
328 2HD ARG 47 HD1 ARG 47 75.774 -1.163 -1.163
329 HE ARG 47 HE ARG 47 76.081 -1.816 -1.816
330 1HH1 ARG 47 HH2 ARG 47 77.761 -1.050 -1.050
331 2HH1 ARG 47 HH2 ARG 47 79.026 -2.204 -2.204
332 1HH2 ARG 47 HH1 ARG 47 77.620 -3.474 -3.474
333 2HH2 ARG 47 HH1 ARG 47 78.946 -3.577 -3.577
334 H MET 48 HN MET 48 71.614 2.857 2.857
335 HA MET 48 HA MET 48 71.193 3.967 3.967
336 1HB MET 48 HB2 MET 48 70.763 4.792 4.792
337 2HB MET 48 HB1 MET 48 70.147 5.814 5.814
338 1HG MET 48 HG2 MET 48 73.002 4.829 4.829
339 2HG MET 48 HG1 MET 48 72.525 6.321 6.321
340 1HE MET 48 HE1 MET 48 74.612 5.792 5.792
341 2HE MET 48 HE3 MET 48 74.300 6.447 6.447
342 3HE MET 48 HE2 MET 48 73.751 4.826 4.826
343 H LEU 49 HN LEU 49 69.237 1.929 1.929
344 HA LEU 49 HA LEU 49 66.690 3.094 3.094
345 1HB LEU 49 HB2 LEU 49 67.434 0.954 0.954
346 2HB LEU 49 HB1 LEU 49 65.765 1.280 1.280
347 HG LEU 49 HG LEU 49 67.643 3.407 3.407
348 HD1 LEU 49 HD1 LEU 49 67.277 1.713 1.713
349 HD1 LEU 49 HD1 LEU 49 66.371 3.176 3.176
350 HD1 LEU 49 HD1 LEU 49 65.536 1.776 1.776
351 HD2 LEU 49 HD2 LEU 49 65.656 4.083 4.083
352 HD2 LEU 49 HD2 LEU 49 64.617 3.343 3.343
353 HD2 LEU 49 HD2 LEU 49 65.627 4.725 4.725
354 H GLY 50 HN GLY 50 68.611 0.082 0.082
355 1HA GLY 50 HA2 GLY 50 68.375 -0.719 -0.719
356 2HA GLY 50 HA1 GLY 50 66.734 -1.046 -1.046
357 H GLN 51 HN GLN 51 68.107 -1.612 -1.612
358 HA GLN 51 HA GLN 51 68.324 -4.504 -4.504
359 1HB GLN 51 HB2 GLN 51 68.888 -2.925 -2.925
360 2HB GLN 51 HB1 GLN 51 68.309 -4.587 -4.587
361 1HG GLN 51 HG2 GLN 51 66.222 -3.759 -3.759
362 2HG GLN 51 HG1 GLN 51 66.430 -3.096 -3.096
363 1HE2 GLN 51 HE22 GLN 51 67.378 -0.518 -0.518
364 2HE2 GLN 51 HE21 GLN 51 67.893 -2.133 -2.133
365 H ASN 52 HN ASN 52 70.276 -5.487 -5.487
366 HA ASN 52 HA ASN 52 72.807 -4.009 -4.009
367 1HB ASN 52 HB2 ASN 52 71.719 -5.984 -5.984
368 2HB ASN 52 HB1 ASN 52 73.052 -6.758 -6.758
369 HD2 ASN 52 HD2 ASN 52 75.157 -6.243 -6.243
370 HD2 ASN 52 HD2 ASN 52 75.525 -5.005 -5.005
371 HA PRO 53 HA PRO 53 72.793 -6.350 -6.350
372 1HB PRO 53 HB2 PRO 53 73.998 -4.368 -4.368
373 2HB PRO 53 HB1 PRO 53 72.244 -4.439 -4.439
374 1HG PRO 53 HG2 PRO 53 74.297 -2.767 -2.767
375 2HG PRO 53 HG1 PRO 53 72.640 -2.360 -2.360
376 1HD PRO 53 HD2 PRO 53 73.382 -2.985 -2.985
377 2HD PRO 53 HD1 PRO 53 71.743 -3.231 -3.231
378 H THR 54 HN THR 54 74.561 -7.563 -7.563
379 HA THR 54 HA THR 54 77.055 -7.379 -7.379
380 HB THR 54 HB THR 54 77.550 -9.221 -9.221
381 HG1 THR 54 HG1 THR 54 75.397 -10.100 -10.100
382 1HG2 THR 54 HG22 THR 54 75.746 -9.301 -9.301
383 2HG2 THR 54 HG21 THR 54 75.939 -10.753 -10.753
384 3HG2 THR 54 HG23 THR 54 77.345 -10.014 -10.014
385 H LYS 55 HN LYS 55 79.069 -6.662 -6.662
386 HA LYS 55 HA LYS 55 79.291 -4.537 -4.537
387 1HB LYS 55 HB2 LYS 55 80.967 -5.893 -5.893
388 2HB LYS 55 HB1 LYS 55 81.455 -6.603 -6.603
389 1HG LYS 55 HG2 LYS 55 82.488 -4.705 -4.705
390 2HG LYS 55 HG1 LYS 55 81.143 -3.694 -3.694
391 1HD LYS 55 HD2 LYS 55 82.316 -4.676 -4.676
392 2HD LYS 55 HD1 LYS 55 83.663 -4.199 -4.199
393 1HE LYS 55 HE2 LYS 55 81.292 -2.361 -2.361
394 2HE LYS 55 HE1 LYS 55 82.571 -2.373 -2.373
395 1HZ LYS 55 HZ3 LYS 55 83.231 -2.285 -2.285
396 2HZ LYS 55 HZ2 LYS 55 82.880 -0.856 -0.856
397 3HZ LYS 55 HZ1 LYS 55 84.190 -1.828 -1.828
398 H GLU 56 HN GLU 56 80.105 -7.927 -7.927
399 HA GLU 56 HA GLU 56 80.515 -7.638 -7.638
400 1HB GLU 56 HB2 GLU 56 80.015 -9.690 -9.690
401 2HB GLU 56 HB1 GLU 56 78.848 -9.947 -9.947
402 1HG GLU 56 HG2 GLU 56 80.702 -9.806 -9.806
403 2HG GLU 56 HG1 GLU 56 81.849 -9.648 -9.648
404 H GLU 57 HN GLU 57 77.332 -8.337 -8.337
405 HA GLU 57 HA GLU 57 75.711 -8.177 -8.177
406 1HB GLU 57 HB2 GLU 57 75.429 -7.626 -7.626
407 2HB GLU 57 HB1 GLU 57 74.103 -7.131 -7.131
408 1HG GLU 57 HG2 GLU 57 74.714 -9.671 -9.671
409 2HG GLU 57 HG1 GLU 57 74.918 -9.822 -9.822
410 H LEU 58 HN LEU 58 76.861 -5.528 -5.528
411 HA LEU 58 HA LEU 58 75.492 -3.368 -3.368
412 1HB LEU 58 HB2 LEU 58 77.558 -3.859 -3.859
413 2HB LEU 58 HB1 LEU 58 78.148 -2.624 -2.624
414 HG LEU 58 HG LEU 58 76.948 -1.568 -1.568
415 HD1 LEU 58 HD1 LEU 58 74.855 -0.850 -0.850
416 HD1 LEU 58 HD1 LEU 58 76.085 -1.419 -1.419
417 HD1 LEU 58 HD1 LEU 58 76.459 -0.116 -0.116
418 HD2 LEU 58 HD2 LEU 58 75.454 -3.229 -3.229
419 HD2 LEU 58 HD2 LEU 58 74.791 -3.506 -3.506
420 HD2 LEU 58 HD2 LEU 58 74.394 -2.027 -2.027
421 H ASP 59 HN ASP 59 78.973 -4.052 -4.052
422 HA ASP 59 HA ASP 59 79.355 -2.543 -2.543
423 1HB ASP 59 HB2 ASP 59 80.870 -4.096 -4.096
424 2HB ASP 59 HB1 ASP 59 80.690 -5.203 -5.203
425 H ALA 60 HN ALA 60 78.252 -5.925 -5.925
426 HA ALA 60 HA ALA 60 78.099 -6.450 -6.450
427 1HB ALA 60 HB2 ALA 60 76.921 -7.600 -7.600
428 2HB ALA 60 HB1 ALA 60 76.446 -8.240 -8.240
429 3HB ALA 60 HB3 ALA 60 78.135 -8.305 -8.305
430 H ILE 61 HN ILE 61 75.660 -5.396 -5.396
431 HA ILE 61 HA ILE 61 73.473 -5.247 -5.247
432 HB ILE 61 HB ILE 61 74.099 -4.083 -4.083
433 1HG1 ILE 61 HG12 ILE 61 72.028 -6.109 -6.109
434 2HG1 ILE 61 HG11 ILE 61 73.629 -6.546 -6.546
435 1HG2 ILE 61 HG22 ILE 61 72.011 -3.297 -3.297
436 2HG2 ILE 61 HG21 ILE 61 71.355 -3.858 -3.858
437 3HG2 ILE 61 HG23 ILE 61 72.508 -2.523 -2.523
438 HD1 ILE 61 HD1 ILE 61 72.787 -4.826 -4.826
439 HD1 ILE 61 HD1 ILE 61 72.611 -6.580 -6.580
440 HD1 ILE 61 HD1 ILE 61 71.265 -5.582 -5.582
441 H ILE 62 HN ILE 62 75.631 -2.750 -2.750
442 HA ILE 62 HA ILE 62 74.637 -0.454 -0.454
443 HB ILE 62 HB ILE 62 77.425 -1.424 -1.424
444 1HG1 ILE 62 HG12 ILE 62 75.583 0.621 0.621
445 2HG1 ILE 62 HG11 ILE 62 75.851 -1.020 -1.020
446 1HG2 ILE 62 HG22 ILE 62 76.565 1.333 1.333
447 2HG2 ILE 62 HG21 ILE 62 78.148 0.945 0.945
448 3HG2 ILE 62 HG23 ILE 62 77.644 0.236 0.236
449 HD1 ILE 62 HD1 ILE 62 77.553 1.364 1.364
450 HD1 ILE 62 HD1 ILE 62 78.425 -0.077 -0.077
451 HD1 ILE 62 HD1 ILE 62 77.508 -0.099 -0.099
452 H GLU 63 HN GLU 63 77.519 -2.126 -2.126
453 HA GLU 63 HA GLU 63 77.600 -1.060 -1.060
454 1HB GLU 63 HB2 GLU 63 78.697 -3.219 -3.219
455 2HB GLU 63 HB1 GLU 63 77.970 -3.958 -3.958
456 1HG GLU 63 HG2 GLU 63 79.894 -1.613 -1.613
457 2HG GLU 63 HG1 GLU 63 80.300 -3.275 -3.275
458 H GLU 64 HN GLU 64 75.413 -3.589 -3.589
459 HA GLU 64 HA GLU 64 74.251 -4.206 -4.206
460 1HB GLU 64 HB2 GLU 64 74.071 -5.863 -5.863
461 2HB GLU 64 HB1 GLU 64 73.633 -4.697 -4.697
462 1HG GLU 64 HG2 GLU 64 71.419 -4.637 -4.637
463 2HG GLU 64 HG1 GLU 64 71.786 -4.971 -4.971
464 H VAL 65 HN VAL 65 73.151 -2.251 -2.251
465 HA VAL 65 HA VAL 65 70.858 -1.214 -1.214
466 HB VAL 65 HB VAL 65 70.272 -0.231 -0.231
467 1HG1 VAL 65 HG11 VAL 65 71.669 -2.896 -2.896
468 2HG1 VAL 65 HG13 VAL 65 70.617 -2.180 -2.180
469 3HG1 VAL 65 HG12 VAL 65 69.963 -2.625 -2.625
470 1HG2 VAL 65 HG23 VAL 65 73.210 -0.356 -0.356
471 2HG2 VAL 65 HG22 VAL 65 72.049 0.848 0.848
472 3HG2 VAL 65 HG21 VAL 65 72.230 -0.674 -0.674
473 H ASP 66 HN ASP 66 74.089 -0.512 -0.512
474 HA ASP 66 HA ASP 66 74.064 2.388 2.388
475 1HB ASP 66 HB2 ASP 66 75.935 0.398 0.398
476 2HB ASP 66 HB1 ASP 66 76.114 0.992 0.992
477 H GLU 67 HN GLU 67 72.311 3.002 3.002
478 HA GLU 67 HA GLU 67 71.766 2.256 2.256
479 1HB GLU 67 HB2 GLU 67 71.151 4.344 4.344
480 2HB GLU 67 HB1 GLU 67 71.960 5.173 5.173
481 1HG GLU 67 HG2 GLU 67 70.352 3.422 3.422
482 2HG GLU 67 HG1 GLU 67 69.353 3.792 3.792
483 H ASP 68 HN ASP 68 73.189 1.892 1.892
484 HA ASP 68 HA ASP 68 75.838 2.975 2.975
485 1HB ASP 68 HB2 ASP 68 74.272 1.036 1.036
486 2HB ASP 68 HB1 ASP 68 74.604 2.191 2.191
487 H GLY 69 HN GLY 69 74.915 5.314 5.314
488 1HA GLY 69 HA2 GLY 69 75.303 6.890 6.890
489 2HA GLY 69 HA1 GLY 69 73.568 6.766 6.766
490 H SER 70 HN SER 70 73.526 6.757 6.757
491 HA SER 70 HA SER 70 74.480 9.536 9.536
492 1HB SER 70 HB2 SER 70 72.593 9.556 9.556
493 2HB SER 70 HB1 SER 70 72.033 9.061 9.061
494 HG SER 70 HG SER 70 71.215 7.559 7.559
495 H GLY 71 HN GLY 71 73.994 6.346 6.346
496 1HA GLY 71 HA2 GLY 71 75.709 5.270 5.270
497 2HA GLY 71 HA1 GLY 71 76.454 6.848 6.848
498 H THR 72 HN THR 72 73.046 6.849 6.849
499 HA THR 72 HA THR 72 73.314 6.851 6.851
500 HB THR 72 HB THR 72 71.221 8.381 8.381
501 HG1 THR 72 HG1 THR 72 70.666 8.443 8.443
502 1HG2 THR 72 HG21 THR 72 74.091 8.916 8.916
503 2HG2 THR 72 HG23 THR 72 73.052 10.186 10.186
504 3HG2 THR 72 HG22 THR 72 72.914 9.711 9.711
505 H ILE 73 HN ILE 73 71.197 6.250 6.250
506 HA ILE 73 HA ILE 73 69.909 3.982 3.982
507 HB ILE 73 HB ILE 73 71.120 3.388 3.388
508 1HG1 ILE 73 HG12 ILE 73 68.995 2.804 2.804
509 2HG1 ILE 73 HG11 ILE 73 68.126 3.344 3.344
510 1HG2 ILE 73 HG22 ILE 73 69.617 5.741 5.741
511 2HG2 ILE 73 HG21 ILE 73 70.120 4.444 4.444
512 3HG2 ILE 73 HG23 ILE 73 71.326 5.337 5.337
513 HD1 ILE 73 HD1 ILE 73 69.099 0.801 0.801
514 HD1 ILE 73 HD1 ILE 73 70.391 1.550 1.550
515 HD1 ILE 73 HD1 ILE 73 68.745 1.521 1.521
516 H ASP 74 HN ASP 74 67.608 3.828 3.828
517 HA ASP 74 HA ASP 74 66.203 6.405 6.405
518 1HB ASP 74 HB2 ASP 74 65.499 3.825 3.825
519 2HB ASP 74 HB1 ASP 74 64.419 5.216 5.216
520 H PHE 75 HN PHE 75 64.962 6.638 6.638
521 HA PHE 75 HA PHE 75 64.730 4.910 4.910
522 1HB PHE 75 HB2 PHE 75 63.932 7.294 7.294
523 2HB PHE 75 HB1 PHE 75 62.511 6.680 6.680
524 HD1 PHE 75 HD2 PHE 75 61.058 4.928 4.928
525 HD2 PHE 75 HD1 PHE 75 64.006 7.320 7.320
526 HE1 PHE 75 HE2 PHE 75 59.971 4.440 4.440
527 HE2 PHE 75 HE1 PHE 75 62.919 6.831 6.831
528 HZ PHE 75 HZ PHE 75 60.902 5.391 5.391
529 H GLU 76 HN GLU 76 62.449 5.080 5.080
530 HA GLU 76 HA GLU 76 60.662 3.041 3.041
531 1HB GLU 76 HB2 GLU 76 61.542 4.387 4.387
532 2HB GLU 76 HB1 GLU 76 60.782 2.814 2.814
533 1HG GLU 76 HG2 GLU 76 58.743 3.512 3.512
534 2HG GLU 76 HG1 GLU 76 59.471 4.723 4.723
535 H GLU 77 HN GLU 77 63.514 2.713 2.713
536 HA GLU 77 HA GLU 77 63.409 -0.179 -0.179
537 1HB GLU 77 HB2 GLU 77 64.440 1.000 1.000
538 2HB GLU 77 HB1 GLU 77 65.453 1.938 1.938
539 1HG GLU 77 HG2 GLU 77 66.787 0.034 0.034
540 2HG GLU 77 HG1 GLU 77 65.643 -1.073 -1.073
541 H PHE 78 HN PHE 78 64.842 2.190 2.190
542 HA PHE 78 HA PHE 78 66.767 0.405 0.405
543 1HB PHE 78 HB2 PHE 78 67.151 2.750 2.750
544 2HB PHE 78 HB1 PHE 78 65.502 3.077 3.077
545 HD1 PHE 78 HD1 PHE 78 68.648 1.340 1.340
546 HD2 PHE 78 HD2 PHE 78 64.999 3.238 3.238
547 HE1 PHE 78 HE1 PHE 78 69.375 1.194 1.194
548 HE2 PHE 78 HE2 PHE 78 65.725 3.091 3.091
549 HZ PHE 78 HZ PHE 78 67.912 2.070 2.070
550 H LEU 79 HN LEU 79 63.360 1.086 1.086
551 HA LEU 79 HA LEU 79 62.853 0.348 0.348
552 1HB LEU 79 HB2 LEU 79 61.459 0.238 0.238
553 2HB LEU 79 HB1 LEU 79 60.761 -0.753 -0.753
554 HG LEU 79 HG LEU 79 61.546 2.002 2.002
555 HD1 LEU 79 HD1 LEU 79 59.835 1.477 1.477
556 HD1 LEU 79 HD1 LEU 79 60.410 3.021 3.021
557 HD1 LEU 79 HD1 LEU 79 58.944 2.291 2.291
558 HD2 LEU 79 HD2 LEU 79 58.903 0.620 0.620
559 HD2 LEU 79 HD2 LEU 79 59.727 1.778 1.778
560 HD2 LEU 79 HD2 LEU 79 60.324 0.123 0.123
561 H VAL 80 HN VAL 80 63.619 -1.733 -1.733
562 HA VAL 80 HA VAL 80 62.951 -4.244 -4.244
563 HB VAL 80 HB VAL 80 64.148 -5.158 -5.158
564 1HG1 VAL 80 HG11 VAL 80 62.473 -2.844 -2.844
565 2HG1 VAL 80 HG13 VAL 80 63.697 -2.865 -2.865
566 3HG1 VAL 80 HG12 VAL 80 62.631 -4.253 -4.253
567 1HG2 VAL 80 HG21 VAL 80 65.630 -2.511 -2.511
568 2HG2 VAL 80 HG23 VAL 80 66.301 -4.069 -4.069
569 3HG2 VAL 80 HG22 VAL 80 65.806 -3.796 -3.796
570 H MET 81 HN MET 81 66.005 -2.389 -2.389
571 HA MET 81 HA MET 81 67.682 -4.247 -4.247
572 1HB MET 81 HB2 MET 81 67.590 -1.398 -1.398
573 2HB MET 81 HB1 MET 81 68.498 -1.709 -1.709
574 1HG MET 81 HG2 MET 81 69.982 -1.842 -1.842
575 2HG MET 81 HG1 MET 81 69.833 -3.422 -3.422
576 1HE MET 81 HE1 MET 81 69.058 -1.019 -1.019
577 2HE MET 81 HE3 MET 81 68.743 -1.901 -1.901
578 3HE MET 81 HE2 MET 81 67.415 -1.503 -1.503
579 H MET 82 HN MET 82 65.168 -2.130 -2.130
580 HA MET 82 HA MET 82 65.996 -2.282 -2.282
581 1HB MET 82 HB2 MET 82 63.309 -1.547 -1.547
582 2HB MET 82 HB1 MET 82 63.971 -1.013 -1.013
583 1HG MET 82 HG2 MET 82 65.849 0.086 0.086
584 2HG MET 82 HG1 MET 82 64.983 -0.297 -0.297
585 1HE MET 82 HE2 MET 82 65.675 1.642 1.642
586 2HE MET 82 HE1 MET 82 64.684 3.097 3.097
587 3HE MET 82 HE3 MET 82 64.122 1.686 1.686
588 H VAL 83 HN VAL 83 63.070 -3.493 -3.493
589 HA VAL 83 HA VAL 83 62.291 -5.292 -5.292
590 HB VAL 83 HB VAL 83 60.808 -4.451 -4.451
591 1HG1 VAL 83 HG12 VAL 83 62.761 -4.660 -4.660
592 2HG1 VAL 83 HG11 VAL 83 62.162 -6.304 -6.304
593 3HG1 VAL 83 HG13 VAL 83 61.107 -4.930 -4.930
594 1HG2 VAL 83 HG22 VAL 83 60.511 -6.764 -6.764
595 2HG2 VAL 83 HG21 VAL 83 59.608 -6.463 -6.463
596 3HG2 VAL 83 HG23 VAL 83 61.082 -7.431 -7.431
597 H ARG 84 HN ARG 84 64.138 -5.830 -5.830
598 HA ARG 84 HA ARG 84 64.491 -8.631 -8.631
599 1HB ARG 84 HB2 ARG 84 66.315 -6.434 -6.434
600 2HB ARG 84 HB1 ARG 84 66.506 -8.148 -8.148
601 1HG ARG 84 HG2 ARG 84 63.800 -7.017 -7.017
602 2HG ARG 84 HG1 ARG 84 65.068 -6.454 -6.454
603 1HD ARG 84 HD2 ARG 84 64.454 -9.378 -9.378
604 2HD ARG 84 HD1 ARG 84 63.964 -8.496 -8.496
605 HE ARG 84 HE ARG 84 66.602 -7.967 -7.967
606 1HH1 ARG 84 HH2 ARG 84 67.254 -10.145 -10.145
607 2HH1 ARG 84 HH2 ARG 84 67.495 -11.503 -11.503
608 1HH2 ARG 84 HH1 ARG 84 65.895 -10.038 -10.038
609 2HH2 ARG 84 HH1 ARG 84 66.724 -11.443 -11.443
610 H GLN 85 HN GLN 85 66.194 -5.970 -5.970
611 HA GLN 85 HA GLN 85 68.210 -7.745 -7.745
612 1HB GLN 85 HB2 GLN 85 68.586 -5.363 -5.363
613 2HB GLN 85 HB1 GLN 85 67.482 -4.852 -4.852
614 1HG GLN 85 HG2 GLN 85 69.869 -4.727 -4.727
615 2HG GLN 85 HG1 GLN 85 68.933 -5.845 -5.845
616 1HE2 GLN 85 HE22 GLN 85 71.616 -7.429 -7.429
617 2HE2 GLN 85 HE21 GLN 85 70.916 -5.919 -5.919
618 H MET 86 HN MET 86 65.305 -5.965 -5.965
619 HA MET 86 HA MET 86 65.515 -6.793 -6.793
620 1HB MET 86 HB2 MET 86 63.842 -5.169 -5.169
621 2HB MET 86 HB1 MET 86 62.852 -6.136 -6.136
622 1HG MET 86 HG2 MET 86 65.035 -5.147 -5.147
623 2HG MET 86 HG1 MET 86 64.397 -3.788 -3.788
624 1HE MET 86 HE1 MET 86 62.720 -2.396 -2.396
625 2HE MET 86 HE3 MET 86 61.893 -2.561 -2.561
626 3HE MET 86 HE2 MET 86 63.653 -2.545 -2.545
627 H LYS 87 HN LYS 87 64.322 -8.273 -8.273
628 HA LYS 87 HA LYS 87 62.280 -9.976 -9.976
629 1HB LYS 87 HB2 LYS 87 64.541 -10.125 -10.125
630 2HB LYS 87 HB1 LYS 87 63.595 -11.587 -11.587
631 1HG LYS 87 HG2 LYS 87 61.782 -9.389 -9.389
632 2HG LYS 87 HG1 LYS 87 62.904 -9.339 -9.339
633 1HD LYS 87 HD2 LYS 87 62.167 -11.333 -11.333
634 2HD LYS 87 HD1 LYS 87 61.821 -12.012 -12.012
635 1HE LYS 87 HE2 LYS 87 59.899 -10.251 -10.251
636 2HE LYS 87 HE1 LYS 87 60.111 -10.170 -10.170
637 1HZ LYS 87 HZ1 LYS 87 59.746 -12.673 -12.673
638 2HZ LYS 87 HZ3 LYS 87 58.534 -11.917 -11.917
639 3HZ LYS 87 HZ2 LYS 87 59.905 -12.559 -12.559
640 H GLU 88 HN GLU 88 65.748 -10.190 -10.190
641 HA GLU 88 HA GLU 88 65.444 -12.788 -12.788
642 1HB GLU 88 HB2 GLU 88 67.344 -12.084 -12.084
643 2HB GLU 88 HB1 GLU 88 67.899 -11.039 -11.039
644 1HG GLU 88 HG2 GLU 88 67.297 -13.887 -13.887
645 2HG GLU 88 HG1 GLU 88 68.773 -13.553 -13.553
646 H ASP 89 HN ASP 89 66.139 -9.368 -9.368
647 HA ASP 89 HA ASP 89 66.679 -9.743 -9.743
648 1HB ASP 89 HB2 ASP 89 67.371 -7.844 -7.844
649 2HB ASP 89 HB1 ASP 89 65.718 -7.250 -7.250
650 H ALA 90 HN ALA 90 63.804 -9.187 -9.187
651 HA ALA 90 HA ALA 90 62.102 -8.598 -8.598
652 1HB ALA 90 HB2 ALA 90 62.075 -7.959 -7.959
653 2HB ALA 90 HB1 ALA 90 60.930 -9.301 -9.301
654 3HB ALA 90 HB3 ALA 90 60.649 -7.884 -7.884
Start of MODEL 16
1 1H ALA 1 HT2 ALA 1 64.960 -5.248 -5.248
2 2H ALA 1 HT1 ALA 1 65.710 -3.939 -3.939
3 3H ALA 1 HT3 ALA 1 66.532 -4.777 -4.777
4 HA ALA 1 HA ALA 1 67.066 -6.536 -6.536
5 1HB ALA 1 HB1 ALA 1 67.988 -4.378 -4.378
6 2HB ALA 1 HB3 ALA 1 66.596 -4.220 -4.220
7 3HB ALA 1 HB2 ALA 1 67.745 -5.537 -5.537
8 H SER 2 HN SER 2 66.563 -7.718 -7.718
9 HA SER 2 HA SER 2 63.674 -8.280 -8.280
10 1HB SER 2 HB2 SER 2 66.171 -9.426 -9.426
11 2HB SER 2 HB1 SER 2 64.567 -10.022 -10.022
12 HG SER 2 HG SER 2 64.666 -11.133 -11.133
13 H MET 3 HN MET 3 65.883 -6.279 -6.279
14 HA MET 3 HA MET 3 64.863 -6.348 -6.348
15 1HB MET 3 HB2 MET 3 66.381 -4.505 -4.505
16 2HB MET 3 HB1 MET 3 65.643 -3.769 -3.769
17 1HG MET 3 HG2 MET 3 66.709 -5.540 -5.540
18 2HG MET 3 HG1 MET 3 67.532 -6.140 -6.140
19 1HE MET 3 HE3 MET 3 67.776 -4.551 -4.551
20 2HE MET 3 HE2 MET 3 68.962 -3.249 -3.249
21 3HE MET 3 HE1 MET 3 67.280 -2.913 -2.913
22 H THR 4 HN THR 4 63.776 -4.542 -4.542
23 HA THR 4 HA THR 4 61.905 -2.792 -2.792
24 HB THR 4 HB THR 4 62.605 -2.888 -2.888
25 HG1 THR 4 HG1 THR 4 60.660 -1.852 -1.852
26 1HG2 THR 4 HG22 THR 4 62.056 -5.572 -5.572
27 2HG2 THR 4 HG21 THR 4 60.669 -4.986 -4.986
28 3HG2 THR 4 HG23 THR 4 62.305 -4.716 -4.716
29 H ASP 5 HN ASP 5 61.797 -6.257 -6.257
30 HA ASP 5 HA ASP 5 58.885 -6.465 -6.465
31 1HB ASP 5 HB2 ASP 5 60.245 -8.119 -8.119
32 2HB ASP 5 HB1 ASP 5 61.152 -8.471 -8.471
33 H GLN 6 HN GLN 6 61.772 -6.864 -6.864
34 HA GLN 6 HA GLN 6 60.161 -7.510 -7.510
35 1HB GLN 6 HB2 GLN 6 63.026 -7.242 -7.242
36 2HB GLN 6 HB1 GLN 6 62.647 -7.047 -7.047
37 1HG GLN 6 HG2 GLN 6 62.825 -9.326 -9.326
38 2HG GLN 6 HG1 GLN 6 61.162 -9.248 -9.248
39 1HE2 GLN 6 HE22 GLN 6 63.857 -10.985 -10.985
40 2HE2 GLN 6 HE21 GLN 6 64.023 -10.766 -10.766
41 H GLN 7 HN GLN 7 60.604 -4.685 -4.685
42 HA GLN 7 HA GLN 7 61.217 -2.883 -2.883
43 1HB GLN 7 HB2 GLN 7 61.538 -2.707 -2.707
44 2HB GLN 7 HB1 GLN 7 59.897 -2.064 -2.064
45 1HG GLN 7 HG2 GLN 7 61.565 -0.901 -0.901
46 2HG GLN 7 HG1 GLN 7 62.248 -0.629 -0.629
47 1HE2 GLN 7 HE22 GLN 7 59.749 1.678 1.678
48 2HE2 GLN 7 HE21 GLN 7 61.162 0.848 0.848
49 H ALA 8 HN ALA 8 58.306 -3.169 -3.169
50 HA ALA 8 HA ALA 8 56.520 -1.657 -1.657
51 1HB ALA 8 HB2 ALA 8 56.185 -2.767 -2.767
52 2HB ALA 8 HB1 ALA 8 55.930 -4.290 -4.290
53 3HB ALA 8 HB3 ALA 8 54.811 -2.949 -2.949
54 H GLU 9 HN GLU 9 57.166 -5.168 -5.168
55 HA GLU 9 HA GLU 9 55.445 -5.447 -5.447
56 1HB GLU 9 HB2 GLU 9 57.662 -7.108 -7.108
57 2HB GLU 9 HB1 GLU 9 56.671 -7.667 -7.667
58 1HG GLU 9 HG2 GLU 9 55.100 -6.572 -6.572
59 2HG GLU 9 HG1 GLU 9 56.042 -7.997 -7.997
60 H ALA 10 HN ALA 10 58.754 -4.450 -4.450
61 HA ALA 10 HA ALA 10 59.809 -5.072 -5.072
62 1HB ALA 10 HB3 ALA 10 60.474 -3.461 -3.461
63 2HB ALA 10 HB2 ALA 10 61.166 -2.848 -2.848
64 3HB ALA 10 HB1 ALA 10 61.512 -4.496 -4.496
65 H ARG 11 HN ARG 11 57.832 -2.413 -2.413
66 HA ARG 11 HA ARG 11 58.209 -0.803 -0.803
67 1HB ARG 11 HB2 ARG 11 56.178 -0.391 -0.391
68 2HB ARG 11 HB1 ARG 11 56.959 0.827 0.827
69 1HG ARG 11 HG2 ARG 11 58.534 1.079 1.079
70 2HG ARG 11 HG1 ARG 11 59.033 -0.592 -0.592
71 1HD ARG 11 HD2 ARG 11 58.467 -0.504 -0.504
72 2HD ARG 11 HD1 ARG 11 57.024 -1.203 -1.203
73 HE ARG 11 HE ARG 11 57.177 1.755 1.755
74 1HH1 ARG 11 HH1 ARG 11 55.182 -0.907 -0.907
75 2HH1 ARG 11 HH1 ARG 11 54.030 -0.434 -0.434
76 1HH2 ARG 11 HH2 ARG 11 55.942 2.207 2.207
77 2HH2 ARG 11 HH2 ARG 11 54.458 1.327 1.327
78 H ALA 12 HN ALA 12 55.361 -2.202 -2.202
79 HA ALA 12 HA ALA 12 53.460 -1.873 -1.873
80 1HB ALA 12 HB1 ALA 12 53.798 -3.266 -3.266
81 2HB ALA 12 HB3 ALA 12 53.125 -4.413 -4.413
82 3HB ALA 12 HB2 ALA 12 52.285 -2.898 -2.898
83 H PHE 13 HN PHE 13 56.169 -4.068 -4.068
84 HA PHE 13 HA PHE 13 55.427 -6.206 -6.206
85 1HB PHE 13 HB2 PHE 13 57.632 -6.039 -6.039
86 2HB PHE 13 HB1 PHE 13 57.923 -4.497 -4.497
87 HD1 PHE 13 HD1 PHE 13 56.802 -7.949 -7.949
88 HD2 PHE 13 HD2 PHE 13 59.329 -4.586 -4.586
89 HE1 PHE 13 HE1 PHE 13 57.727 -9.146 -9.146
90 HE2 PHE 13 HE2 PHE 13 60.255 -5.780 -5.780
91 HZ PHE 13 HZ PHE 13 59.454 -8.062 -8.062
92 H LEU 14 HN LEU 14 56.030 -2.857 -2.857
93 HA LEU 14 HA LEU 14 55.289 -3.587 -3.587
94 1HB LEU 14 HB2 LEU 14 56.837 -1.224 -1.224
95 2HB LEU 14 HB1 LEU 14 56.587 -1.579 -1.579
96 HG LEU 14 HG LEU 14 57.730 -3.769 -3.769
97 HD1 LEU 14 HD1 LEU 14 58.865 -1.562 -1.562
98 HD1 LEU 14 HD1 LEU 14 59.917 -2.859 -2.859
99 HD1 LEU 14 HD1 LEU 14 59.510 -1.519 -1.519
100 HD2 LEU 14 HD2 LEU 14 59.158 -3.115 -3.115
101 HD2 LEU 14 HD2 LEU 14 58.145 -4.522 -4.522
102 HD2 LEU 14 HD2 LEU 14 57.429 -3.053 -3.053
103 H SER 15 HN SER 15 54.421 -1.317 -1.317
104 HA SER 15 HA SER 15 51.995 -0.658 -0.658
105 1HB SER 15 HB2 SER 15 52.764 -0.967 -0.967
106 2HB SER 15 HB1 SER 15 52.018 0.611 0.611
107 HG SER 15 HG SER 15 50.363 -0.637 -0.637
108 H GLU 16 HN GLU 16 51.302 1.680 1.680
109 HA GLU 16 HA GLU 16 53.225 3.413 3.413
110 1HB GLU 16 HB2 GLU 16 50.858 3.726 3.726
111 2HB GLU 16 HB1 GLU 16 50.588 3.865 3.865
112 1HG GLU 16 HG2 GLU 16 51.950 5.939 5.939
113 2HG GLU 16 HG1 GLU 16 52.156 5.811 5.811
114 H GLU 17 HN GLU 17 52.351 2.881 2.881
115 HA GLU 17 HA GLU 17 53.588 5.245 5.245
116 1HB GLU 17 HB2 GLU 17 51.936 3.894 3.894
117 2HB GLU 17 HB1 GLU 17 53.003 2.491 2.491
118 1HG GLU 17 HG2 GLU 17 54.607 4.461 4.461
119 2HG GLU 17 HG1 GLU 17 53.028 4.767 4.767
120 H MET 18 HN MET 18 54.804 2.061 2.061
121 HA MET 18 HA MET 18 57.352 2.268 2.268
122 1HB MET 18 HB2 MET 18 56.619 0.109 0.109
123 2HB MET 18 HB1 MET 18 56.139 0.611 0.611
124 1HG MET 18 HG2 MET 18 59.025 0.845 0.845
125 2HG MET 18 HG1 MET 18 58.385 -0.754 -0.754
126 1HE MET 18 HE2 MET 18 60.443 1.350 1.350
127 2HE MET 18 HE1 MET 18 60.671 0.288 0.288
128 3HE MET 18 HE3 MET 18 60.245 1.987 1.987
129 H ILE 19 HN ILE 19 56.349 2.818 2.818
130 HA ILE 19 HA ILE 19 58.772 3.479 3.479
131 HB ILE 19 HB ILE 19 55.954 4.519 4.519
132 1HG1 ILE 19 HG12 ILE 19 57.053 3.442 3.442
133 2HG1 ILE 19 HG11 ILE 19 57.530 2.375 2.375
134 1HG2 ILE 19 HG22 ILE 19 58.376 5.449 5.449
135 2HG2 ILE 19 HG21 ILE 19 56.716 5.671 5.671
136 3HG2 ILE 19 HG23 ILE 19 57.262 6.447 6.447
137 HD1 ILE 19 HD1 ILE 19 55.241 1.939 1.939
138 HD1 ILE 19 HD1 ILE 19 54.690 3.357 3.357
139 HD1 ILE 19 HD1 ILE 19 55.297 1.948 1.948
140 H ALA 20 HN ALA 20 56.727 5.606 5.606
141 HA ALA 20 HA ALA 20 58.301 7.974 7.974
142 1HB ALA 20 HB2 ALA 20 56.355 6.782 6.782
143 2HB ALA 20 HB1 ALA 20 57.209 8.259 8.259
144 3HB ALA 20 HB3 ALA 20 56.188 8.231 8.231
145 H GLU 21 HN GLU 21 58.813 4.997 4.997
146 HA GLU 21 HA GLU 21 60.723 6.044 6.044
147 1HB GLU 21 HB2 GLU 21 59.266 3.995 3.995
148 2HB GLU 21 HB1 GLU 21 60.258 3.221 3.221
149 1HG GLU 21 HG2 GLU 21 61.122 2.536 2.536
150 2HG GLU 21 HG1 GLU 21 62.272 3.682 3.682
151 H PHE 22 HN PHE 22 60.998 4.076 4.076
152 HA PHE 22 HA PHE 22 63.915 4.249 4.249
153 1HB PHE 22 HB2 PHE 22 61.767 3.287 3.287
154 2HB PHE 22 HB1 PHE 22 63.483 3.195 3.195
155 HD1 PHE 22 HD2 PHE 22 63.002 2.924 2.924
156 HD2 PHE 22 HD1 PHE 22 62.777 0.657 0.657
157 HE1 PHE 22 HE2 PHE 22 63.187 0.820 0.820
158 HE2 PHE 22 HE1 PHE 22 62.962 -1.447 -1.447
159 HZ PHE 22 HZ PHE 22 63.168 -1.365 -1.365
160 H LYS 23 HN LYS 23 61.225 5.967 5.967
161 HA LYS 23 HA LYS 23 62.827 7.407 7.407
162 1HB LYS 23 HB2 LYS 23 60.460 7.095 7.095
163 2HB LYS 23 HB1 LYS 23 60.091 7.796 7.796
164 1HG LYS 23 HG2 LYS 23 61.670 9.531 9.531
165 2HG LYS 23 HG1 LYS 23 60.021 9.204 9.204
166 1HD LYS 23 HD2 LYS 23 59.084 10.098 10.098
167 2HD LYS 23 HD1 LYS 23 60.636 10.066 10.066
168 1HE LYS 23 HE2 LYS 23 60.414 12.343 12.343
169 2HE LYS 23 HE1 LYS 23 61.398 11.699 11.699
170 1HZ LYS 23 HZ2 LYS 23 59.143 11.121 11.121
171 2HZ LYS 23 HZ1 LYS 23 58.499 12.256 12.256
172 3HZ LYS 23 HZ3 LYS 23 59.654 12.740 12.740
173 H ALA 24 HN ALA 24 61.633 8.134 8.134
174 HA ALA 24 HA ALA 24 62.528 10.856 10.856
175 1HB ALA 24 HB1 ALA 24 61.929 8.672 8.672
176 2HB ALA 24 HB3 ALA 24 62.442 10.275 10.275
177 3HB ALA 24 HB2 ALA 24 60.953 10.085 10.085
178 H ALA 25 HN ALA 25 64.098 7.778 7.778
179 HA ALA 25 HA ALA 25 66.561 9.133 9.133
180 1HB ALA 25 HB2 ALA 25 65.249 6.667 6.667
181 2HB ALA 25 HB1 ALA 25 66.747 6.274 6.274
182 3HB ALA 25 HB3 ALA 25 66.800 7.157 7.157
183 H PHE 26 HN PHE 26 65.290 7.630 7.630
184 HA PHE 26 HA PHE 26 67.798 7.114 7.114
185 1HB PHE 26 HB2 PHE 26 65.886 5.990 5.990
186 2HB PHE 26 HB1 PHE 26 64.903 7.454 7.454
187 HD1 PHE 26 HD2 PHE 26 67.521 5.597 5.597
188 HD2 PHE 26 HD1 PHE 26 65.012 9.083 9.083
189 HE1 PHE 26 HE2 PHE 26 68.094 6.029 6.029
190 HE2 PHE 26 HE1 PHE 26 65.585 9.515 9.515
191 HZ PHE 26 HZ PHE 26 67.127 7.989 7.989
192 H ASP 27 HN ASP 27 65.634 9.931 9.931
193 HA ASP 27 HA ASP 27 66.964 11.456 11.456
194 1HB ASP 27 HB2 ASP 27 65.631 13.303 13.303
195 2HB ASP 27 HB1 ASP 27 64.662 11.851 11.851
196 H MET 28 HN MET 28 68.077 10.489 10.489
197 HA MET 28 HA MET 28 69.316 12.815 12.815
198 1HB MET 28 HB2 MET 28 70.037 9.869 9.869
199 2HB MET 28 HB1 MET 28 70.834 11.065 11.065
200 1HG MET 28 HG2 MET 28 67.859 11.048 11.048
201 2HG MET 28 HG1 MET 28 68.670 9.686 9.686
202 1HE MET 28 HE2 MET 28 67.702 13.014 13.014
203 2HE MET 28 HE1 MET 28 67.188 13.098 13.098
204 3HE MET 28 HE3 MET 28 68.569 14.054 14.054
205 H PHE 29 HN PHE 29 70.041 11.020 11.020
206 HA PHE 29 HA PHE 29 72.651 12.491 12.491
207 1HB PHE 29 HB2 PHE 29 72.113 9.861 9.861
208 2HB PHE 29 HB1 PHE 29 73.652 10.546 10.546
209 HD1 PHE 29 HD2 PHE 29 70.596 8.792 8.792
210 HD2 PHE 29 HD1 PHE 29 74.421 10.328 10.328
211 HE1 PHE 29 HE2 PHE 29 70.432 7.527 7.527
212 HE2 PHE 29 HE1 PHE 29 74.258 9.061 9.061
213 HZ PHE 29 HZ PHE 29 72.263 7.661 7.661
214 H ASP 30 HN ASP 30 69.574 12.415 12.415
215 HA ASP 30 HA ASP 30 70.245 12.653 12.653
216 1HB ASP 30 HB2 ASP 30 67.886 12.507 12.507
217 2HB ASP 30 HB1 ASP 30 68.234 11.432 11.432
218 H ALA 31 HN ALA 31 71.375 14.698 14.698
219 HA ALA 31 HA ALA 31 69.837 17.084 17.084
220 1HB ALA 31 HB2 ALA 31 72.316 16.268 16.268
221 2HB ALA 31 HB1 ALA 31 72.726 17.233 17.233
222 3HB ALA 31 HB3 ALA 31 71.866 17.971 17.971
223 H ASP 32 HN ASP 32 71.365 15.541 15.541
224 HA ASP 32 HA ASP 32 70.474 17.834 17.834
225 1HB ASP 32 HB2 ASP 32 73.002 16.192 16.192
226 2HB ASP 32 HB1 ASP 32 72.505 16.997 16.997
227 H GLY 33 HN GLY 33 69.919 14.660 14.660
228 1HA GLY 33 HA2 GLY 33 69.466 13.717 13.717
229 2HA GLY 33 HA1 GLY 33 69.281 12.748 12.748
230 H GLY 34 HN GLY 34 67.636 14.617 14.617
231 1HA GLY 34 HA2 GLY 34 65.376 15.201 15.201
232 2HA GLY 34 HA1 GLY 34 65.346 15.437 15.437
233 H GLY 35 HN GLY 35 66.377 12.343 12.343
234 1HA GLY 35 HA2 GLY 35 64.162 10.832 10.832
235 2HA GLY 35 HA1 GLY 35 64.033 11.096 11.096
236 H ASP 36 HN ASP 36 67.126 11.188 11.188
237 HA ASP 36 HA ASP 36 67.627 8.257 8.257
238 1HB ASP 36 HB2 ASP 36 68.739 8.334 8.334
239 2HB ASP 36 HB1 ASP 36 67.014 8.698 8.698
240 H ILE 37 HN ILE 37 69.502 7.948 7.948
241 HA ILE 37 HA ILE 37 71.404 10.236 10.236
242 HB ILE 37 HB ILE 37 72.088 9.074 9.074
243 1HG1 ILE 37 HG12 ILE 37 70.234 6.861 6.861
244 2HG1 ILE 37 HG11 ILE 37 71.996 6.776 6.776
245 1HG2 ILE 37 HG23 ILE 37 69.136 9.318 9.318
246 2HG2 ILE 37 HG22 ILE 37 69.710 8.747 8.747
247 3HG2 ILE 37 HG21 ILE 37 70.171 10.348 10.348
248 HD1 ILE 37 HD1 ILE 37 72.019 6.298 6.298
249 HD1 ILE 37 HD1 ILE 37 70.276 6.054 6.054
250 HD1 ILE 37 HD1 ILE 37 70.915 7.624 7.624
251 H SER 38 HN SER 38 73.779 9.518 9.518
252 HA SER 38 HA SER 38 74.657 8.297 8.297
253 1HB SER 38 HB2 SER 38 75.782 9.073 9.073
254 2HB SER 38 HB1 SER 38 76.748 7.945 7.945
255 HG SER 38 HG SER 38 76.083 9.628 9.628
256 H THR 39 HN THR 39 74.703 6.169 6.169
257 HA THR 39 HA THR 39 73.606 4.004 4.004
258 HB THR 39 HB THR 39 75.401 2.716 2.716
259 HG1 THR 39 HG1 THR 39 76.933 4.149 4.149
260 1HG2 THR 39 HG21 THR 39 73.058 3.134 3.134
261 2HG2 THR 39 HG23 THR 39 73.533 4.717 4.717
262 3HG2 THR 39 HG22 THR 39 74.168 3.254 3.254
263 H LYS 40 HN LYS 40 76.792 5.427 5.427
264 HA LYS 40 HA LYS 40 77.914 3.256 3.256
265 1HB LYS 40 HB2 LYS 40 78.479 6.128 6.128
266 2HB LYS 40 HB1 LYS 40 79.303 5.416 5.416
267 1HG LYS 40 HG2 LYS 40 80.572 4.021 4.021
268 2HG LYS 40 HG1 LYS 40 79.281 3.777 3.777
269 1HD LYS 40 HD2 LYS 40 79.925 5.562 5.562
270 2HD LYS 40 HD1 LYS 40 80.389 6.523 6.523
271 1HE LYS 40 HE2 LYS 40 82.302 4.629 4.629
272 2HE LYS 40 HE1 LYS 40 82.023 4.613 4.613
273 1HZ LYS 40 HZ2 LYS 40 82.119 7.083 7.083
274 2HZ LYS 40 HZ1 LYS 40 82.632 6.973 6.973
275 3HZ LYS 40 HZ3 LYS 40 83.594 6.330 6.330
276 H GLU 41 HN GLU 41 75.625 5.763 5.763
277 HA GLU 41 HA GLU 41 76.084 5.703 5.703
278 1HB GLU 41 HB2 GLU 41 75.300 7.629 7.629
279 2HB GLU 41 HB1 GLU 41 73.706 6.922 6.922
280 1HG GLU 41 HG2 GLU 41 74.155 8.716 8.716
281 2HG GLU 41 HG1 GLU 41 74.010 7.154 7.154
282 H LEU 42 HN LEU 42 74.917 3.401 3.401
283 HA LEU 42 HA LEU 42 72.258 2.890 2.890
284 1HB LEU 42 HB2 LEU 42 74.069 1.888 1.888
285 2HB LEU 42 HB1 LEU 42 73.650 0.534 0.534
286 HG LEU 42 HG LEU 42 71.301 2.122 2.122
287 HD1 LEU 42 HD1 LEU 42 71.935 0.777 0.777
288 HD1 LEU 42 HD1 LEU 42 73.134 2.021 2.021
289 HD1 LEU 42 HD1 LEU 42 71.425 2.445 2.445
290 HD2 LEU 42 HD2 LEU 42 70.971 -0.085 -0.085
291 HD2 LEU 42 HD2 LEU 42 72.223 -0.730 -0.730
292 HD2 LEU 42 HD2 LEU 42 70.676 -0.213 -0.213
293 H GLY 43 HN GLY 43 75.520 2.124 2.124
294 1HA GLY 43 HA2 GLY 43 74.791 -0.001 -0.001
295 2HA GLY 43 HA1 GLY 43 76.297 0.916 0.916
296 H THR 44 HN THR 44 75.226 3.514 3.514
297 HA THR 44 HA THR 44 74.702 3.495 3.495
298 HB THR 44 HB THR 44 74.603 5.682 5.682
299 HG1 THR 44 HG1 THR 44 76.719 6.048 6.048
300 1HG2 THR 44 HG21 THR 44 73.432 6.214 6.214
301 2HG2 THR 44 HG23 THR 44 74.943 5.897 5.897
302 3HG2 THR 44 HG22 THR 44 74.842 7.231 7.231
303 H VAL 45 HN VAL 45 72.765 4.635 4.635
304 HA VAL 45 HA VAL 45 70.397 5.340 5.340
305 HB VAL 45 HB VAL 45 71.091 5.366 5.366
306 1HG1 VAL 45 HG11 VAL 45 69.907 2.579 2.579
307 2HG1 VAL 45 HG13 VAL 45 70.273 3.426 3.426
308 3HG1 VAL 45 HG12 VAL 45 71.577 2.974 2.974
309 1HG2 VAL 45 HG22 VAL 45 68.531 5.271 5.271
310 2HG2 VAL 45 HG21 VAL 45 68.978 6.115 6.115
311 3HG2 VAL 45 HG23 VAL 45 68.397 4.452 4.452
312 H MET 46 HN MET 46 71.603 2.076 2.076
313 HA MET 46 HA MET 46 69.119 0.745 0.745
314 1HB MET 46 HB2 MET 46 71.957 -0.033 -0.033
315 2HB MET 46 HB1 MET 46 70.830 -1.232 -1.232
316 1HG MET 46 HG2 MET 46 69.315 -0.905 -0.905
317 2HG MET 46 HG1 MET 46 70.208 0.509 0.509
318 1HE MET 46 HE1 MET 46 69.563 -2.957 -2.957
319 2HE MET 46 HE3 MET 46 69.572 -2.749 -2.749
320 3HE MET 46 HE2 MET 46 70.733 -3.827 -3.827
321 H ARG 47 HN ARG 47 72.394 0.937 0.937
322 HA ARG 47 HA ARG 47 71.684 -0.283 -0.283
323 1HB ARG 47 HB2 ARG 47 73.860 1.493 1.493
324 2HB ARG 47 HB1 ARG 47 73.796 1.172 1.172
325 1HG ARG 47 HG2 ARG 47 73.385 -1.293 -1.293
326 2HG ARG 47 HG1 ARG 47 74.842 -0.512 -0.512
327 1HD ARG 47 HD2 ARG 47 75.954 -1.195 -1.195
328 2HD ARG 47 HD1 ARG 47 74.851 -0.226 -0.226
329 HE ARG 47 HE ARG 47 74.286 -3.048 -3.048
330 1HH1 ARG 47 HH2 ARG 47 72.526 -0.584 -0.584
331 2HH1 ARG 47 HH2 ARG 47 72.186 -1.296 -1.296
332 1HH2 ARG 47 HH1 ARG 47 74.472 -3.875 -3.875
333 2HH2 ARG 47 HH1 ARG 47 73.288 -3.159 -3.159
334 H MET 48 HN MET 48 71.096 2.905 2.905
335 HA MET 48 HA MET 48 70.809 4.248 4.248
336 1HB MET 48 HB2 MET 48 70.584 4.789 4.789
337 2HB MET 48 HB1 MET 48 69.373 5.653 5.653
338 1HG MET 48 HG2 MET 48 71.919 5.765 5.765
339 2HG MET 48 HG1 MET 48 72.103 6.327 6.327
340 1HE MET 48 HE1 MET 48 72.672 8.070 8.070
341 2HE MET 48 HE3 MET 48 72.716 8.766 8.766
342 3HE MET 48 HE2 MET 48 71.855 9.595 9.595
343 H LEU 49 HN LEU 49 68.989 1.854 1.854
344 HA LEU 49 HA LEU 49 66.405 2.908 2.908
345 1HB LEU 49 HB2 LEU 49 66.864 0.565 0.565
346 2HB LEU 49 HB1 LEU 49 65.366 1.457 1.457
347 HG LEU 49 HG LEU 49 67.896 2.580 2.580
348 HD1 LEU 49 HD1 LEU 49 66.120 0.924 0.924
349 HD1 LEU 49 HD1 LEU 49 66.966 2.214 2.214
350 HD1 LEU 49 HD1 LEU 49 65.323 2.473 2.473
351 HD2 LEU 49 HD2 LEU 49 65.169 3.790 3.790
352 HD2 LEU 49 HD2 LEU 49 66.385 4.535 4.535
353 HD2 LEU 49 HD2 LEU 49 66.710 4.306 4.306
354 H GLY 50 HN GLY 50 68.598 0.101 0.101
355 1HA GLY 50 HA2 GLY 50 68.605 -0.768 -0.768
356 2HA GLY 50 HA1 GLY 50 66.941 -1.185 -1.185
357 H GLN 51 HN GLN 51 68.305 -1.575 -1.575
358 HA GLN 51 HA GLN 51 68.539 -4.481 -4.481
359 1HB GLN 51 HB2 GLN 51 69.122 -2.776 -2.776
360 2HB GLN 51 HB1 GLN 51 68.584 -4.456 -4.456
361 1HG GLN 51 HG2 GLN 51 66.433 -3.812 -3.812
362 2HG GLN 51 HG1 GLN 51 66.719 -2.811 -2.811
363 1HE2 GLN 51 HE21 GLN 51 65.243 -2.354 -2.354
364 2HE2 GLN 51 HE22 GLN 51 65.831 -0.841 -0.841
365 H ASN 52 HN ASN 52 70.531 -5.218 -5.218
366 HA ASN 52 HA ASN 52 73.040 -3.810 -3.810
367 1HB ASN 52 HB2 ASN 52 72.701 -4.975 -4.975
368 2HB ASN 52 HB1 ASN 52 72.243 -6.458 -6.458
369 HD2 ASN 52 HD2 ASN 52 74.088 -7.443 -7.443
370 HD2 ASN 52 HD2 ASN 52 75.668 -7.290 -7.290
371 HA PRO 53 HA PRO 53 72.993 -6.256 -6.256
372 1HB PRO 53 HB2 PRO 53 74.140 -4.293 -4.293
373 2HB PRO 53 HB1 PRO 53 72.393 -4.391 -4.391
374 1HG PRO 53 HG2 PRO 53 74.436 -2.648 -2.648
375 2HG PRO 53 HG1 PRO 53 72.769 -2.278 -2.278
376 1HD PRO 53 HD2 PRO 53 73.531 -2.815 -2.815
377 2HD PRO 53 HD1 PRO 53 71.897 -3.125 -3.125
378 H THR 54 HN THR 54 74.686 -7.682 -7.682
379 HA THR 54 HA THR 54 77.229 -7.314 -7.314
380 HB THR 54 HB THR 54 77.766 -9.379 -9.379
381 HG1 THR 54 HG1 THR 54 77.037 -9.763 -9.763
382 1HG2 THR 54 HG21 THR 54 75.296 -8.944 -8.944
383 2HG2 THR 54 HG23 THR 54 75.010 -10.120 -10.120
384 3HG2 THR 54 HG22 THR 54 76.256 -10.421 -10.421
385 H LYS 55 HN LYS 55 79.218 -6.600 -6.600
386 HA LYS 55 HA LYS 55 79.434 -4.554 -4.554
387 1HB LYS 55 HB2 LYS 55 81.178 -5.599 -5.599
388 2HB LYS 55 HB1 LYS 55 81.444 -6.806 -6.806
389 1HG LYS 55 HG2 LYS 55 82.339 -5.251 -5.251
390 2HG LYS 55 HG1 LYS 55 81.530 -3.890 -3.890
391 1HD LYS 55 HD2 LYS 55 83.258 -5.156 -5.156
392 2HD LYS 55 HD1 LYS 55 84.179 -4.820 -4.820
393 1HE LYS 55 HE2 LYS 55 82.912 -2.473 -2.473
394 2HE LYS 55 HE1 LYS 55 82.865 -2.904 -2.904
395 1HZ LYS 55 HZ3 LYS 55 85.335 -3.644 -3.644
396 2HZ LYS 55 HZ2 LYS 55 85.160 -2.370 -2.370
397 3HZ LYS 55 HZ1 LYS 55 84.961 -2.085 -2.085
398 H GLU 56 HN GLU 56 79.786 -8.038 -8.038
399 HA GLU 56 HA GLU 56 80.290 -7.872 -7.872
400 1HB GLU 56 HB2 GLU 56 79.748 -9.810 -9.810
401 2HB GLU 56 HB1 GLU 56 78.367 -9.949 -9.949
402 1HG GLU 56 HG2 GLU 56 79.828 -11.309 -11.309
403 2HG GLU 56 HG1 GLU 56 80.321 -9.763 -9.763
404 H GLU 57 HN GLU 57 77.137 -7.830 -7.830
405 HA GLU 57 HA GLU 57 75.466 -7.772 -7.772
406 1HB GLU 57 HB2 GLU 57 75.274 -6.806 -6.806
407 2HB GLU 57 HB1 GLU 57 73.934 -6.565 -6.565
408 1HG GLU 57 HG2 GLU 57 75.193 -9.283 -9.283
409 2HG GLU 57 HG1 GLU 57 73.980 -8.741 -8.741
410 H LEU 58 HN LEU 58 76.477 -4.997 -4.997
411 HA LEU 58 HA LEU 58 75.464 -2.876 -2.876
412 1HB LEU 58 HB2 LEU 58 78.242 -3.113 -3.113
413 2HB LEU 58 HB1 LEU 58 77.367 -1.609 -1.609
414 HG LEU 58 HG LEU 58 76.677 -3.813 -3.813
415 HD1 LEU 58 HD1 LEU 58 77.271 -0.851 -0.851
416 HD1 LEU 58 HD1 LEU 58 78.206 -2.185 -2.185
417 HD1 LEU 58 HD1 LEU 58 76.615 -1.803 -1.803
418 HD2 LEU 58 HD2 LEU 58 74.547 -3.330 -3.330
419 HD2 LEU 58 HD2 LEU 58 74.965 -1.658 -1.658
420 HD2 LEU 58 HD2 LEU 58 74.692 -2.147 -2.147
421 H ASP 59 HN ASP 59 78.608 -4.491 -4.491
422 HA ASP 59 HA ASP 59 79.229 -2.980 -2.980
423 1HB ASP 59 HB2 ASP 59 80.480 -4.755 -4.755
424 2HB ASP 59 HB1 ASP 59 80.280 -5.725 -5.725
425 H ALA 60 HN ALA 60 77.372 -5.906 -5.906
426 HA ALA 60 HA ALA 60 77.220 -6.724 -6.724
427 1HB ALA 60 HB1 ALA 60 76.282 -7.575 -7.575
428 2HB ALA 60 HB3 ALA 60 75.176 -7.971 -7.971
429 3HB ALA 60 HB2 ALA 60 76.840 -8.554 -8.554
430 H ILE 61 HN ILE 61 75.070 -5.040 -5.040
431 HA ILE 61 HA ILE 61 72.865 -4.775 -4.775
432 HB ILE 61 HB ILE 61 73.710 -3.609 -3.609
433 1HG1 ILE 61 HG12 ILE 61 71.663 -4.718 -4.718
434 2HG1 ILE 61 HG11 ILE 61 71.232 -5.109 -5.109
435 1HG2 ILE 61 HG23 ILE 61 71.397 -2.691 -2.691
436 2HG2 ILE 61 HG22 ILE 61 71.479 -2.400 -2.400
437 3HG2 ILE 61 HG21 ILE 61 72.694 -1.699 -1.699
438 HD1 ILE 61 HD1 ILE 61 72.257 -7.051 -7.051
439 HD1 ILE 61 HD1 ILE 61 73.703 -6.097 -6.097
440 HD1 ILE 61 HD1 ILE 61 73.265 -6.490 -6.490
441 H ILE 62 HN ILE 62 75.513 -2.600 -2.600
442 HA ILE 62 HA ILE 62 74.770 -0.286 -0.286
443 HB ILE 62 HB ILE 62 77.407 -1.533 -1.533
444 1HG1 ILE 62 HG12 ILE 62 76.018 0.962 0.962
445 2HG1 ILE 62 HG11 ILE 62 75.746 -0.633 -0.633
446 1HG2 ILE 62 HG21 ILE 62 76.978 0.552 0.552
447 2HG2 ILE 62 HG23 ILE 62 77.705 1.256 1.256
448 3HG2 ILE 62 HG22 ILE 62 78.509 -0.075 -0.075
449 HD1 ILE 62 HD1 ILE 62 77.499 0.667 0.667
450 HD1 ILE 62 HD1 ILE 62 78.464 0.687 0.687
451 HD1 ILE 62 HD1 ILE 62 78.114 -0.844 -0.844
452 H GLU 63 HN GLU 63 77.293 -2.614 -2.614
453 HA GLU 63 HA GLU 63 77.566 -1.813 -1.813
454 1HB GLU 63 HB2 GLU 63 78.546 -3.789 -3.789
455 2HB GLU 63 HB1 GLU 63 77.358 -4.738 -4.738
456 1HG GLU 63 HG2 GLU 63 78.314 -3.976 -3.976
457 2HG GLU 63 HG1 GLU 63 79.477 -2.972 -2.972
458 H GLU 64 HN GLU 64 74.962 -3.703 -3.703
459 HA GLU 64 HA GLU 64 73.658 -4.445 -4.445
460 1HB GLU 64 HB2 GLU 64 73.143 -5.769 -5.769
461 2HB GLU 64 HB1 GLU 64 73.034 -4.379 -4.379
462 1HG GLU 64 HG2 GLU 64 70.863 -3.901 -3.901
463 2HG GLU 64 HG1 GLU 64 71.068 -4.531 -4.531
464 H VAL 65 HN VAL 65 72.797 -2.040 -2.040
465 HA VAL 65 HA VAL 65 70.839 -0.731 -0.731
466 HB VAL 65 HB VAL 65 70.623 0.749 0.749
467 1HG1 VAL 65 HG12 VAL 65 71.105 -2.147 -2.147
468 2HG1 VAL 65 HG11 VAL 65 70.229 -0.980 -0.980
469 3HG1 VAL 65 HG13 VAL 65 69.588 -1.460 -1.460
470 1HG2 VAL 65 HG23 VAL 65 73.357 -0.285 -0.285
471 2HG2 VAL 65 HG22 VAL 65 72.658 1.287 1.287
472 3HG2 VAL 65 HG21 VAL 65 72.333 -0.105 -0.105
473 H ASP 66 HN ASP 66 74.172 -0.707 -0.707
474 HA ASP 66 HA ASP 66 74.483 2.183 2.183
475 1HB ASP 66 HB2 ASP 66 76.087 0.989 0.989
476 2HB ASP 66 HB1 ASP 66 76.429 -0.145 -0.145
477 H GLU 67 HN GLU 67 74.157 -0.876 -0.876
478 HA GLU 67 HA GLU 67 75.474 -0.273 -0.273
479 1HB GLU 67 HB2 GLU 67 74.126 -2.380 -2.380
480 2HB GLU 67 HB1 GLU 67 73.045 -1.924 -1.924
481 1HG GLU 67 HG2 GLU 67 75.461 -1.819 -1.819
482 2HG GLU 67 HG1 GLU 67 75.747 -3.120 -3.120
483 H ASP 68 HN ASP 68 72.687 1.102 1.102
484 HA ASP 68 HA ASP 68 71.089 1.579 1.579
485 1HB ASP 68 HB2 ASP 68 71.357 2.726 2.726
486 2HB ASP 68 HB1 ASP 68 70.275 3.490 3.490
487 H GLY 69 HN GLY 69 74.089 2.874 2.874
488 1HA GLY 69 HA2 GLY 69 75.448 4.425 4.425
489 2HA GLY 69 HA1 GLY 69 74.074 4.790 4.790
490 H SER 70 HN SER 70 72.739 4.977 4.977
491 HA SER 70 HA SER 70 72.907 7.916 7.916
492 1HB SER 70 HB2 SER 70 71.141 7.617 7.617
493 2HB SER 70 HB1 SER 70 70.788 6.674 6.674
494 HG SER 70 HG SER 70 70.583 5.548 5.548
495 H GLY 71 HN GLY 71 74.182 5.181 5.181
496 1HA GLY 71 HA2 GLY 71 75.862 5.135 5.135
497 2HA GLY 71 HA1 GLY 71 76.087 6.864 6.864
498 H THR 72 HN THR 72 72.840 6.320 6.320
499 HA THR 72 HA THR 72 73.147 6.764 6.764
500 HB THR 72 HB THR 72 71.045 8.266 8.266
501 HG1 THR 72 HG1 THR 72 70.847 8.944 8.944
502 1HG2 THR 72 HG21 THR 72 73.936 8.794 8.794
503 2HG2 THR 72 HG23 THR 72 72.820 10.045 10.045
504 3HG2 THR 72 HG22 THR 72 72.813 9.533 9.533
505 H ILE 73 HN ILE 73 70.931 6.397 6.397
506 HA ILE 73 HA ILE 73 69.503 4.106 4.106
507 HB ILE 73 HB ILE 73 71.109 3.620 3.620
508 1HG1 ILE 73 HG12 ILE 73 69.091 2.419 2.419
509 2HG1 ILE 73 HG11 ILE 73 68.225 2.880 2.880
510 1HG2 ILE 73 HG22 ILE 73 70.415 5.729 5.729
511 2HG2 ILE 73 HG21 ILE 73 68.922 4.890 4.890
512 3HG2 ILE 73 HG23 ILE 73 70.472 4.262 4.262
513 HD1 ILE 73 HD1 ILE 73 69.105 1.032 1.032
514 HD1 ILE 73 HD1 ILE 73 70.233 0.797 0.797
515 HD1 ILE 73 HD1 ILE 73 70.649 1.882 1.882
516 H ASP 74 HN ASP 74 67.264 4.261 4.261
517 HA ASP 74 HA ASP 74 66.079 6.759 6.759
518 1HB ASP 74 HB2 ASP 74 64.927 4.517 4.517
519 2HB ASP 74 HB1 ASP 74 64.197 6.100 6.100
520 H PHE 75 HN PHE 75 64.688 6.763 6.763
521 HA PHE 75 HA PHE 75 64.610 4.833 4.833
522 1HB PHE 75 HB2 PHE 75 63.631 7.170 7.170
523 2HB PHE 75 HB1 PHE 75 62.236 6.507 6.507
524 HD1 PHE 75 HD2 PHE 75 64.205 6.303 6.303
525 HD2 PHE 75 HD1 PHE 75 60.548 5.269 5.269
526 HE1 PHE 75 HE2 PHE 75 63.232 5.560 5.560
527 HE2 PHE 75 HE1 PHE 75 59.577 4.527 4.527
528 HZ PHE 75 HZ PHE 75 60.918 4.672 4.672
529 H GLU 76 HN GLU 76 62.298 5.082 5.082
530 HA GLU 76 HA GLU 76 60.636 2.892 2.892
531 1HB GLU 76 HB2 GLU 76 61.466 4.472 4.472
532 2HB GLU 76 HB1 GLU 76 60.886 2.855 2.855
533 1HG GLU 76 HG2 GLU 76 58.928 3.416 3.416
534 2HG GLU 76 HG1 GLU 76 59.423 5.090 5.090
535 H GLU 77 HN GLU 77 63.322 2.750 2.750
536 HA GLU 77 HA GLU 77 63.461 -0.112 -0.112
537 1HB GLU 77 HB2 GLU 77 64.327 1.398 1.398
538 2HB GLU 77 HB1 GLU 77 65.525 2.029 2.029
539 1HG GLU 77 HG2 GLU 77 66.914 0.313 0.313
540 2HG GLU 77 HG1 GLU 77 65.646 -0.857 -0.857
541 H PHE 78 HN PHE 78 64.872 2.311 2.311
542 HA PHE 78 HA PHE 78 66.901 0.592 0.592
543 1HB PHE 78 HB2 PHE 78 67.235 2.937 2.937
544 2HB PHE 78 HB1 PHE 78 65.584 3.232 3.232
545 HD1 PHE 78 HD1 PHE 78 68.538 1.170 1.170
546 HD2 PHE 78 HD2 PHE 78 65.351 3.811 3.811
547 HE1 PHE 78 HE1 PHE 78 69.296 1.062 1.062
548 HE2 PHE 78 HE2 PHE 78 66.108 3.702 3.702
549 HZ PHE 78 HZ PHE 78 68.079 2.325 2.325
550 H LEU 79 HN LEU 79 63.509 1.311 1.311
551 HA LEU 79 HA LEU 79 63.241 0.414 0.414
552 1HB LEU 79 HB2 LEU 79 61.534 0.322 0.322
553 2HB LEU 79 HB1 LEU 79 60.937 -0.388 -0.388
554 HG LEU 79 HG LEU 79 62.097 2.381 2.381
555 HD1 LEU 79 HD1 LEU 79 60.265 3.378 3.378
556 HD1 LEU 79 HD1 LEU 79 59.162 2.128 2.128
557 HD1 LEU 79 HD1 LEU 79 60.144 1.844 1.844
558 HD2 LEU 79 HD2 LEU 79 61.271 2.346 2.346
559 HD2 LEU 79 HD2 LEU 79 60.924 0.633 0.633
560 HD2 LEU 79 HD2 LEU 79 59.682 1.839 1.839
561 H VAL 80 HN VAL 80 63.353 -1.524 -1.524
562 HA VAL 80 HA VAL 80 62.813 -4.072 -4.072
563 HB VAL 80 HB VAL 80 62.957 -3.358 -3.358
564 1HG1 VAL 80 HG11 VAL 80 65.414 -2.441 -2.441
565 2HG1 VAL 80 HG13 VAL 80 65.852 -4.043 -4.043
566 3HG1 VAL 80 HG12 VAL 80 64.973 -2.930 -2.930
567 1HG2 VAL 80 HG22 VAL 80 64.295 -5.833 -5.833
568 2HG2 VAL 80 HG21 VAL 80 62.711 -5.679 -5.679
569 3HG2 VAL 80 HG23 VAL 80 64.174 -5.570 -5.570
570 H MET 81 HN MET 81 65.732 -2.104 -2.104
571 HA MET 81 HA MET 81 67.549 -4.230 -4.230
572 1HB MET 81 HB2 MET 81 67.526 -1.312 -1.312
573 2HB MET 81 HB1 MET 81 68.654 -1.839 -1.839
574 1HG MET 81 HG2 MET 81 69.709 -1.811 -1.811
575 2HG MET 81 HG1 MET 81 69.672 -3.434 -3.434
576 1HE MET 81 HE3 MET 81 68.697 -5.209 -5.209
577 2HE MET 81 HE2 MET 81 67.746 -5.569 -5.569
578 3HE MET 81 HE1 MET 81 69.457 -5.177 -5.177
579 H MET 82 HN MET 82 65.402 -2.000 -2.000
580 HA MET 82 HA MET 82 66.549 -2.548 -2.548
581 1HB MET 82 HB2 MET 82 64.044 -1.119 -1.119
582 2HB MET 82 HB1 MET 82 64.652 -1.087 -1.087
583 1HG MET 82 HG2 MET 82 66.847 -0.207 -0.207
584 2HG MET 82 HG1 MET 82 65.958 0.045 0.045
585 1HE MET 82 HE3 MET 82 63.280 0.912 0.912
586 2HE MET 82 HE2 MET 82 63.354 2.652 2.652
587 3HE MET 82 HE1 MET 82 64.401 1.904 1.904
588 H VAL 83 HN VAL 83 63.505 -3.311 -3.311
589 HA VAL 83 HA VAL 83 62.327 -4.881 -4.881
590 HB VAL 83 HB VAL 83 60.794 -5.527 -5.527
591 1HG1 VAL 83 HG11 VAL 83 61.716 -2.849 -2.849
592 2HG1 VAL 83 HG13 VAL 83 61.386 -3.137 -3.137
593 3HG1 VAL 83 HG12 VAL 83 60.119 -3.401 -3.401
594 1HG2 VAL 83 HG23 VAL 83 63.024 -4.875 -4.875
595 2HG2 VAL 83 HG22 VAL 83 62.419 -6.486 -6.486
596 3HG2 VAL 83 HG21 VAL 83 61.384 -5.336 -5.336
597 H ARG 84 HN ARG 84 64.385 -5.791 -5.791
598 HA ARG 84 HA ARG 84 64.357 -8.615 -8.615
599 1HB ARG 84 HB2 ARG 84 66.405 -6.737 -6.737
600 2HB ARG 84 HB1 ARG 84 66.438 -8.492 -8.492
601 1HG ARG 84 HG2 ARG 84 63.925 -7.003 -7.003
602 2HG ARG 84 HG1 ARG 84 65.263 -7.008 -7.008
603 1HD ARG 84 HD2 ARG 84 65.181 -9.359 -9.359
604 2HD ARG 84 HD1 ARG 84 64.243 -9.582 -9.582
605 HE ARG 84 HE ARG 84 63.072 -8.044 -8.044
606 1HH1 ARG 84 HH2 ARG 84 62.443 -9.667 -9.667
607 2HH1 ARG 84 HH2 ARG 84 61.090 -10.568 -10.568
608 1HH2 ARG 84 HH1 ARG 84 61.577 -9.622 -9.622
609 2HH2 ARG 84 HH1 ARG 84 60.600 -10.542 -10.542
610 H GLN 85 HN GLN 85 66.121 -5.988 -5.988
611 HA GLN 85 HA GLN 85 67.979 -7.829 -7.829
612 1HB GLN 85 HB2 GLN 85 68.617 -5.594 -5.594
613 2HB GLN 85 HB1 GLN 85 67.596 -4.828 -4.828
614 1HG GLN 85 HG2 GLN 85 69.812 -4.809 -4.809
615 2HG GLN 85 HG1 GLN 85 68.955 -6.096 -6.096
616 1HE2 GLN 85 HE22 GLN 85 71.464 -7.387 -7.387
617 2HE2 GLN 85 HE21 GLN 85 70.448 -6.057 -6.057
618 H MET 86 HN MET 86 65.083 -5.910 -5.910
619 HA MET 86 HA MET 86 65.256 -6.343 -6.343
620 1HB MET 86 HB2 MET 86 63.949 -4.583 -4.583
621 2HB MET 86 HB1 MET 86 62.732 -5.329 -5.329
622 1HG MET 86 HG2 MET 86 64.892 -4.688 -4.688
623 2HG MET 86 HG1 MET 86 64.659 -3.279 -3.279
624 1HE MET 86 HE2 MET 86 64.559 -3.029 -3.029
625 2HE MET 86 HE1 MET 86 63.656 -1.641 -1.641
626 3HE MET 86 HE3 MET 86 63.006 -2.616 -2.616
627 H LYS 87 HN LYS 87 63.400 -7.604 -7.604
628 HA LYS 87 HA LYS 87 61.351 -8.985 -8.985
629 1HB LYS 87 HB2 LYS 87 61.681 -10.655 -10.655
630 2HB LYS 87 HB1 LYS 87 61.520 -8.970 -8.970
631 1HG LYS 87 HG2 LYS 87 63.444 -9.291 -9.291
632 2HG LYS 87 HG1 LYS 87 64.241 -9.218 -9.218
633 1HD LYS 87 HD2 LYS 87 64.983 -11.252 -11.252
634 2HD LYS 87 HD1 LYS 87 63.795 -11.722 -11.722
635 1HE LYS 87 HE2 LYS 87 62.044 -11.685 -11.685
636 2HE LYS 87 HE1 LYS 87 63.392 -11.541 -11.541
637 1HZ LYS 87 HZ3 LYS 87 63.588 -13.555 -13.555
638 2HZ LYS 87 HZ2 LYS 87 62.549 -13.885 -13.885
639 3HZ LYS 87 HZ1 LYS 87 64.199 -13.590 -13.590
640 H GLU 88 HN GLU 88 64.785 -9.570 -9.570
641 HA GLU 88 HA GLU 88 64.447 -12.188 -12.188
642 1HB GLU 88 HB2 GLU 88 66.428 -10.835 -10.835
643 2HB GLU 88 HB1 GLU 88 67.154 -11.571 -11.571
644 1HG GLU 88 HG2 GLU 88 65.659 -13.634 -13.634
645 2HG GLU 88 HG1 GLU 88 65.645 -12.884 -12.884
646 H ASP 89 HN ASP 89 65.758 -8.912 -8.912
647 HA ASP 89 HA ASP 89 66.737 -9.412 -9.412
648 1HB ASP 89 HB2 ASP 89 67.496 -7.704 -7.704
649 2HB ASP 89 HB1 ASP 89 66.103 -6.750 -6.750
650 H ALA 90 HN ALA 90 63.779 -8.142 -8.142
651 HA ALA 90 HA ALA 90 62.608 -6.954 -6.954
652 1HB ALA 90 HB3 ALA 90 61.631 -8.191 -8.191
653 2HB ALA 90 HB2 ALA 90 60.470 -7.625 -7.625
654 3HB ALA 90 HB1 ALA 90 61.618 -6.496 -6.496
Start of MODEL 17
1 1H ALA 1 HT2 ALA 1 63.261 -3.957 -3.957
2 2H ALA 1 HT1 ALA 1 64.230 -3.899 -3.899
3 3H ALA 1 HT3 ALA 1 63.088 -5.139 -5.139
4 HA ALA 1 HA ALA 1 65.204 -6.091 -6.091
5 1HB ALA 1 HB2 ALA 1 65.424 -3.451 -3.451
6 2HB ALA 1 HB1 ALA 1 66.403 -4.800 -4.800
7 3HB ALA 1 HB3 ALA 1 66.573 -4.231 -4.231
8 H SER 2 HN SER 2 65.917 -6.897 -6.897
9 HA SER 2 HA SER 2 63.450 -7.928 -7.928
10 1HB SER 2 HB2 SER 2 64.976 -9.600 -9.600
11 2HB SER 2 HB1 SER 2 66.319 -8.493 -8.493
12 HG SER 2 HG SER 2 66.458 -8.126 -8.126
13 H MET 3 HN MET 3 65.556 -5.256 -5.256
14 HA MET 3 HA MET 3 65.239 -5.006 -5.006
15 1HB MET 3 HB2 MET 3 66.252 -3.409 -3.409
16 2HB MET 3 HB1 MET 3 65.876 -2.531 -2.531
17 1HG MET 3 HG2 MET 3 67.239 -4.510 -4.510
18 2HG MET 3 HG1 MET 3 67.955 -4.630 -4.630
19 1HE MET 3 HE1 MET 3 69.210 -3.195 -3.195
20 2HE MET 3 HE3 MET 3 70.203 -1.882 -1.882
21 3HE MET 3 HE2 MET 3 70.450 -3.535 -3.535
22 H THR 4 HN THR 4 63.770 -3.234 -3.234
23 HA THR 4 HA THR 4 61.986 -1.590 -1.590
24 HB THR 4 HB THR 4 62.463 -1.671 -1.671
25 HG1 THR 4 HG1 THR 4 60.690 -0.504 -0.504
26 1HG2 THR 4 HG22 THR 4 61.923 -4.302 -4.302
27 2HG2 THR 4 HG21 THR 4 60.339 -3.723 -3.723
28 3HG2 THR 4 HG23 THR 4 61.763 -3.394 -3.394
29 H ASP 5 HN ASP 5 61.818 -5.057 -5.057
30 HA ASP 5 HA ASP 5 59.000 -5.285 -5.285
31 1HB ASP 5 HB2 ASP 5 60.199 -6.789 -6.789
32 2HB ASP 5 HB1 ASP 5 61.198 -7.362 -7.362
33 H GLN 6 HN GLN 6 62.105 -6.357 -6.357
34 HA GLN 6 HA GLN 6 61.111 -7.252 -7.252
35 1HB GLN 6 HB2 GLN 6 63.541 -6.939 -6.939
36 2HB GLN 6 HB1 GLN 6 63.663 -5.771 -5.771
37 1HG GLN 6 HG2 GLN 6 64.010 -7.432 -7.432
38 2HG GLN 6 HG1 GLN 6 62.481 -8.181 -8.181
39 1HE2 GLN 6 HE22 GLN 6 64.492 -10.887 -10.887
40 2HE2 GLN 6 HE21 GLN 6 63.398 -10.358 -10.358
41 H GLN 7 HN GLN 7 61.341 -4.019 -4.019
42 HA GLN 7 HA GLN 7 61.394 -2.655 -2.655
43 1HB GLN 7 HB2 GLN 7 62.186 -1.777 -1.777
44 2HB GLN 7 HB1 GLN 7 60.496 -1.680 -1.680
45 1HG GLN 7 HG2 GLN 7 60.793 -0.446 -0.446
46 2HG GLN 7 HG1 GLN 7 61.974 0.244 0.244
47 1HE2 GLN 7 HE22 GLN 7 59.124 1.034 1.034
48 2HE2 GLN 7 HE21 GLN 7 60.456 -0.014 -0.014
49 H ALA 8 HN ALA 8 58.860 -3.413 -3.413
50 HA ALA 8 HA ALA 8 56.653 -2.129 -2.129
51 1HB ALA 8 HB3 ALA 8 56.960 -4.804 -4.804
52 2HB ALA 8 HB2 ALA 8 55.392 -4.061 -4.061
53 3HB ALA 8 HB1 ALA 8 56.551 -3.256 -3.256
54 H GLU 9 HN GLU 9 57.440 -5.588 -5.588
55 HA GLU 9 HA GLU 9 55.694 -5.780 -5.780
56 1HB GLU 9 HB2 GLU 9 56.695 -7.519 -7.519
57 2HB GLU 9 HB1 GLU 9 57.962 -7.665 -7.665
58 1HG GLU 9 HG2 GLU 9 56.233 -8.134 -8.134
59 2HG GLU 9 HG1 GLU 9 54.990 -8.047 -8.047
60 H ALA 10 HN ALA 10 58.666 -4.284 -4.284
61 HA ALA 10 HA ALA 10 59.904 -5.094 -5.094
62 1HB ALA 10 HB2 ALA 10 60.475 -3.505 -3.505
63 2HB ALA 10 HB1 ALA 10 60.998 -2.672 -2.672
64 3HB ALA 10 HB3 ALA 10 61.600 -4.292 -4.292
65 H ARG 11 HN ARG 11 57.774 -2.488 -2.488
66 HA ARG 11 HA ARG 11 58.050 -1.031 -1.031
67 1HB ARG 11 HB2 ARG 11 56.017 -0.441 -0.441
68 2HB ARG 11 HB1 ARG 11 56.901 0.685 0.685
69 1HG ARG 11 HG2 ARG 11 58.340 0.990 0.990
70 2HG ARG 11 HG1 ARG 11 58.869 -0.679 -0.679
71 1HD ARG 11 HD2 ARG 11 58.129 -0.326 -0.326
72 2HD ARG 11 HD1 ARG 11 56.974 -1.396 -1.396
73 HE ARG 11 HE ARG 11 55.708 0.823 0.823
74 1HH1 ARG 11 HH1 ARG 11 57.738 2.397 2.397
75 2HH1 ARG 11 HH1 ARG 11 56.873 2.573 2.573
76 1HH2 ARG 11 HH2 ARG 11 54.547 0.114 0.114
77 2HH2 ARG 11 HH2 ARG 11 55.068 1.281 1.281
78 H ALA 12 HN ALA 12 55.645 -2.940 -2.940
79 HA ALA 12 HA ALA 12 53.364 -2.602 -2.602
80 1HB ALA 12 HB2 ALA 12 54.240 -4.190 -4.190
81 2HB ALA 12 HB1 ALA 12 53.935 -5.373 -5.373
82 3HB ALA 12 HB3 ALA 12 52.643 -4.297 -4.297
83 H PHE 13 HN PHE 13 56.196 -4.658 -4.658
84 HA PHE 13 HA PHE 13 55.165 -6.146 -6.146
85 1HB PHE 13 HB2 PHE 13 57.278 -6.663 -6.663
86 2HB PHE 13 HB1 PHE 13 57.922 -5.069 -5.069
87 HD1 PHE 13 HD1 PHE 13 56.647 -8.230 -8.230
88 HD2 PHE 13 HD2 PHE 13 58.964 -4.660 -4.660
89 HE1 PHE 13 HE1 PHE 13 57.433 -9.091 -9.091
90 HE2 PHE 13 HE2 PHE 13 59.752 -5.517 -5.517
91 HZ PHE 13 HZ PHE 13 58.986 -7.733 -7.733
92 H LEU 14 HN LEU 14 56.406 -2.837 -2.837
93 HA LEU 14 HA LEU 14 56.225 -2.539 -2.539
94 1HB LEU 14 HB2 LEU 14 56.970 -0.506 -0.506
95 2HB LEU 14 HB1 LEU 14 57.402 -0.481 -0.481
96 HG LEU 14 HG LEU 14 58.407 -2.900 -2.900
97 HD1 LEU 14 HD1 LEU 14 59.691 -1.871 -1.871
98 HD1 LEU 14 HD1 LEU 14 58.032 -1.321 -1.321
99 HD1 LEU 14 HD1 LEU 14 58.372 -3.041 -3.041
100 HD2 LEU 14 HD2 LEU 14 60.583 -1.438 -1.438
101 HD2 LEU 14 HD2 LEU 14 59.849 -1.505 -1.505
102 HD2 LEU 14 HD2 LEU 14 59.537 -0.127 -0.127
103 H SER 15 HN SER 15 54.354 -1.782 -1.782
104 HA SER 15 HA SER 15 52.060 -0.998 -0.998
105 1HB SER 15 HB2 SER 15 52.927 -1.241 -1.241
106 2HB SER 15 HB1 SER 15 51.717 0.016 0.016
107 HG SER 15 HG SER 15 51.393 -2.627 -2.627
108 H GLU 16 HN GLU 16 51.269 1.075 1.075
109 HA GLU 16 HA GLU 16 52.904 3.195 3.195
110 1HB GLU 16 HB2 GLU 16 50.481 2.957 2.957
111 2HB GLU 16 HB1 GLU 16 50.119 3.331 3.331
112 1HG GLU 16 HG2 GLU 16 50.617 5.558 5.558
113 2HG GLU 16 HG1 GLU 16 51.866 5.253 5.253
114 H GLU 17 HN GLU 17 51.832 2.304 2.304
115 HA GLU 17 HA GLU 17 52.487 4.808 4.808
116 1HB GLU 17 HB2 GLU 17 50.964 2.917 2.917
117 2HB GLU 17 HB1 GLU 17 52.427 2.015 2.015
118 1HG GLU 17 HG2 GLU 17 53.115 4.139 4.139
119 2HG GLU 17 HG1 GLU 17 51.407 4.571 4.571
120 H MET 18 HN MET 18 54.208 1.671 1.671
121 HA MET 18 HA MET 18 56.564 2.536 2.536
122 1HB MET 18 HB2 MET 18 56.000 0.200 0.200
123 2HB MET 18 HB1 MET 18 55.989 0.352 0.352
124 1HG MET 18 HG2 MET 18 58.090 -0.683 -0.683
125 2HG MET 18 HG1 MET 18 58.401 0.887 0.887
126 1HE MET 18 HE3 MET 18 57.549 -0.943 -0.943
127 2HE MET 18 HE2 MET 18 58.006 0.178 0.178
128 3HE MET 18 HE1 MET 18 56.636 0.554 0.554
129 H ILE 19 HN ILE 19 55.883 2.216 2.216
130 HA ILE 19 HA ILE 19 58.304 2.993 2.993
131 HB ILE 19 HB ILE 19 55.437 3.665 3.665
132 1HG1 ILE 19 HG12 ILE 19 57.429 1.786 1.786
133 2HG1 ILE 19 HG11 ILE 19 56.288 1.282 1.282
134 1HG2 ILE 19 HG22 ILE 19 57.981 4.544 4.544
135 2HG2 ILE 19 HG21 ILE 19 56.708 3.971 3.971
136 3HG2 ILE 19 HG23 ILE 19 56.400 5.325 5.325
137 HD1 ILE 19 HD1 ILE 19 55.753 2.143 2.143
138 HD1 ILE 19 HD1 ILE 19 54.522 2.441 2.441
139 HD1 ILE 19 HD1 ILE 19 55.066 0.794 0.794
140 H ALA 20 HN ALA 20 55.922 5.051 5.051
141 HA ALA 20 HA ALA 20 57.198 7.568 7.568
142 1HB ALA 20 HB2 ALA 20 54.811 7.314 7.314
143 2HB ALA 20 HB1 ALA 20 55.265 6.781 6.781
144 3HB ALA 20 HB3 ALA 20 55.605 8.433 8.433
145 H GLU 21 HN GLU 21 57.671 5.155 5.155
146 HA GLU 21 HA GLU 21 59.046 6.842 6.842
147 1HB GLU 21 HB2 GLU 21 58.042 4.789 4.789
148 2HB GLU 21 HB1 GLU 21 58.865 3.869 3.869
149 1HG GLU 21 HG2 GLU 21 59.907 3.595 3.595
150 2HG GLU 21 HG1 GLU 21 61.020 4.246 4.246
151 H PHE 22 HN PHE 22 60.151 4.583 4.583
152 HA PHE 22 HA PHE 22 62.967 4.984 4.984
153 1HB PHE 22 HB2 PHE 22 61.394 4.120 4.120
154 2HB PHE 22 HB1 PHE 22 63.127 3.889 3.889
155 HD1 PHE 22 HD2 PHE 22 62.130 3.564 3.564
156 HD2 PHE 22 HD1 PHE 22 61.632 1.508 1.508
157 HE1 PHE 22 HE2 PHE 22 61.695 1.450 1.450
158 HE2 PHE 22 HE1 PHE 22 61.197 -0.607 -0.607
159 HZ PHE 22 HZ PHE 22 61.228 -0.634 -0.634
160 H LYS 23 HN LYS 23 60.549 6.709 6.709
161 HA LYS 23 HA LYS 23 62.027 8.163 8.163
162 1HB LYS 23 HB2 LYS 23 59.533 8.208 8.208
163 2HB LYS 23 HB1 LYS 23 59.969 9.389 9.389
164 1HG LYS 23 HG2 LYS 23 59.424 10.756 10.756
165 2HG LYS 23 HG1 LYS 23 61.176 10.623 10.623
166 1HD LYS 23 HD2 LYS 23 61.037 9.058 9.058
167 2HD LYS 23 HD1 LYS 23 59.355 8.668 8.668
168 1HE LYS 23 HE2 LYS 23 59.291 10.072 10.072
169 2HE LYS 23 HE1 LYS 23 58.832 11.125 11.125
170 1HZ LYS 23 HZ2 LYS 23 61.683 10.808 10.808
171 2HZ LYS 23 HZ1 LYS 23 60.800 11.746 11.746
172 3HZ LYS 23 HZ3 LYS 23 60.825 12.175 12.175
173 H ALA 24 HN ALA 24 61.246 9.579 9.579
174 HA ALA 24 HA ALA 24 63.072 11.676 11.676
175 1HB ALA 24 HB3 ALA 24 61.455 10.179 10.179
176 2HB ALA 24 HB2 ALA 24 63.012 10.499 10.499
177 3HB ALA 24 HB1 ALA 24 62.035 11.838 11.838
178 H ALA 25 HN ALA 25 63.758 8.262 8.262
179 HA ALA 25 HA ALA 25 66.484 8.719 8.719
180 1HB ALA 25 HB1 ALA 25 65.067 6.834 6.834
181 2HB ALA 25 HB3 ALA 25 65.000 6.233 6.233
182 3HB ALA 25 HB2 ALA 25 66.532 6.245 6.245
183 H PHE 26 HN PHE 26 64.899 7.801 7.801
184 HA PHE 26 HA PHE 26 67.306 7.100 7.100
185 1HB PHE 26 HB2 PHE 26 65.054 6.396 6.396
186 2HB PHE 26 HB1 PHE 26 64.577 8.078 8.078
187 HD1 PHE 26 HD2 PHE 26 65.486 9.392 9.392
188 HD2 PHE 26 HD1 PHE 26 66.486 5.248 5.248
189 HE1 PHE 26 HE2 PHE 26 66.359 9.309 9.309
190 HE2 PHE 26 HE1 PHE 26 67.360 5.165 5.165
191 HZ PHE 26 HZ PHE 26 67.297 7.194 7.194
192 H ASP 27 HN ASP 27 65.325 10.092 10.092
193 HA ASP 27 HA ASP 27 66.974 11.594 11.594
194 1HB ASP 27 HB2 ASP 27 65.787 13.521 13.521
195 2HB ASP 27 HB1 ASP 27 64.699 12.218 12.218
196 H MET 28 HN MET 28 67.601 10.534 10.534
197 HA MET 28 HA MET 28 69.093 12.632 12.632
198 1HB MET 28 HB2 MET 28 69.380 9.616 9.616
199 2HB MET 28 HB1 MET 28 70.291 10.680 10.680
200 1HG MET 28 HG2 MET 28 67.921 11.694 11.694
201 2HG MET 28 HG1 MET 28 67.339 10.144 10.144
202 1HE MET 28 HE2 MET 28 66.890 11.450 11.450
203 2HE MET 28 HE1 MET 28 66.303 9.791 9.791
204 3HE MET 28 HE3 MET 28 67.345 10.418 10.418
205 H PHE 29 HN PHE 29 69.820 10.731 10.731
206 HA PHE 29 HA PHE 29 72.556 11.956 11.956
207 1HB PHE 29 HB2 PHE 29 72.110 9.288 9.288
208 2HB PHE 29 HB1 PHE 29 73.533 9.910 9.910
209 HD1 PHE 29 HD2 PHE 29 70.196 8.382 8.382
210 HD2 PHE 29 HD1 PHE 29 73.813 9.659 9.659
211 HE1 PHE 29 HE2 PHE 29 69.526 7.166 7.166
212 HE2 PHE 29 HE1 PHE 29 73.144 8.441 8.441
213 HZ PHE 29 HZ PHE 29 71.001 7.195 7.195
214 H ASP 30 HN ASP 30 70.286 13.090 13.090
215 HA ASP 30 HA ASP 30 69.881 12.223 12.223
216 1HB ASP 30 HB2 ASP 30 68.892 14.480 14.480
217 2HB ASP 30 HB1 ASP 30 68.397 13.725 13.725
218 H ALA 31 HN ALA 31 72.034 11.835 11.835
219 HA ALA 31 HA ALA 31 74.155 13.750 13.750
220 1HB ALA 31 HB1 ALA 31 73.332 11.474 11.474
221 2HB ALA 31 HB3 ALA 31 74.862 12.334 12.334
222 3HB ALA 31 HB2 ALA 31 74.523 11.427 11.427
223 H ASP 32 HN ASP 32 71.317 13.320 13.320
224 HA ASP 32 HA ASP 32 72.238 15.461 15.461
225 1HB ASP 32 HB2 ASP 32 70.022 13.416 13.416
226 2HB ASP 32 HB1 ASP 32 69.961 14.748 14.748
227 H GLY 33 HN GLY 33 69.985 14.894 14.894
228 1HA GLY 33 HA2 GLY 33 69.357 17.032 17.032
229 2HA GLY 33 HA1 GLY 33 68.920 17.665 17.665
230 H GLY 34 HN GLY 34 68.102 14.483 14.483
231 1HA GLY 34 HA2 GLY 34 65.990 13.719 13.719
232 2HA GLY 34 HA1 GLY 34 65.268 15.120 15.120
233 H GLY 35 HN GLY 35 64.923 12.052 12.052
234 1HA GLY 35 HA2 GLY 35 63.834 11.148 11.148
235 2HA GLY 35 HA1 GLY 35 65.010 12.045 12.045
236 H ASP 36 HN ASP 36 67.367 11.395 11.395
237 HA ASP 36 HA ASP 36 67.628 8.541 8.541
238 1HB ASP 36 HB2 ASP 36 68.890 8.131 8.131
239 2HB ASP 36 HB1 ASP 36 67.180 8.492 8.492
240 H ILE 37 HN ILE 37 69.863 7.969 7.969
241 HA ILE 37 HA ILE 37 71.671 10.343 10.343
242 HB ILE 37 HB ILE 37 72.299 9.399 9.399
243 1HG1 ILE 37 HG12 ILE 37 70.736 6.996 6.996
244 2HG1 ILE 37 HG11 ILE 37 72.436 7.064 7.064
245 1HG2 ILE 37 HG23 ILE 37 69.838 10.395 10.395
246 2HG2 ILE 37 HG22 ILE 37 69.387 8.797 8.797
247 3HG2 ILE 37 HG21 ILE 37 70.352 9.874 9.874
248 HD1 ILE 37 HD1 ILE 37 71.794 6.426 6.426
249 HD1 ILE 37 HD1 ILE 37 70.091 6.657 6.657
250 HD1 ILE 37 HD1 ILE 37 71.055 8.019 8.019
251 H SER 38 HN SER 38 74.021 9.690 9.690
252 HA SER 38 HA SER 38 74.831 8.171 8.171
253 1HB SER 38 HB2 SER 38 76.118 9.862 9.862
254 2HB SER 38 HB1 SER 38 76.368 8.587 8.587
255 HG SER 38 HG SER 38 77.879 7.826 7.826
256 H THR 39 HN THR 39 74.952 5.984 5.984
257 HA THR 39 HA THR 39 73.896 3.995 3.995
258 HB THR 39 HB THR 39 75.317 2.476 2.476
259 HG1 THR 39 HG1 THR 39 76.764 3.749 3.749
260 1HG2 THR 39 HG22 THR 39 73.554 4.466 4.466
261 2HG2 THR 39 HG21 THR 39 74.888 4.378 4.378
262 3HG2 THR 39 HG23 THR 39 73.960 2.929 2.929
263 H LYS 40 HN LYS 40 77.073 5.508 5.508
264 HA LYS 40 HA LYS 40 78.293 3.601 3.601
265 1HB LYS 40 HB2 LYS 40 78.654 6.426 6.426
266 2HB LYS 40 HB1 LYS 40 79.441 5.972 5.972
267 1HG LYS 40 HG2 LYS 40 80.157 3.847 3.847
268 2HG LYS 40 HG1 LYS 40 79.968 5.011 5.011
269 1HD LYS 40 HD2 LYS 40 82.040 5.748 5.748
270 2HD LYS 40 HD1 LYS 40 81.340 6.429 6.429
271 1HE LYS 40 HE2 LYS 40 83.050 5.067 5.067
272 2HE LYS 40 HE1 LYS 40 81.658 3.968 3.968
273 1HZ LYS 40 HZ2 LYS 40 83.395 4.206 4.206
274 2HZ LYS 40 HZ1 LYS 40 83.708 3.083 3.083
275 3HZ LYS 40 HZ3 LYS 40 82.263 2.990 2.990
276 H GLU 41 HN GLU 41 75.758 5.882 5.882
277 HA GLU 41 HA GLU 41 76.081 5.843 5.843
278 1HB GLU 41 HB2 GLU 41 75.881 7.991 7.991
279 2HB GLU 41 HB1 GLU 41 74.250 7.488 7.488
280 1HG GLU 41 HG2 GLU 41 73.974 8.898 8.898
281 2HG GLU 41 HG1 GLU 41 73.797 7.254 7.254
282 H LEU 42 HN LEU 42 74.762 3.875 3.875
283 HA LEU 42 HA LEU 42 71.975 3.716 3.716
284 1HB LEU 42 HB2 LEU 42 72.729 2.885 2.885
285 2HB LEU 42 HB1 LEU 42 73.946 1.862 1.862
286 HG LEU 42 HG LEU 42 71.237 1.358 1.358
287 HD1 LEU 42 HD1 LEU 42 71.864 0.674 0.674
288 HD1 LEU 42 HD1 LEU 42 70.764 1.962 1.962
289 HD1 LEU 42 HD1 LEU 42 70.388 0.282 0.282
290 HD2 LEU 42 HD2 LEU 42 71.966 -0.891 -0.891
291 HD2 LEU 42 HD2 LEU 42 73.441 0.013 0.013
292 HD2 LEU 42 HD2 LEU 42 73.116 -0.552 -0.552
293 H GLY 43 HN GLY 43 74.855 1.751 1.751
294 1HA GLY 43 HA2 GLY 43 73.560 -0.037 -0.037
295 2HA GLY 43 HA1 GLY 43 75.265 0.401 0.401
296 H THR 44 HN THR 44 74.860 3.214 3.214
297 HA THR 44 HA THR 44 74.691 3.301 3.301
298 HB THR 44 HB THR 44 74.417 5.297 5.297
299 HG1 THR 44 HG1 THR 44 76.395 5.991 5.991
300 1HG2 THR 44 HG21 THR 44 74.320 5.893 5.893
301 2HG2 THR 44 HG23 THR 44 74.495 7.101 7.101
302 3HG2 THR 44 HG22 THR 44 73.012 6.154 6.154
303 H VAL 45 HN VAL 45 72.233 4.485 4.485
304 HA VAL 45 HA VAL 45 70.171 5.178 5.178
305 HB VAL 45 HB VAL 45 70.201 3.743 3.743
306 1HG1 VAL 45 HG12 VAL 45 68.050 3.285 3.285
307 2HG1 VAL 45 HG11 VAL 45 67.833 5.014 5.014
308 3HG1 VAL 45 HG13 VAL 45 67.830 4.371 4.371
309 1HG2 VAL 45 HG21 VAL 45 71.053 6.188 6.188
310 2HG2 VAL 45 HG23 VAL 45 70.033 5.879 5.879
311 3HG2 VAL 45 HG22 VAL 45 69.332 6.571 6.571
312 H MET 46 HN MET 46 70.431 1.896 1.896
313 HA MET 46 HA MET 46 68.424 0.686 0.686
314 1HB MET 46 HB2 MET 46 69.580 -1.411 -1.411
315 2HB MET 46 HB1 MET 46 69.364 -0.274 -0.274
316 1HG MET 46 HG2 MET 46 71.666 0.504 0.504
317 2HG MET 46 HG1 MET 46 71.897 -0.538 -0.538
318 1HE MET 46 HE2 MET 46 70.327 -0.550 -0.550
319 2HE MET 46 HE1 MET 46 70.758 -2.087 -2.087
320 3HE MET 46 HE3 MET 46 69.589 -2.042 -2.042
321 H ARG 47 HN ARG 47 71.922 1.055 1.055
322 HA ARG 47 HA ARG 47 71.892 -0.532 -0.532
323 1HB ARG 47 HB2 ARG 47 73.764 0.393 0.393
324 2HB ARG 47 HB1 ARG 47 73.979 1.528 1.528
325 1HG ARG 47 HG2 ARG 47 74.229 -0.354 -0.354
326 2HG ARG 47 HG1 ARG 47 74.010 -1.495 -1.495
327 1HD ARG 47 HD2 ARG 47 76.052 -0.776 -0.776
328 2HD ARG 47 HD1 ARG 47 76.221 0.586 0.586
329 HE ARG 47 HE ARG 47 76.692 -2.260 -2.260
330 1HH1 ARG 47 HH2 ARG 47 75.124 -1.140 -1.140
331 2HH1 ARG 47 HH2 ARG 47 76.342 -0.444 -0.444
332 1HH2 ARG 47 HH1 ARG 47 78.775 -0.441 -0.441
333 2HH2 ARG 47 HH1 ARG 47 78.410 -0.046 -0.046
334 H MET 48 HN MET 48 71.780 2.964 2.964
335 HA MET 48 HA MET 48 71.848 3.805 3.805
336 1HB MET 48 HB2 MET 48 72.500 5.247 5.247
337 2HB MET 48 HB1 MET 48 70.891 5.111 5.111
338 1HG MET 48 HG2 MET 48 71.256 7.241 7.241
339 2HG MET 48 HG1 MET 48 69.896 6.277 6.277
340 1HE MET 48 HE1 MET 48 70.759 8.412 8.412
341 2HE MET 48 HE3 MET 48 72.004 8.168 8.168
342 3HE MET 48 HE2 MET 48 72.464 8.489 8.489
343 H LEU 49 HN LEU 49 69.480 2.175 2.175
344 HA LEU 49 HA LEU 49 67.169 3.505 3.505
345 1HB LEU 49 HB2 LEU 49 67.719 1.570 1.570
346 2HB LEU 49 HB1 LEU 49 66.202 1.323 1.323
347 HG LEU 49 HG LEU 49 66.982 4.073 4.073
348 HD1 LEU 49 HD1 LEU 49 65.259 2.239 2.239
349 HD1 LEU 49 HD1 LEU 49 67.010 2.233 2.233
350 HD1 LEU 49 HD1 LEU 49 66.094 3.714 3.714
351 HD2 LEU 49 HD2 LEU 49 64.217 3.501 3.501
352 HD2 LEU 49 HD2 LEU 49 64.998 4.525 4.525
353 HD2 LEU 49 HD2 LEU 49 64.736 2.813 2.813
354 H GLY 50 HN GLY 50 68.796 0.319 0.319
355 1HA GLY 50 HA2 GLY 50 68.870 -0.399 -0.399
356 2HA GLY 50 HA1 GLY 50 67.128 -0.505 -0.505
357 H GLN 51 HN GLN 51 69.739 -1.359 -1.359
358 HA GLN 51 HA GLN 51 68.787 -4.203 -4.203
359 1HB GLN 51 HB2 GLN 51 69.469 -2.442 -2.442
360 2HB GLN 51 HB1 GLN 51 69.212 -4.183 -4.183
361 1HG GLN 51 HG2 GLN 51 66.965 -3.970 -3.970
362 2HG GLN 51 HG1 GLN 51 67.085 -2.813 -2.813
363 1HE2 GLN 51 HE22 GLN 51 65.789 -0.565 -0.565
364 2HE2 GLN 51 HE21 GLN 51 65.344 -1.568 -1.568
365 H ASN 52 HN ASN 52 70.664 -5.212 -5.212
366 HA ASN 52 HA ASN 52 73.363 -4.365 -4.365
367 1HB ASN 52 HB2 ASN 52 71.947 -6.842 -6.842
368 2HB ASN 52 HB1 ASN 52 73.707 -6.812 -6.812
369 HD2 ASN 52 HD2 ASN 52 74.889 -5.460 -5.460
370 HD2 ASN 52 HD2 ASN 52 74.138 -4.685 -4.685
371 HA PRO 53 HA PRO 53 72.996 -6.361 -6.361
372 1HB PRO 53 HB2 PRO 53 74.325 -4.386 -4.386
373 2HB PRO 53 HB1 PRO 53 72.578 -4.336 -4.336
374 1HG PRO 53 HG2 PRO 53 74.789 -2.931 -2.931
375 2HG PRO 53 HG1 PRO 53 73.164 -2.359 -2.359
376 1HD PRO 53 HD2 PRO 53 73.893 -3.210 -3.210
377 2HD PRO 53 HD1 PRO 53 72.230 -3.286 -3.286
378 H THR 54 HN THR 54 74.559 -7.909 -7.909
379 HA THR 54 HA THR 54 77.111 -7.922 -7.922
380 HB THR 54 HB THR 54 77.477 -9.686 -9.686
381 HG1 THR 54 HG1 THR 54 74.700 -9.594 -9.594
382 1HG2 THR 54 HG22 THR 54 75.407 -9.773 -9.773
383 2HG2 THR 54 HG21 THR 54 75.734 -11.184 -11.184
384 3HG2 THR 54 HG23 THR 54 77.019 -10.488 -10.488
385 H LYS 55 HN LYS 55 79.142 -7.224 -7.224
386 HA LYS 55 HA LYS 55 79.501 -5.047 -5.047
387 1HB LYS 55 HB2 LYS 55 81.081 -6.463 -6.463
388 2HB LYS 55 HB1 LYS 55 81.542 -7.250 -7.250
389 1HG LYS 55 HG2 LYS 55 81.770 -4.776 -4.776
390 2HG LYS 55 HG1 LYS 55 81.922 -4.393 -4.393
391 1HD LYS 55 HD2 LYS 55 83.906 -5.586 -5.586
392 2HD LYS 55 HD1 LYS 55 83.552 -6.641 -6.641
393 1HE LYS 55 HE2 LYS 55 85.001 -5.295 -5.295
394 2HE LYS 55 HE1 LYS 55 83.655 -4.139 -4.139
395 1HZ LYS 55 HZ2 LYS 55 85.574 -4.370 -4.370
396 2HZ LYS 55 HZ1 LYS 55 85.720 -3.225 -3.225
397 3HZ LYS 55 HZ3 LYS 55 84.379 -3.182 -3.182
398 H GLU 56 HN GLU 56 80.012 -8.474 -8.474
399 HA GLU 56 HA GLU 56 80.569 -8.100 -8.100
400 1HB GLU 56 HB2 GLU 56 79.683 -10.187 -10.187
401 2HB GLU 56 HB1 GLU 56 78.894 -10.365 -10.365
402 1HG GLU 56 HG2 GLU 56 81.023 -10.383 -10.383
403 2HG GLU 56 HG1 GLU 56 81.879 -9.975 -9.975
404 H GLU 57 HN GLU 57 77.323 -8.728 -8.728
405 HA GLU 57 HA GLU 57 75.754 -8.428 -8.428
406 1HB GLU 57 HB2 GLU 57 75.395 -7.728 -7.728
407 2HB GLU 57 HB1 GLU 57 74.088 -7.454 -7.454
408 1HG GLU 57 HG2 GLU 57 75.498 -10.117 -10.117
409 2HG GLU 57 HG1 GLU 57 74.029 -9.707 -9.707
410 H LEU 58 HN LEU 58 76.979 -5.855 -5.855
411 HA LEU 58 HA LEU 58 75.751 -3.597 -3.597
412 1HB LEU 58 HB2 LEU 58 77.903 -4.254 -4.254
413 2HB LEU 58 HB1 LEU 58 78.572 -3.153 -3.153
414 HG LEU 58 HG LEU 58 77.654 -1.925 -1.925
415 HD1 LEU 58 HD1 LEU 58 76.648 -1.640 -1.640
416 HD1 LEU 58 HD1 LEU 58 77.468 -0.464 -0.464
417 HD1 LEU 58 HD1 LEU 58 75.740 -0.755 -0.755
418 HD2 LEU 58 HD2 LEU 58 75.751 -3.840 -3.840
419 HD2 LEU 58 HD2 LEU 58 74.865 -2.597 -2.597
420 HD2 LEU 58 HD2 LEU 58 75.527 -2.244 -2.244
421 H ASP 59 HN ASP 59 79.086 -4.538 -4.538
422 HA ASP 59 HA ASP 59 79.306 -3.001 -3.001
423 1HB ASP 59 HB2 ASP 59 80.762 -4.923 -4.923
424 2HB ASP 59 HB1 ASP 59 80.553 -5.639 -5.639
425 H ALA 60 HN ALA 60 77.570 -6.001 -6.001
426 HA ALA 60 HA ALA 60 77.300 -6.739 -6.739
427 1HB ALA 60 HB2 ALA 60 77.076 -8.162 -8.162
428 2HB ALA 60 HB1 ALA 60 75.475 -7.444 -7.444
429 3HB ALA 60 HB3 ALA 60 75.845 -8.419 -8.419
430 H ILE 61 HN ILE 61 75.095 -5.167 -5.167
431 HA ILE 61 HA ILE 61 73.001 -4.684 -4.684
432 HB ILE 61 HB ILE 61 73.698 -3.520 -3.520
433 1HG1 ILE 61 HG12 ILE 61 71.353 -5.291 -5.291
434 2HG1 ILE 61 HG11 ILE 61 72.950 -6.040 -6.040
435 1HG2 ILE 61 HG22 ILE 61 72.229 -2.065 -2.065
436 2HG2 ILE 61 HG21 ILE 61 71.018 -3.338 -3.338
437 3HG2 ILE 61 HG23 ILE 61 71.570 -2.467 -2.467
438 HD1 ILE 61 HD1 ILE 61 73.198 -5.816 -5.816
439 HD1 ILE 61 HD1 ILE 61 71.451 -5.573 -5.573
440 HD1 ILE 61 HD1 ILE 61 72.534 -4.182 -4.182
441 H ILE 62 HN ILE 62 75.626 -2.668 -2.668
442 HA ILE 62 HA ILE 62 75.000 -0.185 -0.185
443 HB ILE 62 HB ILE 62 77.580 -1.647 -1.647
444 1HG1 ILE 62 HG12 ILE 62 76.053 0.623 0.623
445 2HG1 ILE 62 HG11 ILE 62 76.281 -1.007 -1.007
446 1HG2 ILE 62 HG22 ILE 62 77.194 1.179 1.179
447 2HG2 ILE 62 HG21 ILE 62 78.670 0.626 0.626
448 3HG2 ILE 62 HG23 ILE 62 78.161 -0.099 -0.099
449 HD1 ILE 62 HD1 ILE 62 77.823 0.774 0.774
450 HD1 ILE 62 HD1 ILE 62 78.594 0.846 0.846
451 HD1 ILE 62 HD1 ILE 62 78.627 -0.653 -0.653
452 H GLU 63 HN GLU 63 77.379 -2.463 -2.463
453 HA GLU 63 HA GLU 63 77.721 -1.349 -1.349
454 1HB GLU 63 HB2 GLU 63 78.132 -3.825 -3.825
455 2HB GLU 63 HB1 GLU 63 77.306 -4.211 -4.211
456 1HG GLU 63 HG2 GLU 63 79.010 -2.581 -2.581
457 2HG GLU 63 HG1 GLU 63 79.933 -2.791 -2.791
458 H GLU 64 HN GLU 64 74.968 -3.352 -3.352
459 HA GLU 64 HA GLU 64 73.650 -3.501 -3.501
460 1HB GLU 64 HB2 GLU 64 72.945 -5.032 -5.032
461 2HB GLU 64 HB1 GLU 64 72.932 -3.815 -3.815
462 1HG GLU 64 HG2 GLU 64 70.839 -3.040 -3.040
463 2HG GLU 64 HG1 GLU 64 71.046 -3.417 -3.417
464 H VAL 65 HN VAL 65 72.977 -1.403 -1.403
465 HA VAL 65 HA VAL 65 71.137 0.290 0.290
466 HB VAL 65 HB VAL 65 71.071 1.510 1.510
467 1HG1 VAL 65 HG12 VAL 65 71.055 -1.431 -1.431
468 2HG1 VAL 65 HG11 VAL 65 71.273 -0.753 -0.753
469 3HG1 VAL 65 HG13 VAL 65 69.859 -0.314 -0.314
470 1HG2 VAL 65 HG22 VAL 65 73.813 0.874 0.874
471 2HG2 VAL 65 HG21 VAL 65 72.904 1.785 1.785
472 3HG2 VAL 65 HG23 VAL 65 73.099 0.041 0.041
473 H ASP 66 HN ASP 66 74.558 0.140 0.140
474 HA ASP 66 HA ASP 66 75.272 2.901 2.901
475 1HB ASP 66 HB2 ASP 66 76.575 0.564 0.564
476 2HB ASP 66 HB1 ASP 66 76.837 0.799 0.799
477 H GLU 67 HN GLU 67 76.878 2.417 2.417
478 HA GLU 67 HA GLU 67 74.976 3.613 3.613
479 1HB GLU 67 HB2 GLU 67 77.728 3.547 3.547
480 2HB GLU 67 HB1 GLU 67 77.515 2.622 2.622
481 1HG GLU 67 HG2 GLU 67 77.400 4.615 4.615
482 2HG GLU 67 HG1 GLU 67 75.800 4.783 4.783
483 H ASP 68 HN ASP 68 73.862 1.181 1.181
484 HA ASP 68 HA ASP 68 74.609 -0.685 -0.685
485 1HB ASP 68 HB2 ASP 68 73.763 -0.896 -0.896
486 2HB ASP 68 HB1 ASP 68 72.626 -1.763 -1.763
487 H GLY 69 HN GLY 69 72.296 1.681 1.681
488 1HA GLY 69 HA2 GLY 69 70.693 1.032 1.032
489 2HA GLY 69 HA1 GLY 69 69.824 0.897 0.897
490 H SER 70 HN SER 70 70.541 2.967 2.967
491 HA SER 70 HA SER 70 69.978 5.365 5.365
492 1HB SER 70 HB2 SER 70 69.356 5.449 5.449
493 2HB SER 70 HB1 SER 70 68.358 5.913 5.913
494 HG SER 70 HG SER 70 68.433 3.585 3.585
495 H GLY 71 HN GLY 71 71.540 4.352 4.352
496 1HA GLY 71 HA2 GLY 71 74.054 5.257 5.257
497 2HA GLY 71 HA1 GLY 71 73.206 6.798 6.798
498 H THR 72 HN THR 72 72.035 7.236 7.236
499 HA THR 72 HA THR 72 73.328 6.066 6.066
500 HB THR 72 HB THR 72 71.951 7.819 7.819
501 HG1 THR 72 HG1 THR 72 70.137 7.848 7.848
502 1HG2 THR 72 HG21 THR 72 74.091 8.151 8.151
503 2HG2 THR 72 HG23 THR 72 72.935 9.359 9.359
504 3HG2 THR 72 HG22 THR 72 73.476 9.372 9.372
505 H ILE 73 HN ILE 73 71.078 6.288 6.288
506 HA ILE 73 HA ILE 73 69.481 3.896 3.896
507 HB ILE 73 HB ILE 73 70.941 3.361 3.361
508 1HG1 ILE 73 HG12 ILE 73 69.298 3.134 3.134
509 2HG1 ILE 73 HG11 ILE 73 68.138 4.010 4.010
510 1HG2 ILE 73 HG22 ILE 73 70.090 6.060 6.060
511 2HG2 ILE 73 HG21 ILE 73 70.715 4.844 4.844
512 3HG2 ILE 73 HG23 ILE 73 71.719 5.420 5.420
513 HD1 ILE 73 HD1 ILE 73 68.650 1.248 1.248
514 HD1 ILE 73 HD1 ILE 73 69.404 1.886 1.886
515 HD1 ILE 73 HD1 ILE 73 67.689 2.166 2.166
516 H ASP 74 HN ASP 74 67.366 4.413 4.413
517 HA ASP 74 HA ASP 74 66.228 6.940 6.940
518 1HB ASP 74 HB2 ASP 74 65.261 4.662 4.662
519 2HB ASP 74 HB1 ASP 74 64.272 6.076 6.076
520 H PHE 75 HN PHE 75 64.661 7.096 7.096
521 HA PHE 75 HA PHE 75 64.475 5.288 5.288
522 1HB PHE 75 HB2 PHE 75 63.536 7.689 7.689
523 2HB PHE 75 HB1 PHE 75 62.092 6.868 6.868
524 HD1 PHE 75 HD2 PHE 75 61.346 4.792 4.792
525 HD2 PHE 75 HD1 PHE 75 63.588 8.217 8.217
526 HE1 PHE 75 HE2 PHE 75 60.617 4.381 4.381
527 HE2 PHE 75 HE1 PHE 75 62.859 7.805 7.805
528 HZ PHE 75 HZ PHE 75 61.375 5.887 5.887
529 H GLU 76 HN GLU 76 62.259 5.459 5.459
530 HA GLU 76 HA GLU 76 60.526 3.345 3.345
531 1HB GLU 76 HB2 GLU 76 60.224 3.196 3.196
532 2HB GLU 76 HB1 GLU 76 60.238 4.865 4.865
533 1HG GLU 76 HG2 GLU 76 62.619 5.061 5.061
534 2HG GLU 76 HG1 GLU 76 62.611 3.391 3.391
535 H GLU 77 HN GLU 77 63.730 3.232 3.232
536 HA GLU 77 HA GLU 77 63.700 0.341 0.341
537 1HB GLU 77 HB2 GLU 77 65.041 2.389 2.389
538 2HB GLU 77 HB1 GLU 77 66.216 1.948 1.948
539 1HG GLU 77 HG2 GLU 77 66.672 0.725 0.725
540 2HG GLU 77 HG1 GLU 77 66.181 -0.391 -0.391
541 H PHE 78 HN PHE 78 65.611 2.492 2.492
542 HA PHE 78 HA PHE 78 66.883 0.593 0.593
543 1HB PHE 78 HB2 PHE 78 67.133 3.058 3.058
544 2HB PHE 78 HB1 PHE 78 65.534 3.174 3.174
545 HD1 PHE 78 HD1 PHE 78 68.954 1.782 1.782
546 HD2 PHE 78 HD2 PHE 78 65.205 2.739 2.739
547 HE1 PHE 78 HE1 PHE 78 69.948 1.346 1.346
548 HE2 PHE 78 HE2 PHE 78 66.201 2.302 2.302
549 HZ PHE 78 HZ PHE 78 68.572 1.606 1.606
550 H LEU 79 HN LEU 79 63.491 1.596 1.596
551 HA LEU 79 HA LEU 79 62.570 0.634 0.634
552 1HB LEU 79 HB2 LEU 79 61.542 0.732 0.732
553 2HB LEU 79 HB1 LEU 79 60.602 -0.196 -0.196
554 HG LEU 79 HG LEU 79 61.543 2.611 2.611
555 HD1 LEU 79 HD1 LEU 79 59.889 2.064 2.064
556 HD1 LEU 79 HD1 LEU 79 59.815 3.547 3.547
557 HD1 LEU 79 HD1 LEU 79 58.724 2.212 2.212
558 HD2 LEU 79 HD2 LEU 79 59.171 1.027 1.027
559 HD2 LEU 79 HD2 LEU 79 59.807 2.538 2.538
560 HD2 LEU 79 HD2 LEU 79 60.742 1.050 1.050
561 H VAL 80 HN VAL 80 63.655 -1.254 -1.254
562 HA VAL 80 HA VAL 80 62.720 -3.816 -3.816
563 HB VAL 80 HB VAL 80 63.399 -3.023 -3.023
564 1HG1 VAL 80 HG13 VAL 80 65.630 -2.156 -2.156
565 2HG1 VAL 80 HG12 VAL 80 66.128 -3.808 -3.808
566 3HG1 VAL 80 HG11 VAL 80 65.747 -3.349 -3.349
567 1HG2 VAL 80 HG23 VAL 80 63.484 -5.568 -5.568
568 2HG2 VAL 80 HG22 VAL 80 63.149 -5.222 -5.222
569 3HG2 VAL 80 HG21 VAL 80 64.806 -5.511 -5.511
570 H MET 81 HN MET 81 65.824 -2.066 -2.066
571 HA MET 81 HA MET 81 67.326 -4.119 -4.119
572 1HB MET 81 HB2 MET 81 67.436 -1.121 -1.121
573 2HB MET 81 HB1 MET 81 68.576 -1.947 -1.947
574 1HG MET 81 HG2 MET 81 68.158 -2.574 -2.574
575 2HG MET 81 HG1 MET 81 69.512 -1.660 -1.660
576 1HE MET 81 HE2 MET 81 68.276 -4.526 -4.526
577 2HE MET 81 HE1 MET 81 69.210 -5.921 -5.921
578 3HE MET 81 HE3 MET 81 67.784 -5.405 -5.405
579 H MET 82 HN MET 82 65.148 -1.598 -1.598
580 HA MET 82 HA MET 82 65.710 -1.763 -1.763
581 1HB MET 82 HB2 MET 82 63.096 -1.322 -1.322
582 2HB MET 82 HB1 MET 82 63.387 -0.887 -0.887
583 1HG MET 82 HG2 MET 82 65.158 0.663 0.663
584 2HG MET 82 HG1 MET 82 64.961 0.186 0.186
585 1HE MET 82 HE1 MET 82 64.421 2.542 2.542
586 2HE MET 82 HE3 MET 82 64.708 3.342 3.342
587 3HE MET 82 HE2 MET 82 63.230 3.667 3.667
588 H VAL 83 HN VAL 83 63.029 -3.395 -3.395
589 HA VAL 83 HA VAL 83 62.432 -5.193 -5.193
590 HB VAL 83 HB VAL 83 60.836 -4.505 -4.505
591 1HG1 VAL 83 HG12 VAL 83 62.728 -4.599 -4.599
592 2HG1 VAL 83 HG11 VAL 83 62.305 -6.305 -6.305
593 3HG1 VAL 83 HG13 VAL 83 61.099 -5.068 -5.068
594 1HG2 VAL 83 HG22 VAL 83 60.647 -6.737 -6.737
595 2HG2 VAL 83 HG21 VAL 83 59.840 -6.670 -6.670
596 3HG2 VAL 83 HG23 VAL 83 61.401 -7.475 -7.475
597 H ARG 84 HN ARG 84 64.237 -5.600 -5.600
598 HA ARG 84 HA ARG 84 64.799 -8.349 -8.349
599 1HB ARG 84 HB2 ARG 84 66.394 -5.961 -5.961
600 2HB ARG 84 HB1 ARG 84 66.889 -7.626 -7.626
601 1HG ARG 84 HG2 ARG 84 64.116 -6.649 -6.649
602 2HG ARG 84 HG1 ARG 84 65.464 -6.468 -6.468
603 1HD ARG 84 HD2 ARG 84 65.810 -8.854 -8.854
604 2HD ARG 84 HD1 ARG 84 64.676 -9.129 -9.129
605 HE ARG 84 HE ARG 84 63.645 -7.736 -7.736
606 1HH1 ARG 84 HH1 ARG 84 64.364 -10.892 -10.892
607 2HH1 ARG 84 HH1 ARG 84 62.738 -11.487 -11.487
608 1HH2 ARG 84 HH2 ARG 84 61.301 -8.331 -8.331
609 2HH2 ARG 84 HH2 ARG 84 61.003 -10.037 -10.037
610 H GLN 85 HN GLN 85 66.531 -5.643 -5.643
611 HA GLN 85 HA GLN 85 68.506 -7.400 -7.400
612 1HB GLN 85 HB2 GLN 85 68.934 -5.047 -5.047
613 2HB GLN 85 HB1 GLN 85 67.694 -4.517 -4.517
614 1HG GLN 85 HG2 GLN 85 69.893 -4.295 -4.295
615 2HG GLN 85 HG1 GLN 85 68.990 -5.577 -5.577
616 1HE2 GLN 85 HE22 GLN 85 71.590 -7.861 -7.861
617 2HE2 GLN 85 HE21 GLN 85 70.391 -7.279 -7.279
618 H MET 86 HN MET 86 65.610 -5.613 -5.613
619 HA MET 86 HA MET 86 65.759 -6.423 -6.423
620 1HB MET 86 HB2 MET 86 63.998 -5.019 -5.019
621 2HB MET 86 HB1 MET 86 63.061 -6.059 -6.059
622 1HG MET 86 HG2 MET 86 64.289 -5.090 -5.090
623 2HG MET 86 HG1 MET 86 65.100 -3.980 -3.980
624 1HE MET 86 HE1 MET 86 64.309 -2.538 -2.538
625 2HE MET 86 HE3 MET 86 62.639 -2.484 -2.484
626 3HE MET 86 HE2 MET 86 63.202 -1.305 -1.305
627 H LYS 87 HN LYS 87 64.624 -8.050 -8.050
628 HA LYS 87 HA LYS 87 62.818 -9.947 -9.947
629 1HB LYS 87 HB2 LYS 87 65.055 -10.032 -10.032
630 2HB LYS 87 HB1 LYS 87 64.003 -11.426 -11.426
631 1HG LYS 87 HG2 LYS 87 62.518 -8.912 -8.912
632 2HG LYS 87 HG1 LYS 87 63.463 -9.294 -9.294
633 1HD LYS 87 HD2 LYS 87 62.162 -11.079 -11.079
634 2HD LYS 87 HD1 LYS 87 62.037 -11.601 -11.601
635 1HE LYS 87 HE2 LYS 87 60.076 -10.468 -10.468
636 2HE LYS 87 HE1 LYS 87 60.614 -9.075 -9.075
637 1HZ LYS 87 HZ1 LYS 87 60.166 -11.655 -11.655
638 2HZ LYS 87 HZ3 LYS 87 58.823 -10.694 -10.694
639 3HZ LYS 87 HZ2 LYS 87 60.042 -10.081 -10.081
640 H GLU 88 HN GLU 88 66.260 -9.675 -9.675
641 HA GLU 88 HA GLU 88 66.349 -12.329 -12.329
642 1HB GLU 88 HB2 GLU 88 68.091 -10.781 -10.781
643 2HB GLU 88 HB1 GLU 88 68.782 -10.750 -10.750
644 1HG GLU 88 HG2 GLU 88 69.628 -12.793 -12.793
645 2HG GLU 88 HG1 GLU 88 67.976 -13.399 -13.399
646 H ASP 89 HN ASP 89 66.705 -8.852 -8.852
647 HA ASP 89 HA ASP 89 67.385 -9.235 -9.235
648 1HB ASP 89 HB2 ASP 89 68.150 -7.351 -7.351
649 2HB ASP 89 HB1 ASP 89 66.483 -6.780 -6.780
650 H ALA 90 HN ALA 90 64.475 -8.697 -8.697
651 HA ALA 90 HA ALA 90 62.809 -7.990 -7.990
652 1HB ALA 90 HB1 ALA 90 62.311 -8.703 -8.703
653 2HB ALA 90 HB3 ALA 90 61.014 -8.268 -8.268
654 3HB ALA 90 HB2 ALA 90 62.277 -7.099 -7.099
Start of MODEL 18
1 1H ALA 1 HT1 ALA 1 65.526 -4.060 -4.060
2 2H ALA 1 HT3 ALA 1 66.761 -3.363 -3.363
3 3H ALA 1 HT2 ALA 1 67.121 -4.044 -4.044
4 HA ALA 1 HA ALA 1 67.096 -6.174 -6.174
5 1HB ALA 1 HB3 ALA 1 67.769 -4.220 -4.220
6 2HB ALA 1 HB2 ALA 1 67.905 -5.953 -5.953
7 3HB ALA 1 HB1 ALA 1 68.859 -5.200 -5.200
8 H SER 2 HN SER 2 66.424 -7.584 -7.584
9 HA SER 2 HA SER 2 63.501 -7.421 -7.421
10 1HB SER 2 HB2 SER 2 65.380 -9.408 -9.408
11 2HB SER 2 HB1 SER 2 65.020 -9.298 -9.298
12 HG SER 2 HG SER 2 63.430 -10.098 -10.098
13 H MET 3 HN MET 3 66.204 -6.412 -6.412
14 HA MET 3 HA MET 3 65.162 -6.456 -6.456
15 1HB MET 3 HB2 MET 3 67.134 -4.911 -4.911
16 2HB MET 3 HB1 MET 3 66.586 -4.129 -4.129
17 1HG MET 3 HG2 MET 3 67.012 -6.806 -6.806
18 2HG MET 3 HG1 MET 3 68.375 -6.396 -6.396
19 1HE MET 3 HE2 MET 3 68.106 -7.275 -7.275
20 2HE MET 3 HE1 MET 3 69.799 -6.799 -6.799
21 3HE MET 3 HE3 MET 3 68.777 -6.177 -6.177
22 H THR 4 HN THR 4 64.691 -4.009 -4.009
23 HA THR 4 HA THR 4 63.269 -2.053 -2.053
24 HB THR 4 HB THR 4 64.036 -1.957 -1.957
25 HG1 THR 4 HG1 THR 4 61.273 -1.601 -1.601
26 1HG2 THR 4 HG21 THR 4 62.688 -4.375 -4.375
27 2HG2 THR 4 HG23 THR 4 61.654 -3.250 -3.250
28 3HG2 THR 4 HG22 THR 4 63.345 -3.440 -3.440
29 H ASP 5 HN ASP 5 62.257 -5.267 -5.267
30 HA ASP 5 HA ASP 5 59.395 -4.806 -4.806
31 1HB ASP 5 HB2 ASP 5 60.696 -6.624 -6.624
32 2HB ASP 5 HB1 ASP 5 60.888 -7.421 -7.421
33 H GLN 6 HN GLN 6 61.745 -6.599 -6.599
34 HA GLN 6 HA GLN 6 60.191 -7.235 -7.235
35 1HB GLN 6 HB2 GLN 6 62.948 -6.861 -6.861
36 2HB GLN 6 HB1 GLN 6 62.664 -6.123 -6.123
37 1HG GLN 6 HG2 GLN 6 62.768 -8.197 -8.197
38 2HG GLN 6 HG1 GLN 6 61.228 -8.525 -8.525
39 1HE2 GLN 6 HE22 GLN 6 62.684 -10.884 -10.884
40 2HE2 GLN 6 HE21 GLN 6 61.301 -10.322 -10.322
41 H GLN 7 HN GLN 7 61.245 -4.032 -4.032
42 HA GLN 7 HA GLN 7 60.969 -2.523 -2.523
43 1HB GLN 7 HB2 GLN 7 61.666 -1.761 -1.761
44 2HB GLN 7 HB1 GLN 7 59.976 -1.825 -1.825
45 1HG GLN 7 HG2 GLN 7 60.477 -0.316 -0.316
46 2HG GLN 7 HG1 GLN 7 61.175 0.399 0.399
47 1HE2 GLN 7 HE22 GLN 7 58.039 1.296 1.296
48 2HE2 GLN 7 HE21 GLN 7 59.714 1.186 1.186
49 H ALA 8 HN ALA 8 58.345 -3.099 -3.099
50 HA ALA 8 HA ALA 8 56.192 -1.976 -1.976
51 1HB ALA 8 HB1 ALA 8 56.672 -4.113 -4.113
52 2HB ALA 8 HB3 ALA 8 55.141 -4.269 -4.269
53 3HB ALA 8 HB2 ALA 8 55.500 -2.795 -2.795
54 H GLU 9 HN GLU 9 57.498 -5.279 -5.279
55 HA GLU 9 HA GLU 9 55.619 -5.800 -5.800
56 1HB GLU 9 HB2 GLU 9 57.967 -7.446 -7.446
57 2HB GLU 9 HB1 GLU 9 56.529 -8.020 -8.020
58 1HG GLU 9 HG2 GLU 9 55.567 -8.378 -8.378
59 2HG GLU 9 HG1 GLU 9 55.580 -6.633 -6.633
60 H ALA 10 HN ALA 10 58.648 -4.309 -4.309
61 HA ALA 10 HA ALA 10 59.850 -5.198 -5.198
62 1HB ALA 10 HB1 ALA 10 60.498 -3.631 -3.631
63 2HB ALA 10 HB3 ALA 10 61.021 -2.796 -2.796
64 3HB ALA 10 HB2 ALA 10 61.588 -4.434 -4.434
65 H ARG 11 HN ARG 11 57.656 -2.632 -2.632
66 HA ARG 11 HA ARG 11 58.070 -1.276 -1.276
67 1HB ARG 11 HB2 ARG 11 56.124 0.034 0.034
68 2HB ARG 11 HB1 ARG 11 57.709 0.618 0.618
69 1HG ARG 11 HG2 ARG 11 57.953 0.617 0.617
70 2HG ARG 11 HG1 ARG 11 58.535 -1.005 -1.005
71 1HD ARG 11 HD2 ARG 11 56.933 -1.199 -1.199
72 2HD ARG 11 HD1 ARG 11 56.131 -1.806 -1.806
73 HE ARG 11 HE ARG 11 55.014 0.392 0.392
74 1HH1 ARG 11 HH2 ARG 11 56.495 2.323 2.323
75 2HH1 ARG 11 HH2 ARG 11 55.767 2.375 2.375
76 1HH2 ARG 11 HH1 ARG 11 54.160 -0.676 -0.676
77 2HH2 ARG 11 HH1 ARG 11 54.444 0.679 0.679
78 H ALA 12 HN ALA 12 55.786 -3.203 -3.203
79 HA ALA 12 HA ALA 12 53.417 -2.596 -2.596
80 1HB ALA 12 HB2 ALA 12 53.535 -3.715 -3.715
81 2HB ALA 12 HB1 ALA 12 54.251 -5.128 -5.128
82 3HB ALA 12 HB3 ALA 12 52.598 -4.652 -4.652
83 H PHE 13 HN PHE 13 56.224 -4.557 -4.557
84 HA PHE 13 HA PHE 13 55.146 -6.405 -6.405
85 1HB PHE 13 HB2 PHE 13 57.328 -6.772 -6.772
86 2HB PHE 13 HB1 PHE 13 57.827 -5.114 -5.114
87 HD1 PHE 13 HD1 PHE 13 56.536 -8.137 -8.137
88 HD2 PHE 13 HD2 PHE 13 59.120 -4.707 -4.707
89 HE1 PHE 13 HE1 PHE 13 57.400 -8.836 -8.836
90 HE2 PHE 13 HE2 PHE 13 59.985 -5.406 -5.406
91 HZ PHE 13 HZ PHE 13 59.124 -7.471 -7.471
92 H LEU 14 HN LEU 14 56.385 -3.085 -3.085
93 HA LEU 14 HA LEU 14 55.697 -3.158 -3.158
94 1HB LEU 14 HB2 LEU 14 57.324 -1.416 -1.416
95 2HB LEU 14 HB1 LEU 14 56.845 -0.817 -0.817
96 HG LEU 14 HG LEU 14 58.146 -3.518 -3.518
97 HD1 LEU 14 HD1 LEU 14 59.688 -1.976 -1.976
98 HD1 LEU 14 HD1 LEU 14 60.307 -2.359 -2.359
99 HD1 LEU 14 HD1 LEU 14 59.500 -0.817 -0.817
100 HD2 LEU 14 HD2 LEU 14 57.424 -1.621 -1.621
101 HD2 LEU 14 HD2 LEU 14 58.974 -2.443 -2.443
102 HD2 LEU 14 HD2 LEU 14 57.490 -3.384 -3.384
103 H SER 15 HN SER 15 54.076 -1.820 -1.820
104 HA SER 15 HA SER 15 51.970 -0.923 -0.923
105 1HB SER 15 HB2 SER 15 52.489 -1.339 -1.339
106 2HB SER 15 HB1 SER 15 51.673 0.204 0.204
107 HG SER 15 HG SER 15 50.339 -1.241 -1.241
108 H GLU 16 HN GLU 16 51.145 1.401 1.401
109 HA GLU 16 HA GLU 16 53.124 3.259 3.259
110 1HB GLU 16 HB2 GLU 16 50.622 3.233 3.233
111 2HB GLU 16 HB1 GLU 16 50.416 3.849 3.849
112 1HG GLU 16 HG2 GLU 16 51.285 5.921 5.921
113 2HG GLU 16 HG1 GLU 16 52.340 5.280 5.280
114 H GLU 17 HN GLU 17 51.851 2.536 2.536
115 HA GLU 17 HA GLU 17 52.629 4.857 4.857
116 1HB GLU 17 HB2 GLU 17 51.273 3.019 3.019
117 2HB GLU 17 HB1 GLU 17 52.653 1.926 1.926
118 1HG GLU 17 HG2 GLU 17 53.906 3.371 3.371
119 2HG GLU 17 HG1 GLU 17 52.494 4.418 4.418
120 H MET 18 HN MET 18 54.522 1.874 1.874
121 HA MET 18 HA MET 18 56.938 2.923 2.923
122 1HB MET 18 HB2 MET 18 56.210 0.506 0.506
123 2HB MET 18 HB1 MET 18 56.608 0.660 0.660
124 1HG MET 18 HG2 MET 18 58.866 0.705 0.705
125 2HG MET 18 HG1 MET 18 58.691 1.559 1.559
126 1HE MET 18 HE3 MET 18 56.669 0.055 0.055
127 2HE MET 18 HE2 MET 18 57.656 -1.090 -1.090
128 3HE MET 18 HE1 MET 18 58.248 0.545 0.545
129 H ILE 19 HN ILE 19 55.863 2.454 2.454
130 HA ILE 19 HA ILE 19 58.092 3.197 3.197
131 HB ILE 19 HB ILE 19 55.167 3.923 3.923
132 1HG1 ILE 19 HG12 ILE 19 56.972 1.864 1.864
133 2HG1 ILE 19 HG11 ILE 19 55.699 1.539 1.539
134 1HG2 ILE 19 HG22 ILE 19 57.509 4.753 4.753
135 2HG2 ILE 19 HG21 ILE 19 56.163 4.085 4.085
136 3HG2 ILE 19 HG23 ILE 19 55.909 5.485 5.485
137 HD1 ILE 19 HD1 ILE 19 55.438 2.430 2.430
138 HD1 ILE 19 HD1 ILE 19 54.146 2.756 2.756
139 HD1 ILE 19 HD1 ILE 19 54.631 1.094 1.094
140 H ALA 20 HN ALA 20 56.012 5.319 5.319
141 HA ALA 20 HA ALA 20 57.214 7.797 7.797
142 1HB ALA 20 HB1 ALA 20 54.888 7.365 7.365
143 2HB ALA 20 HB3 ALA 20 55.695 7.310 7.310
144 3HB ALA 20 HB2 ALA 20 55.744 8.785 8.785
145 H GLU 21 HN GLU 21 57.958 5.453 5.453
146 HA GLU 21 HA GLU 21 59.584 7.181 7.181
147 1HB GLU 21 HB2 GLU 21 58.654 5.193 5.193
148 2HB GLU 21 HB1 GLU 21 59.251 4.201 4.201
149 1HG GLU 21 HG2 GLU 21 61.340 4.026 4.026
150 2HG GLU 21 HG1 GLU 21 61.334 5.690 5.690
151 H PHE 22 HN PHE 22 60.382 4.711 4.711
152 HA PHE 22 HA PHE 22 63.210 5.025 5.025
153 1HB PHE 22 HB2 PHE 22 61.281 4.264 4.264
154 2HB PHE 22 HB1 PHE 22 63.023 4.017 4.017
155 HD1 PHE 22 HD2 PHE 22 62.286 3.671 3.671
156 HD2 PHE 22 HD1 PHE 22 61.734 1.606 1.606
157 HE1 PHE 22 HE2 PHE 22 62.038 1.529 1.529
158 HE2 PHE 22 HE1 PHE 22 61.486 -0.536 -0.536
159 HZ PHE 22 HZ PHE 22 61.638 -0.575 -0.575
160 H LYS 23 HN LYS 23 60.702 6.852 6.852
161 HA LYS 23 HA LYS 23 62.167 8.279 8.279
162 1HB LYS 23 HB2 LYS 23 59.917 9.041 9.041
163 2HB LYS 23 HB1 LYS 23 60.467 10.118 10.118
164 1HG LYS 23 HG2 LYS 23 59.861 7.274 7.274
165 2HG LYS 23 HG1 LYS 23 58.510 8.374 8.374
166 1HD LYS 23 HD2 LYS 23 60.769 9.271 9.271
167 2HD LYS 23 HD1 LYS 23 59.576 8.147 8.147
168 1HE LYS 23 HE2 LYS 23 57.918 9.728 9.728
169 2HE LYS 23 HE1 LYS 23 58.462 10.465 10.465
170 1HZ LYS 23 HZ3 LYS 23 60.099 10.621 10.621
171 2HZ LYS 23 HZ2 LYS 23 58.880 11.762 11.762
172 3HZ LYS 23 HZ1 LYS 23 60.182 11.591 11.591
173 H ALA 24 HN ALA 24 61.324 9.904 9.904
174 HA ALA 24 HA ALA 24 63.254 11.898 11.898
175 1HB ALA 24 HB2 ALA 24 61.954 10.279 10.279
176 2HB ALA 24 HB1 ALA 24 63.055 11.601 11.601
177 3HB ALA 24 HB3 ALA 24 61.579 11.922 11.922
178 H ALA 25 HN ALA 25 63.755 8.486 8.486
179 HA ALA 25 HA ALA 25 66.413 8.873 8.873
180 1HB ALA 25 HB3 ALA 25 64.411 6.907 6.907
181 2HB ALA 25 HB2 ALA 25 65.764 6.206 6.206
182 3HB ALA 25 HB1 ALA 25 65.990 6.766 6.766
183 H PHE 26 HN PHE 26 65.122 7.510 7.510
184 HA PHE 26 HA PHE 26 67.714 7.043 7.043
185 1HB PHE 26 HB2 PHE 26 65.751 5.859 5.859
186 2HB PHE 26 HB1 PHE 26 64.907 7.369 7.369
187 HD1 PHE 26 HD1 PHE 26 65.482 8.721 8.721
188 HD2 PHE 26 HD2 PHE 26 67.524 5.036 5.036
189 HE1 PHE 26 HE1 PHE 26 66.430 8.725 8.725
190 HE2 PHE 26 HE2 PHE 26 68.471 5.040 5.040
191 HZ PHE 26 HZ PHE 26 67.924 6.887 6.887
192 H ASP 27 HN ASP 27 65.359 9.720 9.720
193 HA ASP 27 HA ASP 27 66.815 11.211 11.211
194 1HB ASP 27 HB2 ASP 27 65.265 12.956 12.956
195 2HB ASP 27 HB1 ASP 27 64.399 11.433 11.433
196 H MET 28 HN MET 28 67.584 10.550 10.550
197 HA MET 28 HA MET 28 68.718 12.934 12.934
198 1HB MET 28 HB2 MET 28 69.402 10.000 10.000
199 2HB MET 28 HB1 MET 28 70.284 11.226 11.226
200 1HG MET 28 HG2 MET 28 67.606 11.907 11.907
201 2HG MET 28 HG1 MET 28 67.618 10.145 10.145
202 1HE MET 28 HE3 MET 28 69.680 13.261 13.261
203 2HE MET 28 HE2 MET 28 68.148 13.390 13.390
204 3HE MET 28 HE1 MET 28 69.645 13.198 13.198
205 H PHE 29 HN PHE 29 69.879 10.773 10.773
206 HA PHE 29 HA PHE 29 72.412 12.373 12.373
207 1HB PHE 29 HB2 PHE 29 71.904 9.656 9.656
208 2HB PHE 29 HB1 PHE 29 73.447 10.385 10.385
209 HD1 PHE 29 HD1 PHE 29 74.108 10.579 10.579
210 HD2 PHE 29 HD2 PHE 29 70.517 8.549 8.549
211 HE1 PHE 29 HE1 PHE 29 73.947 9.535 9.535
212 HE2 PHE 29 HE2 PHE 29 70.356 7.507 7.507
213 HZ PHE 29 HZ PHE 29 72.069 7.999 7.999
214 H ASP 30 HN ASP 30 69.611 12.823 12.823
215 HA ASP 30 HA ASP 30 70.342 12.682 12.682
216 1HB ASP 30 HB2 ASP 30 67.962 12.326 12.326
217 2HB ASP 30 HB1 ASP 30 67.686 13.577 13.577
218 H ALA 31 HN ALA 31 71.751 14.648 14.648
219 HA ALA 31 HA ALA 31 70.304 17.200 17.200
220 1HB ALA 31 HB3 ALA 31 72.300 16.357 16.357
221 2HB ALA 31 HB2 ALA 31 73.293 16.815 16.815
222 3HB ALA 31 HB1 ALA 31 72.317 18.030 18.030
223 H ASP 32 HN ASP 32 72.096 15.277 15.277
224 HA ASP 32 HA ASP 32 72.080 17.571 17.571
225 1HB ASP 32 HB2 ASP 32 74.159 15.628 15.628
226 2HB ASP 32 HB1 ASP 32 74.089 15.965 15.965
227 H GLY 33 HN GLY 33 70.760 14.598 14.598
228 1HA GLY 33 HA2 GLY 33 70.453 13.845 13.845
229 2HA GLY 33 HA1 GLY 33 70.260 12.724 12.724
230 H GLY 34 HN GLY 34 68.623 14.137 14.137
231 1HA GLY 34 HA2 GLY 34 66.449 15.107 15.107
232 2HA GLY 34 HA1 GLY 34 66.296 15.102 15.102
233 H GLY 35 HN GLY 35 66.799 12.456 12.456
234 1HA GLY 35 HA2 GLY 35 64.795 10.932 10.932
235 2HA GLY 35 HA1 GLY 35 64.673 10.979 10.979
236 H ASP 36 HN ASP 36 67.904 11.051 11.051
237 HA ASP 36 HA ASP 36 68.267 8.146 8.146
238 1HB ASP 36 HB2 ASP 36 69.537 8.010 8.010
239 2HB ASP 36 HB1 ASP 36 67.830 8.391 8.391
240 H ILE 37 HN ILE 37 70.143 7.825 7.825
241 HA ILE 37 HA ILE 37 72.023 10.136 10.136
242 HB ILE 37 HB ILE 37 72.590 9.076 9.076
243 1HG1 ILE 37 HG12 ILE 37 70.653 6.889 6.889
244 2HG1 ILE 37 HG11 ILE 37 72.409 6.728 6.728
245 1HG2 ILE 37 HG23 ILE 37 70.090 10.127 10.127
246 2HG2 ILE 37 HG22 ILE 37 69.714 8.673 8.673
247 3HG2 ILE 37 HG21 ILE 37 70.728 9.930 9.930
248 HD1 ILE 37 HD1 ILE 37 71.834 7.732 7.732
249 HD1 ILE 37 HD1 ILE 37 72.326 6.086 6.086
250 HD1 ILE 37 HD1 ILE 37 70.613 6.494 6.494
251 H SER 38 HN SER 38 74.373 9.434 9.434
252 HA SER 38 HA SER 38 75.403 8.063 8.063
253 1HB SER 38 HB2 SER 38 76.584 8.410 8.410
254 2HB SER 38 HB1 SER 38 77.500 8.100 8.100
255 HG SER 38 HG SER 38 77.418 10.328 10.328
256 H THR 39 HN THR 39 75.632 5.899 5.899
257 HA THR 39 HA THR 39 74.376 3.817 3.817
258 HB THR 39 HB THR 39 76.060 2.393 2.393
259 HG1 THR 39 HG1 THR 39 77.316 3.839 3.839
260 1HG2 THR 39 HG22 THR 39 74.139 4.322 4.322
261 2HG2 THR 39 HG21 THR 39 75.411 4.022 4.022
262 3HG2 THR 39 HG23 THR 39 74.459 2.678 2.678
263 H LYS 40 HN LYS 40 77.389 5.404 5.404
264 HA LYS 40 HA LYS 40 78.478 3.297 3.297
265 1HB LYS 40 HB2 LYS 40 79.016 6.263 6.263
266 2HB LYS 40 HB1 LYS 40 80.011 5.198 5.198
267 1HG LYS 40 HG2 LYS 40 79.678 3.902 3.902
268 2HG LYS 40 HG1 LYS 40 80.094 5.581 5.581
269 1HD LYS 40 HD2 LYS 40 81.682 4.485 4.485
270 2HD LYS 40 HD1 LYS 40 81.887 3.569 3.569
271 1HE LYS 40 HE2 LYS 40 83.478 5.249 5.249
272 2HE LYS 40 HE1 LYS 40 82.061 6.025 6.025
273 1HZ LYS 40 HZ1 LYS 40 81.535 6.820 6.820
274 2HZ LYS 40 HZ3 LYS 40 83.118 6.376 6.376
275 3HZ LYS 40 HZ2 LYS 40 82.854 7.567 7.567
276 H GLU 41 HN GLU 41 75.950 5.549 5.549
277 HA GLU 41 HA GLU 41 76.267 5.740 5.740
278 1HB GLU 41 HB2 GLU 41 75.651 7.645 7.645
279 2HB GLU 41 HB1 GLU 41 74.071 6.870 6.870
280 1HG GLU 41 HG2 GLU 41 73.924 8.547 8.547
281 2HG GLU 41 HG1 GLU 41 73.929 6.970 6.970
282 H LEU 42 HN LEU 42 75.076 3.486 3.486
283 HA LEU 42 HA LEU 42 72.433 2.911 2.911
284 1HB LEU 42 HB2 LEU 42 74.580 1.729 1.729
285 2HB LEU 42 HB1 LEU 42 73.804 0.494 0.494
286 HG LEU 42 HG LEU 42 71.626 1.859 1.859
287 HD1 LEU 42 HD1 LEU 42 73.522 3.039 3.039
288 HD1 LEU 42 HD1 LEU 42 71.921 2.692 2.692
289 HD1 LEU 42 HD1 LEU 42 73.269 1.611 1.611
290 HD2 LEU 42 HD2 LEU 42 72.400 -0.665 -0.665
291 HD2 LEU 42 HD2 LEU 42 72.839 -0.290 -0.290
292 HD2 LEU 42 HD2 LEU 42 71.168 -0.104 -0.104
293 H GLY 43 HN GLY 43 75.468 1.311 1.311
294 1HA GLY 43 HA2 GLY 43 74.455 -0.236 -0.236
295 2HA GLY 43 HA1 GLY 43 76.059 0.497 0.497
296 H THR 44 HN THR 44 75.327 3.218 3.218
297 HA THR 44 HA THR 44 74.899 3.666 3.666
298 HB THR 44 HB THR 44 74.660 5.297 5.297
299 HG1 THR 44 HG1 THR 44 76.678 4.605 4.605
300 1HG2 THR 44 HG23 THR 44 73.861 6.069 6.069
301 2HG2 THR 44 HG22 THR 44 74.618 7.272 7.272
302 3HG2 THR 44 HG21 THR 44 73.111 6.500 6.500
303 H VAL 45 HN VAL 45 72.560 4.502 4.502
304 HA VAL 45 HA VAL 45 70.308 5.024 5.024
305 HB VAL 45 HB VAL 45 70.652 3.549 3.549
306 1HG1 VAL 45 HG11 VAL 45 68.431 3.094 3.094
307 2HG1 VAL 45 HG13 VAL 45 68.101 4.820 4.820
308 3HG1 VAL 45 HG12 VAL 45 68.312 3.831 3.831
309 1HG2 VAL 45 HG23 VAL 45 70.832 6.289 6.289
310 2HG2 VAL 45 HG22 VAL 45 71.069 5.626 5.626
311 3HG2 VAL 45 HG21 VAL 45 69.458 6.120 6.120
312 H MET 46 HN MET 46 71.101 1.770 1.770
313 HA MET 46 HA MET 46 69.071 0.317 0.317
314 1HB MET 46 HB2 MET 46 71.930 -0.417 -0.417
315 2HB MET 46 HB1 MET 46 70.676 -1.591 -1.591
316 1HG MET 46 HG2 MET 46 70.638 0.363 0.363
317 2HG MET 46 HG1 MET 46 70.826 -1.387 -1.387
318 1HE MET 46 HE1 MET 46 69.156 -3.028 -3.028
319 2HE MET 46 HE3 MET 46 68.781 -2.078 -2.078
320 3HE MET 46 HE2 MET 46 67.481 -2.674 -2.674
321 H ARG 47 HN ARG 47 72.456 0.748 0.748
322 HA ARG 47 HA ARG 47 72.061 -0.467 -0.467
323 1HB ARG 47 HB2 ARG 47 74.029 1.451 1.451
324 2HB ARG 47 HB1 ARG 47 74.177 0.997 0.997
325 1HG ARG 47 HG2 ARG 47 74.054 -1.434 -1.434
326 2HG ARG 47 HG1 ARG 47 74.290 -0.811 -0.811
327 1HD ARG 47 HD2 ARG 47 76.458 -0.007 -0.007
328 2HD ARG 47 HD1 ARG 47 76.174 -0.042 -0.042
329 HE ARG 47 HE ARG 47 75.793 -2.679 -2.679
330 1HH1 ARG 47 HH2 ARG 47 78.074 -1.823 -1.823
331 2HH1 ARG 47 HH2 ARG 47 79.452 -2.307 -2.307
332 1HH2 ARG 47 HH1 ARG 47 77.664 -2.658 -2.658
333 2HH2 ARG 47 HH1 ARG 47 79.219 -2.780 -2.780
334 H MET 48 HN MET 48 71.863 2.924 2.924
335 HA MET 48 HA MET 48 71.464 4.105 4.105
336 1HB MET 48 HB2 MET 48 72.040 5.131 5.131
337 2HB MET 48 HB1 MET 48 70.308 5.058 5.058
338 1HG MET 48 HG2 MET 48 70.318 7.131 7.131
339 2HG MET 48 HG1 MET 48 70.263 6.199 6.199
340 1HE MET 48 HE1 MET 48 71.606 8.948 8.948
341 2HE MET 48 HE3 MET 48 71.353 9.172 9.172
342 3HE MET 48 HE2 MET 48 72.948 9.428 9.428
343 H LEU 49 HN LEU 49 69.367 2.223 2.223
344 HA LEU 49 HA LEU 49 66.887 3.256 3.256
345 1HB LEU 49 HB2 LEU 49 67.583 1.113 1.113
346 2HB LEU 49 HB1 LEU 49 65.929 1.427 1.427
347 HG LEU 49 HG LEU 49 67.698 3.640 3.640
348 HD1 LEU 49 HD1 LEU 49 67.655 2.052 2.052
349 HD1 LEU 49 HD1 LEU 49 66.446 3.279 3.279
350 HD1 LEU 49 HD1 LEU 49 65.943 1.714 1.714
351 HD2 LEU 49 HD2 LEU 49 65.834 4.645 4.645
352 HD2 LEU 49 HD2 LEU 49 64.813 3.230 3.230
353 HD2 LEU 49 HD2 LEU 49 65.193 4.302 4.302
354 H GLY 50 HN GLY 50 68.809 0.241 0.241
355 1HA GLY 50 HA2 GLY 50 68.721 -0.559 -0.559
356 2HA GLY 50 HA1 GLY 50 67.057 -0.900 -0.900
357 H GLN 51 HN GLN 51 68.334 -1.415 -1.415
358 HA GLN 51 HA GLN 51 68.572 -4.314 -4.314
359 1HB GLN 51 HB2 GLN 51 69.039 -2.671 -2.671
360 2HB GLN 51 HB1 GLN 51 68.505 -4.349 -4.349
361 1HG GLN 51 HG2 GLN 51 66.370 -3.654 -3.654
362 2HG GLN 51 HG1 GLN 51 66.680 -2.793 -2.793
363 1HE2 GLN 51 HE22 GLN 51 65.660 -0.448 -0.448
364 2HE2 GLN 51 HE21 GLN 51 65.016 -1.947 -1.947
365 H ASN 52 HN ASN 52 70.479 -5.122 -5.122
366 HA ASN 52 HA ASN 52 73.015 -3.694 -3.694
367 1HB ASN 52 HB2 ASN 52 72.160 -5.283 -5.283
368 2HB ASN 52 HB1 ASN 52 72.959 -6.499 -6.499
369 HD2 ASN 52 HD2 ASN 52 73.507 -3.521 -3.521
370 HD2 ASN 52 HD2 ASN 52 75.198 -3.662 -3.662
371 HA PRO 53 HA PRO 53 72.800 -6.224 -6.224
372 1HB PRO 53 HB2 PRO 53 73.829 -4.277 -4.277
373 2HB PRO 53 HB1 PRO 53 72.101 -4.401 -4.401
374 1HG PRO 53 HG2 PRO 53 74.164 -2.584 -2.584
375 2HG PRO 53 HG1 PRO 53 72.466 -2.264 -2.264
376 1HD PRO 53 HD2 PRO 53 73.385 -2.723 -2.723
377 2HD PRO 53 HD1 PRO 53 71.724 -3.072 -3.072
378 H THR 54 HN THR 54 74.521 -7.631 -7.631
379 HA THR 54 HA THR 54 77.108 -7.134 -7.134
380 HB THR 54 HB THR 54 77.652 -9.185 -9.185
381 HG1 THR 54 HG1 THR 54 75.672 -10.105 -10.105
382 1HG2 THR 54 HG21 THR 54 75.818 -8.857 -8.857
383 2HG2 THR 54 HG23 THR 54 75.353 -10.246 -10.246
384 3HG2 THR 54 HG22 THR 54 76.976 -10.153 -10.153
385 H LYS 55 HN LYS 55 78.981 -6.297 -6.297
386 HA LYS 55 HA LYS 55 78.983 -4.451 -4.451
387 1HB LYS 55 HB2 LYS 55 80.780 -5.332 -5.332
388 2HB LYS 55 HB1 LYS 55 81.341 -6.264 -6.264
389 1HG LYS 55 HG2 LYS 55 82.158 -4.428 -4.428
390 2HG LYS 55 HG1 LYS 55 80.755 -3.450 -3.450
391 1HD LYS 55 HD2 LYS 55 82.640 -4.213 -4.213
392 2HD LYS 55 HD1 LYS 55 83.161 -2.967 -2.967
393 1HE LYS 55 HE2 LYS 55 80.397 -2.543 -2.543
394 2HE LYS 55 HE1 LYS 55 81.514 -2.554 -2.554
395 1HZ LYS 55 HZ3 LYS 55 83.005 -1.136 -1.136
396 2HZ LYS 55 HZ2 LYS 55 81.657 -0.904 -0.904
397 3HZ LYS 55 HZ1 LYS 55 81.615 -0.378 -0.378
398 H GLU 56 HN GLU 56 79.781 -7.934 -7.934
399 HA GLU 56 HA GLU 56 80.387 -8.091 -8.091
400 1HB GLU 56 HB2 GLU 56 79.655 -9.799 -9.799
401 2HB GLU 56 HB1 GLU 56 78.725 -10.300 -10.300
402 1HG GLU 56 HG2 GLU 56 80.566 -11.358 -11.358
403 2HG GLU 56 HG1 GLU 56 81.316 -9.776 -9.776
404 H GLU 57 HN GLU 57 77.196 -7.898 -7.898
405 HA GLU 57 HA GLU 57 75.697 -8.313 -8.313
406 1HB GLU 57 HB2 GLU 57 75.134 -7.365 -7.365
407 2HB GLU 57 HB1 GLU 57 73.872 -7.328 -7.328
408 1HG GLU 57 HG2 GLU 57 75.488 -9.819 -9.819
409 2HG GLU 57 HG1 GLU 57 74.005 -9.452 -9.452
410 H LEU 58 HN LEU 58 76.638 -5.458 -5.458
411 HA LEU 58 HA LEU 58 75.275 -3.471 -3.471
412 1HB LEU 58 HB2 LEU 58 77.915 -3.440 -3.440
413 2HB LEU 58 HB1 LEU 58 77.041 -1.992 -1.992
414 HG LEU 58 HG LEU 58 76.022 -4.140 -4.140
415 HD1 LEU 58 HD1 LEU 58 77.707 -2.041 -2.041
416 HD1 LEU 58 HD1 LEU 58 76.605 -2.764 -2.764
417 HD1 LEU 58 HD1 LEU 58 76.127 -1.313 -1.313
418 HD2 LEU 58 HD2 LEU 58 74.719 -1.694 -1.694
419 HD2 LEU 58 HD2 LEU 58 74.114 -2.448 -2.448
420 HD2 LEU 58 HD2 LEU 58 74.141 -3.360 -3.360
421 H ASP 59 HN ASP 59 78.629 -4.692 -4.692
422 HA ASP 59 HA ASP 59 79.326 -3.110 -3.110
423 1HB ASP 59 HB2 ASP 59 80.468 -5.019 -5.019
424 2HB ASP 59 HB1 ASP 59 80.509 -5.782 -5.782
425 H ALA 60 HN ALA 60 77.775 -6.300 -6.300
426 HA ALA 60 HA ALA 60 77.771 -6.844 -6.844
427 1HB ALA 60 HB3 ALA 60 76.949 -8.043 -8.043
428 2HB ALA 60 HB2 ALA 60 75.721 -8.286 -8.286
429 3HB ALA 60 HB1 ALA 60 77.374 -8.835 -8.835
430 H ILE 61 HN ILE 61 75.379 -5.537 -5.537
431 HA ILE 61 HA ILE 61 73.266 -5.277 -5.277
432 HB ILE 61 HB ILE 61 73.815 -4.258 -4.258
433 1HG1 ILE 61 HG12 ILE 61 71.400 -5.827 -5.827
434 2HG1 ILE 61 HG11 ILE 61 72.918 -6.674 -6.674
435 1HG2 ILE 61 HG22 ILE 61 71.935 -3.199 -3.199
436 2HG2 ILE 61 HG21 ILE 61 71.106 -3.829 -3.829
437 3HG2 ILE 61 HG23 ILE 61 72.342 -2.585 -2.585
438 HD1 ILE 61 HD1 ILE 61 73.485 -6.727 -6.727
439 HD1 ILE 61 HD1 ILE 61 71.737 -6.628 -6.628
440 HD1 ILE 61 HD1 ILE 61 72.724 -5.173 -5.173
441 H ILE 62 HN ILE 62 75.530 -2.964 -2.964
442 HA ILE 62 HA ILE 62 74.706 -0.568 -0.568
443 HB ILE 62 HB ILE 62 77.392 -1.753 -1.753
444 1HG1 ILE 62 HG12 ILE 62 75.696 0.460 0.460
445 2HG1 ILE 62 HG11 ILE 62 75.819 -1.187 -1.187
446 1HG2 ILE 62 HG22 ILE 62 76.794 0.761 0.761
447 2HG2 ILE 62 HG21 ILE 62 77.923 0.903 0.903
448 3HG2 ILE 62 HG23 ILE 62 78.268 -0.204 -0.204
449 HD1 ILE 62 HD1 ILE 62 78.264 0.545 0.545
450 HD1 ILE 62 HD1 ILE 62 78.091 -0.908 -0.908
451 HD1 ILE 62 HD1 ILE 62 77.312 0.594 0.594
452 H GLU 63 HN GLU 63 77.398 -2.504 -2.504
453 HA GLU 63 HA GLU 63 77.619 -1.284 -1.284
454 1HB GLU 63 HB2 GLU 63 78.873 -3.260 -3.260
455 2HB GLU 63 HB1 GLU 63 77.665 -4.283 -4.283
456 1HG GLU 63 HG2 GLU 63 78.740 -4.124 -4.124
457 2HG GLU 63 HG1 GLU 63 78.670 -2.363 -2.363
458 H GLU 64 HN GLU 64 75.112 -3.521 -3.521
459 HA GLU 64 HA GLU 64 73.975 -3.946 -3.946
460 1HB GLU 64 HB2 GLU 64 73.588 -5.666 -5.666
461 2HB GLU 64 HB1 GLU 64 73.270 -4.539 -4.539
462 1HG GLU 64 HG2 GLU 64 71.165 -5.550 -5.550
463 2HG GLU 64 HG1 GLU 64 71.156 -3.856 -3.856
464 H VAL 65 HN VAL 65 73.316 -1.806 -1.806
465 HA VAL 65 HA VAL 65 71.054 -0.542 -0.542
466 HB VAL 65 HB VAL 65 70.512 0.362 0.362
467 1HG1 VAL 65 HG13 VAL 65 70.129 -2.095 -2.095
468 2HG1 VAL 65 HG12 VAL 65 71.674 -2.399 -2.399
469 3HG1 VAL 65 HG11 VAL 65 70.357 -1.646 -1.646
470 1HG2 VAL 65 HG21 VAL 65 73.373 0.219 0.219
471 2HG2 VAL 65 HG23 VAL 65 72.192 1.078 1.078
472 3HG2 VAL 65 HG22 VAL 65 72.586 -0.603 -0.603
473 H ASP 66 HN ASP 66 74.363 -0.175 -0.175
474 HA ASP 66 HA ASP 66 74.758 2.603 2.603
475 1HB ASP 66 HB2 ASP 66 76.298 0.421 0.421
476 2HB ASP 66 HB1 ASP 66 76.408 1.174 1.174
477 H GLU 67 HN GLU 67 76.153 3.214 3.214
478 HA GLU 67 HA GLU 67 73.997 4.491 4.491
479 1HB GLU 67 HB2 GLU 67 76.726 4.790 4.790
480 2HB GLU 67 HB1 GLU 67 76.606 4.228 4.228
481 1HG GLU 67 HG2 GLU 67 75.296 6.057 6.057
482 2HG GLU 67 HG1 GLU 67 74.791 6.413 6.413
483 H ASP 68 HN ASP 68 73.239 1.878 1.878
484 HA ASP 68 HA ASP 68 74.210 0.697 0.697
485 1HB ASP 68 HB2 ASP 68 72.168 -0.312 -0.312
486 2HB ASP 68 HB1 ASP 68 73.027 -1.263 -1.263
487 H GLY 69 HN GLY 69 71.814 2.826 2.826
488 1HA GLY 69 HA2 GLY 69 70.499 2.882 2.882
489 2HA GLY 69 HA1 GLY 69 69.479 2.077 2.077
490 H SER 70 HN SER 70 69.904 3.502 3.502
491 HA SER 70 HA SER 70 68.724 6.142 6.142
492 1HB SER 70 HB2 SER 70 69.024 4.920 4.920
493 2HB SER 70 HB1 SER 70 67.788 6.037 6.037
494 HG SER 70 HG SER 70 67.014 3.889 3.889
495 H GLY 71 HN GLY 71 70.896 5.059 5.059
496 1HA GLY 71 HA2 GLY 71 73.156 6.601 6.601
497 2HA GLY 71 HA1 GLY 71 72.118 7.637 7.637
498 H THR 72 HN THR 72 72.160 7.367 7.367
499 HA THR 72 HA THR 72 74.082 5.423 5.423
500 HB THR 72 HB THR 72 73.729 6.722 6.722
501 HG1 THR 72 HG1 THR 72 72.112 8.549 8.549
502 1HG2 THR 72 HG21 THR 72 74.969 7.677 7.677
503 2HG2 THR 72 HG23 THR 72 73.584 8.762 8.762
504 3HG2 THR 72 HG22 THR 72 74.589 8.765 8.765
505 H ILE 73 HN ILE 73 70.892 6.347 6.347
506 HA ILE 73 HA ILE 73 69.896 3.579 3.579
507 HB ILE 73 HB ILE 73 71.433 3.599 3.599
508 1HG1 ILE 73 HG12 ILE 73 69.272 3.332 3.332
509 2HG1 ILE 73 HG11 ILE 73 68.550 3.073 3.073
510 1HG2 ILE 73 HG22 ILE 73 70.594 6.180 6.180
511 2HG2 ILE 73 HG21 ILE 73 69.660 5.352 5.352
512 3HG2 ILE 73 HG23 ILE 73 71.420 5.239 5.239
513 HD1 ILE 73 HD1 ILE 73 69.922 1.164 1.164
514 HD1 ILE 73 HD1 ILE 73 71.129 1.720 1.720
515 HD1 ILE 73 HD1 ILE 73 69.587 1.080 1.080
516 H ASP 74 HN ASP 74 67.699 3.723 3.723
517 HA ASP 74 HA ASP 74 66.357 6.317 6.317
518 1HB ASP 74 HB2 ASP 74 65.701 3.718 3.718
519 2HB ASP 74 HB1 ASP 74 64.479 4.968 4.968
520 H PHE 75 HN PHE 75 64.857 6.633 6.633
521 HA PHE 75 HA PHE 75 64.758 5.098 5.098
522 1HB PHE 75 HB2 PHE 75 63.877 7.430 7.430
523 2HB PHE 75 HB1 PHE 75 62.461 6.672 6.672
524 HD1 PHE 75 HD2 PHE 75 61.140 4.978 4.978
525 HD2 PHE 75 HD1 PHE 75 63.990 7.745 7.745
526 HE1 PHE 75 HE2 PHE 75 60.130 4.693 4.693
527 HE2 PHE 75 HE1 PHE 75 62.979 7.460 7.460
528 HZ PHE 75 HZ PHE 75 61.050 5.933 5.933
529 H GLU 76 HN GLU 76 62.166 5.120 5.120
530 HA GLU 76 HA GLU 76 60.678 2.936 2.936
531 1HB GLU 76 HB2 GLU 76 59.841 2.838 2.838
532 2HB GLU 76 HB1 GLU 76 59.990 4.505 4.505
533 1HG GLU 76 HG2 GLU 76 62.252 4.601 4.601
534 2HG GLU 76 HG1 GLU 76 61.947 2.998 2.998
535 H GLU 77 HN GLU 77 63.444 2.925 2.925
536 HA GLU 77 HA GLU 77 63.396 0.056 0.056
537 1HB GLU 77 HB2 GLU 77 64.379 1.837 1.837
538 2HB GLU 77 HB1 GLU 77 65.668 2.046 2.046
539 1HG GLU 77 HG2 GLU 77 66.578 0.522 0.522
540 2HG GLU 77 HG1 GLU 77 66.029 -0.505 -0.505
541 H PHE 78 HN PHE 78 65.056 2.228 2.228
542 HA PHE 78 HA PHE 78 66.876 0.269 0.269
543 1HB PHE 78 HB2 PHE 78 67.385 2.553 2.553
544 2HB PHE 78 HB1 PHE 78 65.743 2.938 2.938
545 HD1 PHE 78 HD1 PHE 78 68.558 0.664 0.664
546 HD2 PHE 78 HD2 PHE 78 65.390 3.281 3.281
547 HE1 PHE 78 HE1 PHE 78 69.215 0.326 0.326
548 HE2 PHE 78 HE2 PHE 78 66.048 2.944 2.944
549 HZ PHE 78 HZ PHE 78 67.960 1.467 1.467
550 H LEU 79 HN LEU 79 63.511 1.081 1.081
551 HA LEU 79 HA LEU 79 62.995 0.164 0.164
552 1HB LEU 79 HB2 LEU 79 61.624 0.279 0.279
553 2HB LEU 79 HB1 LEU 79 61.004 -1.012 -1.012
554 HG LEU 79 HG LEU 79 59.751 1.001 1.001
555 HD1 LEU 79 HD1 LEU 79 61.397 -0.358 -0.358
556 HD1 LEU 79 HD1 LEU 79 59.802 0.356 0.356
557 HD1 LEU 79 HD1 LEU 79 61.252 1.334 1.334
558 HD2 LEU 79 HD2 LEU 79 62.506 2.222 2.222
559 HD2 LEU 79 HD2 LEU 79 61.084 2.985 2.985
560 HD2 LEU 79 HD2 LEU 79 61.172 2.741 2.741
561 H VAL 80 HN VAL 80 63.710 -1.839 -1.839
562 HA VAL 80 HA VAL 80 63.137 -4.398 -4.398
563 HB VAL 80 HB VAL 80 64.680 -5.168 -5.168
564 1HG1 VAL 80 HG12 VAL 80 62.744 -2.989 -2.989
565 2HG1 VAL 80 HG11 VAL 80 63.891 -3.225 -3.225
566 3HG1 VAL 80 HG13 VAL 80 62.871 -4.562 -4.562
567 1HG2 VAL 80 HG23 VAL 80 65.658 -2.304 -2.304
568 2HG2 VAL 80 HG22 VAL 80 66.596 -3.779 -3.779
569 3HG2 VAL 80 HG21 VAL 80 65.999 -3.365 -3.365
570 H MET 81 HN MET 81 66.126 -2.448 -2.448
571 HA MET 81 HA MET 81 67.625 -4.396 -4.396
572 1HB MET 81 HB2 MET 81 67.787 -1.474 -1.474
573 2HB MET 81 HB1 MET 81 68.878 -2.127 -2.127
574 1HG MET 81 HG2 MET 81 68.552 -3.434 -3.434
575 2HG MET 81 HG1 MET 81 69.728 -2.149 -2.149
576 1HE MET 81 HE1 MET 81 70.821 -2.001 -2.001
577 2HE MET 81 HE3 MET 81 70.968 -3.285 -3.285
578 3HE MET 81 HE2 MET 81 72.231 -3.058 -3.058
579 H MET 82 HN MET 82 65.068 -2.248 -2.248
580 HA MET 82 HA MET 82 65.780 -1.971 -1.971
581 1HB MET 82 HB2 MET 82 63.343 -1.287 -1.287
582 2HB MET 82 HB1 MET 82 63.519 -0.854 -0.854
583 1HG MET 82 HG2 MET 82 65.799 0.185 0.185
584 2HG MET 82 HG1 MET 82 65.039 0.170 0.170
585 1HE MET 82 HE1 MET 82 65.727 1.493 1.493
586 2HE MET 82 HE3 MET 82 65.035 3.122 3.122
587 3HE MET 82 HE2 MET 82 64.194 1.812 1.812
588 H VAL 83 HN VAL 83 63.222 -3.633 -3.633
589 HA VAL 83 HA VAL 83 62.225 -5.051 -5.051
590 HB VAL 83 HB VAL 83 60.594 -5.876 -5.876
591 1HG1 VAL 83 HG12 VAL 83 61.123 -3.197 -3.197
592 2HG1 VAL 83 HG11 VAL 83 61.133 -3.431 -3.431
593 3HG1 VAL 83 HG13 VAL 83 59.710 -3.876 -3.876
594 1HG2 VAL 83 HG22 VAL 83 62.575 -5.194 -5.194
595 2HG2 VAL 83 HG21 VAL 83 62.143 -6.818 -6.818
596 3HG2 VAL 83 HG23 VAL 83 60.943 -5.805 -5.805
597 H ARG 84 HN ARG 84 64.086 -5.941 -5.941
598 HA ARG 84 HA ARG 84 64.310 -8.722 -8.722
599 1HB ARG 84 HB2 ARG 84 66.178 -6.680 -6.680
600 2HB ARG 84 HB1 ARG 84 66.416 -8.422 -8.422
601 1HG ARG 84 HG2 ARG 84 64.008 -8.515 -8.515
602 2HG ARG 84 HG1 ARG 84 64.126 -6.764 -6.764
603 1HD ARG 84 HD2 ARG 84 64.924 -7.370 -7.370
604 2HD ARG 84 HD1 ARG 84 66.452 -7.491 -7.491
605 HE ARG 84 HE ARG 84 64.724 -9.779 -9.779
606 1HH1 ARG 84 HH1 ARG 84 65.382 -11.298 -11.298
607 2HH1 ARG 84 HH1 ARG 84 67.088 -11.599 -11.599
608 1HH2 ARG 84 HH2 ARG 84 67.839 -8.955 -8.955
609 2HH2 ARG 84 HH2 ARG 84 68.480 -10.271 -10.271
610 H GLN 85 HN GLN 85 66.156 -6.008 -6.008
611 HA GLN 85 HA GLN 85 68.089 -7.722 -7.722
612 1HB GLN 85 HB2 GLN 85 68.417 -5.346 -5.346
613 2HB GLN 85 HB1 GLN 85 67.380 -4.812 -4.812
614 1HG GLN 85 HG2 GLN 85 69.845 -4.718 -4.718
615 2HG GLN 85 HG1 GLN 85 68.907 -5.704 -5.704
616 1HE2 GLN 85 HE22 GLN 85 71.392 -7.613 -7.613
617 2HE2 GLN 85 HE21 GLN 85 70.788 -6.074 -6.074
618 H MET 86 HN MET 86 65.470 -5.540 -5.540
619 HA MET 86 HA MET 86 65.542 -6.421 -6.421
620 1HB MET 86 HB2 MET 86 64.064 -4.648 -4.648
621 2HB MET 86 HB1 MET 86 62.928 -5.564 -5.564
622 1HG MET 86 HG2 MET 86 65.098 -4.824 -4.824
623 2HG MET 86 HG1 MET 86 64.616 -3.382 -3.382
624 1HE MET 86 HE2 MET 86 62.578 -2.342 -2.342
625 2HE MET 86 HE1 MET 86 61.437 -3.637 -3.637
626 3HE MET 86 HE3 MET 86 61.156 -2.556 -2.556
627 H LYS 87 HN LYS 87 63.978 -7.718 -7.718
628 HA LYS 87 HA LYS 87 61.929 -9.305 -9.305
629 1HB LYS 87 HB2 LYS 87 63.793 -9.334 -9.334
630 2HB LYS 87 HB1 LYS 87 63.140 -10.922 -10.922
631 1HG LYS 87 HG2 LYS 87 61.200 -8.676 -8.676
632 2HG LYS 87 HG1 LYS 87 61.839 -9.162 -9.162
633 1HD LYS 87 HD2 LYS 87 60.107 -10.667 -10.667
634 2HD LYS 87 HD1 LYS 87 61.318 -11.601 -11.601
635 1HE LYS 87 HE2 LYS 87 60.353 -11.148 -11.148
636 2HE LYS 87 HE1 LYS 87 59.585 -9.653 -9.653
637 1HZ LYS 87 HZ3 LYS 87 58.294 -11.116 -11.116
638 2HZ LYS 87 HZ2 LYS 87 58.848 -12.447 -12.447
639 3HZ LYS 87 HZ1 LYS 87 57.878 -11.262 -11.262
640 H GLU 88 HN GLU 88 65.375 -9.617 -9.617
641 HA GLU 88 HA GLU 88 65.116 -12.314 -12.314
642 1HB GLU 88 HB2 GLU 88 67.153 -10.709 -10.709
643 2HB GLU 88 HB1 GLU 88 67.769 -11.485 -11.485
644 1HG GLU 88 HG2 GLU 88 68.103 -13.155 -13.155
645 2HG GLU 88 HG1 GLU 88 66.533 -13.605 -13.605
646 H ASP 89 HN ASP 89 66.074 -8.969 -8.969
647 HA ASP 89 HA ASP 89 66.800 -9.523 -9.523
648 1HB ASP 89 HB2 ASP 89 67.271 -7.551 -7.551
649 2HB ASP 89 HB1 ASP 89 66.012 -6.795 -6.795
650 H ALA 90 HN ALA 90 63.886 -8.503 -8.503
651 HA ALA 90 HA ALA 90 62.430 -7.791 -7.791
652 1HB ALA 90 HB3 ALA 90 62.087 -6.783 -6.783
653 2HB ALA 90 HB2 ALA 90 61.483 -8.340 -8.340
654 3HB ALA 90 HB1 ALA 90 60.600 -7.450 -7.450
Start of MODEL 19
1 1H ALA 1 HT3 ALA 1 63.955 -5.779 -5.779
2 2H ALA 1 HT2 ALA 1 65.220 -4.653 -4.653
3 3H ALA 1 HT1 ALA 1 65.334 -6.155 -6.155
4 HA ALA 1 HA ALA 1 66.401 -6.951 -6.951
5 1HB ALA 1 HB3 ALA 1 66.802 -4.458 -4.458
6 2HB ALA 1 HB2 ALA 1 65.456 -4.482 -4.482
7 3HB ALA 1 HB1 ALA 1 66.903 -5.438 -5.438
8 H SER 2 HN SER 2 65.954 -8.009 -8.009
9 HA SER 2 HA SER 2 63.110 -8.736 -8.736
10 1HB SER 2 HB2 SER 2 64.720 -10.503 -10.503
11 2HB SER 2 HB1 SER 2 65.729 -9.630 -9.630
12 HG SER 2 HG SER 2 64.388 -11.313 -11.313
13 H MET 3 HN MET 3 65.244 -6.468 -6.468
14 HA MET 3 HA MET 3 64.356 -6.399 -6.399
15 1HB MET 3 HB2 MET 3 65.661 -4.583 -4.583
16 2HB MET 3 HB1 MET 3 65.017 -3.843 -3.843
17 1HG MET 3 HG2 MET 3 66.278 -5.579 -5.579
18 2HG MET 3 HG1 MET 3 67.045 -6.087 -6.087
19 1HE MET 3 HE3 MET 3 67.628 -4.636 -4.636
20 2HE MET 3 HE2 MET 3 68.462 -3.090 -3.090
21 3HE MET 3 HE1 MET 3 66.708 -3.152 -3.152
22 H THR 4 HN THR 4 63.007 -4.993 -4.993
23 HA THR 4 HA THR 4 61.175 -3.131 -3.131
24 HB THR 4 HB THR 4 61.639 -3.827 -3.827
25 HG1 THR 4 HG1 THR 4 59.080 -3.513 -3.513
26 1HG2 THR 4 HG21 THR 4 61.474 -6.271 -6.271
27 2HG2 THR 4 HG23 THR 4 59.740 -6.089 -6.089
28 3HG2 THR 4 HG22 THR 4 60.433 -5.749 -5.749
29 H ASP 5 HN ASP 5 61.139 -6.592 -6.592
30 HA ASP 5 HA ASP 5 58.313 -6.654 -6.654
31 1HB ASP 5 HB2 ASP 5 59.148 -8.551 -8.551
32 2HB ASP 5 HB1 ASP 5 60.593 -8.635 -8.635
33 H GLN 6 HN GLN 6 61.383 -7.616 -7.616
34 HA GLN 6 HA GLN 6 60.350 -7.668 -7.668
35 1HB GLN 6 HB2 GLN 6 62.908 -7.758 -7.758
36 2HB GLN 6 HB1 GLN 6 63.049 -6.993 -6.993
37 1HG GLN 6 HG2 GLN 6 62.476 -8.913 -8.913
38 2HG GLN 6 HG1 GLN 6 61.438 -9.497 -9.497
39 1HE2 GLN 6 HE22 GLN 6 64.480 -11.634 -11.634
40 2HE2 GLN 6 HE21 GLN 6 63.198 -11.352 -11.352
41 H GLN 7 HN GLN 7 60.998 -5.003 -5.003
42 HA GLN 7 HA GLN 7 61.687 -3.057 -3.057
43 1HB GLN 7 HB2 GLN 7 62.304 -2.888 -2.888
44 2HB GLN 7 HB1 GLN 7 60.596 -2.764 -2.764
45 1HG GLN 7 HG2 GLN 7 61.237 -0.853 -0.853
46 2HG GLN 7 HG1 GLN 7 62.332 -0.651 -0.651
47 1HE2 GLN 7 HE22 GLN 7 59.840 1.132 1.132
48 2HE2 GLN 7 HE21 GLN 7 61.465 1.027 1.027
49 H ALA 8 HN ALA 8 58.731 -4.488 -4.488
50 HA ALA 8 HA ALA 8 57.034 -2.237 -2.237
51 1HB ALA 8 HB1 ALA 8 56.854 -4.660 -4.660
52 2HB ALA 8 HB3 ALA 8 55.493 -4.534 -4.534
53 3HB ALA 8 HB2 ALA 8 55.820 -3.231 -3.231
54 H GLU 9 HN GLU 9 56.807 -5.716 -5.716
55 HA GLU 9 HA GLU 9 55.394 -5.538 -5.538
56 1HB GLU 9 HB2 GLU 9 57.492 -7.367 -7.367
57 2HB GLU 9 HB1 GLU 9 56.942 -7.629 -7.629
58 1HG GLU 9 HG2 GLU 9 54.753 -8.105 -8.105
59 2HG GLU 9 HG1 GLU 9 54.921 -7.241 -7.241
60 H ALA 10 HN ALA 10 58.858 -4.945 -4.945
61 HA ALA 10 HA ALA 10 59.850 -4.992 -4.992
62 1HB ALA 10 HB2 ALA 10 61.054 -4.477 -4.477
63 2HB ALA 10 HB1 ALA 10 60.359 -2.857 -2.857
64 3HB ALA 10 HB3 ALA 10 61.473 -3.375 -3.375
65 H ARG 11 HN ARG 11 57.542 -2.724 -2.724
66 HA ARG 11 HA ARG 11 57.822 -0.874 -0.874
67 1HB ARG 11 HB2 ARG 11 55.790 -0.722 -0.722
68 2HB ARG 11 HB1 ARG 11 56.500 0.598 0.598
69 1HG ARG 11 HG2 ARG 11 58.231 0.788 0.788
70 2HG ARG 11 HG1 ARG 11 58.528 -0.949 -0.949
71 1HD ARG 11 HD2 ARG 11 57.787 -0.795 -0.795
72 2HD ARG 11 HD1 ARG 11 56.185 -0.835 -0.835
73 HE ARG 11 HE ARG 11 57.624 1.735 1.735
74 1HH1 ARG 11 HH2 ARG 11 55.297 2.221 2.221
75 2HH1 ARG 11 HH2 ARG 11 54.005 2.376 2.376
76 1HH2 ARG 11 HH1 ARG 11 55.755 0.861 0.861
77 2HH2 ARG 11 HH1 ARG 11 54.265 1.606 1.606
78 H ALA 12 HN ALA 12 55.242 -2.764 -2.764
79 HA ALA 12 HA ALA 12 53.226 -2.372 -2.372
80 1HB ALA 12 HB2 ALA 12 53.491 -3.557 -3.557
81 2HB ALA 12 HB1 ALA 12 53.335 -4.972 -4.972
82 3HB ALA 12 HB3 ALA 12 52.071 -3.742 -3.742
83 H PHE 13 HN PHE 13 56.140 -4.158 -4.158
84 HA PHE 13 HA PHE 13 55.595 -6.430 -6.430
85 1HB PHE 13 HB2 PHE 13 57.834 -5.875 -5.875
86 2HB PHE 13 HB1 PHE 13 57.732 -4.297 -4.297
87 HD1 PHE 13 HD1 PHE 13 56.890 -7.788 -7.788
88 HD2 PHE 13 HD2 PHE 13 59.129 -4.204 -4.204
89 HE1 PHE 13 HE1 PHE 13 57.750 -8.774 -8.774
90 HE2 PHE 13 HE2 PHE 13 59.990 -5.189 -5.189
91 HZ PHE 13 HZ PHE 13 59.300 -7.476 -7.476
92 H LEU 14 HN LEU 14 55.671 -3.054 -3.054
93 HA LEU 14 HA LEU 14 54.298 -3.970 -3.970
94 1HB LEU 14 HB2 LEU 14 55.604 -1.923 -1.923
95 2HB LEU 14 HB1 LEU 14 56.488 -3.420 -3.420
96 HG LEU 14 HG LEU 14 57.267 -2.561 -2.561
97 HD1 LEU 14 HD1 LEU 14 56.834 -0.104 -0.104
98 HD1 LEU 14 HD1 LEU 14 55.596 -0.160 -0.160
99 HD1 LEU 14 HD1 LEU 14 55.435 -1.160 -1.160
100 HD2 LEU 14 HD2 LEU 14 58.261 -0.276 -0.276
101 HD2 LEU 14 HD2 LEU 14 58.943 -1.890 -1.890
102 HD2 LEU 14 HD2 LEU 14 57.815 -1.260 -1.260
103 H SER 15 HN SER 15 53.432 -1.746 -1.746
104 HA SER 15 HA SER 15 51.575 -0.599 -0.599
105 1HB SER 15 HB2 SER 15 51.801 -0.974 -0.974
106 2HB SER 15 HB1 SER 15 51.095 0.574 0.574
107 HG SER 15 HG SER 15 49.619 -1.281 -1.281
108 H GLU 16 HN GLU 16 51.256 1.791 1.791
109 HA GLU 16 HA GLU 16 53.561 3.273 3.273
110 1HB GLU 16 HB2 GLU 16 51.401 4.016 4.016
111 2HB GLU 16 HB1 GLU 16 50.792 4.022 4.022
112 1HG GLU 16 HG2 GLU 16 51.582 6.103 6.103
113 2HG GLU 16 HG1 GLU 16 53.153 5.714 5.714
114 H GLU 17 HN GLU 17 52.024 2.743 2.743
115 HA GLU 17 HA GLU 17 53.038 4.748 4.748
116 1HB GLU 17 HB2 GLU 17 53.141 2.922 2.922
117 2HB GLU 17 HB1 GLU 17 51.645 2.931 2.931
118 1HG GLU 17 HG2 GLU 17 52.836 1.252 1.252
119 2HG GLU 17 HG1 GLU 17 53.997 1.059 1.059
120 H MET 18 HN MET 18 54.817 1.906 1.906
121 HA MET 18 HA MET 18 57.302 2.698 2.698
122 1HB MET 18 HB2 MET 18 56.428 0.342 0.342
123 2HB MET 18 HB1 MET 18 56.908 0.673 0.673
124 1HG MET 18 HG2 MET 18 59.079 0.297 0.297
125 2HG MET 18 HG1 MET 18 59.024 1.394 1.394
126 1HE MET 18 HE3 MET 18 59.204 0.783 0.783
127 2HE MET 18 HE2 MET 18 57.454 0.592 0.592
128 3HE MET 18 HE1 MET 18 58.431 -0.613 -0.613
129 H ILE 19 HN ILE 19 56.153 2.530 2.530
130 HA ILE 19 HA ILE 19 58.365 3.421 3.421
131 HB ILE 19 HB ILE 19 55.429 4.141 4.141
132 1HG1 ILE 19 HG12 ILE 19 56.961 2.347 2.347
133 2HG1 ILE 19 HG11 ILE 19 56.483 1.728 1.728
134 1HG2 ILE 19 HG23 ILE 19 57.665 5.307 5.307
135 2HG2 ILE 19 HG22 ILE 19 56.740 4.332 4.332
136 3HG2 ILE 19 HG21 ILE 19 55.947 5.622 5.622
137 HD1 ILE 19 HD1 ILE 19 54.310 3.166 3.166
138 HD1 ILE 19 HD1 ILE 19 54.320 1.545 1.545
139 HD1 ILE 19 HD1 ILE 19 54.879 1.802 1.802
140 H ALA 20 HN ALA 20 56.124 5.411 5.411
141 HA ALA 20 HA ALA 20 57.334 7.949 7.949
142 1HB ALA 20 HB2 ALA 20 55.180 6.864 6.864
143 2HB ALA 20 HB1 ALA 20 56.074 8.036 8.036
144 3HB ALA 20 HB3 ALA 20 55.387 8.516 8.516
145 H GLU 21 HN GLU 21 58.059 5.440 5.440
146 HA GLU 21 HA GLU 21 59.666 7.054 7.054
147 1HB GLU 21 HB2 GLU 21 58.725 4.983 4.983
148 2HB GLU 21 HB1 GLU 21 59.405 4.098 4.098
149 1HG GLU 21 HG2 GLU 21 61.374 3.801 3.801
150 2HG GLU 21 HG1 GLU 21 61.466 5.507 5.507
151 H PHE 22 HN PHE 22 60.558 4.673 4.673
152 HA PHE 22 HA PHE 22 63.372 5.198 5.198
153 1HB PHE 22 HB2 PHE 22 61.610 4.230 4.230
154 2HB PHE 22 HB1 PHE 22 63.348 3.979 3.979
155 HD1 PHE 22 HD2 PHE 22 62.613 3.781 3.781
156 HD2 PHE 22 HD1 PHE 22 61.702 1.628 1.628
157 HE1 PHE 22 HE2 PHE 22 62.211 1.726 1.726
158 HE2 PHE 22 HE1 PHE 22 61.301 -0.426 -0.426
159 HZ PHE 22 HZ PHE 22 61.555 -0.378 -0.378
160 H LYS 23 HN LYS 23 60.722 6.678 6.678
161 HA LYS 23 HA LYS 23 61.990 8.139 8.139
162 1HB LYS 23 HB2 LYS 23 59.533 8.072 8.072
163 2HB LYS 23 HB1 LYS 23 60.071 9.541 9.541
164 1HG LYS 23 HG2 LYS 23 58.971 10.004 10.004
165 2HG LYS 23 HG1 LYS 23 60.641 10.569 10.569
166 1HD LYS 23 HD2 LYS 23 61.411 8.855 8.855
167 2HD LYS 23 HD1 LYS 23 60.041 7.806 7.806
168 1HE LYS 23 HE2 LYS 23 58.893 10.111 10.111
169 2HE LYS 23 HE1 LYS 23 60.305 9.742 9.742
170 1HZ LYS 23 HZ1 LYS 23 59.552 7.352 7.352
171 2HZ LYS 23 HZ3 LYS 23 58.081 7.933 7.933
172 3HZ LYS 23 HZ2 LYS 23 58.585 8.376 8.376
173 H ALA 24 HN ALA 24 61.454 9.483 9.483
174 HA ALA 24 HA ALA 24 63.184 11.712 11.712
175 1HB ALA 24 HB2 ALA 24 61.553 10.478 10.478
176 2HB ALA 24 HB1 ALA 24 63.153 10.561 10.561
177 3HB ALA 24 HB3 ALA 24 62.373 12.032 12.032
178 H ALA 25 HN ALA 25 63.870 8.351 8.351
179 HA ALA 25 HA ALA 25 66.592 8.798 8.798
180 1HB ALA 25 HB3 ALA 25 64.720 6.592 6.592
181 2HB ALA 25 HB2 ALA 25 66.410 6.179 6.179
182 3HB ALA 25 HB1 ALA 25 65.907 6.756 6.756
183 H PHE 26 HN PHE 26 65.198 7.569 7.569
184 HA PHE 26 HA PHE 26 67.644 7.220 7.220
185 1HB PHE 26 HB2 PHE 26 65.349 6.426 6.426
186 2HB PHE 26 HB1 PHE 26 64.931 8.088 8.088
187 HD1 PHE 26 HD1 PHE 26 66.039 9.228 9.228
188 HD2 PHE 26 HD2 PHE 26 66.810 5.103 5.103
189 HE1 PHE 26 HE1 PHE 26 67.060 8.923 8.923
190 HE2 PHE 26 HE2 PHE 26 67.832 4.798 4.798
191 HZ PHE 26 HZ PHE 26 67.957 6.708 6.708
192 H ASP 27 HN ASP 27 65.620 10.100 10.100
193 HA ASP 27 HA ASP 27 67.032 11.789 11.789
194 1HB ASP 27 HB2 ASP 27 65.018 12.017 12.017
195 2HB ASP 27 HB1 ASP 27 65.884 13.495 13.495
196 H MET 28 HN MET 28 68.023 10.438 10.438
197 HA MET 28 HA MET 28 69.435 12.612 12.612
198 1HB MET 28 HB2 MET 28 69.813 9.601 9.601
199 2HB MET 28 HB1 MET 28 70.661 10.684 10.684
200 1HG MET 28 HG2 MET 28 67.645 10.645 10.645
201 2HG MET 28 HG1 MET 28 68.520 9.619 9.619
202 1HE MET 28 HE3 MET 28 69.561 10.202 10.202
203 2HE MET 28 HE2 MET 28 69.060 11.604 11.604
204 3HE MET 28 HE1 MET 28 67.846 10.490 10.490
205 H PHE 29 HN PHE 29 70.014 10.910 10.910
206 HA PHE 29 HA PHE 29 72.842 11.922 11.922
207 1HB PHE 29 HB2 PHE 29 71.934 9.553 9.553
208 2HB PHE 29 HB1 PHE 29 73.528 9.897 9.897
209 HD1 PHE 29 HD1 PHE 29 74.020 9.465 9.465
210 HD2 PHE 29 HD2 PHE 29 70.192 8.528 8.528
211 HE1 PHE 29 HE1 PHE 29 73.470 8.082 8.082
212 HE2 PHE 29 HE2 PHE 29 69.644 7.147 7.147
213 HZ PHE 29 HZ PHE 29 71.283 6.921 6.921
214 H ASP 30 HN ASP 30 69.869 12.539 12.539
215 HA ASP 30 HA ASP 30 70.177 12.610 12.610
216 1HB ASP 30 HB2 ASP 30 68.311 13.352 13.352
217 2HB ASP 30 HB1 ASP 30 68.504 14.726 14.726
218 H ALA 31 HN ALA 31 72.429 13.477 13.477
219 HA ALA 31 HA ALA 31 73.343 15.968 15.968
220 1HB ALA 31 HB3 ALA 31 73.880 14.103 14.103
221 2HB ALA 31 HB2 ALA 31 74.484 15.745 15.745
222 3HB ALA 31 HB1 ALA 31 74.998 14.800 14.800
223 H ASP 32 HN ASP 32 70.976 15.272 15.272
224 HA ASP 32 HA ASP 32 70.832 18.201 18.201
225 1HB ASP 32 HB2 ASP 32 71.609 16.249 16.249
226 2HB ASP 32 HB1 ASP 32 69.865 16.146 16.146
227 H GLY 33 HN GLY 33 69.079 15.190 15.190
228 1HA GLY 33 HA2 GLY 33 66.950 15.132 15.132
229 2HA GLY 33 HA1 GLY 33 66.667 16.799 16.799
230 H GLY 34 HN GLY 34 67.792 14.266 14.266
231 1HA GLY 34 HA2 GLY 34 65.375 14.723 14.723
232 2HA GLY 34 HA1 GLY 34 66.843 13.899 13.899
233 H GLY 35 HN GLY 35 65.888 12.870 12.870
234 1HA GLY 35 HA2 GLY 35 64.637 10.999 10.999
235 2HA GLY 35 HA1 GLY 35 64.000 10.818 10.818
236 H ASP 36 HN ASP 36 67.438 11.097 11.097
237 HA ASP 36 HA ASP 36 67.901 8.194 8.194
238 1HB ASP 36 HB2 ASP 36 69.063 8.379 8.379
239 2HB ASP 36 HB1 ASP 36 67.299 8.368 8.368
240 H ILE 37 HN ILE 37 69.753 8.007 8.007
241 HA ILE 37 HA ILE 37 71.632 10.304 10.304
242 HB ILE 37 HB ILE 37 72.413 9.169 9.169
243 1HG1 ILE 37 HG12 ILE 37 70.822 6.834 6.834
244 2HG1 ILE 37 HG11 ILE 37 72.556 6.895 6.895
245 1HG2 ILE 37 HG22 ILE 37 69.407 8.955 8.955
246 2HG2 ILE 37 HG21 ILE 37 70.232 8.821 8.821
247 3HG2 ILE 37 HG23 ILE 37 70.303 10.331 10.331
248 HD1 ILE 37 HD1 ILE 37 70.428 7.187 7.187
249 HD1 ILE 37 HD1 ILE 37 72.169 7.073 7.073
250 HD1 ILE 37 HD1 ILE 37 71.275 5.683 5.683
251 H SER 38 HN SER 38 74.053 9.463 9.463
252 HA SER 38 HA SER 38 74.915 8.445 8.445
253 1HB SER 38 HB2 SER 38 76.994 7.990 7.990
254 2HB SER 38 HB1 SER 38 76.620 9.561 9.561
255 HG SER 38 HG SER 38 76.402 10.110 10.110
256 H THR 39 HN THR 39 75.207 6.357 6.357
257 HA THR 39 HA THR 39 74.045 4.099 4.099
258 HB THR 39 HB THR 39 75.880 2.924 2.924
259 HG1 THR 39 HG1 THR 39 77.246 4.816 4.816
260 1HG2 THR 39 HG23 THR 39 73.718 4.810 4.810
261 2HG2 THR 39 HG22 THR 39 74.751 4.083 4.083
262 3HG2 THR 39 HG21 THR 39 73.800 3.055 3.055
263 H LYS 40 HN LYS 40 77.189 5.544 5.544
264 HA LYS 40 HA LYS 40 78.315 3.301 3.301
265 1HB LYS 40 HB2 LYS 40 78.839 6.286 6.286
266 2HB LYS 40 HB1 LYS 40 79.859 5.153 5.153
267 1HG LYS 40 HG2 LYS 40 80.513 4.022 4.022
268 2HG LYS 40 HG1 LYS 40 79.227 4.776 4.776
269 1HD LYS 40 HD2 LYS 40 80.295 6.933 6.933
270 2HD LYS 40 HD1 LYS 40 81.478 6.337 6.337
271 1HE LYS 40 HE2 LYS 40 81.611 4.609 4.609
272 2HE LYS 40 HE1 LYS 40 81.642 6.278 6.278
273 1HZ LYS 40 HZ2 LYS 40 83.216 6.669 6.669
274 2HZ LYS 40 HZ1 LYS 40 83.439 4.985 4.985
275 3HZ LYS 40 HZ3 LYS 40 83.839 5.917 5.917
276 H GLU 41 HN GLU 41 75.781 5.431 5.431
277 HA GLU 41 HA GLU 41 76.269 5.367 5.367
278 1HB GLU 41 HB2 GLU 41 75.454 7.363 7.363
279 2HB GLU 41 HB1 GLU 41 73.905 6.523 6.523
280 1HG GLU 41 HG2 GLU 41 73.830 8.052 8.052
281 2HG GLU 41 HG1 GLU 41 73.968 6.420 6.420
282 H LEU 42 HN LEU 42 74.523 3.640 3.640
283 HA LEU 42 HA LEU 42 72.182 2.729 2.729
284 1HB LEU 42 HB2 LEU 42 73.900 1.983 1.983
285 2HB LEU 42 HB1 LEU 42 73.909 0.560 0.560
286 HG LEU 42 HG LEU 42 71.310 0.876 0.876
287 HD1 LEU 42 HD1 LEU 42 70.838 1.732 1.732
288 HD1 LEU 42 HD1 LEU 42 72.249 2.723 2.723
289 HD1 LEU 42 HD1 LEU 42 70.813 2.819 2.819
290 HD2 LEU 42 HD2 LEU 42 71.209 -0.395 -0.395
291 HD2 LEU 42 HD2 LEU 42 72.266 -1.079 -1.079
292 HD2 LEU 42 HD2 LEU 42 72.953 -0.155 -0.155
293 H GLY 43 HN GLY 43 75.471 1.823 1.823
294 1HA GLY 43 HA2 GLY 43 74.673 -0.257 -0.257
295 2HA GLY 43 HA1 GLY 43 76.237 0.562 0.562
296 H THR 44 HN THR 44 75.221 3.230 3.230
297 HA THR 44 HA THR 44 74.910 3.281 3.281
298 HB THR 44 HB THR 44 74.709 5.367 5.367
299 HG1 THR 44 HG1 THR 44 76.810 5.873 5.873
300 1HG2 THR 44 HG21 THR 44 73.505 6.005 6.005
301 2HG2 THR 44 HG23 THR 44 75.027 5.803 5.803
302 3HG2 THR 44 HG22 THR 44 74.878 7.045 7.045
303 H VAL 45 HN VAL 45 72.767 4.403 4.403
304 HA VAL 45 HA VAL 45 70.487 5.057 5.057
305 HB VAL 45 HB VAL 45 70.806 5.359 5.359
306 1HG1 VAL 45 HG12 VAL 45 71.897 3.102 3.102
307 2HG1 VAL 45 HG11 VAL 45 70.291 2.380 2.380
308 3HG1 VAL 45 HG13 VAL 45 70.678 3.495 3.495
309 1HG2 VAL 45 HG23 VAL 45 68.483 5.133 5.133
310 2HG2 VAL 45 HG22 VAL 45 68.552 5.004 5.004
311 3HG2 VAL 45 HG21 VAL 45 68.417 3.548 3.548
312 H MET 46 HN MET 46 71.472 1.824 1.824
313 HA MET 46 HA MET 46 69.158 0.423 0.423
314 1HB MET 46 HB2 MET 46 71.983 -0.271 -0.271
315 2HB MET 46 HB1 MET 46 70.900 -1.516 -1.516
316 1HG MET 46 HG2 MET 46 69.353 -1.217 -1.217
317 2HG MET 46 HG1 MET 46 70.087 0.312 0.312
318 1HE MET 46 HE2 MET 46 69.684 -3.104 -3.104
319 2HE MET 46 HE1 MET 46 69.981 -3.209 -3.209
320 3HE MET 46 HE3 MET 46 71.116 -3.943 -3.943
321 H ARG 47 HN ARG 47 72.476 0.690 0.690
322 HA ARG 47 HA ARG 47 71.834 -0.629 -0.629
323 1HB ARG 47 HB2 ARG 47 74.058 0.686 0.686
324 2HB ARG 47 HB1 ARG 47 74.029 1.081 1.081
325 1HG ARG 47 HG2 ARG 47 73.454 -1.733 -1.733
326 2HG ARG 47 HG1 ARG 47 75.000 -1.284 -1.284
327 1HD ARG 47 HD2 ARG 47 75.751 -1.651 -1.651
328 2HD ARG 47 HD1 ARG 47 75.194 0.019 0.019
329 HE ARG 47 HE ARG 47 72.922 -1.600 -1.600
330 1HH1 ARG 47 HH1 ARG 47 74.977 -3.458 -3.458
331 2HH1 ARG 47 HH1 ARG 47 74.937 -2.967 -2.967
332 1HH2 ARG 47 HH2 ARG 47 73.313 0.027 0.027
333 2HH2 ARG 47 HH2 ARG 47 73.996 -0.994 -0.994
334 H MET 48 HN MET 48 72.230 2.832 2.832
335 HA MET 48 HA MET 48 71.716 3.953 3.953
336 1HB MET 48 HB2 MET 48 72.491 5.050 5.050
337 2HB MET 48 HB1 MET 48 70.811 5.020 5.020
338 1HG MET 48 HG2 MET 48 70.363 6.871 6.871
339 2HG MET 48 HG1 MET 48 70.926 6.084 6.084
340 1HE MET 48 HE1 MET 48 73.366 5.318 5.318
341 2HE MET 48 HE3 MET 48 74.713 6.451 6.451
342 3HE MET 48 HE2 MET 48 73.540 6.666 6.666
343 H LEU 49 HN LEU 49 69.574 2.273 2.273
344 HA LEU 49 HA LEU 49 67.110 3.489 3.489
345 1HB LEU 49 HB2 LEU 49 67.956 1.431 1.431
346 2HB LEU 49 HB1 LEU 49 66.319 1.293 1.293
347 HG LEU 49 HG LEU 49 67.377 3.925 3.925
348 HD1 LEU 49 HD1 LEU 49 67.493 1.984 1.984
349 HD1 LEU 49 HD1 LEU 49 66.631 3.446 3.446
350 HD1 LEU 49 HD1 LEU 49 65.731 2.024 2.024
351 HD2 LEU 49 HD2 LEU 49 64.893 2.889 2.889
352 HD2 LEU 49 HD2 LEU 49 64.635 3.584 3.584
353 HD2 LEU 49 HD2 LEU 49 65.355 4.561 4.561
354 H GLY 50 HN GLY 50 69.146 0.723 0.723
355 1HA GLY 50 HA2 GLY 50 68.805 -0.029 -0.029
356 2HA GLY 50 HA1 GLY 50 67.104 -0.190 -0.190
357 H GLN 51 HN GLN 51 69.118 -1.040 -1.040
358 HA GLN 51 HA GLN 51 68.659 -3.936 -3.936
359 1HB GLN 51 HB2 GLN 51 69.194 -2.531 -2.531
360 2HB GLN 51 HB1 GLN 51 68.660 -4.198 -4.198
361 1HG GLN 51 HG2 GLN 51 67.117 -1.666 -1.666
362 2HG GLN 51 HG1 GLN 51 66.688 -2.967 -2.967
363 1HE2 GLN 51 HE22 GLN 51 65.318 -3.191 -3.191
364 2HE2 GLN 51 HE21 GLN 51 65.843 -1.763 -1.763
365 H ASN 52 HN ASN 52 70.446 -5.047 -5.047
366 HA ASN 52 HA ASN 52 73.136 -3.920 -3.920
367 1HB ASN 52 HB2 ASN 52 71.931 -5.690 -5.690
368 2HB ASN 52 HB1 ASN 52 72.966 -6.728 -6.728
369 HD2 ASN 52 HD2 ASN 52 73.586 -6.229 -6.229
370 HD2 ASN 52 HD2 ASN 52 75.005 -5.300 -5.300
371 HA PRO 53 HA PRO 53 72.656 -6.200 -6.200
372 1HB PRO 53 HB2 PRO 53 73.880 -4.278 -4.278
373 2HB PRO 53 HB1 PRO 53 72.146 -4.252 -4.252
374 1HG PRO 53 HG2 PRO 53 74.378 -2.721 -2.721
375 2HG PRO 53 HG1 PRO 53 72.728 -2.202 -2.202
376 1HD PRO 53 HD2 PRO 53 73.543 -2.880 -2.880
377 2HD PRO 53 HD1 PRO 53 71.868 -3.057 -3.057
378 H THR 54 HN THR 54 74.245 -7.695 -7.695
379 HA THR 54 HA THR 54 76.820 -7.675 -7.675
380 HB THR 54 HB THR 54 77.173 -9.397 -9.397
381 HG1 THR 54 HG1 THR 54 74.930 -10.054 -10.054
382 1HG2 THR 54 HG22 THR 54 75.700 -9.456 -9.456
383 2HG2 THR 54 HG21 THR 54 75.079 -10.647 -10.647
384 3HG2 THR 54 HG23 THR 54 76.783 -10.667 -10.667
385 H LYS 55 HN LYS 55 78.824 -6.938 -6.938
386 HA LYS 55 HA LYS 55 79.044 -4.747 -4.747
387 1HB LYS 55 HB2 LYS 55 80.658 -5.993 -5.993
388 2HB LYS 55 HB1 LYS 55 81.278 -6.727 -6.727
389 1HG LYS 55 HG2 LYS 55 82.244 -4.794 -4.794
390 2HG LYS 55 HG1 LYS 55 80.867 -3.816 -3.816
391 1HD LYS 55 HD2 LYS 55 82.411 -5.006 -5.006
392 2HD LYS 55 HD1 LYS 55 83.299 -3.820 -3.820
393 1HE LYS 55 HE2 LYS 55 80.503 -3.255 -3.255
394 2HE LYS 55 HE1 LYS 55 81.949 -2.876 -2.876
395 1HZ LYS 55 HZ1 LYS 55 82.746 -1.906 -1.906
396 2HZ LYS 55 HZ3 LYS 55 81.081 -1.762 -1.762
397 3HZ LYS 55 HZ2 LYS 55 81.781 -0.977 -0.977
398 H GLU 56 HN GLU 56 79.906 -8.157 -8.157
399 HA GLU 56 HA GLU 56 80.563 -7.902 -7.902
400 1HB GLU 56 HB2 GLU 56 79.330 -9.992 -9.992
401 2HB GLU 56 HB1 GLU 56 79.338 -10.285 -10.285
402 1HG GLU 56 HG2 GLU 56 81.755 -9.662 -9.662
403 2HG GLU 56 HG1 GLU 56 81.369 -11.220 -11.220
404 H GLU 57 HN GLU 57 77.324 -8.127 -8.127
405 HA GLU 57 HA GLU 57 75.833 -8.275 -8.275
406 1HB GLU 57 HB2 GLU 57 75.404 -7.710 -7.710
407 2HB GLU 57 HB1 GLU 57 74.180 -7.046 -7.046
408 1HG GLU 57 HG2 GLU 57 75.060 -9.872 -9.872
409 2HG GLU 57 HG1 GLU 57 73.983 -9.534 -9.534
410 H LEU 58 HN LEU 58 76.458 -5.466 -5.466
411 HA LEU 58 HA LEU 58 75.306 -3.420 -3.420
412 1HB LEU 58 HB2 LEU 58 77.948 -3.474 -3.474
413 2HB LEU 58 HB1 LEU 58 77.067 -2.007 -2.007
414 HG LEU 58 HG LEU 58 76.175 -4.222 -4.222
415 HD1 LEU 58 HD1 LEU 58 75.827 -2.079 -2.079
416 HD1 LEU 58 HD1 LEU 58 76.894 -1.309 -1.309
417 HD1 LEU 58 HD1 LEU 58 77.469 -2.681 -2.681
418 HD2 LEU 58 HD2 LEU 58 74.136 -2.570 -2.570
419 HD2 LEU 58 HD2 LEU 58 74.172 -3.746 -3.746
420 HD2 LEU 58 HD2 LEU 58 74.626 -2.069 -2.069
421 H ASP 59 HN ASP 59 78.707 -4.530 -4.530
422 HA ASP 59 HA ASP 59 79.428 -2.944 -2.944
423 1HB ASP 59 HB2 ASP 59 80.654 -4.705 -4.705
424 2HB ASP 59 HB1 ASP 59 80.414 -5.755 -5.755
425 H ALA 60 HN ALA 60 77.712 -6.043 -6.043
426 HA ALA 60 HA ALA 60 77.716 -6.455 -6.455
427 1HB ALA 60 HB3 ALA 60 76.450 -7.692 -7.692
428 2HB ALA 60 HB2 ALA 60 75.907 -8.172 -8.172
429 3HB ALA 60 HB1 ALA 60 77.590 -8.409 -8.409
430 H ILE 61 HN ILE 61 75.369 -5.295 -5.295
431 HA ILE 61 HA ILE 61 73.167 -4.959 -4.959
432 HB ILE 61 HB ILE 61 73.885 -3.564 -3.564
433 1HG1 ILE 61 HG12 ILE 61 72.100 -5.969 -5.969
434 2HG1 ILE 61 HG11 ILE 61 73.782 -6.094 -6.094
435 1HG2 ILE 61 HG22 ILE 61 72.109 -2.417 -2.417
436 2HG2 ILE 61 HG21 ILE 61 71.203 -3.928 -3.928
437 3HG2 ILE 61 HG23 ILE 61 71.475 -3.131 -3.131
438 HD1 ILE 61 HD1 ILE 61 73.346 -5.022 -5.022
439 HD1 ILE 61 HD1 ILE 61 71.988 -6.126 -6.126
440 HD1 ILE 61 HD1 ILE 61 71.790 -4.406 -4.406
441 H ILE 62 HN ILE 62 75.535 -2.591 -2.591
442 HA ILE 62 HA ILE 62 74.669 -0.284 -0.284
443 HB ILE 62 HB ILE 62 77.398 -1.368 -1.368
444 1HG1 ILE 62 HG12 ILE 62 75.944 1.004 1.004
445 2HG1 ILE 62 HG11 ILE 62 75.574 -0.635 -0.635
446 1HG2 ILE 62 HG22 ILE 62 76.698 0.954 0.954
447 2HG2 ILE 62 HG21 ILE 62 77.691 1.370 1.370
448 3HG2 ILE 62 HG23 ILE 62 78.263 0.174 0.174
449 HD1 ILE 62 HD1 ILE 62 78.254 -0.750 -0.750
450 HD1 ILE 62 HD1 ILE 62 77.263 -0.172 -0.172
451 HD1 ILE 62 HD1 ILE 62 78.042 0.982 0.982
452 H GLU 63 HN GLU 63 77.328 -2.380 -2.380
453 HA GLU 63 HA GLU 63 77.540 -1.375 -1.375
454 1HB GLU 63 HB2 GLU 63 78.434 -3.574 -3.574
455 2HB GLU 63 HB1 GLU 63 77.732 -4.271 -4.271
456 1HG GLU 63 HG2 GLU 63 79.085 -2.520 -2.520
457 2HG GLU 63 HG1 GLU 63 79.959 -2.239 -2.239
458 H GLU 64 HN GLU 64 75.194 -3.682 -3.682
459 HA GLU 64 HA GLU 64 73.975 -4.426 -4.426
460 1HB GLU 64 HB2 GLU 64 73.519 -5.862 -5.862
461 2HB GLU 64 HB1 GLU 64 73.357 -4.542 -4.542
462 1HG GLU 64 HG2 GLU 64 71.179 -3.959 -3.959
463 2HG GLU 64 HG1 GLU 64 71.360 -5.069 -5.069
464 H VAL 65 HN VAL 65 73.191 -1.947 -1.947
465 HA VAL 65 HA VAL 65 71.003 -0.871 -0.871
466 HB VAL 65 HB VAL 65 70.662 0.568 0.568
467 1HG1 VAL 65 HG12 VAL 65 70.283 -2.083 -2.083
468 2HG1 VAL 65 HG11 VAL 65 71.460 -1.995 -1.995
469 3HG1 VAL 65 HG13 VAL 65 69.945 -1.100 -1.100
470 1HG2 VAL 65 HG21 VAL 65 73.169 0.916 0.916
471 2HG2 VAL 65 HG23 VAL 65 72.230 0.691 0.691
472 3HG2 VAL 65 HG22 VAL 65 73.183 -0.642 -0.642
473 H ASP 66 HN ASP 66 74.352 -0.532 -0.532
474 HA ASP 66 HA ASP 66 74.435 2.357 2.357
475 1HB ASP 66 HB2 ASP 66 76.109 1.049 1.049
476 2HB ASP 66 HB1 ASP 66 76.625 0.266 0.266
477 H GLU 67 HN GLU 67 73.881 -0.507 -0.507
478 HA GLU 67 HA GLU 67 75.319 -0.064 -0.064
479 1HB GLU 67 HB2 GLU 67 73.718 -1.687 -1.687
480 2HB GLU 67 HB1 GLU 67 74.160 -2.153 -2.153
481 1HG GLU 67 HG2 GLU 67 72.115 -1.321 -1.321
482 2HG GLU 67 HG1 GLU 67 71.733 -0.450 -0.450
483 H ASP 68 HN ASP 68 72.764 1.713 1.713
484 HA ASP 68 HA ASP 68 71.276 2.507 2.507
485 1HB ASP 68 HB2 ASP 68 71.015 2.805 2.805
486 2HB ASP 68 HB1 ASP 68 71.760 4.365 4.365
487 H GLY 69 HN GLY 69 74.110 3.970 3.970
488 1HA GLY 69 HA2 GLY 69 75.859 4.940 4.940
489 2HA GLY 69 HA1 GLY 69 74.538 5.587 5.587
490 H SER 70 HN SER 70 73.270 5.992 5.992
491 HA SER 70 HA SER 70 74.215 8.793 8.793
492 1HB SER 70 HB2 SER 70 71.848 7.178 7.178
493 2HB SER 70 HB1 SER 70 72.261 8.356 8.356
494 HG SER 70 HG SER 70 71.044 8.781 8.781
495 H GLY 71 HN GLY 71 74.427 5.745 5.745
496 1HA GLY 71 HA2 GLY 71 75.972 5.196 5.196
497 2HA GLY 71 HA1 GLY 71 76.430 6.897 6.897
498 H THR 72 HN THR 72 73.062 6.456 6.456
499 HA THR 72 HA THR 72 73.011 6.595 6.595
500 HB THR 72 HB THR 72 71.173 8.274 8.274
501 HG1 THR 72 HG1 THR 72 70.544 8.750 8.750
502 1HG2 THR 72 HG21 THR 72 73.956 8.598 8.598
503 2HG2 THR 72 HG23 THR 72 73.229 9.610 9.610
504 3HG2 THR 72 HG22 THR 72 72.781 9.837 9.837
505 H ILE 73 HN ILE 73 70.848 5.962 5.962
506 HA ILE 73 HA ILE 73 69.550 3.874 3.874
507 HB ILE 73 HB ILE 73 70.705 3.018 3.018
508 1HG1 ILE 73 HG12 ILE 73 68.404 2.490 2.490
509 2HG1 ILE 73 HG11 ILE 73 67.753 2.985 2.985
510 1HG2 ILE 73 HG21 ILE 73 69.319 5.330 5.330
511 2HG2 ILE 73 HG23 ILE 73 69.589 3.884 3.884
512 3HG2 ILE 73 HG22 ILE 73 70.957 4.725 4.725
513 HD1 ILE 73 HD1 ILE 73 68.291 0.976 0.976
514 HD1 ILE 73 HD1 ILE 73 68.976 0.492 0.492
515 HD1 ILE 73 HD1 ILE 73 69.990 1.292 1.292
516 H ASP 74 HN ASP 74 67.253 3.837 3.837
517 HA ASP 74 HA ASP 74 65.931 6.395 6.395
518 1HB ASP 74 HB2 ASP 74 64.870 3.856 3.856
519 2HB ASP 74 HB1 ASP 74 64.148 5.463 5.463
520 H PHE 75 HN PHE 75 64.631 6.670 6.670
521 HA PHE 75 HA PHE 75 64.496 5.033 5.033
522 1HB PHE 75 HB2 PHE 75 63.596 7.387 7.387
523 2HB PHE 75 HB1 PHE 75 62.156 6.631 6.631
524 HD1 PHE 75 HD2 PHE 75 60.816 5.019 5.019
525 HD2 PHE 75 HD1 PHE 75 63.916 7.522 7.522
526 HE1 PHE 75 HE2 PHE 75 59.916 4.670 4.670
527 HE2 PHE 75 HE1 PHE 75 63.015 7.173 7.173
528 HZ PHE 75 HZ PHE 75 61.016 5.746 5.746
529 H GLU 76 HN GLU 76 61.983 5.090 5.090
530 HA GLU 76 HA GLU 76 60.406 2.944 2.944
531 1HB GLU 76 HB2 GLU 76 61.065 4.222 4.222
532 2HB GLU 76 HB1 GLU 76 60.152 2.713 2.713
533 1HG GLU 76 HG2 GLU 76 58.824 4.046 4.046
534 2HG GLU 76 HG1 GLU 76 59.330 5.396 5.396
535 H GLU 77 HN GLU 77 62.961 2.726 2.726
536 HA GLU 77 HA GLU 77 63.035 -0.138 -0.138
537 1HB GLU 77 HB2 GLU 77 63.873 1.287 1.287
538 2HB GLU 77 HB1 GLU 77 65.067 2.001 2.001
539 1HG GLU 77 HG2 GLU 77 66.508 0.331 0.331
540 2HG GLU 77 HG1 GLU 77 65.315 -0.862 -0.862
541 H PHE 78 HN PHE 78 64.398 2.192 2.192
542 HA PHE 78 HA PHE 78 66.556 0.534 0.534
543 1HB PHE 78 HB2 PHE 78 66.638 2.933 2.933
544 2HB PHE 78 HB1 PHE 78 65.060 2.979 2.979
545 HD1 PHE 78 HD1 PHE 78 68.502 1.560 1.560
546 HD2 PHE 78 HD2 PHE 78 64.910 2.918 2.918
547 HE1 PHE 78 HE1 PHE 78 69.592 1.306 1.306
548 HE2 PHE 78 HE2 PHE 78 66.000 2.666 2.666
549 HZ PHE 78 HZ PHE 78 68.340 1.860 1.860
550 H LEU 79 HN LEU 79 63.132 0.868 0.868
551 HA LEU 79 HA LEU 79 62.772 -0.028 -0.028
552 1HB LEU 79 HB2 LEU 79 61.419 -0.427 -0.427
553 2HB LEU 79 HB1 LEU 79 60.907 -1.498 -1.498
554 HG LEU 79 HG LEU 79 59.513 0.497 0.497
555 HD1 LEU 79 HD1 LEU 79 61.470 0.950 0.950
556 HD1 LEU 79 HD1 LEU 79 60.557 -0.557 -0.557
557 HD1 LEU 79 HD1 LEU 79 59.707 0.984 0.984
558 HD2 LEU 79 HD2 LEU 79 62.118 2.029 2.029
559 HD2 LEU 79 HD2 LEU 79 60.499 2.727 2.727
560 HD2 LEU 79 HD2 LEU 79 61.128 1.980 1.980
561 H VAL 80 HN VAL 80 63.307 -2.195 -2.195
562 HA VAL 80 HA VAL 80 63.318 -4.682 -4.682
563 HB VAL 80 HB VAL 80 65.057 -5.232 -5.232
564 1HG1 VAL 80 HG12 VAL 80 62.552 -3.672 -3.672
565 2HG1 VAL 80 HG11 VAL 80 63.553 -4.304 -4.304
566 3HG1 VAL 80 HG13 VAL 80 62.831 -5.408 -5.408
567 1HG2 VAL 80 HG23 VAL 80 65.161 -2.253 -2.253
568 2HG2 VAL 80 HG22 VAL 80 66.435 -3.424 -3.424
569 3HG2 VAL 80 HG21 VAL 80 65.230 -3.054 -3.054
570 H MET 81 HN MET 81 66.065 -2.391 -2.391
571 HA MET 81 HA MET 81 67.946 -3.998 -3.998
572 1HB MET 81 HB2 MET 81 67.554 -1.205 -1.205
573 2HB MET 81 HB1 MET 81 68.578 -1.375 -1.375
574 1HG MET 81 HG2 MET 81 69.787 -1.471 -1.471
575 2HG MET 81 HG1 MET 81 70.105 -2.812 -2.812
576 1HE MET 81 HE3 MET 81 70.054 -2.129 -2.129
577 2HE MET 81 HE2 MET 81 68.768 -2.974 -2.974
578 3HE MET 81 HE1 MET 81 68.384 -1.561 -1.561
579 H MET 82 HN MET 82 65.260 -2.019 -2.019
580 HA MET 82 HA MET 82 66.144 -2.002 -2.002
581 1HB MET 82 HB2 MET 82 63.457 -1.298 -1.298
582 2HB MET 82 HB1 MET 82 64.119 -0.724 -0.724
583 1HG MET 82 HG2 MET 82 65.800 0.573 0.573
584 2HG MET 82 HG1 MET 82 65.450 -0.188 -0.188
585 1HE MET 82 HE1 MET 82 63.724 1.365 1.365
586 2HE MET 82 HE3 MET 82 64.603 2.780 2.780
587 3HE MET 82 HE2 MET 82 62.842 2.754 2.754
588 H VAL 83 HN VAL 83 63.308 -3.348 -3.348
589 HA VAL 83 HA VAL 83 62.401 -4.989 -4.989
590 HB VAL 83 HB VAL 83 62.069 -5.139 -5.139
591 1HG1 VAL 83 HG11 VAL 83 61.118 -6.879 -6.879
592 2HG1 VAL 83 HG13 VAL 83 59.834 -6.288 -6.288
593 3HG1 VAL 83 HG12 VAL 83 61.190 -7.186 -7.186
594 1HG2 VAL 83 HG21 VAL 83 60.814 -3.610 -3.610
595 2HG2 VAL 83 HG23 VAL 83 60.960 -3.201 -3.201
596 3HG2 VAL 83 HG22 VAL 83 59.695 -4.307 -4.307
597 H ARG 84 HN ARG 84 63.991 -6.038 -6.038
598 HA ARG 84 HA ARG 84 64.486 -8.699 -8.699
599 1HB ARG 84 HB2 ARG 84 66.427 -6.687 -6.687
600 2HB ARG 84 HB1 ARG 84 66.433 -8.426 -8.426
601 1HG ARG 84 HG2 ARG 84 63.809 -7.229 -7.229
602 2HG ARG 84 HG1 ARG 84 65.065 -6.531 -6.531
603 1HD ARG 84 HD2 ARG 84 64.708 -9.527 -9.527
604 2HD ARG 84 HD1 ARG 84 63.948 -8.598 -8.598
605 HE ARG 84 HE ARG 84 66.486 -7.749 -7.749
606 1HH1 ARG 84 HH2 ARG 84 66.768 -10.440 -10.440
607 2HH1 ARG 84 HH2 ARG 84 67.396 -11.467 -11.467
608 1HH2 ARG 84 HH1 ARG 84 66.635 -9.264 -9.264
609 2HH2 ARG 84 HH1 ARG 84 67.319 -10.802 -10.802
610 H GLN 85 HN GLN 85 66.063 -5.906 -5.906
611 HA GLN 85 HA GLN 85 68.099 -7.560 -7.560
612 1HB GLN 85 HB2 GLN 85 68.561 -5.291 -5.291
613 2HB GLN 85 HB1 GLN 85 67.364 -4.620 -4.620
614 1HG GLN 85 HG2 GLN 85 69.758 -4.458 -4.458
615 2HG GLN 85 HG1 GLN 85 68.659 -5.279 -5.279
616 1HE2 GLN 85 HE22 GLN 85 70.887 -8.004 -8.004
617 2HE2 GLN 85 HE21 GLN 85 69.989 -6.861 -6.861
618 H MET 86 HN MET 86 65.228 -5.614 -5.614
619 HA MET 86 HA MET 86 65.362 -6.162 -6.162
620 1HB MET 86 HB2 MET 86 63.723 -4.761 -4.761
621 2HB MET 86 HB1 MET 86 62.698 -5.648 -5.648
622 1HG MET 86 HG2 MET 86 64.314 -4.650 -4.650
623 2HG MET 86 HG1 MET 86 64.681 -3.463 -3.463
624 1HE MET 86 HE3 MET 86 63.575 -3.666 -3.666
625 2HE MET 86 HE2 MET 86 62.607 -2.196 -2.196
626 3HE MET 86 HE1 MET 86 61.822 -3.765 -3.765
627 H LYS 87 HN LYS 87 64.204 -7.956 -7.956
628 HA LYS 87 HA LYS 87 62.207 -9.614 -9.614
629 1HB LYS 87 HB2 LYS 87 64.422 -9.847 -9.847
630 2HB LYS 87 HB1 LYS 87 63.593 -11.336 -11.336
631 1HG LYS 87 HG2 LYS 87 61.762 -9.097 -9.097
632 2HG LYS 87 HG1 LYS 87 62.714 -9.559 -9.559
633 1HD LYS 87 HD2 LYS 87 61.288 -11.274 -11.274
634 2HD LYS 87 HD1 LYS 87 61.914 -11.984 -11.984
635 1HE LYS 87 HE2 LYS 87 59.783 -11.770 -11.770
636 2HE LYS 87 HE1 LYS 87 60.148 -10.039 -10.039
637 1HZ LYS 87 HZ1 LYS 87 59.671 -10.198 -10.198
638 2HZ LYS 87 HZ3 LYS 87 58.665 -11.461 -11.461
639 3HZ LYS 87 HZ2 LYS 87 58.440 -9.892 -9.892
640 H GLU 88 HN GLU 88 65.610 -9.522 -9.522
641 HA GLU 88 HA GLU 88 65.437 -12.092 -12.092
642 1HB GLU 88 HB2 GLU 88 67.595 -10.214 -10.214
643 2HB GLU 88 HB1 GLU 88 67.948 -11.395 -11.395
644 1HG GLU 88 HG2 GLU 88 66.840 -13.109 -13.109
645 2HG GLU 88 HG1 GLU 88 67.134 -11.878 -11.878
646 H ASP 89 HN ASP 89 65.899 -8.607 -8.607
647 HA ASP 89 HA ASP 89 66.325 -8.875 -8.875
648 1HB ASP 89 HB2 ASP 89 67.091 -7.065 -7.065
649 2HB ASP 89 HB1 ASP 89 65.503 -6.362 -6.362
650 H ALA 90 HN ALA 90 63.602 -8.331 -8.331
651 HA ALA 90 HA ALA 90 61.770 -7.467 -7.467
652 1HB ALA 90 HB2 ALA 90 61.773 -6.963 -6.963
653 2HB ALA 90 HB1 ALA 90 61.064 -8.568 -8.568
654 3HB ALA 90 HB3 ALA 90 60.219 -7.331 -7.331
Start of MODEL 20
1 1H ALA 1 HT1 ALA 1 64.500 -3.926 -3.926
2 2H ALA 1 HT3 ALA 1 65.965 -3.597 -3.597
3 3H ALA 1 HT2 ALA 1 65.972 -4.127 -4.127
4 HA ALA 1 HA ALA 1 65.637 -6.298 -6.298
5 1HB ALA 1 HB3 ALA 1 66.806 -4.954 -4.954
6 2HB ALA 1 HB2 ALA 1 66.910 -6.685 -6.685
7 3HB ALA 1 HB1 ALA 1 67.698 -5.538 -5.538
8 H SER 2 HN SER 2 65.189 -7.612 -7.612
9 HA SER 2 HA SER 2 62.296 -7.222 -7.222
10 1HB SER 2 HB2 SER 2 63.533 -9.426 -9.426
11 2HB SER 2 HB1 SER 2 64.209 -9.129 -9.129
12 HG SER 2 HG SER 2 62.217 -10.408 -10.408
13 H MET 3 HN MET 3 65.149 -6.114 -6.114
14 HA MET 3 HA MET 3 64.505 -6.039 -6.039
15 1HB MET 3 HB2 MET 3 66.201 -4.639 -4.639
16 2HB MET 3 HB1 MET 3 65.698 -3.585 -3.585
17 1HG MET 3 HG2 MET 3 66.537 -6.304 -6.304
18 2HG MET 3 HG1 MET 3 67.819 -5.287 -5.287
19 1HE MET 3 HE1 MET 3 69.262 -4.363 -4.363
20 2HE MET 3 HE3 MET 3 68.995 -4.048 -4.048
21 3HE MET 3 HE2 MET 3 68.864 -5.688 -5.688
22 H THR 4 HN THR 4 63.551 -3.731 -3.731
23 HA THR 4 HA THR 4 62.181 -1.838 -1.838
24 HB THR 4 HB THR 4 62.644 -1.499 -1.499
25 HG1 THR 4 HG1 THR 4 60.448 -0.920 -0.920
26 1HG2 THR 4 HG21 THR 4 61.394 -4.161 -4.161
27 2HG2 THR 4 HG23 THR 4 60.937 -3.040 -3.040
28 3HG2 THR 4 HG22 THR 4 62.637 -3.420 -3.420
29 H ASP 5 HN ASP 5 61.268 -5.098 -5.098
30 HA ASP 5 HA ASP 5 58.424 -4.775 -4.775
31 1HB ASP 5 HB2 ASP 5 59.774 -6.473 -6.473
32 2HB ASP 5 HB1 ASP 5 59.911 -7.385 -7.385
33 H GLN 6 HN GLN 6 61.322 -5.712 -5.712
34 HA GLN 6 HA GLN 6 60.007 -6.911 -6.911
35 1HB GLN 6 HB2 GLN 6 62.603 -6.417 -6.417
36 2HB GLN 6 HB1 GLN 6 62.516 -5.559 -5.559
37 1HG GLN 6 HG2 GLN 6 62.665 -7.498 -7.498
38 2HG GLN 6 HG1 GLN 6 61.242 -8.119 -8.119
39 1HE2 GLN 6 HE21 GLN 6 64.742 -7.531 -7.531
40 2HE2 GLN 6 HE22 GLN 6 64.945 -8.952 -8.952
41 H GLN 7 HN GLN 7 60.466 -3.618 -3.618
42 HA GLN 7 HA GLN 7 60.438 -2.224 -2.224
43 1HB GLN 7 HB2 GLN 7 60.672 -1.482 -1.482
44 2HB GLN 7 HB1 GLN 7 58.916 -1.324 -1.324
45 1HG GLN 7 HG2 GLN 7 59.992 -0.126 -0.126
46 2HG GLN 7 HG1 GLN 7 60.878 0.508 0.508
47 1HE2 GLN 7 HE22 GLN 7 57.470 2.242 2.242
48 2HE2 GLN 7 HE21 GLN 7 58.589 1.653 1.653
49 H ALA 8 HN ALA 8 57.624 -2.974 -2.974
50 HA ALA 8 HA ALA 8 55.546 -2.083 -2.083
51 1HB ALA 8 HB3 ALA 8 55.956 -3.794 -3.794
52 2HB ALA 8 HB2 ALA 8 54.885 -4.649 -4.649
53 3HB ALA 8 HB1 ALA 8 54.443 -3.048 -3.048
54 H GLU 9 HN GLU 9 57.069 -5.328 -5.328
55 HA GLU 9 HA GLU 9 55.558 -6.072 -6.072
56 1HB GLU 9 HB2 GLU 9 57.667 -7.255 -7.255
57 2HB GLU 9 HB1 GLU 9 57.325 -8.017 -8.017
58 1HG GLU 9 HG2 GLU 9 55.605 -9.067 -9.067
59 2HG GLU 9 HG1 GLU 9 54.802 -7.498 -7.498
60 H ALA 10 HN ALA 10 58.518 -4.424 -4.424
61 HA ALA 10 HA ALA 10 59.945 -5.130 -5.130
62 1HB ALA 10 HB1 ALA 10 60.148 -3.233 -3.233
63 2HB ALA 10 HB3 ALA 10 61.029 -2.794 -2.794
64 3HB ALA 10 HB2 ALA 10 61.364 -4.327 -4.327
65 H ARG 11 HN ARG 11 57.953 -2.333 -2.333
66 HA ARG 11 HA ARG 11 58.118 -1.248 -1.248
67 1HB ARG 11 HB2 ARG 11 56.621 0.558 0.558
68 2HB ARG 11 HB1 ARG 11 58.346 0.484 0.484
69 1HG ARG 11 HG2 ARG 11 56.861 0.680 0.680
70 2HG ARG 11 HG1 ARG 11 57.977 -0.683 -0.683
71 1HD ARG 11 HD2 ARG 11 55.738 -1.413 -1.413
72 2HD ARG 11 HD1 ARG 11 56.121 -2.154 -2.154
73 HE ARG 11 HE ARG 11 54.516 -0.725 -0.725
74 1HH1 ARG 11 HH1 ARG 11 54.984 1.931 1.931
75 2HH1 ARG 11 HH1 ARG 11 53.778 2.293 2.293
76 1HH2 ARG 11 HH2 ARG 11 53.031 -1.032 -1.032
77 2HH2 ARG 11 HH2 ARG 11 52.673 0.617 0.617
78 H ALA 12 HN ALA 12 56.351 -3.601 -3.601
79 HA ALA 12 HA ALA 12 53.687 -2.770 -2.770
80 1HB ALA 12 HB1 ALA 12 54.857 -4.702 -4.702
81 2HB ALA 12 HB3 ALA 12 53.670 -5.463 -5.463
82 3HB ALA 12 HB2 ALA 12 53.206 -4.085 -4.085
83 H PHE 13 HN PHE 13 56.478 -4.508 -4.508
84 HA PHE 13 HA PHE 13 55.223 -6.289 -6.289
85 1HB PHE 13 HB2 PHE 13 57.417 -6.808 -6.808
86 2HB PHE 13 HB1 PHE 13 57.966 -5.144 -5.144
87 HD1 PHE 13 HD1 PHE 13 56.199 -7.583 -7.583
88 HD2 PHE 13 HD2 PHE 13 59.536 -4.936 -4.936
89 HE1 PHE 13 HE1 PHE 13 56.976 -8.085 -8.085
90 HE2 PHE 13 HE2 PHE 13 60.314 -5.434 -5.434
91 HZ PHE 13 HZ PHE 13 59.034 -7.012 -7.012
92 H LEU 14 HN LEU 14 56.357 -2.940 -2.940
93 HA LEU 14 HA LEU 14 55.657 -2.794 -2.794
94 1HB LEU 14 HB2 LEU 14 57.273 -1.101 -1.101
95 2HB LEU 14 HB1 LEU 14 56.883 -0.560 -0.560
96 HG LEU 14 HG LEU 14 58.434 -3.047 -3.047
97 HD1 LEU 14 HD1 LEU 14 59.948 -1.652 -1.652
98 HD1 LEU 14 HD1 LEU 14 59.107 -0.330 -0.330
99 HD1 LEU 14 HD1 LEU 14 60.079 -1.461 -1.461
100 HD2 LEU 14 HD2 LEU 14 57.568 -3.904 -3.904
101 HD2 LEU 14 HD2 LEU 14 56.917 -2.343 -2.343
102 HD2 LEU 14 HD2 LEU 14 58.603 -2.741 -2.741
103 H SER 15 HN SER 15 54.045 -1.360 -1.360
104 HA SER 15 HA SER 15 52.042 -0.545 -0.545
105 1HB SER 15 HB2 SER 15 52.395 -0.705 -0.705
106 2HB SER 15 HB1 SER 15 51.261 0.519 0.519
107 HG SER 15 HG SER 15 49.997 -1.200 -1.200
108 H GLU 16 HN GLU 16 51.157 1.783 1.783
109 HA GLU 16 HA GLU 16 53.091 3.681 3.681
110 1HB GLU 16 HB2 GLU 16 50.651 3.765 3.765
111 2HB GLU 16 HB1 GLU 16 50.373 4.066 4.066
112 1HG GLU 16 HG2 GLU 16 50.485 6.257 6.257
113 2HG GLU 16 HG1 GLU 16 52.228 5.996 5.996
114 H GLU 17 HN GLU 17 52.295 2.574 2.574
115 HA GLU 17 HA GLU 17 52.987 4.929 4.929
116 1HB GLU 17 HB2 GLU 17 51.880 2.472 2.472
117 2HB GLU 17 HB1 GLU 17 53.491 2.246 2.246
118 1HG GLU 17 HG2 GLU 17 53.228 4.093 4.093
119 2HG GLU 17 HG1 GLU 17 51.776 4.647 4.647
120 H MET 18 HN MET 18 54.846 1.872 1.872
121 HA MET 18 HA MET 18 57.311 3.005 3.005
122 1HB MET 18 HB2 MET 18 56.711 0.603 0.603
123 2HB MET 18 HB1 MET 18 56.746 0.597 0.597
124 1HG MET 18 HG2 MET 18 59.028 0.613 0.613
125 2HG MET 18 HG1 MET 18 59.173 1.670 1.670
126 1HE MET 18 HE2 MET 18 59.115 1.283 1.283
127 2HE MET 18 HE1 MET 18 58.033 0.046 0.046
128 3HE MET 18 HE3 MET 18 59.784 -0.144 -0.144
129 H ILE 19 HN ILE 19 56.094 2.359 2.359
130 HA ILE 19 HA ILE 19 58.287 3.013 3.013
131 HB ILE 19 HB ILE 19 55.337 3.635 3.635
132 1HG1 ILE 19 HG12 ILE 19 57.011 1.736 1.736
133 2HG1 ILE 19 HG11 ILE 19 56.372 1.258 1.258
134 1HG2 ILE 19 HG22 ILE 19 57.596 4.326 4.326
135 2HG2 ILE 19 HG21 ILE 19 56.030 3.872 3.872
136 3HG2 ILE 19 HG23 ILE 19 56.158 5.265 5.265
137 HD1 ILE 19 HD1 ILE 19 54.243 1.099 1.099
138 HD1 ILE 19 HD1 ILE 19 55.004 1.010 1.010
139 HD1 ILE 19 HD1 ILE 19 54.396 2.552 2.552
140 H ALA 20 HN ALA 20 56.104 5.271 5.271
141 HA ALA 20 HA ALA 20 57.286 7.682 7.682
142 1HB ALA 20 HB1 ALA 20 55.382 6.845 6.845
143 2HB ALA 20 HB3 ALA 20 56.121 8.433 8.433
144 3HB ALA 20 HB2 ALA 20 55.194 8.069 8.069
145 H GLU 21 HN GLU 21 58.242 5.451 5.451
146 HA GLU 21 HA GLU 21 59.834 7.298 7.298
147 1HB GLU 21 HB2 GLU 21 58.887 5.179 5.179
148 2HB GLU 21 HB1 GLU 21 59.868 4.278 4.278
149 1HG GLU 21 HG2 GLU 21 61.793 4.565 4.565
150 2HG GLU 21 HG1 GLU 21 61.335 6.182 6.182
151 H PHE 22 HN PHE 22 60.808 4.605 4.605
152 HA PHE 22 HA PHE 22 63.555 5.157 5.157
153 1HB PHE 22 HB2 PHE 22 61.654 4.177 4.177
154 2HB PHE 22 HB1 PHE 22 63.400 3.940 3.940
155 HD1 PHE 22 HD2 PHE 22 62.652 3.821 3.821
156 HD2 PHE 22 HD1 PHE 22 62.034 1.517 1.517
157 HE1 PHE 22 HE2 PHE 22 62.374 1.772 1.772
158 HE2 PHE 22 HE1 PHE 22 61.756 -0.536 -0.536
159 HZ PHE 22 HZ PHE 22 61.928 -0.404 -0.404
160 H LYS 23 HN LYS 23 60.907 6.561 6.561
161 HA LYS 23 HA LYS 23 62.248 8.005 8.005
162 1HB LYS 23 HB2 LYS 23 59.742 7.862 7.862
163 2HB LYS 23 HB1 LYS 23 60.126 9.307 9.307
164 1HG LYS 23 HG2 LYS 23 59.314 10.092 10.092
165 2HG LYS 23 HG1 LYS 23 61.067 10.291 10.291
166 1HD LYS 23 HD2 LYS 23 61.352 8.362 8.362
167 2HD LYS 23 HD1 LYS 23 59.710 7.801 7.801
168 1HE LYS 23 HE2 LYS 23 60.220 10.447 10.447
169 2HE LYS 23 HE1 LYS 23 60.104 8.927 8.927
170 1HZ LYS 23 HZ2 LYS 23 58.091 9.676 9.676
171 2HZ LYS 23 HZ1 LYS 23 57.945 10.187 10.187
172 3HZ LYS 23 HZ3 LYS 23 57.958 8.531 8.531
173 H ALA 24 HN ALA 24 61.336 9.585 9.585
174 HA ALA 24 HA ALA 24 62.987 11.832 11.832
175 1HB ALA 24 HB1 ALA 24 61.234 11.326 11.326
176 2HB ALA 24 HB3 ALA 24 62.346 10.190 10.190
177 3HB ALA 24 HB2 ALA 24 62.731 11.911 11.911
178 H ALA 25 HN ALA 25 63.843 8.574 8.574
179 HA ALA 25 HA ALA 25 66.518 9.284 9.284
180 1HB ALA 25 HB1 ALA 25 64.908 6.811 6.811
181 2HB ALA 25 HB3 ALA 25 66.653 6.649 6.649
182 3HB ALA 25 HB2 ALA 25 65.678 7.338 7.338
183 H PHE 26 HN PHE 26 65.204 7.741 7.741
184 HA PHE 26 HA PHE 26 67.675 7.307 7.307
185 1HB PHE 26 HB2 PHE 26 65.721 6.256 6.256
186 2HB PHE 26 HB1 PHE 26 64.804 7.763 7.763
187 HD1 PHE 26 HD2 PHE 26 65.202 9.488 9.488
188 HD2 PHE 26 HD1 PHE 26 67.196 5.685 5.685
189 HE1 PHE 26 HE2 PHE 26 65.837 9.890 9.890
190 HE2 PHE 26 HE1 PHE 26 67.832 6.088 6.088
191 HZ PHE 26 HZ PHE 26 67.152 8.190 8.190
192 H ASP 27 HN ASP 27 65.449 10.106 10.106
193 HA ASP 27 HA ASP 27 66.768 11.689 11.689
194 1HB ASP 27 HB2 ASP 27 64.626 12.308 12.308
195 2HB ASP 27 HB1 ASP 27 65.214 12.309 12.309
196 H MET 28 HN MET 28 67.824 10.797 10.797
197 HA MET 28 HA MET 28 69.417 12.949 12.949
198 1HB MET 28 HB2 MET 28 69.846 9.950 9.950
199 2HB MET 28 HB1 MET 28 70.796 11.103 11.103
200 1HG MET 28 HG2 MET 28 67.819 11.314 11.314
201 2HG MET 28 HG1 MET 28 68.591 9.982 9.982
202 1HE MET 28 HE3 MET 28 70.516 10.224 10.224
203 2HE MET 28 HE2 MET 28 70.199 11.338 11.338
204 3HE MET 28 HE1 MET 28 68.924 10.256 10.256
205 H PHE 29 HN PHE 29 69.920 10.804 10.804
206 HA PHE 29 HA PHE 29 72.569 12.136 12.136
207 1HB PHE 29 HB2 PHE 29 71.879 9.399 9.399
208 2HB PHE 29 HB1 PHE 29 73.461 10.070 10.070
209 HD1 PHE 29 HD2 PHE 29 70.383 8.580 8.580
210 HD2 PHE 29 HD1 PHE 29 74.311 10.068 10.068
211 HE1 PHE 29 HE2 PHE 29 70.254 7.556 7.556
212 HE2 PHE 29 HE1 PHE 29 74.183 9.043 9.043
213 HZ PHE 29 HZ PHE 29 72.154 7.786 7.786
214 H ASP 30 HN ASP 30 70.083 13.176 13.176
215 HA ASP 30 HA ASP 30 69.426 12.281 12.281
216 1HB ASP 30 HB2 ASP 30 68.322 14.510 14.510
217 2HB ASP 30 HB1 ASP 30 67.989 13.683 13.683
218 H ALA 31 HN ALA 31 71.545 12.006 12.006
219 HA ALA 31 HA ALA 31 73.526 14.023 14.023
220 1HB ALA 31 HB2 ALA 31 73.577 11.543 11.543
221 2HB ALA 31 HB1 ALA 31 72.707 11.971 11.971
222 3HB ALA 31 HB3 ALA 31 74.322 12.618 12.618
223 H ASP 32 HN ASP 32 70.782 13.231 13.231
224 HA ASP 32 HA ASP 32 71.235 15.813 15.813
225 1HB ASP 32 HB2 ASP 32 69.406 13.499 13.499
226 2HB ASP 32 HB1 ASP 32 69.993 14.763 14.763
227 H GLY 33 HN GLY 33 68.784 13.967 13.967
228 1HA GLY 33 HA2 GLY 33 67.125 15.070 15.070
229 2HA GLY 33 HA1 GLY 33 67.267 16.501 16.501
230 H GLY 34 HN GLY 34 67.173 13.580 13.580
231 1HA GLY 34 HA2 GLY 34 64.367 14.185 14.185
232 2HA GLY 34 HA1 GLY 34 65.528 13.285 13.285
233 H GLY 35 HN GLY 35 66.118 12.048 12.048
234 1HA GLY 35 HA2 GLY 35 64.643 10.481 10.481
235 2HA GLY 35 HA1 GLY 35 63.949 9.997 9.997
236 H ASP 36 HN ASP 36 67.388 10.586 10.586
237 HA ASP 36 HA ASP 36 68.000 7.709 7.709
238 1HB ASP 36 HB2 ASP 36 69.122 7.641 7.641
239 2HB ASP 36 HB1 ASP 36 67.496 8.273 8.273
240 H ILE 37 HN ILE 37 69.870 7.493 7.493
241 HA ILE 37 HA ILE 37 71.575 9.927 9.927
242 HB ILE 37 HB ILE 37 72.167 8.878 8.878
243 1HG1 ILE 37 HG12 ILE 37 70.528 6.536 6.536
244 2HG1 ILE 37 HG11 ILE 37 72.274 6.552 6.552
245 1HG2 ILE 37 HG22 ILE 37 69.748 9.914 9.914
246 2HG2 ILE 37 HG21 ILE 37 69.249 8.289 8.289
247 3HG2 ILE 37 HG23 ILE 37 70.160 9.292 9.292
248 HD1 ILE 37 HD1 ILE 37 70.079 6.538 6.538
249 HD1 ILE 37 HD1 ILE 37 71.626 7.282 7.282
250 HD1 ILE 37 HD1 ILE 37 71.559 5.581 5.581
251 H SER 38 HN SER 38 73.967 9.291 9.291
252 HA SER 38 HA SER 38 75.138 8.092 8.092
253 1HB SER 38 HB2 SER 38 75.943 8.950 8.950
254 2HB SER 38 HB1 SER 38 77.047 7.841 7.841
255 HG SER 38 HG SER 38 76.288 10.446 10.446
256 H THR 39 HN THR 39 75.315 5.963 5.963
257 HA THR 39 HA THR 39 74.179 3.768 3.768
258 HB THR 39 HB THR 39 76.092 2.517 2.517
259 HG1 THR 39 HG1 THR 39 77.344 4.621 4.621
260 1HG2 THR 39 HG21 THR 39 73.960 4.276 4.276
261 2HG2 THR 39 HG23 THR 39 75.182 3.801 3.801
262 3HG2 THR 39 HG22 THR 39 74.266 2.568 2.568
263 H LYS 40 HN LYS 40 77.248 5.314 5.314
264 HA LYS 40 HA LYS 40 78.337 3.218 3.218
265 1HB LYS 40 HB2 LYS 40 79.000 5.795 5.795
266 2HB LYS 40 HB1 LYS 40 79.019 5.914 5.914
267 1HG LYS 40 HG2 LYS 40 81.184 5.169 5.169
268 2HG LYS 40 HG1 LYS 40 80.344 3.639 3.639
269 1HD LYS 40 HD2 LYS 40 81.281 3.089 3.089
270 2HD LYS 40 HD1 LYS 40 79.911 3.989 3.989
271 1HE LYS 40 HE2 LYS 40 81.802 5.969 5.969
272 2HE LYS 40 HE1 LYS 40 82.746 4.647 4.647
273 1HZ LYS 40 HZ3 LYS 40 80.627 4.567 4.567
274 2HZ LYS 40 HZ2 LYS 40 80.575 6.218 6.218
275 3HZ LYS 40 HZ1 LYS 40 81.956 5.563 5.563
276 H GLU 41 HN GLU 41 75.686 5.338 5.338
277 HA GLU 41 HA GLU 41 75.843 5.311 5.311
278 1HB GLU 41 HB2 GLU 41 74.571 6.817 6.817
279 2HB GLU 41 HB1 GLU 41 73.380 6.336 6.336
280 1HG GLU 41 HG2 GLU 41 74.536 8.543 8.543
281 2HG GLU 41 HG1 GLU 41 74.645 7.360 7.360
282 H LEU 42 HN LEU 42 74.441 3.457 3.457
283 HA LEU 42 HA LEU 42 72.047 2.448 2.448
284 1HB LEU 42 HB2 LEU 42 73.802 1.846 1.846
285 2HB LEU 42 HB1 LEU 42 74.035 0.447 0.447
286 HG LEU 42 HG LEU 42 71.321 0.622 0.622
287 HD1 LEU 42 HD1 LEU 42 72.181 2.312 2.312
288 HD1 LEU 42 HD1 LEU 42 70.533 1.853 1.853
289 HD1 LEU 42 HD1 LEU 42 71.455 0.872 0.872
290 HD2 LEU 42 HD2 LEU 42 71.482 -1.112 -1.112
291 HD2 LEU 42 HD2 LEU 42 72.386 -1.453 -1.453
292 HD2 LEU 42 HD2 LEU 42 73.221 -0.821 -0.821
293 H GLY 43 HN GLY 43 75.249 1.944 1.944
294 1HA GLY 43 HA2 GLY 43 74.462 -0.306 -0.306
295 2HA GLY 43 HA1 GLY 43 75.980 0.587 0.587
296 H THR 44 HN THR 44 75.043 3.178 3.178
297 HA THR 44 HA THR 44 74.341 3.097 3.097
298 HB THR 44 HB THR 44 74.742 5.226 5.226
299 HG1 THR 44 HG1 THR 44 76.660 5.356 5.356
300 1HG2 THR 44 HG23 THR 44 73.024 6.021 6.021
301 2HG2 THR 44 HG22 THR 44 74.113 5.652 5.652
302 3HG2 THR 44 HG21 THR 44 74.538 6.909 6.909
303 H VAL 45 HN VAL 45 72.637 4.178 4.178
304 HA VAL 45 HA VAL 45 70.267 5.177 5.177
305 HB VAL 45 HB VAL 45 71.019 4.958 4.958
306 1HG1 VAL 45 HG13 VAL 45 71.532 2.522 2.522
307 2HG1 VAL 45 HG12 VAL 45 69.807 2.193 2.193
308 3HG1 VAL 45 HG11 VAL 45 70.435 2.904 2.904
309 1HG2 VAL 45 HG22 VAL 45 68.209 4.118 4.118
310 2HG2 VAL 45 HG21 VAL 45 68.782 5.757 5.757
311 3HG2 VAL 45 HG23 VAL 45 68.672 4.596 4.596
312 H MET 46 HN MET 46 71.193 1.762 1.762
313 HA MET 46 HA MET 46 68.593 0.765 0.765
314 1HB MET 46 HB2 MET 46 71.317 -0.389 -0.389
315 2HB MET 46 HB1 MET 46 70.026 -1.396 -1.396
316 1HG MET 46 HG2 MET 46 68.694 -1.171 -1.171
317 2HG MET 46 HG1 MET 46 69.453 0.347 0.347
318 1HE MET 46 HE2 MET 46 69.278 -3.131 -3.131
319 2HE MET 46 HE1 MET 46 69.647 -3.560 -3.560
320 3HE MET 46 HE3 MET 46 70.834 -3.859 -3.859
321 H ARG 47 HN ARG 47 71.869 0.290 0.290
322 HA ARG 47 HA ARG 47 71.236 -0.584 -0.584
323 1HB ARG 47 HB2 ARG 47 73.372 1.122 1.122
324 2HB ARG 47 HB1 ARG 47 73.334 0.988 0.988
325 1HG ARG 47 HG2 ARG 47 72.964 -1.624 -1.624
326 2HG ARG 47 HG1 ARG 47 74.063 -1.029 -1.029
327 1HD ARG 47 HD2 ARG 47 74.917 -0.036 -0.036
328 2HD ARG 47 HD1 ARG 47 74.752 -1.802 -1.802
329 HE ARG 47 HE ARG 47 76.002 -1.503 -1.503
330 1HH1 ARG 47 HH1 ARG 47 76.495 0.966 0.966
331 2HH1 ARG 47 HH1 ARG 47 78.207 0.741 0.741
332 1HH2 ARG 47 HH2 ARG 47 78.240 -2.236 -2.236
333 2HH2 ARG 47 HH2 ARG 47 79.195 -1.071 -1.071
334 H MET 48 HN MET 48 70.881 2.692 2.692
335 HA MET 48 HA MET 48 70.402 3.924 3.924
336 1HB MET 48 HB2 MET 48 70.382 4.645 4.645
337 2HB MET 48 HB1 MET 48 69.414 5.663 5.663
338 1HG MET 48 HG2 MET 48 72.115 4.995 4.995
339 2HG MET 48 HG1 MET 48 72.082 6.027 6.027
340 1HE MET 48 HE2 MET 48 71.644 5.284 5.284
341 2HE MET 48 HE1 MET 48 72.065 6.842 6.842
342 3HE MET 48 HE3 MET 48 70.383 6.297 6.297
343 H LEU 49 HN LEU 49 68.598 1.667 1.667
344 HA LEU 49 HA LEU 49 66.001 2.963 2.963
345 1HB LEU 49 HB2 LEU 49 66.577 0.810 0.810
346 2HB LEU 49 HB1 LEU 49 65.022 1.596 1.596
347 HG LEU 49 HG LEU 49 67.528 3.110 3.110
348 HD1 LEU 49 HD1 LEU 49 66.757 1.431 1.431
349 HD1 LEU 49 HD1 LEU 49 66.742 3.112 3.112
350 HD1 LEU 49 HD1 LEU 49 65.236 2.318 2.318
351 HD2 LEU 49 HD2 LEU 49 66.023 4.641 4.641
352 HD2 LEU 49 HD2 LEU 49 64.611 3.761 3.761
353 HD2 LEU 49 HD2 LEU 49 65.590 4.707 4.707
354 H GLY 50 HN GLY 50 67.848 -0.095 -0.095
355 1HA GLY 50 HA2 GLY 50 67.313 -1.052 -1.052
356 2HA GLY 50 HA1 GLY 50 65.819 -1.440 -1.440
357 H GLN 51 HN GLN 51 67.590 -1.718 -1.718
358 HA GLN 51 HA GLN 51 68.193 -4.593 -4.593
359 1HB GLN 51 HB2 GLN 51 68.542 -4.383 -4.383
360 2HB GLN 51 HB1 GLN 51 66.907 -4.260 -4.260
361 1HG GLN 51 HG2 GLN 51 68.434 -1.719 -1.719
362 2HG GLN 51 HG1 GLN 51 67.966 -2.437 -2.437
363 1HE2 GLN 51 HE22 GLN 51 64.570 -1.563 -1.563
364 2HE2 GLN 51 HE21 GLN 51 65.785 -2.209 -2.209
365 H ASN 52 HN ASN 52 70.243 -5.266 -5.266
366 HA ASN 52 HA ASN 52 72.449 -3.321 -3.321
367 1HB ASN 52 HB2 ASN 52 72.089 -4.208 -4.208
368 2HB ASN 52 HB1 ASN 52 72.488 -5.814 -5.814
369 HD2 ASN 52 HD2 ASN 52 74.002 -3.969 -3.969
370 HD2 ASN 52 HD2 ASN 52 75.557 -3.853 -3.853
371 HA PRO 53 HA PRO 53 73.020 -6.417 -6.417
372 1HB PRO 53 HB2 PRO 53 74.206 -4.678 -4.678
373 2HB PRO 53 HB1 PRO 53 72.445 -4.816 -4.816
374 1HG PRO 53 HG2 PRO 53 74.300 -2.765 -2.765
375 2HG PRO 53 HG1 PRO 53 72.650 -2.586 -2.586
376 1HD PRO 53 HD2 PRO 53 73.313 -2.654 -2.654
377 2HD PRO 53 HD1 PRO 53 71.715 -3.086 -3.086
378 H THR 54 HN THR 54 74.987 -7.483 -7.483
379 HA THR 54 HA THR 54 77.290 -6.961 -6.961
380 HB THR 54 HB THR 54 78.153 -8.983 -8.983
381 HG1 THR 54 HG1 THR 54 75.731 -9.171 -9.171
382 1HG2 THR 54 HG21 THR 54 76.052 -8.816 -8.816
383 2HG2 THR 54 HG23 THR 54 75.348 -9.763 -9.763
384 3HG2 THR 54 HG22 THR 54 76.815 -10.324 -10.324
385 H LYS 55 HN LYS 55 79.260 -6.053 -6.053
386 HA LYS 55 HA LYS 55 79.511 -4.111 -4.111
387 1HB LYS 55 HB2 LYS 55 81.126 -5.021 -5.021
388 2HB LYS 55 HB1 LYS 55 81.748 -6.058 -6.058
389 1HG LYS 55 HG2 LYS 55 82.102 -4.008 -4.008
390 2HG LYS 55 HG1 LYS 55 81.635 -3.029 -3.029
391 1HD LYS 55 HD2 LYS 55 83.538 -4.791 -4.791
392 2HD LYS 55 HD1 LYS 55 84.176 -4.349 -4.349
393 1HE LYS 55 HE2 LYS 55 84.973 -2.510 -2.510
394 2HE LYS 55 HE1 LYS 55 83.315 -1.910 -1.910
395 1HZ LYS 55 HZ2 LYS 55 83.162 -3.630 -3.630
396 2HZ LYS 55 HZ1 LYS 55 84.636 -2.825 -2.825
397 3HZ LYS 55 HZ3 LYS 55 83.202 -1.933 -1.933
398 H GLU 56 HN GLU 56 80.059 -7.607 -7.607
399 HA GLU 56 HA GLU 56 80.971 -7.518 -7.518
400 1HB GLU 56 HB2 GLU 56 80.620 -9.396 -9.396
401 2HB GLU 56 HB1 GLU 56 79.224 -9.752 -9.752
402 1HG GLU 56 HG2 GLU 56 80.884 -9.684 -9.684
403 2HG GLU 56 HG1 GLU 56 82.147 -9.797 -9.797
404 H GLU 57 HN GLU 57 77.674 -8.329 -8.329
405 HA GLU 57 HA GLU 57 76.311 -8.397 -8.397
406 1HB GLU 57 HB2 GLU 57 75.736 -7.811 -7.811
407 2HB GLU 57 HB1 GLU 57 74.552 -7.139 -7.139
408 1HG GLU 57 HG2 GLU 57 75.382 -9.907 -9.907
409 2HG GLU 57 HG1 GLU 57 74.503 -9.716 -9.716
410 H LEU 58 HN LEU 58 77.262 -5.538 -5.538
411 HA LEU 58 HA LEU 58 75.876 -3.520 -3.520
412 1HB LEU 58 HB2 LEU 58 78.072 -3.825 -3.825
413 2HB LEU 58 HB1 LEU 58 78.488 -2.602 -2.602
414 HG LEU 58 HG LEU 58 77.336 -1.521 -1.521
415 HD1 LEU 58 HD1 LEU 58 76.336 -1.591 -1.591
416 HD1 LEU 58 HD1 LEU 58 76.430 -0.222 -0.222
417 HD1 LEU 58 HD1 LEU 58 75.013 -1.272 -1.272
418 HD2 LEU 58 HD2 LEU 58 74.878 -2.215 -2.215
419 HD2 LEU 58 HD2 LEU 58 76.114 -3.293 -3.293
420 HD2 LEU 58 HD2 LEU 58 75.296 -3.697 -3.697
421 H ASP 59 HN ASP 59 79.355 -4.177 -4.177
422 HA ASP 59 HA ASP 59 79.710 -2.877 -2.877
423 1HB ASP 59 HB2 ASP 59 80.856 -5.282 -5.282
424 2HB ASP 59 HB1 ASP 59 81.302 -5.021 -5.021
425 H ALA 60 HN ALA 60 78.091 -5.954 -5.954
426 HA ALA 60 HA ALA 60 77.947 -6.746 -6.746
427 1HB ALA 60 HB2 ALA 60 77.141 -7.671 -7.671
428 2HB ALA 60 HB1 ALA 60 75.908 -8.004 -8.004
429 3HB ALA 60 HB3 ALA 60 77.549 -8.616 -8.616
430 H ILE 61 HN ILE 61 75.442 -5.597 -5.597
431 HA ILE 61 HA ILE 61 73.391 -5.208 -5.208
432 HB ILE 61 HB ILE 61 73.951 -3.833 -3.833
433 1HG1 ILE 61 HG12 ILE 61 72.218 -6.238 -6.238
434 2HG1 ILE 61 HG11 ILE 61 73.826 -6.334 -6.334
435 1HG2 ILE 61 HG23 ILE 61 71.653 -3.787 -3.787
436 2HG2 ILE 61 HG22 ILE 61 71.277 -3.852 -3.852
437 3HG2 ILE 61 HG21 ILE 61 72.242 -2.523 -2.523
438 HD1 ILE 61 HD1 ILE 61 71.578 -6.238 -6.238
439 HD1 ILE 61 HD1 ILE 61 71.894 -4.509 -4.509
440 HD1 ILE 61 HD1 ILE 61 73.113 -5.569 -5.569
441 H ILE 62 HN ILE 62 75.821 -2.946 -2.946
442 HA ILE 62 HA ILE 62 74.993 -0.562 -0.562
443 HB ILE 62 HB ILE 62 77.722 -1.718 -1.718
444 1HG1 ILE 62 HG12 ILE 62 76.131 0.434 0.434
445 2HG1 ILE 62 HG11 ILE 62 76.016 -1.274 -1.274
446 1HG2 ILE 62 HG23 ILE 62 76.912 0.899 0.899
447 2HG2 ILE 62 HG22 ILE 62 78.188 0.911 0.911
448 3HG2 ILE 62 HG21 ILE 62 78.381 -0.041 -0.041
449 HD1 ILE 62 HD1 ILE 62 78.530 0.422 0.422
450 HD1 ILE 62 HD1 ILE 62 78.483 -1.312 -1.312
451 HD1 ILE 62 HD1 ILE 62 77.656 -0.192 -0.192
452 H GLU 63 HN GLU 63 77.712 -2.537 -2.537
453 HA GLU 63 HA GLU 63 77.956 -1.508 -1.508
454 1HB GLU 63 HB2 GLU 63 79.048 -3.535 -3.535
455 2HB GLU 63 HB1 GLU 63 77.918 -4.486 -4.486
456 1HG GLU 63 HG2 GLU 63 79.035 -4.085 -4.085
457 2HG GLU 63 HG1 GLU 63 79.430 -2.427 -2.427
458 H GLU 64 HN GLU 64 75.530 -3.860 -3.860
459 HA GLU 64 HA GLU 64 74.329 -4.356 -4.356
460 1HB GLU 64 HB2 GLU 64 73.869 -5.914 -5.914
461 2HB GLU 64 HB1 GLU 64 73.593 -4.659 -4.659
462 1HG GLU 64 HG2 GLU 64 71.416 -4.293 -4.293
463 2HG GLU 64 HG1 GLU 64 71.747 -4.737 -4.737
464 H VAL 65 HN VAL 65 73.368 -2.200 -2.200
465 HA VAL 65 HA VAL 65 71.280 -0.933 -0.933
466 HB VAL 65 HB VAL 65 70.848 0.274 0.274
467 1HG1 VAL 65 HG11 VAL 65 71.353 -2.631 -2.631
468 2HG1 VAL 65 HG13 VAL 65 71.282 -1.904 -1.904
469 3HG1 VAL 65 HG12 VAL 65 69.918 -1.737 -1.737
470 1HG2 VAL 65 HG21 VAL 65 73.613 0.209 0.209
471 2HG2 VAL 65 HG23 VAL 65 72.462 0.796 0.796
472 3HG2 VAL 65 HG22 VAL 65 73.037 -0.869 -0.869
473 H ASP 66 HN ASP 66 74.612 -0.595 -0.595
474 HA ASP 66 HA ASP 66 74.836 2.306 2.306
475 1HB ASP 66 HB2 ASP 66 76.520 0.255 0.255
476 2HB ASP 66 HB1 ASP 66 76.881 0.512 0.512
477 H GLU 67 HN GLU 67 73.860 -0.099 -0.099
478 HA GLU 67 HA GLU 67 74.770 1.214 1.214
479 1HB GLU 67 HB2 GLU 67 72.721 -0.926 -0.926
480 2HB GLU 67 HB1 GLU 67 73.159 -0.468 -0.468
481 1HG GLU 67 HG2 GLU 67 75.548 -0.989 -0.989
482 2HG GLU 67 HG1 GLU 67 75.017 -1.586 -1.586
483 H ASP 68 HN ASP 68 73.591 3.239 3.239
484 HA ASP 68 HA ASP 68 70.857 3.555 3.555
485 1HB ASP 68 HB2 ASP 68 71.679 3.708 3.708
486 2HB ASP 68 HB1 ASP 68 71.853 5.394 5.394
487 H GLY 69 HN GLY 69 74.109 4.694 4.694
488 1HA GLY 69 HA2 GLY 69 74.870 6.120 6.120
489 2HA GLY 69 HA1 GLY 69 73.276 6.875 6.875
490 H SER 70 HN SER 70 73.416 6.900 6.900
491 HA SER 70 HA SER 70 75.116 9.363 9.363
492 1HB SER 70 HB2 SER 70 72.505 8.484 8.484
493 2HB SER 70 HB1 SER 70 73.437 9.816 9.816
494 HG SER 70 HG SER 70 73.273 10.876 10.876
495 H GLY 71 HN GLY 71 74.463 6.203 6.203
496 1HA GLY 71 HA2 GLY 71 75.964 4.983 4.983
497 2HA GLY 71 HA1 GLY 71 76.793 6.494 6.494
498 H THR 72 HN THR 72 73.314 6.328 6.328
499 HA THR 72 HA THR 72 73.497 6.274 6.274
500 HB THR 72 HB THR 72 71.797 8.039 8.039
501 HG1 THR 72 HG1 THR 72 70.569 7.923 7.923
502 1HG2 THR 72 HG21 THR 72 74.376 8.323 8.323
503 2HG2 THR 72 HG23 THR 72 73.227 9.622 9.622
504 3HG2 THR 72 HG22 THR 72 73.710 9.261 9.261
505 H ILE 73 HN ILE 73 71.259 5.754 5.754
506 HA ILE 73 HA ILE 73 69.957 3.621 3.621
507 HB ILE 73 HB ILE 73 71.064 2.838 2.838
508 1HG1 ILE 73 HG12 ILE 73 68.853 2.257 2.257
509 2HG1 ILE 73 HG11 ILE 73 68.072 2.923 2.923
510 1HG2 ILE 73 HG23 ILE 73 69.774 5.267 5.267
511 2HG2 ILE 73 HG22 ILE 73 69.833 3.860 3.860
512 3HG2 ILE 73 HG21 ILE 73 71.325 4.527 4.527
513 HD1 ILE 73 HD1 ILE 73 68.510 0.413 0.413
514 HD1 ILE 73 HD1 ILE 73 70.227 0.805 0.805
515 HD1 ILE 73 HD1 ILE 73 69.134 1.323 1.323
516 H ASP 74 HN ASP 74 67.732 3.735 3.735
517 HA ASP 74 HA ASP 74 66.391 6.272 6.272
518 1HB ASP 74 HB2 ASP 74 65.892 3.784 3.784
519 2HB ASP 74 HB1 ASP 74 64.510 4.805 4.805
520 H PHE 75 HN PHE 75 65.058 6.586 6.586
521 HA PHE 75 HA PHE 75 64.783 4.934 4.934
522 1HB PHE 75 HB2 PHE 75 63.983 7.336 7.336
523 2HB PHE 75 HB1 PHE 75 62.520 6.611 6.611
524 HD1 PHE 75 HD2 PHE 75 60.968 5.347 5.347
525 HD2 PHE 75 HD1 PHE 75 64.485 7.192 7.192
526 HE1 PHE 75 HE2 PHE 75 60.064 5.042 5.042
527 HE2 PHE 75 HE1 PHE 75 63.580 6.887 6.887
528 HZ PHE 75 HZ PHE 75 61.371 5.811 5.811
529 H GLU 76 HN GLU 76 62.523 5.051 5.051
530 HA GLU 76 HA GLU 76 60.705 3.061 3.061
531 1HB GLU 76 HB2 GLU 76 61.722 4.232 4.232
532 2HB GLU 76 HB1 GLU 76 60.857 2.702 2.702
533 1HG GLU 76 HG2 GLU 76 59.018 3.730 3.730
534 2HG GLU 76 HG1 GLU 76 59.845 5.276 5.276
535 H GLU 77 HN GLU 77 63.725 2.657 2.657
536 HA GLU 77 HA GLU 77 63.569 -0.249 -0.249
537 1HB GLU 77 HB2 GLU 77 64.746 1.441 1.441
538 2HB GLU 77 HB1 GLU 77 66.047 1.423 1.423
539 1HG GLU 77 HG2 GLU 77 66.813 -0.447 -0.447
540 2HG GLU 77 HG1 GLU 77 65.383 -1.275 -1.275
541 H PHE 78 HN PHE 78 65.193 2.215 2.215
542 HA PHE 78 HA PHE 78 66.930 0.514 0.514
543 1HB PHE 78 HB2 PHE 78 67.179 2.898 2.898
544 2HB PHE 78 HB1 PHE 78 65.510 3.131 3.131
545 HD1 PHE 78 HD1 PHE 78 68.484 1.134 1.134
546 HD2 PHE 78 HD2 PHE 78 65.230 3.719 3.719
547 HE1 PHE 78 HE1 PHE 78 69.199 1.036 1.036
548 HE2 PHE 78 HE2 PHE 78 65.944 3.620 3.620
549 HZ PHE 78 HZ PHE 78 67.928 2.280 2.280
550 H LEU 79 HN LEU 79 63.510 1.375 1.375
551 HA LEU 79 HA LEU 79 62.926 0.495 0.495
552 1HB LEU 79 HB2 LEU 79 61.536 0.254 0.254
553 2HB LEU 79 HB1 LEU 79 60.770 -0.386 -0.386
554 HG LEU 79 HG LEU 79 61.873 2.413 2.413
555 HD1 LEU 79 HD1 LEU 79 59.057 2.467 2.467
556 HD1 LEU 79 HD1 LEU 79 59.764 1.446 1.446
557 HD1 LEU 79 HD1 LEU 79 60.325 3.106 3.106
558 HD2 LEU 79 HD2 LEU 79 59.693 0.935 0.935
559 HD2 LEU 79 HD2 LEU 79 59.967 2.671 2.671
560 HD2 LEU 79 HD2 LEU 79 61.219 1.537 1.537
561 H VAL 80 HN VAL 80 63.605 -1.506 -1.506
562 HA VAL 80 HA VAL 80 62.924 -4.050 -4.050
563 HB VAL 80 HB VAL 80 65.057 -3.335 -3.335
564 1HG1 VAL 80 HG12 VAL 80 63.578 -5.838 -5.838
565 2HG1 VAL 80 HG11 VAL 80 64.091 -5.608 -5.608
566 3HG1 VAL 80 HG13 VAL 80 65.288 -5.625 -5.625
567 1HG2 VAL 80 HG22 VAL 80 62.427 -2.573 -2.573
568 2HG2 VAL 80 HG21 VAL 80 63.430 -2.891 -2.891
569 3HG2 VAL 80 HG23 VAL 80 62.365 -4.149 -4.149
570 H MET 81 HN MET 81 65.993 -2.227 -2.227
571 HA MET 81 HA MET 81 67.616 -4.200 -4.200
572 1HB MET 81 HB2 MET 81 67.667 -1.246 -1.246
573 2HB MET 81 HB1 MET 81 68.851 -1.920 -1.920
574 1HG MET 81 HG2 MET 81 69.702 -1.852 -1.852
575 2HG MET 81 HG1 MET 81 69.623 -3.493 -3.493
576 1HE MET 81 HE2 MET 81 69.907 -2.165 -2.165
577 2HE MET 81 HE1 MET 81 69.525 -3.738 -3.738
578 3HE MET 81 HE3 MET 81 68.595 -2.310 -2.310
579 H MET 82 HN MET 82 65.144 -2.108 -2.108
580 HA MET 82 HA MET 82 66.112 -2.085 -2.085
581 1HB MET 82 HB2 MET 82 63.470 -1.294 -1.294
582 2HB MET 82 HB1 MET 82 63.999 -0.860 -0.860
583 1HG MET 82 HG2 MET 82 66.133 -0.047 -0.047
584 2HG MET 82 HG1 MET 82 64.759 0.307 0.307
585 1HE MET 82 HE1 MET 82 63.713 1.916 1.916
586 2HE MET 82 HE3 MET 82 62.631 2.466 2.466
587 3HE MET 82 HE2 MET 82 64.010 3.452 3.452
588 H VAL 83 HN VAL 83 63.132 -3.338 -3.338
589 HA VAL 83 HA VAL 83 62.399 -5.011 -5.011
590 HB VAL 83 HB VAL 83 60.689 -5.769 -5.769
591 1HG1 VAL 83 HG13 VAL 83 61.208 -3.096 -3.096
592 2HG1 VAL 83 HG12 VAL 83 61.039 -3.171 -3.171
593 3HG1 VAL 83 HG11 VAL 83 59.729 -3.735 -3.735
594 1HG2 VAL 83 HG21 VAL 83 62.623 -4.897 -4.897
595 2HG2 VAL 83 HG23 VAL 83 62.008 -6.522 -6.522
596 3HG2 VAL 83 HG22 VAL 83 60.930 -5.273 -5.273
597 H ARG 84 HN ARG 84 64.278 -5.593 -5.593
598 HA ARG 84 HA ARG 84 64.440 -8.435 -8.435
599 1HB ARG 84 HB2 ARG 84 66.280 -6.267 -6.267
600 2HB ARG 84 HB1 ARG 84 66.581 -7.983 -7.983
601 1HG ARG 84 HG2 ARG 84 63.945 -6.683 -6.683
602 2HG ARG 84 HG1 ARG 84 65.292 -6.755 -6.755
603 1HD ARG 84 HD2 ARG 84 65.251 -9.346 -9.346
604 2HD ARG 84 HD1 ARG 84 63.534 -8.949 -8.949
605 HE ARG 84 HE ARG 84 64.135 -7.805 -7.805
606 1HH1 ARG 84 HH1 ARG 84 66.209 -9.634 -9.634
607 2HH1 ARG 84 HH1 ARG 84 65.384 -11.040 -11.040
608 1HH2 ARG 84 HH2 ARG 84 62.347 -10.179 -10.179
609 2HH2 ARG 84 HH2 ARG 84 63.197 -11.348 -11.348
610 H GLN 85 HN GLN 85 66.649 -5.937 -5.937
611 HA GLN 85 HA GLN 85 68.449 -7.779 -7.779
612 1HB GLN 85 HB2 GLN 85 68.802 -5.341 -5.341
613 2HB GLN 85 HB1 GLN 85 67.760 -4.928 -4.928
614 1HG GLN 85 HG2 GLN 85 70.134 -4.850 -4.850
615 2HG GLN 85 HG1 GLN 85 69.282 -6.129 -6.129
616 1HE2 GLN 85 HE22 GLN 85 71.623 -8.499 -8.499
617 2HE2 GLN 85 HE21 GLN 85 70.649 -7.912 -7.912
618 H MET 86 HN MET 86 65.789 -5.789 -5.789
619 HA MET 86 HA MET 86 65.937 -6.991 -6.991
620 1HB MET 86 HB2 MET 86 64.530 -4.925 -4.925
621 2HB MET 86 HB1 MET 86 63.360 -5.909 -5.909
622 1HG MET 86 HG2 MET 86 65.556 -5.548 -5.548
623 2HG MET 86 HG1 MET 86 65.224 -3.967 -3.967
624 1HE MET 86 HE1 MET 86 64.872 -6.301 -6.301
625 2HE MET 86 HE3 MET 86 64.096 -5.235 -5.235
626 3HE MET 86 HE2 MET 86 63.204 -6.590 -6.590
627 H LYS 87 HN LYS 87 64.331 -7.857 -7.857
628 HA LYS 87 HA LYS 87 62.172 -9.426 -9.426
629 1HB LYS 87 HB2 LYS 87 64.071 -9.294 -9.294
630 2HB LYS 87 HB1 LYS 87 63.359 -10.893 -10.893
631 1HG LYS 87 HG2 LYS 87 61.616 -8.445 -8.445
632 2HG LYS 87 HG1 LYS 87 62.100 -9.151 -9.151
633 1HD LYS 87 HD2 LYS 87 60.771 -10.702 -10.702
634 2HD LYS 87 HD1 LYS 87 59.913 -10.041 -10.041
635 1HE LYS 87 HE2 LYS 87 60.487 -11.859 -11.859
636 2HE LYS 87 HE1 LYS 87 62.205 -11.510 -11.510
637 1HZ LYS 87 HZ3 LYS 87 60.475 -12.757 -12.757
638 2HZ LYS 87 HZ2 LYS 87 61.366 -13.679 -13.679
639 3HZ LYS 87 HZ1 LYS 87 62.169 -12.659 -12.659
640 H GLU 88 HN GLU 88 65.607 -10.059 -10.059
641 HA GLU 88 HA GLU 88 65.122 -12.832 -12.832
642 1HB GLU 88 HB2 GLU 88 67.019 -11.697 -11.697
643 2HB GLU 88 HB1 GLU 88 67.833 -11.630 -11.630
644 1HG GLU 88 HG2 GLU 88 68.332 -13.813 -13.813
645 2HG GLU 88 HG1 GLU 88 66.608 -14.185 -14.185
646 H ASP 89 HN ASP 89 66.264 -9.660 -9.660
647 HA ASP 89 HA ASP 89 66.990 -10.609 -10.609
648 1HB ASP 89 HB2 ASP 89 67.827 -8.594 -8.594
649 2HB ASP 89 HB1 ASP 89 66.471 -7.746 -7.746
650 H ALA 90 HN ALA 90 64.170 -9.203 -9.203
651 HA ALA 90 HA ALA 90 62.800 -8.583 -8.583
652 1HB ALA 90 HB2 ALA 90 62.680 -7.699 -7.699
653 2HB ALA 90 HB1 ALA 90 61.303 -8.801 -8.801
654 3HB ALA 90 HB3 ALA 90 61.388 -7.457 -7.457
Start of MODEL 21
1 1H ALA 1 HT2 ALA 1 64.791 -3.707 -3.707
2 2H ALA 1 HT1 ALA 1 66.398 -3.349 -3.349
3 3H ALA 1 HT3 ALA 1 65.451 -4.319 -4.319
4 HA ALA 1 HA ALA 1 66.562 -5.995 -5.995
5 1HB ALA 1 HB3 ALA 1 66.930 -3.773 -3.773
6 2HB ALA 1 HB2 ALA 1 67.175 -5.420 -5.420
7 3HB ALA 1 HB1 ALA 1 68.140 -4.806 -4.806
8 H SER 2 HN SER 2 66.132 -7.273 -7.273
9 HA SER 2 HA SER 2 63.209 -7.645 -7.645
10 1HB SER 2 HB2 SER 2 65.319 -9.318 -9.318
11 2HB SER 2 HB1 SER 2 65.087 -9.097 -9.097
12 HG SER 2 HG SER 2 63.221 -10.017 -10.017
13 H MET 3 HN MET 3 65.533 -5.846 -5.846
14 HA MET 3 HA MET 3 64.579 -5.980 -5.980
15 1HB MET 3 HB2 MET 3 66.118 -4.129 -4.129
16 2HB MET 3 HB1 MET 3 65.439 -3.416 -3.416
17 1HG MET 3 HG2 MET 3 66.444 -5.375 -5.375
18 2HG MET 3 HG1 MET 3 67.316 -5.780 -5.780
19 1HE MET 3 HE2 MET 3 69.031 -4.932 -4.932
20 2HE MET 3 HE1 MET 3 68.725 -3.244 -3.244
21 3HE MET 3 HE3 MET 3 70.134 -3.684 -3.684
22 H THR 4 HN THR 4 63.514 -3.956 -3.956
23 HA THR 4 HA THR 4 61.754 -2.184 -2.184
24 HB THR 4 HB THR 4 62.352 -2.521 -2.521
25 HG1 THR 4 HG1 THR 4 60.151 -1.907 -1.907
26 1HG2 THR 4 HG21 THR 4 61.771 -4.932 -4.932
27 2HG2 THR 4 HG23 THR 4 60.075 -4.514 -4.514
28 3HG2 THR 4 HG22 THR 4 60.905 -4.011 -4.011
29 H ASP 5 HN ASP 5 61.415 -5.658 -5.658
30 HA ASP 5 HA ASP 5 58.551 -5.657 -5.657
31 1HB ASP 5 HB2 ASP 5 60.633 -7.484 -7.484
32 2HB ASP 5 HB1 ASP 5 59.592 -8.229 -8.229
33 H GLN 6 HN GLN 6 61.654 -6.206 -6.206
34 HA GLN 6 HA GLN 6 60.465 -7.177 -7.177
35 1HB GLN 6 HB2 GLN 6 62.752 -7.715 -7.715
36 2HB GLN 6 HB1 GLN 6 63.215 -6.038 -6.038
37 1HG GLN 6 HG2 GLN 6 63.940 -7.312 -7.312
38 2HG GLN 6 HG1 GLN 6 62.537 -6.369 -6.369
39 1HE2 GLN 6 HE22 GLN 6 60.438 -9.222 -9.222
40 2HE2 GLN 6 HE21 GLN 6 60.458 -7.535 -7.535
41 H GLN 7 HN GLN 7 60.722 -4.110 -4.110
42 HA GLN 7 HA GLN 7 61.164 -2.531 -2.531
43 1HB GLN 7 HB2 GLN 7 61.679 -1.852 -1.852
44 2HB GLN 7 HB1 GLN 7 59.945 -1.784 -1.784
45 1HG GLN 7 HG2 GLN 7 60.494 -0.314 -0.314
46 2HG GLN 7 HG1 GLN 7 61.590 0.242 0.242
47 1HE2 GLN 7 HE22 GLN 7 57.874 1.584 1.584
48 2HE2 GLN 7 HE21 GLN 7 58.668 1.009 1.009
49 H ALA 8 HN ALA 8 58.286 -2.694 -2.694
50 HA ALA 8 HA ALA 8 56.410 -1.516 -1.516
51 1HB ALA 8 HB2 ALA 8 56.490 -3.271 -3.271
52 2HB ALA 8 HB1 ALA 8 55.121 -3.680 -3.680
53 3HB ALA 8 HB3 ALA 8 55.296 -2.039 -2.039
54 H GLU 9 HN GLU 9 57.343 -4.975 -4.975
55 HA GLU 9 HA GLU 9 55.565 -5.677 -5.677
56 1HB GLU 9 HB2 GLU 9 57.037 -6.953 -6.953
57 2HB GLU 9 HB1 GLU 9 57.828 -7.452 -7.452
58 1HG GLU 9 HG2 GLU 9 55.459 -7.935 -7.935
59 2HG GLU 9 HG1 GLU 9 54.937 -7.814 -7.814
60 H ALA 10 HN ALA 10 58.635 -4.171 -4.171
61 HA ALA 10 HA ALA 10 59.716 -5.188 -5.188
62 1HB ALA 10 HB1 ALA 10 60.431 -3.402 -3.402
63 2HB ALA 10 HB3 ALA 10 60.977 -2.793 -2.793
64 3HB ALA 10 HB2 ALA 10 61.477 -4.394 -4.394
65 H ARG 11 HN ARG 11 57.549 -2.622 -2.622
66 HA ARG 11 HA ARG 11 57.882 -1.118 -1.118
67 1HB ARG 11 HB2 ARG 11 55.726 -0.782 -0.782
68 2HB ARG 11 HB1 ARG 11 56.436 0.449 0.449
69 1HG ARG 11 HG2 ARG 11 57.962 0.919 0.919
70 2HG ARG 11 HG1 ARG 11 58.540 -0.745 -0.745
71 1HD ARG 11 HD2 ARG 11 57.820 -0.658 -0.658
72 2HD ARG 11 HD1 ARG 11 56.288 -1.124 -1.124
73 HE ARG 11 HE ARG 11 57.018 1.641 1.641
74 1HH1 ARG 11 HH2 ARG 11 55.431 2.848 2.848
75 2HH1 ARG 11 HH2 ARG 11 53.787 2.358 2.358
76 1HH2 ARG 11 HH1 ARG 11 54.625 -0.512 -0.512
77 2HH2 ARG 11 HH1 ARG 11 53.330 0.455 0.455
78 H ALA 12 HN ALA 12 55.240 -2.904 -2.904
79 HA ALA 12 HA ALA 12 53.311 -2.775 -2.775
80 1HB ALA 12 HB3 ALA 12 53.562 -3.846 -3.846
81 2HB ALA 12 HB2 ALA 12 53.522 -5.305 -5.305
82 3HB ALA 12 HB1 ALA 12 52.192 -4.151 -4.151
83 H PHE 13 HN PHE 13 56.309 -4.487 -4.487
84 HA PHE 13 HA PHE 13 55.897 -6.801 -6.801
85 1HB PHE 13 HB2 PHE 13 58.081 -6.234 -6.234
86 2HB PHE 13 HB1 PHE 13 58.022 -4.654 -4.654
87 HD1 PHE 13 HD1 PHE 13 57.759 -8.296 -8.296
88 HD2 PHE 13 HD2 PHE 13 59.108 -4.390 -4.390
89 HE1 PHE 13 HE1 PHE 13 58.796 -9.264 -9.264
90 HE2 PHE 13 HE2 PHE 13 60.144 -5.359 -5.359
91 HZ PHE 13 HZ PHE 13 59.988 -7.796 -7.796
92 H LEU 14 HN LEU 14 55.889 -3.447 -3.447
93 HA LEU 14 HA LEU 14 54.804 -4.446 -4.446
94 1HB LEU 14 HB2 LEU 14 56.088 -2.335 -2.335
95 2HB LEU 14 HB1 LEU 14 57.005 -3.797 -3.797
96 HG LEU 14 HG LEU 14 57.541 -2.906 -2.906
97 HD1 LEU 14 HD1 LEU 14 55.812 -1.467 -1.467
98 HD1 LEU 14 HD1 LEU 14 57.069 -0.318 -0.318
99 HD1 LEU 14 HD1 LEU 14 55.764 -0.691 -0.691
100 HD2 LEU 14 HD2 LEU 14 58.445 -0.584 -0.584
101 HD2 LEU 14 HD2 LEU 14 59.369 -2.005 -2.005
102 HD2 LEU 14 HD2 LEU 14 58.516 -1.994 -1.994
103 H SER 15 HN SER 15 53.575 -2.651 -2.651
104 HA SER 15 HA SER 15 51.600 -1.482 -1.482
105 1HB SER 15 HB2 SER 15 52.290 -1.592 -1.592
106 2HB SER 15 HB1 SER 15 51.318 -0.206 -0.206
107 HG SER 15 HG SER 15 49.936 -1.782 -1.782
108 H GLU 16 HN GLU 16 51.177 0.865 0.865
109 HA GLU 16 HA GLU 16 53.349 2.398 2.398
110 1HB GLU 16 HB2 GLU 16 51.033 2.880 2.880
111 2HB GLU 16 HB1 GLU 16 50.658 3.175 3.175
112 1HG GLU 16 HG2 GLU 16 51.272 5.327 5.327
113 2HG GLU 16 HG1 GLU 16 52.875 4.834 4.834
114 H GLU 17 HN GLU 17 52.216 1.903 1.903
115 HA GLU 17 HA GLU 17 53.161 4.155 4.155
116 1HB GLU 17 HB2 GLU 17 53.232 1.202 1.202
117 2HB GLU 17 HB1 GLU 17 53.502 2.487 2.487
118 1HG GLU 17 HG2 GLU 17 51.227 3.426 3.426
119 2HG GLU 17 HG1 GLU 17 50.983 1.759 1.759
120 H MET 18 HN MET 18 55.030 1.191 1.191
121 HA MET 18 HA MET 18 57.533 2.111 2.111
122 1HB MET 18 HB2 MET 18 56.675 -0.224 -0.224
123 2HB MET 18 HB1 MET 18 57.181 0.275 0.275
124 1HG MET 18 HG2 MET 18 59.341 -0.122 -0.122
125 2HG MET 18 HG1 MET 18 59.246 0.889 0.889
126 1HE MET 18 HE3 MET 18 59.279 0.399 0.399
127 2HE MET 18 HE2 MET 18 59.195 -1.139 -1.139
128 3HE MET 18 HE1 MET 18 60.633 -0.737 -0.737
129 H ILE 19 HN ILE 19 56.237 2.156 2.156
130 HA ILE 19 HA ILE 19 58.365 3.280 3.280
131 HB ILE 19 HB ILE 19 55.376 3.750 3.750
132 1HG1 ILE 19 HG12 ILE 19 57.188 2.186 2.186
133 2HG1 ILE 19 HG11 ILE 19 56.415 1.458 1.458
134 1HG2 ILE 19 HG21 ILE 19 57.452 5.242 5.242
135 2HG2 ILE 19 HG23 ILE 19 56.616 4.267 4.267
136 3HG2 ILE 19 HG22 ILE 19 55.707 5.391 5.391
137 HD1 ILE 19 HD1 ILE 19 54.356 2.852 2.852
138 HD1 ILE 19 HD1 ILE 19 54.606 1.106 1.106
139 HD1 ILE 19 HD1 ILE 19 55.268 2.102 2.102
140 H ALA 20 HN ALA 20 56.148 4.897 4.897
141 HA ALA 20 HA ALA 20 57.154 7.582 7.582
142 1HB ALA 20 HB2 ALA 20 54.950 6.362 6.362
143 2HB ALA 20 HB1 ALA 20 55.780 7.286 7.286
144 3HB ALA 20 HB3 ALA 20 55.226 8.091 8.091
145 H GLU 21 HN GLU 21 58.077 4.964 4.964
146 HA GLU 21 HA GLU 21 59.464 6.565 6.565
147 1HB GLU 21 HB2 GLU 21 58.661 4.390 4.390
148 2HB GLU 21 HB1 GLU 21 59.417 3.652 3.652
149 1HG GLU 21 HG2 GLU 21 61.510 3.634 3.634
150 2HG GLU 21 HG1 GLU 21 61.209 5.097 5.097
151 H PHE 22 HN PHE 22 60.548 4.521 4.521
152 HA PHE 22 HA PHE 22 63.335 5.271 5.271
153 1HB PHE 22 HB2 PHE 22 61.810 4.177 4.177
154 2HB PHE 22 HB1 PHE 22 63.538 4.017 4.017
155 HD1 PHE 22 HD2 PHE 22 62.961 3.674 3.674
156 HD2 PHE 22 HD1 PHE 22 61.592 1.703 1.703
157 HE1 PHE 22 HE2 PHE 22 62.537 1.608 1.608
158 HE2 PHE 22 HE1 PHE 22 61.170 -0.362 -0.362
159 HZ PHE 22 HZ PHE 22 61.643 -0.410 -0.410
160 H LYS 23 HN LYS 23 60.566 6.619 6.619
161 HA LYS 23 HA LYS 23 61.732 8.149 8.149
162 1HB LYS 23 HB2 LYS 23 59.302 7.881 7.881
163 2HB LYS 23 HB1 LYS 23 59.563 9.027 9.027
164 1HG LYS 23 HG2 LYS 23 58.676 10.226 10.226
165 2HG LYS 23 HG1 LYS 23 60.356 10.702 10.702
166 1HD LYS 23 HD2 LYS 23 61.086 9.628 9.628
167 2HD LYS 23 HD1 LYS 23 59.857 8.369 8.369
168 1HE LYS 23 HE2 LYS 23 58.149 9.840 9.840
169 2HE LYS 23 HE1 LYS 23 59.226 11.245 11.245
170 1HZ LYS 23 HZ2 LYS 23 60.748 10.175 10.175
171 2HZ LYS 23 HZ1 LYS 23 59.715 8.831 8.831
172 3HZ LYS 23 HZ3 LYS 23 59.214 10.341 10.341
173 H ALA 24 HN ALA 24 61.197 9.214 9.214
174 HA ALA 24 HA ALA 24 62.597 11.701 11.701
175 1HB ALA 24 HB1 ALA 24 60.962 10.647 10.647
176 2HB ALA 24 HB3 ALA 24 62.469 10.140 10.140
177 3HB ALA 24 HB2 ALA 24 62.152 11.853 11.853
178 H ALA 25 HN ALA 25 63.656 8.574 8.574
179 HA ALA 25 HA ALA 25 66.354 9.379 9.379
180 1HB ALA 25 HB3 ALA 25 64.711 6.924 6.924
181 2HB ALA 25 HB2 ALA 25 66.437 6.665 6.665
182 3HB ALA 25 HB1 ALA 25 65.867 7.434 7.434
183 H PHE 26 HN PHE 26 64.731 8.395 8.395
184 HA PHE 26 HA PHE 26 67.028 7.503 7.503
185 1HB PHE 26 HB2 PHE 26 64.779 6.932 6.932
186 2HB PHE 26 HB1 PHE 26 64.309 8.631 8.631
187 HD1 PHE 26 HD2 PHE 26 65.347 10.134 10.134
188 HD2 PHE 26 HD1 PHE 26 65.838 5.867 5.867
189 HE1 PHE 26 HE2 PHE 26 66.055 10.236 10.236
190 HE2 PHE 26 HE1 PHE 26 66.544 5.970 5.970
191 HZ PHE 26 HZ PHE 26 66.652 8.154 8.154
192 H ASP 27 HN ASP 27 65.308 10.650 10.650
193 HA ASP 27 HA ASP 27 67.135 11.974 11.974
194 1HB ASP 27 HB2 ASP 27 64.816 12.570 12.570
195 2HB ASP 27 HB1 ASP 27 65.916 13.932 13.932
196 H MET 28 HN MET 28 67.636 10.878 10.878
197 HA MET 28 HA MET 28 68.990 13.028 13.028
198 1HB MET 28 HB2 MET 28 69.295 10.012 10.012
199 2HB MET 28 HB1 MET 28 70.112 11.088 11.088
200 1HG MET 28 HG2 MET 28 67.113 10.940 10.940
201 2HG MET 28 HG1 MET 28 67.988 10.241 10.241
202 1HE MET 28 HE3 MET 28 69.822 11.516 11.516
203 2HE MET 28 HE2 MET 28 70.283 12.998 12.998
204 3HE MET 28 HE1 MET 28 69.548 13.086 13.086
205 H PHE 29 HN PHE 29 69.874 11.196 11.196
206 HA PHE 29 HA PHE 29 72.703 12.175 12.175
207 1HB PHE 29 HB2 PHE 29 71.918 9.852 9.852
208 2HB PHE 29 HB1 PHE 29 73.424 10.130 10.130
209 HD1 PHE 29 HD1 PHE 29 73.507 9.813 9.813
210 HD2 PHE 29 HD2 PHE 29 70.072 8.721 8.721
211 HE1 PHE 29 HE1 PHE 29 72.665 8.432 8.432
212 HE2 PHE 29 HE2 PHE 29 69.232 7.340 7.340
213 HZ PHE 29 HZ PHE 29 70.528 7.194 7.194
214 H ASP 30 HN ASP 30 69.789 12.240 12.240
215 HA ASP 30 HA ASP 30 70.815 12.696 12.696
216 1HB ASP 30 HB2 ASP 30 68.298 13.512 13.512
217 2HB ASP 30 HB1 ASP 30 68.527 13.801 13.801
218 H ALA 31 HN ALA 31 72.669 14.145 14.145
219 HA ALA 31 HA ALA 31 72.194 16.824 16.824
220 1HB ALA 31 HB2 ALA 31 74.320 15.570 15.570
221 2HB ALA 31 HB1 ALA 31 74.509 15.595 15.595
222 3HB ALA 31 HB3 ALA 31 74.573 17.101 17.101
223 H ASP 32 HN ASP 32 72.278 15.322 15.322
224 HA ASP 32 HA ASP 32 72.179 17.966 17.966
225 1HB ASP 32 HB2 ASP 32 72.319 15.092 15.092
226 2HB ASP 32 HB1 ASP 32 72.366 16.499 16.499
227 H GLY 33 HN GLY 33 70.194 15.053 15.053
228 1HA GLY 33 HA2 GLY 33 67.807 15.002 15.002
229 2HA GLY 33 HA1 GLY 33 67.774 16.641 16.641
230 H GLY 34 HN GLY 34 69.589 13.942 13.942
231 1HA GLY 34 HA2 GLY 34 68.159 14.371 14.371
232 2HA GLY 34 HA1 GLY 34 69.604 13.382 13.382
233 H GLY 35 HN GLY 35 66.874 13.046 13.046
234 1HA GLY 35 HA2 GLY 35 65.080 11.423 11.423
235 2HA GLY 35 HA1 GLY 35 65.977 10.610 10.610
236 H ASP 36 HN ASP 36 68.450 11.042 11.042
237 HA ASP 36 HA ASP 36 68.029 9.405 9.405
238 1HB ASP 36 HB2 ASP 36 67.719 7.950 7.950
239 2HB ASP 36 HB1 ASP 36 69.483 7.935 7.935
240 H ILE 37 HN ILE 37 70.615 8.058 8.058
241 HA ILE 37 HA ILE 37 72.455 10.427 10.427
242 HB ILE 37 HB ILE 37 73.551 9.341 9.341
243 1HG1 ILE 37 HG12 ILE 37 71.265 7.378 7.378
244 2HG1 ILE 37 HG11 ILE 37 72.993 7.023 7.023
245 1HG2 ILE 37 HG22 ILE 37 71.007 10.625 10.625
246 2HG2 ILE 37 HG21 ILE 37 70.937 9.396 9.396
247 3HG2 ILE 37 HG23 ILE 37 72.183 10.642 10.642
248 HD1 ILE 37 HD1 ILE 37 71.580 8.197 8.197
249 HD1 ILE 37 HD1 ILE 37 73.219 7.547 7.547
250 HD1 ILE 37 HD1 ILE 37 71.834 6.466 6.466
251 H SER 38 HN SER 38 74.813 9.664 9.664
252 HA SER 38 HA SER 38 75.250 8.172 8.172
253 1HB SER 38 HB2 SER 38 77.593 7.920 7.920
254 2HB SER 38 HB1 SER 38 77.075 9.433 9.433
255 HG SER 38 HG SER 38 77.296 8.726 8.726
256 H THR 39 HN THR 39 75.379 5.983 5.983
257 HA THR 39 HA THR 39 74.353 3.974 3.974
258 HB THR 39 HB THR 39 75.711 2.465 2.465
259 HG1 THR 39 HG1 THR 39 77.175 3.778 3.778
260 1HG2 THR 39 HG22 THR 39 73.945 4.440 4.440
261 2HG2 THR 39 HG21 THR 39 75.300 4.534 4.534
262 3HG2 THR 39 HG23 THR 39 74.445 3.009 3.009
263 H LYS 40 HN LYS 40 77.569 5.408 5.408
264 HA LYS 40 HA LYS 40 78.817 3.472 3.472
265 1HB LYS 40 HB2 LYS 40 79.119 6.452 6.452
266 2HB LYS 40 HB1 LYS 40 80.206 5.546 5.546
267 1HG LYS 40 HG2 LYS 40 79.765 4.299 4.299
268 2HG LYS 40 HG1 LYS 40 80.576 5.866 5.866
269 1HD LYS 40 HD2 LYS 40 81.432 3.588 3.588
270 2HD LYS 40 HD1 LYS 40 82.163 3.937 3.937
271 1HE LYS 40 HE2 LYS 40 83.518 5.438 5.438
272 2HE LYS 40 HE1 LYS 40 82.086 6.392 6.392
273 1HZ LYS 40 HZ3 LYS 40 81.794 4.557 4.557
274 2HZ LYS 40 HZ2 LYS 40 83.455 4.293 4.293
275 3HZ LYS 40 HZ1 LYS 40 82.900 5.813 5.813
276 H GLU 41 HN GLU 41 76.648 6.184 6.184
277 HA GLU 41 HA GLU 41 76.947 5.850 5.850
278 1HB GLU 41 HB2 GLU 41 76.694 8.038 8.038
279 2HB GLU 41 HB1 GLU 41 75.011 7.578 7.578
280 1HG GLU 41 HG2 GLU 41 75.097 8.998 8.998
281 2HG GLU 41 HG1 GLU 41 74.769 7.350 7.350
282 H LEU 42 HN LEU 42 75.416 4.065 4.065
283 HA LEU 42 HA LEU 42 72.701 3.891 3.891
284 1HB LEU 42 HB2 LEU 42 73.859 3.128 3.128
285 2HB LEU 42 HB1 LEU 42 74.254 1.663 1.663
286 HG LEU 42 HG LEU 42 71.487 2.370 2.370
287 HD1 LEU 42 HD1 LEU 42 72.173 1.782 1.782
288 HD1 LEU 42 HD1 LEU 42 71.909 3.425 3.425
289 HD1 LEU 42 HD1 LEU 42 70.608 2.238 2.238
290 HD2 LEU 42 HD2 LEU 42 72.866 0.126 0.126
291 HD2 LEU 42 HD2 LEU 42 72.447 0.016 0.016
292 HD2 LEU 42 HD2 LEU 42 71.173 0.088 0.088
293 H GLY 43 HN GLY 43 75.647 2.900 2.900
294 1HA GLY 43 HA2 GLY 43 74.590 0.525 0.525
295 2HA GLY 43 HA1 GLY 43 76.175 1.252 1.252
296 H THR 44 HN THR 44 75.062 3.943 3.943
297 HA THR 44 HA THR 44 74.570 3.728 3.728
298 HB THR 44 HB THR 44 74.529 5.969 5.969
299 HG1 THR 44 HG1 THR 44 76.317 5.699 5.699
300 1HG2 THR 44 HG21 THR 44 73.024 6.348 6.348
301 2HG2 THR 44 HG23 THR 44 74.497 6.302 6.302
302 3HG2 THR 44 HG22 THR 44 74.290 7.547 7.547
303 H VAL 45 HN VAL 45 72.567 4.882 4.882
304 HA VAL 45 HA VAL 45 70.194 5.530 5.530
305 HB VAL 45 HB VAL 45 70.551 5.716 5.716
306 1HG1 VAL 45 HG13 VAL 45 71.909 3.545 3.545
307 2HG1 VAL 45 HG12 VAL 45 70.364 2.702 2.702
308 3HG1 VAL 45 HG11 VAL 45 70.840 3.837 3.837
309 1HG2 VAL 45 HG21 VAL 45 68.306 3.870 3.870
310 2HG2 VAL 45 HG23 VAL 45 68.229 5.601 5.601
311 3HG2 VAL 45 HG22 VAL 45 68.454 4.463 4.463
312 H MET 46 HN MET 46 71.423 2.265 2.265
313 HA MET 46 HA MET 46 68.991 0.940 0.940
314 1HB MET 46 HB2 MET 46 71.778 0.146 0.146
315 2HB MET 46 HB1 MET 46 70.671 -1.047 -1.047
316 1HG MET 46 HG2 MET 46 69.097 -0.747 -0.747
317 2HG MET 46 HG1 MET 46 69.868 0.744 0.744
318 1HE MET 46 HE3 MET 46 69.945 -2.823 -2.823
319 2HE MET 46 HE2 MET 46 69.585 -3.014 -3.014
320 3HE MET 46 HE1 MET 46 71.131 -3.573 -3.573
321 H ARG 47 HN ARG 47 72.360 0.737 0.737
322 HA ARG 47 HA ARG 47 71.834 -0.381 -0.381
323 1HB ARG 47 HB2 ARG 47 73.973 0.741 0.741
324 2HB ARG 47 HB1 ARG 47 73.910 1.660 1.660
325 1HG ARG 47 HG2 ARG 47 73.485 -1.054 -1.054
326 2HG ARG 47 HG1 ARG 47 74.848 -1.029 -1.029
327 1HD ARG 47 HD2 ARG 47 74.969 1.141 1.141
328 2HD ARG 47 HD1 ARG 47 75.028 -0.477 -0.477
329 HE ARG 47 HE ARG 47 76.804 0.255 0.255
330 1HH1 ARG 47 HH2 ARG 47 76.107 -2.009 -2.009
331 2HH1 ARG 47 HH2 ARG 47 77.743 -2.213 -2.213
332 1HH2 ARG 47 HH1 ARG 47 78.973 0.404 0.404
333 2HH2 ARG 47 HH1 ARG 47 79.365 -0.847 -0.847
334 H MET 48 HN MET 48 71.370 2.953 2.953
335 HA MET 48 HA MET 48 71.094 4.046 4.046
336 1HB MET 48 HB2 MET 48 70.710 4.924 4.924
337 2HB MET 48 HB1 MET 48 69.990 5.900 5.900
338 1HG MET 48 HG2 MET 48 72.880 5.031 5.031
339 2HG MET 48 HG1 MET 48 72.384 6.514 6.514
340 1HE MET 48 HE2 MET 48 74.358 6.038 6.038
341 2HE MET 48 HE1 MET 48 74.197 7.766 7.766
342 3HE MET 48 HE3 MET 48 74.075 6.616 6.616
343 H LEU 49 HN LEU 49 69.178 1.848 1.848
344 HA LEU 49 HA LEU 49 66.637 3.105 3.105
345 1HB LEU 49 HB2 LEU 49 67.217 1.005 1.005
346 2HB LEU 49 HB1 LEU 49 65.594 1.510 1.510
347 HG LEU 49 HG LEU 49 67.737 3.374 3.374
348 HD1 LEU 49 HD1 LEU 49 65.313 2.126 2.126
349 HD1 LEU 49 HD1 LEU 49 67.002 1.894 1.894
350 HD1 LEU 49 HD1 LEU 49 66.234 3.464 3.464
351 HD2 LEU 49 HD2 LEU 49 65.424 4.697 4.697
352 HD2 LEU 49 HD2 LEU 49 66.355 4.794 4.794
353 HD2 LEU 49 HD2 LEU 49 64.971 3.706 3.706
354 H GLY 50 HN GLY 50 68.477 0.043 0.043
355 1HA GLY 50 HA2 GLY 50 68.267 -0.886 -0.886
356 2HA GLY 50 HA1 GLY 50 66.629 -1.189 -1.189
357 H GLN 51 HN GLN 51 68.068 -1.566 -1.566
358 HA GLN 51 HA GLN 51 68.254 -4.483 -4.483
359 1HB GLN 51 HB2 GLN 51 68.928 -2.760 -2.760
360 2HB GLN 51 HB1 GLN 51 68.290 -4.404 -4.404
361 1HG GLN 51 HG2 GLN 51 66.229 -3.515 -3.515
362 2HG GLN 51 HG1 GLN 51 66.426 -2.902 -2.902
363 1HE2 GLN 51 HE22 GLN 51 65.722 0.061 0.061
364 2HE2 GLN 51 HE21 GLN 51 64.875 -1.322 -1.322
365 H ASN 52 HN ASN 52 70.327 -4.828 -4.828
366 HA ASN 52 HA ASN 52 72.791 -3.681 -3.681
367 1HB ASN 52 HB2 ASN 52 71.671 -6.057 -6.057
368 2HB ASN 52 HB1 ASN 52 72.950 -6.592 -6.592
369 HD2 ASN 52 HD2 ASN 52 72.316 -5.245 -5.245
370 HD2 ASN 52 HD2 ASN 52 73.929 -4.956 -4.956
371 HA PRO 53 HA PRO 53 73.142 -4.458 -4.458
372 1HB PRO 53 HB2 PRO 53 74.629 -2.217 -2.217
373 2HB PRO 53 HB1 PRO 53 72.856 -2.198 -2.198
374 1HG PRO 53 HG2 PRO 53 74.861 -1.355 -1.355
375 2HG PRO 53 HG1 PRO 53 73.289 -0.646 -0.646
376 1HD PRO 53 HD2 PRO 53 73.743 -2.249 -2.249
377 2HD PRO 53 HD1 PRO 53 72.159 -2.053 -2.053
378 H THR 54 HN THR 54 74.558 -6.277 -6.277
379 HA THR 54 HA THR 54 77.240 -5.988 -5.988
380 HB THR 54 HB THR 54 77.201 -8.299 -8.299
381 HG1 THR 54 HG1 THR 54 74.876 -8.907 -8.907
382 1HG2 THR 54 HG21 THR 54 77.164 -7.581 -7.581
383 2HG2 THR 54 HG23 THR 54 75.673 -8.509 -8.509
384 3HG2 THR 54 HG22 THR 54 77.218 -9.238 -9.238
385 H LYS 55 HN LYS 55 79.216 -5.863 -5.863
386 HA LYS 55 HA LYS 55 79.470 -4.309 -4.309
387 1HB LYS 55 HB2 LYS 55 81.195 -5.289 -5.289
388 2HB LYS 55 HB1 LYS 55 81.269 -6.667 -6.667
389 1HG LYS 55 HG2 LYS 55 82.540 -5.524 -5.524
390 2HG LYS 55 HG1 LYS 55 81.428 -4.155 -4.155
391 1HD LYS 55 HD2 LYS 55 82.455 -3.507 -3.507
392 2HD LYS 55 HD1 LYS 55 83.707 -4.705 -4.705
393 1HE LYS 55 HE2 LYS 55 83.237 -2.946 -2.946
394 2HE LYS 55 HE1 LYS 55 83.767 -2.059 -2.059
395 1HZ LYS 55 HZ2 LYS 55 85.044 -4.609 -4.609
396 2HZ LYS 55 HZ1 LYS 55 85.553 -3.150 -3.150
397 3HZ LYS 55 HZ3 LYS 55 85.658 -3.359 -3.359
398 H GLU 56 HN GLU 56 79.735 -7.890 -7.890
399 HA GLU 56 HA GLU 56 79.796 -8.356 -8.356
400 1HB GLU 56 HB2 GLU 56 79.614 -9.835 -9.835
401 2HB GLU 56 HB1 GLU 56 77.998 -10.087 -10.087
402 1HG GLU 56 HG2 GLU 56 78.926 -11.677 -11.677
403 2HG GLU 56 HG1 GLU 56 79.651 -10.351 -10.351
404 H GLU 57 HN GLU 57 76.850 -7.998 -7.998
405 HA GLU 57 HA GLU 57 75.033 -8.174 -8.174
406 1HB GLU 57 HB2 GLU 57 74.775 -7.120 -7.120
407 2HB GLU 57 HB1 GLU 57 73.411 -7.390 -7.390
408 1HG GLU 57 HG2 GLU 57 75.181 -9.708 -9.708
409 2HG GLU 57 HG1 GLU 57 74.519 -9.277 -9.277
410 H LEU 58 HN LEU 58 76.309 -5.450 -5.450
411 HA LEU 58 HA LEU 58 74.901 -3.368 -3.368
412 1HB LEU 58 HB2 LEU 58 75.912 -2.906 -2.906
413 2HB LEU 58 HB1 LEU 58 77.460 -3.584 -3.584
414 HG LEU 58 HG LEU 58 77.863 -1.740 -1.740
415 HD1 LEU 58 HD1 LEU 58 75.974 -0.986 -0.986
416 HD1 LEU 58 HD1 LEU 58 75.903 0.139 0.139
417 HD1 LEU 58 HD1 LEU 58 74.957 -1.349 -1.349
418 HD2 LEU 58 HD2 LEU 58 77.360 0.230 0.230
419 HD2 LEU 58 HD2 LEU 58 78.598 -0.985 -0.985
420 HD2 LEU 58 HD2 LEU 58 77.003 -1.134 -1.134
421 H ASP 59 HN ASP 59 78.114 -4.824 -4.824
422 HA ASP 59 HA ASP 59 78.866 -3.100 -3.100
423 1HB ASP 59 HB2 ASP 59 79.635 -5.894 -5.894
424 2HB ASP 59 HB1 ASP 59 80.452 -5.056 -5.056
425 H ALA 60 HN ALA 60 77.400 -6.365 -6.365
426 HA ALA 60 HA ALA 60 77.175 -6.698 -6.698
427 1HB ALA 60 HB2 ALA 60 76.955 -8.405 -8.405
428 2HB ALA 60 HB1 ALA 60 75.341 -7.759 -7.759
429 3HB ALA 60 HB3 ALA 60 75.714 -8.519 -8.519
430 H ILE 61 HN ILE 61 75.231 -4.942 -4.942
431 HA ILE 61 HA ILE 61 72.876 -4.655 -4.655
432 HB ILE 61 HB ILE 61 73.984 -3.294 -3.294
433 1HG1 ILE 61 HG12 ILE 61 71.447 -4.906 -4.906
434 2HG1 ILE 61 HG11 ILE 61 73.005 -5.697 -5.697
435 1HG2 ILE 61 HG22 ILE 61 71.486 -2.692 -2.692
436 2HG2 ILE 61 HG21 ILE 61 71.596 -2.331 -2.331
437 3HG2 ILE 61 HG23 ILE 61 72.707 -1.563 -1.563
438 HD1 ILE 61 HD1 ILE 61 73.074 -5.115 -5.115
439 HD1 ILE 61 HD1 ILE 61 71.361 -4.732 -4.732
440 HD1 ILE 61 HD1 ILE 61 72.570 -3.460 -3.460
441 H ILE 62 HN ILE 62 75.377 -2.269 -2.269
442 HA ILE 62 HA ILE 62 74.664 -0.146 -0.146
443 HB ILE 62 HB ILE 62 77.348 -1.236 -1.236
444 1HG1 ILE 62 HG12 ILE 62 75.889 1.252 1.252
445 2HG1 ILE 62 HG11 ILE 62 75.576 -0.325 -0.325
446 1HG2 ILE 62 HG22 ILE 62 76.760 0.823 0.823
447 2HG2 ILE 62 HG21 ILE 62 77.585 1.511 1.511
448 3HG2 ILE 62 HG23 ILE 62 78.325 0.183 0.183
449 HD1 ILE 62 HD1 ILE 62 78.111 1.299 1.299
450 HD1 ILE 62 HD1 ILE 62 78.170 -0.450 -0.450
451 HD1 ILE 62 HD1 ILE 62 77.255 0.550 0.550
452 H GLU 63 HN GLU 63 77.194 -2.559 -2.559
453 HA GLU 63 HA GLU 63 77.511 -1.906 -1.906
454 1HB GLU 63 HB2 GLU 63 78.535 -3.709 -3.709
455 2HB GLU 63 HB1 GLU 63 77.492 -4.780 -4.780
456 1HG GLU 63 HG2 GLU 63 78.650 -4.399 -4.399
457 2HG GLU 63 HG1 GLU 63 79.273 -2.841 -2.841
458 H GLU 64 HN GLU 64 75.008 -3.850 -3.850
459 HA GLU 64 HA GLU 64 73.815 -4.893 -4.893
460 1HB GLU 64 HB2 GLU 64 73.276 -6.078 -6.078
461 2HB GLU 64 HB1 GLU 64 73.161 -4.621 -4.621
462 1HG GLU 64 HG2 GLU 64 70.976 -4.203 -4.203
463 2HG GLU 64 HG1 GLU 64 71.164 -4.977 -4.977
464 H VAL 65 HN VAL 65 72.942 -2.172 -2.172
465 HA VAL 65 HA VAL 65 70.862 -1.225 -1.225
466 HB VAL 65 HB VAL 65 70.546 0.458 0.458
467 1HG1 VAL 65 HG13 VAL 65 70.926 -2.389 -2.389
468 2HG1 VAL 65 HG12 VAL 65 70.916 -1.298 -1.298
469 3HG1 VAL 65 HG11 VAL 65 69.539 -1.338 -1.338
470 1HG2 VAL 65 HG23 VAL 65 72.964 0.978 0.978
471 2HG2 VAL 65 HG22 VAL 65 72.147 0.714 0.714
472 3HG2 VAL 65 HG21 VAL 65 73.166 -0.552 -0.552
473 H ASP 66 HN ASP 66 74.239 -0.907 -0.907
474 HA ASP 66 HA ASP 66 74.428 1.829 1.829
475 1HB ASP 66 HB2 ASP 66 76.131 0.959 0.959
476 2HB ASP 66 HB1 ASP 66 76.383 -0.445 -0.445
477 H GLU 67 HN GLU 67 74.625 -1.487 -1.487
478 HA GLU 67 HA GLU 67 75.564 -0.821 -0.821
479 1HB GLU 67 HB2 GLU 67 74.739 -3.090 -3.090
480 2HB GLU 67 HB1 GLU 67 73.933 -3.160 -3.160
481 1HG GLU 67 HG2 GLU 67 75.900 -4.134 -4.134
482 2HG GLU 67 HG1 GLU 67 76.420 -2.456 -2.456
483 H ASP 68 HN ASP 68 72.530 -0.361 -0.361
484 HA ASP 68 HA ASP 68 70.757 -0.661 -0.661
485 1HB ASP 68 HB2 ASP 68 70.757 0.277 0.277
486 2HB ASP 68 HB1 ASP 68 69.733 1.290 1.290
487 H GLY 69 HN GLY 69 73.122 1.721 1.721
488 1HA GLY 69 HA2 GLY 69 73.803 3.550 3.550
489 2HA GLY 69 HA1 GLY 69 72.410 3.259 3.259
490 H SER 70 HN SER 70 71.626 3.381 3.381
491 HA SER 70 HA SER 70 70.275 5.991 5.991
492 1HB SER 70 HB2 SER 70 70.184 3.883 3.883
493 2HB SER 70 HB1 SER 70 69.153 5.311 5.311
494 HG SER 70 HG SER 70 69.319 3.607 3.607
495 H GLY 71 HN GLY 71 73.288 5.608 5.608
496 1HA GLY 71 HA2 GLY 71 74.942 6.717 6.717
497 2HA GLY 71 HA1 GLY 71 73.693 7.900 7.900
498 H THR 72 HN THR 72 72.375 7.525 7.525
499 HA THR 72 HA THR 72 73.779 5.848 5.848
500 HB THR 72 HB THR 72 72.755 7.375 7.375
501 HG1 THR 72 HG1 THR 72 71.316 8.280 8.280
502 1HG2 THR 72 HG22 THR 72 74.636 8.117 8.117
503 2HG2 THR 72 HG21 THR 72 73.392 9.301 9.301
504 3HG2 THR 72 HG23 THR 72 74.026 9.209 9.209
505 H ILE 73 HN ILE 73 71.211 6.164 6.164
506 HA ILE 73 HA ILE 73 69.674 3.942 3.942
507 HB ILE 73 HB ILE 73 70.916 3.192 3.192
508 1HG1 ILE 73 HG12 ILE 73 69.047 2.535 2.535
509 2HG1 ILE 73 HG11 ILE 73 68.003 3.695 3.695
510 1HG2 ILE 73 HG21 ILE 73 70.014 5.808 5.808
511 2HG2 ILE 73 HG23 ILE 73 70.016 4.483 4.483
512 3HG2 ILE 73 HG22 ILE 73 71.502 4.918 4.918
513 HD1 ILE 73 HD1 ILE 73 67.486 2.006 2.006
514 HD1 ILE 73 HD1 ILE 73 68.836 1.021 1.021
515 HD1 ILE 73 HD1 ILE 73 69.095 2.243 2.243
516 H ASP 74 HN ASP 74 67.330 3.902 3.902
517 HA ASP 74 HA ASP 74 66.308 6.694 6.694
518 1HB ASP 74 HB2 ASP 74 65.925 4.787 4.787
519 2HB ASP 74 HB1 ASP 74 64.413 4.828 4.828
520 H PHE 75 HN PHE 75 64.476 6.923 6.923
521 HA PHE 75 HA PHE 75 64.413 5.287 5.287
522 1HB PHE 75 HB2 PHE 75 63.569 7.679 7.679
523 2HB PHE 75 HB1 PHE 75 62.111 6.925 6.925
524 HD1 PHE 75 HD2 PHE 75 60.775 5.358 5.358
525 HD2 PHE 75 HD1 PHE 75 63.939 7.839 7.839
526 HE1 PHE 75 HE2 PHE 75 59.911 5.057 5.057
527 HE2 PHE 75 HE1 PHE 75 63.075 7.537 7.537
528 HZ PHE 75 HZ PHE 75 61.060 6.146 6.146
529 H GLU 76 HN GLU 76 61.997 5.445 5.445
530 HA GLU 76 HA GLU 76 60.339 3.325 3.325
531 1HB GLU 76 HB2 GLU 76 59.803 3.209 3.209
532 2HB GLU 76 HB1 GLU 76 59.769 4.842 4.842
533 1HG GLU 76 HG2 GLU 76 62.363 4.731 4.731
534 2HG GLU 76 HG1 GLU 76 61.693 3.611 3.611
535 H GLU 77 HN GLU 77 63.298 3.213 3.213
536 HA GLU 77 HA GLU 77 63.180 0.313 0.313
537 1HB GLU 77 HB2 GLU 77 64.227 2.214 2.214
538 2HB GLU 77 HB1 GLU 77 65.602 2.067 2.067
539 1HG GLU 77 HG2 GLU 77 66.168 0.541 0.541
540 2HG GLU 77 HG1 GLU 77 65.372 -0.501 -0.501
541 H PHE 78 HN PHE 78 64.773 2.588 2.588
542 HA PHE 78 HA PHE 78 66.631 0.718 0.718
543 1HB PHE 78 HB2 PHE 78 67.068 3.023 3.023
544 2HB PHE 78 HB1 PHE 78 65.407 3.376 3.376
545 HD1 PHE 78 HD1 PHE 78 68.436 1.476 1.476
546 HD2 PHE 78 HD2 PHE 78 64.837 3.524 3.524
547 HE1 PHE 78 HE1 PHE 78 69.059 1.238 1.238
548 HE2 PHE 78 HE2 PHE 78 65.460 3.284 3.284
549 HZ PHE 78 HZ PHE 78 67.570 2.141 2.141
550 H LEU 79 HN LEU 79 63.257 1.555 1.555
551 HA LEU 79 HA LEU 79 62.781 0.608 0.608
552 1HB LEU 79 HB2 LEU 79 61.355 0.815 0.815
553 2HB LEU 79 HB1 LEU 79 60.725 -0.485 -0.485
554 HG LEU 79 HG LEU 79 60.534 1.100 1.100
555 HD1 LEU 79 HD1 LEU 79 61.354 3.224 3.224
556 HD1 LEU 79 HD1 LEU 79 60.856 3.467 3.467
557 HD1 LEU 79 HD1 LEU 79 62.354 2.607 2.607
558 HD2 LEU 79 HD2 LEU 79 58.602 0.760 0.760
559 HD2 LEU 79 HD2 LEU 79 59.195 2.027 2.027
560 HD2 LEU 79 HD2 LEU 79 58.659 2.433 2.433
561 H VAL 80 HN VAL 80 63.641 -1.284 -1.284
562 HA VAL 80 HA VAL 80 62.963 -3.886 -3.886
563 HB VAL 80 HB VAL 80 64.245 -4.647 -4.647
564 1HG1 VAL 80 HG11 VAL 80 62.471 -2.374 -2.374
565 2HG1 VAL 80 HG13 VAL 80 63.678 -2.324 -2.324
566 3HG1 VAL 80 HG12 VAL 80 62.651 -3.745 -3.745
567 1HG2 VAL 80 HG22 VAL 80 65.608 -1.949 -1.949
568 2HG2 VAL 80 HG21 VAL 80 66.345 -3.542 -3.542
569 3HG2 VAL 80 HG23 VAL 80 65.778 -3.003 -3.003
570 H MET 81 HN MET 81 65.885 -1.871 -1.871
571 HA MET 81 HA MET 81 67.591 -3.835 -3.835
572 1HB MET 81 HB2 MET 81 67.547 -0.798 -0.798
573 2HB MET 81 HB1 MET 81 68.901 -1.750 -1.750
574 1HG MET 81 HG2 MET 81 67.784 -1.836 -1.836
575 2HG MET 81 HG1 MET 81 69.324 -1.131 -1.131
576 1HE MET 81 HE3 MET 81 69.416 -2.630 -2.630
577 2HE MET 81 HE2 MET 81 70.162 -4.225 -4.225
578 3HE MET 81 HE1 MET 81 68.407 -4.079 -4.079
579 H MET 82 HN MET 82 64.950 -1.969 -1.969
580 HA MET 82 HA MET 82 65.824 -1.973 -1.973
581 1HB MET 82 HB2 MET 82 63.066 -1.433 -1.433
582 2HB MET 82 HB1 MET 82 63.798 -0.758 -0.758
583 1HG MET 82 HG2 MET 82 65.576 0.226 0.226
584 2HG MET 82 HG1 MET 82 64.383 -0.098 -0.098
585 1HE MET 82 HE3 MET 82 65.537 1.433 1.433
586 2HE MET 82 HE2 MET 82 64.899 3.075 3.075
587 3HE MET 82 HE1 MET 82 64.068 1.836 1.836
588 H VAL 83 HN VAL 83 63.175 -3.522 -3.522
589 HA VAL 83 HA VAL 83 62.443 -5.296 -5.296
590 HB VAL 83 HB VAL 83 60.825 -6.089 -6.089
591 1HG1 VAL 83 HG13 VAL 83 61.046 -3.457 -3.457
592 2HG1 VAL 83 HG12 VAL 83 61.225 -3.417 -3.417
593 3HG1 VAL 83 HG11 VAL 83 59.776 -4.113 -4.113
594 1HG2 VAL 83 HG22 VAL 83 62.654 -5.030 -5.030
595 2HG2 VAL 83 HG21 VAL 83 62.404 -6.730 -6.730
596 3HG2 VAL 83 HG23 VAL 83 61.079 -5.775 -5.775
597 H ARG 84 HN ARG 84 64.264 -5.689 -5.689
598 HA ARG 84 HA ARG 84 64.767 -8.470 -8.470
599 1HB ARG 84 HB2 ARG 84 66.451 -6.154 -6.154
600 2HB ARG 84 HB1 ARG 84 66.744 -7.846 -7.846
601 1HG ARG 84 HG2 ARG 84 63.989 -6.760 -6.760
602 2HG ARG 84 HG1 ARG 84 65.250 -6.297 -6.297
603 1HD ARG 84 HD2 ARG 84 65.563 -8.490 -8.490
604 2HD ARG 84 HD1 ARG 84 64.937 -9.196 -9.196
605 HE ARG 84 HE ARG 84 63.220 -7.819 -7.819
606 1HH1 ARG 84 HH1 ARG 84 61.407 -7.770 -7.770
607 2HH1 ARG 84 HH1 ARG 84 60.826 -9.381 -9.381
608 1HH2 ARG 84 HH2 ARG 84 63.488 -10.886 -10.886
609 2HH2 ARG 84 HH2 ARG 84 62.005 -11.145 -11.145
610 H GLN 85 HN GLN 85 66.415 -5.747 -5.747
611 HA GLN 85 HA GLN 85 68.523 -7.414 -7.414
612 1HB GLN 85 HB2 GLN 85 68.606 -4.938 -4.938
613 2HB GLN 85 HB1 GLN 85 67.591 -4.638 -4.638
614 1HG GLN 85 HG2 GLN 85 70.087 -4.387 -4.387
615 2HG GLN 85 HG1 GLN 85 69.262 -5.497 -5.497
616 1HE2 GLN 85 HE22 GLN 85 70.921 -8.388 -8.388
617 2HE2 GLN 85 HE21 GLN 85 69.620 -7.821 -7.821
618 H MET 86 HN MET 86 65.732 -5.614 -5.614
619 HA MET 86 HA MET 86 65.955 -6.761 -6.761
620 1HB MET 86 HB2 MET 86 64.343 -4.893 -4.893
621 2HB MET 86 HB1 MET 86 63.277 -5.987 -5.987
622 1HG MET 86 HG2 MET 86 65.488 -5.262 -5.262
623 2HG MET 86 HG1 MET 86 64.749 -3.798 -3.798
624 1HE MET 86 HE2 MET 86 64.136 -2.869 -2.869
625 2HE MET 86 HE1 MET 86 62.426 -2.771 -2.771
626 3HE MET 86 HE3 MET 86 62.922 -3.313 -3.313
627 H LYS 87 HN LYS 87 64.527 -7.877 -7.877
628 HA LYS 87 HA LYS 87 62.536 -9.653 -9.653
629 1HB LYS 87 HB2 LYS 87 64.494 -9.383 -9.383
630 2HB LYS 87 HB1 LYS 87 63.910 -11.031 -11.031
631 1HG LYS 87 HG2 LYS 87 61.641 -9.374 -9.374
632 2HG LYS 87 HG1 LYS 87 62.538 -8.769 -8.769
633 1HD LYS 87 HD2 LYS 87 61.779 -10.499 -10.499
634 2HD LYS 87 HD1 LYS 87 62.606 -11.610 -11.610
635 1HE LYS 87 HE2 LYS 87 60.322 -12.279 -12.279
636 2HE LYS 87 HE1 LYS 87 60.538 -11.273 -11.273
637 1HZ LYS 87 HZ3 LYS 87 59.906 -9.341 -9.341
638 2HZ LYS 87 HZ2 LYS 87 59.392 -10.480 -10.480
639 3HZ LYS 87 HZ1 LYS 87 58.649 -10.415 -10.415
640 H GLU 88 HN GLU 88 65.990 -9.839 -9.839
641 HA GLU 88 HA GLU 88 65.799 -12.638 -12.638
642 1HB GLU 88 HB2 GLU 88 67.956 -10.727 -10.727
643 2HB GLU 88 HB1 GLU 88 68.378 -12.083 -12.083
644 1HG GLU 88 HG2 GLU 88 66.823 -12.419 -12.419
645 2HG GLU 88 HG1 GLU 88 68.580 -12.543 -12.543
646 H ASP 89 HN ASP 89 66.458 -9.319 -9.319
647 HA ASP 89 HA ASP 89 67.142 -10.116 -10.116
648 1HB ASP 89 HB2 ASP 89 66.549 -7.469 -7.469
649 2HB ASP 89 HB1 ASP 89 67.144 -7.620 -7.620
650 H ALA 90 HN ALA 90 64.278 -9.153 -9.153
651 HA ALA 90 HA ALA 90 62.662 -8.442 -8.442
652 1HB ALA 90 HB2 ALA 90 62.260 -7.658 -7.658
653 2HB ALA 90 HB1 ALA 90 61.957 -9.317 -9.317
654 3HB ALA 90 HB3 ALA 90 60.852 -8.528 -8.528
Start of MODEL 22
1 1H ALA 1 HT3 ALA 1 63.594 -4.091 -4.091
2 2H ALA 1 HT2 ALA 1 64.685 -3.225 -3.225
3 3H ALA 1 HT1 ALA 1 65.164 -3.779 -3.779
4 HA ALA 1 HA ALA 1 65.398 -5.953 -5.953
5 1HB ALA 1 HB2 ALA 1 66.390 -3.809 -3.809
6 2HB ALA 1 HB1 ALA 1 66.006 -5.143 -5.143
7 3HB ALA 1 HB3 ALA 1 67.123 -5.391 -5.391
8 H SER 2 HN SER 2 65.125 -7.372 -7.372
9 HA SER 2 HA SER 2 62.215 -7.604 -7.604
10 1HB SER 2 HB2 SER 2 63.142 -9.571 -9.571
11 2HB SER 2 HB1 SER 2 63.347 -9.647 -9.647
12 HG SER 2 HG SER 2 65.234 -8.746 -8.746
13 H MET 3 HN MET 3 64.891 -6.175 -6.175
14 HA MET 3 HA MET 3 64.208 -6.346 -6.346
15 1HB MET 3 HB2 MET 3 65.551 -4.385 -4.385
16 2HB MET 3 HB1 MET 3 65.187 -3.859 -3.859
17 1HG MET 3 HG2 MET 3 67.452 -4.898 -4.898
18 2HG MET 3 HG1 MET 3 66.402 -5.753 -5.753
19 1HE MET 3 HE3 MET 3 69.065 -6.599 -6.599
20 2HE MET 3 HE2 MET 3 68.880 -7.697 -7.697
21 3HE MET 3 HE1 MET 3 68.609 -5.972 -5.972
22 H THR 4 HN THR 4 62.574 -4.651 -4.651
23 HA THR 4 HA THR 4 61.191 -2.645 -2.645
24 HB THR 4 HB THR 4 61.349 -2.905 -2.905
25 HG1 THR 4 HG1 THR 4 59.527 -1.847 -1.847
26 1HG2 THR 4 HG23 THR 4 60.642 -5.489 -5.489
27 2HG2 THR 4 HG22 THR 4 59.082 -4.812 -4.812
28 3HG2 THR 4 HG21 THR 4 60.462 -4.684 -4.684
29 H ASP 5 HN ASP 5 60.934 -6.062 -6.062
30 HA ASP 5 HA ASP 5 58.119 -6.065 -6.065
31 1HB ASP 5 HB2 ASP 5 59.130 -7.819 -7.819
32 2HB ASP 5 HB1 ASP 5 60.198 -8.271 -8.271
33 H GLN 6 HN GLN 6 61.389 -6.416 -6.416
34 HA GLN 6 HA GLN 6 60.605 -7.290 -7.290
35 1HB GLN 6 HB2 GLN 6 62.892 -6.954 -6.954
36 2HB GLN 6 HB1 GLN 6 62.896 -7.260 -7.260
37 1HG GLN 6 HG2 GLN 6 62.602 -4.619 -4.619
38 2HG GLN 6 HG1 GLN 6 63.361 -4.699 -4.699
39 1HE2 GLN 6 HE22 GLN 6 66.113 -6.679 -6.679
40 2HE2 GLN 6 HE21 GLN 6 64.837 -7.238 -7.238
41 H GLN 7 HN GLN 7 60.393 -4.221 -4.221
42 HA GLN 7 HA GLN 7 60.476 -2.591 -2.591
43 1HB GLN 7 HB2 GLN 7 59.863 -2.244 -2.244
44 2HB GLN 7 HB1 GLN 7 59.436 -0.956 -0.956
45 1HG GLN 7 HG2 GLN 7 61.582 -0.294 -0.294
46 2HG GLN 7 HG1 GLN 7 62.106 -1.930 -1.930
47 1HE2 GLN 7 HE22 GLN 7 62.065 -0.838 -0.838
48 2HE2 GLN 7 HE21 GLN 7 60.959 -0.112 -0.112
49 H ALA 8 HN ALA 8 58.181 -4.694 -4.694
50 HA ALA 8 HA ALA 8 55.783 -3.165 -3.165
51 1HB ALA 8 HB1 ALA 8 56.408 -5.237 -5.237
52 2HB ALA 8 HB3 ALA 8 55.619 -6.087 -6.087
53 3HB ALA 8 HB2 ALA 8 54.767 -4.801 -4.801
54 H GLU 9 HN GLU 9 57.311 -6.178 -6.178
55 HA GLU 9 HA GLU 9 55.680 -6.075 -6.075
56 1HB GLU 9 HB2 GLU 9 57.440 -7.945 -7.945
57 2HB GLU 9 HB1 GLU 9 57.496 -8.106 -8.106
58 1HG GLU 9 HG2 GLU 9 55.214 -8.623 -8.623
59 2HG GLU 9 HG1 GLU 9 54.848 -7.909 -7.909
60 H ALA 10 HN ALA 10 58.733 -4.900 -4.900
61 HA ALA 10 HA ALA 10 60.238 -5.066 -5.066
62 1HB ALA 10 HB3 ALA 10 60.272 -3.464 -3.464
63 2HB ALA 10 HB2 ALA 10 61.327 -2.971 -2.971
64 3HB ALA 10 HB1 ALA 10 61.484 -4.584 -4.584
65 H ARG 11 HN ARG 11 58.124 -2.515 -2.515
66 HA ARG 11 HA ARG 11 58.331 -1.062 -1.062
67 1HB ARG 11 HB2 ARG 11 57.079 0.706 0.706
68 2HB ARG 11 HB1 ARG 11 58.801 0.432 0.432
69 1HG ARG 11 HG2 ARG 11 57.485 0.498 0.498
70 2HG ARG 11 HG1 ARG 11 58.360 -1.014 -1.014
71 1HD ARG 11 HD2 ARG 11 56.421 -2.237 -2.237
72 2HD ARG 11 HD1 ARG 11 55.548 -0.853 -0.853
73 HE ARG 11 HE ARG 11 56.308 -0.598 -0.598
74 1HH1 ARG 11 HH1 ARG 11 54.240 1.139 1.139
75 2HH1 ARG 11 HH1 ARG 11 52.767 0.254 0.254
76 1HH2 ARG 11 HH2 ARG 11 54.274 -2.850 -2.850
77 2HH2 ARG 11 HH2 ARG 11 52.786 -2.006 -2.006
78 H ALA 12 HN ALA 12 56.278 -3.173 -3.173
79 HA ALA 12 HA ALA 12 53.778 -2.114 -2.114
80 1HB ALA 12 HB2 ALA 12 53.971 -3.022 -3.022
81 2HB ALA 12 HB1 ALA 12 54.322 -4.605 -4.605
82 3HB ALA 12 HB3 ALA 12 52.753 -3.849 -3.849
83 H PHE 13 HN PHE 13 56.315 -4.196 -4.196
84 HA PHE 13 HA PHE 13 54.893 -6.242 -6.242
85 1HB PHE 13 HB2 PHE 13 57.092 -6.794 -6.794
86 2HB PHE 13 HB1 PHE 13 57.656 -5.139 -5.139
87 HD1 PHE 13 HD1 PHE 13 56.066 -7.844 -7.844
88 HD2 PHE 13 HD2 PHE 13 58.989 -4.707 -4.707
89 HE1 PHE 13 HE1 PHE 13 56.824 -8.380 -8.380
90 HE2 PHE 13 HE2 PHE 13 59.747 -5.238 -5.238
91 HZ PHE 13 HZ PHE 13 58.665 -7.078 -7.078
92 H LEU 14 HN LEU 14 55.515 -2.903 -2.903
93 HA LEU 14 HA LEU 14 54.685 -3.318 -3.318
94 1HB LEU 14 HB2 LEU 14 56.387 -1.106 -1.106
95 2HB LEU 14 HB1 LEU 14 56.102 -1.412 -1.412
96 HG LEU 14 HG LEU 14 57.057 -3.811 -3.811
97 HD1 LEU 14 HD1 LEU 14 58.262 -2.581 -2.581
98 HD1 LEU 14 HD1 LEU 14 59.435 -2.786 -2.786
99 HD1 LEU 14 HD1 LEU 14 58.577 -1.256 -1.256
100 HD2 LEU 14 HD2 LEU 14 58.840 -2.395 -2.395
101 HD2 LEU 14 HD2 LEU 14 58.113 -3.997 -3.997
102 HD2 LEU 14 HD2 LEU 14 57.191 -2.565 -2.565
103 H SER 15 HN SER 15 53.397 -1.497 -1.497
104 HA SER 15 HA SER 15 51.374 -0.575 -0.575
105 1HB SER 15 HB2 SER 15 51.431 -1.264 -1.264
106 2HB SER 15 HB1 SER 15 51.500 0.491 0.491
107 HG SER 15 HG SER 15 49.571 0.652 0.652
108 H GLU 16 HN GLU 16 50.691 1.879 1.879
109 HA GLU 16 HA GLU 16 52.717 3.550 3.550
110 1HB GLU 16 HB2 GLU 16 50.326 3.953 3.953
111 2HB GLU 16 HB1 GLU 16 50.149 4.145 4.145
112 1HG GLU 16 HG2 GLU 16 52.159 5.947 5.947
113 2HG GLU 16 HG1 GLU 16 51.054 6.082 6.082
114 H GLU 17 HN GLU 17 51.708 2.986 2.986
115 HA GLU 17 HA GLU 17 52.978 5.136 5.136
116 1HB GLU 17 HB2 GLU 17 51.476 3.208 3.208
117 2HB GLU 17 HB1 GLU 17 52.972 2.285 2.285
118 1HG GLU 17 HG2 GLU 17 52.833 3.240 3.240
119 2HG GLU 17 HG1 GLU 17 53.810 4.443 4.443
120 H MET 18 HN MET 18 54.360 1.969 1.969
121 HA MET 18 HA MET 18 56.980 2.444 2.444
122 1HB MET 18 HB2 MET 18 56.028 0.243 0.243
123 2HB MET 18 HB1 MET 18 56.034 0.717 0.717
124 1HG MET 18 HG2 MET 18 58.125 -0.127 -0.127
125 2HG MET 18 HG1 MET 18 58.633 1.253 1.253
126 1HE MET 18 HE2 MET 18 58.475 1.479 1.479
127 2HE MET 18 HE1 MET 18 58.713 0.239 0.239
128 3HE MET 18 HE3 MET 18 60.030 0.660 0.660
129 H ILE 19 HN ILE 19 55.843 2.593 2.593
130 HA ILE 19 HA ILE 19 58.102 3.533 3.533
131 HB ILE 19 HB ILE 19 55.204 4.392 4.392
132 1HG1 ILE 19 HG12 ILE 19 56.920 2.264 2.264
133 2HG1 ILE 19 HG11 ILE 19 55.452 2.033 2.033
134 1HG2 ILE 19 HG23 ILE 19 57.318 5.721 5.721
135 2HG2 ILE 19 HG22 ILE 19 56.967 4.517 4.517
136 3HG2 ILE 19 HG21 ILE 19 55.708 5.634 5.634
137 HD1 ILE 19 HD1 ILE 19 55.592 3.466 3.466
138 HD1 ILE 19 HD1 ILE 19 54.131 3.173 3.173
139 HD1 ILE 19 HD1 ILE 19 55.012 1.819 1.819
140 H ALA 20 HN ALA 20 55.864 5.443 5.443
141 HA ALA 20 HA ALA 20 57.172 7.986 7.986
142 1HB ALA 20 HB3 ALA 20 54.867 6.946 6.946
143 2HB ALA 20 HB2 ALA 20 55.773 7.785 7.785
144 3HB ALA 20 HB1 ALA 20 55.289 8.646 8.646
145 H GLU 21 HN GLU 21 57.681 5.320 5.320
146 HA GLU 21 HA GLU 21 59.255 6.720 6.720
147 1HB GLU 21 HB2 GLU 21 58.243 4.582 4.582
148 2HB GLU 21 HB1 GLU 21 59.046 3.835 3.835
149 1HG GLU 21 HG2 GLU 21 60.161 3.296 3.296
150 2HG GLU 21 HG1 GLU 21 61.227 4.143 4.143
151 H PHE 22 HN PHE 22 60.123 4.838 4.838
152 HA PHE 22 HA PHE 22 62.987 5.288 5.288
153 1HB PHE 22 HB2 PHE 22 61.367 4.408 4.408
154 2HB PHE 22 HB1 PHE 22 63.090 4.138 4.138
155 HD1 PHE 22 HD2 PHE 22 62.368 3.742 3.742
156 HD2 PHE 22 HD1 PHE 22 61.207 1.888 1.888
157 HE1 PHE 22 HE2 PHE 22 61.861 1.640 1.640
158 HE2 PHE 22 HE1 PHE 22 60.700 -0.217 -0.217
159 HZ PHE 22 HZ PHE 22 61.028 -0.339 -0.339
160 H LYS 23 HN LYS 23 60.380 6.750 6.750
161 HA LYS 23 HA LYS 23 61.684 8.337 8.337
162 1HB LYS 23 HB2 LYS 23 59.239 8.239 8.239
163 2HB LYS 23 HB1 LYS 23 59.502 9.214 9.214
164 1HG LYS 23 HG2 LYS 23 58.827 10.739 10.739
165 2HG LYS 23 HG1 LYS 23 60.565 10.961 10.961
166 1HD LYS 23 HD2 LYS 23 61.077 9.810 9.810
167 2HD LYS 23 HD1 LYS 23 59.510 9.001 9.001
168 1HE LYS 23 HE2 LYS 23 59.592 10.797 10.797
169 2HE LYS 23 HE1 LYS 23 58.420 11.215 11.215
170 1HZ LYS 23 HZ2 LYS 23 60.239 12.388 12.388
171 2HZ LYS 23 HZ1 LYS 23 61.247 12.114 12.114
172 3HZ LYS 23 HZ3 LYS 23 59.865 13.083 13.083
173 H ALA 24 HN ALA 24 61.051 9.414 9.414
174 HA ALA 24 HA ALA 24 62.649 11.768 11.768
175 1HB ALA 24 HB3 ALA 24 60.910 11.056 11.056
176 2HB ALA 24 HB2 ALA 24 62.127 9.977 9.977
177 3HB ALA 24 HB1 ALA 24 62.387 11.722 11.722
178 H ALA 25 HN ALA 25 63.473 8.500 8.500
179 HA ALA 25 HA ALA 25 66.202 9.123 9.123
180 1HB ALA 25 HB1 ALA 25 64.507 7.115 7.115
181 2HB ALA 25 HB3 ALA 25 65.355 6.386 6.386
182 3HB ALA 25 HB2 ALA 25 66.255 6.885 6.885
183 H PHE 26 HN PHE 26 64.605 8.291 8.291
184 HA PHE 26 HA PHE 26 66.920 7.364 7.364
185 1HB PHE 26 HB2 PHE 26 64.544 6.972 6.972
186 2HB PHE 26 HB1 PHE 26 64.360 8.693 8.693
187 HD1 PHE 26 HD1 PHE 26 65.609 9.750 9.750
188 HD2 PHE 26 HD2 PHE 26 65.702 5.511 5.511
189 HE1 PHE 26 HE1 PHE 26 66.516 9.406 9.406
190 HE2 PHE 26 HE2 PHE 26 66.610 5.165 5.165
191 HZ PHE 26 HZ PHE 26 67.020 7.113 7.113
192 H ASP 27 HN ASP 27 65.316 10.565 10.565
193 HA ASP 27 HA ASP 27 67.175 11.886 11.886
194 1HB ASP 27 HB2 ASP 27 64.973 12.553 12.553
195 2HB ASP 27 HB1 ASP 27 66.108 13.859 13.859
196 H MET 28 HN MET 28 67.627 10.642 10.642
197 HA MET 28 HA MET 28 69.097 12.581 12.581
198 1HB MET 28 HB2 MET 28 69.322 9.575 9.575
199 2HB MET 28 HB1 MET 28 70.265 10.484 10.484
200 1HG MET 28 HG2 MET 28 67.258 10.732 10.732
201 2HG MET 28 HG1 MET 28 68.038 9.520 9.520
202 1HE MET 28 HE3 MET 28 66.096 11.940 11.940
203 2HE MET 28 HE2 MET 28 66.315 11.423 11.423
204 3HE MET 28 HE1 MET 28 66.572 13.112 13.112
205 H PHE 29 HN PHE 29 69.913 10.972 10.972
206 HA PHE 29 HA PHE 29 72.685 12.110 12.110
207 1HB PHE 29 HB2 PHE 29 72.120 9.679 9.679
208 2HB PHE 29 HB1 PHE 29 73.575 10.105 10.105
209 HD1 PHE 29 HD2 PHE 29 70.208 8.619 8.619
210 HD2 PHE 29 HD1 PHE 29 73.786 9.614 9.614
211 HE1 PHE 29 HE2 PHE 29 69.468 7.188 7.188
212 HE2 PHE 29 HE1 PHE 29 73.044 8.183 8.183
213 HZ PHE 29 HZ PHE 29 70.886 6.969 6.969
214 H ASP 30 HN ASP 30 69.913 12.815 12.815
215 HA ASP 30 HA ASP 30 70.287 12.668 12.668
216 1HB ASP 30 HB2 ASP 30 68.484 14.342 14.342
217 2HB ASP 30 HB1 ASP 30 68.158 13.111 13.111
218 H ALA 31 HN ALA 31 72.594 13.313 13.313
219 HA ALA 31 HA ALA 31 73.550 15.917 15.917
220 1HB ALA 31 HB2 ALA 31 74.421 13.535 13.535
221 2HB ALA 31 HB1 ALA 31 75.007 14.992 14.992
222 3HB ALA 31 HB3 ALA 31 75.388 14.706 14.706
223 H ASP 32 HN ASP 32 72.338 14.634 14.634
224 HA ASP 32 HA ASP 32 72.401 17.364 17.364
225 1HB ASP 32 HB2 ASP 32 71.805 14.586 14.586
226 2HB ASP 32 HB1 ASP 32 71.760 16.042 16.042
227 H GLY 33 HN GLY 33 70.052 14.723 14.723
228 1HA GLY 33 HA2 GLY 33 67.821 15.222 15.222
229 2HA GLY 33 HA1 GLY 33 67.907 16.796 16.796
230 H GLY 34 HN GLY 34 68.965 13.894 13.894
231 1HA GLY 34 HA2 GLY 34 66.899 14.354 14.354
232 2HA GLY 34 HA1 GLY 34 68.258 13.237 13.237
233 H GLY 35 HN GLY 35 66.419 13.124 13.124
234 1HA GLY 35 HA2 GLY 35 64.582 11.686 11.686
235 2HA GLY 35 HA1 GLY 35 64.704 10.928 10.928
236 H ASP 36 HN ASP 36 67.808 11.039 11.039
237 HA ASP 36 HA ASP 36 67.819 8.760 8.760
238 1HB ASP 36 HB2 ASP 36 68.486 8.659 8.659
239 2HB ASP 36 HB1 ASP 36 69.243 7.530 7.530
240 H ILE 37 HN ILE 37 70.384 7.928 7.928
241 HA ILE 37 HA ILE 37 72.056 10.410 10.410
242 HB ILE 37 HB ILE 37 73.026 9.411 9.411
243 1HG1 ILE 37 HG12 ILE 37 71.236 7.088 7.088
244 2HG1 ILE 37 HG11 ILE 37 72.985 7.074 7.074
245 1HG2 ILE 37 HG21 ILE 37 69.997 9.407 9.407
246 2HG2 ILE 37 HG23 ILE 37 70.909 9.286 9.286
247 3HG2 ILE 37 HG22 ILE 37 71.048 10.730 10.730
248 HD1 ILE 37 HD1 ILE 37 70.949 6.608 6.608
249 HD1 ILE 37 HD1 ILE 37 71.814 8.077 8.077
250 HD1 ILE 37 HD1 ILE 37 72.698 6.570 6.570
251 H SER 38 HN SER 38 74.503 9.607 9.607
252 HA SER 38 HA SER 38 75.178 8.331 8.331
253 1HB SER 38 HB2 SER 38 76.447 9.814 9.814
254 2HB SER 38 HB1 SER 38 77.067 8.221 8.221
255 HG SER 38 HG SER 38 76.995 8.950 8.950
256 H THR 39 HN THR 39 75.399 6.172 6.172
257 HA THR 39 HA THR 39 74.309 4.045 4.045
258 HB THR 39 HB THR 39 76.212 2.736 2.736
259 HG1 THR 39 HG1 THR 39 77.709 3.951 3.951
260 1HG2 THR 39 HG21 THR 39 73.915 4.267 4.267
261 2HG2 THR 39 HG23 THR 39 75.117 4.004 4.004
262 3HG2 THR 39 HG22 THR 39 74.418 2.627 2.627
263 H LYS 40 HN LYS 40 77.479 5.509 5.509
264 HA LYS 40 HA LYS 40 78.589 3.488 3.488
265 1HB LYS 40 HB2 LYS 40 79.284 5.968 5.968
266 2HB LYS 40 HB1 LYS 40 79.195 6.273 6.273
267 1HG LYS 40 HG2 LYS 40 80.549 4.003 4.003
268 2HG LYS 40 HG1 LYS 40 81.007 4.424 4.424
269 1HD LYS 40 HD2 LYS 40 81.197 6.502 6.502
270 2HD LYS 40 HD1 LYS 40 82.468 5.288 5.288
271 1HE LYS 40 HE2 LYS 40 81.979 6.173 6.173
272 2HE LYS 40 HE1 LYS 40 82.021 7.638 7.638
273 1HZ LYS 40 HZ2 LYS 40 84.048 6.792 6.792
274 2HZ LYS 40 HZ1 LYS 40 84.032 5.448 5.448
275 3HZ LYS 40 HZ3 LYS 40 84.259 7.005 7.005
276 H GLU 41 HN GLU 41 76.095 5.862 5.862
277 HA GLU 41 HA GLU 41 76.238 5.462 5.462
278 1HB GLU 41 HB2 GLU 41 76.059 7.729 7.729
279 2HB GLU 41 HB1 GLU 41 74.474 7.258 7.258
280 1HG GLU 41 HG2 GLU 41 73.767 8.222 8.222
281 2HG GLU 41 HG1 GLU 41 74.137 6.622 6.622
282 H LEU 42 HN LEU 42 74.882 3.880 3.880
283 HA LEU 42 HA LEU 42 72.131 3.554 3.554
284 1HB LEU 42 HB2 LEU 42 72.960 2.852 2.852
285 2HB LEU 42 HB1 LEU 42 74.206 1.845 1.845
286 HG LEU 42 HG LEU 42 71.678 1.007 1.007
287 HD1 LEU 42 HD1 LEU 42 71.719 1.709 1.709
288 HD1 LEU 42 HD1 LEU 42 70.361 1.649 1.649
289 HD1 LEU 42 HD1 LEU 42 70.999 0.157 0.157
290 HD2 LEU 42 HD2 LEU 42 73.453 -0.546 -0.546
291 HD2 LEU 42 HD2 LEU 42 73.818 -0.148 -0.148
292 HD2 LEU 42 HD2 LEU 42 72.369 -1.074 -1.074
293 H GLY 43 HN GLY 43 75.064 1.960 1.960
294 1HA GLY 43 HA2 GLY 43 73.707 -0.137 -0.137
295 2HA GLY 43 HA1 GLY 43 75.367 0.387 0.387
296 H THR 44 HN THR 44 74.641 3.173 3.173
297 HA THR 44 HA THR 44 74.077 2.936 2.936
298 HB THR 44 HB THR 44 74.428 5.202 5.202
299 HG1 THR 44 HG1 THR 44 76.280 5.407 5.407
300 1HG2 THR 44 HG23 THR 44 72.901 5.945 5.945
301 2HG2 THR 44 HG22 THR 44 74.057 5.390 5.390
302 3HG2 THR 44 HG21 THR 44 74.474 6.727 6.727
303 H VAL 45 HN VAL 45 72.324 4.635 4.635
304 HA VAL 45 HA VAL 45 70.033 5.437 5.437
305 HB VAL 45 HB VAL 45 70.464 5.922 5.922
306 1HG1 VAL 45 HG13 VAL 45 71.573 3.675 3.675
307 2HG1 VAL 45 HG12 VAL 45 69.955 2.997 2.997
308 3HG1 VAL 45 HG11 VAL 45 70.519 4.239 4.239
309 1HG2 VAL 45 HG21 VAL 45 67.982 4.307 4.307
310 2HG2 VAL 45 HG23 VAL 45 68.142 6.053 6.053
311 3HG2 VAL 45 HG22 VAL 45 68.255 5.001 5.001
312 H MET 46 HN MET 46 70.647 2.167 2.167
313 HA MET 46 HA MET 46 68.068 1.152 1.152
314 1HB MET 46 HB2 MET 46 68.921 -0.944 -0.944
315 2HB MET 46 HB1 MET 46 69.300 0.375 0.375
316 1HG MET 46 HG2 MET 46 71.564 0.525 0.525
317 2HG MET 46 HG1 MET 46 71.160 -1.019 -1.019
318 1HE MET 46 HE2 MET 46 69.686 -2.573 -2.573
319 2HE MET 46 HE1 MET 46 70.404 -3.276 -3.276
320 3HE MET 46 HE3 MET 46 71.214 -3.443 -3.443
321 H ARG 47 HN ARG 47 71.481 0.744 0.744
322 HA ARG 47 HA ARG 47 70.895 -1.018 -1.018
323 1HB ARG 47 HB2 ARG 47 73.085 -0.538 -0.538
324 2HB ARG 47 HB1 ARG 47 73.236 0.880 0.880
325 1HG ARG 47 HG2 ARG 47 73.240 -0.490 -0.490
326 2HG ARG 47 HG1 ARG 47 72.857 -1.934 -1.934
327 1HD ARG 47 HD2 ARG 47 75.192 -2.120 -2.120
328 2HD ARG 47 HD1 ARG 47 75.073 -1.330 -1.330
329 HE ARG 47 HE ARG 47 75.122 0.854 0.854
330 1HH1 ARG 47 HH1 ARG 47 75.946 -0.379 -0.379
331 2HH1 ARG 47 HH1 ARG 47 77.674 -0.405 -0.405
332 1HH2 ARG 47 HH2 ARG 47 77.751 0.084 0.084
333 2HH2 ARG 47 HH2 ARG 47 78.696 -0.142 -0.142
334 H MET 48 HN MET 48 70.711 2.435 2.435
335 HA MET 48 HA MET 48 70.876 3.119 3.119
336 1HB MET 48 HB2 MET 48 70.281 4.433 4.433
337 2HB MET 48 HB1 MET 48 69.740 5.257 5.257
338 1HG MET 48 HG2 MET 48 72.544 4.191 4.191
339 2HG MET 48 HG1 MET 48 72.156 5.720 5.720
340 1HE MET 48 HE3 MET 48 70.422 7.145 7.145
341 2HE MET 48 HE2 MET 48 70.401 7.691 7.691
342 3HE MET 48 HE1 MET 48 71.737 8.151 8.151
343 H LEU 49 HN LEU 49 68.482 1.670 1.670
344 HA LEU 49 HA LEU 49 66.195 2.825 2.825
345 1HB LEU 49 HB2 LEU 49 66.423 0.688 0.688
346 2HB LEU 49 HB1 LEU 49 64.915 1.413 1.413
347 HG LEU 49 HG LEU 49 67.198 3.045 3.045
348 HD1 LEU 49 HD1 LEU 49 65.828 1.220 1.220
349 HD1 LEU 49 HD1 LEU 49 66.427 2.745 2.745
350 HD1 LEU 49 HD1 LEU 49 64.749 2.609 2.609
351 HD2 LEU 49 HD2 LEU 49 65.872 4.614 4.614
352 HD2 LEU 49 HD2 LEU 49 64.459 3.556 3.556
353 HD2 LEU 49 HD2 LEU 49 64.899 4.421 4.421
354 H GLY 50 HN GLY 50 67.570 -0.454 -0.454
355 1HA GLY 50 HA2 GLY 50 67.501 -1.287 -1.287
356 2HA GLY 50 HA1 GLY 50 65.918 -1.679 -1.679
357 H GLN 51 HN GLN 51 68.822 -1.780 -1.780
358 HA GLN 51 HA GLN 51 68.727 -4.772 -4.772
359 1HB GLN 51 HB2 GLN 51 69.302 -4.475 -4.475
360 2HB GLN 51 HB1 GLN 51 67.631 -4.331 -4.331
361 1HG GLN 51 HG2 GLN 51 69.242 -1.839 -1.839
362 2HG GLN 51 HG1 GLN 51 68.852 -2.464 -2.464
363 1HE2 GLN 51 HE22 GLN 51 65.531 -1.334 -1.334
364 2HE2 GLN 51 HE21 GLN 51 66.834 -1.855 -1.855
365 H ASN 52 HN ASN 52 70.813 -5.585 -5.585
366 HA ASN 52 HA ASN 52 73.148 -3.805 -3.805
367 1HB ASN 52 HB2 ASN 52 72.352 -6.237 -6.237
368 2HB ASN 52 HB1 ASN 52 74.068 -6.056 -6.056
369 HD2 ASN 52 HD2 ASN 52 72.761 -5.789 -5.789
370 HD2 ASN 52 HD2 ASN 52 73.109 -4.215 -4.215
371 HA PRO 53 HA PRO 53 73.497 -6.476 -6.476
372 1HB PRO 53 HB2 PRO 53 74.291 -4.466 -4.466
373 2HB PRO 53 HB1 PRO 53 72.585 -4.836 -4.836
374 1HG PRO 53 HG2 PRO 53 74.291 -2.672 -2.672
375 2HG PRO 53 HG1 PRO 53 72.582 -2.641 -2.641
376 1HD PRO 53 HD2 PRO 53 73.474 -2.844 -2.844
377 2HD PRO 53 HD1 PRO 53 71.896 -3.440 -3.440
378 H THR 54 HN THR 54 75.433 -7.582 -7.582
379 HA THR 54 HA THR 54 77.849 -6.646 -6.646
380 HB THR 54 HB THR 54 78.762 -8.584 -8.584
381 HG1 THR 54 HG1 THR 54 76.997 -9.877 -9.877
382 1HG2 THR 54 HG21 THR 54 77.282 -8.492 -8.492
383 2HG2 THR 54 HG23 THR 54 76.700 -9.888 -9.888
384 3HG2 THR 54 HG22 THR 54 78.415 -9.738 -9.738
385 H LYS 55 HN LYS 55 79.628 -5.558 -5.558
386 HA LYS 55 HA LYS 55 79.363 -3.780 -3.780
387 1HB LYS 55 HB2 LYS 55 81.170 -4.195 -4.195
388 2HB LYS 55 HB1 LYS 55 82.012 -5.043 -5.043
389 1HG LYS 55 HG2 LYS 55 82.472 -3.121 -3.121
390 2HG LYS 55 HG1 LYS 55 80.895 -2.420 -2.420
391 1HD LYS 55 HD2 LYS 55 82.105 -2.513 -2.513
392 2HD LYS 55 HD1 LYS 55 83.443 -2.097 -2.097
393 1HE LYS 55 HE2 LYS 55 80.872 -0.648 -0.648
394 2HE LYS 55 HE1 LYS 55 81.811 -0.208 -0.208
395 1HZ LYS 55 HZ2 LYS 55 83.276 -0.628 -0.628
396 2HZ LYS 55 HZ1 LYS 55 82.365 0.801 0.801
397 3HZ LYS 55 HZ3 LYS 55 83.579 0.468 0.468
398 H GLU 56 HN GLU 56 81.082 -6.933 -6.933
399 HA GLU 56 HA GLU 56 81.755 -7.034 -7.034
400 1HB GLU 56 HB2 GLU 56 80.968 -9.058 -9.058
401 2HB GLU 56 HB1 GLU 56 81.345 -9.589 -9.589
402 1HG GLU 56 HG2 GLU 56 83.470 -8.044 -8.044
403 2HG GLU 56 HG1 GLU 56 83.140 -8.329 -8.329
404 H GLU 57 HN GLU 57 78.605 -7.479 -7.479
405 HA GLU 57 HA GLU 57 77.335 -8.619 -8.619
406 1HB GLU 57 HB2 GLU 57 76.597 -7.693 -7.693
407 2HB GLU 57 HB1 GLU 57 75.301 -7.785 -7.785
408 1HG GLU 57 HG2 GLU 57 77.217 -10.057 -10.057
409 2HG GLU 57 HG1 GLU 57 75.615 -9.909 -9.909
410 H LEU 58 HN LEU 58 77.340 -5.411 -5.411
411 HA LEU 58 HA LEU 58 75.558 -4.061 -4.061
412 1HB LEU 58 HB2 LEU 58 78.056 -3.169 -3.169
413 2HB LEU 58 HB1 LEU 58 76.903 -2.050 -2.050
414 HG LEU 58 HG LEU 58 76.408 -4.013 -4.013
415 HD1 LEU 58 HD1 LEU 58 76.466 -1.025 -1.025
416 HD1 LEU 58 HD1 LEU 58 77.196 -2.022 -2.022
417 HD1 LEU 58 HD1 LEU 58 75.454 -1.747 -1.747
418 HD2 LEU 58 HD2 LEU 58 74.420 -4.262 -4.262
419 HD2 LEU 58 HD2 LEU 58 74.517 -2.644 -2.644
420 HD2 LEU 58 HD2 LEU 58 74.037 -2.854 -2.854
421 H ASP 59 HN ASP 59 79.104 -4.461 -4.461
422 HA ASP 59 HA ASP 59 79.525 -2.966 -2.966
423 1HB ASP 59 HB2 ASP 59 80.781 -5.351 -5.351
424 2HB ASP 59 HB1 ASP 59 81.377 -4.839 -4.839
425 H ALA 60 HN ALA 60 78.155 -6.187 -6.187
426 HA ALA 60 HA ALA 60 78.321 -6.937 -6.937
427 1HB ALA 60 HB3 ALA 60 78.254 -8.523 -8.523
428 2HB ALA 60 HB2 ALA 60 76.623 -7.970 -7.970
429 3HB ALA 60 HB1 ALA 60 76.930 -8.819 -8.819
430 H ILE 61 HN ILE 61 75.581 -6.009 -6.009
431 HA ILE 61 HA ILE 61 73.678 -5.822 -5.822
432 HB ILE 61 HB ILE 61 73.819 -4.850 -4.850
433 1HG1 ILE 61 HG12 ILE 61 71.683 -6.668 -6.668
434 2HG1 ILE 61 HG11 ILE 61 73.202 -7.319 -7.319
435 1HG2 ILE 61 HG21 ILE 61 71.877 -4.201 -4.201
436 2HG2 ILE 61 HG23 ILE 61 71.174 -4.724 -4.724
437 3HG2 ILE 61 HG22 ILE 61 72.247 -3.325 -3.325
438 HD1 ILE 61 HD1 ILE 61 74.061 -6.505 -6.505
439 HD1 ILE 61 HD1 ILE 61 73.354 -8.101 -8.101
440 HD1 ILE 61 HD1 ILE 61 72.367 -6.794 -6.794
441 H ILE 62 HN ILE 62 75.810 -3.491 -3.491
442 HA ILE 62 HA ILE 62 74.728 -1.071 -1.071
443 HB ILE 62 HB ILE 62 77.490 -2.037 -2.037
444 1HG1 ILE 62 HG12 ILE 62 75.575 -0.065 -0.065
445 2HG1 ILE 62 HG11 ILE 62 75.739 -1.757 -1.757
446 1HG2 ILE 62 HG23 ILE 62 76.642 0.599 0.599
447 2HG2 ILE 62 HG22 ILE 62 77.894 0.572 0.572
448 3HG2 ILE 62 HG21 ILE 62 78.130 -0.309 -0.309
449 HD1 ILE 62 HD1 ILE 62 77.747 -1.415 -1.415
450 HD1 ILE 62 HD1 ILE 62 77.148 0.238 0.238
451 HD1 ILE 62 HD1 ILE 62 78.261 -0.199 -0.199
452 H GLU 63 HN GLU 63 77.590 -2.786 -2.786
453 HA GLU 63 HA GLU 63 77.972 -1.425 -1.425
454 1HB GLU 63 HB2 GLU 63 78.755 -3.822 -3.822
455 2HB GLU 63 HB1 GLU 63 77.989 -4.341 -4.341
456 1HG GLU 63 HG2 GLU 63 79.460 -3.040 -3.040
457 2HG GLU 63 HG1 GLU 63 80.005 -2.094 -2.094
458 H GLU 64 HN GLU 64 75.374 -3.709 -3.709
459 HA GLU 64 HA GLU 64 74.372 -3.901 -3.901
460 1HB GLU 64 HB2 GLU 64 73.822 -5.678 -5.678
461 2HB GLU 64 HB1 GLU 64 73.455 -4.601 -4.601
462 1HG GLU 64 HG2 GLU 64 71.361 -3.989 -3.989
463 2HG GLU 64 HG1 GLU 64 71.791 -4.558 -4.558
464 H VAL 65 HN VAL 65 73.430 -2.020 -2.020
465 HA VAL 65 HA VAL 65 71.376 -0.543 -0.543
466 HB VAL 65 HB VAL 65 70.788 0.295 0.295
467 1HG1 VAL 65 HG12 VAL 65 71.828 -2.545 -2.545
468 2HG1 VAL 65 HG11 VAL 65 70.692 -1.798 -1.798
469 3HG1 VAL 65 HG13 VAL 65 70.227 -2.062 -2.062
470 1HG2 VAL 65 HG22 VAL 65 73.630 0.054 0.054
471 2HG2 VAL 65 HG21 VAL 65 72.441 0.916 0.916
472 3HG2 VAL 65 HG23 VAL 65 72.771 -0.788 -0.788
473 H ASP 66 HN ASP 66 74.706 -0.278 -0.278
474 HA ASP 66 HA ASP 66 75.090 2.516 2.516
475 1HB ASP 66 HB2 ASP 66 76.624 0.275 0.275
476 2HB ASP 66 HB1 ASP 66 76.975 1.032 1.032
477 H GLU 67 HN GLU 67 76.847 2.753 2.753
478 HA GLU 67 HA GLU 67 74.913 4.142 4.142
479 1HB GLU 67 HB2 GLU 67 76.897 4.817 4.817
480 2HB GLU 67 HB1 GLU 67 77.317 4.781 4.781
481 1HG GLU 67 HG2 GLU 67 78.008 2.298 2.298
482 2HG GLU 67 HG1 GLU 67 78.096 2.864 2.864
483 H ASP 68 HN ASP 68 74.077 1.491 1.491
484 HA ASP 68 HA ASP 68 75.166 0.104 0.104
485 1HB ASP 68 HB2 ASP 68 74.466 -1.011 -1.011
486 2HB ASP 68 HB1 ASP 68 72.803 -0.542 -0.542
487 H GLY 69 HN GLY 69 72.875 2.516 2.516
488 1HA GLY 69 HA2 GLY 69 71.896 2.445 2.445
489 2HA GLY 69 HA1 GLY 69 70.654 1.951 1.951
490 H SER 70 HN SER 70 71.325 3.634 3.634
491 HA SER 70 HA SER 70 70.682 6.321 6.321
492 1HB SER 70 HB2 SER 70 68.817 5.772 5.772
493 2HB SER 70 HB1 SER 70 69.719 4.695 4.695
494 HG SER 70 HG SER 70 68.957 6.792 6.792
495 H GLY 71 HN GLY 71 71.793 5.240 5.240
496 1HA GLY 71 HA2 GLY 71 74.461 6.147 6.147
497 2HA GLY 71 HA1 GLY 71 73.489 7.524 7.524
498 H THR 72 HN THR 72 72.614 7.523 7.523
499 HA THR 72 HA THR 72 73.861 5.679 5.679
500 HB THR 72 HB THR 72 72.879 7.194 7.194
501 HG1 THR 72 HG1 THR 72 71.120 8.277 8.277
502 1HG2 THR 72 HG21 THR 72 74.704 7.964 7.964
503 2HG2 THR 72 HG23 THR 72 73.421 9.079 9.079
504 3HG2 THR 72 HG22 THR 72 74.040 9.097 9.097
505 H ILE 73 HN ILE 73 71.365 5.951 5.951
506 HA ILE 73 HA ILE 73 69.912 3.599 3.599
507 HB ILE 73 HB ILE 73 71.201 3.535 3.535
508 1HG1 ILE 73 HG12 ILE 73 69.395 2.266 2.266
509 2HG1 ILE 73 HG11 ILE 73 68.229 2.919 2.919
510 1HG2 ILE 73 HG21 ILE 73 70.128 5.882 5.882
511 2HG2 ILE 73 HG23 ILE 73 68.804 4.897 4.897
512 3HG2 ILE 73 HG22 ILE 73 70.427 4.716 4.716
513 HD1 ILE 73 HD1 ILE 73 70.311 1.897 1.897
514 HD1 ILE 73 HD1 ILE 73 68.718 1.180 1.180
515 HD1 ILE 73 HD1 ILE 73 70.063 0.692 0.692
516 H ASP 74 HN ASP 74 67.524 3.549 3.549
517 HA ASP 74 HA ASP 74 66.356 6.315 6.315
518 1HB ASP 74 HB2 ASP 74 65.397 3.715 3.715
519 2HB ASP 74 HB1 ASP 74 64.591 5.277 5.277
520 H PHE 75 HN PHE 75 64.898 6.749 6.749
521 HA PHE 75 HA PHE 75 64.544 5.210 5.210
522 1HB PHE 75 HB2 PHE 75 63.804 7.600 7.600
523 2HB PHE 75 HB1 PHE 75 62.354 6.877 6.877
524 HD1 PHE 75 HD2 PHE 75 60.811 5.527 5.527
525 HD2 PHE 75 HD1 PHE 75 64.115 7.724 7.724
526 HE1 PHE 75 HE2 PHE 75 59.809 5.339 5.339
527 HE2 PHE 75 HE1 PHE 75 63.114 7.535 7.535
528 HZ PHE 75 HZ PHE 75 60.962 6.341 6.341
529 H GLU 76 HN GLU 76 62.608 5.073 5.073
530 HA GLU 76 HA GLU 76 60.676 3.162 3.162
531 1HB GLU 76 HB2 GLU 76 61.594 4.403 4.403
532 2HB GLU 76 HB1 GLU 76 60.858 2.812 2.812
533 1HG GLU 76 HG2 GLU 76 58.979 3.712 3.712
534 2HG GLU 76 HG1 GLU 76 59.641 5.307 5.307
535 H GLU 77 HN GLU 77 63.462 2.666 2.666
536 HA GLU 77 HA GLU 77 63.351 -0.210 -0.210
537 1HB GLU 77 HB2 GLU 77 64.366 0.960 0.960
538 2HB GLU 77 HB1 GLU 77 65.490 1.794 1.794
539 1HG GLU 77 HG2 GLU 77 66.647 -0.242 -0.242
540 2HG GLU 77 HG1 GLU 77 65.400 -1.219 -1.219
541 H PHE 78 HN PHE 78 64.769 2.227 2.227
542 HA PHE 78 HA PHE 78 66.738 0.512 0.512
543 1HB PHE 78 HB2 PHE 78 67.100 2.853 2.853
544 2HB PHE 78 HB1 PHE 78 65.433 3.181 3.181
545 HD1 PHE 78 HD1 PHE 78 68.596 1.594 1.594
546 HD2 PHE 78 HD2 PHE 78 64.817 3.328 3.328
547 HE1 PHE 78 HE1 PHE 78 69.248 1.527 1.527
548 HE2 PHE 78 HE2 PHE 78 65.468 3.260 3.260
549 HZ PHE 78 HZ PHE 78 67.684 2.359 2.359
550 H LEU 79 HN LEU 79 63.327 1.196 1.196
551 HA LEU 79 HA LEU 79 62.889 0.449 0.449
552 1HB LEU 79 HB2 LEU 79 61.385 0.207 0.207
553 2HB LEU 79 HB1 LEU 79 60.692 -0.499 -0.499
554 HG LEU 79 HG LEU 79 61.762 2.245 2.245
555 HD1 LEU 79 HD1 LEU 79 59.108 2.530 2.530
556 HD1 LEU 79 HD1 LEU 79 60.032 1.619 1.619
557 HD1 LEU 79 HD1 LEU 79 60.597 3.204 3.204
558 HD2 LEU 79 HD2 LEU 79 60.158 0.514 0.514
559 HD2 LEU 79 HD2 LEU 79 58.982 1.619 1.619
560 HD2 LEU 79 HD2 LEU 79 60.290 2.249 2.249
561 H VAL 80 HN VAL 80 63.500 -1.636 -1.636
562 HA VAL 80 HA VAL 80 62.864 -4.123 -4.123
563 HB VAL 80 HB VAL 80 63.048 -3.526 -3.526
564 1HG1 VAL 80 HG13 VAL 80 65.403 -2.600 -2.600
565 2HG1 VAL 80 HG12 VAL 80 65.945 -4.269 -4.269
566 3HG1 VAL 80 HG11 VAL 80 65.202 -3.726 -3.726
567 1HG2 VAL 80 HG22 VAL 80 63.704 -5.976 -5.976
568 2HG2 VAL 80 HG21 VAL 80 62.681 -5.758 -5.758
569 3HG2 VAL 80 HG23 VAL 80 64.424 -5.941 -5.941
570 H MET 81 HN MET 81 65.864 -2.258 -2.258
571 HA MET 81 HA MET 81 67.678 -4.210 -4.210
572 1HB MET 81 HB2 MET 81 67.577 -1.278 -1.278
573 2HB MET 81 HB1 MET 81 68.837 -1.838 -1.838
574 1HG MET 81 HG2 MET 81 69.907 -2.031 -2.031
575 2HG MET 81 HG1 MET 81 69.257 -3.656 -3.656
576 1HE MET 81 HE2 MET 81 68.666 -4.746 -4.746
577 2HE MET 81 HE1 MET 81 67.775 -4.306 -4.306
578 3HE MET 81 HE3 MET 81 69.474 -3.847 -3.847
579 H MET 82 HN MET 82 66.511 -1.245 -1.245
580 HA MET 82 HA MET 82 67.335 -1.869 -1.869
581 1HB MET 82 HB2 MET 82 65.234 -0.446 -0.446
582 2HB MET 82 HB1 MET 82 66.468 0.289 0.289
583 1HG MET 82 HG2 MET 82 65.071 0.404 0.404
584 2HG MET 82 HG1 MET 82 64.485 -1.238 -1.238
585 1HE MET 82 HE3 MET 82 64.961 1.683 1.683
586 2HE MET 82 HE2 MET 82 63.653 2.693 2.693
587 3HE MET 82 HE1 MET 82 63.483 1.891 1.891
588 H VAL 83 HN VAL 83 64.551 -3.086 -3.086
589 HA VAL 83 HA VAL 83 63.351 -4.381 -4.381
590 HB VAL 83 HB VAL 83 62.827 -4.434 -4.434
591 1HG1 VAL 83 HG12 VAL 83 61.962 -6.274 -6.274
592 2HG1 VAL 83 HG11 VAL 83 60.587 -5.220 -5.220
593 3HG1 VAL 83 HG13 VAL 83 61.353 -6.104 -6.104
594 1HG2 VAL 83 HG22 VAL 83 62.447 -2.366 -2.366
595 2HG2 VAL 83 HG21 VAL 83 61.295 -2.746 -2.746
596 3HG2 VAL 83 HG23 VAL 83 60.976 -3.264 -3.264
597 H ARG 84 HN ARG 84 64.674 -5.608 -5.608
598 HA ARG 84 HA ARG 84 64.717 -8.328 -8.328
599 1HB ARG 84 HB2 ARG 84 66.807 -6.496 -6.496
600 2HB ARG 84 HB1 ARG 84 66.856 -8.253 -8.253
601 1HG ARG 84 HG2 ARG 84 64.318 -6.810 -6.810
602 2HG ARG 84 HG1 ARG 84 65.656 -6.774 -6.774
603 1HD ARG 84 HD2 ARG 84 65.316 -8.941 -8.941
604 2HD ARG 84 HD1 ARG 84 65.164 -9.460 -9.460
605 HE ARG 84 HE ARG 84 62.904 -7.914 -7.914
606 1HH1 ARG 84 HH1 ARG 84 62.975 -9.707 -9.707
607 2HH1 ARG 84 HH1 ARG 84 62.039 -11.056 -11.056
608 1HH2 ARG 84 HH2 ARG 84 62.257 -10.177 -10.177
609 2HH2 ARG 84 HH2 ARG 84 61.634 -11.323 -11.323
610 H GLN 85 HN GLN 85 66.824 -5.908 -5.908
611 HA GLN 85 HA GLN 85 68.571 -7.900 -7.900
612 1HB GLN 85 HB2 GLN 85 69.161 -5.533 -5.533
613 2HB GLN 85 HB1 GLN 85 68.211 -4.956 -4.956
614 1HG GLN 85 HG2 GLN 85 70.632 -5.136 -5.136
615 2HG GLN 85 HG1 GLN 85 69.640 -6.195 -6.195
616 1HE2 GLN 85 HE22 GLN 85 71.641 -8.072 -8.072
617 2HE2 GLN 85 HE21 GLN 85 70.876 -6.587 -6.587
618 H MET 86 HN MET 86 66.347 -5.416 -5.416
619 HA MET 86 HA MET 86 66.262 -6.420 -6.420
620 1HB MET 86 HB2 MET 86 65.036 -4.423 -4.423
621 2HB MET 86 HB1 MET 86 63.754 -5.262 -5.262
622 1HG MET 86 HG2 MET 86 65.339 -4.985 -4.985
623 2HG MET 86 HG1 MET 86 66.097 -3.724 -3.724
624 1HE MET 86 HE2 MET 86 63.170 -5.263 -5.263
625 2HE MET 86 HE1 MET 86 62.044 -3.984 -3.984
626 3HE MET 86 HE3 MET 86 62.020 -4.651 -4.651
627 H LYS 87 HN LYS 87 64.824 -7.634 -7.634
628 HA LYS 87 HA LYS 87 62.486 -8.919 -8.919
629 1HB LYS 87 HB2 LYS 87 64.687 -9.442 -9.442
630 2HB LYS 87 HB1 LYS 87 63.538 -10.750 -10.750
631 1HG LYS 87 HG2 LYS 87 62.125 -8.247 -8.247
632 2HG LYS 87 HG1 LYS 87 63.175 -8.500 -8.500
633 1HD LYS 87 HD2 LYS 87 61.389 -9.734 -9.734
634 2HD LYS 87 HD1 LYS 87 62.157 -10.988 -10.988
635 1HE LYS 87 HE2 LYS 87 60.538 -10.893 -10.893
636 2HE LYS 87 HE1 LYS 87 60.307 -9.144 -9.144
637 1HZ LYS 87 HZ1 LYS 87 59.598 -11.002 -11.002
638 2HZ LYS 87 HZ3 LYS 87 58.504 -10.714 -10.714
639 3HZ LYS 87 HZ2 LYS 87 59.029 -9.428 -9.428
640 H GLU 88 HN GLU 88 65.833 -9.761 -9.761
641 HA GLU 88 HA GLU 88 65.179 -12.370 -12.370
642 1HB GLU 88 HB2 GLU 88 67.382 -11.205 -11.205
643 2HB GLU 88 HB1 GLU 88 67.717 -10.964 -10.964
644 1HG GLU 88 HG2 GLU 88 67.605 -13.302 -13.302
645 2HG GLU 88 HG1 GLU 88 66.886 -13.647 -13.647
646 H ASP 89 HN ASP 89 65.747 -9.072 -9.072
647 HA ASP 89 HA ASP 89 65.625 -9.915 -9.915
648 1HB ASP 89 HB2 ASP 89 67.158 -8.142 -8.142
649 2HB ASP 89 HB1 ASP 89 65.726 -7.150 -7.150
650 H ALA 90 HN ALA 90 63.557 -8.482 -8.482
651 HA ALA 90 HA ALA 90 61.541 -7.401 -7.401
652 1HB ALA 90 HB2 ALA 90 62.076 -7.136 -7.136
653 2HB ALA 90 HB1 ALA 90 60.990 -8.514 -8.514
654 3HB ALA 90 HB3 ALA 90 60.406 -7.016 -7.016
Start of MODEL 23
1 1H ALA 1 HT3 ALA 1 62.047 -1.004 -1.004
2 2H ALA 1 HT2 ALA 1 62.706 -0.305 -0.305
3 3H ALA 1 HT1 ALA 1 61.328 -1.292 -1.292
4 HA ALA 1 HA ALA 1 63.162 -2.603 -2.603
5 1HB ALA 1 HB2 ALA 1 64.484 -0.843 -0.843
6 2HB ALA 1 HB1 ALA 1 64.692 -2.417 -2.417
7 3HB ALA 1 HB3 ALA 1 65.230 -2.169 -2.169
8 H SER 2 HN SER 2 64.179 -4.614 -4.614
9 HA SER 2 HA SER 2 61.822 -5.998 -5.998
10 1HB SER 2 HB2 SER 2 64.744 -6.534 -6.534
11 2HB SER 2 HB1 SER 2 63.821 -7.644 -7.644
12 HG SER 2 HG SER 2 63.002 -8.427 -8.427
13 H MET 3 HN MET 3 64.057 -3.848 -3.848
14 HA MET 3 HA MET 3 64.230 -4.971 -4.971
15 1HB MET 3 HB2 MET 3 64.995 -2.578 -2.578
16 2HB MET 3 HB1 MET 3 64.548 -2.211 -2.211
17 1HG MET 3 HG2 MET 3 66.135 -4.587 -4.587
18 2HG MET 3 HG1 MET 3 66.974 -3.379 -3.379
19 1HE MET 3 HE2 MET 3 68.390 -1.978 -1.978
20 2HE MET 3 HE1 MET 3 68.735 -1.359 -1.359
21 3HE MET 3 HE3 MET 3 69.061 -3.053 -3.053
22 H THR 4 HN THR 4 61.807 -3.138 -3.138
23 HA THR 4 HA THR 4 60.461 -1.851 -1.851
24 HB THR 4 HB THR 4 60.110 -1.598 -1.598
25 HG1 THR 4 HG1 THR 4 57.619 -2.281 -2.281
26 1HG2 THR 4 HG22 THR 4 59.899 -4.286 -4.286
27 2HG2 THR 4 HG21 THR 4 58.189 -3.864 -3.864
28 3HG2 THR 4 HG23 THR 4 59.185 -3.252 -3.252
29 H ASP 5 HN ASP 5 60.822 -5.198 -5.198
30 HA ASP 5 HA ASP 5 58.331 -6.116 -6.116
31 1HB ASP 5 HB2 ASP 5 59.729 -7.300 -7.300
32 2HB ASP 5 HB1 ASP 5 60.945 -7.575 -7.575
33 H GLN 6 HN GLN 6 61.763 -6.170 -6.170
34 HA GLN 6 HA GLN 6 61.332 -7.204 -7.204
35 1HB GLN 6 HB2 GLN 6 63.429 -6.291 -6.291
36 2HB GLN 6 HB1 GLN 6 63.431 -5.173 -5.173
37 1HG GLN 6 HG2 GLN 6 64.624 -6.797 -6.797
38 2HG GLN 6 HG1 GLN 6 63.055 -7.575 -7.575
39 1HE2 GLN 6 HE22 GLN 6 65.782 -9.203 -9.203
40 2HE2 GLN 6 HE21 GLN 6 66.111 -7.761 -7.761
41 H GLN 7 HN GLN 7 60.566 -4.093 -4.093
42 HA GLN 7 HA GLN 7 60.550 -2.694 -2.694
43 1HB GLN 7 HB2 GLN 7 61.005 -1.805 -1.805
44 2HB GLN 7 HB1 GLN 7 59.250 -1.813 -1.813
45 1HG GLN 7 HG2 GLN 7 60.075 -0.612 -0.612
46 2HG GLN 7 HG1 GLN 7 60.775 0.226 0.226
47 1HE2 GLN 7 HE22 GLN 7 57.515 1.111 1.111
48 2HE2 GLN 7 HE21 GLN 7 59.043 0.588 0.588
49 H ALA 8 HN ALA 8 58.500 -4.909 -4.909
50 HA ALA 8 HA ALA 8 55.926 -3.747 -3.747
51 1HB ALA 8 HB2 ALA 8 56.831 -5.711 -5.711
52 2HB ALA 8 HB1 ALA 8 56.230 -6.677 -6.677
53 3HB ALA 8 HB3 ALA 8 55.148 -5.564 -5.564
54 H GLU 9 HN GLU 9 57.687 -6.611 -6.611
55 HA GLU 9 HA GLU 9 56.065 -6.573 -6.573
56 1HB GLU 9 HB2 GLU 9 56.889 -8.597 -8.597
57 2HB GLU 9 HB1 GLU 9 58.480 -8.272 -8.272
58 1HG GLU 9 HG2 GLU 9 57.881 -9.024 -9.024
59 2HG GLU 9 HG1 GLU 9 56.276 -8.297 -8.297
60 H ALA 10 HN ALA 10 58.740 -4.867 -4.867
61 HA ALA 10 HA ALA 10 60.366 -4.980 -4.980
62 1HB ALA 10 HB2 ALA 10 60.241 -3.358 -3.358
63 2HB ALA 10 HB1 ALA 10 61.327 -2.876 -2.876
64 3HB ALA 10 HB3 ALA 10 61.510 -4.458 -4.458
65 H ARG 11 HN ARG 11 57.797 -2.918 -2.918
66 HA ARG 11 HA ARG 11 57.998 -1.181 -1.181
67 1HB ARG 11 HB2 ARG 11 56.127 0.018 0.018
68 2HB ARG 11 HB1 ARG 11 57.850 0.344 0.344
69 1HG ARG 11 HG2 ARG 11 56.965 -0.084 -0.084
70 2HG ARG 11 HG1 ARG 11 58.010 -1.425 -1.425
71 1HD ARG 11 HD2 ARG 11 55.883 -2.232 -2.232
72 2HD ARG 11 HD1 ARG 11 56.007 -2.736 -2.736
73 HE ARG 11 HE ARG 11 54.396 -1.039 -1.039
74 1HH1 ARG 11 HH1 ARG 11 54.784 1.297 1.297
75 2HH1 ARG 11 HH1 ARG 11 53.649 1.227 1.227
76 1HH2 ARG 11 HH2 ARG 11 53.104 -2.184 -2.184
77 2HH2 ARG 11 HH2 ARG 11 52.698 -0.744 -0.744
78 H ALA 12 HN ALA 12 56.224 -3.785 -3.785
79 HA ALA 12 HA ALA 12 53.711 -3.099 -3.099
80 1HB ALA 12 HB1 ALA 12 54.422 -4.531 -4.531
81 2HB ALA 12 HB3 ALA 12 53.996 -5.787 -5.787
82 3HB ALA 12 HB2 ALA 12 52.829 -4.527 -4.527
83 H PHE 13 HN PHE 13 56.586 -5.048 -5.048
84 HA PHE 13 HA PHE 13 55.672 -6.955 -6.955
85 1HB PHE 13 HB2 PHE 13 57.781 -7.326 -7.326
86 2HB PHE 13 HB1 PHE 13 58.264 -5.641 -5.641
87 HD1 PHE 13 HD1 PHE 13 57.897 -8.882 -8.882
88 HD2 PHE 13 HD2 PHE 13 59.124 -4.784 -4.784
89 HE1 PHE 13 HE1 PHE 13 59.029 -9.425 -9.425
90 HE2 PHE 13 HE2 PHE 13 60.257 -5.327 -5.327
91 HZ PHE 13 HZ PHE 13 60.209 -7.648 -7.648
92 H LEU 14 HN LEU 14 56.612 -3.563 -3.563
93 HA LEU 14 HA LEU 14 56.265 -3.771 -3.771
94 1HB LEU 14 HB2 LEU 14 57.358 -1.472 -1.472
95 2HB LEU 14 HB1 LEU 14 58.355 -2.808 -2.808
96 HG LEU 14 HG LEU 14 56.653 -1.664 -1.664
97 HD1 LEU 14 HD1 LEU 14 58.898 0.052 0.052
98 HD1 LEU 14 HD1 LEU 14 57.195 0.358 0.358
99 HD1 LEU 14 HD1 LEU 14 57.789 0.445 0.445
100 HD2 LEU 14 HD2 LEU 14 59.422 -2.656 -2.656
101 HD2 LEU 14 HD2 LEU 14 59.217 -1.460 -1.460
102 HD2 LEU 14 HD2 LEU 14 58.307 -2.970 -2.970
103 H SER 15 HN SER 15 54.590 -2.665 -2.665
104 HA SER 15 HA SER 15 52.265 -1.886 -1.886
105 1HB SER 15 HB2 SER 15 51.486 -1.239 -1.239
106 2HB SER 15 HB1 SER 15 52.664 -2.509 -2.509
107 HG SER 15 HG SER 15 54.099 -1.021 -1.021
108 H GLU 16 HN GLU 16 51.327 0.420 0.420
109 HA GLU 16 HA GLU 16 52.966 2.257 2.257
110 1HB GLU 16 HB2 GLU 16 50.412 2.045 2.045
111 2HB GLU 16 HB1 GLU 16 50.577 2.945 2.945
112 1HG GLU 16 HG2 GLU 16 51.297 4.885 4.885
113 2HG GLU 16 HG1 GLU 16 51.858 4.005 4.005
114 H GLU 17 HN GLU 17 52.184 2.022 2.022
115 HA GLU 17 HA GLU 17 53.261 4.437 4.437
116 1HB GLU 17 HB2 GLU 17 53.399 1.642 1.642
117 2HB GLU 17 HB1 GLU 17 53.587 3.138 3.138
118 1HG GLU 17 HG2 GLU 17 51.348 3.694 3.694
119 2HG GLU 17 HG1 GLU 17 51.147 2.824 2.824
120 H MET 18 HN MET 18 54.966 1.363 1.363
121 HA MET 18 HA MET 18 57.564 2.243 2.243
122 1HB MET 18 HB2 MET 18 56.816 -0.104 -0.104
123 2HB MET 18 HB1 MET 18 56.735 0.196 0.196
124 1HG MET 18 HG2 MET 18 58.902 -0.418 -0.418
125 2HG MET 18 HG1 MET 18 59.281 1.084 1.084
126 1HE MET 18 HE2 MET 18 57.677 0.705 0.705
127 2HE MET 18 HE1 MET 18 58.590 -0.168 -0.168
128 3HE MET 18 HE3 MET 18 59.331 1.188 1.188
129 H ILE 19 HN ILE 19 56.091 2.066 2.066
130 HA ILE 19 HA ILE 19 58.135 2.994 2.994
131 HB ILE 19 HB ILE 19 55.174 3.595 3.595
132 1HG1 ILE 19 HG12 ILE 19 56.894 1.908 1.908
133 2HG1 ILE 19 HG11 ILE 19 55.929 1.284 1.284
134 1HG2 ILE 19 HG23 ILE 19 57.193 4.990 4.990
135 2HG2 ILE 19 HG22 ILE 19 56.139 4.083 4.083
136 3HG2 ILE 19 HG21 ILE 19 55.451 5.259 5.259
137 HD1 ILE 19 HD1 ILE 19 53.890 2.245 2.245
138 HD1 ILE 19 HD1 ILE 19 54.675 1.024 1.024
139 HD1 ILE 19 HD1 ILE 19 54.883 2.736 2.736
140 H ALA 20 HN ALA 20 56.165 4.910 4.910
141 HA ALA 20 HA ALA 20 57.224 7.486 7.486
142 1HB ALA 20 HB1 ALA 20 55.553 6.307 6.307
143 2HB ALA 20 HB3 ALA 20 56.284 7.880 7.880
144 3HB ALA 20 HB2 ALA 20 55.208 7.673 7.673
145 H GLU 21 HN GLU 21 58.174 5.014 5.014
146 HA GLU 21 HA GLU 21 60.016 6.571 6.571
147 1HB GLU 21 HB2 GLU 21 59.280 4.453 4.453
148 2HB GLU 21 HB1 GLU 21 59.706 3.645 3.645
149 1HG GLU 21 HG2 GLU 21 61.855 3.348 3.348
150 2HG GLU 21 HG1 GLU 21 61.988 5.008 5.008
151 H PHE 22 HN PHE 22 60.399 4.680 4.680
152 HA PHE 22 HA PHE 22 63.276 5.189 5.189
153 1HB PHE 22 HB2 PHE 22 61.321 4.202 4.202
154 2HB PHE 22 HB1 PHE 22 63.060 3.911 3.911
155 HD1 PHE 22 HD2 PHE 22 62.886 3.627 3.627
156 HD2 PHE 22 HD1 PHE 22 60.941 1.730 1.730
157 HE1 PHE 22 HE2 PHE 22 62.509 1.599 1.599
158 HE2 PHE 22 HE1 PHE 22 60.565 -0.298 -0.298
159 HZ PHE 22 HZ PHE 22 61.350 -0.363 -0.363
160 H LYS 23 HN LYS 23 60.434 6.936 6.936
161 HA LYS 23 HA LYS 23 61.334 8.355 8.355
162 1HB LYS 23 HB2 LYS 23 59.250 8.632 8.632
163 2HB LYS 23 HB1 LYS 23 59.565 10.027 10.027
164 1HG LYS 23 HG2 LYS 23 58.907 7.240 7.240
165 2HG LYS 23 HG1 LYS 23 57.767 8.584 8.584
166 1HD LYS 23 HD2 LYS 23 60.239 9.346 9.346
167 2HD LYS 23 HD1 LYS 23 59.459 7.978 7.978
168 1HE LYS 23 HE2 LYS 23 57.790 10.345 10.345
169 2HE LYS 23 HE1 LYS 23 58.727 10.407 10.407
170 1HZ LYS 23 HZ1 LYS 23 57.753 7.999 7.999
171 2HZ LYS 23 HZ3 LYS 23 56.526 8.618 8.618
172 3HZ LYS 23 HZ2 LYS 23 56.861 9.356 9.356
173 H ALA 24 HN ALA 24 60.885 9.765 9.765
174 HA ALA 24 HA ALA 24 62.593 11.997 11.997
175 1HB ALA 24 HB2 ALA 24 61.248 10.579 10.579
176 2HB ALA 24 HB1 ALA 24 62.673 11.492 11.492
177 3HB ALA 24 HB3 ALA 24 61.343 12.309 12.309
178 H ALA 25 HN ALA 25 63.292 8.705 8.705
179 HA ALA 25 HA ALA 25 65.986 9.201 9.201
180 1HB ALA 25 HB2 ALA 25 64.402 7.237 7.237
181 2HB ALA 25 HB1 ALA 25 64.845 6.639 6.639
182 3HB ALA 25 HB3 ALA 25 66.078 6.808 6.808
183 H PHE 26 HN PHE 26 64.604 8.183 8.183
184 HA PHE 26 HA PHE 26 67.131 7.730 7.730
185 1HB PHE 26 HB2 PHE 26 64.896 6.848 6.848
186 2HB PHE 26 HB1 PHE 26 64.410 8.489 8.489
187 HD1 PHE 26 HD1 PHE 26 66.697 5.695 5.695
188 HD2 PHE 26 HD2 PHE 26 65.229 9.559 9.559
189 HE1 PHE 26 HE1 PHE 26 67.757 5.424 5.424
190 HE2 PHE 26 HE2 PHE 26 66.290 9.288 9.288
191 HZ PHE 26 HZ PHE 26 67.554 7.220 7.220
192 H ASP 27 HN ASP 27 64.941 10.542 10.542
193 HA ASP 27 HA ASP 27 66.359 12.231 12.231
194 1HB ASP 27 HB2 ASP 27 64.550 12.704 12.704
195 2HB ASP 27 HB1 ASP 27 65.115 14.016 14.016
196 H MET 28 HN MET 28 67.272 11.064 11.064
197 HA MET 28 HA MET 28 68.701 13.317 13.317
198 1HB MET 28 HB2 MET 28 68.917 10.309 10.309
199 2HB MET 28 HB1 MET 28 69.916 11.414 11.414
200 1HG MET 28 HG2 MET 28 66.950 11.849 11.849
201 2HG MET 28 HG1 MET 28 67.602 10.572 10.572
202 1HE MET 28 HE2 MET 28 66.256 11.811 11.811
203 2HE MET 28 HE1 MET 28 67.610 11.485 11.485
204 3HE MET 28 HE3 MET 28 66.865 13.088 13.088
205 H PHE 29 HN PHE 29 69.415 11.084 11.084
206 HA PHE 29 HA PHE 29 72.203 12.194 12.194
207 1HB PHE 29 HB2 PHE 29 71.383 9.590 9.590
208 2HB PHE 29 HB1 PHE 29 72.950 10.066 10.066
209 HD1 PHE 29 HD1 PHE 29 73.317 10.130 10.130
210 HD2 PHE 29 HD2 PHE 29 69.682 8.627 8.627
211 HE1 PHE 29 HE1 PHE 29 72.735 9.057 9.057
212 HE2 PHE 29 HE2 PHE 29 69.100 7.554 7.554
213 HZ PHE 29 HZ PHE 29 70.626 7.768 7.768
214 H ASP 30 HN ASP 30 69.866 13.448 13.448
215 HA ASP 30 HA ASP 30 69.524 12.753 12.753
216 1HB ASP 30 HB2 ASP 30 68.569 15.069 15.069
217 2HB ASP 30 HB1 ASP 30 67.961 14.132 14.132
218 H ALA 31 HN ALA 31 71.797 12.418 12.418
219 HA ALA 31 HA ALA 31 73.766 14.520 14.520
220 1HB ALA 31 HB2 ALA 31 73.825 11.901 11.901
221 2HB ALA 31 HB1 ALA 31 73.676 12.405 12.405
222 3HB ALA 31 HB3 ALA 31 75.045 12.955 12.955
223 H ASP 32 HN ASP 32 71.242 13.616 13.616
224 HA ASP 32 HA ASP 32 72.085 15.896 15.896
225 1HB ASP 32 HB2 ASP 32 71.796 13.340 13.340
226 2HB ASP 32 HB1 ASP 32 70.095 13.794 13.794
227 H GLY 33 HN GLY 33 69.283 14.395 14.395
228 1HA GLY 33 HA2 GLY 33 67.478 15.653 15.653
229 2HA GLY 33 HA1 GLY 33 67.947 17.042 17.042
230 H GLY 34 HN GLY 34 67.670 13.858 13.858
231 1HA GLY 34 HA2 GLY 34 65.173 14.771 14.771
232 2HA GLY 34 HA1 GLY 34 66.434 13.853 13.853
233 H GLY 35 HN GLY 35 65.816 12.969 12.969
234 1HA GLY 35 HA2 GLY 35 64.458 11.229 11.229
235 2HA GLY 35 HA1 GLY 35 63.839 10.904 10.904
236 H ASP 36 HN ASP 36 67.274 11.165 11.165
237 HA ASP 36 HA ASP 36 67.694 8.281 8.281
238 1HB ASP 36 HB2 ASP 36 68.871 8.172 8.172
239 2HB ASP 36 HB1 ASP 36 67.126 8.410 8.410
240 H ILE 37 HN ILE 37 69.496 8.163 8.163
241 HA ILE 37 HA ILE 37 71.382 10.451 10.451
242 HB ILE 37 HB ILE 37 72.121 9.383 9.383
243 1HG1 ILE 37 HG12 ILE 37 70.468 7.030 7.030
244 2HG1 ILE 37 HG11 ILE 37 72.219 7.070 7.070
245 1HG2 ILE 37 HG21 ILE 37 69.905 10.570 10.570
246 2HG2 ILE 37 HG23 ILE 37 69.122 9.007 9.007
247 3HG2 ILE 37 HG22 ILE 37 70.032 9.327 9.327
248 HD1 ILE 37 HD1 ILE 37 72.023 6.605 6.605
249 HD1 ILE 37 HD1 ILE 37 70.308 6.310 6.310
250 HD1 ILE 37 HD1 ILE 37 70.856 7.908 7.908
251 H SER 38 HN SER 38 73.774 9.878 9.878
252 HA SER 38 HA SER 38 74.661 8.615 8.615
253 1HB SER 38 HB2 SER 38 75.733 9.776 9.776
254 2HB SER 38 HB1 SER 38 76.707 8.400 8.400
255 HG SER 38 HG SER 38 76.383 10.868 10.868
256 H THR 39 HN THR 39 75.184 6.491 6.491
257 HA THR 39 HA THR 39 74.096 4.299 4.299
258 HB THR 39 HB THR 39 75.969 3.084 3.084
259 HG1 THR 39 HG1 THR 39 76.626 4.667 4.667
260 1HG2 THR 39 HG21 THR 39 73.769 4.829 4.829
261 2HG2 THR 39 HG23 THR 39 74.737 3.798 3.798
262 3HG2 THR 39 HG22 THR 39 73.768 3.082 3.082
263 H LYS 40 HN LYS 40 77.127 5.998 5.998
264 HA LYS 40 HA LYS 40 78.435 3.955 3.955
265 1HB LYS 40 HB2 LYS 40 78.737 6.889 6.889
266 2HB LYS 40 HB1 LYS 40 79.679 6.174 6.174
267 1HG LYS 40 HG2 LYS 40 81.043 5.071 5.071
268 2HG LYS 40 HG1 LYS 40 79.698 4.568 4.568
269 1HD LYS 40 HD2 LYS 40 79.700 7.186 7.186
270 2HD LYS 40 HD1 LYS 40 81.404 7.005 7.005
271 1HE LYS 40 HE2 LYS 40 79.875 5.415 5.415
272 2HE LYS 40 HE1 LYS 40 81.203 6.557 6.557
273 1HZ LYS 40 HZ1 LYS 40 82.317 4.999 4.999
274 2HZ LYS 40 HZ3 LYS 40 81.284 3.859 3.859
275 3HZ LYS 40 HZ2 LYS 40 82.432 4.675 4.675
276 H GLU 41 HN GLU 41 75.916 6.239 6.239
277 HA GLU 41 HA GLU 41 76.313 6.033 6.033
278 1HB GLU 41 HB2 GLU 41 76.015 8.248 8.248
279 2HB GLU 41 HB1 GLU 41 74.460 7.719 7.719
280 1HG GLU 41 HG2 GLU 41 73.521 8.449 8.449
281 2HG GLU 41 HG1 GLU 41 74.348 7.130 7.130
282 H LEU 42 HN LEU 42 74.575 4.572 4.572
283 HA LEU 42 HA LEU 42 71.992 4.119 4.119
284 1HB LEU 42 HB2 LEU 42 72.502 3.393 3.393
285 2HB LEU 42 HB1 LEU 42 73.950 2.536 2.536
286 HG LEU 42 HG LEU 42 71.536 1.542 1.542
287 HD1 LEU 42 HD1 LEU 42 71.380 2.130 2.130
288 HD1 LEU 42 HD1 LEU 42 70.154 1.419 1.419
289 HD1 LEU 42 HD1 LEU 42 71.338 0.385 0.385
290 HD2 LEU 42 HD2 LEU 42 74.074 0.626 0.626
291 HD2 LEU 42 HD2 LEU 42 72.766 -0.436 -0.436
292 HD2 LEU 42 HD2 LEU 42 73.034 -0.143 -0.143
293 H GLY 43 HN GLY 43 75.062 2.885 2.885
294 1HA GLY 43 HA2 GLY 43 73.960 0.628 0.628
295 2HA GLY 43 HA1 GLY 43 75.589 1.281 1.281
296 H THR 44 HN THR 44 74.445 4.033 4.033
297 HA THR 44 HA THR 44 74.242 3.869 3.869
298 HB THR 44 HB THR 44 73.955 6.053 6.053
299 HG1 THR 44 HG1 THR 44 76.011 6.241 6.241
300 1HG2 THR 44 HG21 THR 44 73.923 6.306 6.306
301 2HG2 THR 44 HG23 THR 44 73.996 7.651 7.651
302 3HG2 THR 44 HG22 THR 44 72.561 6.626 6.626
303 H VAL 45 HN VAL 45 71.938 5.082 5.082
304 HA VAL 45 HA VAL 45 69.707 5.575 5.575
305 HB VAL 45 HB VAL 45 69.781 5.940 5.940
306 1HG1 VAL 45 HG12 VAL 45 71.119 3.693 3.693
307 2HG1 VAL 45 HG11 VAL 45 69.519 2.992 2.992
308 3HG1 VAL 45 HG13 VAL 45 70.094 4.262 4.262
309 1HG2 VAL 45 HG21 VAL 45 67.656 4.291 4.291
310 2HG2 VAL 45 HG23 VAL 45 67.531 5.813 5.813
311 3HG2 VAL 45 HG22 VAL 45 67.659 4.292 4.292
312 H MET 46 HN MET 46 70.654 2.369 2.369
313 HA MET 46 HA MET 46 68.470 0.970 0.970
314 1HB MET 46 HB2 MET 46 69.660 -0.991 -0.991
315 2HB MET 46 HB1 MET 46 69.750 0.266 0.266
316 1HG MET 46 HG2 MET 46 71.988 0.927 0.927
317 2HG MET 46 HG1 MET 46 71.900 -0.441 -0.441
318 1HE MET 46 HE3 MET 46 70.865 -2.756 -2.756
319 2HE MET 46 HE2 MET 46 69.990 -2.047 -2.047
320 3HE MET 46 HE1 MET 46 71.207 -3.286 -3.286
321 H ARG 47 HN ARG 47 71.835 1.705 1.705
322 HA ARG 47 HA ARG 47 71.967 -0.015 -0.015
323 1HB ARG 47 HB2 ARG 47 73.517 2.144 2.144
324 2HB ARG 47 HB1 ARG 47 73.798 1.969 1.969
325 1HG ARG 47 HG2 ARG 47 73.752 -0.656 -0.656
326 2HG ARG 47 HG1 ARG 47 74.691 0.267 0.267
327 1HD ARG 47 HD2 ARG 47 76.400 0.653 0.653
328 2HD ARG 47 HD1 ARG 47 75.293 0.827 0.827
329 HE ARG 47 HE ARG 47 75.121 -1.863 -1.863
330 1HH1 ARG 47 HH2 ARG 47 78.070 -0.398 -0.398
331 2HH1 ARG 47 HH2 ARG 47 78.710 -1.287 -1.287
332 1HH2 ARG 47 HH1 ARG 47 75.664 -2.708 -2.708
333 2HH2 ARG 47 HH1 ARG 47 77.349 -2.595 -2.595
334 H MET 48 HN MET 48 71.251 3.451 3.451
335 HA MET 48 HA MET 48 70.839 4.013 4.013
336 1HB MET 48 HB2 MET 48 70.406 5.325 5.325
337 2HB MET 48 HB1 MET 48 69.554 5.996 5.996
338 1HG MET 48 HG2 MET 48 72.526 5.436 5.436
339 2HG MET 48 HG1 MET 48 71.853 6.992 6.992
340 1HE MET 48 HE3 MET 48 72.891 8.299 8.299
341 2HE MET 48 HE2 MET 48 72.566 8.627 8.627
342 3HE MET 48 HE1 MET 48 73.766 7.415 7.415
343 H LEU 49 HN LEU 49 68.971 2.426 2.426
344 HA LEU 49 HA LEU 49 66.330 3.112 3.112
345 1HB LEU 49 HB2 LEU 49 67.578 1.591 1.591
346 2HB LEU 49 HB1 LEU 49 66.145 0.793 0.793
347 HG LEU 49 HG LEU 49 64.741 2.609 2.609
348 HD1 LEU 49 HD1 LEU 49 67.178 4.153 4.153
349 HD1 LEU 49 HD1 LEU 49 65.494 4.661 4.661
350 HD1 LEU 49 HD1 LEU 49 66.300 4.688 4.688
351 HD2 LEU 49 HD2 LEU 49 66.166 1.408 1.408
352 HD2 LEU 49 HD2 LEU 49 66.561 3.100 3.100
353 HD2 LEU 49 HD2 LEU 49 64.877 2.574 2.574
354 H GLY 50 HN GLY 50 68.581 0.356 0.356
355 1HA GLY 50 HA2 GLY 50 68.518 -0.623 -0.623
356 2HA GLY 50 HA1 GLY 50 66.784 -0.783 -0.783
357 H GLN 51 HN GLN 51 69.602 -1.490 -1.490
358 HA GLN 51 HA GLN 51 68.623 -4.323 -4.323
359 1HB GLN 51 HB2 GLN 51 69.710 -2.592 -2.592
360 2HB GLN 51 HB1 GLN 51 69.075 -4.229 -4.229
361 1HG GLN 51 HG2 GLN 51 66.861 -3.536 -3.536
362 2HG GLN 51 HG1 GLN 51 67.406 -1.974 -1.974
363 1HE2 GLN 51 HE22 GLN 51 66.607 -0.683 -0.683
364 2HE2 GLN 51 HE21 GLN 51 66.245 -0.668 -0.668
365 H ASN 52 HN ASN 52 70.626 -5.289 -5.289
366 HA ASN 52 HA ASN 52 73.231 -4.571 -4.571
367 1HB ASN 52 HB2 ASN 52 71.789 -7.232 -7.232
368 2HB ASN 52 HB1 ASN 52 73.528 -7.101 -7.101
369 HD2 ASN 52 HD2 ASN 52 70.775 -7.375 -7.375
370 HD2 ASN 52 HD2 ASN 52 71.176 -6.446 -6.446
371 HA PRO 53 HA PRO 53 73.329 -5.532 -5.532
372 1HB PRO 53 HB2 PRO 53 74.671 -3.258 -3.258
373 2HB PRO 53 HB1 PRO 53 72.902 -3.335 -3.335
374 1HG PRO 53 HG2 PRO 53 74.894 -2.247 -2.247
375 2HG PRO 53 HG1 PRO 53 73.299 -1.624 -1.624
376 1HD PRO 53 HD2 PRO 53 73.772 -3.004 -3.004
377 2HD PRO 53 HD1 PRO 53 72.202 -3.005 -3.005
378 H THR 54 HN THR 54 74.894 -7.178 -7.178
379 HA THR 54 HA THR 54 77.566 -6.724 -6.724
380 HB THR 54 HB THR 54 77.844 -9.041 -9.041
381 HG1 THR 54 HG1 THR 54 75.515 -9.832 -9.832
382 1HG2 THR 54 HG21 THR 54 76.692 -8.218 -8.218
383 2HG2 THR 54 HG23 THR 54 75.584 -9.432 -9.432
384 3HG2 THR 54 HG22 THR 54 77.282 -9.834 -9.834
385 H LYS 55 HN LYS 55 79.473 -6.356 -6.356
386 HA LYS 55 HA LYS 55 79.544 -4.800 -4.800
387 1HB LYS 55 HB2 LYS 55 81.361 -5.952 -5.952
388 2HB LYS 55 HB1 LYS 55 81.573 -6.978 -6.978
389 1HG LYS 55 HG2 LYS 55 81.871 -4.938 -4.938
390 2HG LYS 55 HG1 LYS 55 81.751 -3.951 -3.951
391 1HD LYS 55 HD2 LYS 55 83.913 -4.324 -4.324
392 2HD LYS 55 HD1 LYS 55 83.670 -6.069 -6.069
393 1HE LYS 55 HE2 LYS 55 84.826 -6.116 -6.116
394 2HE LYS 55 HE1 LYS 55 83.629 -5.028 -5.028
395 1HZ LYS 55 HZ3 LYS 55 84.801 -3.216 -3.216
396 2HZ LYS 55 HZ2 LYS 55 86.078 -4.322 -4.322
397 3HZ LYS 55 HZ1 LYS 55 85.606 -3.808 -3.808
398 H GLU 56 HN GLU 56 79.982 -8.364 -8.364
399 HA GLU 56 HA GLU 56 79.953 -8.748 -8.748
400 1HB GLU 56 HB2 GLU 56 78.598 -10.421 -10.421
401 2HB GLU 56 HB1 GLU 56 79.150 -11.005 -11.005
402 1HG GLU 56 HG2 GLU 56 81.407 -9.770 -9.770
403 2HG GLU 56 HG1 GLU 56 80.691 -10.487 -10.487
404 H GLU 57 HN GLU 57 77.116 -8.533 -8.533
405 HA GLU 57 HA GLU 57 75.178 -8.827 -8.827
406 1HB GLU 57 HB2 GLU 57 75.076 -7.832 -7.832
407 2HB GLU 57 HB1 GLU 57 73.638 -8.052 -8.052
408 1HG GLU 57 HG2 GLU 57 75.652 -10.210 -10.210
409 2HG GLU 57 HG1 GLU 57 74.036 -10.045 -10.045
410 H LEU 58 HN LEU 58 76.306 -6.019 -6.019
411 HA LEU 58 HA LEU 58 74.750 -4.032 -4.032
412 1HB LEU 58 HB2 LEU 58 75.844 -3.542 -3.542
413 2HB LEU 58 HB1 LEU 58 77.407 -4.082 -4.082
414 HG LEU 58 HG LEU 58 77.558 -2.195 -2.195
415 HD1 LEU 58 HD1 LEU 58 74.677 -1.819 -1.819
416 HD1 LEU 58 HD1 LEU 58 75.391 -1.847 -1.847
417 HD1 LEU 58 HD1 LEU 58 75.626 -0.445 -0.445
418 HD2 LEU 58 HD2 LEU 58 76.453 -1.035 -1.035
419 HD2 LEU 58 HD2 LEU 58 77.799 -0.448 -0.448
420 HD2 LEU 58 HD2 LEU 58 77.980 -1.919 -1.919
421 H ASP 59 HN ASP 59 77.980 -5.350 -5.350
422 HA ASP 59 HA ASP 59 78.501 -3.557 -3.557
423 1HB ASP 59 HB2 ASP 59 79.873 -5.413 -5.413
424 2HB ASP 59 HB1 ASP 59 79.714 -6.244 -6.244
425 H ALA 60 HN ALA 60 76.754 -6.583 -6.583
426 HA ALA 60 HA ALA 60 76.682 -7.246 -7.246
427 1HB ALA 60 HB1 ALA 60 75.934 -8.345 -8.345
428 2HB ALA 60 HB3 ALA 60 74.482 -8.312 -8.312
429 3HB ALA 60 HB2 ALA 60 75.926 -9.150 -9.150
430 H ILE 61 HN ILE 61 74.418 -5.655 -5.655
431 HA ILE 61 HA ILE 61 72.311 -5.266 -5.266
432 HB ILE 61 HB ILE 61 73.071 -3.890 -3.890
433 1HG1 ILE 61 HG12 ILE 61 70.676 -5.486 -5.486
434 2HG1 ILE 61 HG11 ILE 61 71.991 -6.450 -6.450
435 1HG2 ILE 61 HG21 ILE 61 71.143 -3.137 -3.137
436 2HG2 ILE 61 HG23 ILE 61 70.282 -3.723 -3.723
437 3HG2 ILE 61 HG22 ILE 61 71.437 -2.398 -2.398
438 HD1 ILE 61 HD1 ILE 61 73.143 -5.055 -5.055
439 HD1 ILE 61 HD1 ILE 61 72.725 -6.768 -6.768
440 HD1 ILE 61 HD1 ILE 61 71.572 -5.593 -5.593
441 H ILE 62 HN ILE 62 74.904 -3.110 -3.110
442 HA ILE 62 HA ILE 62 74.268 -0.770 -0.770
443 HB ILE 62 HB ILE 62 76.875 -2.078 -2.078
444 1HG1 ILE 62 HG12 ILE 62 75.207 0.204 0.204
445 2HG1 ILE 62 HG11 ILE 62 75.423 -1.389 -1.389
446 1HG2 ILE 62 HG22 ILE 62 76.420 0.241 0.241
447 2HG2 ILE 62 HG21 ILE 62 77.342 0.654 0.654
448 3HG2 ILE 62 HG23 ILE 62 77.924 -0.607 -0.607
449 HD1 ILE 62 HD1 ILE 62 77.361 0.888 0.888
450 HD1 ILE 62 HD1 ILE 62 77.989 -0.761 -0.761
451 HD1 ILE 62 HD1 ILE 62 77.008 -0.170 -0.170
452 H GLU 63 HN GLU 63 76.795 -3.089 -3.089
453 HA GLU 63 HA GLU 63 77.199 -2.230 -2.230
454 1HB GLU 63 HB2 GLU 63 77.967 -4.331 -4.331
455 2HB GLU 63 HB1 GLU 63 76.882 -5.162 -5.162
456 1HG GLU 63 HG2 GLU 63 78.115 -4.176 -4.176
457 2HG GLU 63 HG1 GLU 63 79.221 -3.397 -3.397
458 H GLU 64 HN GLU 64 74.552 -4.302 -4.302
459 HA GLU 64 HA GLU 64 73.347 -4.848 -4.848
460 1HB GLU 64 HB2 GLU 64 72.692 -6.200 -6.200
461 2HB GLU 64 HB1 GLU 64 72.522 -4.826 -4.826
462 1HG GLU 64 HG2 GLU 64 70.412 -4.297 -4.297
463 2HG GLU 64 HG1 GLU 64 70.730 -4.923 -4.923
464 H VAL 65 HN VAL 65 72.493 -2.418 -2.418
465 HA VAL 65 HA VAL 65 70.609 -1.064 -1.064
466 HB VAL 65 HB VAL 65 70.276 0.348 0.348
467 1HG1 VAL 65 HG12 VAL 65 69.426 -1.965 -1.965
468 2HG1 VAL 65 HG11 VAL 65 70.961 -2.466 -2.466
469 3HG1 VAL 65 HG13 VAL 65 69.920 -1.333 -1.333
470 1HG2 VAL 65 HG21 VAL 65 72.877 -0.846 -0.846
471 2HG2 VAL 65 HG23 VAL 65 72.643 0.817 0.817
472 3HG2 VAL 65 HG22 VAL 65 71.835 0.240 0.240
473 H ASP 66 HN ASP 66 73.974 -1.052 -1.052
474 HA ASP 66 HA ASP 66 74.354 1.805 1.805
475 1HB ASP 66 HB2 ASP 66 75.795 0.324 0.324
476 2HB ASP 66 HB1 ASP 66 76.386 -0.439 -0.439
477 H GLU 67 HN GLU 67 72.839 0.907 0.907
478 HA GLU 67 HA GLU 67 73.981 -0.503 -0.503
479 1HB GLU 67 HB2 GLU 67 72.096 1.875 1.875
480 2HB GLU 67 HB1 GLU 67 72.333 0.842 0.842
481 1HG GLU 67 HG2 GLU 67 71.810 -1.091 -1.091
482 2HG GLU 67 HG1 GLU 67 71.001 0.211 0.211
483 H ASP 68 HN ASP 68 74.101 3.020 3.020
484 HA ASP 68 HA ASP 68 75.885 3.516 3.516
485 1HB ASP 68 HB2 ASP 68 74.159 4.949 4.949
486 2HB ASP 68 HB1 ASP 68 75.770 5.591 5.591
487 H GLY 69 HN GLY 69 76.285 2.519 2.519
488 1HA GLY 69 HA2 GLY 69 78.377 1.784 1.784
489 2HA GLY 69 HA1 GLY 69 79.221 2.727 2.727
490 H SER 70 HN SER 70 77.683 5.159 5.159
491 HA SER 70 HA SER 70 78.690 5.909 5.909
492 1HB SER 70 HB2 SER 70 80.174 6.852 6.852
493 2HB SER 70 HB1 SER 70 78.861 7.248 7.248
494 HG SER 70 HG SER 70 79.902 8.908 8.908
495 H GLY 71 HN GLY 71 75.956 5.484 5.484
496 1HA GLY 71 HA2 GLY 71 74.472 7.891 7.891
497 2HA GLY 71 HA1 GLY 71 73.765 6.316 6.316
498 H THR 72 HN THR 72 72.219 7.300 7.300
499 HA THR 72 HA THR 72 73.218 6.614 6.614
500 HB THR 72 HB THR 72 71.313 8.163 8.163
501 HG1 THR 72 HG1 THR 72 70.833 9.591 9.591
502 1HG2 THR 72 HG23 THR 72 73.881 8.777 8.777
503 2HG2 THR 72 HG22 THR 72 72.743 10.083 10.083
504 3HG2 THR 72 HG21 THR 72 73.049 9.580 9.580
505 H ILE 73 HN ILE 73 70.851 6.308 6.308
506 HA ILE 73 HA ILE 73 69.606 3.957 3.957
507 HB ILE 73 HB ILE 73 70.943 3.735 3.735
508 1HG1 ILE 73 HG12 ILE 73 68.985 2.397 2.397
509 2HG1 ILE 73 HG11 ILE 73 68.085 2.851 2.851
510 1HG2 ILE 73 HG23 ILE 73 69.944 5.882 5.882
511 2HG2 ILE 73 HG22 ILE 73 68.463 4.966 4.966
512 3HG2 ILE 73 HG21 ILE 73 69.956 4.502 4.502
513 HD1 ILE 73 HD1 ILE 73 70.003 0.756 0.756
514 HD1 ILE 73 HD1 ILE 73 70.675 1.955 1.955
515 HD1 ILE 73 HD1 ILE 73 69.109 1.219 1.219
516 H ASP 74 HN ASP 74 67.353 3.905 3.905
517 HA ASP 74 HA ASP 74 65.915 6.439 6.439
518 1HB ASP 74 HB2 ASP 74 65.703 3.988 3.988
519 2HB ASP 74 HB1 ASP 74 64.146 4.505 4.505
520 H PHE 75 HN PHE 75 64.474 6.781 6.781
521 HA PHE 75 HA PHE 75 64.414 5.275 5.275
522 1HB PHE 75 HB2 PHE 75 63.518 7.587 7.587
523 2HB PHE 75 HB1 PHE 75 62.120 6.850 6.850
524 HD1 PHE 75 HD2 PHE 75 60.758 5.125 5.125
525 HD2 PHE 75 HD1 PHE 75 63.564 7.858 7.858
526 HE1 PHE 75 HE2 PHE 75 59.689 4.794 4.794
527 HE2 PHE 75 HE1 PHE 75 62.496 7.527 7.527
528 HZ PHE 75 HZ PHE 75 60.558 5.995 5.995
529 H GLU 76 HN GLU 76 61.822 5.230 5.230
530 HA GLU 76 HA GLU 76 60.317 3.086 3.086
531 1HB GLU 76 HB2 GLU 76 59.615 2.854 2.854
532 2HB GLU 76 HB1 GLU 76 59.572 4.511 4.511
533 1HG GLU 76 HG2 GLU 76 62.100 4.480 4.480
534 2HG GLU 76 HG1 GLU 76 61.422 3.259 3.259
535 H GLU 77 HN GLU 77 63.077 2.958 2.958
536 HA GLU 77 HA GLU 77 63.032 0.061 0.061
537 1HB GLU 77 HB2 GLU 77 63.933 1.758 1.758
538 2HB GLU 77 HB1 GLU 77 65.282 2.019 2.019
539 1HG GLU 77 HG2 GLU 77 66.104 0.392 0.392
540 2HG GLU 77 HG1 GLU 77 65.592 -0.553 -0.553
541 H PHE 78 HN PHE 78 64.612 2.388 2.388
542 HA PHE 78 HA PHE 78 66.628 0.660 0.660
543 1HB PHE 78 HB2 PHE 78 66.857 2.981 2.981
544 2HB PHE 78 HB1 PHE 78 65.172 3.165 3.165
545 HD1 PHE 78 HD1 PHE 78 68.406 1.615 1.615
546 HD2 PHE 78 HD2 PHE 78 64.558 3.087 3.087
547 HE1 PHE 78 HE1 PHE 78 69.054 1.348 1.348
548 HE2 PHE 78 HE2 PHE 78 65.206 2.821 2.821
549 HZ PHE 78 HZ PHE 78 67.453 1.952 1.952
550 H LEU 79 HN LEU 79 63.194 1.059 1.059
551 HA LEU 79 HA LEU 79 62.822 0.037 0.037
552 1HB LEU 79 HB2 LEU 79 61.413 -0.124 -0.124
553 2HB LEU 79 HB1 LEU 79 60.857 -1.232 -1.232
554 HG LEU 79 HG LEU 79 59.612 0.888 0.888
555 HD1 LEU 79 HD1 LEU 79 61.069 1.416 1.416
556 HD1 LEU 79 HD1 LEU 79 61.087 -0.325 -0.325
557 HD1 LEU 79 HD1 LEU 79 59.551 0.536 0.536
558 HD2 LEU 79 HD2 LEU 79 61.123 2.481 2.481
559 HD2 LEU 79 HD2 LEU 79 62.403 2.028 2.028
560 HD2 LEU 79 HD2 LEU 79 60.994 2.916 2.916
561 H VAL 80 HN VAL 80 63.679 -1.809 -1.809
562 HA VAL 80 HA VAL 80 63.397 -4.438 -4.438
563 HB VAL 80 HB VAL 80 64.874 -5.028 -5.028
564 1HG1 VAL 80 HG11 VAL 80 62.759 -3.027 -3.027
565 2HG1 VAL 80 HG13 VAL 80 63.907 -2.981 -2.981
566 3HG1 VAL 80 HG12 VAL 80 63.059 -4.479 -4.479
567 1HG2 VAL 80 HG23 VAL 80 65.713 -2.130 -2.130
568 2HG2 VAL 80 HG22 VAL 80 66.731 -3.564 -3.564
569 3HG2 VAL 80 HG21 VAL 80 66.044 -3.100 -3.100
570 H MET 81 HN MET 81 66.119 -2.144 -2.144
571 HA MET 81 HA MET 81 67.997 -3.898 -3.898
572 1HB MET 81 HB2 MET 81 67.676 -1.123 -1.123
573 2HB MET 81 HB1 MET 81 68.351 -1.227 -1.227
574 1HG MET 81 HG2 MET 81 69.663 -3.198 -3.198
575 2HG MET 81 HG1 MET 81 69.664 -1.704 -1.704
576 1HE MET 81 HE3 MET 81 71.699 -3.516 -3.516
577 2HE MET 81 HE2 MET 81 72.862 -2.209 -2.209
578 3HE MET 81 HE1 MET 81 72.680 -2.978 -2.978
579 H MET 82 HN MET 82 65.150 -2.305 -2.305
580 HA MET 82 HA MET 82 65.897 -2.393 -2.393
581 1HB MET 82 HB2 MET 82 63.299 -1.845 -1.845
582 2HB MET 82 HB1 MET 82 63.571 -1.546 -1.546
583 1HG MET 82 HG2 MET 82 65.678 -0.205 -0.205
584 2HG MET 82 HG1 MET 82 64.610 -0.066 -0.066
585 1HE MET 82 HE2 MET 82 64.878 0.010 0.010
586 2HE MET 82 HE1 MET 82 63.742 1.221 1.221
587 3HE MET 82 HE3 MET 82 63.155 -0.353 -0.353
588 H VAL 83 HN VAL 83 63.074 -3.779 -3.779
589 HA VAL 83 HA VAL 83 62.434 -5.756 -5.756
590 HB VAL 83 HB VAL 83 62.180 -5.858 -5.858
591 1HG1 VAL 83 HG13 VAL 83 61.063 -7.440 -7.440
592 2HG1 VAL 83 HG12 VAL 83 59.932 -7.000 -7.000
593 3HG1 VAL 83 HG11 VAL 83 61.384 -7.925 -7.925
594 1HG2 VAL 83 HG23 VAL 83 60.575 -4.474 -4.474
595 2HG2 VAL 83 HG22 VAL 83 61.245 -3.782 -3.782
596 3HG2 VAL 83 HG21 VAL 83 59.868 -4.879 -4.879
597 H ARG 84 HN ARG 84 64.373 -6.149 -6.149
598 HA ARG 84 HA ARG 84 65.108 -8.849 -8.849
599 1HB ARG 84 HB2 ARG 84 66.737 -6.530 -6.530
600 2HB ARG 84 HB1 ARG 84 66.949 -8.231 -8.231
601 1HG ARG 84 HG2 ARG 84 64.194 -7.206 -7.206
602 2HG ARG 84 HG1 ARG 84 65.387 -6.503 -6.503
603 1HD ARG 84 HD2 ARG 84 65.752 -8.496 -8.496
604 2HD ARG 84 HD1 ARG 84 65.476 -9.467 -9.467
605 HE ARG 84 HE ARG 84 63.083 -8.055 -8.055
606 1HH1 ARG 84 HH2 ARG 84 65.129 -10.749 -10.749
607 2HH1 ARG 84 HH2 ARG 84 63.829 -11.793 -11.793
608 1HH2 ARG 84 HH1 ARG 84 61.358 -9.449 -9.449
609 2HH2 ARG 84 HH1 ARG 84 61.697 -11.059 -11.059
610 H GLN 85 HN GLN 85 66.409 -5.955 -5.955
611 HA GLN 85 HA GLN 85 68.611 -7.492 -7.492
612 1HB GLN 85 HB2 GLN 85 68.974 -5.221 -5.221
613 2HB GLN 85 HB1 GLN 85 67.706 -4.597 -4.597
614 1HG GLN 85 HG2 GLN 85 69.650 -4.135 -4.135
615 2HG GLN 85 HG1 GLN 85 69.122 -5.670 -5.670
616 1HE2 GLN 85 HE22 GLN 85 72.257 -7.082 -7.082
617 2HE2 GLN 85 HE21 GLN 85 70.996 -6.874 -6.874
618 H MET 86 HN MET 86 65.580 -5.855 -5.855
619 HA MET 86 HA MET 86 65.875 -6.370 -6.370
620 1HB MET 86 HB2 MET 86 64.059 -5.075 -5.075
621 2HB MET 86 HB1 MET 86 63.168 -5.981 -5.981
622 1HG MET 86 HG2 MET 86 64.904 -4.846 -4.846
623 2HG MET 86 HG1 MET 86 65.029 -3.660 -3.660
624 1HE MET 86 HE2 MET 86 63.940 -3.785 -3.785
625 2HE MET 86 HE1 MET 86 62.200 -3.576 -3.576
626 3HE MET 86 HE3 MET 86 62.866 -5.157 -5.157
627 H LYS 87 HN LYS 87 64.638 -8.165 -8.165
628 HA LYS 87 HA LYS 87 62.808 -9.946 -9.946
629 1HB LYS 87 HB2 LYS 87 64.961 -10.145 -10.145
630 2HB LYS 87 HB1 LYS 87 64.004 -11.571 -11.571
631 1HG LYS 87 HG2 LYS 87 62.250 -9.309 -9.309
632 2HG LYS 87 HG1 LYS 87 63.276 -9.437 -9.437
633 1HD LYS 87 HD2 LYS 87 62.008 -11.144 -11.144
634 2HD LYS 87 HD1 LYS 87 62.483 -12.076 -12.076
635 1HE LYS 87 HE2 LYS 87 60.425 -11.839 -11.839
636 2HE LYS 87 HE1 LYS 87 60.468 -10.080 -10.080
637 1HZ LYS 87 HZ1 LYS 87 60.096 -11.919 -11.919
638 2HZ LYS 87 HZ3 LYS 87 58.770 -11.424 -11.424
639 3HZ LYS 87 HZ2 LYS 87 59.706 -10.269 -10.269
640 H GLU 88 HN GLU 88 66.244 -9.681 -9.681
641 HA GLU 88 HA GLU 88 66.328 -12.277 -12.277
642 1HB GLU 88 HB2 GLU 88 68.295 -10.276 -10.276
643 2HB GLU 88 HB1 GLU 88 68.817 -11.437 -11.437
644 1HG GLU 88 HG2 GLU 88 68.041 -13.294 -13.294
645 2HG GLU 88 HG1 GLU 88 67.493 -12.142 -12.142
646 H ASP 89 HN ASP 89 66.671 -8.779 -8.779
647 HA ASP 89 HA ASP 89 67.344 -9.007 -9.007
648 1HB ASP 89 HB2 ASP 89 66.850 -6.937 -6.937
649 2HB ASP 89 HB1 ASP 89 66.465 -6.450 -6.450
650 H ALA 90 HN ALA 90 64.392 -8.659 -8.659
651 HA ALA 90 HA ALA 90 62.701 -8.001 -8.001
652 1HB ALA 90 HB1 ALA 90 62.572 -7.762 -7.762
653 2HB ALA 90 HB3 ALA 90 61.497 -9.130 -9.130
654 3HB ALA 90 HB2 ALA 90 61.187 -7.584 -7.584
Start of MODEL 24
1 1H ALA 1 HT2 ALA 1 64.613 -2.826 -2.826
2 2H ALA 1 HT1 ALA 1 65.242 -2.660 -2.660
3 3H ALA 1 HT3 ALA 1 63.631 -3.142 -3.142
4 HA ALA 1 HA ALA 1 65.034 -5.043 -5.043
5 1HB ALA 1 HB3 ALA 1 66.849 -3.615 -3.615
6 2HB ALA 1 HB2 ALA 1 66.423 -4.909 -4.909
7 3HB ALA 1 HB1 ALA 1 67.066 -5.299 -5.299
8 H SER 2 HN SER 2 65.454 -6.888 -6.888
9 HA SER 2 HA SER 2 62.699 -7.509 -7.509
10 1HB SER 2 HB2 SER 2 65.096 -8.842 -8.842
11 2HB SER 2 HB1 SER 2 63.617 -9.566 -9.566
12 HG SER 2 HG SER 2 65.215 -9.954 -9.954
13 H MET 3 HN MET 3 64.993 -5.445 -5.445
14 HA MET 3 HA MET 3 64.555 -5.941 -5.941
15 1HB MET 3 HB2 MET 3 65.987 -4.116 -4.116
16 2HB MET 3 HB1 MET 3 65.357 -3.295 -3.295
17 1HG MET 3 HG2 MET 3 66.552 -5.901 -5.901
18 2HG MET 3 HG1 MET 3 67.700 -4.765 -4.765
19 1HE MET 3 HE3 MET 3 65.943 -6.153 -6.153
20 2HE MET 3 HE2 MET 3 66.790 -5.523 -5.523
21 3HE MET 3 HE1 MET 3 65.187 -4.911 -4.911
22 H THR 4 HN THR 4 62.998 -3.937 -3.937
23 HA THR 4 HA THR 4 61.522 -2.120 -2.120
24 HB THR 4 HB THR 4 61.649 -2.475 -2.475
25 HG1 THR 4 HG1 THR 4 59.365 -1.883 -1.883
26 1HG2 THR 4 HG22 THR 4 60.767 -4.962 -4.962
27 2HG2 THR 4 HG21 THR 4 59.218 -4.177 -4.177
28 3HG2 THR 4 HG23 THR 4 60.477 -4.156 -4.156
29 H ASP 5 HN ASP 5 61.204 -5.587 -5.587
30 HA ASP 5 HA ASP 5 58.475 -5.706 -5.706
31 1HB ASP 5 HB2 ASP 5 60.292 -7.400 -7.400
32 2HB ASP 5 HB1 ASP 5 60.251 -8.008 -8.008
33 H GLN 6 HN GLN 6 61.652 -6.558 -6.558
34 HA GLN 6 HA GLN 6 60.824 -6.987 -6.987
35 1HB GLN 6 HB2 GLN 6 63.235 -6.474 -6.474
36 2HB GLN 6 HB1 GLN 6 63.308 -5.612 -5.612
37 1HG GLN 6 HG2 GLN 6 62.828 -8.572 -8.572
38 2HG GLN 6 HG1 GLN 6 64.200 -7.814 -7.814
39 1HE2 GLN 6 HE22 GLN 6 60.768 -8.473 -8.473
40 2HE2 GLN 6 HE21 GLN 6 60.917 -8.919 -8.919
41 H GLN 7 HN GLN 7 60.953 -4.003 -4.003
42 HA GLN 7 HA GLN 7 61.168 -2.168 -2.168
43 1HB GLN 7 HB2 GLN 7 61.312 -1.967 -1.967
44 2HB GLN 7 HB1 GLN 7 59.606 -1.555 -1.555
45 1HG GLN 7 HG2 GLN 7 60.268 0.161 0.161
46 2HG GLN 7 HG1 GLN 7 61.954 -0.170 -0.170
47 1HE2 GLN 7 HE22 GLN 7 59.698 2.107 2.107
48 2HE2 GLN 7 HE21 GLN 7 59.029 1.421 1.421
49 H ALA 8 HN ALA 8 58.244 -2.718 -2.718
50 HA ALA 8 HA ALA 8 56.341 -1.652 -1.652
51 1HB ALA 8 HB1 ALA 8 56.233 -4.039 -4.039
52 2HB ALA 8 HB3 ALA 8 54.800 -3.281 -3.281
53 3HB ALA 8 HB2 ALA 8 55.841 -2.365 -2.365
54 H GLU 9 HN GLU 9 57.886 -4.834 -4.834
55 HA GLU 9 HA GLU 9 56.139 -5.806 -5.806
56 1HB GLU 9 HB2 GLU 9 58.363 -6.746 -6.746
57 2HB GLU 9 HB1 GLU 9 58.292 -7.486 -7.486
58 1HG GLU 9 HG2 GLU 9 56.006 -7.350 -7.350
59 2HG GLU 9 HG1 GLU 9 56.958 -8.786 -8.786
60 H ALA 10 HN ALA 10 59.059 -3.953 -3.953
61 HA ALA 10 HA ALA 10 60.095 -4.642 -4.642
62 1HB ALA 10 HB3 ALA 10 60.686 -2.651 -2.651
63 2HB ALA 10 HB2 ALA 10 61.482 -2.506 -2.506
64 3HB ALA 10 HB1 ALA 10 61.697 -3.965 -3.965
65 H ARG 11 HN ARG 11 57.978 -2.160 -2.160
66 HA ARG 11 HA ARG 11 57.992 -0.588 -0.588
67 1HB ARG 11 HB2 ARG 11 56.166 -0.255 -0.255
68 2HB ARG 11 HB1 ARG 11 56.762 0.985 0.985
69 1HG ARG 11 HG2 ARG 11 58.449 1.387 1.387
70 2HG ARG 11 HG1 ARG 11 59.051 -0.245 -0.245
71 1HD ARG 11 HD2 ARG 11 58.709 -0.285 -0.285
72 2HD ARG 11 HD1 ARG 11 57.162 -0.926 -0.926
73 HE ARG 11 HE ARG 11 57.203 1.988 1.988
74 1HH1 ARG 11 HH1 ARG 11 57.715 -0.065 -0.065
75 2HH1 ARG 11 HH1 ARG 11 56.219 0.232 0.232
76 1HH2 ARG 11 HH2 ARG 11 54.815 1.995 1.995
77 2HH2 ARG 11 HH2 ARG 11 54.576 1.398 1.398
78 H ALA 12 HN ALA 12 55.579 -2.375 -2.375
79 HA ALA 12 HA ALA 12 53.348 -2.153 -2.153
80 1HB ALA 12 HB1 ALA 12 54.212 -3.624 -3.624
81 2HB ALA 12 HB3 ALA 12 53.628 -4.823 -4.823
82 3HB ALA 12 HB2 ALA 12 52.566 -3.518 -3.518
83 H PHE 13 HN PHE 13 55.929 -4.641 -4.641
84 HA PHE 13 HA PHE 13 54.980 -6.224 -6.224
85 1HB PHE 13 HB2 PHE 13 56.971 -6.782 -6.782
86 2HB PHE 13 HB1 PHE 13 57.757 -5.275 -5.275
87 HD1 PHE 13 HD2 PHE 13 58.216 -4.878 -4.878
88 HD2 PHE 13 HD1 PHE 13 57.163 -8.715 -8.715
89 HE1 PHE 13 HE2 PHE 13 59.120 -5.982 -5.982
90 HE2 PHE 13 HE1 PHE 13 58.068 -9.819 -9.819
91 HZ PHE 13 HZ PHE 13 59.047 -8.453 -8.453
92 H LEU 14 HN LEU 14 56.094 -2.927 -2.927
93 HA LEU 14 HA LEU 14 56.296 -3.006 -3.006
94 1HB LEU 14 HB2 LEU 14 57.014 -0.889 -0.889
95 2HB LEU 14 HB1 LEU 14 57.380 -0.807 -0.807
96 HG LEU 14 HG LEU 14 58.331 -3.055 -3.055
97 HD1 LEU 14 HD1 LEU 14 59.581 -0.404 -0.404
98 HD1 LEU 14 HD1 LEU 14 59.455 -1.169 -1.169
99 HD1 LEU 14 HD1 LEU 14 60.581 -1.805 -1.805
100 HD2 LEU 14 HD2 LEU 14 59.405 -2.119 -2.119
101 HD2 LEU 14 HD2 LEU 14 59.725 -3.645 -3.645
102 HD2 LEU 14 HD2 LEU 14 58.135 -3.337 -3.337
103 H SER 15 HN SER 15 54.712 -2.035 -2.035
104 HA SER 15 HA SER 15 52.218 -1.199 -1.199
105 1HB SER 15 HB2 SER 15 53.474 -1.025 -1.025
106 2HB SER 15 HB1 SER 15 51.833 -0.470 -0.470
107 HG SER 15 HG SER 15 52.601 -3.006 -3.006
108 H GLU 16 HN GLU 16 51.270 1.045 1.045
109 HA GLU 16 HA GLU 16 52.729 3.121 3.121
110 1HB GLU 16 HB2 GLU 16 50.211 2.807 2.807
111 2HB GLU 16 HB1 GLU 16 50.629 3.559 3.559
112 1HG GLU 16 HG2 GLU 16 51.671 5.453 5.453
113 2HG GLU 16 HG1 GLU 16 50.935 4.742 4.742
114 H GLU 17 HN GLU 17 52.267 2.455 2.455
115 HA GLU 17 HA GLU 17 53.677 4.677 4.677
116 1HB GLU 17 HB2 GLU 17 52.361 3.237 3.237
117 2HB GLU 17 HB1 GLU 17 53.288 1.816 1.816
118 1HG GLU 17 HG2 GLU 17 55.001 3.906 3.906
119 2HG GLU 17 HG1 GLU 17 53.766 3.397 3.397
120 H MET 18 HN MET 18 54.852 1.725 1.725
121 HA MET 18 HA MET 18 57.588 1.942 1.942
122 1HB MET 18 HB2 MET 18 56.077 -0.009 -0.009
123 2HB MET 18 HB1 MET 18 56.868 0.538 0.538
124 1HG MET 18 HG2 MET 18 58.743 -0.555 -0.555
125 2HG MET 18 HG1 MET 18 58.839 0.384 0.384
126 1HE MET 18 HE2 MET 18 59.923 -1.375 -1.375
127 2HE MET 18 HE1 MET 18 58.659 -0.577 -0.577
128 3HE MET 18 HE3 MET 18 58.886 -2.326 -2.326
129 H ILE 19 HN ILE 19 56.129 2.459 2.459
130 HA ILE 19 HA ILE 19 58.281 3.460 3.460
131 HB ILE 19 HB ILE 19 55.361 4.216 4.216
132 1HG1 ILE 19 HG12 ILE 19 56.481 3.133 3.133
133 2HG1 ILE 19 HG11 ILE 19 56.779 2.079 2.079
134 1HG2 ILE 19 HG22 ILE 19 56.684 6.196 6.196
135 2HG2 ILE 19 HG21 ILE 19 57.360 5.191 5.191
136 3HG2 ILE 19 HG23 ILE 19 55.630 5.533 5.533
137 HD1 ILE 19 HD1 ILE 19 54.648 1.443 1.443
138 HD1 ILE 19 HD1 ILE 19 54.106 3.121 3.121
139 HD1 ILE 19 HD1 ILE 19 54.324 2.306 2.306
140 H ALA 20 HN ALA 20 56.138 5.416 5.416
141 HA ALA 20 HA ALA 20 57.625 7.860 7.860
142 1HB ALA 20 HB1 ALA 20 55.230 7.415 7.415
143 2HB ALA 20 HB3 ALA 20 55.961 6.989 6.989
144 3HB ALA 20 HB2 ALA 20 56.155 8.618 8.618
145 H GLU 21 HN GLU 21 58.227 4.974 4.974
146 HA GLU 21 HA GLU 21 59.950 6.293 6.293
147 1HB GLU 21 HB2 GLU 21 58.644 4.432 4.432
148 2HB GLU 21 HB1 GLU 21 59.119 3.456 3.456
149 1HG GLU 21 HG2 GLU 21 60.409 2.678 2.678
150 2HG GLU 21 HG1 GLU 21 61.505 3.595 3.595
151 H PHE 22 HN PHE 22 60.296 4.155 4.155
152 HA PHE 22 HA PHE 22 63.204 4.016 4.016
153 1HB PHE 22 HB2 PHE 22 61.150 3.316 3.316
154 2HB PHE 22 HB1 PHE 22 62.870 2.977 2.977
155 HD1 PHE 22 HD2 PHE 22 62.064 2.818 2.818
156 HD2 PHE 22 HD1 PHE 22 61.710 0.580 0.580
157 HE1 PHE 22 HE2 PHE 22 61.791 0.729 0.729
158 HE2 PHE 22 HE1 PHE 22 61.438 -1.508 -1.508
159 HZ PHE 22 HZ PHE 22 61.478 -1.435 -1.435
160 H LYS 23 HN LYS 23 60.860 5.976 5.976
161 HA LYS 23 HA LYS 23 62.825 7.244 7.244
162 1HB LYS 23 HB2 LYS 23 60.567 7.125 7.125
163 2HB LYS 23 HB1 LYS 23 59.953 7.734 7.734
164 1HG LYS 23 HG2 LYS 23 61.788 9.659 9.659
165 2HG LYS 23 HG1 LYS 23 60.621 9.233 9.233
166 1HD LYS 23 HD2 LYS 23 58.950 9.452 9.452
167 2HD LYS 23 HD1 LYS 23 60.190 10.611 10.611
168 1HE LYS 23 HE2 LYS 23 59.701 12.056 12.056
169 2HE LYS 23 HE1 LYS 23 59.251 10.741 10.741
170 1HZ LYS 23 HZ1 LYS 23 57.387 10.362 10.362
171 2HZ LYS 23 HZ3 LYS 23 57.665 11.991 11.991
172 3HZ LYS 23 HZ2 LYS 23 57.194 11.556 11.556
173 H ALA 24 HN ALA 24 61.305 8.051 8.051
174 HA ALA 24 HA ALA 24 62.124 10.744 10.744
175 1HB ALA 24 HB2 ALA 24 61.080 8.594 8.594
176 2HB ALA 24 HB1 ALA 24 62.349 9.405 9.405
177 3HB ALA 24 HB3 ALA 24 60.975 10.327 10.327
178 H ALA 25 HN ALA 25 63.951 7.748 7.748
179 HA ALA 25 HA ALA 25 66.312 9.254 9.254
180 1HB ALA 25 HB2 ALA 25 65.183 6.623 6.623
181 2HB ALA 25 HB1 ALA 25 66.818 6.479 6.479
182 3HB ALA 25 HB3 ALA 25 66.543 7.315 7.315
183 H PHE 26 HN PHE 26 65.074 7.843 7.843
184 HA PHE 26 HA PHE 26 67.572 7.362 7.362
185 1HB PHE 26 HB2 PHE 26 65.346 6.421 6.421
186 2HB PHE 26 HB1 PHE 26 64.815 8.034 8.034
187 HD1 PHE 26 HD1 PHE 26 66.413 9.284 9.284
188 HD2 PHE 26 HD2 PHE 26 66.283 5.027 5.027
189 HE1 PHE 26 HE1 PHE 26 67.432 8.962 8.962
190 HE2 PHE 26 HE2 PHE 26 67.302 4.705 4.705
191 HZ PHE 26 HZ PHE 26 67.878 6.672 6.672
192 H ASP 27 HN ASP 27 65.289 10.125 10.125
193 HA ASP 27 HA ASP 27 66.708 11.723 11.723
194 1HB ASP 27 HB2 ASP 27 65.341 13.520 13.520
195 2HB ASP 27 HB1 ASP 27 64.383 12.040 12.040
196 H MET 28 HN MET 28 67.578 10.849 10.849
197 HA MET 28 HA MET 28 68.969 13.136 13.136
198 1HB MET 28 HB2 MET 28 69.470 10.158 10.158
199 2HB MET 28 HB1 MET 28 70.275 11.382 11.382
200 1HG MET 28 HG2 MET 28 67.762 12.203 12.203
201 2HG MET 28 HG1 MET 28 67.419 10.509 10.509
202 1HE MET 28 HE1 MET 28 68.129 13.088 13.088
203 2HE MET 28 HE3 MET 28 67.386 12.229 12.229
204 3HE MET 28 HE2 MET 28 69.098 12.637 12.637
205 H PHE 29 HN PHE 29 69.793 10.863 10.863
206 HA PHE 29 HA PHE 29 72.481 12.176 12.176
207 1HB PHE 29 HB2 PHE 29 71.774 9.466 9.466
208 2HB PHE 29 HB1 PHE 29 73.353 10.083 10.083
209 HD1 PHE 29 HD1 PHE 29 74.008 10.186 10.186
210 HD2 PHE 29 HD2 PHE 29 70.196 8.610 8.610
211 HE1 PHE 29 HE1 PHE 29 73.703 9.205 9.205
212 HE2 PHE 29 HE2 PHE 29 69.892 7.628 7.628
213 HZ PHE 29 HZ PHE 29 71.646 7.925 7.925
214 H ASP 30 HN ASP 30 69.860 13.024 13.024
215 HA ASP 30 HA ASP 30 69.732 12.281 12.281
216 1HB ASP 30 HB2 ASP 30 68.477 14.052 14.052
217 2HB ASP 30 HB1 ASP 30 68.832 14.955 14.955
218 H ALA 31 HN ALA 31 72.074 12.376 12.376
219 HA ALA 31 HA ALA 31 73.857 14.474 14.474
220 1HB ALA 31 HB2 ALA 31 73.589 12.121 12.121
221 2HB ALA 31 HB1 ALA 31 73.563 13.309 13.309
222 3HB ALA 31 HB3 ALA 31 74.935 13.243 13.243
223 H ASP 32 HN ASP 32 71.268 14.155 14.155
224 HA ASP 32 HA ASP 32 71.687 17.037 17.037
225 1HB ASP 32 HB2 ASP 32 71.552 14.716 14.716
226 2HB ASP 32 HB1 ASP 32 69.943 15.414 15.414
227 H GLY 33 HN GLY 33 69.170 14.613 14.613
228 1HA GLY 33 HA2 GLY 33 67.364 15.377 15.377
229 2HA GLY 33 HA1 GLY 33 67.339 16.888 16.888
230 H GLY 34 HN GLY 34 67.810 14.075 14.075
231 1HA GLY 34 HA2 GLY 34 65.054 14.383 14.383
232 2HA GLY 34 HA1 GLY 34 66.393 13.593 13.593
233 H GLY 35 HN GLY 35 65.831 12.891 12.891
234 1HA GLY 35 HA2 GLY 35 64.938 10.982 10.982
235 2HA GLY 35 HA1 GLY 35 64.124 10.583 10.583
236 H ASP 36 HN ASP 36 67.584 11.150 11.150
237 HA ASP 36 HA ASP 36 68.193 8.257 8.257
238 1HB ASP 36 HB2 ASP 36 69.366 8.563 8.563
239 2HB ASP 36 HB1 ASP 36 67.603 8.513 8.513
240 H ILE 37 HN ILE 37 70.018 8.125 8.125
241 HA ILE 37 HA ILE 37 71.833 10.481 10.481
242 HB ILE 37 HB ILE 37 72.530 9.464 9.464
243 1HG1 ILE 37 HG12 ILE 37 71.192 6.974 6.974
244 2HG1 ILE 37 HG11 ILE 37 72.903 7.193 7.193
245 1HG2 ILE 37 HG23 ILE 37 69.580 8.887 8.887
246 2HG2 ILE 37 HG22 ILE 37 70.377 9.057 9.057
247 3HG2 ILE 37 HG21 ILE 37 70.266 10.441 10.441
248 HD1 ILE 37 HD1 ILE 37 70.677 7.340 7.340
249 HD1 ILE 37 HD1 ILE 37 72.410 7.409 7.409
250 HD1 ILE 37 HD1 ILE 37 71.683 5.919 5.919
251 H SER 38 HN SER 38 74.253 9.843 9.843
252 HA SER 38 HA SER 38 75.163 8.681 8.681
253 1HB SER 38 HB2 SER 38 76.309 9.304 9.304
254 2HB SER 38 HB1 SER 38 77.295 8.390 8.390
255 HG SER 38 HG SER 38 76.739 11.013 11.013
256 H THR 39 HN THR 39 75.414 6.560 6.560
257 HA THR 39 HA THR 39 74.291 4.351 4.351
258 HB THR 39 HB THR 39 76.226 3.154 3.154
259 HG1 THR 39 HG1 THR 39 77.538 4.466 4.466
260 1HG2 THR 39 HG22 THR 39 74.183 4.986 4.986
261 2HG2 THR 39 HG21 THR 39 74.986 3.632 3.632
262 3HG2 THR 39 HG23 THR 39 73.887 3.338 3.338
263 H LYS 40 HN LYS 40 77.416 5.850 5.850
264 HA LYS 40 HA LYS 40 78.476 3.677 3.677
265 1HB LYS 40 HB2 LYS 40 79.134 6.486 6.486
266 2HB LYS 40 HB1 LYS 40 79.863 5.878 5.878
267 1HG LYS 40 HG2 LYS 40 80.048 3.861 3.861
268 2HG LYS 40 HG1 LYS 40 80.708 5.378 5.378
269 1HD LYS 40 HD2 LYS 40 82.246 5.550 5.550
270 2HD LYS 40 HD1 LYS 40 81.453 4.235 4.235
271 1HE LYS 40 HE2 LYS 40 82.135 3.170 3.170
272 2HE LYS 40 HE1 LYS 40 83.563 4.059 4.059
273 1HZ LYS 40 HZ2 LYS 40 81.987 2.221 2.221
274 2HZ LYS 40 HZ1 LYS 40 83.382 1.740 1.740
275 3HZ LYS 40 HZ3 LYS 40 83.486 2.935 2.935
276 H GLU 41 HN GLU 41 76.038 5.979 5.979
277 HA GLU 41 HA GLU 41 76.421 5.979 5.979
278 1HB GLU 41 HB2 GLU 41 76.089 8.043 8.043
279 2HB GLU 41 HB1 GLU 41 74.387 7.606 7.606
280 1HG GLU 41 HG2 GLU 41 74.949 9.252 9.252
281 2HG GLU 41 HG1 GLU 41 74.619 7.700 7.700
282 H LEU 42 HN LEU 42 74.883 4.164 4.164
283 HA LEU 42 HA LEU 42 72.169 4.001 4.001
284 1HB LEU 42 HB2 LEU 42 72.981 3.153 3.153
285 2HB LEU 42 HB1 LEU 42 74.023 1.994 1.994
286 HG LEU 42 HG LEU 42 71.157 1.910 1.910
287 HD1 LEU 42 HD1 LEU 42 71.238 2.284 2.284
288 HD1 LEU 42 HD1 LEU 42 70.409 0.828 0.828
289 HD1 LEU 42 HD1 LEU 42 72.046 0.720 0.720
290 HD2 LEU 42 HD2 LEU 42 72.904 0.346 0.346
291 HD2 LEU 42 HD2 LEU 42 73.172 -0.217 -0.217
292 HD2 LEU 42 HD2 LEU 42 71.618 -0.496 -0.496
293 H GLY 43 HN GLY 43 74.952 1.843 1.843
294 1HA GLY 43 HA2 GLY 43 73.786 0.080 0.080
295 2HA GLY 43 HA1 GLY 43 75.444 0.651 0.651
296 H THR 44 HN THR 44 74.789 3.419 3.419
297 HA THR 44 HA THR 44 74.451 3.429 3.429
298 HB THR 44 HB THR 44 74.185 5.482 5.482
299 HG1 THR 44 HG1 THR 44 76.112 4.619 4.619
300 1HG2 THR 44 HG23 THR 44 73.804 5.810 5.810
301 2HG2 THR 44 HG22 THR 44 74.359 7.145 7.145
302 3HG2 THR 44 HG21 THR 44 72.783 6.409 6.409
303 H VAL 45 HN VAL 45 72.116 4.754 4.754
304 HA VAL 45 HA VAL 45 69.930 5.188 5.188
305 HB VAL 45 HB VAL 45 70.130 4.057 4.057
306 1HG1 VAL 45 HG12 VAL 45 67.899 3.614 3.614
307 2HG1 VAL 45 HG11 VAL 45 67.695 5.364 5.364
308 3HG1 VAL 45 HG13 VAL 45 67.812 4.544 4.544
309 1HG2 VAL 45 HG22 VAL 45 69.682 6.830 6.830
310 2HG2 VAL 45 HG21 VAL 45 71.097 6.271 6.271
311 3HG2 VAL 45 HG23 VAL 45 69.547 6.440 6.440
312 H MET 46 HN MET 46 70.216 2.155 2.155
313 HA MET 46 HA MET 46 68.189 0.721 0.721
314 1HB MET 46 HB2 MET 46 69.172 -1.183 -1.183
315 2HB MET 46 HB1 MET 46 69.468 0.203 0.203
316 1HG MET 46 HG2 MET 46 71.722 0.453 0.453
317 2HG MET 46 HG1 MET 46 71.419 -1.092 -1.092
318 1HE MET 46 HE2 MET 46 70.358 -2.901 -2.901
319 2HE MET 46 HE1 MET 46 69.810 -2.667 -2.667
320 3HE MET 46 HE3 MET 46 71.211 -3.694 -3.694
321 H ARG 47 HN ARG 47 71.665 0.929 0.929
322 HA ARG 47 HA ARG 47 71.479 -0.967 -0.967
323 1HB ARG 47 HB2 ARG 47 73.492 -0.304 -0.304
324 2HB ARG 47 HB1 ARG 47 73.564 1.173 1.173
325 1HG ARG 47 HG2 ARG 47 73.541 -1.581 -1.581
326 2HG ARG 47 HG1 ARG 47 75.035 -0.748 -0.748
327 1HD ARG 47 HD2 ARG 47 73.631 1.207 1.207
328 2HD ARG 47 HD1 ARG 47 73.255 -0.275 -0.275
329 HE ARG 47 HE ARG 47 75.779 -0.697 -0.697
330 1HH1 ARG 47 HH2 ARG 47 76.732 1.516 1.516
331 2HH1 ARG 47 HH2 ARG 47 77.108 2.750 2.750
332 1HH2 ARG 47 HH1 ARG 47 75.258 1.297 1.297
333 2HH2 ARG 47 HH1 ARG 47 76.273 2.626 2.626
334 H MET 48 HN MET 48 71.918 2.595 2.595
335 HA MET 48 HA MET 48 71.678 2.985 2.985
336 1HB MET 48 HB2 MET 48 72.451 4.464 4.464
337 2HB MET 48 HB1 MET 48 70.798 5.065 5.065
338 1HG MET 48 HG2 MET 48 71.179 5.601 5.601
339 2HG MET 48 HG1 MET 48 72.831 4.998 4.998
340 1HE MET 48 HE3 MET 48 73.938 7.050 7.050
341 2HE MET 48 HE2 MET 48 74.773 6.356 6.356
342 3HE MET 48 HE1 MET 48 74.613 8.105 8.105
343 H LEU 49 HN LEU 49 69.315 2.058 2.058
344 HA LEU 49 HA LEU 49 67.050 3.482 3.482
345 1HB LEU 49 HB2 LEU 49 67.604 1.493 1.493
346 2HB LEU 49 HB1 LEU 49 65.974 1.481 1.481
347 HG LEU 49 HG LEU 49 67.382 3.953 3.953
348 HD1 LEU 49 HD1 LEU 49 66.758 2.183 2.183
349 HD1 LEU 49 HD1 LEU 49 66.012 3.764 3.764
350 HD1 LEU 49 HD1 LEU 49 65.077 2.444 2.444
351 HD2 LEU 49 HD2 LEU 49 64.631 3.387 3.387
352 HD2 LEU 49 HD2 LEU 49 64.936 4.778 4.778
353 HD2 LEU 49 HD2 LEU 49 65.780 4.627 4.627
354 H GLY 50 HN GLY 50 68.745 0.488 0.488
355 1HA GLY 50 HA2 GLY 50 68.075 -0.211 -0.211
356 2HA GLY 50 HA1 GLY 50 66.513 -0.509 -0.509
357 H GLN 51 HN GLN 51 68.313 -1.244 -1.244
358 HA GLN 51 HA GLN 51 68.481 -4.121 -4.121
359 1HB GLN 51 HB2 GLN 51 68.836 -2.816 -2.816
360 2HB GLN 51 HB1 GLN 51 68.353 -4.477 -4.477
361 1HG GLN 51 HG2 GLN 51 66.747 -1.955 -1.955
362 2HG GLN 51 HG1 GLN 51 66.352 -3.290 -3.290
363 1HE2 GLN 51 HE22 GLN 51 64.833 -3.499 -3.499
364 2HE2 GLN 51 HE21 GLN 51 65.197 -2.086 -2.086
365 H ASN 52 HN ASN 52 70.402 -4.950 -4.950
366 HA ASN 52 HA ASN 52 72.871 -3.389 -3.389
367 1HB ASN 52 HB2 ASN 52 71.998 -5.527 -5.527
368 2HB ASN 52 HB1 ASN 52 73.572 -5.875 -5.875
369 HD2 ASN 52 HD2 ASN 52 74.769 -3.385 -3.385
370 HD2 ASN 52 HD2 ASN 52 74.908 -2.678 -2.678
371 HA PRO 53 HA PRO 53 72.876 -5.934 -5.934
372 1HB PRO 53 HB2 PRO 53 74.253 -4.103 -4.103
373 2HB PRO 53 HB1 PRO 53 72.495 -4.026 -4.026
374 1HG PRO 53 HG2 PRO 53 74.653 -2.481 -2.481
375 2HG PRO 53 HG1 PRO 53 73.050 -1.952 -1.952
376 1HD PRO 53 HD2 PRO 53 73.661 -2.536 -2.536
377 2HD PRO 53 HD1 PRO 53 72.028 -2.689 -2.689
378 H THR 54 HN THR 54 74.469 -7.487 -7.487
379 HA THR 54 HA THR 54 76.951 -7.369 -7.369
380 HB THR 54 HB THR 54 77.435 -9.391 -9.391
381 HG1 THR 54 HG1 THR 54 75.803 -9.902 -9.902
382 1HG2 THR 54 HG21 THR 54 75.426 -9.111 -9.111
383 2HG2 THR 54 HG23 THR 54 74.489 -9.593 -9.593
384 3HG2 THR 54 HG22 THR 54 75.770 -10.641 -10.641
385 H LYS 55 HN LYS 55 79.015 -6.704 -6.704
386 HA LYS 55 HA LYS 55 79.475 -4.642 -4.642
387 1HB LYS 55 HB2 LYS 55 81.078 -5.646 -5.646
388 2HB LYS 55 HB1 LYS 55 81.297 -7.012 -7.012
389 1HG LYS 55 HG2 LYS 55 82.771 -5.851 -5.851
390 2HG LYS 55 HG1 LYS 55 81.624 -4.524 -4.524
391 1HD LYS 55 HD2 LYS 55 82.280 -3.656 -3.656
392 2HD LYS 55 HD1 LYS 55 83.467 -4.954 -4.954
393 1HE LYS 55 HE2 LYS 55 83.518 -3.151 -3.151
394 2HE LYS 55 HE1 LYS 55 84.271 -2.626 -2.626
395 1HZ LYS 55 HZ1 LYS 55 84.747 -5.311 -5.311
396 2HZ LYS 55 HZ3 LYS 55 85.722 -3.981 -3.981
397 3HZ LYS 55 HZ2 LYS 55 85.634 -4.519 -4.519
398 H GLU 56 HN GLU 56 79.457 -8.123 -8.123
399 HA GLU 56 HA GLU 56 80.260 -7.884 -7.884
400 1HB GLU 56 HB2 GLU 56 78.820 -9.875 -9.875
401 2HB GLU 56 HB1 GLU 56 78.893 -10.148 -10.148
402 1HG GLU 56 HG2 GLU 56 81.350 -9.978 -9.978
403 2HG GLU 56 HG1 GLU 56 81.286 -9.691 -9.691
404 H GLU 57 HN GLU 57 77.116 -7.660 -7.660
405 HA GLU 57 HA GLU 57 75.459 -7.746 -7.746
406 1HB GLU 57 HB2 GLU 57 75.300 -7.006 -7.006
407 2HB GLU 57 HB1 GLU 57 74.130 -6.181 -6.181
408 1HG GLU 57 HG2 GLU 57 74.547 -9.177 -9.177
409 2HG GLU 57 HG1 GLU 57 73.152 -8.267 -8.267
410 H LEU 58 HN LEU 58 76.785 -4.972 -4.972
411 HA LEU 58 HA LEU 58 75.731 -2.861 -2.861
412 1HB LEU 58 HB2 LEU 58 78.490 -3.115 -3.115
413 2HB LEU 58 HB1 LEU 58 77.645 -1.606 -1.606
414 HG LEU 58 HG LEU 58 76.899 -3.727 -3.727
415 HD1 LEU 58 HD1 LEU 58 78.089 -2.287 -2.287
416 HD1 LEU 58 HD1 LEU 58 76.701 -1.210 -1.210
417 HD1 LEU 58 HD1 LEU 58 78.074 -1.038 -1.038
418 HD2 LEU 58 HD2 LEU 58 74.788 -3.231 -3.231
419 HD2 LEU 58 HD2 LEU 58 75.241 -1.579 -1.579
420 HD2 LEU 58 HD2 LEU 58 74.939 -2.015 -2.015
421 H ASP 59 HN ASP 59 78.965 -4.360 -4.360
422 HA ASP 59 HA ASP 59 79.755 -3.073 -3.073
423 1HB ASP 59 HB2 ASP 59 81.269 -4.476 -4.476
424 2HB ASP 59 HB1 ASP 59 80.175 -5.857 -5.857
425 H ALA 60 HN ALA 60 77.760 -6.018 -6.018
426 HA ALA 60 HA ALA 60 77.446 -6.451 -6.451
427 1HB ALA 60 HB2 ALA 60 76.485 -7.513 -7.513
428 2HB ALA 60 HB1 ALA 60 75.310 -7.657 -7.657
429 3HB ALA 60 HB3 ALA 60 76.912 -8.375 -8.375
430 H ILE 61 HN ILE 61 75.365 -4.953 -4.953
431 HA ILE 61 HA ILE 61 73.113 -4.342 -4.342
432 HB ILE 61 HB ILE 61 74.484 -2.868 -2.868
433 1HG1 ILE 61 HG12 ILE 61 71.959 -4.528 -4.528
434 2HG1 ILE 61 HG11 ILE 61 73.551 -5.261 -5.261
435 1HG2 ILE 61 HG21 ILE 61 72.026 -2.261 -2.261
436 2HG2 ILE 61 HG23 ILE 61 71.900 -2.112 -2.112
437 3HG2 ILE 61 HG22 ILE 61 73.103 -1.169 -1.169
438 HD1 ILE 61 HD1 ILE 61 74.017 -3.873 -3.873
439 HD1 ILE 61 HD1 ILE 61 72.453 -4.648 -4.648
440 HD1 ILE 61 HD1 ILE 61 72.531 -2.957 -2.957
441 H ILE 62 HN ILE 62 75.802 -2.075 -2.075
442 HA ILE 62 HA ILE 62 75.146 -0.010 -0.010
443 HB ILE 62 HB ILE 62 77.803 -1.207 -1.207
444 1HG1 ILE 62 HG12 ILE 62 76.477 1.354 1.354
445 2HG1 ILE 62 HG11 ILE 62 76.151 -0.195 -0.195
446 1HG2 ILE 62 HG21 ILE 62 77.181 0.970 0.970
447 2HG2 ILE 62 HG23 ILE 62 78.286 1.439 1.439
448 3HG2 ILE 62 HG22 ILE 62 78.688 0.084 0.084
449 HD1 ILE 62 HD1 ILE 62 78.934 0.941 0.941
450 HD1 ILE 62 HD1 ILE 62 78.479 -0.472 -0.472
451 HD1 ILE 62 HD1 ILE 62 77.985 1.139 1.139
452 H GLU 63 HN GLU 63 77.572 -2.535 -2.535
453 HA GLU 63 HA GLU 63 77.807 -2.072 -2.072
454 1HB GLU 63 HB2 GLU 63 79.055 -3.698 -3.698
455 2HB GLU 63 HB1 GLU 63 77.670 -4.783 -4.783
456 1HG GLU 63 HG2 GLU 63 78.661 -5.594 -5.594
457 2HG GLU 63 HG1 GLU 63 78.182 -4.083 -4.083
458 H GLU 64 HN GLU 64 75.251 -3.783 -3.783
459 HA GLU 64 HA GLU 64 73.906 -4.828 -4.828
460 1HB GLU 64 HB2 GLU 64 73.440 -5.957 -5.957
461 2HB GLU 64 HB1 GLU 64 73.382 -4.470 -4.470
462 1HG GLU 64 HG2 GLU 64 71.175 -4.108 -4.108
463 2HG GLU 64 HG1 GLU 64 71.317 -4.711 -4.711
464 H VAL 65 HN VAL 65 73.169 -2.115 -2.115
465 HA VAL 65 HA VAL 65 71.090 -1.064 -1.064
466 HB VAL 65 HB VAL 65 70.897 0.610 0.610
467 1HG1 VAL 65 HG12 VAL 65 71.472 -2.187 -2.187
468 2HG1 VAL 65 HG11 VAL 65 70.681 -0.934 -0.934
469 3HG1 VAL 65 HG13 VAL 65 69.910 -1.545 -1.545
470 1HG2 VAL 65 HG23 VAL 65 73.684 0.094 0.094
471 2HG2 VAL 65 HG22 VAL 65 72.721 1.293 1.293
472 3HG2 VAL 65 HG21 VAL 65 72.925 -0.325 -0.325
473 H ASP 66 HN ASP 66 74.404 -1.009 -1.009
474 HA ASP 66 HA ASP 66 74.713 1.815 1.815
475 1HB ASP 66 HB2 ASP 66 76.419 0.583 0.583
476 2HB ASP 66 HB1 ASP 66 76.605 -0.560 -0.560
477 H GLU 67 HN GLU 67 74.160 -1.300 -1.300
478 HA GLU 67 HA GLU 67 75.136 -0.611 -0.611
479 1HB GLU 67 HB2 GLU 67 74.666 -2.899 -2.899
480 2HB GLU 67 HB1 GLU 67 73.034 -2.679 -2.679
481 1HG GLU 67 HG2 GLU 67 73.701 -2.923 -2.923
482 2HG GLU 67 HG1 GLU 67 75.308 -2.263 -2.263
483 H ASP 68 HN ASP 68 72.571 0.592 0.592
484 HA ASP 68 HA ASP 68 70.499 0.600 0.600
485 1HB ASP 68 HB2 ASP 68 70.936 2.237 2.237
486 2HB ASP 68 HB1 ASP 68 69.422 2.150 2.150
487 H GLY 69 HN GLY 69 73.425 2.236 2.236
488 1HA GLY 69 HA2 GLY 69 74.314 4.067 4.067
489 2HA GLY 69 HA1 GLY 69 72.893 3.979 3.979
490 H SER 70 HN SER 70 73.079 4.585 4.585
491 HA SER 70 HA SER 70 71.776 7.242 7.242
492 1HB SER 70 HB2 SER 70 71.011 4.904 4.904
493 2HB SER 70 HB1 SER 70 71.122 6.322 6.322
494 HG SER 70 HG SER 70 69.126 6.463 6.463
495 H GLY 71 HN GLY 71 73.959 5.370 5.370
496 1HA GLY 71 HA2 GLY 71 76.033 6.336 6.336
497 2HA GLY 71 HA1 GLY 71 75.280 7.930 7.930
498 H THR 72 HN THR 72 72.867 7.443 7.443
499 HA THR 72 HA THR 72 73.824 6.826 6.826
500 HB THR 72 HB THR 72 71.937 8.365 8.365
501 HG1 THR 72 HG1 THR 72 70.767 9.302 9.302
502 1HG2 THR 72 HG21 THR 72 74.253 9.200 9.200
503 2HG2 THR 72 HG23 THR 72 73.892 9.508 9.508
504 3HG2 THR 72 HG22 THR 72 73.048 10.412 10.412
505 H ILE 73 HN ILE 73 71.358 6.580 6.580
506 HA ILE 73 HA ILE 73 70.218 4.122 4.122
507 HB ILE 73 HB ILE 73 71.553 3.908 3.908
508 1HG1 ILE 73 HG12 ILE 73 69.464 2.805 2.805
509 2HG1 ILE 73 HG11 ILE 73 68.689 3.102 3.102
510 1HG2 ILE 73 HG21 ILE 73 70.491 6.189 6.189
511 2HG2 ILE 73 HG23 ILE 73 69.217 5.145 5.145
512 3HG2 ILE 73 HG22 ILE 73 70.878 4.938 4.938
513 HD1 ILE 73 HD1 ILE 73 69.945 0.838 0.838
514 HD1 ILE 73 HD1 ILE 73 71.399 1.801 1.801
515 HD1 ILE 73 HD1 ILE 73 70.171 1.699 1.699
516 H ASP 74 HN ASP 74 67.958 4.009 4.009
517 HA ASP 74 HA ASP 74 66.473 6.524 6.524
518 1HB ASP 74 HB2 ASP 74 65.556 4.009 4.009
519 2HB ASP 74 HB1 ASP 74 64.913 5.641 5.641
520 H PHE 75 HN PHE 75 65.223 6.649 6.649
521 HA PHE 75 HA PHE 75 64.949 4.789 4.789
522 1HB PHE 75 HB2 PHE 75 64.152 7.198 7.198
523 2HB PHE 75 HB1 PHE 75 62.725 6.604 6.604
524 HD1 PHE 75 HD1 PHE 75 64.568 6.577 6.577
525 HD2 PHE 75 HD2 PHE 75 61.009 5.335 5.335
526 HE1 PHE 75 HE1 PHE 75 63.521 5.984 5.984
527 HE2 PHE 75 HE2 PHE 75 59.961 4.743 4.743
528 HZ PHE 75 HZ PHE 75 61.217 5.068 5.068
529 H GLU 76 HN GLU 76 62.724 5.142 5.142
530 HA GLU 76 HA GLU 76 60.899 3.088 3.088
531 1HB GLU 76 HB2 GLU 76 61.896 4.543 4.543
532 2HB GLU 76 HB1 GLU 76 61.184 2.971 2.971
533 1HG GLU 76 HG2 GLU 76 59.262 3.751 3.751
534 2HG GLU 76 HG1 GLU 76 59.901 5.367 5.367
535 H GLU 77 HN GLU 77 63.958 2.851 2.851
536 HA GLU 77 HA GLU 77 63.795 -0.063 -0.063
537 1HB GLU 77 HB2 GLU 77 64.872 1.146 1.146
538 2HB GLU 77 HB1 GLU 77 65.858 2.062 2.062
539 1HG GLU 77 HG2 GLU 77 66.107 -0.907 -0.907
540 2HG GLU 77 HG1 GLU 77 66.814 -0.079 -0.079
541 H PHE 78 HN PHE 78 65.224 2.281 2.281
542 HA PHE 78 HA PHE 78 67.082 0.453 0.453
543 1HB PHE 78 HB2 PHE 78 67.548 2.761 2.761
544 2HB PHE 78 HB1 PHE 78 65.875 3.160 3.160
545 HD1 PHE 78 HD1 PHE 78 68.973 1.590 1.590
546 HD2 PHE 78 HD2 PHE 78 65.057 3.095 3.095
547 HE1 PHE 78 HE1 PHE 78 69.489 1.443 1.443
548 HE2 PHE 78 HE2 PHE 78 65.573 2.949 2.949
549 HZ PHE 78 HZ PHE 78 67.788 2.123 2.123
550 H LEU 79 HN LEU 79 63.692 1.310 1.310
551 HA LEU 79 HA LEU 79 63.075 0.529 0.529
552 1HB LEU 79 HB2 LEU 79 61.789 0.300 0.300
553 2HB LEU 79 HB1 LEU 79 61.041 -0.609 -0.609
554 HG LEU 79 HG LEU 79 61.775 2.079 2.079
555 HD1 LEU 79 HD1 LEU 79 60.473 1.744 1.744
556 HD1 LEU 79 HD1 LEU 79 61.222 3.175 3.175
557 HD1 LEU 79 HD1 LEU 79 59.559 2.756 2.756
558 HD2 LEU 79 HD2 LEU 79 59.722 0.093 0.093
559 HD2 LEU 79 HD2 LEU 79 58.968 1.644 1.644
560 HD2 LEU 79 HD2 LEU 79 60.073 1.502 1.502
561 H VAL 80 HN VAL 80 63.879 -1.616 -1.616
562 HA VAL 80 HA VAL 80 63.255 -4.112 -4.112
563 HB VAL 80 HB VAL 80 64.745 -5.001 -5.001
564 1HG1 VAL 80 HG11 VAL 80 62.870 -2.801 -2.801
565 2HG1 VAL 80 HG13 VAL 80 64.019 -3.105 -3.105
566 3HG1 VAL 80 HG12 VAL 80 62.971 -4.403 -4.403
567 1HG2 VAL 80 HG23 VAL 80 65.848 -2.189 -2.189
568 2HG2 VAL 80 HG22 VAL 80 66.720 -3.709 -3.709
569 3HG2 VAL 80 HG21 VAL 80 66.088 -3.250 -3.250
570 H MET 81 HN MET 81 66.152 -2.060 -2.060
571 HA MET 81 HA MET 81 67.859 -3.855 -3.855
572 1HB MET 81 HB2 MET 81 67.598 -0.828 -0.828
573 2HB MET 81 HB1 MET 81 68.987 -1.702 -1.702
574 1HG MET 81 HG2 MET 81 67.999 -1.785 -1.785
575 2HG MET 81 HG1 MET 81 69.471 -1.000 -1.000
576 1HE MET 81 HE2 MET 81 69.116 -2.631 -2.631
577 2HE MET 81 HE1 MET 81 70.641 -3.513 -3.513
578 3HE MET 81 HE3 MET 81 69.107 -4.389 -4.389
579 H MET 82 HN MET 82 65.120 -1.937 -1.937
580 HA MET 82 HA MET 82 65.731 -2.068 -2.068
581 1HB MET 82 HB2 MET 82 63.206 -1.365 -1.365
582 2HB MET 82 HB1 MET 82 63.512 -0.999 -0.999
583 1HG MET 82 HG2 MET 82 65.080 0.055 0.055
584 2HG MET 82 HG1 MET 82 63.981 0.981 0.981
585 1HE MET 82 HE2 MET 82 64.215 0.676 0.676
586 2HE MET 82 HE1 MET 82 64.889 -0.951 -0.951
587 3HE MET 82 HE3 MET 82 65.740 0.356 0.356
588 H VAL 83 HN VAL 83 63.108 -3.423 -3.423
589 HA VAL 83 HA VAL 83 62.124 -5.247 -5.247
590 HB VAL 83 HB VAL 83 62.018 -5.114 -5.114
591 1HG1 VAL 83 HG11 VAL 83 61.204 -7.254 -7.254
592 2HG1 VAL 83 HG13 VAL 83 59.860 -6.640 -6.640
593 3HG1 VAL 83 HG12 VAL 83 61.306 -7.258 -7.258
594 1HG2 VAL 83 HG21 VAL 83 60.102 -4.397 -4.397
595 2HG2 VAL 83 HG23 VAL 83 60.856 -3.295 -3.295
596 3HG2 VAL 83 HG22 VAL 83 59.637 -4.444 -4.444
597 H ARG 84 HN ARG 84 64.065 -5.942 -5.942
598 HA ARG 84 HA ARG 84 64.643 -8.631 -8.631
599 1HB ARG 84 HB2 ARG 84 66.435 -6.380 -6.380
600 2HB ARG 84 HB1 ARG 84 66.733 -8.093 -8.093
601 1HG ARG 84 HG2 ARG 84 64.367 -8.153 -8.153
602 2HG ARG 84 HG1 ARG 84 64.450 -6.390 -6.390
603 1HD ARG 84 HD2 ARG 84 65.254 -7.009 -7.009
604 2HD ARG 84 HD1 ARG 84 66.736 -6.726 -6.726
605 HE ARG 84 HE ARG 84 67.116 -9.077 -9.077
606 1HH1 ARG 84 HH2 ARG 84 64.519 -10.101 -10.101
607 2HH1 ARG 84 HH2 ARG 84 63.906 -10.895 -10.895
608 1HH2 ARG 84 HH1 ARG 84 66.102 -9.310 -9.310
609 2HH2 ARG 84 HH1 ARG 84 64.803 -10.447 -10.447
610 H GLN 85 HN GLN 85 66.335 -5.837 -5.837
611 HA GLN 85 HA GLN 85 68.259 -7.454 -7.454
612 1HB GLN 85 HB2 GLN 85 68.581 -5.091 -5.091
613 2HB GLN 85 HB1 GLN 85 67.280 -4.606 -4.606
614 1HG GLN 85 HG2 GLN 85 69.373 -4.237 -4.237
615 2HG GLN 85 HG1 GLN 85 68.589 -5.632 -5.632
616 1HE2 GLN 85 HE22 GLN 85 71.600 -6.604 -6.604
617 2HE2 GLN 85 HE21 GLN 85 70.437 -5.456 -5.456
618 H MET 86 HN MET 86 65.165 -5.890 -5.890
619 HA MET 86 HA MET 86 65.266 -6.673 -6.673
620 1HB MET 86 HB2 MET 86 63.539 -5.247 -5.247
621 2HB MET 86 HB1 MET 86 62.613 -6.212 -6.212
622 1HG MET 86 HG2 MET 86 64.230 -5.181 -5.181
623 2HG MET 86 HG1 MET 86 64.528 -3.959 -3.959
624 1HE MET 86 HE1 MET 86 62.738 -5.495 -5.495
625 2HE MET 86 HE3 MET 86 61.656 -4.225 -4.225
626 3HE MET 86 HE2 MET 86 61.035 -5.504 -5.504
627 H LYS 87 HN LYS 87 64.222 -8.211 -8.211
628 HA LYS 87 HA LYS 87 62.327 -10.083 -10.083
629 1HB LYS 87 HB2 LYS 87 64.631 -10.122 -10.122
630 2HB LYS 87 HB1 LYS 87 63.626 -11.557 -11.557
631 1HG LYS 87 HG2 LYS 87 62.020 -9.137 -9.137
632 2HG LYS 87 HG1 LYS 87 63.061 -9.383 -9.383
633 1HD LYS 87 HD2 LYS 87 62.066 -11.931 -11.931
634 2HD LYS 87 HD1 LYS 87 60.685 -10.859 -10.859
635 1HE LYS 87 HE2 LYS 87 60.933 -9.944 -9.944
636 2HE LYS 87 HE1 LYS 87 62.456 -10.827 -10.827
637 1HZ LYS 87 HZ1 LYS 87 60.085 -12.333 -12.333
638 2HZ LYS 87 HZ3 LYS 87 60.183 -11.850 -11.850
639 3HZ LYS 87 HZ2 LYS 87 61.400 -12.830 -12.830
640 H GLU 88 HN GLU 88 65.722 -9.881 -9.881
641 HA GLU 88 HA GLU 88 65.735 -12.592 -12.592
642 1HB GLU 88 HB2 GLU 88 67.567 -11.228 -11.228
643 2HB GLU 88 HB1 GLU 88 68.028 -10.693 -10.693
644 1HG GLU 88 HG2 GLU 88 68.013 -13.150 -13.150
645 2HG GLU 88 HG1 GLU 88 67.890 -13.531 -13.531
646 H ASP 89 HN ASP 89 65.901 -9.157 -9.157
647 HA ASP 89 HA ASP 89 66.344 -9.634 -9.634
648 1HB ASP 89 HB2 ASP 89 67.076 -7.613 -7.613
649 2HB ASP 89 HB1 ASP 89 65.387 -7.203 -7.203
650 H ALA 90 HN ALA 90 63.565 -9.216 -9.216
651 HA ALA 90 HA ALA 90 61.693 -8.952 -8.952
652 1HB ALA 90 HB2 ALA 90 61.631 -8.760 -8.760
653 2HB ALA 90 HB1 ALA 90 60.115 -9.056 -9.056
654 3HB ALA 90 HB3 ALA 90 61.055 -7.606 -7.606
Start of MODEL 25
1 1H ALA 1 HT3 ALA 1 64.465 -5.859 -5.859
2 2H ALA 1 HT2 ALA 1 65.362 -4.499 -4.499
3 3H ALA 1 HT1 ALA 1 66.033 -5.621 -5.621
4 HA ALA 1 HA ALA 1 66.518 -7.142 -7.142
5 1HB ALA 1 HB3 ALA 1 66.595 -4.300 -4.300
6 2HB ALA 1 HB2 ALA 1 66.930 -5.524 -5.524
7 3HB ALA 1 HB1 ALA 1 67.922 -5.438 -5.438
8 H SER 2 HN SER 2 66.112 -7.693 -7.693
9 HA SER 2 HA SER 2 63.208 -8.111 -8.111
10 1HB SER 2 HB2 SER 2 63.894 -9.869 -9.869
11 2HB SER 2 HB1 SER 2 65.429 -9.596 -9.596
12 HG SER 2 HG SER 2 64.982 -9.474 -9.474
13 H MET 3 HN MET 3 65.601 -5.906 -5.906
14 HA MET 3 HA MET 3 64.796 -5.192 -5.192
15 1HB MET 3 HB2 MET 3 65.943 -3.787 -3.787
16 2HB MET 3 HB1 MET 3 65.528 -2.836 -2.836
17 1HG MET 3 HG2 MET 3 67.346 -3.579 -3.579
18 2HG MET 3 HG1 MET 3 66.932 -5.257 -5.257
19 1HE MET 3 HE2 MET 3 67.888 -6.607 -6.607
20 2HE MET 3 HE1 MET 3 68.681 -6.543 -6.543
21 3HE MET 3 HE3 MET 3 69.629 -6.353 -6.353
22 H THR 4 HN THR 4 63.605 -3.776 -3.776
23 HA THR 4 HA THR 4 61.646 -2.047 -2.047
24 HB THR 4 HB THR 4 61.667 -3.788 -3.788
25 HG1 THR 4 HG1 THR 4 62.213 -1.054 -1.054
26 1HG2 THR 4 HG23 THR 4 59.831 -1.637 -1.637
27 2HG2 THR 4 HG22 THR 4 60.257 -1.653 -1.653
28 3HG2 THR 4 HG21 THR 4 59.480 -3.059 -3.059
29 H ASP 5 HN ASP 5 61.572 -5.552 -5.552
30 HA ASP 5 HA ASP 5 58.690 -5.753 -5.753
31 1HB ASP 5 HB2 ASP 5 60.521 -7.276 -7.276
32 2HB ASP 5 HB1 ASP 5 60.525 -8.077 -8.077
33 H GLN 6 HN GLN 6 61.710 -6.591 -6.591
34 HA GLN 6 HA GLN 6 60.450 -7.449 -7.449
35 1HB GLN 6 HB2 GLN 6 63.132 -6.645 -6.645
36 2HB GLN 6 HB1 GLN 6 62.899 -6.523 -6.523
37 1HG GLN 6 HG2 GLN 6 62.448 -8.984 -8.984
38 2HG GLN 6 HG1 GLN 6 63.729 -8.750 -8.750
39 1HE2 GLN 6 HE22 GLN 6 61.397 -8.992 -8.992
40 2HE2 GLN 6 HE21 GLN 6 62.725 -8.060 -8.060
41 H GLN 7 HN GLN 7 60.703 -4.345 -4.345
42 HA GLN 7 HA GLN 7 60.861 -2.775 -2.775
43 1HB GLN 7 HB2 GLN 7 61.546 -1.993 -1.993
44 2HB GLN 7 HB1 GLN 7 59.876 -2.127 -2.127
45 1HG GLN 7 HG2 GLN 7 59.662 -0.609 -0.609
46 2HG GLN 7 HG1 GLN 7 61.148 -0.013 -0.013
47 1HE2 GLN 7 HE22 GLN 7 57.564 0.810 0.810
48 2HE2 GLN 7 HE21 GLN 7 57.660 -0.142 -0.142
49 H ALA 8 HN ALA 8 58.175 -3.309 -3.309
50 HA ALA 8 HA ALA 8 56.076 -2.133 -2.133
51 1HB ALA 8 HB2 ALA 8 56.371 -3.565 -3.565
52 2HB ALA 8 HB1 ALA 8 55.590 -4.787 -4.787
53 3HB ALA 8 HB3 ALA 8 54.789 -3.243 -3.243
54 H GLU 9 HN GLU 9 57.255 -5.496 -5.496
55 HA GLU 9 HA GLU 9 55.394 -6.039 -6.039
56 1HB GLU 9 HB2 GLU 9 56.019 -7.833 -7.833
57 2HB GLU 9 HB1 GLU 9 57.736 -7.465 -7.465
58 1HG GLU 9 HG2 GLU 9 56.343 -7.998 -7.998
59 2HG GLU 9 HG1 GLU 9 56.421 -9.380 -9.380
60 H ALA 10 HN ALA 10 58.413 -4.468 -4.468
61 HA ALA 10 HA ALA 10 59.488 -5.249 -5.249
62 1HB ALA 10 HB2 ALA 10 60.101 -3.257 -3.257
63 2HB ALA 10 HB1 ALA 10 60.933 -3.141 -3.141
64 3HB ALA 10 HB3 ALA 10 61.084 -4.604 -4.604
65 H ARG 11 HN ARG 11 57.527 -2.580 -2.580
66 HA ARG 11 HA ARG 11 57.675 -1.007 -1.007
67 1HB ARG 11 HB2 ARG 11 55.596 -0.797 -0.797
68 2HB ARG 11 HB1 ARG 11 56.279 0.495 0.495
69 1HG ARG 11 HG2 ARG 11 57.808 0.868 0.868
70 2HG ARG 11 HG1 ARG 11 58.452 -0.752 -0.752
71 1HD ARG 11 HD2 ARG 11 57.848 -0.748 -0.748
72 2HD ARG 11 HD1 ARG 11 56.470 -1.541 -1.541
73 HE ARG 11 HE ARG 11 56.448 1.135 1.135
74 1HH1 ARG 11 HH1 ARG 11 55.210 2.442 2.442
75 2HH1 ARG 11 HH1 ARG 11 53.648 1.757 1.757
76 1HH2 ARG 11 HH2 ARG 11 54.378 -1.256 -1.256
77 2HH2 ARG 11 HH2 ARG 11 53.178 -0.337 -0.337
78 H ALA 12 HN ALA 12 55.181 -3.021 -3.021
79 HA ALA 12 HA ALA 12 53.170 -2.740 -2.740
80 1HB ALA 12 HB3 ALA 12 53.539 -3.974 -3.974
81 2HB ALA 12 HB2 ALA 12 53.286 -5.328 -5.328
82 3HB ALA 12 HB1 ALA 12 52.073 -4.054 -4.054
83 H PHE 13 HN PHE 13 56.144 -4.510 -4.510
84 HA PHE 13 HA PHE 13 55.696 -6.759 -6.759
85 1HB PHE 13 HB2 PHE 13 57.885 -6.288 -6.288
86 2HB PHE 13 HB1 PHE 13 57.878 -4.671 -4.671
87 HD1 PHE 13 HD1 PHE 13 57.849 -8.301 -8.301
88 HD2 PHE 13 HD2 PHE 13 58.681 -4.295 -4.295
89 HE1 PHE 13 HE1 PHE 13 58.886 -9.192 -9.192
90 HE2 PHE 13 HE2 PHE 13 59.718 -5.185 -5.185
91 HZ PHE 13 HZ PHE 13 59.821 -7.634 -7.634
92 H LEU 14 HN LEU 14 55.745 -3.367 -3.367
93 HA LEU 14 HA LEU 14 54.711 -4.257 -4.257
94 1HB LEU 14 HB2 LEU 14 56.079 -2.412 -2.412
95 2HB LEU 14 HB1 LEU 14 57.076 -3.610 -3.610
96 HG LEU 14 HG LEU 14 56.815 -2.065 -2.065
97 HD1 LEU 14 HD1 LEU 14 55.718 -0.421 -0.421
98 HD1 LEU 14 HD1 LEU 14 55.266 -0.438 -0.438
99 HD1 LEU 14 HD1 LEU 14 56.735 0.391 0.391
100 HD2 LEU 14 HD2 LEU 14 58.875 -1.113 -1.113
101 HD2 LEU 14 HD2 LEU 14 58.819 -2.424 -2.424
102 HD2 LEU 14 HD2 LEU 14 58.419 -0.778 -0.778
103 H SER 15 HN SER 15 53.546 -2.390 -2.390
104 HA SER 15 HA SER 15 51.590 -1.222 -1.222
105 1HB SER 15 HB2 SER 15 51.964 -0.370 -0.370
106 2HB SER 15 HB1 SER 15 50.475 -0.741 -0.741
107 HG SER 15 HG SER 15 50.656 -2.656 -2.656
108 H GLU 16 HN GLU 16 51.307 1.027 1.027
109 HA GLU 16 HA GLU 16 53.471 2.627 2.627
110 1HB GLU 16 HB2 GLU 16 51.198 3.137 3.137
111 2HB GLU 16 HB1 GLU 16 50.713 3.354 3.354
112 1HG GLU 16 HG2 GLU 16 51.288 5.522 5.522
113 2HG GLU 16 HG1 GLU 16 52.950 5.057 5.057
114 H GLU 17 HN GLU 17 52.113 2.084 2.084
115 HA GLU 17 HA GLU 17 52.965 4.261 4.261
116 1HB GLU 17 HB2 GLU 17 51.765 2.439 2.439
117 2HB GLU 17 HB1 GLU 17 53.011 1.281 1.281
118 1HG GLU 17 HG2 GLU 17 54.495 2.011 2.011
119 2HG GLU 17 HG1 GLU 17 53.721 3.591 3.591
120 H MET 18 HN MET 18 54.965 1.370 1.370
121 HA MET 18 HA MET 18 57.385 2.478 2.478
122 1HB MET 18 HB2 MET 18 56.625 0.038 0.038
123 2HB MET 18 HB1 MET 18 57.248 0.385 0.385
124 1HG MET 18 HG2 MET 18 59.017 -0.643 -0.643
125 2HG MET 18 HG1 MET 18 59.427 1.049 1.049
126 1HE MET 18 HE2 MET 18 60.443 -1.113 -1.113
127 2HE MET 18 HE1 MET 18 61.208 0.470 0.470
128 3HE MET 18 HE3 MET 18 60.655 -0.144 -0.144
129 H ILE 19 HN ILE 19 56.143 2.221 2.221
130 HA ILE 19 HA ILE 19 58.272 3.155 3.155
131 HB ILE 19 HB ILE 19 55.334 3.907 3.907
132 1HG1 ILE 19 HG12 ILE 19 57.008 1.687 1.687
133 2HG1 ILE 19 HG11 ILE 19 55.597 1.531 1.531
134 1HG2 ILE 19 HG21 ILE 19 57.148 5.301 5.301
135 2HG2 ILE 19 HG23 ILE 19 57.160 3.885 3.885
136 3HG2 ILE 19 HG22 ILE 19 55.664 4.786 4.786
137 HD1 ILE 19 HD1 ILE 19 54.526 1.205 1.205
138 HD1 ILE 19 HD1 ILE 19 55.740 2.099 2.099
139 HD1 ILE 19 HD1 ILE 19 54.503 2.969 2.969
140 H ALA 20 HN ALA 20 56.161 5.067 5.067
141 HA ALA 20 HA ALA 20 57.252 7.644 7.644
142 1HB ALA 20 HB1 ALA 20 55.531 6.545 6.545
143 2HB ALA 20 HB3 ALA 20 56.061 8.227 8.227
144 3HB ALA 20 HB2 ALA 20 55.077 7.639 7.639
145 H GLU 21 HN GLU 21 58.184 5.146 5.146
146 HA GLU 21 HA GLU 21 59.839 6.814 6.814
147 1HB GLU 21 HB2 GLU 21 58.998 4.759 4.759
148 2HB GLU 21 HB1 GLU 21 59.531 3.858 3.858
149 1HG GLU 21 HG2 GLU 21 61.636 3.605 3.605
150 2HG GLU 21 HG1 GLU 21 61.708 5.271 5.271
151 H PHE 22 HN PHE 22 60.396 4.820 4.820
152 HA PHE 22 HA PHE 22 63.297 5.204 5.204
153 1HB PHE 22 HB2 PHE 22 61.339 4.144 4.144
154 2HB PHE 22 HB1 PHE 22 63.093 4.023 4.023
155 HD1 PHE 22 HD2 PHE 22 63.834 3.495 3.495
156 HD2 PHE 22 HD1 PHE 22 60.654 1.896 1.896
157 HE1 PHE 22 HE2 PHE 22 63.803 1.447 1.447
158 HE2 PHE 22 HE1 PHE 22 60.625 -0.153 -0.153
159 HZ PHE 22 HZ PHE 22 62.200 -0.376 -0.376
160 H LYS 23 HN LYS 23 60.578 6.993 6.993
161 HA LYS 23 HA LYS 23 61.775 8.338 8.338
162 1HB LYS 23 HB2 LYS 23 59.314 8.121 8.121
163 2HB LYS 23 HB1 LYS 23 59.715 9.535 9.535
164 1HG LYS 23 HG2 LYS 23 58.718 10.229 10.229
165 2HG LYS 23 HG1 LYS 23 60.404 10.744 10.744
166 1HD LYS 23 HD2 LYS 23 61.103 9.214 9.214
167 2HD LYS 23 HD1 LYS 23 59.822 8.066 8.066
168 1HE LYS 23 HE2 LYS 23 59.522 9.217 9.217
169 2HE LYS 23 HE1 LYS 23 58.161 9.460 9.460
170 1HZ LYS 23 HZ2 LYS 23 60.402 11.312 11.312
171 2HZ LYS 23 HZ1 LYS 23 59.418 11.484 11.484
172 3HZ LYS 23 HZ3 LYS 23 58.736 11.599 11.599
173 H ALA 24 HN ALA 24 61.137 9.603 9.603
174 HA ALA 24 HA ALA 24 62.818 11.915 11.915
175 1HB ALA 24 HB1 ALA 24 60.942 11.627 11.627
176 2HB ALA 24 HB3 ALA 24 61.903 10.434 10.434
177 3HB ALA 24 HB2 ALA 24 62.433 12.115 12.115
178 H ALA 25 HN ALA 25 63.559 8.605 8.605
179 HA ALA 25 HA ALA 25 66.147 9.197 9.197
180 1HB ALA 25 HB3 ALA 25 64.450 7.300 7.300
181 2HB ALA 25 HB2 ALA 25 65.102 6.516 6.516
182 3HB ALA 25 HB1 ALA 25 66.159 6.874 6.874
183 H PHE 26 HN PHE 26 64.891 7.831 7.831
184 HA PHE 26 HA PHE 26 67.464 7.215 7.215
185 1HB PHE 26 HB2 PHE 26 65.400 6.190 6.190
186 2HB PHE 26 HB1 PHE 26 64.715 7.767 7.767
187 HD1 PHE 26 HD1 PHE 26 67.169 5.203 5.203
188 HD2 PHE 26 HD2 PHE 26 65.429 9.008 9.008
189 HE1 PHE 26 HE1 PHE 26 68.173 5.083 5.083
190 HE2 PHE 26 HE2 PHE 26 66.434 8.887 8.887
191 HZ PHE 26 HZ PHE 26 67.806 6.926 6.926
192 H ASP 27 HN ASP 27 65.393 10.096 10.096
193 HA ASP 27 HA ASP 27 66.879 11.532 11.532
194 1HB ASP 27 HB2 ASP 27 64.999 12.332 12.332
195 2HB ASP 27 HB1 ASP 27 65.591 13.467 13.467
196 H MET 28 HN MET 28 67.736 10.616 10.616
197 HA MET 28 HA MET 28 69.057 12.930 12.930
198 1HB MET 28 HB2 MET 28 69.612 9.956 9.956
199 2HB MET 28 HB1 MET 28 70.300 11.192 11.192
200 1HG MET 28 HG2 MET 28 67.327 10.744 10.744
201 2HG MET 28 HG1 MET 28 68.258 10.122 10.122
202 1HE MET 28 HE2 MET 28 69.306 11.313 11.313
203 2HE MET 28 HE1 MET 28 68.592 12.771 12.771
204 3HE MET 28 HE3 MET 28 67.597 11.331 11.331
205 H PHE 29 HN PHE 29 69.894 10.754 10.754
206 HA PHE 29 HA PHE 29 72.617 12.013 12.013
207 1HB PHE 29 HB2 PHE 29 71.863 9.343 9.343
208 2HB PHE 29 HB1 PHE 29 73.455 9.917 9.917
209 HD1 PHE 29 HD1 PHE 29 74.103 9.951 9.951
210 HD2 PHE 29 HD2 PHE 29 70.255 8.503 8.503
211 HE1 PHE 29 HE1 PHE 29 73.757 8.943 8.943
212 HE2 PHE 29 HE2 PHE 29 69.910 7.494 7.494
213 HZ PHE 29 HZ PHE 29 71.661 7.713 7.713
214 H ASP 30 HN ASP 30 69.930 12.804 12.804
215 HA ASP 30 HA ASP 30 69.955 12.204 12.204
216 1HB ASP 30 HB2 ASP 30 68.642 14.033 14.033
217 2HB ASP 30 HB1 ASP 30 68.721 14.644 14.644
218 H ALA 31 HN ALA 31 72.333 12.512 12.512
219 HA ALA 31 HA ALA 31 73.777 14.910 14.910
220 1HB ALA 31 HB1 ALA 31 73.764 12.592 12.592
221 2HB ALA 31 HB3 ALA 31 74.840 13.951 13.951
222 3HB ALA 31 HB2 ALA 31 74.986 13.052 13.052
223 H ASP 32 HN ASP 32 71.495 13.967 13.967
224 HA ASP 32 HA ASP 32 71.839 16.651 16.651
225 1HB ASP 32 HB2 ASP 32 71.925 14.246 14.246
226 2HB ASP 32 HB1 ASP 32 70.169 14.416 14.416
227 H GLY 33 HN GLY 33 69.463 14.558 14.558
228 1HA GLY 33 HA2 GLY 33 67.526 15.353 15.353
229 2HA GLY 33 HA1 GLY 33 67.688 16.899 16.899
230 H GLY 34 HN GLY 34 67.869 13.908 13.908
231 1HA GLY 34 HA2 GLY 34 65.278 14.627 14.627
232 2HA GLY 34 HA1 GLY 34 66.562 13.690 13.690
233 H GLY 35 HN GLY 35 65.907 12.927 12.927
234 1HA GLY 35 HA2 GLY 35 64.598 11.190 11.190
235 2HA GLY 35 HA1 GLY 35 63.937 10.838 10.838
236 H ASP 36 HN ASP 36 67.338 11.136 11.136
237 HA ASP 36 HA ASP 36 67.779 8.236 8.236
238 1HB ASP 36 HB2 ASP 36 68.936 8.175 8.175
239 2HB ASP 36 HB1 ASP 36 67.176 8.302 8.302
240 H ILE 37 HN ILE 37 69.822 7.889 7.889
241 HA ILE 37 HA ILE 37 71.645 10.260 10.260
242 HB ILE 37 HB ILE 37 72.432 9.210 9.210
243 1HG1 ILE 37 HG12 ILE 37 70.770 6.860 6.860
244 2HG1 ILE 37 HG11 ILE 37 72.513 6.897 6.897
245 1HG2 ILE 37 HG23 ILE 37 69.866 10.134 10.134
246 2HG2 ILE 37 HG22 ILE 37 69.585 8.563 8.563
247 3HG2 ILE 37 HG21 ILE 37 70.583 9.766 9.766
248 HD1 ILE 37 HD1 ILE 37 72.205 7.160 7.160
249 HD1 ILE 37 HD1 ILE 37 71.196 5.810 5.810
250 HD1 ILE 37 HD1 ILE 37 70.467 7.383 7.383
251 H SER 38 HN SER 38 74.056 9.360 9.360
252 HA SER 38 HA SER 38 74.898 8.201 8.201
253 1HB SER 38 HB2 SER 38 76.327 9.649 9.649
254 2HB SER 38 HB1 SER 38 76.208 8.592 8.592
255 HG SER 38 HG SER 38 77.584 8.220 8.220
256 H THR 39 HN THR 39 75.139 6.063 6.063
257 HA THR 39 HA THR 39 73.992 3.907 3.907
258 HB THR 39 HB THR 39 75.717 2.601 2.601
259 HG1 THR 39 HG1 THR 39 76.087 5.099 5.099
260 1HG2 THR 39 HG22 THR 39 73.604 4.522 4.522
261 2HG2 THR 39 HG21 THR 39 74.560 3.673 3.673
262 3HG2 THR 39 HG23 THR 39 73.606 2.758 2.758
263 H LYS 40 HN LYS 40 77.163 5.368 5.368
264 HA LYS 40 HA LYS 40 78.329 3.203 3.203
265 1HB LYS 40 HB2 LYS 40 79.135 5.566 5.566
266 2HB LYS 40 HB1 LYS 40 79.275 5.936 5.936
267 1HG LYS 40 HG2 LYS 40 81.177 4.742 4.742
268 2HG LYS 40 HG1 LYS 40 80.288 3.300 3.300
269 1HD LYS 40 HD2 LYS 40 81.605 3.362 3.362
270 2HD LYS 40 HD1 LYS 40 80.525 4.653 4.653
271 1HE LYS 40 HE2 LYS 40 82.073 6.269 6.269
272 2HE LYS 40 HE1 LYS 40 83.226 4.921 4.921
273 1HZ LYS 40 HZ2 LYS 40 82.725 4.665 4.665
274 2HZ LYS 40 HZ1 LYS 40 82.084 6.236 6.236
275 3HZ LYS 40 HZ3 LYS 40 83.715 5.966 5.966
276 H GLU 41 HN GLU 41 76.018 5.660 5.660
277 HA GLU 41 HA GLU 41 76.568 5.600 5.600
278 1HB GLU 41 HB2 GLU 41 76.090 7.721 7.721
279 2HB GLU 41 HB1 GLU 41 74.550 7.076 7.076
280 1HG GLU 41 HG2 GLU 41 73.784 8.154 8.154
281 2HG GLU 41 HG1 GLU 41 74.235 6.622 6.622
282 H LEU 42 HN LEU 42 74.539 4.069 4.069
283 HA LEU 42 HA LEU 42 72.130 3.509 3.509
284 1HB LEU 42 HB2 LEU 42 73.171 2.636 2.636
285 2HB LEU 42 HB1 LEU 42 73.918 1.376 1.376
286 HG LEU 42 HG LEU 42 71.178 1.509 1.509
287 HD1 LEU 42 HD1 LEU 42 70.099 1.001 1.001
288 HD1 LEU 42 HD1 LEU 42 71.618 1.349 1.349
289 HD1 LEU 42 HD1 LEU 42 70.762 2.635 2.635
290 HD2 LEU 42 HD2 LEU 42 72.762 -0.484 -0.484
291 HD2 LEU 42 HD2 LEU 42 71.188 -0.811 -0.811
292 HD2 LEU 42 HD2 LEU 42 72.585 -0.491 -0.491
293 H GLY 43 HN GLY 43 75.243 1.915 1.915
294 1HA GLY 43 HA2 GLY 43 74.319 0.050 0.050
295 2HA GLY 43 HA1 GLY 43 75.921 0.789 0.789
296 H THR 44 HN THR 44 75.448 3.396 3.396
297 HA THR 44 HA THR 44 75.056 3.572 3.572
298 HB THR 44 HB THR 44 74.673 5.478 5.478
299 HG1 THR 44 HG1 THR 44 76.588 5.006 5.006
300 1HG2 THR 44 HG23 THR 44 74.223 5.984 5.984
301 2HG2 THR 44 HG22 THR 44 74.718 7.276 7.276
302 3HG2 THR 44 HG21 THR 44 73.194 6.432 6.432
303 H VAL 45 HN VAL 45 72.607 4.608 4.608
304 HA VAL 45 HA VAL 45 70.424 5.008 5.008
305 HB VAL 45 HB VAL 45 70.699 3.832 3.832
306 1HG1 VAL 45 HG12 VAL 45 68.553 3.090 3.090
307 2HG1 VAL 45 HG11 VAL 45 68.149 4.783 4.783
308 3HG1 VAL 45 HG13 VAL 45 68.309 4.177 4.177
309 1HG2 VAL 45 HG21 VAL 45 71.399 6.182 6.182
310 2HG2 VAL 45 HG23 VAL 45 69.963 6.089 6.089
311 3HG2 VAL 45 HG22 VAL 45 69.811 6.545 6.545
312 H MET 46 HN MET 46 70.725 1.955 1.955
313 HA MET 46 HA MET 46 68.901 0.369 0.369
314 1HB MET 46 HB2 MET 46 71.683 -0.215 -0.215
315 2HB MET 46 HB1 MET 46 70.592 -1.498 -1.498
316 1HG MET 46 HG2 MET 46 68.902 -0.744 -0.744
317 2HG MET 46 HG1 MET 46 69.970 0.561 0.561
318 1HE MET 46 HE2 MET 46 68.791 -2.676 -2.676
319 2HE MET 46 HE1 MET 46 69.273 -3.312 -3.312
320 3HE MET 46 HE3 MET 46 70.158 -3.781 -3.781
321 H ARG 47 HN ARG 47 72.242 1.022 1.022
322 HA ARG 47 HA ARG 47 71.999 -0.626 -0.626
323 1HB ARG 47 HB2 ARG 47 73.998 0.618 0.618
324 2HB ARG 47 HB1 ARG 47 73.986 1.526 1.526
325 1HG ARG 47 HG2 ARG 47 73.858 -0.907 -0.907
326 2HG ARG 47 HG1 ARG 47 74.600 -1.365 -1.365
327 1HD ARG 47 HD2 ARG 47 75.731 0.956 0.956
328 2HD ARG 47 HD1 ARG 47 76.167 -0.705 -0.705
329 HE ARG 47 HE ARG 47 76.473 -0.712 -0.712
330 1HH1 ARG 47 HH1 ARG 47 78.549 -0.330 -0.330
331 2HH1 ARG 47 HH1 ARG 47 79.579 0.849 0.849
332 1HH2 ARG 47 HH2 ARG 47 77.384 1.533 1.533
333 2HH2 ARG 47 HH2 ARG 47 78.921 1.904 1.904
334 H MET 48 HN MET 48 71.885 2.897 2.897
335 HA MET 48 HA MET 48 71.500 3.704 3.704
336 1HB MET 48 HB2 MET 48 71.467 4.800 4.800
337 2HB MET 48 HB1 MET 48 70.201 5.529 5.529
338 1HG MET 48 HG2 MET 48 72.429 5.401 5.401
339 2HG MET 48 HG1 MET 48 73.081 5.910 5.910
340 1HE MET 48 HE1 MET 48 72.429 6.979 6.979
341 2HE MET 48 HE3 MET 48 71.498 8.483 8.483
342 3HE MET 48 HE2 MET 48 70.669 6.929 6.929
343 H LEU 49 HN LEU 49 69.426 2.003 2.003
344 HA LEU 49 HA LEU 49 66.915 3.057 3.057
345 1HB LEU 49 HB2 LEU 49 67.687 0.934 0.934
346 2HB LEU 49 HB1 LEU 49 66.013 1.202 1.202
347 HG LEU 49 HG LEU 49 67.874 3.235 3.235
348 HD1 LEU 49 HD1 LEU 49 66.080 3.207 3.207
349 HD1 LEU 49 HD1 LEU 49 65.363 1.824 1.824
350 HD1 LEU 49 HD1 LEU 49 66.981 1.697 1.697
351 HD2 LEU 49 HD2 LEU 49 65.197 3.463 3.463
352 HD2 LEU 49 HD2 LEU 49 65.575 4.524 4.524
353 HD2 LEU 49 HD2 LEU 49 66.583 4.551 4.551
354 H GLY 50 HN GLY 50 68.772 -0.002 -0.002
355 1HA GLY 50 HA2 GLY 50 68.513 -0.745 -0.745
356 2HA GLY 50 HA1 GLY 50 66.933 -1.184 -1.184
357 H GLN 51 HN GLN 51 68.330 -1.707 -1.707
358 HA GLN 51 HA GLN 51 68.864 -4.549 -4.549
359 1HB GLN 51 HB2 GLN 51 69.243 -3.028 -3.028
360 2HB GLN 51 HB1 GLN 51 68.757 -4.711 -4.711
361 1HG GLN 51 HG2 GLN 51 66.615 -4.035 -4.035
362 2HG GLN 51 HG1 GLN 51 66.843 -3.196 -3.196
363 1HE2 GLN 51 HE22 GLN 51 65.788 -0.487 -0.487
364 2HE2 GLN 51 HE21 GLN 51 65.121 -1.769 -1.769
365 H ASN 52 HN ASN 52 70.877 -5.332 -5.332
366 HA ASN 52 HA ASN 52 73.239 -3.578 -3.578
367 1HB ASN 52 HB2 ASN 52 72.459 -5.977 -5.977
368 2HB ASN 52 HB1 ASN 52 74.097 -6.074 -6.074
369 HD2 ASN 52 HD2 ASN 52 72.459 -5.082 -5.082
370 HD2 ASN 52 HD2 ASN 52 73.518 -3.871 -3.871
371 HA PRO 53 HA PRO 53 73.353 -5.860 -5.860
372 1HB PRO 53 HB2 PRO 53 74.262 -3.727 -3.727
373 2HB PRO 53 HB1 PRO 53 72.539 -4.016 -4.016
374 1HG PRO 53 HG2 PRO 53 74.417 -2.129 -2.129
375 2HG PRO 53 HG1 PRO 53 72.715 -1.911 -1.911
376 1HD PRO 53 HD2 PRO 53 73.566 -2.472 -2.472
377 2HD PRO 53 HD1 PRO 53 71.965 -2.930 -2.930
378 H THR 54 HN THR 54 75.168 -7.152 -7.152
379 HA THR 54 HA THR 54 77.738 -6.212 -6.212
380 HB THR 54 HB THR 54 78.393 -8.481 -8.481
381 HG1 THR 54 HG1 THR 54 77.411 -9.722 -9.722
382 1HG2 THR 54 HG23 THR 54 76.341 -7.943 -7.943
383 2HG2 THR 54 HG22 THR 54 75.450 -8.880 -8.880
384 3HG2 THR 54 HG21 THR 54 76.800 -9.612 -9.612
385 H LYS 55 HN LYS 55 79.655 -5.860 -5.860
386 HA LYS 55 HA LYS 55 79.576 -4.372 -4.372
387 1HB LYS 55 HB2 LYS 55 81.527 -5.013 -5.013
388 2HB LYS 55 HB1 LYS 55 81.678 -6.479 -6.479
389 1HG LYS 55 HG2 LYS 55 82.480 -5.352 -5.352
390 2HG LYS 55 HG1 LYS 55 81.504 -3.919 -3.919
391 1HD LYS 55 HD2 LYS 55 83.446 -2.990 -2.990
392 2HD LYS 55 HD1 LYS 55 83.204 -3.962 -3.962
393 1HE LYS 55 HE2 LYS 55 84.905 -5.388 -5.388
394 2HE LYS 55 HE1 LYS 55 84.457 -5.420 -5.420
395 1HZ LYS 55 HZ2 LYS 55 85.215 -2.979 -2.979
396 2HZ LYS 55 HZ1 LYS 55 86.048 -3.406 -3.406
397 3HZ LYS 55 HZ3 LYS 55 86.406 -4.191 -4.191
398 H GLU 56 HN GLU 56 80.370 -7.876 -7.876
399 HA GLU 56 HA GLU 56 80.288 -8.394 -8.394
400 1HB GLU 56 HB2 GLU 56 80.085 -9.810 -9.810
401 2HB GLU 56 HB1 GLU 56 78.809 -10.430 -10.430
402 1HG GLU 56 HG2 GLU 56 80.444 -11.722 -11.722
403 2HG GLU 56 HG1 GLU 56 80.934 -10.249 -10.249
404 H GLU 57 HN GLU 57 77.431 -8.470 -8.470
405 HA GLU 57 HA GLU 57 75.512 -8.850 -8.850
406 1HB GLU 57 HB2 GLU 57 75.493 -7.957 -7.957
407 2HB GLU 57 HB1 GLU 57 74.004 -7.919 -7.919
408 1HG GLU 57 HG2 GLU 57 75.615 -10.415 -10.415
409 2HG GLU 57 HG1 GLU 57 74.790 -10.105 -10.105
410 H LEU 58 HN LEU 58 76.452 -5.937 -5.937
411 HA LEU 58 HA LEU 58 74.799 -4.063 -4.063
412 1HB LEU 58 HB2 LEU 58 75.900 -3.442 -3.442
413 2HB LEU 58 HB1 LEU 58 77.473 -3.964 -3.964
414 HG LEU 58 HG LEU 58 77.370 -2.147 -2.147
415 HD1 LEU 58 HD1 LEU 58 74.811 -1.546 -1.546
416 HD1 LEU 58 HD1 LEU 58 75.036 -1.759 -1.759
417 HD1 LEU 58 HD1 LEU 58 75.654 -0.314 -0.314
418 HD2 LEU 58 HD2 LEU 58 77.730 -1.905 -1.905
419 HD2 LEU 58 HD2 LEU 58 77.087 -0.392 -0.392
420 HD2 LEU 58 HD2 LEU 58 78.584 -1.060 -1.060
421 H ASP 59 HN ASP 59 78.130 -5.126 -5.126
422 HA ASP 59 HA ASP 59 78.594 -3.400 -3.400
423 1HB ASP 59 HB2 ASP 59 79.556 -6.162 -6.162
424 2HB ASP 59 HB1 ASP 59 80.217 -5.292 -5.292
425 H ALA 60 HN ALA 60 77.163 -6.673 -6.673
426 HA ALA 60 HA ALA 60 76.835 -7.076 -7.076
427 1HB ALA 60 HB2 ALA 60 76.067 -8.248 -8.248
428 2HB ALA 60 HB1 ALA 60 74.686 -8.271 -8.271
429 3HB ALA 60 HB3 ALA 60 76.206 -9.028 -9.028
430 H ILE 61 HN ILE 61 74.632 -5.611 -5.611
431 HA ILE 61 HA ILE 61 72.495 -5.104 -5.104
432 HB ILE 61 HB ILE 61 73.288 -4.170 -4.170
433 1HG1 ILE 61 HG12 ILE 61 70.891 -5.232 -5.232
434 2HG1 ILE 61 HG11 ILE 61 71.237 -5.979 -5.979
435 1HG2 ILE 61 HG23 ILE 61 72.188 -2.267 -2.267
436 2HG2 ILE 61 HG22 ILE 61 70.783 -3.305 -3.305
437 3HG2 ILE 61 HG21 ILE 61 71.269 -2.842 -2.842
438 HD1 ILE 61 HD1 ILE 61 73.358 -6.877 -6.877
439 HD1 ILE 61 HD1 ILE 61 71.962 -7.453 -7.453
440 HD1 ILE 61 HD1 ILE 61 72.970 -6.164 -6.164
441 H ILE 62 HN ILE 62 74.881 -2.888 -2.888
442 HA ILE 62 HA ILE 62 74.299 -0.507 -0.507
443 HB ILE 62 HB ILE 62 76.901 -1.870 -1.870
444 1HG1 ILE 62 HG12 ILE 62 75.342 0.452 0.452
445 2HG1 ILE 62 HG11 ILE 62 75.404 -1.186 -1.186
446 1HG2 ILE 62 HG23 ILE 62 76.533 0.437 0.437
447 2HG2 ILE 62 HG22 ILE 62 77.330 0.912 0.912
448 3HG2 ILE 62 HG21 ILE 62 78.034 -0.350 -0.350
449 HD1 ILE 62 HD1 ILE 62 77.729 0.739 0.739
450 HD1 ILE 62 HD1 ILE 62 77.889 -0.945 -0.945
451 HD1 ILE 62 HD1 ILE 62 76.988 0.193 0.193
452 H GLU 63 HN GLU 63 76.645 -2.905 -2.905
453 HA GLU 63 HA GLU 63 77.003 -1.749 -1.749
454 1HB GLU 63 HB2 GLU 63 78.408 -3.524 -3.524
455 2HB GLU 63 HB1 GLU 63 77.028 -4.608 -4.608
456 1HG GLU 63 HG2 GLU 63 76.694 -4.599 -4.599
457 2HG GLU 63 HG1 GLU 63 78.061 -3.499 -3.499
458 H GLU 64 HN GLU 64 74.398 -3.765 -3.765
459 HA GLU 64 HA GLU 64 73.178 -4.332 -4.332
460 1HB GLU 64 HB2 GLU 64 72.560 -5.856 -5.856
461 2HB GLU 64 HB1 GLU 64 72.592 -4.654 -4.654
462 1HG GLU 64 HG2 GLU 64 70.473 -3.719 -3.719
463 2HG GLU 64 HG1 GLU 64 70.455 -4.803 -4.803
464 H VAL 65 HN VAL 65 72.880 -1.779 -1.779
465 HA VAL 65 HA VAL 65 70.689 -0.509 -0.509
466 HB VAL 65 HB VAL 65 70.427 0.831 0.831
467 1HG1 VAL 65 HG13 VAL 65 69.851 -1.890 -1.890
468 2HG1 VAL 65 HG12 VAL 65 70.451 -1.791 -1.791
469 3HG1 VAL 65 HG11 VAL 65 69.072 -0.812 -0.812
470 1HG2 VAL 65 HG23 VAL 65 73.002 0.354 0.354
471 2HG2 VAL 65 HG22 VAL 65 71.862 0.623 0.623
472 3HG2 VAL 65 HG21 VAL 65 72.337 -1.019 -1.019
473 H ASP 66 HN ASP 66 74.019 -0.420 -0.420
474 HA ASP 66 HA ASP 66 74.311 2.516 2.516
475 1HB ASP 66 HB2 ASP 66 75.837 0.864 0.864
476 2HB ASP 66 HB1 ASP 66 76.413 0.368 0.368
477 H GLU 67 HN GLU 67 73.585 -0.036 -0.036
478 HA GLU 67 HA GLU 67 75.149 0.800 0.800
479 1HB GLU 67 HB2 GLU 67 74.023 -1.484 -1.484
480 2HB GLU 67 HB1 GLU 67 72.604 -0.797 -0.797
481 1HG GLU 67 HG2 GLU 67 73.550 -0.891 -0.891
482 2HG GLU 67 HG1 GLU 67 75.175 -0.577 -0.577
483 H ASP 68 HN ASP 68 73.975 3.117 3.117
484 HA ASP 68 HA ASP 68 71.659 3.569 3.569
485 1HB ASP 68 HB2 ASP 68 71.589 3.813 3.813
486 2HB ASP 68 HB1 ASP 68 72.409 5.344 5.344
487 H GLY 69 HN GLY 69 74.928 4.403 4.403
488 1HA GLY 69 HA2 GLY 69 76.042 5.551 5.551
489 2HA GLY 69 HA1 GLY 69 74.761 6.755 6.755
490 H SER 70 HN SER 70 74.671 6.965 6.965
491 HA SER 70 HA SER 70 77.355 8.185 8.185
492 1HB SER 70 HB2 SER 70 75.571 9.813 9.813
493 2HB SER 70 HB1 SER 70 74.532 8.914 8.914
494 HG SER 70 HG SER 70 75.979 10.836 10.836
495 H GLY 71 HN GLY 71 74.519 6.730 6.730
496 1HA GLY 71 HA2 GLY 71 75.159 4.717 4.717
497 2HA GLY 71 HA1 GLY 71 76.397 5.776 5.776
498 H THR 72 HN THR 72 72.889 6.050 6.050
499 HA THR 72 HA THR 72 72.560 7.107 7.107
500 HB THR 72 HB THR 72 70.768 8.537 8.537
501 HG1 THR 72 HG1 THR 72 70.866 8.659 8.659
502 1HG2 THR 72 HG21 THR 72 73.572 8.819 8.819
503 2HG2 THR 72 HG23 THR 72 72.959 9.369 9.369
504 3HG2 THR 72 HG22 THR 72 72.367 10.105 10.105
505 H ILE 73 HN ILE 73 70.899 6.160 6.160
506 HA ILE 73 HA ILE 73 69.393 3.955 3.955
507 HB ILE 73 HB ILE 73 70.694 3.394 3.394
508 1HG1 ILE 73 HG12 ILE 73 68.822 2.682 2.682
509 2HG1 ILE 73 HG11 ILE 73 67.715 3.596 3.596
510 1HG2 ILE 73 HG23 ILE 73 69.620 5.970 5.970
511 2HG2 ILE 73 HG22 ILE 73 69.524 4.708 4.708
512 3HG2 ILE 73 HG21 ILE 73 71.080 5.121 5.121
513 HD1 ILE 73 HD1 ILE 73 69.002 2.151 2.151
514 HD1 ILE 73 HD1 ILE 73 67.532 1.593 1.593
515 HD1 ILE 73 HD1 ILE 73 69.106 1.028 1.028
516 H ASP 74 HN ASP 74 67.181 4.104 4.104
517 HA ASP 74 HA ASP 74 65.857 6.643 6.643
518 1HB ASP 74 HB2 ASP 74 65.408 4.281 4.281
519 2HB ASP 74 HB1 ASP 74 63.970 5.148 5.148
520 H PHE 75 HN PHE 75 64.065 6.770 6.770
521 HA PHE 75 HA PHE 75 64.019 5.129 5.129
522 1HB PHE 75 HB2 PHE 75 62.984 7.470 7.470
523 2HB PHE 75 HB1 PHE 75 61.564 6.512 6.512
524 HD1 PHE 75 HD2 PHE 75 60.481 5.056 5.056
525 HD2 PHE 75 HD1 PHE 75 63.623 7.818 7.818
526 HE1 PHE 75 HE2 PHE 75 59.876 4.897 4.897
527 HE2 PHE 75 HE1 PHE 75 63.017 7.660 7.660
528 HZ PHE 75 HZ PHE 75 61.145 6.200 6.200
529 H GLU 76 HN GLU 76 61.793 5.063 5.063
530 HA GLU 76 HA GLU 76 60.141 2.927 2.927
531 1HB GLU 76 HB2 GLU 76 59.817 2.662 2.662
532 2HB GLU 76 HB1 GLU 76 59.781 4.353 4.353
533 1HG GLU 76 HG2 GLU 76 62.281 4.417 4.417
534 2HG GLU 76 HG1 GLU 76 62.041 2.863 2.863
535 H GLU 77 HN GLU 77 63.272 2.801 2.801
536 HA GLU 77 HA GLU 77 63.293 -0.123 -0.123
537 1HB GLU 77 HB2 GLU 77 64.354 1.509 1.509
538 2HB GLU 77 HB1 GLU 77 65.553 1.862 1.862
539 1HG GLU 77 HG2 GLU 77 66.605 0.177 0.177
540 2HG GLU 77 HG1 GLU 77 65.872 -0.729 -0.729
541 H PHE 78 HN PHE 78 64.707 2.403 2.403
542 HA PHE 78 HA PHE 78 66.542 0.800 0.800
543 1HB PHE 78 HB2 PHE 78 66.682 3.158 3.158
544 2HB PHE 78 HB1 PHE 78 64.958 3.322 3.322
545 HD1 PHE 78 HD1 PHE 78 67.969 1.597 1.597
546 HD2 PHE 78 HD2 PHE 78 64.321 3.737 3.737
547 HE1 PHE 78 HE1 PHE 78 68.426 1.519 1.519
548 HE2 PHE 78 HE2 PHE 78 64.777 3.658 3.658
549 HZ PHE 78 HZ PHE 78 66.830 2.549 2.549
550 H LEU 79 HN LEU 79 63.079 1.486 1.486
551 HA LEU 79 HA LEU 79 62.577 0.442 0.442
552 1HB LEU 79 HB2 LEU 79 61.146 0.250 0.250
553 2HB LEU 79 HB1 LEU 79 60.435 -0.460 -0.460
554 HG LEU 79 HG LEU 79 61.346 2.424 2.424
555 HD1 LEU 79 HD1 LEU 79 58.643 1.115 1.115
556 HD1 LEU 79 HD1 LEU 79 59.459 2.234 2.234
557 HD1 LEU 79 HD1 LEU 79 58.807 2.816 2.816
558 HD2 LEU 79 HD2 LEU 79 59.782 0.878 0.878
559 HD2 LEU 79 HD2 LEU 79 59.979 2.630 2.630
560 HD2 LEU 79 HD2 LEU 79 61.386 1.584 1.584
561 H VAL 80 HN VAL 80 63.428 -1.375 -1.375
562 HA VAL 80 HA VAL 80 62.818 -3.999 -3.999
563 HB VAL 80 HB VAL 80 64.852 -3.142 -3.142
564 1HG1 VAL 80 HG13 VAL 80 63.516 -5.706 -5.706
565 2HG1 VAL 80 HG12 VAL 80 63.822 -5.411 -5.411
566 3HG1 VAL 80 HG11 VAL 80 65.162 -5.425 -5.425
567 1HG2 VAL 80 HG23 VAL 80 62.168 -2.481 -2.481
568 2HG2 VAL 80 HG22 VAL 80 63.164 -2.620 -2.620
569 3HG2 VAL 80 HG21 VAL 80 62.182 -3.985 -3.985
570 H MET 81 HN MET 81 65.819 -2.068 -2.068
571 HA MET 81 HA MET 81 67.597 -3.988 -3.988
572 1HB MET 81 HB2 MET 81 67.427 -1.080 -1.080
573 2HB MET 81 HB1 MET 81 68.517 -1.540 -1.540
574 1HG MET 81 HG2 MET 81 69.686 -1.471 -1.471
575 2HG MET 81 HG1 MET 81 69.691 -3.092 -3.092
576 1HE MET 81 HE1 MET 81 68.789 -0.690 -0.690
577 2HE MET 81 HE3 MET 81 67.951 -1.506 -1.506
578 3HE MET 81 HE2 MET 81 67.046 -0.937 -0.937
579 H MET 82 HN MET 82 66.569 -1.114 -1.114
580 HA MET 82 HA MET 82 67.132 -2.003 -2.003
581 1HB MET 82 HB2 MET 82 64.980 -0.579 -0.579
582 2HB MET 82 HB1 MET 82 66.376 0.203 0.203
583 1HG MET 82 HG2 MET 82 65.360 0.292 0.292
584 2HG MET 82 HG1 MET 82 64.200 -0.975 -0.975
585 1HE MET 82 HE1 MET 82 61.971 -0.506 -0.506
586 2HE MET 82 HE3 MET 82 62.272 -0.634 -0.634
587 3HE MET 82 HE2 MET 82 61.224 0.637 0.637
588 H VAL 83 HN VAL 83 64.400 -2.974 -2.974
589 HA VAL 83 HA VAL 83 63.042 -4.374 -4.374
590 HB VAL 83 HB VAL 83 62.673 -4.136 -4.136
591 1HG1 VAL 83 HG12 VAL 83 61.911 -6.371 -6.371
592 2HG1 VAL 83 HG11 VAL 83 60.838 -5.520 -5.520
593 3HG1 VAL 83 HG13 VAL 83 60.599 -5.375 -5.375
594 1HG2 VAL 83 HG21 VAL 83 62.158 -2.289 -2.289
595 2HG2 VAL 83 HG23 VAL 83 61.039 -2.564 -2.564
596 3HG2 VAL 83 HG22 VAL 83 60.710 -3.267 -3.267
597 H ARG 84 HN ARG 84 64.310 -5.532 -5.532
598 HA ARG 84 HA ARG 84 64.310 -8.261 -8.261
599 1HB ARG 84 HB2 ARG 84 66.471 -6.517 -6.517
600 2HB ARG 84 HB1 ARG 84 66.309 -8.251 -8.251
601 1HG ARG 84 HG2 ARG 84 63.807 -6.769 -6.769
602 2HG ARG 84 HG1 ARG 84 65.097 -6.285 -6.285
603 1HD ARG 84 HD2 ARG 84 64.816 -9.213 -9.213
604 2HD ARG 84 HD1 ARG 84 63.488 -8.423 -8.423
605 HE ARG 84 HE ARG 84 64.995 -8.019 -8.019
606 1HH1 ARG 84 HH1 ARG 84 66.634 -9.782 -9.782
607 2HH1 ARG 84 HH1 ARG 84 68.215 -9.209 -9.209
608 1HH2 ARG 84 HH2 ARG 84 67.051 -6.747 -6.747
609 2HH2 ARG 84 HH2 ARG 84 68.451 -7.490 -7.490
610 H GLN 85 HN GLN 85 66.404 -5.895 -5.895
611 HA GLN 85 HA GLN 85 68.227 -7.921 -7.921
612 1HB GLN 85 HB2 GLN 85 68.831 -5.563 -5.563
613 2HB GLN 85 HB1 GLN 85 67.870 -4.983 -4.983
614 1HG GLN 85 HG2 GLN 85 70.279 -5.154 -5.154
615 2HG GLN 85 HG1 GLN 85 69.286 -6.230 -6.230
616 1HE2 GLN 85 HE22 GLN 85 71.406 -8.890 -8.890
617 2HE2 GLN 85 HE21 GLN 85 70.677 -8.007 -8.007
618 H MET 86 HN MET 86 65.694 -5.718 -5.718
619 HA MET 86 HA MET 86 65.845 -6.653 -6.653
620 1HB MET 86 HB2 MET 86 64.397 -4.767 -4.767
621 2HB MET 86 HB1 MET 86 63.260 -5.651 -5.651
622 1HG MET 86 HG2 MET 86 65.620 -4.972 -4.972
623 2HG MET 86 HG1 MET 86 64.940 -3.522 -3.522
624 1HE MET 86 HE2 MET 86 63.206 -2.510 -2.510
625 2HE MET 86 HE1 MET 86 61.647 -3.301 -3.301
626 3HE MET 86 HE3 MET 86 62.363 -2.379 -2.379
627 H LYS 87 HN LYS 87 64.322 -7.904 -7.904
628 HA LYS 87 HA LYS 87 62.129 -9.349 -9.349
629 1HB LYS 87 HB2 LYS 87 64.176 -9.629 -9.629
630 2HB LYS 87 HB1 LYS 87 63.254 -11.086 -11.086
631 1HG LYS 87 HG2 LYS 87 61.503 -8.782 -8.782
632 2HG LYS 87 HG1 LYS 87 62.422 -8.922 -8.922
633 1HD LYS 87 HD2 LYS 87 61.303 -11.450 -11.450
634 2HD LYS 87 HD1 LYS 87 60.134 -10.293 -10.293
635 1HE LYS 87 HE2 LYS 87 62.415 -10.487 -10.487
636 2HE LYS 87 HE1 LYS 87 61.689 -12.084 -12.084
637 1HZ LYS 87 HZ3 LYS 87 59.979 -9.721 -9.721
638 2HZ LYS 87 HZ2 LYS 87 60.643 -10.541 -10.541
639 3HZ LYS 87 HZ1 LYS 87 59.616 -11.359 -11.359
640 H GLU 88 HN GLU 88 65.554 -9.938 -9.938
641 HA GLU 88 HA GLU 88 64.992 -12.524 -12.524
642 1HB GLU 88 HB2 GLU 88 66.945 -11.692 -11.692
643 2HB GLU 88 HB1 GLU 88 67.739 -11.431 -11.431
644 1HG GLU 88 HG2 GLU 88 66.326 -13.969 -13.969
645 2HG GLU 88 HG1 GLU 88 67.495 -13.872 -13.872
646 H ASP 89 HN ASP 89 66.221 -9.246 -9.246
647 HA ASP 89 HA ASP 89 66.907 -9.761 -9.761
648 1HB ASP 89 HB2 ASP 89 68.069 -8.063 -8.063
649 2HB ASP 89 HB1 ASP 89 66.551 -7.285 -7.285
650 H ALA 90 HN ALA 90 64.054 -8.720 -8.720
651 HA ALA 90 HA ALA 90 62.674 -7.702 -7.702
652 1HB ALA 90 HB1 ALA 90 62.462 -6.978 -6.978
653 2HB ALA 90 HB3 ALA 90 61.486 -8.433 -8.433
654 3HB ALA 90 HB2 ALA 90 60.961 -7.172 -7.172
Start of MODEL 26
1 1H ALA 1 HT1 ALA 1 63.497 -1.789 -1.789
2 2H ALA 1 HT3 ALA 1 64.787 -1.110 -1.110
3 3H ALA 1 HT2 ALA 1 63.697 -2.156 -2.156
4 HA ALA 1 HA ALA 1 65.495 -3.552 -3.552
5 1HB ALA 1 HB3 ALA 1 65.902 -1.516 -1.516
6 2HB ALA 1 HB2 ALA 1 66.194 -3.121 -3.121
7 3HB ALA 1 HB1 ALA 1 67.091 -2.583 -2.583
8 H SER 2 HN SER 2 65.792 -5.373 -5.373
9 HA SER 2 HA SER 2 63.125 -6.475 -6.475
10 1HB SER 2 HB2 SER 2 65.094 -7.813 -7.813
11 2HB SER 2 HB1 SER 2 65.913 -7.381 -7.381
12 HG SER 2 HG SER 2 64.847 -9.422 -9.422
13 H MET 3 HN MET 3 65.230 -4.411 -4.411
14 HA MET 3 HA MET 3 64.790 -5.210 -5.210
15 1HB MET 3 HB2 MET 3 65.695 -2.832 -2.832
16 2HB MET 3 HB1 MET 3 65.221 -2.549 -2.549
17 1HG MET 3 HG2 MET 3 67.665 -3.104 -3.104
18 2HG MET 3 HG1 MET 3 66.805 -4.194 -4.194
19 1HE MET 3 HE1 MET 3 69.402 -4.432 -4.432
20 2HE MET 3 HE3 MET 3 69.202 -6.162 -6.162
21 3HE MET 3 HE2 MET 3 69.706 -5.604 -5.604
22 H THR 4 HN THR 4 63.069 -2.926 -2.926
23 HA THR 4 HA THR 4 61.262 -1.733 -1.733
24 HB THR 4 HB THR 4 61.115 -2.800 -2.800
25 HG1 THR 4 HG1 THR 4 62.281 -0.880 -0.880
26 1HG2 THR 4 HG21 THR 4 58.876 -1.617 -1.617
27 2HG2 THR 4 HG23 THR 4 58.948 -1.356 -1.356
28 3HG2 THR 4 HG22 THR 4 58.832 -2.995 -2.995
29 H ASP 5 HN ASP 5 61.381 -5.105 -5.105
30 HA ASP 5 HA ASP 5 58.689 -5.807 -5.807
31 1HB ASP 5 HB2 ASP 5 61.195 -7.085 -7.085
32 2HB ASP 5 HB1 ASP 5 60.217 -8.091 -8.091
33 H GLN 6 HN GLN 6 61.873 -5.918 -5.918
34 HA GLN 6 HA GLN 6 60.746 -6.989 -6.989
35 1HB GLN 6 HB2 GLN 6 63.365 -6.345 -6.345
36 2HB GLN 6 HB1 GLN 6 63.292 -6.111 -6.111
37 1HG GLN 6 HG2 GLN 6 63.149 -8.337 -8.337
38 2HG GLN 6 HG1 GLN 6 62.012 -8.597 -8.597
39 1HE2 GLN 6 HE22 GLN 6 66.026 -8.625 -8.625
40 2HE2 GLN 6 HE21 GLN 6 65.480 -7.593 -7.593
41 H GLN 7 HN GLN 7 60.743 -3.962 -3.962
42 HA GLN 7 HA GLN 7 61.276 -2.329 -2.329
43 1HB GLN 7 HB2 GLN 7 60.682 -2.039 -2.039
44 2HB GLN 7 HB1 GLN 7 59.850 -0.831 -0.831
45 1HG GLN 7 HG2 GLN 7 61.840 0.071 0.071
46 2HG GLN 7 HG1 GLN 7 62.754 -1.404 -1.404
47 1HE2 GLN 7 HE22 GLN 7 63.916 -0.085 -0.085
48 2HE2 GLN 7 HE21 GLN 7 64.243 -0.977 -0.977
49 H ALA 8 HN ALA 8 58.357 -3.298 -3.298
50 HA ALA 8 HA ALA 8 56.443 -1.936 -1.936
51 1HB ALA 8 HB2 ALA 8 56.580 -3.880 -3.880
52 2HB ALA 8 HB1 ALA 8 55.325 -4.340 -4.340
53 3HB ALA 8 HB3 ALA 8 55.277 -2.754 -2.754
54 H GLU 9 HN GLU 9 57.368 -5.407 -5.407
55 HA GLU 9 HA GLU 9 55.913 -5.965 -5.965
56 1HB GLU 9 HB2 GLU 9 57.028 -8.094 -8.094
57 2HB GLU 9 HB1 GLU 9 56.731 -7.551 -7.551
58 1HG GLU 9 HG2 GLU 9 59.126 -6.444 -6.444
59 2HG GLU 9 HG1 GLU 9 59.312 -7.712 -7.712
60 H ALA 10 HN ALA 10 58.760 -4.197 -4.197
61 HA ALA 10 HA ALA 10 60.161 -4.951 -4.951
62 1HB ALA 10 HB3 ALA 10 60.476 -3.154 -3.154
63 2HB ALA 10 HB2 ALA 10 61.205 -2.556 -2.556
64 3HB ALA 10 HB1 ALA 10 61.685 -4.125 -4.125
65 H ARG 11 HN ARG 11 57.648 -2.678 -2.678
66 HA ARG 11 HA ARG 11 58.045 -1.152 -1.152
67 1HB ARG 11 HB2 ARG 11 55.879 -0.620 -0.620
68 2HB ARG 11 HB1 ARG 11 56.774 0.524 0.524
69 1HG ARG 11 HG2 ARG 11 58.130 0.916 0.916
70 2HG ARG 11 HG1 ARG 11 58.681 -0.755 -0.755
71 1HD ARG 11 HD2 ARG 11 57.052 -1.478 -1.478
72 2HD ARG 11 HD1 ARG 11 56.106 0.011 0.011
73 HE ARG 11 HE ARG 11 58.871 0.019 0.019
74 1HH1 ARG 11 HH2 ARG 11 57.188 2.517 2.517
75 2HH1 ARG 11 HH2 ARG 11 56.628 2.996 2.996
76 1HH2 ARG 11 HH1 ARG 11 57.460 -0.013 -0.013
77 2HH2 ARG 11 HH1 ARG 11 56.782 1.564 1.564
78 H ALA 12 HN ALA 12 55.565 -3.040 -3.040
79 HA ALA 12 HA ALA 12 53.426 -2.879 -2.879
80 1HB ALA 12 HB3 ALA 12 54.253 -4.397 -4.397
81 2HB ALA 12 HB2 ALA 12 53.813 -5.576 -5.576
82 3HB ALA 12 HB1 ALA 12 52.641 -4.365 -4.365
83 H PHE 13 HN PHE 13 56.444 -4.666 -4.666
84 HA PHE 13 HA PHE 13 55.859 -6.577 -6.577
85 1HB PHE 13 HB2 PHE 13 58.062 -6.365 -6.365
86 2HB PHE 13 HB1 PHE 13 58.189 -4.684 -4.684
87 HD1 PHE 13 HD1 PHE 13 57.009 -7.736 -7.736
88 HD2 PHE 13 HD2 PHE 13 59.902 -4.571 -4.571
89 HE1 PHE 13 HE1 PHE 13 57.981 -8.472 -8.472
90 HE2 PHE 13 HE2 PHE 13 60.875 -5.305 -5.305
91 HZ PHE 13 HZ PHE 13 59.914 -7.257 -7.257
92 H LEU 14 HN LEU 14 56.362 -3.079 -3.079
93 HA LEU 14 HA LEU 14 55.380 -3.387 -3.387
94 1HB LEU 14 HB2 LEU 14 57.095 -1.196 -1.196
95 2HB LEU 14 HB1 LEU 14 56.788 -1.480 -1.480
96 HG LEU 14 HG LEU 14 58.074 -3.578 -3.578
97 HD1 LEU 14 HD1 LEU 14 59.617 -1.695 -1.695
98 HD1 LEU 14 HD1 LEU 14 59.307 -1.292 -1.292
99 HD1 LEU 14 HD1 LEU 14 60.222 -2.744 -2.744
100 HD2 LEU 14 HD2 LEU 14 58.955 -3.530 -3.530
101 HD2 LEU 14 HD2 LEU 14 57.981 -4.762 -4.762
102 HD2 LEU 14 HD2 LEU 14 57.196 -3.406 -3.406
103 H SER 15 HN SER 15 53.916 -1.706 -1.706
104 HA SER 15 HA SER 15 52.116 -0.705 -0.705
105 1HB SER 15 HB2 SER 15 50.921 0.130 0.130
106 2HB SER 15 HB1 SER 15 51.142 -1.613 -1.613
107 HG SER 15 HG SER 15 51.775 -0.457 -0.457
108 H GLU 16 HN GLU 16 51.292 1.689 1.689
109 HA GLU 16 HA GLU 16 53.303 3.530 3.530
110 1HB GLU 16 HB2 GLU 16 51.593 5.175 5.175
111 2HB GLU 16 HB1 GLU 16 50.770 3.717 3.717
112 1HG GLU 16 HG2 GLU 16 50.456 3.073 3.073
113 2HG GLU 16 HG1 GLU 16 51.085 4.660 4.660
114 H GLU 17 HN GLU 17 52.167 2.565 2.565
115 HA GLU 17 HA GLU 17 53.252 4.507 4.507
116 1HB GLU 17 HB2 GLU 17 52.973 1.517 1.517
117 2HB GLU 17 HB1 GLU 17 53.750 2.370 2.370
118 1HG GLU 17 HG2 GLU 17 51.367 3.788 3.788
119 2HG GLU 17 HG1 GLU 17 50.969 2.093 2.093
120 H MET 18 HN MET 18 55.071 1.482 1.482
121 HA MET 18 HA MET 18 57.601 2.528 2.528
122 1HB MET 18 HB2 MET 18 57.057 0.145 0.145
123 2HB MET 18 HB1 MET 18 56.825 0.294 0.294
124 1HG MET 18 HG2 MET 18 59.070 0.354 0.354
125 2HG MET 18 HG1 MET 18 59.430 1.260 1.260
126 1HE MET 18 HE2 MET 18 58.983 0.543 0.543
127 2HE MET 18 HE1 MET 18 58.398 -1.045 -1.045
128 3HE MET 18 HE3 MET 18 60.129 -0.683 -0.683
129 H ILE 19 HN ILE 19 56.257 2.049 2.049
130 HA ILE 19 HA ILE 19 58.332 2.986 2.986
131 HB ILE 19 HB ILE 19 55.335 3.372 3.372
132 1HG1 ILE 19 HG12 ILE 19 57.147 1.678 1.678
133 2HG1 ILE 19 HG11 ILE 19 56.475 1.085 1.085
134 1HG2 ILE 19 HG22 ILE 19 57.403 4.652 4.652
135 2HG2 ILE 19 HG21 ILE 19 56.320 3.661 3.661
136 3HG2 ILE 19 HG23 ILE 19 55.665 4.951 4.951
137 HD1 ILE 19 HD1 ILE 19 54.187 1.836 1.836
138 HD1 ILE 19 HD1 ILE 19 54.911 0.375 0.375
139 HD1 ILE 19 HD1 ILE 19 55.010 1.897 1.897
140 H ALA 20 HN ALA 20 55.924 4.989 4.989
141 HA ALA 20 HA ALA 20 56.979 7.519 7.519
142 1HB ALA 20 HB1 ALA 20 55.241 6.623 6.623
143 2HB ALA 20 HB3 ALA 20 55.559 8.321 8.321
144 3HB ALA 20 HB2 ALA 20 54.712 7.318 7.318
145 H GLU 21 HN GLU 21 57.947 5.278 5.278
146 HA GLU 21 HA GLU 21 59.364 7.225 7.225
147 1HB GLU 21 HB2 GLU 21 58.540 5.239 5.239
148 2HB GLU 21 HB1 GLU 21 59.237 4.211 4.211
149 1HG GLU 21 HG2 GLU 21 60.590 4.122 4.122
150 2HG GLU 21 HG1 GLU 21 61.505 4.843 4.843
151 H PHE 22 HN PHE 22 60.168 5.095 5.095
152 HA PHE 22 HA PHE 22 63.054 5.421 5.421
153 1HB PHE 22 HB2 PHE 22 61.235 4.481 4.481
154 2HB PHE 22 HB1 PHE 22 62.988 4.306 4.306
155 HD1 PHE 22 HD2 PHE 22 62.469 4.003 4.003
156 HD2 PHE 22 HD1 PHE 22 61.468 1.884 1.884
157 HE1 PHE 22 HE2 PHE 22 62.262 1.898 1.898
158 HE2 PHE 22 HE1 PHE 22 61.262 -0.220 -0.220
159 HZ PHE 22 HZ PHE 22 61.659 -0.212 -0.212
160 H LYS 23 HN LYS 23 60.458 7.157 7.157
161 HA LYS 23 HA LYS 23 61.809 8.554 8.554
162 1HB LYS 23 HB2 LYS 23 59.640 9.385 9.385
163 2HB LYS 23 HB1 LYS 23 60.066 10.320 10.320
164 1HG LYS 23 HG2 LYS 23 59.288 7.397 7.397
165 2HG LYS 23 HG1 LYS 23 58.125 8.711 8.711
166 1HD LYS 23 HD2 LYS 23 60.548 8.993 8.993
167 2HD LYS 23 HD1 LYS 23 59.550 7.597 7.597
168 1HE LYS 23 HE2 LYS 23 57.628 9.521 9.521
169 2HE LYS 23 HE1 LYS 23 58.973 10.477 10.477
170 1HZ LYS 23 HZ2 LYS 23 58.182 7.850 7.850
171 2HZ LYS 23 HZ1 LYS 23 57.544 9.314 9.314
172 3HZ LYS 23 HZ3 LYS 23 59.209 9.012 9.012
173 H ALA 24 HN ALA 24 61.099 10.068 10.068
174 HA ALA 24 HA ALA 24 63.015 12.145 12.145
175 1HB ALA 24 HB2 ALA 24 61.179 11.015 11.015
176 2HB ALA 24 HB1 ALA 24 62.687 11.431 11.431
177 3HB ALA 24 HB3 ALA 24 61.801 12.663 12.663
178 H ALA 25 HN ALA 25 63.509 8.786 8.786
179 HA ALA 25 HA ALA 25 66.102 9.195 9.195
180 1HB ALA 25 HB1 ALA 25 64.459 6.793 6.793
181 2HB ALA 25 HB3 ALA 25 66.020 6.656 6.656
182 3HB ALA 25 HB2 ALA 25 64.666 7.425 7.425
183 H PHE 26 HN PHE 26 64.881 7.774 7.774
184 HA PHE 26 HA PHE 26 67.489 7.149 7.149
185 1HB PHE 26 HB2 PHE 26 65.509 6.037 6.037
186 2HB PHE 26 HB1 PHE 26 64.739 7.574 7.574
187 HD1 PHE 26 HD2 PHE 26 67.311 5.127 5.127
188 HD2 PHE 26 HD1 PHE 26 65.415 8.854 8.854
189 HE1 PHE 26 HE2 PHE 26 68.331 5.052 5.052
190 HE2 PHE 26 HE1 PHE 26 66.435 8.781 8.781
191 HZ PHE 26 HZ PHE 26 67.894 6.881 6.881
192 H ASP 27 HN ASP 27 65.278 9.920 9.920
193 HA ASP 27 HA ASP 27 66.833 11.302 11.302
194 1HB ASP 27 HB2 ASP 27 64.676 11.896 11.896
195 2HB ASP 27 HB1 ASP 27 65.516 13.274 13.274
196 H MET 28 HN MET 28 67.509 10.691 10.691
197 HA MET 28 HA MET 28 68.750 13.014 13.014
198 1HB MET 28 HB2 MET 28 69.463 10.076 10.076
199 2HB MET 28 HB1 MET 28 70.185 11.329 11.329
200 1HG MET 28 HG2 MET 28 67.224 10.705 10.705
201 2HG MET 28 HG1 MET 28 68.276 10.293 10.293
202 1HE MET 28 HE1 MET 28 69.789 12.033 12.033
203 2HE MET 28 HE3 MET 28 70.176 13.041 13.041
204 3HE MET 28 HE2 MET 28 69.508 13.770 13.770
205 H PHE 29 HN PHE 29 69.779 10.916 10.916
206 HA PHE 29 HA PHE 29 72.351 12.462 12.462
207 1HB PHE 29 HB2 PHE 29 71.913 9.690 9.690
208 2HB PHE 29 HB1 PHE 29 73.429 10.464 10.464
209 HD1 PHE 29 HD2 PHE 29 70.378 8.810 8.810
210 HD2 PHE 29 HD1 PHE 29 74.159 10.544 10.544
211 HE1 PHE 29 HE2 PHE 29 70.187 7.827 7.827
212 HE2 PHE 29 HE1 PHE 29 73.969 9.560 9.560
213 HZ PHE 29 HZ PHE 29 71.983 8.201 8.201
214 H ASP 30 HN ASP 30 69.996 13.443 13.443
215 HA ASP 30 HA ASP 30 69.760 12.551 12.551
216 1HB ASP 30 HB2 ASP 30 68.380 14.157 14.157
217 2HB ASP 30 HB1 ASP 30 68.961 15.303 15.303
218 H ALA 31 HN ALA 31 72.153 12.623 12.623
219 HA ALA 31 HA ALA 31 73.689 15.028 15.028
220 1HB ALA 31 HB1 ALA 31 73.793 12.300 12.300
221 2HB ALA 31 HB3 ALA 31 74.513 13.421 13.421
222 3HB ALA 31 HB2 ALA 31 75.120 13.349 13.349
223 H ASP 32 HN ASP 32 71.483 13.643 13.643
224 HA ASP 32 HA ASP 32 72.021 15.915 15.915
225 1HB ASP 32 HB2 ASP 32 70.757 13.211 13.211
226 2HB ASP 32 HB1 ASP 32 70.191 14.411 14.411
227 H GLY 33 HN GLY 33 69.398 14.541 14.541
228 1HA GLY 33 HA2 GLY 33 67.654 15.857 15.857
229 2HA GLY 33 HA1 GLY 33 68.015 17.158 17.158
230 H GLY 34 HN GLY 34 67.540 13.774 13.774
231 1HA GLY 34 HA2 GLY 34 64.934 14.536 14.536
232 2HA GLY 34 HA1 GLY 34 66.153 13.672 13.672
233 H GLY 35 HN GLY 35 65.948 12.886 12.886
234 1HA GLY 35 HA2 GLY 35 64.838 11.087 11.087
235 2HA GLY 35 HA1 GLY 35 64.063 10.664 10.664
236 H ASP 36 HN ASP 36 67.535 11.161 11.161
237 HA ASP 36 HA ASP 36 68.076 8.261 8.261
238 1HB ASP 36 HB2 ASP 36 69.243 8.355 8.355
239 2HB ASP 36 HB1 ASP 36 67.529 8.739 8.739
240 H ILE 37 HN ILE 37 69.858 8.070 8.070
241 HA ILE 37 HA ILE 37 71.688 10.408 10.408
242 HB ILE 37 HB ILE 37 72.252 9.389 9.389
243 1HG1 ILE 37 HG12 ILE 37 70.793 6.975 6.975
244 2HG1 ILE 37 HG11 ILE 37 72.499 7.082 7.082
245 1HG2 ILE 37 HG23 ILE 37 69.653 10.125 10.125
246 2HG2 ILE 37 HG22 ILE 37 69.448 8.607 8.607
247 3HG2 ILE 37 HG21 ILE 37 70.277 9.962 9.962
248 HD1 ILE 37 HD1 ILE 37 71.091 5.939 5.939
249 HD1 ILE 37 HD1 ILE 37 70.218 7.455 7.455
250 HD1 ILE 37 HD1 ILE 37 71.938 7.362 7.362
251 H SER 38 HN SER 38 74.062 9.784 9.784
252 HA SER 38 HA SER 38 75.129 8.512 8.512
253 1HB SER 38 HB2 SER 38 75.997 9.774 9.774
254 2HB SER 38 HB1 SER 38 76.909 8.276 8.276
255 HG SER 38 HG SER 38 77.831 10.111 10.111
256 H THR 39 HN THR 39 75.293 6.366 6.366
257 HA THR 39 HA THR 39 74.187 4.211 4.211
258 HB THR 39 HB THR 39 75.889 2.874 2.874
259 HG1 THR 39 HG1 THR 39 77.423 3.960 3.960
260 1HG2 THR 39 HG23 THR 39 73.729 4.341 4.341
261 2HG2 THR 39 HG22 THR 39 75.000 4.936 4.936
262 3HG2 THR 39 HG21 THR 39 74.627 3.214 3.214
263 H LYS 40 HN LYS 40 77.255 5.797 5.797
264 HA LYS 40 HA LYS 40 78.450 3.736 3.736
265 1HB LYS 40 HB2 LYS 40 78.996 6.350 6.350
266 2HB LYS 40 HB1 LYS 40 79.165 6.415 6.415
267 1HG LYS 40 HG2 LYS 40 80.538 4.231 4.231
268 2HG LYS 40 HG1 LYS 40 80.644 4.669 4.669
269 1HD LYS 40 HD2 LYS 40 82.124 6.335 6.335
270 2HD LYS 40 HD1 LYS 40 81.223 6.907 6.907
271 1HE LYS 40 HE2 LYS 40 82.198 5.143 5.143
272 2HE LYS 40 HE1 LYS 40 83.049 4.475 4.475
273 1HZ LYS 40 HZ1 LYS 40 83.782 6.983 6.983
274 2HZ LYS 40 HZ3 LYS 40 83.540 6.966 6.966
275 3HZ LYS 40 HZ2 LYS 40 84.648 5.890 5.890
276 H GLU 41 HN GLU 41 75.906 6.032 6.032
277 HA GLU 41 HA GLU 41 76.172 5.890 5.890
278 1HB GLU 41 HB2 GLU 41 74.520 7.316 7.316
279 2HB GLU 41 HB1 GLU 41 73.859 7.170 7.170
280 1HG GLU 41 HG2 GLU 41 75.249 9.256 9.256
281 2HG GLU 41 HG1 GLU 41 75.761 8.278 8.278
282 H LEU 42 HN LEU 42 74.759 4.000 4.000
283 HA LEU 42 HA LEU 42 72.288 3.133 3.133
284 1HB LEU 42 HB2 LEU 42 74.072 2.375 2.375
285 2HB LEU 42 HB1 LEU 42 74.237 1.025 1.025
286 HG LEU 42 HG LEU 42 71.591 1.106 1.106
287 HD1 LEU 42 HD1 LEU 42 70.681 2.487 2.487
288 HD1 LEU 42 HD1 LEU 42 71.568 1.663 1.663
289 HD1 LEU 42 HD1 LEU 42 72.291 3.042 3.042
290 HD2 LEU 42 HD2 LEU 42 71.778 -0.825 -0.825
291 HD2 LEU 42 HD2 LEU 42 73.510 -0.495 -0.495
292 HD2 LEU 42 HD2 LEU 42 72.556 -0.015 -0.015
293 H GLY 43 HN GLY 43 75.464 1.836 1.836
294 1HA GLY 43 HA2 GLY 43 74.496 0.003 0.003
295 2HA GLY 43 HA1 GLY 43 76.068 0.796 0.796
296 H THR 44 HN THR 44 75.319 3.453 3.453
297 HA THR 44 HA THR 44 74.812 3.691 3.691
298 HB THR 44 HB THR 44 74.555 5.526 5.526
299 HG1 THR 44 HG1 THR 44 76.410 4.981 4.981
300 1HG2 THR 44 HG21 THR 44 73.992 6.099 6.099
301 2HG2 THR 44 HG23 THR 44 74.521 7.367 7.367
302 3HG2 THR 44 HG22 THR 44 73.012 6.507 6.507
303 H VAL 45 HN VAL 45 72.537 4.627 4.627
304 HA VAL 45 HA VAL 45 70.234 5.027 5.027
305 HB VAL 45 HB VAL 45 70.706 3.821 3.821
306 1HG1 VAL 45 HG11 VAL 45 68.494 3.098 3.098
307 2HG1 VAL 45 HG13 VAL 45 68.060 4.802 4.802
308 3HG1 VAL 45 HG12 VAL 45 68.352 4.079 4.079
309 1HG2 VAL 45 HG21 VAL 45 69.997 6.549 6.549
310 2HG2 VAL 45 HG23 VAL 45 71.359 6.103 6.103
311 3HG2 VAL 45 HG22 VAL 45 69.726 6.133 6.133
312 H MET 46 HN MET 46 71.365 1.918 1.918
313 HA MET 46 HA MET 46 69.312 0.214 0.214
314 1HB MET 46 HB2 MET 46 72.288 -0.014 -0.014
315 2HB MET 46 HB1 MET 46 71.378 -1.402 -1.402
316 1HG MET 46 HG2 MET 46 70.273 0.015 0.015
317 2HG MET 46 HG1 MET 46 71.728 -0.951 -0.951
318 1HE MET 46 HE1 MET 46 70.467 -1.934 -1.934
319 2HE MET 46 HE3 MET 46 71.006 -3.522 -3.522
320 3HE MET 46 HE2 MET 46 69.312 -3.255 -3.255
321 H ARG 47 HN ARG 47 72.354 0.776 0.776
322 HA ARG 47 HA ARG 47 71.383 -0.443 -0.443
323 1HB ARG 47 HB2 ARG 47 73.631 1.481 1.481
324 2HB ARG 47 HB1 ARG 47 73.439 0.730 0.730
325 1HG ARG 47 HG2 ARG 47 73.307 -1.500 -1.500
326 2HG ARG 47 HG1 ARG 47 74.154 -0.541 -0.541
327 1HD ARG 47 HD2 ARG 47 75.432 -0.014 -0.014
328 2HD ARG 47 HD1 ARG 47 75.252 -1.774 -1.774
329 HE ARG 47 HE ARG 47 76.278 -0.236 -0.236
330 1HH1 ARG 47 HH1 ARG 47 77.166 -1.949 -1.949
331 2HH1 ARG 47 HH1 ARG 47 78.374 -2.912 -2.912
332 1HH2 ARG 47 HH2 ARG 47 77.617 -1.750 -1.750
333 2HH2 ARG 47 HH2 ARG 47 78.630 -2.798 -2.798
334 H MET 48 HN MET 48 71.248 2.826 2.826
335 HA MET 48 HA MET 48 70.631 4.236 4.236
336 1HB MET 48 HB2 MET 48 70.459 4.606 4.606
337 2HB MET 48 HB1 MET 48 69.389 5.632 5.632
338 1HG MET 48 HG2 MET 48 72.367 5.344 5.344
339 2HG MET 48 HG1 MET 48 71.625 6.675 6.675
340 1HE MET 48 HE3 MET 48 70.726 8.600 8.600
341 2HE MET 48 HE2 MET 48 70.951 9.182 9.182
342 3HE MET 48 HE1 MET 48 72.349 8.687 8.687
343 H LEU 49 HN LEU 49 68.842 1.900 1.900
344 HA LEU 49 HA LEU 49 66.236 2.936 2.936
345 1HB LEU 49 HB2 LEU 49 66.959 0.836 0.836
346 2HB LEU 49 HB1 LEU 49 65.312 1.313 1.313
347 HG LEU 49 HG LEU 49 67.428 3.234 3.234
348 HD1 LEU 49 HD1 LEU 49 65.260 1.685 1.685
349 HD1 LEU 49 HD1 LEU 49 66.966 1.818 1.818
350 HD1 LEU 49 HD1 LEU 49 65.892 3.198 3.198
351 HD2 LEU 49 HD2 LEU 49 65.630 4.227 4.227
352 HD2 LEU 49 HD2 LEU 49 64.423 3.498 3.498
353 HD2 LEU 49 HD2 LEU 49 65.504 4.744 4.744
354 H GLY 50 HN GLY 50 68.503 0.235 0.235
355 1HA GLY 50 HA2 GLY 50 68.334 -0.815 -0.815
356 2HA GLY 50 HA1 GLY 50 66.660 -1.133 -1.133
357 H GLN 51 HN GLN 51 68.415 -1.412 -1.412
358 HA GLN 51 HA GLN 51 68.342 -4.366 -4.366
359 1HB GLN 51 HB2 GLN 51 69.193 -2.684 -2.684
360 2HB GLN 51 HB1 GLN 51 68.411 -4.265 -4.265
361 1HG GLN 51 HG2 GLN 51 67.187 -1.580 -1.580
362 2HG GLN 51 HG1 GLN 51 66.683 -2.745 -2.745
363 1HE2 GLN 51 HE22 GLN 51 65.653 -4.976 -4.976
364 2HE2 GLN 51 HE21 GLN 51 66.955 -5.080 -5.080
365 H ASN 52 HN ASN 52 70.386 -5.137 -5.137
366 HA ASN 52 HA ASN 52 72.925 -3.908 -3.908
367 1HB ASN 52 HB2 ASN 52 73.640 -5.913 -5.913
368 2HB ASN 52 HB1 ASN 52 72.166 -5.251 -5.251
369 HD2 ASN 52 HD2 ASN 52 73.198 -8.121 -8.121
370 HD2 ASN 52 HD2 ASN 52 71.923 -9.019 -9.019
371 HA PRO 53 HA PRO 53 73.043 -6.179 -6.179
372 1HB PRO 53 HB2 PRO 53 74.223 -4.156 -4.156
373 2HB PRO 53 HB1 PRO 53 72.466 -4.277 -4.277
374 1HG PRO 53 HG2 PRO 53 74.436 -2.546 -2.546
375 2HG PRO 53 HG1 PRO 53 72.774 -2.197 -2.197
376 1HD PRO 53 HD2 PRO 53 73.522 -2.821 -2.821
377 2HD PRO 53 HD1 PRO 53 71.889 -3.075 -3.075
378 H THR 54 HN THR 54 74.771 -7.582 -7.582
379 HA THR 54 HA THR 54 77.256 -7.177 -7.177
380 HB THR 54 HB THR 54 77.888 -9.206 -9.206
381 HG1 THR 54 HG1 THR 54 77.347 -9.402 -9.402
382 1HG2 THR 54 HG21 THR 54 75.623 -8.969 -8.969
383 2HG2 THR 54 HG23 THR 54 74.980 -9.707 -9.707
384 3HG2 THR 54 HG22 THR 54 76.273 -10.506 -10.506
385 H LYS 55 HN LYS 55 79.226 -6.317 -6.317
386 HA LYS 55 HA LYS 55 79.424 -4.274 -4.274
387 1HB LYS 55 HB2 LYS 55 81.125 -5.301 -5.301
388 2HB LYS 55 HB1 LYS 55 81.597 -6.347 -6.347
389 1HG LYS 55 HG2 LYS 55 82.788 -4.689 -4.689
390 2HG LYS 55 HG1 LYS 55 81.398 -3.604 -3.604
391 1HD LYS 55 HD2 LYS 55 82.029 -3.503 -3.503
392 2HD LYS 55 HD1 LYS 55 83.625 -3.929 -3.929
393 1HE LYS 55 HE2 LYS 55 81.983 -1.626 -1.626
394 2HE LYS 55 HE1 LYS 55 83.228 -1.433 -1.433
395 1HZ LYS 55 HZ3 LYS 55 83.702 -2.813 -2.813
396 2HZ LYS 55 HZ2 LYS 55 84.062 -1.173 -1.173
397 3HZ LYS 55 HZ1 LYS 55 84.860 -2.373 -2.373
398 H GLU 56 HN GLU 56 80.199 -7.707 -7.707
399 HA GLU 56 HA GLU 56 80.735 -7.465 -7.465
400 1HB GLU 56 HB2 GLU 56 79.537 -9.571 -9.571
401 2HB GLU 56 HB1 GLU 56 79.648 -9.868 -9.868
402 1HG GLU 56 HG2 GLU 56 82.149 -8.856 -8.856
403 2HG GLU 56 HG1 GLU 56 81.775 -9.816 -9.816
404 H GLU 57 HN GLU 57 77.558 -8.078 -8.078
405 HA GLU 57 HA GLU 57 75.928 -8.162 -8.162
406 1HB GLU 57 HB2 GLU 57 75.624 -7.212 -7.212
407 2HB GLU 57 HB1 GLU 57 74.282 -7.000 -7.000
408 1HG GLU 57 HG2 GLU 57 75.551 -9.675 -9.675
409 2HG GLU 57 HG1 GLU 57 74.681 -9.269 -9.269
410 H LEU 58 HN LEU 58 76.929 -5.282 -5.282
411 HA LEU 58 HA LEU 58 75.616 -3.242 -3.242
412 1HB LEU 58 HB2 LEU 58 77.818 -3.592 -3.592
413 2HB LEU 58 HB1 LEU 58 78.385 -2.550 -2.550
414 HG LEU 58 HG LEU 58 77.401 -1.197 -1.197
415 HD1 LEU 58 HD1 LEU 58 76.710 0.171 0.171
416 HD1 LEU 58 HD1 LEU 58 75.200 -0.732 -0.732
417 HD1 LEU 58 HD1 LEU 58 76.588 -1.204 -1.204
418 HD2 LEU 58 HD2 LEU 58 75.080 -3.070 -3.070
419 HD2 LEU 58 HD2 LEU 58 74.822 -1.463 -1.463
420 HD2 LEU 58 HD2 LEU 58 75.856 -2.621 -2.621
421 H ASP 59 HN ASP 59 79.006 -4.088 -4.088
422 HA ASP 59 HA ASP 59 79.141 -2.813 -2.813
423 1HB ASP 59 HB2 ASP 59 81.023 -3.785 -3.785
424 2HB ASP 59 HB1 ASP 59 80.438 -5.404 -5.404
425 H ALA 60 HN ALA 60 77.927 -6.055 -6.055
426 HA ALA 60 HA ALA 60 77.574 -6.965 -6.965
427 1HB ALA 60 HB2 ALA 60 77.513 -8.076 -8.076
428 2HB ALA 60 HB1 ALA 60 75.779 -7.879 -7.879
429 3HB ALA 60 HB3 ALA 60 76.735 -8.832 -8.832
430 H ILE 61 HN ILE 61 75.373 -5.403 -5.403
431 HA ILE 61 HA ILE 61 73.084 -5.407 -5.407
432 HB ILE 61 HB ILE 61 73.829 -3.864 -3.864
433 1HG1 ILE 61 HG12 ILE 61 71.914 -6.180 -6.180
434 2HG1 ILE 61 HG11 ILE 61 73.578 -6.372 -6.372
435 1HG2 ILE 61 HG23 ILE 61 71.482 -3.707 -3.707
436 2HG2 ILE 61 HG22 ILE 61 71.111 -3.831 -3.831
437 3HG2 ILE 61 HG21 ILE 61 72.118 -2.510 -2.510
438 HD1 ILE 61 HD1 ILE 61 72.442 -6.263 -6.263
439 HD1 ILE 61 HD1 ILE 61 71.248 -5.120 -5.120
440 HD1 ILE 61 HD1 ILE 61 72.881 -4.571 -4.571
441 H ILE 62 HN ILE 62 75.438 -2.889 -2.889
442 HA ILE 62 HA ILE 62 74.436 -0.691 -0.691
443 HB ILE 62 HB ILE 62 77.227 -1.687 -1.687
444 1HG1 ILE 62 HG12 ILE 62 75.468 0.508 0.508
445 2HG1 ILE 62 HG11 ILE 62 75.861 -1.025 -1.025
446 1HG2 ILE 62 HG23 ILE 62 76.337 0.653 0.653
447 2HG2 ILE 62 HG22 ILE 62 77.622 0.942 0.942
448 3HG2 ILE 62 HG21 ILE 62 77.837 -0.270 -0.270
449 HD1 ILE 62 HD1 ILE 62 77.234 1.091 1.091
450 HD1 ILE 62 HD1 ILE 62 78.054 0.839 0.839
451 HD1 ILE 62 HD1 ILE 62 78.101 -0.415 -0.415
452 H GLU 63 HN GLU 63 77.000 -2.874 -2.874
453 HA GLU 63 HA GLU 63 77.113 -2.007 -2.007
454 1HB GLU 63 HB2 GLU 63 78.409 -3.840 -3.840
455 2HB GLU 63 HB1 GLU 63 77.067 -4.917 -4.917
456 1HG GLU 63 HG2 GLU 63 77.681 -5.092 -5.092
457 2HG GLU 63 HG1 GLU 63 78.031 -3.368 -3.368
458 H GLU 64 HN GLU 64 74.771 -4.319 -4.319
459 HA GLU 64 HA GLU 64 73.365 -4.958 -4.958
460 1HB GLU 64 HB2 GLU 64 72.931 -6.291 -6.291
461 2HB GLU 64 HB1 GLU 64 72.790 -4.898 -4.898
462 1HG GLU 64 HG2 GLU 64 70.612 -4.401 -4.401
463 2HG GLU 64 HG1 GLU 64 70.801 -5.307 -5.307
464 H VAL 65 HN VAL 65 72.691 -2.438 -2.438
465 HA VAL 65 HA VAL 65 70.570 -1.259 -1.259
466 HB VAL 65 HB VAL 65 70.302 0.188 0.188
467 1HG1 VAL 65 HG12 VAL 65 69.629 -2.306 -2.306
468 2HG1 VAL 65 HG11 VAL 65 71.032 -2.539 -2.539
469 3HG1 VAL 65 HG13 VAL 65 69.719 -1.477 -1.477
470 1HG2 VAL 65 HG23 VAL 65 72.890 0.331 0.331
471 2HG2 VAL 65 HG22 VAL 65 71.899 0.360 0.360
472 3HG2 VAL 65 HG21 VAL 65 72.714 -1.128 -1.128
473 H ASP 66 HN ASP 66 73.921 -1.066 -1.066
474 HA ASP 66 HA ASP 66 74.006 1.816 1.816
475 1HB ASP 66 HB2 ASP 66 75.519 0.671 0.671
476 2HB ASP 66 HB1 ASP 66 76.301 -0.119 -0.119
477 H GLU 67 HN GLU 67 74.598 -1.445 -1.445
478 HA GLU 67 HA GLU 67 75.828 -0.624 -0.624
479 1HB GLU 67 HB2 GLU 67 75.608 -2.960 -2.960
480 2HB GLU 67 HB1 GLU 67 75.921 -2.872 -2.872
481 1HG GLU 67 HG2 GLU 67 73.559 -3.137 -3.137
482 2HG GLU 67 HG1 GLU 67 73.152 -3.054 -3.054
483 H ASP 68 HN ASP 68 72.702 -0.189 -0.189
484 HA ASP 68 HA ASP 68 71.091 -0.886 -0.886
485 1HB ASP 68 HB2 ASP 68 70.636 -0.064 -0.064
486 2HB ASP 68 HB1 ASP 68 70.481 1.497 1.497
487 H GLY 69 HN GLY 69 72.708 2.173 2.173
488 1HA GLY 69 HA2 GLY 69 73.783 3.368 3.368
489 2HA GLY 69 HA1 GLY 69 72.249 3.116 3.116
490 H SER 70 HN SER 70 72.673 4.040 4.040
491 HA SER 70 HA SER 70 71.364 6.662 6.662
492 1HB SER 70 HB2 SER 70 70.329 4.519 4.519
493 2HB SER 70 HB1 SER 70 70.966 5.534 5.534
494 HG SER 70 HG SER 70 69.493 6.701 6.701
495 H GLY 71 HN GLY 71 72.996 5.117 5.117
496 1HA GLY 71 HA2 GLY 71 75.377 6.185 6.185
497 2HA GLY 71 HA1 GLY 71 74.446 7.678 7.678
498 H THR 72 HN THR 72 72.919 7.865 7.865
499 HA THR 72 HA THR 72 73.936 6.579 6.579
500 HB THR 72 HB THR 72 72.393 8.172 8.172
501 HG1 THR 72 HG1 THR 72 70.853 9.150 9.150
502 1HG2 THR 72 HG22 THR 72 74.535 8.821 8.821
503 2HG2 THR 72 HG21 THR 72 73.281 10.020 10.020
504 3HG2 THR 72 HG23 THR 72 73.890 9.799 9.799
505 H ILE 73 HN ILE 73 71.473 6.493 6.493
506 HA ILE 73 HA ILE 73 70.189 4.095 4.095
507 HB ILE 73 HB ILE 73 71.519 3.872 3.872
508 1HG1 ILE 73 HG12 ILE 73 69.366 2.883 2.883
509 2HG1 ILE 73 HG11 ILE 73 68.640 3.152 3.152
510 1HG2 ILE 73 HG21 ILE 73 70.374 6.217 6.217
511 2HG2 ILE 73 HG23 ILE 73 69.271 5.098 5.098
512 3HG2 ILE 73 HG22 ILE 73 70.993 5.061 5.061
513 HD1 ILE 73 HD1 ILE 73 70.242 0.971 0.971
514 HD1 ILE 73 HD1 ILE 73 71.266 1.958 1.958
515 HD1 ILE 73 HD1 ILE 73 69.712 1.370 1.370
516 H ASP 74 HN ASP 74 67.987 4.190 4.190
517 HA ASP 74 HA ASP 74 66.589 6.732 6.732
518 1HB ASP 74 HB2 ASP 74 66.616 4.931 4.931
519 2HB ASP 74 HB1 ASP 74 65.185 4.393 4.393
520 H PHE 75 HN PHE 75 64.687 6.880 6.880
521 HA PHE 75 HA PHE 75 64.600 5.318 5.318
522 1HB PHE 75 HB2 PHE 75 63.672 7.659 7.659
523 2HB PHE 75 HB1 PHE 75 62.273 6.806 6.806
524 HD1 PHE 75 HD2 PHE 75 61.090 5.103 5.103
525 HD2 PHE 75 HD1 PHE 75 63.847 8.072 8.072
526 HE1 PHE 75 HE2 PHE 75 60.173 4.853 4.853
527 HE2 PHE 75 HE1 PHE 75 62.930 7.822 7.822
528 HZ PHE 75 HZ PHE 75 61.094 6.212 6.212
529 H GLU 76 HN GLU 76 62.332 5.288 5.288
530 HA GLU 76 HA GLU 76 60.704 3.141 3.141
531 1HB GLU 76 HB2 GLU 76 61.583 4.383 4.383
532 2HB GLU 76 HB1 GLU 76 60.712 2.851 2.851
533 1HG GLU 76 HG2 GLU 76 58.841 3.767 3.767
534 2HG GLU 76 HG1 GLU 76 59.725 5.260 5.260
535 H GLU 77 HN GLU 77 63.792 3.055 3.055
536 HA GLU 77 HA GLU 77 63.816 0.157 0.157
537 1HB GLU 77 HB2 GLU 77 65.008 1.450 1.450
538 2HB GLU 77 HB1 GLU 77 65.800 2.411 2.411
539 1HG GLU 77 HG2 GLU 77 66.951 0.308 0.308
540 2HG GLU 77 HG1 GLU 77 66.288 -0.511 -0.511
541 H PHE 78 HN PHE 78 65.514 2.493 2.493
542 HA PHE 78 HA PHE 78 67.088 0.679 0.679
543 1HB PHE 78 HB2 PHE 78 67.401 3.020 3.020
544 2HB PHE 78 HB1 PHE 78 65.695 3.286 3.286
545 HD1 PHE 78 HD1 PHE 78 68.393 1.015 1.015
546 HD2 PHE 78 HD2 PHE 78 65.289 3.834 3.834
547 HE1 PHE 78 HE1 PHE 78 68.856 0.731 0.731
548 HE2 PHE 78 HE2 PHE 78 65.753 3.554 3.554
549 HZ PHE 78 HZ PHE 78 67.535 2.001 2.001
550 H LEU 79 HN LEU 79 63.648 1.484 1.484
551 HA LEU 79 HA LEU 79 62.918 0.468 0.468
552 1HB LEU 79 HB2 LEU 79 61.739 0.441 0.441
553 2HB LEU 79 HB1 LEU 79 60.922 -0.500 -0.500
554 HG LEU 79 HG LEU 79 61.746 2.319 2.319
555 HD1 LEU 79 HD1 LEU 79 59.031 2.321 2.321
556 HD1 LEU 79 HD1 LEU 79 59.964 1.569 1.569
557 HD1 LEU 79 HD1 LEU 79 60.382 3.188 3.188
558 HD2 LEU 79 HD2 LEU 79 60.405 0.268 0.268
559 HD2 LEU 79 HD2 LEU 79 59.124 1.370 1.370
560 HD2 LEU 79 HD2 LEU 79 60.465 1.964 1.964
561 H VAL 80 HN VAL 80 63.890 -1.380 -1.380
562 HA VAL 80 HA VAL 80 63.215 -3.997 -3.997
563 HB VAL 80 HB VAL 80 65.527 -3.118 -3.118
564 1HG1 VAL 80 HG11 VAL 80 64.211 -5.693 -5.693
565 2HG1 VAL 80 HG13 VAL 80 64.521 -5.408 -5.408
566 3HG1 VAL 80 HG12 VAL 80 65.854 -5.376 -5.376
567 1HG2 VAL 80 HG21 VAL 80 62.772 -2.609 -2.609
568 2HG2 VAL 80 HG23 VAL 80 64.037 -2.455 -2.455
569 3HG2 VAL 80 HG22 VAL 80 63.139 -3.966 -3.966
570 H MET 81 HN MET 81 66.345 -2.246 -2.246
571 HA MET 81 HA MET 81 67.868 -4.115 -4.115
572 1HB MET 81 HB2 MET 81 67.769 -1.109 -1.109
573 2HB MET 81 HB1 MET 81 68.951 -1.888 -1.888
574 1HG MET 81 HG2 MET 81 70.193 -1.844 -1.844
575 2HG MET 81 HG1 MET 81 69.347 -3.370 -3.370
576 1HE MET 81 HE3 MET 81 67.453 -3.799 -3.799
577 2HE MET 81 HE2 MET 81 67.436 -3.025 -3.025
578 3HE MET 81 HE1 MET 81 68.930 -3.730 -3.730
579 H MET 82 HN MET 82 65.389 -1.878 -1.878
580 HA MET 82 HA MET 82 65.943 -2.139 -2.139
581 1HB MET 82 HB2 MET 82 63.318 -1.544 -1.544
582 2HB MET 82 HB1 MET 82 63.812 -1.016 -1.016
583 1HG MET 82 HG2 MET 82 65.851 0.025 0.025
584 2HG MET 82 HG1 MET 82 64.648 0.014 0.014
585 1HE MET 82 HE2 MET 82 64.126 1.853 1.853
586 2HE MET 82 HE1 MET 82 62.501 2.125 2.125
587 3HE MET 82 HE3 MET 82 63.762 3.342 3.342
588 H VAL 83 HN VAL 83 63.096 -3.387 -3.387
589 HA VAL 83 HA VAL 83 62.359 -5.320 -5.320
590 HB VAL 83 HB VAL 83 60.850 -4.555 -4.555
591 1HG1 VAL 83 HG11 VAL 83 63.076 -4.620 -4.620
592 2HG1 VAL 83 HG13 VAL 83 62.132 -5.981 -5.981
593 3HG1 VAL 83 HG12 VAL 83 61.425 -4.366 -4.366
594 1HG2 VAL 83 HG22 VAL 83 60.813 -7.020 -7.020
595 2HG2 VAL 83 HG21 VAL 83 59.910 -6.625 -6.625
596 3HG2 VAL 83 HG23 VAL 83 61.489 -7.400 -7.400
597 H ARG 84 HN ARG 84 64.613 -5.483 -5.483
598 HA ARG 84 HA ARG 84 65.007 -8.333 -8.333
599 1HB ARG 84 HB2 ARG 84 66.704 -5.965 -5.965
600 2HB ARG 84 HB1 ARG 84 67.121 -7.641 -7.641
601 1HG ARG 84 HG2 ARG 84 64.403 -6.550 -6.550
602 2HG ARG 84 HG1 ARG 84 65.783 -6.295 -6.295
603 1HD ARG 84 HD2 ARG 84 65.908 -9.020 -9.020
604 2HD ARG 84 HD1 ARG 84 64.196 -8.697 -8.697
605 HE ARG 84 HE ARG 84 65.130 -7.495 -7.495
606 1HH1 ARG 84 HH2 ARG 84 67.761 -8.920 -8.920
607 2HH1 ARG 84 HH2 ARG 84 68.039 -10.063 -10.063
608 1HH2 ARG 84 HH1 ARG 84 64.968 -9.516 -9.516
609 2HH2 ARG 84 HH1 ARG 84 66.456 -10.401 -10.401
610 H GLN 85 HN GLN 85 66.572 -5.646 -5.646
611 HA GLN 85 HA GLN 85 68.534 -7.394 -7.394
612 1HB GLN 85 HB2 GLN 85 68.866 -4.968 -4.968
613 2HB GLN 85 HB1 GLN 85 67.668 -4.551 -4.551
614 1HG GLN 85 HG2 GLN 85 69.911 -4.347 -4.347
615 2HG GLN 85 HG1 GLN 85 69.072 -5.700 -5.700
616 1HE2 GLN 85 HE22 GLN 85 71.808 -6.786 -6.786
617 2HE2 GLN 85 HE21 GLN 85 70.737 -5.509 -5.509
618 H MET 86 HN MET 86 65.332 -6.127 -6.127
619 HA MET 86 HA MET 86 65.383 -6.834 -6.834
620 1HB MET 86 HB2 MET 86 63.723 -5.393 -5.393
621 2HB MET 86 HB1 MET 86 62.752 -6.422 -6.422
622 1HG MET 86 HG2 MET 86 64.305 -5.414 -5.414
623 2HG MET 86 HG1 MET 86 64.523 -4.115 -4.115
624 1HE MET 86 HE2 MET 86 63.209 -2.586 -2.586
625 2HE MET 86 HE1 MET 86 61.599 -2.118 -2.118
626 3HE MET 86 HE3 MET 86 62.987 -1.955 -1.955
627 H LYS 87 HN LYS 87 64.306 -8.271 -8.271
628 HA LYS 87 HA LYS 87 62.513 -10.244 -10.244
629 1HB LYS 87 HB2 LYS 87 64.741 -10.171 -10.171
630 2HB LYS 87 HB1 LYS 87 63.718 -11.598 -11.598
631 1HG LYS 87 HG2 LYS 87 62.069 -9.235 -9.235
632 2HG LYS 87 HG1 LYS 87 63.139 -9.237 -9.237
633 1HD LYS 87 HD2 LYS 87 62.430 -11.752 -11.752
634 2HD LYS 87 HD1 LYS 87 61.060 -11.259 -11.259
635 1HE LYS 87 HE2 LYS 87 61.712 -9.506 -9.506
636 2HE LYS 87 HE1 LYS 87 60.976 -11.082 -11.082
637 1HZ LYS 87 HZ1 LYS 87 59.496 -10.415 -10.415
638 2HZ LYS 87 HZ3 LYS 87 59.905 -8.843 -8.843
639 3HZ LYS 87 HZ2 LYS 87 59.109 -9.882 -9.882
640 H GLU 88 HN GLU 88 65.983 -10.020 -10.020
641 HA GLU 88 HA GLU 88 66.084 -12.706 -12.706
642 1HB GLU 88 HB2 GLU 88 67.739 -11.356 -11.356
643 2HB GLU 88 HB1 GLU 88 68.484 -10.987 -10.987
644 1HG GLU 88 HG2 GLU 88 68.821 -13.280 -13.280
645 2HG GLU 88 HG1 GLU 88 67.705 -13.805 -13.805
646 H ASP 89 HN ASP 89 66.540 -9.246 -9.246
647 HA ASP 89 HA ASP 89 67.394 -9.636 -9.636
648 1HB ASP 89 HB2 ASP 89 67.764 -7.681 -7.681
649 2HB ASP 89 HB1 ASP 89 66.162 -7.146 -7.146
650 H ALA 90 HN ALA 90 64.312 -9.196 -9.196
651 HA ALA 90 HA ALA 90 62.817 -8.674 -8.674
652 1HB ALA 90 HB2 ALA 90 62.117 -9.232 -9.232
653 2HB ALA 90 HB1 ALA 90 60.891 -8.936 -8.936
654 3HB ALA 90 HB3 ALA 90 62.066 -7.680 -7.680
Start of MODEL 27
1 1H ALA 1 HT2 ALA 1 64.780 -1.282 -1.282
2 2H ALA 1 HT1 ALA 1 66.062 -0.959 -0.959
3 3H ALA 1 HT3 ALA 1 64.587 -1.540 -1.540
4 HA ALA 1 HA ALA 1 66.145 -3.355 -3.355
5 1HB ALA 1 HB2 ALA 1 66.779 -1.960 -1.960
6 2HB ALA 1 HB1 ALA 1 66.736 -3.714 -3.714
7 3HB ALA 1 HB3 ALA 1 67.811 -2.978 -2.978
8 H SER 2 HN SER 2 65.795 -5.476 -5.476
9 HA SER 2 HA SER 2 62.898 -5.895 -5.895
10 1HB SER 2 HB2 SER 2 64.376 -7.615 -7.615
11 2HB SER 2 HB1 SER 2 65.341 -7.580 -7.580
12 HG SER 2 HG SER 2 63.796 -8.636 -8.636
13 H MET 3 HN MET 3 65.016 -4.522 -4.522
14 HA MET 3 HA MET 3 64.220 -5.781 -5.781
15 1HB MET 3 HB2 MET 3 65.863 -3.591 -3.591
16 2HB MET 3 HB1 MET 3 65.013 -3.134 -3.134
17 1HG MET 3 HG2 MET 3 65.846 -5.668 -5.668
18 2HG MET 3 HG1 MET 3 67.174 -5.106 -5.106
19 1HE MET 3 HE2 MET 3 68.780 -4.070 -4.070
20 2HE MET 3 HE1 MET 3 68.620 -2.394 -2.394
21 3HE MET 3 HE3 MET 3 69.365 -3.588 -3.588
22 H THR 4 HN THR 4 62.814 -3.315 -3.315
23 HA THR 4 HA THR 4 61.198 -1.885 -1.885
24 HB THR 4 HB THR 4 61.581 -1.493 -1.493
25 HG1 THR 4 HG1 THR 4 58.962 -1.599 -1.599
26 1HG2 THR 4 HG21 THR 4 60.522 -4.110 -4.110
27 2HG2 THR 4 HG23 THR 4 59.332 -3.048 -3.048
28 3HG2 THR 4 HG22 THR 4 60.995 -3.063 -3.063
29 H ASP 5 HN ASP 5 61.024 -5.209 -5.209
30 HA ASP 5 HA ASP 5 58.176 -5.582 -5.582
31 1HB ASP 5 HB2 ASP 5 60.609 -7.259 -7.259
32 2HB ASP 5 HB1 ASP 5 59.156 -8.046 -8.046
33 H GLN 6 HN GLN 6 61.190 -6.204 -6.204
34 HA GLN 6 HA GLN 6 59.787 -7.232 -7.232
35 1HB GLN 6 HB2 GLN 6 62.165 -7.715 -7.715
36 2HB GLN 6 HB1 GLN 6 62.603 -6.139 -6.139
37 1HG GLN 6 HG2 GLN 6 61.923 -6.810 -6.810
38 2HG GLN 6 HG1 GLN 6 61.261 -8.326 -8.326
39 1HE2 GLN 6 HE22 GLN 6 65.362 -7.996 -7.996
40 2HE2 GLN 6 HE21 GLN 6 64.404 -6.660 -6.660
41 H GLN 7 HN GLN 7 60.145 -4.129 -4.129
42 HA GLN 7 HA GLN 7 60.541 -2.651 -2.651
43 1HB GLN 7 HB2 GLN 7 61.119 -1.882 -1.882
44 2HB GLN 7 HB1 GLN 7 59.394 -1.795 -1.795
45 1HG GLN 7 HG2 GLN 7 59.682 -0.406 -0.406
46 2HG GLN 7 HG1 GLN 7 61.064 0.101 0.101
47 1HE2 GLN 7 HE22 GLN 7 59.099 1.914 1.914
48 2HE2 GLN 7 HE21 GLN 7 60.645 1.331 1.331
49 H ALA 8 HN ALA 8 57.874 -4.254 -4.254
50 HA ALA 8 HA ALA 8 55.816 -2.521 -2.521
51 1HB ALA 8 HB1 ALA 8 55.536 -3.583 -3.583
52 2HB ALA 8 HB3 ALA 8 55.699 -5.174 -5.174
53 3HB ALA 8 HB2 ALA 8 54.309 -4.159 -4.159
54 H GLU 9 HN GLU 9 57.044 -5.858 -5.858
55 HA GLU 9 HA GLU 9 55.395 -6.256 -6.256
56 1HB GLU 9 HB2 GLU 9 57.129 -7.829 -7.829
57 2HB GLU 9 HB1 GLU 9 57.013 -8.420 -8.420
58 1HG GLU 9 HG2 GLU 9 54.957 -9.240 -9.240
59 2HG GLU 9 HG1 GLU 9 54.395 -7.655 -7.655
60 H ALA 10 HN ALA 10 58.319 -4.743 -4.743
61 HA ALA 10 HA ALA 10 59.844 -5.692 -5.692
62 1HB ALA 10 HB2 ALA 10 60.090 -3.773 -3.773
63 2HB ALA 10 HB1 ALA 10 60.994 -3.348 -3.348
64 3HB ALA 10 HB3 ALA 10 61.284 -4.894 -4.894
65 H ARG 11 HN ARG 11 57.446 -3.212 -3.212
66 HA ARG 11 HA ARG 11 58.105 -1.932 -1.932
67 1HB ARG 11 HB2 ARG 11 55.961 -0.599 -0.599
68 2HB ARG 11 HB1 ARG 11 57.604 -0.023 -0.023
69 1HG ARG 11 HG2 ARG 11 57.377 0.048 0.048
70 2HG ARG 11 HG1 ARG 11 58.156 -1.514 -1.514
71 1HD ARG 11 HD2 ARG 11 56.352 -2.011 -2.011
72 2HD ARG 11 HD1 ARG 11 55.706 -2.439 -2.439
73 HE ARG 11 HE ARG 11 54.203 -0.638 -0.638
74 1HH1 ARG 11 HH1 ARG 11 55.190 1.801 1.801
75 2HH1 ARG 11 HH1 ARG 11 55.429 2.414 2.414
76 1HH2 ARG 11 HH2 ARG 11 55.293 -0.710 -0.710
77 2HH2 ARG 11 HH2 ARG 11 55.488 0.992 0.992
78 H ALA 12 HN ALA 12 55.608 -3.736 -3.736
79 HA ALA 12 HA ALA 12 53.407 -3.339 -3.339
80 1HB ALA 12 HB3 ALA 12 54.341 -5.760 -5.760
81 2HB ALA 12 HB2 ALA 12 52.723 -5.583 -5.583
82 3HB ALA 12 HB1 ALA 12 53.278 -4.478 -4.478
83 H PHE 13 HN PHE 13 56.394 -5.012 -5.012
84 HA PHE 13 HA PHE 13 55.665 -6.968 -6.968
85 1HB PHE 13 HB2 PHE 13 57.870 -6.973 -6.973
86 2HB PHE 13 HB1 PHE 13 58.085 -5.250 -5.250
87 HD1 PHE 13 HD1 PHE 13 57.111 -8.273 -8.273
88 HD2 PHE 13 HD2 PHE 13 59.544 -4.745 -4.745
89 HE1 PHE 13 HE1 PHE 13 58.104 -8.782 -8.782
90 HE2 PHE 13 HE2 PHE 13 60.537 -5.252 -5.252
91 HZ PHE 13 HZ PHE 13 59.818 -7.271 -7.271
92 H LEU 14 HN LEU 14 56.172 -3.474 -3.474
93 HA LEU 14 HA LEU 14 55.382 -3.697 -3.697
94 1HB LEU 14 HB2 LEU 14 56.550 -1.398 -1.398
95 2HB LEU 14 HB1 LEU 14 57.583 -2.805 -2.805
96 HG LEU 14 HG LEU 14 56.439 -1.607 -1.607
97 HD1 LEU 14 HD1 LEU 14 58.558 -0.199 -0.199
98 HD1 LEU 14 HD1 LEU 14 56.959 0.430 0.430
99 HD1 LEU 14 HD1 LEU 14 58.157 0.196 0.196
100 HD2 LEU 14 HD2 LEU 14 59.125 -1.853 -1.853
101 HD2 LEU 14 HD2 LEU 14 57.992 -3.186 -3.186
102 HD2 LEU 14 HD2 LEU 14 58.870 -3.026 -3.026
103 H SER 15 HN SER 15 53.828 -2.154 -2.154
104 HA SER 15 HA SER 15 51.689 -1.488 -1.488
105 1HB SER 15 HB2 SER 15 52.316 -1.437 -1.437
106 2HB SER 15 HB1 SER 15 51.813 0.199 0.199
107 HG SER 15 HG SER 15 50.031 -0.985 -0.985
108 H GLU 16 HN GLU 16 50.918 0.810 0.810
109 HA GLU 16 HA GLU 16 52.859 2.364 2.364
110 1HB GLU 16 HB2 GLU 16 50.350 2.283 2.283
111 2HB GLU 16 HB1 GLU 16 50.209 3.241 3.241
112 1HG GLU 16 HG2 GLU 16 50.723 5.145 5.145
113 2HG GLU 16 HG1 GLU 16 52.135 4.406 4.406
114 H GLU 17 HN GLU 17 51.464 2.723 2.723
115 HA GLU 17 HA GLU 17 52.505 5.206 5.206
116 1HB GLU 17 HB2 GLU 17 51.019 3.499 3.499
117 2HB GLU 17 HB1 GLU 17 52.522 2.730 2.730
118 1HG GLU 17 HG2 GLU 17 53.138 4.509 4.509
119 2HG GLU 17 HG1 GLU 17 52.240 5.684 5.684
120 H MET 18 HN MET 18 54.149 2.033 2.033
121 HA MET 18 HA MET 18 56.600 2.937 2.937
122 1HB MET 18 HB2 MET 18 55.977 0.600 0.600
123 2HB MET 18 HB1 MET 18 55.881 0.659 0.659
124 1HG MET 18 HG2 MET 18 57.997 -0.361 -0.361
125 2HG MET 18 HG1 MET 18 58.322 1.236 1.236
126 1HE MET 18 HE3 MET 18 57.396 -0.746 -0.746
127 2HE MET 18 HE2 MET 18 58.417 -0.250 -0.250
128 3HE MET 18 HE1 MET 18 56.948 0.652 0.652
129 H ILE 19 HN ILE 19 55.686 2.461 2.461
130 HA ILE 19 HA ILE 19 58.044 3.116 3.116
131 HB ILE 19 HB ILE 19 55.133 3.715 3.715
132 1HG1 ILE 19 HG12 ILE 19 56.658 2.156 2.156
133 2HG1 ILE 19 HG11 ILE 19 56.774 1.484 1.484
134 1HG2 ILE 19 HG23 ILE 19 57.497 4.494 4.494
135 2HG2 ILE 19 HG22 ILE 19 55.860 4.330 4.330
136 3HG2 ILE 19 HG21 ILE 19 56.212 5.542 5.542
137 HD1 ILE 19 HD1 ILE 19 54.397 1.302 1.302
138 HD1 ILE 19 HD1 ILE 19 54.804 0.660 0.660
139 HD1 ILE 19 HD1 ILE 19 54.136 2.285 2.285
140 H ALA 20 HN ALA 20 55.894 5.289 5.289
141 HA ALA 20 HA ALA 20 57.149 7.745 7.745
142 1HB ALA 20 HB2 ALA 20 55.337 7.056 7.056
143 2HB ALA 20 HB1 ALA 20 55.745 8.702 8.702
144 3HB ALA 20 HB3 ALA 20 54.831 7.663 7.663
145 H GLU 21 HN GLU 21 57.757 5.433 5.433
146 HA GLU 21 HA GLU 21 59.321 7.156 7.156
147 1HB GLU 21 HB2 GLU 21 58.361 5.178 5.178
148 2HB GLU 21 HB1 GLU 21 58.976 4.179 4.179
149 1HG GLU 21 HG2 GLU 21 61.094 4.060 4.060
150 2HG GLU 21 HG1 GLU 21 60.985 5.656 5.656
151 H PHE 22 HN PHE 22 60.083 4.997 4.997
152 HA PHE 22 HA PHE 22 62.977 5.295 5.295
153 1HB PHE 22 HB2 PHE 22 61.262 4.308 4.308
154 2HB PHE 22 HB1 PHE 22 62.983 3.997 3.997
155 HD1 PHE 22 HD2 PHE 22 62.370 3.865 3.865
156 HD2 PHE 22 HD1 PHE 22 61.003 1.787 1.787
157 HE1 PHE 22 HE2 PHE 22 61.837 1.878 1.878
158 HE2 PHE 22 HE1 PHE 22 60.473 -0.200 -0.200
159 HZ PHE 22 HZ PHE 22 60.888 -0.154 -0.154
160 H LYS 23 HN LYS 23 60.421 6.813 6.813
161 HA LYS 23 HA LYS 23 61.808 8.149 8.149
162 1HB LYS 23 HB2 LYS 23 59.320 8.159 8.159
163 2HB LYS 23 HB1 LYS 23 59.777 9.529 9.529
164 1HG LYS 23 HG2 LYS 23 58.979 10.422 10.422
165 2HG LYS 23 HG1 LYS 23 60.731 10.624 10.624
166 1HD LYS 23 HD2 LYS 23 61.068 9.087 9.087
167 2HD LYS 23 HD1 LYS 23 59.733 8.065 8.065
168 1HE LYS 23 HE2 LYS 23 58.998 10.743 10.743
169 2HE LYS 23 HE1 LYS 23 59.566 9.526 9.526
170 1HZ LYS 23 HZ1 LYS 23 57.598 8.861 8.861
171 2HZ LYS 23 HZ3 LYS 23 57.104 9.484 9.484
172 3HZ LYS 23 HZ2 LYS 23 57.947 8.010 8.010
173 H ALA 24 HN ALA 24 61.102 9.738 9.738
174 HA ALA 24 HA ALA 24 63.007 11.837 11.837
175 1HB ALA 24 HB3 ALA 24 61.019 11.621 11.621
176 2HB ALA 24 HB2 ALA 24 62.053 10.610 10.610
177 3HB ALA 24 HB1 ALA 24 62.486 12.294 12.294
178 H ALA 25 HN ALA 25 63.483 8.516 8.516
179 HA ALA 25 HA ALA 25 66.002 8.898 8.898
180 1HB ALA 25 HB2 ALA 25 64.092 7.043 7.043
181 2HB ALA 25 HB1 ALA 25 65.073 6.289 6.289
182 3HB ALA 25 HB3 ALA 25 65.774 6.629 6.629
183 H PHE 26 HN PHE 26 65.013 7.461 7.461
184 HA PHE 26 HA PHE 26 67.713 7.033 7.033
185 1HB PHE 26 HB2 PHE 26 65.873 5.776 5.776
186 2HB PHE 26 HB1 PHE 26 65.005 7.247 7.247
187 HD1 PHE 26 HD1 PHE 26 65.776 8.661 8.661
188 HD2 PHE 26 HD2 PHE 26 67.703 4.943 4.943
189 HE1 PHE 26 HE1 PHE 26 66.908 8.675 8.675
190 HE2 PHE 26 HE2 PHE 26 68.834 4.959 4.959
191 HZ PHE 26 HZ PHE 26 68.438 6.825 6.825
192 H ASP 27 HN ASP 27 65.415 9.717 9.717
193 HA ASP 27 HA ASP 27 66.877 11.191 11.191
194 1HB ASP 27 HB2 ASP 27 64.695 11.638 11.638
195 2HB ASP 27 HB1 ASP 27 65.479 13.075 13.075
196 H MET 28 HN MET 28 67.668 10.476 10.476
197 HA MET 28 HA MET 28 68.778 12.846 12.846
198 1HB MET 28 HB2 MET 28 69.494 9.915 9.915
199 2HB MET 28 HB1 MET 28 70.356 11.129 11.129
200 1HG MET 28 HG2 MET 28 67.363 11.146 11.146
201 2HG MET 28 HG1 MET 28 68.212 9.916 9.916
202 1HE MET 28 HE2 MET 28 68.505 9.987 9.987
203 2HE MET 28 HE1 MET 28 69.966 10.852 10.852
204 3HE MET 28 HE3 MET 28 68.402 11.311 11.311
205 H PHE 29 HN PHE 29 70.009 10.719 10.719
206 HA PHE 29 HA PHE 29 72.476 12.422 12.422
207 1HB PHE 29 HB2 PHE 29 72.106 9.662 9.662
208 2HB PHE 29 HB1 PHE 29 73.610 10.477 10.477
209 HD1 PHE 29 HD2 PHE 29 70.690 8.646 8.646
210 HD2 PHE 29 HD1 PHE 29 74.360 10.628 10.628
211 HE1 PHE 29 HE2 PHE 29 70.600 7.637 7.637
212 HE2 PHE 29 HE1 PHE 29 74.269 9.616 9.616
213 HZ PHE 29 HZ PHE 29 72.390 8.121 8.121
214 H ASP 30 HN ASP 30 69.715 12.813 12.813
215 HA ASP 30 HA ASP 30 70.457 12.579 12.579
216 1HB ASP 30 HB2 ASP 30 68.120 12.123 12.123
217 2HB ASP 30 HB1 ASP 30 67.780 13.506 13.506
218 H ALA 31 HN ALA 31 71.706 14.638 14.638
219 HA ALA 31 HA ALA 31 70.308 17.158 17.158
220 1HB ALA 31 HB2 ALA 31 72.604 16.131 16.131
221 2HB ALA 31 HB1 ALA 31 73.235 17.246 17.246
222 3HB ALA 31 HB3 ALA 31 72.109 17.824 17.824
223 H ASP 32 HN ASP 32 72.190 15.223 15.223
224 HA ASP 32 HA ASP 32 72.106 17.471 17.471
225 1HB ASP 32 HB2 ASP 32 74.225 16.683 16.683
226 2HB ASP 32 HB1 ASP 32 74.358 16.717 16.717
227 H GLY 33 HN GLY 33 71.073 14.307 14.307
228 1HA GLY 33 HA2 GLY 33 70.666 13.566 13.566
229 2HA GLY 33 HA1 GLY 33 70.437 12.491 12.491
230 H GLY 34 HN GLY 34 68.874 14.400 14.400
231 1HA GLY 34 HA2 GLY 34 66.700 15.373 15.373
232 2HA GLY 34 HA1 GLY 34 66.519 15.021 15.021
233 H GLY 35 HN GLY 35 66.897 12.342 12.342
234 1HA GLY 35 HA2 GLY 35 65.113 11.084 11.084
235 2HA GLY 35 HA1 GLY 35 64.671 10.971 10.971
236 H ASP 36 HN ASP 36 68.044 11.001 11.001
237 HA ASP 36 HA ASP 36 68.287 8.065 8.065
238 1HB ASP 36 HB2 ASP 36 69.631 8.110 8.110
239 2HB ASP 36 HB1 ASP 36 67.878 8.249 8.249
240 H ILE 37 HN ILE 37 70.072 7.714 7.714
241 HA ILE 37 HA ILE 37 72.085 9.893 9.893
242 HB ILE 37 HB ILE 37 72.576 8.835 8.835
243 1HG1 ILE 37 HG12 ILE 37 70.928 6.473 6.473
244 2HG1 ILE 37 HG11 ILE 37 72.693 6.518 6.518
245 1HG2 ILE 37 HG22 ILE 37 69.947 9.559 9.559
246 2HG2 ILE 37 HG21 ILE 37 69.791 8.088 8.088
247 3HG2 ILE 37 HG23 ILE 37 70.619 9.495 9.495
248 HD1 ILE 37 HD1 ILE 37 71.384 5.474 5.474
249 HD1 ILE 37 HD1 ILE 37 71.173 7.160 7.160
250 HD1 ILE 37 HD1 ILE 37 72.795 6.490 6.490
251 H SER 38 HN SER 38 74.396 9.276 9.276
252 HA SER 38 HA SER 38 75.228 7.803 7.803
253 1HB SER 38 HB2 SER 38 76.335 9.293 9.293
254 2HB SER 38 HB1 SER 38 77.185 7.750 7.750
255 HG SER 38 HG SER 38 77.713 9.721 9.721
256 H THR 39 HN THR 39 75.312 5.622 5.622
257 HA THR 39 HA THR 39 74.338 3.595 3.595
258 HB THR 39 HB THR 39 76.028 2.169 2.169
259 HG1 THR 39 HG1 THR 39 77.424 4.138 4.138
260 1HG2 THR 39 HG21 THR 39 73.898 3.979 3.979
261 2HG2 THR 39 HG23 THR 39 74.919 3.208 3.208
262 3HG2 THR 39 HG22 THR 39 74.009 2.220 2.220
263 H LYS 40 HN LYS 40 77.492 5.156 5.156
264 HA LYS 40 HA LYS 40 78.767 3.231 3.231
265 1HB LYS 40 HB2 LYS 40 79.363 5.620 5.620
266 2HB LYS 40 HB1 LYS 40 79.566 6.012 6.012
267 1HG LYS 40 HG2 LYS 40 81.442 4.766 4.766
268 2HG LYS 40 HG1 LYS 40 80.686 3.399 3.399
269 1HD LYS 40 HD2 LYS 40 81.661 5.859 5.859
270 2HD LYS 40 HD1 LYS 40 82.671 4.436 4.436
271 1HE LYS 40 HE2 LYS 40 79.994 3.790 3.790
272 2HE LYS 40 HE1 LYS 40 80.984 4.766 4.766
273 1HZ LYS 40 HZ2 LYS 40 82.856 3.175 3.175
274 2HZ LYS 40 HZ1 LYS 40 81.597 2.141 2.141
275 3HZ LYS 40 HZ3 LYS 40 81.723 2.625 2.625
276 H GLU 41 HN GLU 41 76.401 5.727 5.727
277 HA GLU 41 HA GLU 41 76.826 5.665 5.665
278 1HB GLU 41 HB2 GLU 41 76.596 7.794 7.794
279 2HB GLU 41 HB1 GLU 41 74.929 7.320 7.320
280 1HG GLU 41 HG2 GLU 41 74.820 8.776 8.776
281 2HG GLU 41 HG1 GLU 41 74.624 7.145 7.145
282 H LEU 42 HN LEU 42 75.341 3.693 3.693
283 HA LEU 42 HA LEU 42 72.601 3.609 3.609
284 1HB LEU 42 HB2 LEU 42 73.783 2.682 2.682
285 2HB LEU 42 HB1 LEU 42 74.159 1.287 1.287
286 HG LEU 42 HG LEU 42 71.389 2.041 2.041
287 HD1 LEU 42 HD1 LEU 42 70.754 1.265 1.265
288 HD1 LEU 42 HD1 LEU 42 72.415 1.665 1.665
289 HD1 LEU 42 HD1 LEU 42 71.339 2.921 2.921
290 HD2 LEU 42 HD2 LEU 42 71.096 -0.251 -0.251
291 HD2 LEU 42 HD2 LEU 42 72.825 -0.205 -0.205
292 HD2 LEU 42 HD2 LEU 42 72.261 -0.444 -0.444
293 H GLY 43 HN GLY 43 75.615 2.066 2.066
294 1HA GLY 43 HA2 GLY 43 74.460 0.089 0.089
295 2HA GLY 43 HA1 GLY 43 76.091 0.739 0.739
296 H THR 44 HN THR 44 75.329 3.486 3.486
297 HA THR 44 HA THR 44 74.981 3.600 3.600
298 HB THR 44 HB THR 44 74.659 5.530 5.530
299 HG1 THR 44 HG1 THR 44 76.543 4.955 4.955
300 1HG2 THR 44 HG23 THR 44 74.317 6.104 6.104
301 2HG2 THR 44 HG22 THR 44 74.544 7.344 7.344
302 3HG2 THR 44 HG21 THR 44 73.107 6.322 6.322
303 H VAL 45 HN VAL 45 72.603 4.556 4.556
304 HA VAL 45 HA VAL 45 70.360 5.032 5.032
305 HB VAL 45 HB VAL 45 70.743 3.641 3.641
306 1HG1 VAL 45 HG13 VAL 45 68.370 3.694 3.694
307 2HG1 VAL 45 HG12 VAL 45 68.129 4.759 4.759
308 3HG1 VAL 45 HG11 VAL 45 68.569 3.070 3.070
309 1HG2 VAL 45 HG23 VAL 45 70.222 6.430 6.430
310 2HG2 VAL 45 HG22 VAL 45 71.345 5.873 5.873
311 3HG2 VAL 45 HG21 VAL 45 69.618 5.958 5.958
312 H MET 46 HN MET 46 71.310 1.813 1.813
313 HA MET 46 HA MET 46 69.291 0.228 0.228
314 1HB MET 46 HB2 MET 46 72.263 -0.204 -0.204
315 2HB MET 46 HB1 MET 46 71.171 -1.512 -1.512
316 1HG MET 46 HG2 MET 46 70.602 0.236 0.236
317 2HG MET 46 HG1 MET 46 71.643 -1.182 -1.182
318 1HE MET 46 HE1 MET 46 70.810 -2.637 -2.637
319 2HE MET 46 HE3 MET 46 70.588 -3.815 -3.815
320 3HE MET 46 HE2 MET 46 69.316 -3.565 -3.565
321 H ARG 47 HN ARG 47 72.403 1.052 1.052
322 HA ARG 47 HA ARG 47 71.614 -0.140 -0.140
323 1HB ARG 47 HB2 ARG 47 73.862 1.563 1.563
324 2HB ARG 47 HB1 ARG 47 73.737 1.239 1.239
325 1HG ARG 47 HG2 ARG 47 73.846 -1.144 -1.144
326 2HG ARG 47 HG1 ARG 47 73.721 -0.934 -0.934
327 1HD ARG 47 HD2 ARG 47 75.891 0.593 0.593
328 2HD ARG 47 HD1 ARG 47 76.075 -0.512 -0.512
329 HE ARG 47 HE ARG 47 75.422 -2.188 -2.188
330 1HH1 ARG 47 HH2 ARG 47 77.117 0.429 0.429
331 2HH1 ARG 47 HH2 ARG 47 78.611 -0.382 -0.382
332 1HH2 ARG 47 HH1 ARG 47 77.652 -3.342 -3.342
333 2HH2 ARG 47 HH1 ARG 47 78.914 -2.518 -2.518
334 H MET 48 HN MET 48 71.253 3.015 3.015
335 HA MET 48 HA MET 48 70.859 4.491 4.491
336 1HB MET 48 HB2 MET 48 71.192 4.987 4.987
337 2HB MET 48 HB1 MET 48 69.574 5.585 5.585
338 1HG MET 48 HG2 MET 48 72.101 6.302 6.302
339 2HG MET 48 HG1 MET 48 71.280 7.342 7.342
340 1HE MET 48 HE2 MET 48 72.272 7.682 7.682
341 2HE MET 48 HE1 MET 48 71.162 9.011 9.011
342 3HE MET 48 HE3 MET 48 71.185 7.595 7.595
343 H LEU 49 HN LEU 49 68.952 2.257 2.257
344 HA LEU 49 HA LEU 49 66.393 3.392 3.392
345 1HB LEU 49 HB2 LEU 49 67.147 1.308 1.308
346 2HB LEU 49 HB1 LEU 49 65.479 1.576 1.576
347 HG LEU 49 HG LEU 49 67.151 3.916 3.916
348 HD1 LEU 49 HD1 LEU 49 67.415 2.240 2.240
349 HD1 LEU 49 HD1 LEU 49 66.376 3.562 3.562
350 HD1 LEU 49 HD1 LEU 49 65.666 2.019 2.019
351 HD2 LEU 49 HD2 LEU 49 64.338 3.271 3.271
352 HD2 LEU 49 HD2 LEU 49 64.567 4.139 4.139
353 HD2 LEU 49 HD2 LEU 49 65.148 4.837 4.837
354 H GLY 50 HN GLY 50 67.919 0.154 0.154
355 1HA GLY 50 HA2 GLY 50 67.933 -0.616 -0.616
356 2HA GLY 50 HA1 GLY 50 66.287 -0.952 -0.952
357 H GLN 51 HN GLN 51 69.145 -1.227 -1.227
358 HA GLN 51 HA GLN 51 68.812 -4.207 -4.207
359 1HB GLN 51 HB2 GLN 51 69.350 -2.483 -2.483
360 2HB GLN 51 HB1 GLN 51 68.949 -4.202 -4.202
361 1HG GLN 51 HG2 GLN 51 66.815 -3.499 -3.499
362 2HG GLN 51 HG1 GLN 51 66.849 -3.125 -3.125
363 1HE2 GLN 51 HE22 GLN 51 67.446 -0.004 -0.004
364 2HE2 GLN 51 HE21 GLN 51 67.983 -1.555 -1.555
365 H ASN 52 HN ASN 52 70.852 -4.959 -4.959
366 HA ASN 52 HA ASN 52 73.312 -3.460 -3.460
367 1HB ASN 52 HB2 ASN 52 72.629 -4.737 -4.737
368 2HB ASN 52 HB1 ASN 52 72.884 -6.222 -6.222
369 HD2 ASN 52 HD2 ASN 52 74.938 -7.077 -7.077
370 HD2 ASN 52 HD2 ASN 52 76.338 -6.170 -6.170
371 HA PRO 53 HA PRO 53 73.374 -6.148 -6.148
372 1HB PRO 53 HB2 PRO 53 74.263 -4.193 -4.193
373 2HB PRO 53 HB1 PRO 53 72.544 -4.456 -4.456
374 1HG PRO 53 HG2 PRO 53 74.407 -2.406 -2.406
375 2HG PRO 53 HG1 PRO 53 72.696 -2.262 -2.262
376 1HD PRO 53 HD2 PRO 53 73.598 -2.517 -2.517
377 2HD PRO 53 HD1 PRO 53 71.984 -3.033 -3.033
378 H THR 54 HN THR 54 75.218 -7.394 -7.394
379 HA THR 54 HA THR 54 77.732 -6.549 -6.549
380 HB THR 54 HB THR 54 78.495 -8.694 -8.694
381 HG1 THR 54 HG1 THR 54 77.509 -9.276 -9.276
382 1HG2 THR 54 HG22 THR 54 75.829 -8.578 -8.578
383 2HG2 THR 54 HG21 THR 54 76.599 -10.117 -10.117
384 3HG2 THR 54 HG23 THR 54 77.409 -8.970 -8.970
385 H LYS 55 HN LYS 55 79.571 -5.693 -5.693
386 HA LYS 55 HA LYS 55 79.461 -4.028 -4.028
387 1HB LYS 55 HB2 LYS 55 81.358 -4.678 -4.678
388 2HB LYS 55 HB1 LYS 55 81.866 -5.783 -5.783
389 1HG LYS 55 HG2 LYS 55 81.557 -3.626 -3.626
390 2HG LYS 55 HG1 LYS 55 81.828 -2.791 -2.791
391 1HD LYS 55 HD2 LYS 55 83.697 -5.013 -5.013
392 2HD LYS 55 HD1 LYS 55 83.827 -3.684 -3.684
393 1HE LYS 55 HE2 LYS 55 85.128 -2.689 -2.689
394 2HE LYS 55 HE1 LYS 55 83.599 -2.362 -2.362
395 1HZ LYS 55 HZ3 LYS 55 83.838 -4.767 -4.767
396 2HZ LYS 55 HZ2 LYS 55 85.474 -4.612 -4.612
397 3HZ LYS 55 HZ1 LYS 55 84.799 -3.579 -3.579
398 H GLU 56 HN GLU 56 80.221 -7.524 -7.524
399 HA GLU 56 HA GLU 56 80.712 -7.789 -7.789
400 1HB GLU 56 HB2 GLU 56 79.942 -9.460 -9.460
401 2HB GLU 56 HB1 GLU 56 79.462 -10.127 -10.127
402 1HG GLU 56 HG2 GLU 56 81.579 -10.820 -10.820
403 2HG GLU 56 HG1 GLU 56 82.092 -9.132 -9.132
404 H GLU 57 HN GLU 57 77.676 -7.606 -7.606
405 HA GLU 57 HA GLU 57 75.964 -8.327 -8.327
406 1HB GLU 57 HB2 GLU 57 75.709 -7.213 -7.213
407 2HB GLU 57 HB1 GLU 57 74.320 -7.083 -7.083
408 1HG GLU 57 HG2 GLU 57 75.516 -9.730 -9.730
409 2HG GLU 57 HG1 GLU 57 75.042 -9.327 -9.327
410 H LEU 58 HN LEU 58 76.910 -5.237 -5.237
411 HA LEU 58 HA LEU 58 75.367 -3.465 -3.465
412 1HB LEU 58 HB2 LEU 58 78.152 -3.224 -3.224
413 2HB LEU 58 HB1 LEU 58 77.206 -1.855 -1.855
414 HG LEU 58 HG LEU 58 76.557 -3.707 -3.707
415 HD1 LEU 58 HD1 LEU 58 77.358 -0.857 -0.857
416 HD1 LEU 58 HD1 LEU 58 77.782 -1.990 -1.990
417 HD1 LEU 58 HD1 LEU 58 76.199 -1.214 -1.214
418 HD2 LEU 58 HD2 LEU 58 74.476 -2.122 -2.122
419 HD2 LEU 58 HD2 LEU 58 74.447 -3.485 -3.485
420 HD2 LEU 58 HD2 LEU 58 74.799 -1.863 -1.863
421 H ASP 59 HN ASP 59 78.729 -4.582 -4.582
422 HA ASP 59 HA ASP 59 79.209 -3.290 -3.290
423 1HB ASP 59 HB2 ASP 59 80.455 -5.112 -5.112
424 2HB ASP 59 HB1 ASP 59 80.131 -6.089 -6.089
425 H ALA 60 HN ALA 60 77.729 -6.504 -6.504
426 HA ALA 60 HA ALA 60 77.214 -7.096 -7.096
427 1HB ALA 60 HB3 ALA 60 77.231 -8.644 -8.644
428 2HB ALA 60 HB2 ALA 60 75.664 -7.970 -7.970
429 3HB ALA 60 HB1 ALA 60 75.841 -8.856 -8.856
430 H ILE 61 HN ILE 61 75.239 -5.526 -5.526
431 HA ILE 61 HA ILE 61 72.867 -5.224 -5.224
432 HB ILE 61 HB ILE 61 73.991 -3.869 -3.869
433 1HG1 ILE 61 HG12 ILE 61 71.567 -5.656 -5.656
434 2HG1 ILE 61 HG11 ILE 61 73.185 -6.314 -6.314
435 1HG2 ILE 61 HG23 ILE 61 71.879 -2.955 -2.955
436 2HG2 ILE 61 HG22 ILE 61 71.188 -3.459 -3.459
437 3HG2 ILE 61 HG21 ILE 61 72.458 -2.236 -2.236
438 HD1 ILE 61 HD1 ILE 61 71.832 -4.288 -4.288
439 HD1 ILE 61 HD1 ILE 61 73.415 -5.018 -5.018
440 HD1 ILE 61 HD1 ILE 61 71.963 -6.014 -6.014
441 H ILE 62 HN ILE 62 75.528 -2.967 -2.967
442 HA ILE 62 HA ILE 62 74.668 -0.690 -0.690
443 HB ILE 62 HB ILE 62 77.367 -1.931 -1.931
444 1HG1 ILE 62 HG12 ILE 62 76.221 0.642 0.642
445 2HG1 ILE 62 HG11 ILE 62 75.774 -0.911 -0.911
446 1HG2 ILE 62 HG21 ILE 62 76.678 0.407 0.407
447 2HG2 ILE 62 HG23 ILE 62 77.964 0.666 0.666
448 3HG2 ILE 62 HG22 ILE 62 78.115 -0.615 -0.615
449 HD1 ILE 62 HD1 ILE 62 78.574 0.220 0.220
450 HD1 ILE 62 HD1 ILE 62 78.213 -1.413 -1.413
451 HD1 ILE 62 HD1 ILE 62 77.670 -0.020 -0.020
452 H GLU 63 HN GLU 63 77.088 -2.997 -2.997
453 HA GLU 63 HA GLU 63 77.101 -2.211 -2.211
454 1HB GLU 63 HB2 GLU 63 77.921 -4.406 -4.406
455 2HB GLU 63 HB1 GLU 63 77.085 -5.092 -5.092
456 1HG GLU 63 HG2 GLU 63 79.201 -2.948 -2.948
457 2HG GLU 63 HG1 GLU 63 79.588 -4.669 -4.669
458 H GLU 64 HN GLU 64 74.716 -4.239 -4.239
459 HA GLU 64 HA GLU 64 73.223 -5.008 -5.008
460 1HB GLU 64 HB2 GLU 64 72.894 -6.325 -6.325
461 2HB GLU 64 HB1 GLU 64 72.829 -4.928 -4.928
462 1HG GLU 64 HG2 GLU 64 70.605 -4.500 -4.500
463 2HG GLU 64 HG1 GLU 64 70.699 -5.194 -5.194
464 H VAL 65 HN VAL 65 72.706 -2.461 -2.461
465 HA VAL 65 HA VAL 65 70.490 -1.287 -1.287
466 HB VAL 65 HB VAL 65 70.300 0.140 0.140
467 1HG1 VAL 65 HG11 VAL 65 70.622 -2.723 -2.723
468 2HG1 VAL 65 HG13 VAL 65 71.102 -1.932 -1.932
469 3HG1 VAL 65 HG12 VAL 65 69.490 -1.664 -1.664
470 1HG2 VAL 65 HG23 VAL 65 72.701 0.745 0.745
471 2HG2 VAL 65 HG22 VAL 65 72.072 0.250 0.250
472 3HG2 VAL 65 HG21 VAL 65 73.063 -0.863 -0.863
473 H ASP 66 HN ASP 66 73.820 -1.156 -1.156
474 HA ASP 66 HA ASP 66 74.193 1.697 1.697
475 1HB ASP 66 HB2 ASP 66 75.970 0.171 0.171
476 2HB ASP 66 HB1 ASP 66 75.811 -0.761 -0.761
477 H GLU 67 HN GLU 67 72.488 -0.556 -0.556
478 HA GLU 67 HA GLU 67 73.400 0.026 0.026
479 1HB GLU 67 HB2 GLU 67 71.801 -1.843 -1.843
480 2HB GLU 67 HB1 GLU 67 70.668 -0.954 -0.954
481 1HG GLU 67 HG2 GLU 67 71.400 -2.083 -2.083
482 2HG GLU 67 HG1 GLU 67 73.019 -1.430 -1.430
483 H ASP 68 HN ASP 68 72.004 2.040 2.040
484 HA ASP 68 HA ASP 68 69.743 3.144 3.144
485 1HB ASP 68 HB2 ASP 68 71.076 3.465 3.465
486 2HB ASP 68 HB1 ASP 68 71.449 4.976 4.976
487 H GLY 69 HN GLY 69 73.226 3.858 3.858
488 1HA GLY 69 HA2 GLY 69 73.970 4.530 4.530
489 2HA GLY 69 HA1 GLY 69 72.623 5.669 5.669
490 H SER 70 HN SER 70 73.226 6.134 6.134
491 HA SER 70 HA SER 70 75.490 8.048 8.048
492 1HB SER 70 HB2 SER 70 73.030 8.742 8.742
493 2HB SER 70 HB1 SER 70 73.398 8.216 8.216
494 HG SER 70 HG SER 70 73.845 10.528 10.528
495 H GLY 71 HN GLY 71 74.125 5.647 5.647
496 1HA GLY 71 HA2 GLY 71 75.775 4.201 4.201
497 2HA GLY 71 HA1 GLY 71 76.741 5.654 5.654
498 H THR 72 HN THR 72 73.246 5.663 5.663
499 HA THR 72 HA THR 72 73.556 5.920 5.920
500 HB THR 72 HB THR 72 71.633 7.583 7.583
501 HG1 THR 72 HG1 THR 72 71.002 8.068 8.068
502 1HG2 THR 72 HG23 THR 72 74.389 7.895 7.895
503 2HG2 THR 72 HG22 THR 72 73.751 8.809 8.809
504 3HG2 THR 72 HG21 THR 72 73.219 9.187 9.187
505 H ILE 73 HN ILE 73 70.833 6.084 6.084
506 HA ILE 73 HA ILE 73 69.668 3.561 3.561
507 HB ILE 73 HB ILE 73 70.830 3.166 3.166
508 1HG1 ILE 73 HG12 ILE 73 68.739 2.395 2.395
509 2HG1 ILE 73 HG11 ILE 73 67.809 3.066 3.066
510 1HG2 ILE 73 HG21 ILE 73 69.842 5.716 5.716
511 2HG2 ILE 73 HG23 ILE 73 68.944 4.622 4.622
512 3HG2 ILE 73 HG22 ILE 73 70.708 4.635 4.635
513 HD1 ILE 73 HD1 ILE 73 68.650 1.517 1.517
514 HD1 ILE 73 HD1 ILE 73 68.522 0.542 0.542
515 HD1 ILE 73 HD1 ILE 73 70.087 1.189 1.189
516 H ASP 74 HN ASP 74 67.371 3.575 3.575
517 HA ASP 74 HA ASP 74 66.124 6.261 6.261
518 1HB ASP 74 HB2 ASP 74 65.200 3.661 3.661
519 2HB ASP 74 HB1 ASP 74 64.368 5.211 5.211
520 H PHE 75 HN PHE 75 64.744 6.677 6.677
521 HA PHE 75 HA PHE 75 64.360 5.081 5.081
522 1HB PHE 75 HB2 PHE 75 63.736 7.519 7.519
523 2HB PHE 75 HB1 PHE 75 62.248 6.901 6.901
524 HD1 PHE 75 HD2 PHE 75 60.613 5.634 5.634
525 HD2 PHE 75 HD1 PHE 75 64.086 7.478 7.478
526 HE1 PHE 75 HE2 PHE 75 59.609 5.411 5.411
527 HE2 PHE 75 HE1 PHE 75 63.083 7.254 7.254
528 HZ PHE 75 HZ PHE 75 60.844 6.219 6.219
529 H GLU 76 HN GLU 76 62.127 5.309 5.309
530 HA GLU 76 HA GLU 76 60.188 3.444 3.444
531 1HB GLU 76 HB2 GLU 76 59.823 3.185 3.185
532 2HB GLU 76 HB1 GLU 76 60.011 4.871 4.871
533 1HG GLU 76 HG2 GLU 76 62.457 4.685 4.685
534 2HG GLU 76 HG1 GLU 76 62.116 3.089 3.089
535 H GLU 77 HN GLU 77 63.252 2.848 2.848
536 HA GLU 77 HA GLU 77 62.858 -0.054 -0.054
537 1HB GLU 77 HB2 GLU 77 64.069 1.071 1.071
538 2HB GLU 77 HB1 GLU 77 65.181 1.798 1.798
539 1HG GLU 77 HG2 GLU 77 65.954 -0.472 -0.472
540 2HG GLU 77 HG1 GLU 77 64.888 -1.166 -1.166
541 H PHE 78 HN PHE 78 64.947 2.244 2.244
542 HA PHE 78 HA PHE 78 66.479 0.493 0.493
543 1HB PHE 78 HB2 PHE 78 66.899 2.808 2.808
544 2HB PHE 78 HB1 PHE 78 65.202 3.185 3.185
545 HD1 PHE 78 HD1 PHE 78 67.985 1.167 1.167
546 HD2 PHE 78 HD2 PHE 78 64.567 3.682 3.682
547 HE1 PHE 78 HE1 PHE 78 68.392 1.079 1.079
548 HE2 PHE 78 HE2 PHE 78 64.973 3.594 3.594
549 HZ PHE 78 HZ PHE 78 66.886 2.293 2.293
550 H LEU 79 HN LEU 79 63.068 1.350 1.350
551 HA LEU 79 HA LEU 79 62.413 0.541 0.541
552 1HB LEU 79 HB2 LEU 79 61.162 0.449 0.449
553 2HB LEU 79 HB1 LEU 79 60.398 -0.565 -0.565
554 HG LEU 79 HG LEU 79 61.118 2.269 2.269
555 HD1 LEU 79 HD1 LEU 79 58.507 1.470 1.470
556 HD1 LEU 79 HD1 LEU 79 59.834 2.218 2.218
557 HD1 LEU 79 HD1 LEU 79 59.044 3.094 3.094
558 HD2 LEU 79 HD2 LEU 79 58.760 1.762 1.762
559 HD2 LEU 79 HD2 LEU 79 60.290 1.253 1.253
560 HD2 LEU 79 HD2 LEU 79 59.318 0.101 0.101
561 H VAL 80 HN VAL 80 63.530 -1.475 -1.475
562 HA VAL 80 HA VAL 80 62.750 -4.017 -4.017
563 HB VAL 80 HB VAL 80 63.947 -4.919 -4.919
564 1HG1 VAL 80 HG11 VAL 80 62.176 -2.678 -2.678
565 2HG1 VAL 80 HG13 VAL 80 63.373 -2.625 -2.625
566 3HG1 VAL 80 HG12 VAL 80 62.375 -4.062 -4.062
567 1HG2 VAL 80 HG23 VAL 80 65.371 -2.244 -2.244
568 2HG2 VAL 80 HG22 VAL 80 66.082 -3.838 -3.838
569 3HG2 VAL 80 HG21 VAL 80 65.473 -3.392 -3.392
570 H MET 81 HN MET 81 65.709 -2.036 -2.036
571 HA MET 81 HA MET 81 67.442 -3.937 -3.937
572 1HB MET 81 HB2 MET 81 67.333 -1.027 -1.027
573 2HB MET 81 HB1 MET 81 68.434 -1.506 -1.506
574 1HG MET 81 HG2 MET 81 69.764 -1.661 -1.661
575 2HG MET 81 HG1 MET 81 69.254 -3.325 -3.325
576 1HE MET 81 HE3 MET 81 69.556 -4.305 -4.305
577 2HE MET 81 HE2 MET 81 67.858 -4.753 -4.753
578 3HE MET 81 HE1 MET 81 68.497 -4.228 -4.228
579 H MET 82 HN MET 82 64.949 -1.816 -1.816
580 HA MET 82 HA MET 82 65.834 -1.776 -1.776
581 1HB MET 82 HB2 MET 82 63.128 -1.328 -1.328
582 2HB MET 82 HB1 MET 82 63.563 -0.842 -0.842
583 1HG MET 82 HG2 MET 82 65.611 0.267 0.267
584 2HG MET 82 HG1 MET 82 64.293 0.392 0.392
585 1HE MET 82 HE2 MET 82 63.315 2.552 2.552
586 2HE MET 82 HE1 MET 82 62.032 1.521 1.521
587 3HE MET 82 HE3 MET 82 62.222 3.173 3.173
588 H VAL 83 HN VAL 83 63.301 -3.621 -3.621
589 HA VAL 83 HA VAL 83 62.742 -5.286 -5.286
590 HB VAL 83 HB VAL 83 61.031 -6.185 -6.185
591 1HG1 VAL 83 HG11 VAL 83 61.051 -3.607 -3.607
592 2HG1 VAL 83 HG13 VAL 83 61.374 -3.499 -3.499
593 3HG1 VAL 83 HG12 VAL 83 59.897 -4.272 -4.272
594 1HG2 VAL 83 HG21 VAL 83 62.644 -5.194 -5.194
595 2HG2 VAL 83 HG23 VAL 83 62.480 -6.878 -6.878
596 3HG2 VAL 83 HG22 VAL 83 61.076 -5.994 -5.994
597 H ARG 84 HN ARG 84 64.328 -5.748 -5.748
598 HA ARG 84 HA ARG 84 64.910 -8.478 -8.478
599 1HB ARG 84 HB2 ARG 84 66.423 -6.053 -6.053
600 2HB ARG 84 HB1 ARG 84 67.017 -7.688 -7.688
601 1HG ARG 84 HG2 ARG 84 64.806 -8.251 -8.251
602 2HG ARG 84 HG1 ARG 84 64.342 -6.558 -6.558
603 1HD ARG 84 HD2 ARG 84 65.197 -6.617 -6.617
604 2HD ARG 84 HD1 ARG 84 66.626 -6.118 -6.118
605 HE ARG 84 HE ARG 84 66.384 -9.002 -9.002
606 1HH1 ARG 84 HH1 ARG 84 66.891 -6.408 -6.408
607 2HH1 ARG 84 HH1 ARG 84 68.234 -7.149 -7.149
608 1HH2 ARG 84 HH2 ARG 84 68.321 -9.894 -9.894
609 2HH2 ARG 84 HH2 ARG 84 69.044 -9.125 -9.125
610 H GLN 85 HN GLN 85 66.732 -5.815 -5.815
611 HA GLN 85 HA GLN 85 68.719 -7.606 -7.606
612 1HB GLN 85 HB2 GLN 85 69.163 -5.250 -5.250
613 2HB GLN 85 HB1 GLN 85 67.926 -4.730 -4.730
614 1HG GLN 85 HG2 GLN 85 70.292 -4.620 -4.620
615 2HG GLN 85 HG1 GLN 85 69.185 -5.587 -5.587
616 1HE2 GLN 85 HE22 GLN 85 70.999 -8.572 -8.572
617 2HE2 GLN 85 HE21 GLN 85 69.714 -7.783 -7.783
618 H MET 86 HN MET 86 66.070 -5.625 -5.625
619 HA MET 86 HA MET 86 66.257 -6.690 -6.690
620 1HB MET 86 HB2 MET 86 64.512 -5.011 -5.011
621 2HB MET 86 HB1 MET 86 63.574 -6.022 -6.022
622 1HG MET 86 HG2 MET 86 65.847 -5.058 -5.058
623 2HG MET 86 HG1 MET 86 65.097 -3.682 -3.682
624 1HE MET 86 HE2 MET 86 64.343 -2.407 -2.407
625 2HE MET 86 HE1 MET 86 62.633 -2.565 -2.565
626 3HE MET 86 HE3 MET 86 63.166 -2.621 -2.621
627 H LYS 87 HN LYS 87 64.755 -7.947 -7.947
628 HA LYS 87 HA LYS 87 62.874 -9.768 -9.768
629 1HB LYS 87 HB2 LYS 87 64.706 -9.505 -9.505
630 2HB LYS 87 HB1 LYS 87 64.199 -11.165 -11.165
631 1HG LYS 87 HG2 LYS 87 62.014 -9.208 -9.208
632 2HG LYS 87 HG1 LYS 87 62.734 -9.313 -9.313
633 1HD LYS 87 HD2 LYS 87 62.313 -11.668 -11.668
634 2HD LYS 87 HD1 LYS 87 61.894 -11.756 -11.756
635 1HE LYS 87 HE2 LYS 87 60.143 -9.825 -9.825
636 2HE LYS 87 HE1 LYS 87 60.200 -11.032 -11.032
637 1HZ LYS 87 HZ2 LYS 87 60.014 -11.846 -11.846
638 2HZ LYS 87 HZ1 LYS 87 58.616 -11.466 -11.466
639 3HZ LYS 87 HZ3 LYS 87 59.618 -12.740 -12.740
640 H GLU 88 HN GLU 88 66.353 -9.794 -9.794
641 HA GLU 88 HA GLU 88 66.349 -12.541 -12.541
642 1HB GLU 88 HB2 GLU 88 68.026 -12.020 -12.020
643 2HB GLU 88 HB1 GLU 88 68.510 -10.569 -10.569
644 1HG GLU 88 HG2 GLU 88 69.146 -12.043 -12.043
645 2HG GLU 88 HG1 GLU 88 68.837 -13.441 -13.441
646 H ASP 89 HN ASP 89 67.092 -9.154 -9.154
647 HA ASP 89 HA ASP 89 67.959 -9.715 -9.715
648 1HB ASP 89 HB2 ASP 89 68.650 -7.745 -7.745
649 2HB ASP 89 HB1 ASP 89 66.975 -7.195 -7.195
650 H ALA 90 HN ALA 90 64.881 -9.070 -9.070
651 HA ALA 90 HA ALA 90 63.455 -8.514 -8.514
652 1HB ALA 90 HB2 ALA 90 62.936 -7.585 -7.585
653 2HB ALA 90 HB1 ALA 90 62.403 -9.201 -9.201
654 3HB ALA 90 HB3 ALA 90 61.553 -8.322 -8.322
Start of MODEL 28
1 1H ALA 1 HT3 ALA 1 65.468 -5.570 -5.570
2 2H ALA 1 HT2 ALA 1 67.028 -5.924 -5.924
3 3H ALA 1 HT1 ALA 1 65.768 -7.045 -7.045
4 HA ALA 1 HA ALA 1 67.072 -7.859 -7.859
5 1HB ALA 1 HB3 ALA 1 68.182 -5.609 -5.609
6 2HB ALA 1 HB2 ALA 1 66.766 -5.056 -5.056
7 3HB ALA 1 HB1 ALA 1 67.774 -6.348 -6.348
8 H SER 2 HN SER 2 66.104 -8.706 -8.706
9 HA SER 2 HA SER 2 63.193 -8.573 -8.573
10 1HB SER 2 HB2 SER 2 64.459 -10.623 -10.623
11 2HB SER 2 HB1 SER 2 65.268 -9.846 -9.846
12 HG SER 2 HG SER 2 63.635 -10.609 -10.609
13 H MET 3 HN MET 3 65.702 -6.750 -6.750
14 HA MET 3 HA MET 3 64.695 -6.082 -6.082
15 1HB MET 3 HB2 MET 3 66.563 -5.085 -5.085
16 2HB MET 3 HB1 MET 3 65.763 -3.744 -3.744
17 1HG MET 3 HG2 MET 3 66.490 -5.821 -5.821
18 2HG MET 3 HG1 MET 3 67.901 -5.275 -5.275
19 1HE MET 3 HE1 MET 3 68.505 -2.849 -2.849
20 2HE MET 3 HE3 MET 3 68.701 -1.884 -1.884
21 3HE MET 3 HE2 MET 3 69.328 -3.529 -3.529
22 H THR 4 HN THR 4 63.881 -4.674 -4.674
23 HA THR 4 HA THR 4 62.226 -2.549 -2.549
24 HB THR 4 HB THR 4 62.974 -3.230 -3.230
25 HG1 THR 4 HG1 THR 4 60.997 -1.880 -1.880
26 1HG2 THR 4 HG22 THR 4 62.240 -5.654 -5.654
27 2HG2 THR 4 HG21 THR 4 60.600 -5.095 -5.095
28 3HG2 THR 4 HG23 THR 4 61.845 -4.957 -4.957
29 H ASP 5 HN ASP 5 61.637 -5.988 -5.988
30 HA ASP 5 HA ASP 5 58.732 -5.679 -5.679
31 1HB ASP 5 HB2 ASP 5 59.953 -7.614 -7.614
32 2HB ASP 5 HB1 ASP 5 60.509 -8.087 -8.087
33 H GLN 6 HN GLN 6 61.331 -7.109 -7.109
34 HA GLN 6 HA GLN 6 59.941 -7.187 -7.187
35 1HB GLN 6 HB2 GLN 6 62.450 -7.756 -7.756
36 2HB GLN 6 HB1 GLN 6 62.782 -6.359 -6.359
37 1HG GLN 6 HG2 GLN 6 61.596 -7.452 -7.452
38 2HG GLN 6 HG1 GLN 6 61.283 -8.856 -8.856
39 1HE2 GLN 6 HE22 GLN 6 65.155 -9.044 -9.044
40 2HE2 GLN 6 HE21 GLN 6 64.099 -8.353 -8.353
41 H GLN 7 HN GLN 7 61.129 -4.426 -4.426
42 HA GLN 7 HA GLN 7 61.473 -2.550 -2.550
43 1HB GLN 7 HB2 GLN 7 62.222 -2.034 -2.034
44 2HB GLN 7 HB1 GLN 7 60.637 -2.379 -2.379
45 1HG GLN 7 HG2 GLN 7 60.426 -0.348 -0.348
46 2HG GLN 7 HG1 GLN 7 61.598 0.130 0.130
47 1HE2 GLN 7 HE22 GLN 7 57.661 0.185 0.185
48 2HE2 GLN 7 HE21 GLN 7 58.228 -0.151 -0.151
49 H ALA 8 HN ALA 8 58.571 -3.480 -3.480
50 HA ALA 8 HA ALA 8 56.818 -1.589 -1.589
51 1HB ALA 8 HB2 ALA 8 56.491 -4.017 -4.017
52 2HB ALA 8 HB1 ALA 8 55.095 -3.149 -3.149
53 3HB ALA 8 HB3 ALA 8 56.239 -2.321 -2.321
54 H GLU 9 HN GLU 9 57.582 -5.046 -5.046
55 HA GLU 9 HA GLU 9 55.624 -5.424 -5.424
56 1HB GLU 9 HB2 GLU 9 56.171 -7.290 -7.290
57 2HB GLU 9 HB1 GLU 9 57.903 -7.017 -7.017
58 1HG GLU 9 HG2 GLU 9 57.045 -8.923 -8.923
59 2HG GLU 9 HG1 GLU 9 57.790 -7.646 -7.646
60 H ALA 10 HN ALA 10 58.815 -4.171 -4.171
61 HA ALA 10 HA ALA 10 59.857 -4.916 -4.916
62 1HB ALA 10 HB1 ALA 10 60.365 -2.566 -2.566
63 2HB ALA 10 HB3 ALA 10 61.393 -2.991 -2.991
64 3HB ALA 10 HB2 ALA 10 61.233 -4.101 -4.101
65 H ARG 11 HN ARG 11 57.744 -2.297 -2.297
66 HA ARG 11 HA ARG 11 57.852 -0.918 -0.918
67 1HB ARG 11 HB2 ARG 11 55.849 -0.380 -0.380
68 2HB ARG 11 HB1 ARG 11 56.654 0.766 0.766
69 1HG ARG 11 HG2 ARG 11 58.083 1.177 1.177
70 2HG ARG 11 HG1 ARG 11 58.740 -0.439 -0.439
71 1HD ARG 11 HD2 ARG 11 57.982 -0.021 -0.021
72 2HD ARG 11 HD1 ARG 11 57.162 -1.393 -1.393
73 HE ARG 11 HE ARG 11 55.188 -0.145 -0.145
74 1HH1 ARG 11 HH1 ARG 11 54.956 1.576 1.576
75 2HH1 ARG 11 HH1 ARG 11 55.292 3.170 3.170
76 1HH2 ARG 11 HH2 ARG 11 56.878 2.060 2.060
77 2HH2 ARG 11 HH2 ARG 11 56.380 3.444 3.444
78 H ALA 12 HN ALA 12 55.659 -3.006 -3.006
79 HA ALA 12 HA ALA 12 53.389 -2.769 -2.769
80 1HB ALA 12 HB2 ALA 12 54.079 -3.944 -3.944
81 2HB ALA 12 HB1 ALA 12 53.729 -5.323 -5.323
82 3HB ALA 12 HB3 ALA 12 52.510 -4.073 -4.073
83 H PHE 13 HN PHE 13 56.425 -4.210 -4.210
84 HA PHE 13 HA PHE 13 55.783 -6.574 -6.574
85 1HB PHE 13 HB2 PHE 13 58.020 -6.222 -6.222
86 2HB PHE 13 HB1 PHE 13 58.056 -4.587 -4.587
87 HD1 PHE 13 HD1 PHE 13 57.251 -8.029 -8.029
88 HD2 PHE 13 HD2 PHE 13 59.368 -4.341 -4.341
89 HE1 PHE 13 HE1 PHE 13 58.159 -8.899 -8.899
90 HE2 PHE 13 HE2 PHE 13 60.273 -5.207 -5.207
91 HZ PHE 13 HZ PHE 13 59.671 -7.488 -7.488
92 H LEU 14 HN LEU 14 55.752 -3.170 -3.170
93 HA LEU 14 HA LEU 14 54.741 -3.988 -3.988
94 1HB LEU 14 HB2 LEU 14 55.920 -1.844 -1.844
95 2HB LEU 14 HB1 LEU 14 56.953 -3.203 -3.203
96 HG LEU 14 HG LEU 14 57.682 -0.925 -0.925
97 HD1 LEU 14 HD1 LEU 14 57.502 -2.298 -2.298
98 HD1 LEU 14 HD1 LEU 14 57.705 -3.495 -3.495
99 HD1 LEU 14 HD1 LEU 14 58.879 -2.192 -2.192
100 HD2 LEU 14 HD2 LEU 14 56.563 -0.052 -0.052
101 HD2 LEU 14 HD2 LEU 14 55.387 -0.184 -0.184
102 HD2 LEU 14 HD2 LEU 14 55.410 -1.384 -1.384
103 H SER 15 HN SER 15 53.926 -1.604 -1.604
104 HA SER 15 HA SER 15 51.697 -0.881 -0.881
105 1HB SER 15 HB2 SER 15 51.340 0.467 0.467
106 2HB SER 15 HB1 SER 15 50.772 -1.173 -1.173
107 HG SER 15 HG SER 15 52.319 -1.935 -1.935
108 H GLU 16 HN GLU 16 51.242 1.358 1.358
109 HA GLU 16 HA GLU 16 53.264 2.990 2.990
110 1HB GLU 16 HB2 GLU 16 50.697 3.191 3.191
111 2HB GLU 16 HB1 GLU 16 50.817 4.069 4.069
112 1HG GLU 16 HG2 GLU 16 52.497 5.596 5.596
113 2HG GLU 16 HG1 GLU 16 52.059 4.820 4.820
114 H GLU 17 HN GLU 17 52.019 2.877 2.877
115 HA GLU 17 HA GLU 17 53.239 5.078 5.078
116 1HB GLU 17 HB2 GLU 17 52.979 2.217 2.217
117 2HB GLU 17 HB1 GLU 17 53.334 3.590 3.590
118 1HG GLU 17 HG2 GLU 17 51.134 4.453 4.453
119 2HG GLU 17 HG1 GLU 17 50.782 2.750 2.750
120 H MET 18 HN MET 18 54.762 1.899 1.899
121 HA MET 18 HA MET 18 57.330 2.537 2.537
122 1HB MET 18 HB2 MET 18 56.267 0.295 0.295
123 2HB MET 18 HB1 MET 18 56.775 0.704 0.704
124 1HG MET 18 HG2 MET 18 58.833 -0.068 -0.068
125 2HG MET 18 HG1 MET 18 58.999 1.193 1.193
126 1HE MET 18 HE3 MET 18 60.001 0.709 0.709
127 2HE MET 18 HE2 MET 18 59.088 0.161 0.161
128 3HE MET 18 HE1 MET 18 60.327 -0.880 -0.880
129 H ILE 19 HN ILE 19 56.273 2.492 2.492
130 HA ILE 19 HA ILE 19 58.532 3.456 3.456
131 HB ILE 19 HB ILE 19 55.583 4.025 4.025
132 1HG1 ILE 19 HG12 ILE 19 56.952 2.665 2.665
133 2HG1 ILE 19 HG11 ILE 19 57.298 1.868 1.868
134 1HG2 ILE 19 HG21 ILE 19 57.885 5.308 5.308
135 2HG2 ILE 19 HG23 ILE 19 56.690 4.627 4.627
136 3HG2 ILE 19 HG22 ILE 19 56.203 5.831 5.831
137 HD1 ILE 19 HD1 ILE 19 54.512 2.596 2.596
138 HD1 ILE 19 HD1 ILE 19 54.927 1.654 1.654
139 HD1 ILE 19 HD1 ILE 19 55.231 0.995 0.995
140 H ALA 20 HN ALA 20 56.119 5.398 5.398
141 HA ALA 20 HA ALA 20 57.390 7.946 7.946
142 1HB ALA 20 HB1 ALA 20 55.108 6.825 6.825
143 2HB ALA 20 HB3 ALA 20 55.893 8.047 8.047
144 3HB ALA 20 HB2 ALA 20 55.328 8.463 8.463
145 H GLU 21 HN GLU 21 57.700 5.480 5.480
146 HA GLU 21 HA GLU 21 59.219 7.035 7.035
147 1HB GLU 21 HB2 GLU 21 58.170 5.005 5.005
148 2HB GLU 21 HB1 GLU 21 58.905 4.090 4.090
149 1HG GLU 21 HG2 GLU 21 60.895 3.851 3.851
150 2HG GLU 21 HG1 GLU 21 60.803 5.458 5.458
151 H PHE 22 HN PHE 22 60.104 5.125 5.125
152 HA PHE 22 HA PHE 22 62.984 5.320 5.320
153 1HB PHE 22 HB2 PHE 22 61.322 4.509 4.509
154 2HB PHE 22 HB1 PHE 22 63.059 4.257 4.257
155 HD1 PHE 22 HD2 PHE 22 62.337 3.864 3.864
156 HD2 PHE 22 HD1 PHE 22 61.359 1.942 1.942
157 HE1 PHE 22 HE2 PHE 22 61.918 1.740 1.740
158 HE2 PHE 22 HE1 PHE 22 60.942 -0.182 -0.182
159 HZ PHE 22 HZ PHE 22 61.221 -0.283 -0.283
160 H LYS 23 HN LYS 23 60.554 7.287 7.287
161 HA LYS 23 HA LYS 23 62.085 8.679 8.679
162 1HB LYS 23 HB2 LYS 23 59.702 9.288 9.288
163 2HB LYS 23 HB1 LYS 23 60.332 10.510 10.510
164 1HG LYS 23 HG2 LYS 23 59.716 7.709 7.709
165 2HG LYS 23 HG1 LYS 23 58.470 8.958 8.958
166 1HD LYS 23 HD2 LYS 23 60.964 9.889 9.889
167 2HD LYS 23 HD1 LYS 23 60.233 8.537 8.537
168 1HE LYS 23 HE2 LYS 23 58.478 10.814 10.814
169 2HE LYS 23 HE1 LYS 23 59.460 10.988 10.988
170 1HZ LYS 23 HZ3 LYS 23 57.996 8.483 8.483
171 2HZ LYS 23 HZ2 LYS 23 57.116 9.844 9.844
172 3HZ LYS 23 HZ1 LYS 23 58.406 9.261 9.261
173 H ALA 24 HN ALA 24 61.168 10.012 10.012
174 HA ALA 24 HA ALA 24 63.081 12.100 12.100
175 1HB ALA 24 HB2 ALA 24 61.001 11.461 11.461
176 2HB ALA 24 HB1 ALA 24 62.208 10.649 10.649
177 3HB ALA 24 HB3 ALA 24 62.325 12.386 12.386
178 H ALA 25 HN ALA 25 63.531 8.703 8.703
179 HA ALA 25 HA ALA 25 66.081 9.026 9.026
180 1HB ALA 25 HB1 ALA 25 64.135 6.892 6.892
181 2HB ALA 25 HB3 ALA 25 65.818 6.375 6.375
182 3HB ALA 25 HB2 ALA 25 65.053 7.144 7.144
183 H PHE 26 HN PHE 26 64.975 7.538 7.538
184 HA PHE 26 HA PHE 26 67.580 7.008 7.008
185 1HB PHE 26 HB2 PHE 26 65.669 5.930 5.930
186 2HB PHE 26 HB1 PHE 26 64.832 7.463 7.463
187 HD1 PHE 26 HD1 PHE 26 65.450 8.965 8.965
188 HD2 PHE 26 HD2 PHE 26 67.434 5.197 5.197
189 HE1 PHE 26 HE1 PHE 26 66.415 9.132 9.132
190 HE2 PHE 26 HE2 PHE 26 68.398 5.364 5.364
191 HZ PHE 26 HZ PHE 26 67.889 7.330 7.330
192 H ASP 27 HN ASP 27 65.456 9.856 9.856
193 HA ASP 27 HA ASP 27 67.059 11.296 11.296
194 1HB ASP 27 HB2 ASP 27 64.646 11.570 11.570
195 2HB ASP 27 HB1 ASP 27 65.621 12.984 12.984
196 H MET 28 HN MET 28 67.696 10.450 10.450
197 HA MET 28 HA MET 28 68.938 12.730 12.730
198 1HB MET 28 HB2 MET 28 69.456 9.751 9.751
199 2HB MET 28 HB1 MET 28 70.307 10.911 10.911
200 1HG MET 28 HG2 MET 28 67.306 10.991 10.991
201 2HG MET 28 HG1 MET 28 68.096 9.818 9.818
202 1HE MET 28 HE2 MET 28 66.604 10.984 10.984
203 2HE MET 28 HE1 MET 28 68.138 10.360 10.360
204 3HE MET 28 HE3 MET 28 67.541 11.930 11.930
205 H PHE 29 HN PHE 29 69.942 10.748 10.748
206 HA PHE 29 HA PHE 29 72.595 12.154 12.154
207 1HB PHE 29 HB2 PHE 29 72.123 9.465 9.465
208 2HB PHE 29 HB1 PHE 29 73.620 10.142 10.142
209 HD1 PHE 29 HD2 PHE 29 70.416 8.533 8.533
210 HD2 PHE 29 HD1 PHE 29 74.135 10.058 10.058
211 HE1 PHE 29 HE2 PHE 29 69.990 7.416 7.416
212 HE2 PHE 29 HE1 PHE 29 73.709 8.940 8.940
213 HZ PHE 29 HZ PHE 29 71.636 7.619 7.619
214 H ASP 30 HN ASP 30 70.243 13.197 13.197
215 HA ASP 30 HA ASP 30 70.019 12.461 12.461
216 1HB ASP 30 HB2 ASP 30 68.881 14.671 14.671
217 2HB ASP 30 HB1 ASP 30 68.351 13.752 13.752
218 H ALA 31 HN ALA 31 72.301 12.282 12.282
219 HA ALA 31 HA ALA 31 74.353 14.131 14.131
220 1HB ALA 31 HB1 ALA 31 73.713 11.864 11.864
221 2HB ALA 31 HB3 ALA 31 73.921 13.088 13.088
222 3HB ALA 31 HB2 ALA 31 75.232 12.753 12.753
223 H ASP 32 HN ASP 32 71.669 14.190 14.190
224 HA ASP 32 HA ASP 32 72.399 17.037 17.037
225 1HB ASP 32 HB2 ASP 32 72.642 15.422 15.422
226 2HB ASP 32 HB1 ASP 32 70.964 14.922 14.922
227 H GLY 33 HN GLY 33 69.727 14.781 14.781
228 1HA GLY 33 HA2 GLY 33 67.871 15.571 15.571
229 2HA GLY 33 HA1 GLY 33 68.027 17.149 17.149
230 H GLY 34 HN GLY 34 68.338 14.375 14.375
231 1HA GLY 34 HA2 GLY 34 65.745 15.080 15.080
232 2HA GLY 34 HA1 GLY 34 67.033 14.142 14.142
233 H GLY 35 HN GLY 35 66.524 13.173 13.173
234 1HA GLY 35 HA2 GLY 35 65.132 11.465 11.465
235 2HA GLY 35 HA1 GLY 35 64.416 11.214 11.214
236 H ASP 36 HN ASP 36 67.882 11.369 11.369
237 HA ASP 36 HA ASP 36 68.164 8.425 8.425
238 1HB ASP 36 HB2 ASP 36 69.307 8.419 8.419
239 2HB ASP 36 HB1 ASP 36 67.611 8.893 8.893
240 H ILE 37 HN ILE 37 69.980 8.053 8.053
241 HA ILE 37 HA ILE 37 71.995 10.235 10.235
242 HB ILE 37 HB ILE 37 72.562 9.095 9.095
243 1HG1 ILE 37 HG12 ILE 37 70.729 6.857 6.857
244 2HG1 ILE 37 HG11 ILE 37 72.489 6.796 6.796
245 1HG2 ILE 37 HG22 ILE 37 69.575 9.050 9.050
246 2HG2 ILE 37 HG21 ILE 37 70.304 8.910 8.910
247 3HG2 ILE 37 HG23 ILE 37 70.512 10.389 10.389
248 HD1 ILE 37 HD1 ILE 37 72.736 6.522 6.522
249 HD1 ILE 37 HD1 ILE 37 71.097 5.882 5.882
250 HD1 ILE 37 HD1 ILE 37 71.356 7.553 7.553
251 H SER 38 HN SER 38 74.315 9.550 9.550
252 HA SER 38 HA SER 38 75.130 8.156 8.156
253 1HB SER 38 HB2 SER 38 76.260 9.643 9.643
254 2HB SER 38 HB1 SER 38 76.984 8.054 8.054
255 HG SER 38 HG SER 38 77.516 9.894 9.894
256 H THR 39 HN THR 39 75.106 5.987 5.987
257 HA THR 39 HA THR 39 74.118 3.930 3.930
258 HB THR 39 HB THR 39 75.693 2.497 2.497
259 HG1 THR 39 HG1 THR 39 77.082 3.516 3.516
260 1HG2 THR 39 HG23 THR 39 74.039 4.659 4.659
261 2HG2 THR 39 HG22 THR 39 74.551 3.153 3.153
262 3HG2 THR 39 HG21 THR 39 73.432 3.116 3.116
263 H LYS 40 HN LYS 40 77.310 5.405 5.405
264 HA LYS 40 HA LYS 40 78.580 3.372 3.372
265 1HB LYS 40 HB2 LYS 40 79.833 5.057 5.057
266 2HB LYS 40 HB1 LYS 40 79.001 6.355 6.355
267 1HG LYS 40 HG2 LYS 40 80.080 5.847 5.847
268 2HG LYS 40 HG1 LYS 40 80.610 4.267 4.267
269 1HD LYS 40 HD2 LYS 40 82.536 5.186 5.186
270 2HD LYS 40 HD1 LYS 40 81.624 6.209 6.209
271 1HE LYS 40 HE2 LYS 40 81.328 7.906 7.906
272 2HE LYS 40 HE1 LYS 40 82.172 6.870 6.870
273 1HZ LYS 40 HZ2 LYS 40 84.071 6.819 6.819
274 2HZ LYS 40 HZ1 LYS 40 83.279 7.971 7.971
275 3HZ LYS 40 HZ3 LYS 40 83.758 8.373 8.373
276 H GLU 41 HN GLU 41 76.442 6.064 6.064
277 HA GLU 41 HA GLU 41 76.893 5.757 5.757
278 1HB GLU 41 HB2 GLU 41 76.773 7.990 7.990
279 2HB GLU 41 HB1 GLU 41 75.225 7.617 7.617
280 1HG GLU 41 HG2 GLU 41 74.877 8.917 8.917
281 2HG GLU 41 HG1 GLU 41 74.213 7.293 7.293
282 H LEU 42 HN LEU 42 74.992 4.312 4.312
283 HA LEU 42 HA LEU 42 72.389 4.166 4.166
284 1HB LEU 42 HB2 LEU 42 73.094 3.354 3.354
285 2HB LEU 42 HB1 LEU 42 74.044 2.078 2.078
286 HG LEU 42 HG LEU 42 71.516 1.821 1.821
287 HD1 LEU 42 HD1 LEU 42 70.417 1.492 1.492
288 HD1 LEU 42 HD1 LEU 42 71.348 2.976 2.976
289 HD1 LEU 42 HD1 LEU 42 70.116 2.874 2.874
290 HD2 LEU 42 HD2 LEU 42 72.229 0.245 0.245
291 HD2 LEU 42 HD2 LEU 42 71.641 -0.322 -0.322
292 HD2 LEU 42 HD2 LEU 42 73.324 0.176 0.176
293 H GLY 43 HN GLY 43 75.299 2.262 2.262
294 1HA GLY 43 HA2 GLY 43 74.129 0.297 0.297
295 2HA GLY 43 HA1 GLY 43 75.773 0.903 0.903
296 H THR 44 HN THR 44 75.453 3.480 3.480
297 HA THR 44 HA THR 44 74.937 3.417 3.417
298 HB THR 44 HB THR 44 74.805 5.551 5.551
299 HG1 THR 44 HG1 THR 44 76.500 5.493 5.493
300 1HG2 THR 44 HG21 THR 44 74.401 5.942 5.942
301 2HG2 THR 44 HG23 THR 44 74.680 7.240 7.240
302 3HG2 THR 44 HG22 THR 44 73.213 6.266 6.266
303 H VAL 45 HN VAL 45 72.645 4.557 4.557
304 HA VAL 45 HA VAL 45 70.425 5.115 5.115
305 HB VAL 45 HB VAL 45 70.780 3.974 3.974
306 1HG1 VAL 45 HG11 VAL 45 68.337 4.118 4.118
307 2HG1 VAL 45 HG13 VAL 45 68.221 5.073 5.073
308 3HG1 VAL 45 HG12 VAL 45 68.607 3.355 3.355
309 1HG2 VAL 45 HG22 VAL 45 71.473 6.335 6.335
310 2HG2 VAL 45 HG21 VAL 45 70.237 6.231 6.231
311 3HG2 VAL 45 HG23 VAL 45 69.787 6.672 6.672
312 H MET 46 HN MET 46 70.411 2.120 2.120
313 HA MET 46 HA MET 46 68.519 0.676 0.676
314 1HB MET 46 HB2 MET 46 69.758 -1.323 -1.323
315 2HB MET 46 HB1 MET 46 69.661 -0.054 -0.054
316 1HG MET 46 HG2 MET 46 71.935 0.736 0.736
317 2HG MET 46 HG1 MET 46 72.029 -0.727 -0.727
318 1HE MET 46 HE3 MET 46 71.028 -3.003 -3.003
319 2HE MET 46 HE2 MET 46 69.976 -2.232 -2.232
320 3HE MET 46 HE1 MET 46 71.219 -3.357 -3.357
321 H ARG 47 HN ARG 47 71.853 1.268 1.268
322 HA ARG 47 HA ARG 47 71.693 -0.627 -0.627
323 1HB ARG 47 HB2 ARG 47 73.640 1.199 1.199
324 2HB ARG 47 HB1 ARG 47 73.866 0.967 0.967
325 1HG ARG 47 HG2 ARG 47 73.510 -1.335 -1.335
326 2HG ARG 47 HG1 ARG 47 75.091 -0.701 -0.701
327 1HD ARG 47 HD2 ARG 47 73.882 -1.011 -1.011
328 2HD ARG 47 HD1 ARG 47 73.245 -2.396 -2.396
329 HE ARG 47 HE ARG 47 75.944 -2.330 -2.330
330 1HH1 ARG 47 HH1 ARG 47 73.884 -3.422 -3.422
331 2HH1 ARG 47 HH1 ARG 47 75.145 -3.883 -3.883
332 1HH2 ARG 47 HH2 ARG 47 77.681 -2.504 -2.504
333 2HH2 ARG 47 HH2 ARG 47 77.294 -3.364 -3.364
334 H MET 48 HN MET 48 71.376 2.876 2.876
335 HA MET 48 HA MET 48 71.311 3.566 3.566
336 1HB MET 48 HB2 MET 48 70.935 4.801 4.801
337 2HB MET 48 HB1 MET 48 69.965 5.545 5.545
338 1HG MET 48 HG2 MET 48 72.954 5.054 5.054
339 2HG MET 48 HG1 MET 48 72.195 6.611 6.611
340 1HE MET 48 HE1 MET 48 71.295 7.979 7.979
341 2HE MET 48 HE3 MET 48 70.166 7.597 7.597
342 3HE MET 48 HE2 MET 48 71.747 8.280 8.280
343 H LEU 49 HN LEU 49 69.123 1.837 1.837
344 HA LEU 49 HA LEU 49 66.706 2.897 2.897
345 1HB LEU 49 HB2 LEU 49 67.199 0.867 0.867
346 2HB LEU 49 HB1 LEU 49 65.595 1.290 1.290
347 HG LEU 49 HG LEU 49 67.499 3.427 3.427
348 HD1 LEU 49 HD1 LEU 49 66.110 3.258 3.258
349 HD1 LEU 49 HD1 LEU 49 65.718 1.624 1.624
350 HD1 LEU 49 HD1 LEU 49 67.397 2.077 2.077
351 HD2 LEU 49 HD2 LEU 49 64.567 3.144 3.144
352 HD2 LEU 49 HD2 LEU 49 65.090 4.340 4.340
353 HD2 LEU 49 HD2 LEU 49 65.679 4.429 4.429
354 H GLY 50 HN GLY 50 68.513 -0.169 -0.169
355 1HA GLY 50 HA2 GLY 50 68.639 -1.227 -1.227
356 2HA GLY 50 HA1 GLY 50 66.897 -1.362 -1.362
357 H GLN 51 HN GLN 51 69.623 -1.877 -1.877
358 HA GLN 51 HA GLN 51 68.665 -4.700 -4.700
359 1HB GLN 51 HB2 GLN 51 69.474 -2.629 -2.629
360 2HB GLN 51 HB1 GLN 51 69.230 -4.336 -4.336
361 1HG GLN 51 HG2 GLN 51 66.935 -4.241 -4.241
362 2HG GLN 51 HG1 GLN 51 67.084 -2.813 -2.813
363 1HE2 GLN 51 HE22 GLN 51 67.572 -2.053 -2.053
364 2HE2 GLN 51 HE21 GLN 51 68.393 -3.362 -3.362
365 H ASN 52 HN ASN 52 70.627 -5.527 -5.527
366 HA ASN 52 HA ASN 52 73.281 -4.781 -4.781
367 1HB ASN 52 HB2 ASN 52 71.964 -7.476 -7.476
368 2HB ASN 52 HB1 ASN 52 73.673 -7.154 -7.154
369 HD2 ASN 52 HD2 ASN 52 70.571 -7.037 -7.037
370 HD2 ASN 52 HD2 ASN 52 70.974 -6.094 -6.094
371 HA PRO 53 HA PRO 53 73.092 -6.369 -6.369
372 1HB PRO 53 HB2 PRO 53 74.278 -4.185 -4.185
373 2HB PRO 53 HB1 PRO 53 72.527 -4.302 -4.302
374 1HG PRO 53 HG2 PRO 53 74.588 -2.850 -2.850
375 2HG PRO 53 HG1 PRO 53 72.929 -2.377 -2.377
376 1HD PRO 53 HD2 PRO 53 73.679 -3.377 -3.377
377 2HD PRO 53 HD1 PRO 53 72.040 -3.531 -3.531
378 H THR 54 HN THR 54 74.758 -7.869 -7.869
379 HA THR 54 HA THR 54 77.330 -7.549 -7.549
380 HB THR 54 HB THR 54 77.758 -9.418 -9.418
381 HG1 THR 54 HG1 THR 54 75.746 -10.309 -10.309
382 1HG2 THR 54 HG21 THR 54 76.582 -9.350 -9.350
383 2HG2 THR 54 HG23 THR 54 75.873 -10.657 -10.657
384 3HG2 THR 54 HG22 THR 54 77.620 -10.581 -10.581
385 H LYS 55 HN LYS 55 79.316 -6.851 -6.851
386 HA LYS 55 HA LYS 55 79.514 -4.744 -4.744
387 1HB LYS 55 HB2 LYS 55 81.253 -6.113 -6.113
388 2HB LYS 55 HB1 LYS 55 81.561 -6.945 -6.945
389 1HG LYS 55 HG2 LYS 55 81.910 -4.701 -4.701
390 2HG LYS 55 HG1 LYS 55 81.786 -3.968 -3.968
391 1HD LYS 55 HD2 LYS 55 84.056 -4.268 -4.268
392 2HD LYS 55 HD1 LYS 55 83.615 -5.894 -5.894
393 1HE LYS 55 HE2 LYS 55 85.031 -6.359 -6.359
394 2HE LYS 55 HE1 LYS 55 83.446 -6.343 -6.343
395 1HZ LYS 55 HZ3 LYS 55 84.760 -3.768 -3.768
396 2HZ LYS 55 HZ2 LYS 55 85.443 -4.798 -4.798
397 3HZ LYS 55 HZ1 LYS 55 83.816 -4.323 -4.323
398 H GLU 56 HN GLU 56 79.917 -8.186 -8.186
399 HA GLU 56 HA GLU 56 80.229 -7.865 -7.865
400 1HB GLU 56 HB2 GLU 56 79.750 -9.913 -9.913
401 2HB GLU 56 HB1 GLU 56 78.424 -10.048 -10.048
402 1HG GLU 56 HG2 GLU 56 80.162 -11.374 -11.374
403 2HG GLU 56 HG1 GLU 56 80.225 -9.859 -9.859
404 H GLU 57 HN GLU 57 77.149 -8.164 -8.164
405 HA GLU 57 HA GLU 57 75.358 -7.920 -7.920
406 1HB GLU 57 HB2 GLU 57 75.262 -7.030 -7.030
407 2HB GLU 57 HB1 GLU 57 73.853 -6.968 -6.968
408 1HG GLU 57 HG2 GLU 57 75.470 -9.487 -9.487
409 2HG GLU 57 HG1 GLU 57 74.037 -9.075 -9.075
410 H LEU 58 HN LEU 58 76.823 -5.367 -5.367
411 HA LEU 58 HA LEU 58 75.619 -3.087 -3.087
412 1HB LEU 58 HB2 LEU 58 77.767 -3.794 -3.794
413 2HB LEU 58 HB1 LEU 58 78.447 -2.708 -2.708
414 HG LEU 58 HG LEU 58 77.603 -1.413 -1.413
415 HD1 LEU 58 HD1 LEU 58 76.017 0.049 0.049
416 HD1 LEU 58 HD1 LEU 58 75.827 -1.212 -1.212
417 HD1 LEU 58 HD1 LEU 58 77.389 -0.422 -0.422
418 HD2 LEU 58 HD2 LEU 58 75.020 -1.447 -1.447
419 HD2 LEU 58 HD2 LEU 58 75.940 -2.777 -2.777
420 HD2 LEU 58 HD2 LEU 58 75.099 -3.001 -3.001
421 H ASP 59 HN ASP 59 78.917 -4.179 -4.179
422 HA ASP 59 HA ASP 59 79.139 -2.699 -2.699
423 1HB ASP 59 HB2 ASP 59 80.499 -4.798 -4.798
424 2HB ASP 59 HB1 ASP 59 80.519 -5.166 -5.166
425 H ALA 60 HN ALA 60 77.716 -5.895 -5.895
426 HA ALA 60 HA ALA 60 77.315 -6.609 -6.609
427 1HB ALA 60 HB2 ALA 60 76.062 -7.420 -7.420
428 2HB ALA 60 HB1 ALA 60 75.646 -8.199 -8.199
429 3HB ALA 60 HB3 ALA 60 77.298 -8.284 -8.284
430 H ILE 61 HN ILE 61 75.256 -5.011 -5.011
431 HA ILE 61 HA ILE 61 72.955 -4.768 -4.768
432 HB ILE 61 HB ILE 61 73.852 -3.582 -3.582
433 1HG1 ILE 61 HG12 ILE 61 71.355 -5.172 -5.172
434 2HG1 ILE 61 HG11 ILE 61 72.903 -6.017 -6.017
435 1HG2 ILE 61 HG23 ILE 61 72.484 -1.911 -1.911
436 2HG2 ILE 61 HG22 ILE 61 71.185 -3.101 -3.101
437 3HG2 ILE 61 HG21 ILE 61 71.709 -2.463 -2.463
438 HD1 ILE 61 HD1 ILE 61 72.856 -4.191 -4.191
439 HD1 ILE 61 HD1 ILE 61 72.956 -5.952 -5.952
440 HD1 ILE 61 HD1 ILE 61 71.381 -5.158 -5.158
441 H ILE 62 HN ILE 62 75.417 -2.444 -2.444
442 HA ILE 62 HA ILE 62 74.608 -0.125 -0.125
443 HB ILE 62 HB ILE 62 77.304 -1.343 -1.343
444 1HG1 ILE 62 HG12 ILE 62 75.715 0.956 0.956
445 2HG1 ILE 62 HG11 ILE 62 75.889 -0.650 -0.650
446 1HG2 ILE 62 HG22 ILE 62 76.637 1.134 1.134
447 2HG2 ILE 62 HG21 ILE 62 77.914 1.258 1.258
448 3HG2 ILE 62 HG23 ILE 62 78.060 0.099 0.099
449 HD1 ILE 62 HD1 ILE 62 78.181 -0.334 -0.334
450 HD1 ILE 62 HD1 ILE 62 77.460 1.224 1.224
451 HD1 ILE 62 HD1 ILE 62 78.310 1.016 1.016
452 H GLU 63 HN GLU 63 77.160 -2.271 -2.271
453 HA GLU 63 HA GLU 63 77.214 -1.277 -1.277
454 1HB GLU 63 HB2 GLU 63 78.827 -2.878 -2.878
455 2HB GLU 63 HB1 GLU 63 77.578 -4.040 -4.040
456 1HG GLU 63 HG2 GLU 63 77.323 -4.787 -4.787
457 2HG GLU 63 HG1 GLU 63 77.536 -3.178 -3.178
458 H GLU 64 HN GLU 64 74.912 -3.513 -3.513
459 HA GLU 64 HA GLU 64 73.572 -4.263 -4.263
460 1HB GLU 64 HB2 GLU 64 73.315 -5.750 -5.750
461 2HB GLU 64 HB1 GLU 64 73.106 -4.450 -4.450
462 1HG GLU 64 HG2 GLU 64 70.864 -4.154 -4.154
463 2HG GLU 64 HG1 GLU 64 71.057 -4.759 -4.759
464 H VAL 65 HN VAL 65 73.084 -1.748 -1.748
465 HA VAL 65 HA VAL 65 70.683 -0.745 -0.745
466 HB VAL 65 HB VAL 65 70.281 0.453 0.453
467 1HG1 VAL 65 HG12 VAL 65 70.817 -2.330 -2.330
468 2HG1 VAL 65 HG11 VAL 65 71.451 -1.699 -1.699
469 3HG1 VAL 65 HG13 VAL 65 69.758 -1.445 -1.445
470 1HG2 VAL 65 HG23 VAL 65 73.173 0.461 0.461
471 2HG2 VAL 65 HG22 VAL 65 72.029 1.470 1.470
472 3HG2 VAL 65 HG21 VAL 65 72.507 -0.099 -0.099
473 H ASP 66 HN ASP 66 74.004 -0.287 -0.287
474 HA ASP 66 HA ASP 66 74.064 2.625 2.625
475 1HB ASP 66 HB2 ASP 66 75.854 0.453 0.453
476 2HB ASP 66 HB1 ASP 66 76.291 1.222 1.222
477 H GLU 67 HN GLU 67 74.810 0.002 0.002
478 HA GLU 67 HA GLU 67 74.437 1.768 1.768
479 1HB GLU 67 HB2 GLU 67 76.066 -0.083 -0.083
480 2HB GLU 67 HB1 GLU 67 74.748 -1.240 -1.240
481 1HG GLU 67 HG2 GLU 67 74.230 -1.194 -1.194
482 2HG GLU 67 HG1 GLU 67 74.415 0.558 0.558
483 H ASP 68 HN ASP 68 72.179 0.554 0.554
484 HA ASP 68 HA ASP 68 70.280 -0.765 -0.765
485 1HB ASP 68 HB2 ASP 68 70.584 0.007 0.007
486 2HB ASP 68 HB1 ASP 68 69.149 0.877 0.877
487 H GLY 69 HN GLY 69 71.144 2.603 2.603
488 1HA GLY 69 HA2 GLY 69 69.393 3.319 3.319
489 2HA GLY 69 HA1 GLY 69 68.887 4.024 4.024
490 H SER 70 HN SER 70 70.883 5.024 5.024
491 HA SER 70 HA SER 70 72.531 6.559 6.559
492 1HB SER 70 HB2 SER 70 70.653 7.349 7.349
493 2HB SER 70 HB1 SER 70 72.211 8.158 8.158
494 HG SER 70 HG SER 70 71.017 7.942 7.942
495 H GLY 71 HN GLY 71 72.492 6.471 6.471
496 1HA GLY 71 HA2 GLY 71 74.872 4.861 4.861
497 2HA GLY 71 HA1 GLY 71 75.266 6.577 6.577
498 H THR 72 HN THR 72 72.779 7.363 7.363
499 HA THR 72 HA THR 72 73.429 6.571 6.571
500 HB THR 72 HB THR 72 71.406 8.276 8.276
501 HG1 THR 72 HG1 THR 72 70.763 9.096 9.096
502 1HG2 THR 72 HG22 THR 72 73.829 8.669 8.669
503 2HG2 THR 72 HG21 THR 72 74.059 9.176 9.176
504 3HG2 THR 72 HG23 THR 72 72.999 10.100 10.100
505 H ILE 73 HN ILE 73 71.280 6.305 6.305
506 HA ILE 73 HA ILE 73 69.754 4.057 4.057
507 HB ILE 73 HB ILE 73 71.102 3.872 3.872
508 1HG1 ILE 73 HG12 ILE 73 68.989 2.861 2.861
509 2HG1 ILE 73 HG11 ILE 73 68.194 3.199 3.199
510 1HG2 ILE 73 HG21 ILE 73 69.925 6.233 6.233
511 2HG2 ILE 73 HG23 ILE 73 68.843 5.112 5.112
512 3HG2 ILE 73 HG22 ILE 73 70.566 5.114 5.114
513 HD1 ILE 73 HD1 ILE 73 70.216 1.997 1.997
514 HD1 ILE 73 HD1 ILE 73 69.012 0.999 0.999
515 HD1 ILE 73 HD1 ILE 73 70.537 1.377 1.377
516 H ASP 74 HN ASP 74 67.513 4.195 4.195
517 HA ASP 74 HA ASP 74 66.281 6.853 6.853
518 1HB ASP 74 HB2 ASP 74 65.186 4.396 4.396
519 2HB ASP 74 HB1 ASP 74 64.607 6.056 6.056
520 H PHE 75 HN PHE 75 64.824 7.151 7.151
521 HA PHE 75 HA PHE 75 64.453 5.484 5.484
522 1HB PHE 75 HB2 PHE 75 63.607 7.901 7.901
523 2HB PHE 75 HB1 PHE 75 62.128 7.048 7.048
524 HD1 PHE 75 HD2 PHE 75 61.247 5.304 5.304
525 HD2 PHE 75 HD1 PHE 75 63.906 8.556 8.556
526 HE1 PHE 75 HE2 PHE 75 60.596 5.178 5.178
527 HE2 PHE 75 HE1 PHE 75 63.255 8.430 8.430
528 HZ PHE 75 HZ PHE 75 61.601 6.740 6.740
529 H GLU 76 HN GLU 76 62.359 5.566 5.566
530 HA GLU 76 HA GLU 76 60.551 3.515 3.515
531 1HB GLU 76 HB2 GLU 76 61.447 4.898 4.898
532 2HB GLU 76 HB1 GLU 76 60.715 3.316 3.316
533 1HG GLU 76 HG2 GLU 76 58.731 3.984 3.984
534 2HG GLU 76 HG1 GLU 76 59.464 5.547 5.547
535 H GLU 77 HN GLU 77 63.212 3.135 3.135
536 HA GLU 77 HA GLU 77 63.211 0.278 0.278
537 1HB GLU 77 HB2 GLU 77 64.194 1.880 1.880
538 2HB GLU 77 HB1 GLU 77 65.534 2.133 2.133
539 1HG GLU 77 HG2 GLU 77 66.268 0.415 0.415
540 2HG GLU 77 HG1 GLU 77 65.811 -0.414 -0.414
541 H PHE 78 HN PHE 78 64.547 2.630 2.630
542 HA PHE 78 HA PHE 78 66.594 0.931 0.931
543 1HB PHE 78 HB2 PHE 78 66.920 3.237 3.237
544 2HB PHE 78 HB1 PHE 78 65.214 3.536 3.536
545 HD1 PHE 78 HD1 PHE 78 67.879 1.328 1.328
546 HD2 PHE 78 HD2 PHE 78 64.807 4.249 4.249
547 HE1 PHE 78 HE1 PHE 78 68.317 1.212 1.212
548 HE2 PHE 78 HE2 PHE 78 65.246 4.134 4.134
549 HZ PHE 78 HZ PHE 78 67.000 2.615 2.615
550 H LEU 79 HN LEU 79 63.167 1.526 1.526
551 HA LEU 79 HA LEU 79 62.723 0.623 0.623
552 1HB LEU 79 HB2 LEU 79 61.329 0.435 0.435
553 2HB LEU 79 HB1 LEU 79 60.705 -0.600 -0.600
554 HG LEU 79 HG LEU 79 61.265 2.015 2.015
555 HD1 LEU 79 HD1 LEU 79 60.109 1.942 1.942
556 HD1 LEU 79 HD1 LEU 79 60.746 3.310 3.310
557 HD1 LEU 79 HD1 LEU 79 59.086 2.774 2.774
558 HD2 LEU 79 HD2 LEU 79 58.466 1.153 1.153
559 HD2 LEU 79 HD2 LEU 79 59.302 1.589 1.589
560 HD2 LEU 79 HD2 LEU 79 59.491 -0.029 -0.029
561 H VAL 80 HN VAL 80 63.787 -1.314 -1.314
562 HA VAL 80 HA VAL 80 63.252 -3.903 -3.903
563 HB VAL 80 HB VAL 80 64.592 -4.690 -4.690
564 1HG1 VAL 80 HG11 VAL 80 62.639 -2.506 -2.506
565 2HG1 VAL 80 HG13 VAL 80 63.670 -2.788 -2.788
566 3HG1 VAL 80 HG12 VAL 80 62.689 -4.101 -4.101
567 1HG2 VAL 80 HG22 VAL 80 65.611 -1.843 -1.843
568 2HG2 VAL 80 HG21 VAL 80 66.547 -3.329 -3.329
569 3HG2 VAL 80 HG23 VAL 80 65.802 -2.913 -2.913
570 H MET 81 HN MET 81 66.110 -1.770 -1.770
571 HA MET 81 HA MET 81 67.983 -3.529 -3.529
572 1HB MET 81 HB2 MET 81 67.658 -0.721 -0.721
573 2HB MET 81 HB1 MET 81 68.508 -0.900 -0.900
574 1HG MET 81 HG2 MET 81 70.369 -1.665 -1.665
575 2HG MET 81 HG1 MET 81 69.445 -2.824 -2.824
576 1HE MET 81 HE1 MET 81 67.492 -1.625 -1.625
577 2HE MET 81 HE3 MET 81 67.906 -0.574 -0.574
578 3HE MET 81 HE2 MET 81 68.548 -2.212 -2.212
579 H MET 82 HN MET 82 65.295 -1.748 -1.748
580 HA MET 82 HA MET 82 66.225 -1.952 -1.952
581 1HB MET 82 HB2 MET 82 63.490 -1.248 -1.248
582 2HB MET 82 HB1 MET 82 64.172 -0.769 -0.769
583 1HG MET 82 HG2 MET 82 66.008 0.416 0.416
584 2HG MET 82 HG1 MET 82 65.030 0.144 0.144
585 1HE MET 82 HE2 MET 82 65.805 1.973 1.973
586 2HE MET 82 HE1 MET 82 64.471 3.060 3.060
587 3HE MET 82 HE3 MET 82 64.362 1.344 1.344
588 H VAL 83 HN VAL 83 63.416 -3.260 -3.260
589 HA VAL 83 HA VAL 83 62.613 -5.112 -5.112
590 HB VAL 83 HB VAL 83 62.226 -5.167 -5.167
591 1HG1 VAL 83 HG12 VAL 83 60.922 -6.580 -6.580
592 2HG1 VAL 83 HG11 VAL 83 60.002 -6.249 -6.249
593 3HG1 VAL 83 HG13 VAL 83 61.457 -7.244 -7.244
594 1HG2 VAL 83 HG23 VAL 83 61.083 -3.522 -3.522
595 2HG2 VAL 83 HG22 VAL 83 61.267 -3.141 -3.141
596 3HG2 VAL 83 HG21 VAL 83 59.930 -4.156 -4.156
597 H ARG 84 HN ARG 84 64.130 -5.859 -5.859
598 HA ARG 84 HA ARG 84 64.729 -8.528 -8.528
599 1HB ARG 84 HB2 ARG 84 66.521 -6.320 -6.320
600 2HB ARG 84 HB1 ARG 84 66.673 -8.031 -8.031
601 1HG ARG 84 HG2 ARG 84 64.064 -7.690 -7.690
602 2HG ARG 84 HG1 ARG 84 64.636 -6.049 -6.049
603 1HD ARG 84 HD2 ARG 84 65.725 -8.601 -8.601
604 2HD ARG 84 HD1 ARG 84 64.824 -7.315 -7.315
605 HE ARG 84 HE ARG 84 66.917 -5.960 -5.960
606 1HH1 ARG 84 HH1 ARG 84 66.608 -8.700 -8.700
607 2HH1 ARG 84 HH1 ARG 84 68.143 -8.455 -8.455
608 1HH2 ARG 84 HH2 ARG 84 68.927 -5.642 -5.642
609 2HH2 ARG 84 HH2 ARG 84 69.454 -6.726 -6.726
610 H GLN 85 HN GLN 85 66.461 -5.824 -5.824
611 HA GLN 85 HA GLN 85 68.492 -7.596 -7.596
612 1HB GLN 85 HB2 GLN 85 68.949 -5.273 -5.273
613 2HB GLN 85 HB1 GLN 85 67.786 -4.678 -4.678
614 1HG GLN 85 HG2 GLN 85 69.957 -4.473 -4.473
615 2HG GLN 85 HG1 GLN 85 69.170 -5.849 -5.849
616 1HE2 GLN 85 HE22 GLN 85 71.684 -8.089 -8.089
617 2HE2 GLN 85 HE21 GLN 85 70.386 -7.746 -7.746
618 H MET 86 HN MET 86 65.679 -5.718 -5.718
619 HA MET 86 HA MET 86 65.974 -6.497 -6.497
620 1HB MET 86 HB2 MET 86 64.167 -5.009 -5.009
621 2HB MET 86 HB1 MET 86 63.272 -5.947 -5.947
622 1HG MET 86 HG2 MET 86 65.156 -4.984 -4.984
623 2HG MET 86 HG1 MET 86 65.205 -3.708 -3.708
624 1HE MET 86 HE1 MET 86 64.733 -2.022 -2.022
625 2HE MET 86 HE3 MET 86 63.340 -1.559 -1.559
626 3HE MET 86 HE2 MET 86 63.224 -1.534 -1.534
627 H LYS 87 HN LYS 87 64.591 -8.065 -8.065
628 HA LYS 87 HA LYS 87 62.706 -9.825 -9.825
629 1HB LYS 87 HB2 LYS 87 64.679 -9.806 -9.806
630 2HB LYS 87 HB1 LYS 87 64.037 -11.392 -11.392
631 1HG LYS 87 HG2 LYS 87 62.131 -9.097 -9.097
632 2HG LYS 87 HG1 LYS 87 62.765 -9.868 -9.868
633 1HD LYS 87 HD2 LYS 87 62.111 -12.088 -12.088
634 2HD LYS 87 HD1 LYS 87 60.985 -10.999 -10.999
635 1HE LYS 87 HE2 LYS 87 60.886 -10.445 -10.445
636 2HE LYS 87 HE1 LYS 87 60.683 -12.191 -12.191
637 1HZ LYS 87 HZ2 LYS 87 59.335 -10.370 -10.370
638 2HZ LYS 87 HZ1 LYS 87 58.670 -10.544 -10.544
639 3HZ LYS 87 HZ3 LYS 87 58.851 -11.902 -11.902
640 H GLU 88 HN GLU 88 66.189 -9.813 -9.813
641 HA GLU 88 HA GLU 88 66.133 -12.452 -12.452
642 1HB GLU 88 HB2 GLU 88 67.828 -11.635 -11.635
643 2HB GLU 88 HB1 GLU 88 68.517 -10.666 -10.666
644 1HG GLU 88 HG2 GLU 88 67.984 -13.520 -13.520
645 2HG GLU 88 HG1 GLU 88 69.298 -13.203 -13.203
646 H ASP 89 HN ASP 89 66.744 -9.006 -9.006
647 HA ASP 89 HA ASP 89 67.560 -9.392 -9.392
648 1HB ASP 89 HB2 ASP 89 68.461 -7.535 -7.535
649 2HB ASP 89 HB1 ASP 89 66.871 -7.052 -7.052
650 H ALA 90 HN ALA 90 64.564 -8.819 -8.819
651 HA ALA 90 HA ALA 90 63.075 -8.026 -8.026
652 1HB ALA 90 HB3 ALA 90 62.736 -7.241 -7.241
653 2HB ALA 90 HB2 ALA 90 62.016 -8.823 -8.823
654 3HB ALA 90 HB1 ALA 90 61.280 -7.726 -7.726
Start of MODEL 29
1 1H ALA 1 HT2 ALA 1 64.089 -4.143 -4.143
2 2H ALA 1 HT1 ALA 1 65.324 -4.117 -4.117
3 3H ALA 1 HT3 ALA 1 63.887 -4.963 -4.963
4 HA ALA 1 HA ALA 1 65.403 -6.640 -6.640
5 1HB ALA 1 HB2 ALA 1 66.830 -4.579 -4.579
6 2HB ALA 1 HB1 ALA 1 66.229 -5.192 -5.192
7 3HB ALA 1 HB3 ALA 1 67.182 -6.237 -6.237
8 H SER 2 HN SER 2 65.613 -7.703 -7.703
9 HA SER 2 HA SER 2 62.803 -8.243 -8.243
10 1HB SER 2 HB2 SER 2 65.299 -9.548 -9.548
11 2HB SER 2 HB1 SER 2 64.796 -9.347 -9.347
12 HG SER 2 HG SER 2 62.785 -10.285 -10.285
13 H MET 3 HN MET 3 65.253 -6.087 -6.087
14 HA MET 3 HA MET 3 64.803 -5.811 -5.811
15 1HB MET 3 HB2 MET 3 65.701 -4.136 -4.136
16 2HB MET 3 HB1 MET 3 65.239 -3.261 -3.261
17 1HG MET 3 HG2 MET 3 67.681 -3.923 -3.923
18 2HG MET 3 HG1 MET 3 66.823 -4.494 -4.494
19 1HE MET 3 HE3 MET 3 66.920 -6.225 -6.225
20 2HE MET 3 HE2 MET 3 66.779 -7.861 -7.861
21 3HE MET 3 HE1 MET 3 68.374 -7.157 -7.157
22 H THR 4 HN THR 4 63.116 -4.102 -4.102
23 HA THR 4 HA THR 4 61.316 -2.545 -2.545
24 HB THR 4 HB THR 4 61.065 -4.119 -4.119
25 HG1 THR 4 HG1 THR 4 61.663 -1.472 -1.472
26 1HG2 THR 4 HG23 THR 4 59.074 -2.372 -2.372
27 2HG2 THR 4 HG22 THR 4 59.157 -2.334 -2.334
28 3HG2 THR 4 HG21 THR 4 58.806 -3.848 -3.848
29 H ASP 5 HN ASP 5 61.251 -6.031 -6.031
30 HA ASP 5 HA ASP 5 58.550 -6.408 -6.408
31 1HB ASP 5 HB2 ASP 5 60.022 -7.830 -7.830
32 2HB ASP 5 HB1 ASP 5 60.710 -8.504 -8.504
33 H GLN 6 HN GLN 6 61.863 -6.738 -6.738
34 HA GLN 6 HA GLN 6 61.041 -7.767 -7.767
35 1HB GLN 6 HB2 GLN 6 63.357 -7.571 -7.571
36 2HB GLN 6 HB1 GLN 6 63.592 -6.291 -6.291
37 1HG GLN 6 HG2 GLN 6 63.057 -7.914 -7.914
38 2HG GLN 6 HG1 GLN 6 62.925 -9.189 -9.189
39 1HE2 GLN 6 HE22 GLN 6 66.542 -8.809 -8.809
40 2HE2 GLN 6 HE21 GLN 6 65.089 -8.707 -8.707
41 H GLN 7 HN GLN 7 60.737 -4.722 -4.722
42 HA GLN 7 HA GLN 7 61.196 -3.133 -3.133
43 1HB GLN 7 HB2 GLN 7 61.702 -2.256 -2.256
44 2HB GLN 7 HB1 GLN 7 60.033 -2.521 -2.521
45 1HG GLN 7 HG2 GLN 7 59.894 -1.014 -1.014
46 2HG GLN 7 HG1 GLN 7 61.157 -0.265 -0.265
47 1HE2 GLN 7 HE22 GLN 7 58.894 0.614 0.614
48 2HE2 GLN 7 HE21 GLN 7 60.503 0.161 0.161
49 H ALA 8 HN ALA 8 58.369 -3.955 -3.955
50 HA ALA 8 HA ALA 8 56.313 -2.750 -2.750
51 1HB ALA 8 HB1 ALA 8 56.529 -4.449 -4.449
52 2HB ALA 8 HB3 ALA 8 55.890 -5.559 -5.559
53 3HB ALA 8 HB2 ALA 8 54.990 -4.104 -4.104
54 H GLU 9 HN GLU 9 57.152 -6.209 -6.209
55 HA GLU 9 HA GLU 9 55.777 -6.501 -6.501
56 1HB GLU 9 HB2 GLU 9 57.741 -7.934 -7.934
57 2HB GLU 9 HB1 GLU 9 57.850 -8.323 -8.323
58 1HG GLU 9 HG2 GLU 9 55.698 -9.197 -9.197
59 2HG GLU 9 HG1 GLU 9 55.147 -8.236 -8.236
60 H ALA 10 HN ALA 10 58.721 -4.885 -4.885
61 HA ALA 10 HA ALA 10 59.996 -5.196 -5.196
62 1HB ALA 10 HB1 ALA 10 60.495 -4.028 -4.028
63 2HB ALA 10 HB3 ALA 10 60.980 -2.920 -2.920
64 3HB ALA 10 HB2 ALA 10 61.653 -4.550 -4.550
65 H ARG 11 HN ARG 11 57.748 -2.912 -2.912
66 HA ARG 11 HA ARG 11 57.976 -1.028 -1.028
67 1HB ARG 11 HB2 ARG 11 55.958 -0.895 -0.895
68 2HB ARG 11 HB1 ARG 11 56.734 0.430 0.430
69 1HG ARG 11 HG2 ARG 11 58.323 0.548 0.548
70 2HG ARG 11 HG1 ARG 11 58.771 -1.132 -1.132
71 1HD ARG 11 HD2 ARG 11 58.090 -1.248 -1.248
72 2HD ARG 11 HD1 ARG 11 56.553 -1.598 -1.598
73 HE ARG 11 HE ARG 11 57.338 1.085 1.085
74 1HH1 ARG 11 HH2 ARG 11 55.570 2.293 2.293
75 2HH1 ARG 11 HH2 ARG 11 53.972 1.774 1.774
76 1HH2 ARG 11 HH1 ARG 11 55.047 -1.086 -1.086
77 2HH2 ARG 11 HH1 ARG 11 53.676 -0.138 -0.138
78 H ALA 12 HN ALA 12 55.554 -3.161 -3.161
79 HA ALA 12 HA ALA 12 53.329 -2.680 -2.680
80 1HB ALA 12 HB3 ALA 12 54.040 -4.382 -4.382
81 2HB ALA 12 HB2 ALA 12 53.956 -5.506 -5.506
82 3HB ALA 12 HB1 ALA 12 52.545 -4.542 -4.542
83 H PHE 13 HN PHE 13 56.115 -4.818 -4.818
84 HA PHE 13 HA PHE 13 55.239 -6.077 -6.077
85 1HB PHE 13 HB2 PHE 13 57.320 -6.662 -6.662
86 2HB PHE 13 HB1 PHE 13 57.926 -5.011 -5.011
87 HD1 PHE 13 HD1 PHE 13 57.052 -8.070 -8.070
88 HD2 PHE 13 HD2 PHE 13 58.888 -4.189 -4.189
89 HE1 PHE 13 HE1 PHE 13 58.007 -8.602 -8.602
90 HE2 PHE 13 HE2 PHE 13 59.844 -4.722 -4.722
91 HZ PHE 13 HZ PHE 13 59.404 -6.928 -6.928
92 H LEU 14 HN LEU 14 56.110 -2.734 -2.734
93 HA LEU 14 HA LEU 14 56.075 -2.205 -2.205
94 1HB LEU 14 HB2 LEU 14 56.866 -0.420 -0.420
95 2HB LEU 14 HB1 LEU 14 57.216 -0.151 -0.151
96 HG LEU 14 HG LEU 14 58.158 -2.641 -2.641
97 HD1 LEU 14 HD1 LEU 14 59.468 0.084 0.084
98 HD1 LEU 14 HD1 LEU 14 59.123 -0.874 -0.874
99 HD1 LEU 14 HD1 LEU 14 60.374 -1.396 -1.396
100 HD2 LEU 14 HD2 LEU 14 58.608 -3.030 -3.030
101 HD2 LEU 14 HD2 LEU 14 58.531 -1.319 -1.319
102 HD2 LEU 14 HD2 LEU 14 59.995 -1.984 -1.984
103 H SER 15 HN SER 15 54.132 -1.497 -1.497
104 HA SER 15 HA SER 15 51.906 -0.743 -0.743
105 1HB SER 15 HB2 SER 15 52.640 -0.945 -0.945
106 2HB SER 15 HB1 SER 15 51.406 0.267 0.267
107 HG SER 15 HG SER 15 50.943 -2.205 -2.205
108 H GLU 16 HN GLU 16 50.884 1.412 1.412
109 HA GLU 16 HA GLU 16 52.492 3.527 3.527
110 1HB GLU 16 HB2 GLU 16 50.093 3.449 3.449
111 2HB GLU 16 HB1 GLU 16 49.811 3.492 3.492
112 1HG GLU 16 HG2 GLU 16 50.571 5.743 5.743
113 2HG GLU 16 HG1 GLU 16 51.276 5.707 5.707
114 H GLU 17 HN GLU 17 51.640 2.624 2.624
115 HA GLU 17 HA GLU 17 52.515 5.058 5.058
116 1HB GLU 17 HB2 GLU 17 51.122 2.862 2.862
117 2HB GLU 17 HB1 GLU 17 52.699 2.418 2.418
118 1HG GLU 17 HG2 GLU 17 52.671 4.083 4.083
119 2HG GLU 17 HG1 GLU 17 51.786 5.197 5.197
120 H MET 18 HN MET 18 54.103 1.864 1.864
121 HA MET 18 HA MET 18 56.614 2.683 2.683
122 1HB MET 18 HB2 MET 18 55.966 0.364 0.364
123 2HB MET 18 HB1 MET 18 55.748 0.459 0.459
124 1HG MET 18 HG2 MET 18 57.997 0.342 0.342
125 2HG MET 18 HG1 MET 18 58.426 1.225 1.225
126 1HE MET 18 HE2 MET 18 58.204 0.627 0.627
127 2HE MET 18 HE1 MET 18 57.469 -0.843 -0.843
128 3HE MET 18 HE3 MET 18 59.226 -0.732 -0.732
129 H ILE 19 HN ILE 19 55.520 2.350 2.350
130 HA ILE 19 HA ILE 19 57.821 2.941 2.941
131 HB ILE 19 HB ILE 19 54.946 3.826 3.826
132 1HG1 ILE 19 HG12 ILE 19 56.669 1.766 1.766
133 2HG1 ILE 19 HG11 ILE 19 55.449 1.414 1.414
134 1HG2 ILE 19 HG22 ILE 19 57.328 4.680 4.680
135 2HG2 ILE 19 HG21 ILE 19 56.067 3.987 3.987
136 3HG2 ILE 19 HG23 ILE 19 55.705 5.369 5.369
137 HD1 ILE 19 HD1 ILE 19 54.490 1.064 1.064
138 HD1 ILE 19 HD1 ILE 19 54.955 2.695 2.695
139 HD1 ILE 19 HD1 ILE 19 53.724 2.460 2.460
140 H ALA 20 HN ALA 20 55.707 5.284 5.284
141 HA ALA 20 HA ALA 20 57.149 7.638 7.638
142 1HB ALA 20 HB3 ALA 20 55.225 6.906 6.906
143 2HB ALA 20 HB2 ALA 20 55.895 8.534 8.534
144 3HB ALA 20 HB1 ALA 20 54.922 7.882 7.882
145 H GLU 21 HN GLU 21 57.588 5.312 5.312
146 HA GLU 21 HA GLU 21 59.303 6.882 6.882
147 1HB GLU 21 HB2 GLU 21 58.135 4.778 4.778
148 2HB GLU 21 HB1 GLU 21 59.175 3.888 3.888
149 1HG GLU 21 HG2 GLU 21 61.045 4.114 4.114
150 2HG GLU 21 HG1 GLU 21 60.474 5.620 5.620
151 H PHE 22 HN PHE 22 59.970 4.688 4.688
152 HA PHE 22 HA PHE 22 62.835 4.774 4.774
153 1HB PHE 22 HB2 PHE 22 60.846 4.258 4.258
154 2HB PHE 22 HB1 PHE 22 62.584 4.047 4.047
155 HD1 PHE 22 HD2 PHE 22 61.714 3.391 3.391
156 HD2 PHE 22 HD1 PHE 22 61.637 1.632 1.632
157 HE1 PHE 22 HE2 PHE 22 61.564 1.135 1.135
158 HE2 PHE 22 HE1 PHE 22 61.486 -0.624 -0.624
159 HZ PHE 22 HZ PHE 22 61.451 -0.873 -0.873
160 H LYS 23 HN LYS 23 60.459 6.842 6.842
161 HA LYS 23 HA LYS 23 62.060 8.355 8.355
162 1HB LYS 23 HB2 LYS 23 59.780 9.127 9.127
163 2HB LYS 23 HB1 LYS 23 60.390 10.182 10.182
164 1HG LYS 23 HG2 LYS 23 59.455 7.351 7.351
165 2HG LYS 23 HG1 LYS 23 58.391 8.752 8.752
166 1HD LYS 23 HD2 LYS 23 61.029 8.718 8.718
167 2HD LYS 23 HD1 LYS 23 59.624 7.910 7.910
168 1HE LYS 23 HE2 LYS 23 58.588 10.361 10.361
169 2HE LYS 23 HE1 LYS 23 60.200 10.779 10.779
170 1HZ LYS 23 HZ2 LYS 23 59.671 9.212 9.212
171 2HZ LYS 23 HZ1 LYS 23 58.054 9.270 9.270
172 3HZ LYS 23 HZ3 LYS 23 58.830 10.688 10.688
173 H ALA 24 HN ALA 24 61.095 9.869 9.869
174 HA ALA 24 HA ALA 24 63.117 11.734 11.734
175 1HB ALA 24 HB1 ALA 24 61.196 10.382 10.382
176 2HB ALA 24 HB3 ALA 24 62.685 10.636 10.636
177 3HB ALA 24 HB2 ALA 24 61.854 12.008 12.008
178 H ALA 25 HN ALA 25 63.385 8.267 8.267
179 HA ALA 25 HA ALA 25 65.980 8.394 8.394
180 1HB ALA 25 HB1 ALA 25 64.222 6.600 6.600
181 2HB ALA 25 HB3 ALA 25 64.586 6.095 6.095
182 3HB ALA 25 HB2 ALA 25 65.822 5.973 5.973
183 H PHE 26 HN PHE 26 64.976 7.084 7.084
184 HA PHE 26 HA PHE 26 67.642 6.883 6.883
185 1HB PHE 26 HB2 PHE 26 65.836 5.614 5.614
186 2HB PHE 26 HB1 PHE 26 64.876 7.068 7.068
187 HD1 PHE 26 HD1 PHE 26 67.831 5.137 5.137
188 HD2 PHE 26 HD2 PHE 26 65.290 8.511 8.511
189 HE1 PHE 26 HE1 PHE 26 68.847 5.380 5.380
190 HE2 PHE 26 HE2 PHE 26 66.307 8.753 8.753
191 HZ PHE 26 HZ PHE 26 68.087 7.188 7.188
192 H ASP 27 HN ASP 27 65.334 9.528 9.528
193 HA ASP 27 HA ASP 27 66.563 11.211 11.211
194 1HB ASP 27 HB2 ASP 27 64.232 11.173 11.173
195 2HB ASP 27 HB1 ASP 27 65.102 12.349 12.349
196 H MET 28 HN MET 28 67.718 10.178 10.178
197 HA MET 28 HA MET 28 68.834 12.493 12.493
198 1HB MET 28 HB2 MET 28 69.650 9.587 9.587
199 2HB MET 28 HB1 MET 28 70.540 10.740 10.740
200 1HG MET 28 HG2 MET 28 68.626 11.193 11.193
201 2HG MET 28 HG1 MET 28 67.548 10.367 10.367
202 1HE MET 28 HE2 MET 28 70.698 10.225 10.225
203 2HE MET 28 HE1 MET 28 70.197 9.366 9.366
204 3HE MET 28 HE3 MET 28 71.107 8.523 8.523
205 H PHE 29 HN PHE 29 69.806 10.725 10.725
206 HA PHE 29 HA PHE 29 72.211 12.510 12.510
207 1HB PHE 29 HB2 PHE 29 71.873 9.818 9.818
208 2HB PHE 29 HB1 PHE 29 73.367 10.677 10.677
209 HD1 PHE 29 HD2 PHE 29 70.557 8.748 8.748
210 HD2 PHE 29 HD1 PHE 29 74.384 10.556 10.556
211 HE1 PHE 29 HE2 PHE 29 70.698 7.567 7.567
212 HE2 PHE 29 HE1 PHE 29 74.526 9.374 9.374
213 HZ PHE 29 HZ PHE 29 72.683 7.881 7.881
214 H ASP 30 HN ASP 30 69.190 11.649 11.649
215 HA ASP 30 HA ASP 30 69.880 12.375 12.375
216 1HB ASP 30 HB2 ASP 30 68.301 10.546 10.546
217 2HB ASP 30 HB1 ASP 30 67.243 11.734 11.734
218 H ALA 31 HN ALA 31 69.721 14.252 14.252
219 HA ALA 31 HA ALA 31 67.659 16.158 16.158
220 1HB ALA 31 HB1 ALA 31 70.520 16.316 16.316
221 2HB ALA 31 HB3 ALA 31 69.405 17.677 17.677
222 3HB ALA 31 HB2 ALA 31 69.053 16.173 16.173
223 H ASP 32 HN ASP 32 70.425 15.476 15.476
224 HA ASP 32 HA ASP 32 69.791 17.873 17.873
225 1HB ASP 32 HB2 ASP 32 71.957 17.710 17.710
226 2HB ASP 32 HB1 ASP 32 72.605 16.922 16.922
227 H GLY 33 HN GLY 33 69.366 14.766 14.766
228 1HA GLY 33 HA2 GLY 33 70.786 14.141 14.141
229 2HA GLY 33 HA1 GLY 33 69.925 12.976 12.976
230 H GLY 34 HN GLY 34 67.664 15.029 15.029
231 1HA GLY 34 HA2 GLY 34 65.794 15.724 15.724
232 2HA GLY 34 HA1 GLY 34 66.624 15.170 15.170
233 H GLY 35 HN GLY 35 66.924 12.664 12.664
234 1HA GLY 35 HA2 GLY 35 64.351 11.476 11.476
235 2HA GLY 35 HA1 GLY 35 65.090 10.978 10.978
236 H ASP 36 HN ASP 36 67.822 10.962 10.962
237 HA ASP 36 HA ASP 36 67.800 8.997 8.997
238 1HB ASP 36 HB2 ASP 36 68.401 8.377 8.377
239 2HB ASP 36 HB1 ASP 36 69.018 7.368 7.368
240 H ILE 37 HN ILE 37 70.336 7.944 7.944
241 HA ILE 37 HA ILE 37 72.128 10.345 10.345
242 HB ILE 37 HB ILE 37 73.332 9.093 9.093
243 1HG1 ILE 37 HG12 ILE 37 70.591 7.828 7.828
244 2HG1 ILE 37 HG11 ILE 37 71.966 6.982 6.982
245 1HG2 ILE 37 HG22 ILE 37 71.273 10.993 10.993
246 2HG2 ILE 37 HG21 ILE 37 70.782 9.838 9.838
247 3HG2 ILE 37 HG23 ILE 37 72.344 10.647 10.647
248 HD1 ILE 37 HD1 ILE 37 73.185 7.772 7.772
249 HD1 ILE 37 HD1 ILE 37 72.172 6.330 6.330
250 HD1 ILE 37 HD1 ILE 37 71.538 7.856 7.856
251 H SER 38 HN SER 38 74.534 9.461 9.461
252 HA SER 38 HA SER 38 74.902 7.930 7.930
253 1HB SER 38 HB2 SER 38 76.419 9.550 9.550
254 2HB SER 38 HB1 SER 38 76.971 8.029 8.029
255 HG SER 38 HG SER 38 77.922 9.045 9.045
256 H THR 39 HN THR 39 75.195 5.723 5.723
257 HA THR 39 HA THR 39 74.116 3.779 3.779
258 HB THR 39 HB THR 39 75.620 2.230 2.230
259 HG1 THR 39 HG1 THR 39 77.374 3.722 3.722
260 1HG2 THR 39 HG23 THR 39 73.505 3.862 3.862
261 2HG2 THR 39 HG22 THR 39 74.711 4.017 4.017
262 3HG2 THR 39 HG21 THR 39 74.105 2.424 2.424
263 H LYS 40 HN LYS 40 77.282 5.294 5.294
264 HA LYS 40 HA LYS 40 78.519 3.345 3.345
265 1HB LYS 40 HB2 LYS 40 79.011 6.014 6.014
266 2HB LYS 40 HB1 LYS 40 79.686 5.814 5.814
267 1HG LYS 40 HG2 LYS 40 80.124 3.495 3.495
268 2HG LYS 40 HG1 LYS 40 80.902 4.972 4.972
269 1HD LYS 40 HD2 LYS 40 81.203 4.597 4.597
270 2HD LYS 40 HD1 LYS 40 81.901 3.271 3.271
271 1HE LYS 40 HE2 LYS 40 83.292 4.787 4.787
272 2HE LYS 40 HE1 LYS 40 82.467 6.199 6.199
273 1HZ LYS 40 HZ3 LYS 40 83.751 4.149 4.149
274 2HZ LYS 40 HZ2 LYS 40 84.623 5.481 5.481
275 3HZ LYS 40 HZ1 LYS 40 83.281 5.724 5.724
276 H GLU 41 HN GLU 41 76.193 5.881 5.881
277 HA GLU 41 HA GLU 41 76.640 5.794 5.794
278 1HB GLU 41 HB2 GLU 41 76.579 7.960 7.960
279 2HB GLU 41 HB1 GLU 41 74.891 7.617 7.617
280 1HG GLU 41 HG2 GLU 41 74.529 8.826 8.826
281 2HG GLU 41 HG1 GLU 41 74.821 7.263 7.263
282 H LEU 42 HN LEU 42 74.963 4.042 4.042
283 HA LEU 42 HA LEU 42 72.253 4.127 4.127
284 1HB LEU 42 HB2 LEU 42 72.772 3.342 3.342
285 2HB LEU 42 HB1 LEU 42 73.864 2.113 2.113
286 HG LEU 42 HG LEU 42 71.225 1.913 1.913
287 HD1 LEU 42 HD1 LEU 42 71.368 2.412 2.412
288 HD1 LEU 42 HD1 LEU 42 69.955 2.317 2.317
289 HD1 LEU 42 HD1 LEU 42 70.646 0.845 0.845
290 HD2 LEU 42 HD2 LEU 42 72.894 0.041 0.041
291 HD2 LEU 42 HD2 LEU 42 71.495 -0.432 -0.432
292 HD2 LEU 42 HD2 LEU 42 72.955 0.156 0.156
293 H GLY 43 HN GLY 43 74.926 1.768 1.768
294 1HA GLY 43 HA2 GLY 43 73.649 0.039 0.039
295 2HA GLY 43 HA1 GLY 43 75.389 0.329 0.329
296 H THR 44 HN THR 44 74.687 3.300 3.300
297 HA THR 44 HA THR 44 75.032 3.218 3.218
298 HB THR 44 HB THR 44 74.458 5.327 5.327
299 HG1 THR 44 HG1 THR 44 76.537 5.171 5.171
300 1HG2 THR 44 HG23 THR 44 74.401 5.563 5.563
301 2HG2 THR 44 HG22 THR 44 75.085 6.886 6.886
302 3HG2 THR 44 HG21 THR 44 73.413 6.387 6.387
303 H VAL 45 HN VAL 45 72.296 4.482 4.482
304 HA VAL 45 HA VAL 45 70.491 4.992 4.992
305 HB VAL 45 HB VAL 45 70.147 4.005 4.005
306 1HG1 VAL 45 HG13 VAL 45 68.111 4.652 4.652
307 2HG1 VAL 45 HG12 VAL 45 67.771 5.076 5.076
308 3HG1 VAL 45 HG11 VAL 45 68.074 3.395 3.395
309 1HG2 VAL 45 HG22 VAL 45 71.153 6.305 6.305
310 2HG2 VAL 45 HG21 VAL 45 69.802 6.295 6.295
311 3HG2 VAL 45 HG23 VAL 45 69.532 6.723 6.723
312 H MET 46 HN MET 46 70.084 2.106 2.106
313 HA MET 46 HA MET 46 68.406 0.617 0.617
314 1HB MET 46 HB2 MET 46 69.439 -1.348 -1.348
315 2HB MET 46 HB1 MET 46 69.125 -0.014 -0.014
316 1HG MET 46 HG2 MET 46 71.528 0.731 0.731
317 2HG MET 46 HG1 MET 46 71.771 -0.829 -0.829
318 1HE MET 46 HE1 MET 46 69.544 -2.385 -2.385
319 2HE MET 46 HE3 MET 46 70.524 -3.228 -3.228
320 3HE MET 46 HE2 MET 46 71.063 -3.146 -3.146
321 H ARG 47 HN ARG 47 71.916 1.009 1.009
322 HA ARG 47 HA ARG 47 72.061 -0.988 -0.988
323 1HB ARG 47 HB2 ARG 47 73.878 -0.449 -0.449
324 2HB ARG 47 HB1 ARG 47 74.038 1.135 1.135
325 1HG ARG 47 HG2 ARG 47 74.095 -0.693 -0.693
326 2HG ARG 47 HG1 ARG 47 75.092 -1.427 -1.427
327 1HD ARG 47 HD2 ARG 47 75.586 1.453 1.453
328 2HD ARG 47 HD1 ARG 47 75.952 0.542 0.542
329 HE ARG 47 HE ARG 47 77.144 -0.012 -0.012
330 1HH1 ARG 47 HH2 ARG 47 76.533 -1.651 -1.651
331 2HH1 ARG 47 HH2 ARG 47 78.185 -2.019 -2.019
332 1HH2 ARG 47 HH1 ARG 47 79.467 0.021 0.021
333 2HH2 ARG 47 HH1 ARG 47 79.847 -1.073 -1.073
334 H MET 48 HN MET 48 71.945 2.552 2.552
335 HA MET 48 HA MET 48 72.352 3.018 3.018
336 1HB MET 48 HB2 MET 48 72.984 4.646 4.646
337 2HB MET 48 HB1 MET 48 71.322 4.714 4.714
338 1HG MET 48 HG2 MET 48 71.848 6.633 6.633
339 2HG MET 48 HG1 MET 48 70.570 5.618 5.618
340 1HE MET 48 HE2 MET 48 74.255 6.145 6.145
341 2HE MET 48 HE1 MET 48 73.895 7.385 7.385
342 3HE MET 48 HE3 MET 48 74.928 6.013 6.013
343 H LEU 49 HN LEU 49 69.713 1.958 1.958
344 HA LEU 49 HA LEU 49 67.580 3.216 3.216
345 1HB LEU 49 HB2 LEU 49 67.942 1.394 1.394
346 2HB LEU 49 HB1 LEU 49 66.490 1.082 1.082
347 HG LEU 49 HG LEU 49 67.146 3.913 3.913
348 HD1 LEU 49 HD1 LEU 49 65.507 3.266 3.266
349 HD1 LEU 49 HD1 LEU 49 66.352 1.726 1.726
350 HD1 LEU 49 HD1 LEU 49 67.262 3.203 3.203
351 HD2 LEU 49 HD2 LEU 49 64.987 2.440 2.440
352 HD2 LEU 49 HD2 LEU 49 64.412 3.157 3.157
353 HD2 LEU 49 HD2 LEU 49 65.111 4.180 4.180
354 H GLY 50 HN GLY 50 69.737 0.689 0.689
355 1HA GLY 50 HA2 GLY 50 69.500 -0.269 -0.269
356 2HA GLY 50 HA1 GLY 50 67.811 -0.570 -0.570
357 H GLN 51 HN GLN 51 69.106 -1.188 -1.188
358 HA GLN 51 HA GLN 51 69.365 -4.095 -4.095
359 1HB GLN 51 HB2 GLN 51 69.382 -2.764 -2.764
360 2HB GLN 51 HB1 GLN 51 68.775 -4.361 -4.361
361 1HG GLN 51 HG2 GLN 51 67.520 -1.669 -1.669
362 2HG GLN 51 HG1 GLN 51 66.822 -3.054 -3.054
363 1HE2 GLN 51 HE22 GLN 51 66.189 -2.709 -2.709
364 2HE2 GLN 51 HE21 GLN 51 66.721 -1.438 -1.438
365 H ASN 52 HN ASN 52 71.001 -4.973 -4.973
366 HA ASN 52 HA ASN 52 73.477 -3.387 -3.387
367 1HB ASN 52 HB2 ASN 52 74.759 -5.069 -5.069
368 2HB ASN 52 HB1 ASN 52 73.478 -4.353 -4.353
369 HD2 ASN 52 HD2 ASN 52 71.499 -5.677 -5.677
370 HD2 ASN 52 HD2 ASN 52 71.570 -7.365 -7.365
371 HA PRO 53 HA PRO 53 73.035 -6.238 -6.238
372 1HB PRO 53 HB2 PRO 53 74.053 -4.484 -4.484
373 2HB PRO 53 HB1 PRO 53 72.350 -4.473 -4.473
374 1HG PRO 53 HG2 PRO 53 74.576 -2.690 -2.690
375 2HG PRO 53 HG1 PRO 53 72.868 -2.315 -2.315
376 1HD PRO 53 HD2 PRO 53 74.006 -2.647 -2.647
377 2HD PRO 53 HD1 PRO 53 72.279 -2.880 -2.880
378 H THR 54 HN THR 54 74.689 -7.679 -7.679
379 HA THR 54 HA THR 54 77.305 -7.432 -7.432
380 HB THR 54 HB THR 54 77.598 -9.229 -9.229
381 HG1 THR 54 HG1 THR 54 75.371 -10.149 -10.149
382 1HG2 THR 54 HG21 THR 54 77.127 -9.295 -9.295
383 2HG2 THR 54 HG23 THR 54 75.787 -10.242 -10.242
384 3HG2 THR 54 HG22 THR 54 77.449 -10.705 -10.705
385 H LYS 55 HN LYS 55 79.259 -6.710 -6.710
386 HA LYS 55 HA LYS 55 79.310 -4.603 -4.603
387 1HB LYS 55 HB2 LYS 55 81.077 -5.520 -5.520
388 2HB LYS 55 HB1 LYS 55 81.536 -6.618 -6.618
389 1HG LYS 55 HG2 LYS 55 81.368 -4.152 -4.152
390 2HG LYS 55 HG1 LYS 55 82.083 -3.760 -3.760
391 1HD LYS 55 HD2 LYS 55 84.023 -4.363 -4.363
392 2HD LYS 55 HD1 LYS 55 83.499 -5.988 -5.988
393 1HE LYS 55 HE2 LYS 55 83.992 -6.121 -6.121
394 2HE LYS 55 HE1 LYS 55 82.224 -5.980 -5.980
395 1HZ LYS 55 HZ2 LYS 55 83.846 -3.533 -3.533
396 2HZ LYS 55 HZ1 LYS 55 83.607 -4.349 -4.349
397 3HZ LYS 55 HZ3 LYS 55 82.273 -3.785 -3.785
398 H GLU 56 HN GLU 56 79.798 -8.092 -8.092
399 HA GLU 56 HA GLU 56 80.388 -7.878 -7.878
400 1HB GLU 56 HB2 GLU 56 80.569 -9.822 -9.822
401 2HB GLU 56 HB1 GLU 56 78.918 -10.185 -10.185
402 1HG GLU 56 HG2 GLU 56 79.574 -10.953 -10.953
403 2HG GLU 56 HG1 GLU 56 80.791 -9.689 -9.689
404 H GLU 57 HN GLU 57 77.368 -7.893 -7.893
405 HA GLU 57 HA GLU 57 75.614 -8.431 -8.431
406 1HB GLU 57 HB2 GLU 57 75.492 -7.599 -7.599
407 2HB GLU 57 HB1 GLU 57 74.151 -7.013 -7.013
408 1HG GLU 57 HG2 GLU 57 74.220 -9.548 -9.548
409 2HG GLU 57 HG1 GLU 57 74.885 -9.807 -9.807
410 H LEU 58 HN LEU 58 76.673 -5.412 -5.412
411 HA LEU 58 HA LEU 58 75.168 -3.573 -3.573
412 1HB LEU 58 HB2 LEU 58 77.965 -3.316 -3.316
413 2HB LEU 58 HB1 LEU 58 76.884 -1.979 -1.979
414 HG LEU 58 HG LEU 58 76.484 -4.105 -4.105
415 HD1 LEU 58 HD1 LEU 58 76.383 -2.142 -2.142
416 HD1 LEU 58 HD1 LEU 58 76.635 -1.077 -1.077
417 HD1 LEU 58 HD1 LEU 58 77.912 -2.185 -2.185
418 HD2 LEU 58 HD2 LEU 58 74.363 -2.574 -2.574
419 HD2 LEU 58 HD2 LEU 58 74.303 -3.882 -3.882
420 HD2 LEU 58 HD2 LEU 58 74.561 -2.221 -2.221
421 H ASP 59 HN ASP 59 78.580 -4.581 -4.581
422 HA ASP 59 HA ASP 59 78.985 -3.264 -3.264
423 1HB ASP 59 HB2 ASP 59 80.181 -5.412 -5.412
424 2HB ASP 59 HB1 ASP 59 80.518 -5.559 -5.559
425 H ALA 60 HN ALA 60 77.353 -6.286 -6.286
426 HA ALA 60 HA ALA 60 77.271 -7.259 -7.259
427 1HB ALA 60 HB3 ALA 60 76.073 -7.967 -7.967
428 2HB ALA 60 HB2 ALA 60 75.454 -8.738 -8.738
429 3HB ALA 60 HB1 ALA 60 77.151 -8.920 -8.920
430 H ILE 61 HN ILE 61 74.814 -5.897 -5.897
431 HA ILE 61 HA ILE 61 72.740 -5.736 -5.736
432 HB ILE 61 HB ILE 61 73.284 -4.591 -4.591
433 1HG1 ILE 61 HG12 ILE 61 71.524 -6.055 -6.055
434 2HG1 ILE 61 HG11 ILE 61 70.968 -6.272 -6.272
435 1HG2 ILE 61 HG22 ILE 61 70.927 -3.955 -3.955
436 2HG2 ILE 61 HG21 ILE 61 70.960 -3.641 -3.641
437 3HG2 ILE 61 HG23 ILE 61 72.088 -2.806 -2.806
438 HD1 ILE 61 HD1 ILE 61 73.640 -7.213 -7.213
439 HD1 ILE 61 HD1 ILE 61 73.051 -7.453 -7.453
440 HD1 ILE 61 HD1 ILE 61 72.239 -8.244 -8.244
441 H ILE 62 HN ILE 62 75.211 -3.465 -3.465
442 HA ILE 62 HA ILE 62 74.310 -1.081 -1.081
443 HB ILE 62 HB ILE 62 77.033 -2.252 -2.252
444 1HG1 ILE 62 HG12 ILE 62 75.725 0.124 0.124
445 2HG1 ILE 62 HG11 ILE 62 75.255 -1.511 -1.511
446 1HG2 ILE 62 HG22 ILE 62 76.314 0.490 0.490
447 2HG2 ILE 62 HG21 ILE 62 77.848 0.134 0.134
448 3HG2 ILE 62 HG23 ILE 62 77.426 -0.679 -0.679
449 HD1 ILE 62 HD1 ILE 62 77.801 -0.065 -0.065
450 HD1 ILE 62 HD1 ILE 62 77.953 -1.770 -1.770
451 HD1 ILE 62 HD1 ILE 62 77.004 -1.295 -1.295
452 H GLU 63 HN GLU 63 77.005 -3.019 -3.019
453 HA GLU 63 HA GLU 63 77.150 -2.035 -2.035
454 1HB GLU 63 HB2 GLU 63 78.051 -4.245 -4.245
455 2HB GLU 63 HB1 GLU 63 77.140 -4.972 -4.972
456 1HG GLU 63 HG2 GLU 63 79.232 -4.707 -4.707
457 2HG GLU 63 HG1 GLU 63 78.435 -3.208 -3.208
458 H GLU 64 HN GLU 64 74.653 -4.208 -4.208
459 HA GLU 64 HA GLU 64 73.401 -4.699 -4.699
460 1HB GLU 64 HB2 GLU 64 73.030 -6.338 -6.338
461 2HB GLU 64 HB1 GLU 64 72.787 -5.143 -5.143
462 1HG GLU 64 HG2 GLU 64 70.573 -4.916 -4.916
463 2HG GLU 64 HG1 GLU 64 70.837 -4.976 -4.976
464 H VAL 65 HN VAL 65 72.643 -2.617 -2.617
465 HA VAL 65 HA VAL 65 70.498 -1.260 -1.260
466 HB VAL 65 HB VAL 65 69.971 -0.307 -0.307
467 1HG1 VAL 65 HG11 VAL 65 70.914 -3.177 -3.177
468 2HG1 VAL 65 HG13 VAL 65 69.994 -2.394 -2.394
469 3HG1 VAL 65 HG12 VAL 65 69.279 -2.597 -2.597
470 1HG2 VAL 65 HG23 VAL 65 72.772 -1.207 -1.207
471 2HG2 VAL 65 HG22 VAL 65 72.087 0.414 0.414
472 3HG2 VAL 65 HG21 VAL 65 71.579 -0.843 -0.843
473 H ASP 66 HN ASP 66 73.730 -1.006 -1.006
474 HA ASP 66 HA ASP 66 74.055 1.889 1.889
475 1HB ASP 66 HB2 ASP 66 75.734 -0.050 -0.050
476 2HB ASP 66 HB1 ASP 66 75.950 -0.026 -0.026
477 H GLU 67 HN GLU 67 72.896 3.054 3.054
478 HA GLU 67 HA GLU 67 72.264 2.395 2.395
479 1HB GLU 67 HB2 GLU 67 72.387 4.697 4.697
480 2HB GLU 67 HB1 GLU 67 73.061 5.146 5.146
481 1HG GLU 67 HG2 GLU 67 71.049 5.000 5.000
482 2HG GLU 67 HG1 GLU 67 70.641 3.496 3.496
483 H ASP 68 HN ASP 68 73.609 1.722 1.722
484 HA ASP 68 HA ASP 68 76.460 2.002 2.002
485 1HB ASP 68 HB2 ASP 68 74.669 0.477 0.477
486 2HB ASP 68 HB1 ASP 68 74.955 1.679 1.679
487 H GLY 69 HN GLY 69 76.334 4.460 4.460
488 1HA GLY 69 HA2 GLY 69 77.279 5.955 5.955
489 2HA GLY 69 HA1 GLY 69 75.555 6.305 6.305
490 H SER 70 HN SER 70 75.142 6.344 6.344
491 HA SER 70 HA SER 70 76.965 8.545 8.545
492 1HB SER 70 HB2 SER 70 74.584 8.852 8.852
493 2HB SER 70 HB1 SER 70 74.994 9.677 9.677
494 HG SER 70 HG SER 70 72.960 8.300 8.300
495 H GLY 71 HN GLY 71 74.686 6.077 6.077
496 1HA GLY 71 HA2 GLY 71 75.394 4.385 4.385
497 2HA GLY 71 HA1 GLY 71 76.680 5.477 5.477
498 H THR 72 HN THR 72 73.116 5.693 5.693
499 HA THR 72 HA THR 72 73.052 6.756 6.756
500 HB THR 72 HB THR 72 71.440 8.389 8.389
501 HG1 THR 72 HG1 THR 72 71.624 7.443 7.443
502 1HG2 THR 72 HG22 THR 72 73.976 8.605 8.605
503 2HG2 THR 72 HG21 THR 72 73.417 8.358 8.358
504 3HG2 THR 72 HG23 THR 72 72.822 9.728 9.728
505 H ILE 73 HN ILE 73 71.225 6.106 6.106
506 HA ILE 73 HA ILE 73 69.750 3.755 3.755
507 HB ILE 73 HB ILE 73 71.150 3.853 3.853
508 1HG1 ILE 73 HG12 ILE 73 69.160 2.612 2.612
509 2HG1 ILE 73 HG11 ILE 73 68.379 2.766 2.766
510 1HG2 ILE 73 HG22 ILE 73 68.638 5.314 5.314
511 2HG2 ILE 73 HG21 ILE 73 69.853 4.664 4.664
512 3HG2 ILE 73 HG23 ILE 73 70.277 5.966 5.966
513 HD1 ILE 73 HD1 ILE 73 69.776 1.264 1.264
514 HD1 ILE 73 HD1 ILE 73 70.061 0.723 0.723
515 HD1 ILE 73 HD1 ILE 73 71.184 1.846 1.846
516 H ASP 74 HN ASP 74 67.369 3.651 3.651
517 HA ASP 74 HA ASP 74 66.153 6.396 6.396
518 1HB ASP 74 HB2 ASP 74 65.731 3.922 3.922
519 2HB ASP 74 HB1 ASP 74 64.277 4.815 4.815
520 H PHE 75 HN PHE 75 64.697 6.761 6.761
521 HA PHE 75 HA PHE 75 64.433 5.215 5.215
522 1HB PHE 75 HB2 PHE 75 63.542 7.567 7.567
523 2HB PHE 75 HB1 PHE 75 62.088 6.706 6.706
524 HD1 PHE 75 HD2 PHE 75 60.848 5.273 5.273
525 HD2 PHE 75 HD1 PHE 75 64.020 7.932 7.932
526 HE1 PHE 75 HE2 PHE 75 60.090 5.156 5.156
527 HE2 PHE 75 HE1 PHE 75 63.262 7.814 7.814
528 HZ PHE 75 HZ PHE 75 61.297 6.425 6.425
529 H GLU 76 HN GLU 76 62.019 5.193 5.193
530 HA GLU 76 HA GLU 76 60.398 3.097 3.097
531 1HB GLU 76 HB2 GLU 76 61.196 4.154 4.154
532 2HB GLU 76 HB1 GLU 76 60.109 2.769 2.769
533 1HG GLU 76 HG2 GLU 76 59.235 4.745 4.745
534 2HG GLU 76 HG1 GLU 76 59.467 5.530 5.530
535 H GLU 77 HN GLU 77 63.002 2.714 2.714
536 HA GLU 77 HA GLU 77 63.013 -0.151 -0.151
537 1HB GLU 77 HB2 GLU 77 63.898 1.261 1.261
538 2HB GLU 77 HB1 GLU 77 65.180 1.833 1.833
539 1HG GLU 77 HG2 GLU 77 66.372 0.098 0.098
540 2HG GLU 77 HG1 GLU 77 65.430 -0.882 -0.882
541 H PHE 78 HN PHE 78 64.517 2.283 2.283
542 HA PHE 78 HA PHE 78 66.551 0.554 0.554
543 1HB PHE 78 HB2 PHE 78 66.956 2.878 2.878
544 2HB PHE 78 HB1 PHE 78 65.313 3.241 3.241
545 HD1 PHE 78 HD1 PHE 78 68.277 1.236 1.236
546 HD2 PHE 78 HD2 PHE 78 65.008 3.803 3.803
547 HE1 PHE 78 HE1 PHE 78 69.020 1.188 1.188
548 HE2 PHE 78 HE2 PHE 78 65.750 3.754 3.754
549 HZ PHE 78 HZ PHE 78 67.756 2.444 2.444
550 H LEU 79 HN LEU 79 63.187 1.312 1.312
551 HA LEU 79 HA LEU 79 62.847 0.629 0.629
552 1HB LEU 79 HB2 LEU 79 61.328 0.358 0.358
553 2HB LEU 79 HB1 LEU 79 60.777 -0.709 -0.709
554 HG LEU 79 HG LEU 79 60.519 1.181 1.181
555 HD1 LEU 79 HD1 LEU 79 62.488 2.405 2.405
556 HD1 LEU 79 HD1 LEU 79 61.263 3.332 3.332
557 HD1 LEU 79 HD1 LEU 79 61.143 3.130 3.130
558 HD2 LEU 79 HD2 LEU 79 58.711 2.370 2.370
559 HD2 LEU 79 HD2 LEU 79 58.662 0.658 0.658
560 HD2 LEU 79 HD2 LEU 79 59.326 1.825 1.825
561 H VAL 80 HN VAL 80 63.154 -1.729 -1.729
562 HA VAL 80 HA VAL 80 62.849 -4.110 -4.110
563 HB VAL 80 HB VAL 80 63.011 -3.907 -3.907
564 1HG1 VAL 80 HG12 VAL 80 64.981 -2.222 -2.222
565 2HG1 VAL 80 HG11 VAL 80 65.996 -3.663 -3.663
566 3HG1 VAL 80 HG13 VAL 80 64.993 -3.327 -3.327
567 1HG2 VAL 80 HG21 VAL 80 63.795 -6.003 -6.003
568 2HG2 VAL 80 HG23 VAL 80 63.933 -6.006 -6.006
569 3HG2 VAL 80 HG22 VAL 80 65.343 -5.638 -5.638
570 H MET 81 HN MET 81 65.844 -2.222 -2.222
571 HA MET 81 HA MET 81 67.661 -3.928 -3.928
572 1HB MET 81 HB2 MET 81 67.458 -1.155 -1.155
573 2HB MET 81 HB1 MET 81 68.491 -1.315 -1.315
574 1HG MET 81 HG2 MET 81 69.741 -1.603 -1.603
575 2HG MET 81 HG1 MET 81 69.830 -3.021 -3.021
576 1HE MET 81 HE2 MET 81 67.660 -1.248 -1.248
577 2HE MET 81 HE1 MET 81 69.006 -1.756 -1.756
578 3HE MET 81 HE3 MET 81 67.389 -2.422 -2.422
579 H MET 82 HN MET 82 65.138 -1.884 -1.884
580 HA MET 82 HA MET 82 66.236 -1.731 -1.731
581 1HB MET 82 HB2 MET 82 63.488 -1.074 -1.074
582 2HB MET 82 HB1 MET 82 64.168 -0.499 -0.499
583 1HG MET 82 HG2 MET 82 66.023 0.579 0.579
584 2HG MET 82 HG1 MET 82 65.142 0.153 0.153
585 1HE MET 82 HE2 MET 82 65.504 1.781 1.781
586 2HE MET 82 HE1 MET 82 65.386 3.407 3.407
587 3HE MET 82 HE3 MET 82 64.085 2.766 2.766
588 H VAL 83 HN VAL 83 63.166 -3.055 -3.055
589 HA VAL 83 HA VAL 83 62.518 -4.632 -4.632
590 HB VAL 83 HB VAL 83 60.909 -4.071 -4.071
591 1HG1 VAL 83 HG13 VAL 83 62.981 -4.460 -4.460
592 2HG1 VAL 83 HG12 VAL 83 61.988 -5.885 -5.885
593 3HG1 VAL 83 HG11 VAL 83 61.292 -4.275 -4.275
594 1HG2 VAL 83 HG22 VAL 83 60.720 -6.309 -6.309
595 2HG2 VAL 83 HG21 VAL 83 59.899 -6.226 -6.226
596 3HG2 VAL 83 HG23 VAL 83 61.457 -7.041 -7.041
597 H ARG 84 HN ARG 84 64.476 -5.391 -5.391
598 HA ARG 84 HA ARG 84 64.740 -8.187 -8.187
599 1HB ARG 84 HB2 ARG 84 66.612 -6.026 -6.026
600 2HB ARG 84 HB1 ARG 84 66.936 -7.749 -7.749
601 1HG ARG 84 HG2 ARG 84 64.313 -6.541 -6.541
602 2HG ARG 84 HG1 ARG 84 65.727 -6.524 -6.524
603 1HD ARG 84 HD2 ARG 84 65.601 -8.773 -8.773
604 2HD ARG 84 HD1 ARG 84 65.136 -9.144 -9.144
605 HE ARG 84 HE ARG 84 62.908 -7.874 -7.874
606 1HH1 ARG 84 HH1 ARG 84 64.679 -9.142 -9.142
607 2HH1 ARG 84 HH1 ARG 84 63.498 -10.298 -10.298
608 1HH2 ARG 84 HH2 ARG 84 61.457 -9.838 -9.838
609 2HH2 ARG 84 HH2 ARG 84 61.673 -10.694 -10.694
610 H GLN 85 HN GLN 85 66.693 -5.554 -5.554
611 HA GLN 85 HA GLN 85 68.418 -7.373 -7.373
612 1HB GLN 85 HB2 GLN 85 68.859 -4.974 -4.974
613 2HB GLN 85 HB1 GLN 85 67.827 -4.455 -4.455
614 1HG GLN 85 HG2 GLN 85 70.201 -4.436 -4.436
615 2HG GLN 85 HG1 GLN 85 69.295 -5.632 -5.632
616 1HE2 GLN 85 HE22 GLN 85 71.545 -7.206 -7.206
617 2HE2 GLN 85 HE21 GLN 85 70.593 -5.830 -5.830
618 H MET 86 HN MET 86 65.459 -5.551 -5.551
619 HA MET 86 HA MET 86 65.479 -6.235 -6.235
620 1HB MET 86 HB2 MET 86 63.961 -4.655 -4.655
621 2HB MET 86 HB1 MET 86 62.886 -5.538 -5.538
622 1HG MET 86 HG2 MET 86 63.921 -4.592 -4.592
623 2HG MET 86 HG1 MET 86 65.250 -3.930 -3.930
624 1HE MET 86 HE1 MET 86 63.831 -2.709 -2.709
625 2HE MET 86 HE3 MET 86 64.194 -1.132 -1.132
626 3HE MET 86 HE2 MET 86 62.532 -1.557 -1.557
627 H LYS 87 HN LYS 87 64.406 -7.776 -7.776
628 HA LYS 87 HA LYS 87 62.288 -9.410 -9.410
629 1HB LYS 87 HB2 LYS 87 64.618 -9.635 -9.635
630 2HB LYS 87 HB1 LYS 87 63.669 -11.092 -11.092
631 1HG LYS 87 HG2 LYS 87 62.108 -8.622 -8.622
632 2HG LYS 87 HG1 LYS 87 63.020 -9.259 -9.259
633 1HD LYS 87 HD2 LYS 87 61.603 -11.328 -11.328
634 2HD LYS 87 HD1 LYS 87 60.532 -10.149 -10.149
635 1HE LYS 87 HE2 LYS 87 62.747 -11.127 -11.127
636 2HE LYS 87 HE1 LYS 87 61.491 -12.318 -12.318
637 1HZ LYS 87 HZ1 LYS 87 59.824 -10.599 -10.599
638 2HZ LYS 87 HZ3 LYS 87 61.078 -9.598 -9.598
639 3HZ LYS 87 HZ2 LYS 87 60.770 -11.077 -11.077
640 H GLU 88 HN GLU 88 65.671 -9.559 -9.559
641 HA GLU 88 HA GLU 88 65.317 -12.180 -12.180
642 1HB GLU 88 HB2 GLU 88 67.446 -10.592 -10.592
643 2HB GLU 88 HB1 GLU 88 67.852 -11.030 -11.030
644 1HG GLU 88 HG2 GLU 88 66.781 -13.374 -13.374
645 2HG GLU 88 HG1 GLU 88 67.673 -12.729 -12.729
646 H ASP 89 HN ASP 89 65.946 -8.755 -8.755
647 HA ASP 89 HA ASP 89 66.183 -9.156 -9.156
648 1HB ASP 89 HB2 ASP 89 67.109 -7.257 -7.257
649 2HB ASP 89 HB1 ASP 89 65.458 -6.683 -6.683
650 H ALA 90 HN ALA 90 63.518 -8.503 -8.503
651 HA ALA 90 HA ALA 90 61.584 -7.840 -7.840
652 1HB ALA 90 HB2 ALA 90 61.597 -7.164 -7.164
653 2HB ALA 90 HB1 ALA 90 61.109 -8.817 -8.817
654 3HB ALA 90 HB3 ALA 90 60.058 -7.783 -7.783
Start of MODEL 30
1 1H ALA 1 HT1 ALA 1 64.336 -5.957 -5.957
2 2H ALA 1 HT3 ALA 1 65.271 -4.871 -4.871
3 3H ALA 1 HT2 ALA 1 66.001 -5.814 -5.814
4 HA ALA 1 HA ALA 1 65.755 -7.801 -7.801
5 1HB ALA 1 HB3 ALA 1 67.159 -5.490 -5.490
6 2HB ALA 1 HB2 ALA 1 66.510 -6.182 -6.182
7 3HB ALA 1 HB1 ALA 1 67.536 -7.156 -7.156
8 H SER 2 HN SER 2 65.136 -8.644 -8.644
9 HA SER 2 HA SER 2 62.300 -8.101 -8.101
10 1HB SER 2 HB2 SER 2 63.996 -10.230 -10.230
11 2HB SER 2 HB1 SER 2 63.856 -9.689 -9.689
12 HG SER 2 HG SER 2 61.559 -9.748 -9.748
13 H MET 3 HN MET 3 65.231 -6.793 -6.793
14 HA MET 3 HA MET 3 64.696 -6.205 -6.205
15 1HB MET 3 HB2 MET 3 66.382 -5.290 -5.290
16 2HB MET 3 HB1 MET 3 65.908 -3.936 -3.936
17 1HG MET 3 HG2 MET 3 66.503 -5.942 -5.942
18 2HG MET 3 HG1 MET 3 67.729 -6.154 -6.154
19 1HE MET 3 HE1 MET 3 67.135 -4.935 -4.935
20 2HE MET 3 HE3 MET 3 68.809 -5.404 -5.404
21 3HE MET 3 HE2 MET 3 68.441 -3.783 -3.783
22 H THR 4 HN THR 4 63.677 -4.394 -4.394
23 HA THR 4 HA THR 4 62.354 -2.261 -2.261
24 HB THR 4 HB THR 4 62.127 -3.510 -3.510
25 HG1 THR 4 HG1 THR 4 63.690 -2.185 -2.185
26 1HG2 THR 4 HG22 THR 4 59.963 -2.444 -2.444
27 2HG2 THR 4 HG21 THR 4 60.838 -0.935 -0.935
28 3HG2 THR 4 HG23 THR 4 60.746 -1.636 -1.636
29 H ASP 5 HN ASP 5 61.478 -5.566 -5.566
30 HA ASP 5 HA ASP 5 58.581 -5.092 -5.092
31 1HB ASP 5 HB2 ASP 5 59.847 -6.830 -6.830
32 2HB ASP 5 HB1 ASP 5 60.004 -7.748 -7.748
33 H GLN 6 HN GLN 6 61.368 -5.862 -5.862
34 HA GLN 6 HA GLN 6 59.918 -7.121 -7.121
35 1HB GLN 6 HB2 GLN 6 62.684 -6.011 -6.011
36 2HB GLN 6 HB1 GLN 6 62.208 -6.597 -6.597
37 1HG GLN 6 HG2 GLN 6 61.871 -8.259 -8.259
38 2HG GLN 6 HG1 GLN 6 63.337 -8.310 -8.310
39 1HE2 GLN 6 HE21 GLN 6 63.262 -9.475 -9.475
40 2HE2 GLN 6 HE22 GLN 6 61.875 -10.281 -10.281
41 H GLN 7 HN GLN 7 60.463 -3.871 -3.871
42 HA GLN 7 HA GLN 7 60.577 -2.385 -2.385
43 1HB GLN 7 HB2 GLN 7 59.372 -2.028 -2.028
44 2HB GLN 7 HB1 GLN 7 59.070 -0.796 -0.796
45 1HG GLN 7 HG2 GLN 7 61.397 -0.344 -0.344
46 2HG GLN 7 HG1 GLN 7 61.853 -1.796 -1.796
47 1HE2 GLN 7 HE22 GLN 7 62.270 0.604 0.604
48 2HE2 GLN 7 HE21 GLN 7 63.105 -0.200 -0.200
49 H ALA 8 HN ALA 8 57.675 -3.680 -3.680
50 HA ALA 8 HA ALA 8 55.680 -2.621 -2.621
51 1HB ALA 8 HB3 ALA 8 56.060 -4.930 -4.930
52 2HB ALA 8 HB2 ALA 8 54.727 -5.085 -5.085
53 3HB ALA 8 HB1 ALA 8 54.776 -3.723 -3.723
54 H GLU 9 HN GLU 9 56.383 -6.088 -6.088
55 HA GLU 9 HA GLU 9 55.533 -6.517 -6.517
56 1HB GLU 9 HB2 GLU 9 57.259 -7.781 -7.781
57 2HB GLU 9 HB1 GLU 9 57.775 -8.157 -8.157
58 1HG GLU 9 HG2 GLU 9 55.283 -8.653 -8.653
59 2HG GLU 9 HG1 GLU 9 55.098 -8.684 -8.684
60 H ALA 10 HN ALA 10 58.493 -4.962 -4.962
61 HA ALA 10 HA ALA 10 59.953 -5.196 -5.196
62 1HB ALA 10 HB2 ALA 10 60.053 -3.506 -3.506
63 2HB ALA 10 HB1 ALA 10 61.114 -3.129 -3.129
64 3HB ALA 10 HB3 ALA 10 61.217 -4.704 -4.704
65 H ARG 11 HN ARG 11 58.261 -2.395 -2.395
66 HA ARG 11 HA ARG 11 58.320 -0.874 -0.874
67 1HB ARG 11 HB2 ARG 11 57.161 0.771 0.771
68 2HB ARG 11 HB1 ARG 11 58.400 0.013 0.013
69 1HG ARG 11 HG2 ARG 11 56.269 -1.672 -1.672
70 2HG ARG 11 HG1 ARG 11 55.465 -0.109 -0.109
71 1HD ARG 11 HD2 ARG 11 57.890 -0.377 -0.377
72 2HD ARG 11 HD1 ARG 11 56.286 -0.846 -0.846
73 HE ARG 11 HE ARG 11 56.526 1.803 1.803
74 1HH1 ARG 11 HH1 ARG 11 54.256 0.735 0.735
75 2HH1 ARG 11 HH1 ARG 11 54.533 1.655 1.655
76 1HH2 ARG 11 HH2 ARG 11 57.731 2.630 2.630
77 2HH2 ARG 11 HH2 ARG 11 56.500 2.727 2.727
78 H ALA 12 HN ALA 12 56.109 -3.098 -3.098
79 HA ALA 12 HA ALA 12 53.711 -2.271 -2.271
80 1HB ALA 12 HB1 ALA 12 54.235 -3.739 -3.739
81 2HB ALA 12 HB3 ALA 12 54.153 -5.056 -5.056
82 3HB ALA 12 HB2 ALA 12 52.764 -3.994 -3.994
83 H PHE 13 HN PHE 13 56.447 -4.279 -4.279
84 HA PHE 13 HA PHE 13 55.294 -5.990 -5.990
85 1HB PHE 13 HB2 PHE 13 57.525 -6.357 -6.357
86 2HB PHE 13 HB1 PHE 13 58.007 -4.705 -4.705
87 HD1 PHE 13 HD1 PHE 13 56.436 -7.638 -7.638
88 HD2 PHE 13 HD2 PHE 13 59.285 -4.427 -4.427
89 HE1 PHE 13 HE1 PHE 13 57.121 -8.366 -8.366
90 HE2 PHE 13 HE2 PHE 13 59.971 -5.156 -5.156
91 HZ PHE 13 HZ PHE 13 58.888 -7.125 -7.125
92 H LEU 14 HN LEU 14 56.269 -2.596 -2.596
93 HA LEU 14 HA LEU 14 55.502 -2.532 -2.532
94 1HB LEU 14 HB2 LEU 14 56.965 -0.414 -0.414
95 2HB LEU 14 HB1 LEU 14 56.974 -0.662 -0.662
96 HG LEU 14 HG LEU 14 57.865 -3.097 -3.097
97 HD1 LEU 14 HD1 LEU 14 58.270 -1.104 -1.104
98 HD1 LEU 14 HD1 LEU 14 58.698 -2.814 -2.814
99 HD1 LEU 14 HD1 LEU 14 59.831 -1.632 -1.632
100 HD2 LEU 14 HD2 LEU 14 59.409 -0.640 -0.640
101 HD2 LEU 14 HD2 LEU 14 60.113 -2.253 -2.253
102 HD2 LEU 14 HD2 LEU 14 58.812 -1.944 -1.944
103 H SER 15 HN SER 15 54.150 -0.717 -0.717
104 HA SER 15 HA SER 15 52.169 0.066 0.066
105 1HB SER 15 HB2 SER 15 52.004 0.771 0.771
106 2HB SER 15 HB1 SER 15 50.720 0.277 0.277
107 HG SER 15 HG SER 15 51.735 -1.259 -1.259
108 H GLU 16 HN GLU 16 51.275 2.419 2.419
109 HA GLU 16 HA GLU 16 53.221 4.332 4.332
110 1HB GLU 16 HB2 GLU 16 50.823 4.609 4.609
111 2HB GLU 16 HB1 GLU 16 50.544 4.600 4.600
112 1HG GLU 16 HG2 GLU 16 51.338 6.742 6.742
113 2HG GLU 16 HG1 GLU 16 52.481 6.606 6.606
114 H GLU 17 HN GLU 17 52.122 3.308 3.308
115 HA GLU 17 HA GLU 17 53.197 5.403 5.403
116 1HB GLU 17 HB2 GLU 17 51.706 3.444 3.444
117 2HB GLU 17 HB1 GLU 17 53.159 2.445 2.445
118 1HG GLU 17 HG2 GLU 17 52.698 3.239 3.239
119 2HG GLU 17 HG1 GLU 17 54.172 3.998 3.998
120 H MET 18 HN MET 18 54.731 2.212 2.212
121 HA MET 18 HA MET 18 57.312 3.002 3.002
122 1HB MET 18 HB2 MET 18 56.395 0.681 0.681
123 2HB MET 18 HB1 MET 18 56.556 0.841 0.841
124 1HG MET 18 HG2 MET 18 58.843 0.674 0.674
125 2HG MET 18 HG1 MET 18 58.967 1.484 1.484
126 1HE MET 18 HE2 MET 18 59.118 0.809 0.809
127 2HE MET 18 HE1 MET 18 58.695 -0.720 -0.720
128 3HE MET 18 HE3 MET 18 60.277 -0.518 -0.518
129 H ILE 19 HN ILE 19 56.035 2.696 2.696
130 HA ILE 19 HA ILE 19 58.254 3.312 3.312
131 HB ILE 19 HB ILE 19 55.379 4.253 4.253
132 1HG1 ILE 19 HG12 ILE 19 56.967 2.106 2.106
133 2HG1 ILE 19 HG11 ILE 19 55.760 1.831 1.831
134 1HG2 ILE 19 HG22 ILE 19 57.651 5.185 5.185
135 2HG2 ILE 19 HG21 ILE 19 56.583 4.268 4.268
136 3HG2 ILE 19 HG23 ILE 19 55.957 5.649 5.649
137 HD1 ILE 19 HD1 ILE 19 54.985 1.584 1.584
138 HD1 ILE 19 HD1 ILE 19 55.083 3.343 3.343
139 HD1 ILE 19 HD1 ILE 19 53.984 2.569 2.569
140 H ALA 20 HN ALA 20 56.253 5.603 5.603
141 HA ALA 20 HA ALA 20 57.593 8.000 8.000
142 1HB ALA 20 HB1 ALA 20 56.121 7.268 7.268
143 2HB ALA 20 HB3 ALA 20 56.482 8.914 8.914
144 3HB ALA 20 HB2 ALA 20 55.383 7.911 7.911
145 H GLU 21 HN GLU 21 58.151 5.711 5.711
146 HA GLU 21 HA GLU 21 60.156 7.149 7.149
147 1HB GLU 21 HB2 GLU 21 59.080 5.158 5.158
148 2HB GLU 21 HB1 GLU 21 59.665 4.192 4.192
149 1HG GLU 21 HG2 GLU 21 61.271 3.647 3.647
150 2HG GLU 21 HG1 GLU 21 62.031 5.076 5.076
151 H PHE 22 HN PHE 22 60.360 5.005 5.005
152 HA PHE 22 HA PHE 22 63.266 5.080 5.080
153 1HB PHE 22 HB2 PHE 22 61.034 4.302 4.302
154 2HB PHE 22 HB1 PHE 22 62.742 4.050 4.050
155 HD1 PHE 22 HD2 PHE 22 62.382 3.777 3.777
156 HD2 PHE 22 HD1 PHE 22 61.569 1.619 1.619
157 HE1 PHE 22 HE2 PHE 22 62.330 1.651 1.651
158 HE2 PHE 22 HE1 PHE 22 61.517 -0.506 -0.506
159 HZ PHE 22 HZ PHE 22 61.898 -0.491 -0.491
160 H LYS 23 HN LYS 23 60.626 7.051 7.051
161 HA LYS 23 HA LYS 23 62.004 8.391 8.391
162 1HB LYS 23 HB2 LYS 23 59.684 9.063 9.063
163 2HB LYS 23 HB1 LYS 23 60.176 10.124 10.124
164 1HG LYS 23 HG2 LYS 23 59.638 7.194 7.194
165 2HG LYS 23 HG1 LYS 23 58.328 8.375 8.375
166 1HD LYS 23 HD2 LYS 23 60.584 9.328 9.328
167 2HD LYS 23 HD1 LYS 23 60.043 7.752 7.752
168 1HE LYS 23 HE2 LYS 23 58.300 8.764 8.764
169 2HE LYS 23 HE1 LYS 23 57.708 9.309 9.309
170 1HZ LYS 23 HZ1 LYS 23 60.006 10.679 10.679
171 2HZ LYS 23 HZ3 LYS 23 58.452 11.046 11.046
172 3HZ LYS 23 HZ2 LYS 23 58.830 11.285 11.285
173 H ALA 24 HN ALA 24 60.992 10.069 10.069
174 HA ALA 24 HA ALA 24 62.845 12.146 12.146
175 1HB ALA 24 HB2 ALA 24 60.858 11.425 11.425
176 2HB ALA 24 HB1 ALA 24 62.174 10.785 10.785
177 3HB ALA 24 HB3 ALA 24 62.127 12.502 12.502
178 H ALA 25 HN ALA 25 63.352 8.801 8.801
179 HA ALA 25 HA ALA 25 65.972 9.279 9.279
180 1HB ALA 25 HB3 ALA 25 64.399 7.447 7.447
181 2HB ALA 25 HB2 ALA 25 64.614 6.747 6.747
182 3HB ALA 25 HB1 ALA 25 65.976 6.825 6.825
183 H PHE 26 HN PHE 26 64.835 7.748 7.748
184 HA PHE 26 HA PHE 26 67.458 7.313 7.313
185 1HB PHE 26 HB2 PHE 26 65.478 6.122 6.122
186 2HB PHE 26 HB1 PHE 26 64.704 7.636 7.636
187 HD1 PHE 26 HD2 PHE 26 65.450 8.882 8.882
188 HD2 PHE 26 HD1 PHE 26 67.292 5.168 5.168
189 HE1 PHE 26 HE2 PHE 26 66.529 8.745 8.745
190 HE2 PHE 26 HE1 PHE 26 68.373 5.031 5.031
191 HZ PHE 26 HZ PHE 26 67.990 6.820 6.820
192 H ASP 27 HN ASP 27 65.174 10.024 10.024
193 HA ASP 27 HA ASP 27 66.569 11.516 11.516
194 1HB ASP 27 HB2 ASP 27 64.408 11.881 11.881
195 2HB ASP 27 HB1 ASP 27 65.211 13.363 13.363
196 H MET 28 HN MET 28 67.459 10.748 10.748
197 HA MET 28 HA MET 28 68.632 13.146 13.146
198 1HB MET 28 HB2 MET 28 69.181 10.191 10.191
199 2HB MET 28 HB1 MET 28 70.129 11.391 11.391
200 1HG MET 28 HG2 MET 28 67.185 11.743 11.743
201 2HG MET 28 HG1 MET 28 67.824 10.337 10.337
202 1HE MET 28 HE3 MET 28 67.882 14.019 14.019
203 2HE MET 28 HE2 MET 28 66.699 13.791 13.791
204 3HE MET 28 HE1 MET 28 68.153 14.737 14.737
205 H PHE 29 HN PHE 29 69.746 10.833 10.833
206 HA PHE 29 HA PHE 29 72.323 12.350 12.350
207 1HB PHE 29 HB2 PHE 29 71.711 9.620 9.620
208 2HB PHE 29 HB1 PHE 29 73.283 10.305 10.305
209 HD1 PHE 29 HD1 PHE 29 73.954 10.563 10.563
210 HD2 PHE 29 HD2 PHE 29 70.306 8.599 8.599
211 HE1 PHE 29 HE1 PHE 29 73.772 9.591 9.591
212 HE2 PHE 29 HE2 PHE 29 70.125 7.627 7.627
213 HZ PHE 29 HZ PHE 29 71.858 8.121 8.121
214 H ASP 30 HN ASP 30 69.703 13.131 13.131
215 HA ASP 30 HA ASP 30 70.265 12.679 12.679
216 1HB ASP 30 HB2 ASP 30 67.929 13.326 13.326
217 2HB ASP 30 HB1 ASP 30 68.029 12.123 12.123
218 H ALA 31 HN ALA 31 72.039 14.451 14.451
219 HA ALA 31 HA ALA 31 71.393 17.161 17.161
220 1HB ALA 31 HB2 ALA 31 73.706 15.481 15.481
221 2HB ALA 31 HB1 ALA 31 73.838 17.030 17.030
222 3HB ALA 31 HB3 ALA 31 73.617 16.986 16.986
223 H ASP 32 HN ASP 32 72.150 15.362 15.362
224 HA ASP 32 HA ASP 32 70.821 17.571 17.571
225 1HB ASP 32 HB2 ASP 32 73.570 16.729 16.729
226 2HB ASP 32 HB1 ASP 32 72.889 16.379 16.379
227 H GLY 33 HN GLY 33 70.508 14.471 14.471
228 1HA GLY 33 HA2 GLY 33 69.952 13.321 13.321
229 2HA GLY 33 HA1 GLY 33 69.832 12.468 12.468
230 H GLY 34 HN GLY 34 68.201 14.425 14.425
231 1HA GLY 34 HA2 GLY 34 65.904 14.764 14.764
232 2HA GLY 34 HA1 GLY 34 65.891 15.265 15.265
233 H GLY 35 HN GLY 35 66.628 12.034 12.034
234 1HA GLY 35 HA2 GLY 35 64.380 10.585 10.585
235 2HA GLY 35 HA1 GLY 35 64.565 10.927 10.927
236 H ASP 36 HN ASP 36 67.634 10.896 10.896
237 HA ASP 36 HA ASP 36 68.029 7.977 7.977
238 1HB ASP 36 HB2 ASP 36 69.213 7.828 7.828
239 2HB ASP 36 HB1 ASP 36 67.540 8.341 8.341
240 H ILE 37 HN ILE 37 69.960 7.612 7.612
241 HA ILE 37 HA ILE 37 71.817 9.940 9.940
242 HB ILE 37 HB ILE 37 72.434 8.837 8.837
243 1HG1 ILE 37 HG12 ILE 37 70.564 6.632 6.632
244 2HG1 ILE 37 HG11 ILE 37 72.320 6.509 6.509
245 1HG2 ILE 37 HG21 ILE 37 69.434 8.836 8.836
246 2HG2 ILE 37 HG23 ILE 37 70.222 8.855 8.855
247 3HG2 ILE 37 HG22 ILE 37 70.408 10.225 10.225
248 HD1 ILE 37 HD1 ILE 37 72.290 6.392 6.392
249 HD1 ILE 37 HD1 ILE 37 70.691 5.715 5.715
250 HD1 ILE 37 HD1 ILE 37 70.858 7.413 7.413
251 H SER 38 HN SER 38 74.169 9.354 9.354
252 HA SER 38 HA SER 38 75.076 7.913 7.913
253 1HB SER 38 HB2 SER 38 76.474 9.511 9.511
254 2HB SER 38 HB1 SER 38 76.331 8.669 8.669
255 HG SER 38 HG SER 38 78.153 8.336 8.336
256 H THR 39 HN THR 39 75.272 5.742 5.742
257 HA THR 39 HA THR 39 74.250 3.686 3.686
258 HB THR 39 HB THR 39 75.778 2.242 2.242
259 HG1 THR 39 HG1 THR 39 77.019 4.727 4.727
260 1HG2 THR 39 HG22 THR 39 73.924 4.223 4.223
261 2HG2 THR 39 HG21 THR 39 75.192 3.968 3.968
262 3HG2 THR 39 HG23 THR 39 74.235 2.603 2.603
263 H LYS 40 HN LYS 40 77.364 5.298 5.298
264 HA LYS 40 HA LYS 40 78.620 3.372 3.372
265 1HB LYS 40 HB2 LYS 40 79.124 5.915 5.915
266 2HB LYS 40 HB1 LYS 40 79.459 6.064 6.064
267 1HG LYS 40 HG2 LYS 40 80.474 3.551 3.551
268 2HG LYS 40 HG1 LYS 40 81.143 4.925 4.925
269 1HD LYS 40 HD2 LYS 40 82.359 5.624 5.624
270 2HD LYS 40 HD1 LYS 40 81.037 5.326 5.326
271 1HE LYS 40 HE2 LYS 40 82.398 3.614 3.614
272 2HE LYS 40 HE1 LYS 40 81.719 2.761 2.761
273 1HZ LYS 40 HZ3 LYS 40 84.042 4.577 4.577
274 2HZ LYS 40 HZ2 LYS 40 84.241 2.931 2.931
275 3HZ LYS 40 HZ1 LYS 40 83.511 3.388 3.388
276 H GLU 41 HN GLU 41 75.951 5.405 5.405
277 HA GLU 41 HA GLU 41 76.388 5.474 5.474
278 1HB GLU 41 HB2 GLU 41 76.113 7.626 7.626
279 2HB GLU 41 HB1 GLU 41 74.520 7.079 7.079
280 1HG GLU 41 HG2 GLU 41 74.012 8.363 8.363
281 2HG GLU 41 HG1 GLU 41 74.071 6.726 6.726
282 H LEU 42 HN LEU 42 74.723 3.820 3.820
283 HA LEU 42 HA LEU 42 72.098 3.475 3.475
284 1HB LEU 42 HB2 LEU 42 73.349 2.613 2.613
285 2HB LEU 42 HB1 LEU 42 73.788 1.233 1.233
286 HG LEU 42 HG LEU 42 70.939 1.976 1.976
287 HD1 LEU 42 HD1 LEU 42 70.578 2.133 2.133
288 HD1 LEU 42 HD1 LEU 42 71.051 0.438 0.438
289 HD1 LEU 42 HD1 LEU 42 72.252 1.708 1.708
290 HD2 LEU 42 HD2 LEU 42 72.494 -0.584 -0.584
291 HD2 LEU 42 HD2 LEU 42 70.742 -0.509 -0.509
292 HD2 LEU 42 HD2 LEU 42 71.799 -0.049 -0.049
293 H GLY 43 HN GLY 43 75.133 2.024 2.024
294 1HA GLY 43 HA2 GLY 43 73.950 0.029 0.029
295 2HA GLY 43 HA1 GLY 43 75.594 0.650 0.650
296 H THR 44 HN THR 44 74.764 3.435 3.435
297 HA THR 44 HA THR 44 74.525 3.591 3.591
298 HB THR 44 HB THR 44 74.060 5.470 5.470
299 HG1 THR 44 HG1 THR 44 76.173 5.078 5.078
300 1HG2 THR 44 HG22 THR 44 73.698 5.999 5.999
301 2HG2 THR 44 HG21 THR 44 74.069 7.286 7.286
302 3HG2 THR 44 HG23 THR 44 72.579 6.358 6.358
303 H VAL 45 HN VAL 45 72.026 4.553 4.553
304 HA VAL 45 HA VAL 45 69.852 4.875 4.875
305 HB VAL 45 HB VAL 45 69.969 3.622 3.622
306 1HG1 VAL 45 HG13 VAL 45 67.788 3.517 3.517
307 2HG1 VAL 45 HG12 VAL 45 67.656 5.220 5.220
308 3HG1 VAL 45 HG11 VAL 45 67.679 3.986 3.986
309 1HG2 VAL 45 HG21 VAL 45 70.245 6.375 6.375
310 2HG2 VAL 45 HG23 VAL 45 70.844 5.686 5.686
311 3HG2 VAL 45 HG22 VAL 45 69.165 6.208 6.208
312 H MET 46 HN MET 46 70.788 1.818 1.818
313 HA MET 46 HA MET 46 68.827 0.116 0.116
314 1HB MET 46 HB2 MET 46 71.702 -0.200 -0.200
315 2HB MET 46 HB1 MET 46 70.786 -1.589 -1.589
316 1HG MET 46 HG2 MET 46 69.429 0.111 0.111
317 2HG MET 46 HG1 MET 46 70.801 -0.835 -0.835
318 1HE MET 46 HE1 MET 46 71.215 -2.858 -2.858
319 2HE MET 46 HE3 MET 46 70.373 -4.212 -4.212
320 3HE MET 46 HE2 MET 46 69.979 -3.746 -3.746
321 H ARG 47 HN ARG 47 71.985 1.042 1.042
322 HA ARG 47 HA ARG 47 71.558 -0.549 -0.549
323 1HB ARG 47 HB2 ARG 47 73.563 1.561 1.561
324 2HB ARG 47 HB1 ARG 47 73.682 0.655 0.655
325 1HG ARG 47 HG2 ARG 47 73.383 -1.424 -1.424
326 2HG ARG 47 HG1 ARG 47 74.054 -0.289 -0.289
327 1HD ARG 47 HD2 ARG 47 75.436 -0.431 -0.431
328 2HD ARG 47 HD1 ARG 47 75.640 -1.817 -1.817
329 HE ARG 47 HE ARG 47 76.189 0.001 0.001
330 1HH1 ARG 47 HH1 ARG 47 76.026 1.468 1.468
331 2HH1 ARG 47 HH1 ARG 47 77.652 2.064 2.064
332 1HH2 ARG 47 HH2 ARG 47 78.617 0.262 0.262
333 2HH2 ARG 47 HH2 ARG 47 79.119 1.382 1.382
334 H MET 48 HN MET 48 71.291 2.875 2.875
335 HA MET 48 HA MET 48 70.811 3.889 3.889
336 1HB MET 48 HB2 MET 48 71.481 5.031 5.031
337 2HB MET 48 HB1 MET 48 69.742 5.091 5.091
338 1HG MET 48 HG2 MET 48 70.423 5.961 5.961
339 2HG MET 48 HG1 MET 48 71.218 6.943 6.943
340 1HE MET 48 HE2 MET 48 69.743 8.633 8.633
341 2HE MET 48 HE1 MET 48 68.006 8.862 8.862
342 3HE MET 48 HE3 MET 48 68.623 7.488 7.488
343 H LEU 49 HN LEU 49 68.912 1.956 1.956
344 HA LEU 49 HA LEU 49 66.332 2.977 2.977
345 1HB LEU 49 HB2 LEU 49 67.313 1.553 1.553
346 2HB LEU 49 HB1 LEU 49 65.870 0.803 0.803
347 HG LEU 49 HG LEU 49 64.615 2.830 2.830
348 HD1 LEU 49 HD1 LEU 49 65.667 4.782 4.782
349 HD1 LEU 49 HD1 LEU 49 66.356 4.680 4.680
350 HD1 LEU 49 HD1 LEU 49 67.242 4.026 4.026
351 HD2 LEU 49 HD2 LEU 49 64.847 3.386 3.386
352 HD2 LEU 49 HD2 LEU 49 64.851 1.647 1.647
353 HD2 LEU 49 HD2 LEU 49 66.365 2.489 2.489
354 H GLY 50 HN GLY 50 68.127 -0.125 -0.125
355 1HA GLY 50 HA2 GLY 50 67.844 -1.015 -1.015
356 2HA GLY 50 HA1 GLY 50 66.320 -1.469 -1.469
357 H GLN 51 HN GLN 51 67.821 -1.797 -1.797
358 HA GLN 51 HA GLN 51 68.484 -4.629 -4.629
359 1HB GLN 51 HB2 GLN 51 68.940 -3.084 -3.084
360 2HB GLN 51 HB1 GLN 51 68.360 -4.737 -4.737
361 1HG GLN 51 HG2 GLN 51 66.279 -3.916 -3.916
362 2HG GLN 51 HG1 GLN 51 66.439 -3.183 -3.183
363 1HE2 GLN 51 HE22 GLN 51 66.893 -0.843 -0.843
364 2HE2 GLN 51 HE21 GLN 51 66.983 -2.532 -2.532
365 H ASN 52 HN ASN 52 70.576 -5.311 -5.311
366 HA ASN 52 HA ASN 52 72.842 -3.444 -3.444
367 1HB ASN 52 HB2 ASN 52 72.098 -5.033 -5.033
368 2HB ASN 52 HB1 ASN 52 73.221 -6.107 -6.107
369 HD2 ASN 52 HD2 ASN 52 72.962 -2.997 -2.997
370 HD2 ASN 52 HD2 ASN 52 74.633 -2.754 -2.754
371 HA PRO 53 HA PRO 53 73.234 -6.271 -6.271
372 1HB PRO 53 HB2 PRO 53 74.172 -4.349 -4.349
373 2HB PRO 53 HB1 PRO 53 72.442 -4.632 -4.632
374 1HG PRO 53 HG2 PRO 53 74.218 -2.525 -2.525
375 2HG PRO 53 HG1 PRO 53 72.533 -2.417 -2.417
376 1HD PRO 53 HD2 PRO 53 73.287 -2.587 -2.587
377 2HD PRO 53 HD1 PRO 53 71.720 -3.157 -3.157
378 H THR 54 HN THR 54 75.115 -7.451 -7.451
379 HA THR 54 HA THR 54 77.543 -6.644 -6.644
380 HB THR 54 HB THR 54 78.402 -8.679 -8.679
381 HG1 THR 54 HG1 THR 54 77.200 -9.296 -9.296
382 1HG2 THR 54 HG21 THR 54 76.565 -8.450 -8.450
383 2HG2 THR 54 HG23 THR 54 76.046 -9.818 -9.818
384 3HG2 THR 54 HG22 THR 54 77.684 -9.771 -9.771
385 H LYS 55 HN LYS 55 79.397 -5.677 -5.677
386 HA LYS 55 HA LYS 55 79.396 -3.889 -3.889
387 1HB LYS 55 HB2 LYS 55 81.152 -4.419 -4.419
388 2HB LYS 55 HB1 LYS 55 81.762 -5.643 -5.643
389 1HG LYS 55 HG2 LYS 55 81.641 -3.590 -3.590
390 2HG LYS 55 HG1 LYS 55 81.842 -2.669 -2.669
391 1HD LYS 55 HD2 LYS 55 83.630 -4.993 -4.993
392 2HD LYS 55 HD1 LYS 55 83.902 -3.799 -3.799
393 1HE LYS 55 HE2 LYS 55 85.171 -2.748 -2.748
394 2HE LYS 55 HE1 LYS 55 83.606 -2.196 -2.196
395 1HZ LYS 55 HZ2 LYS 55 83.582 -4.541 -4.541
396 2HZ LYS 55 HZ1 LYS 55 85.268 -4.453 -4.453
397 3HZ LYS 55 HZ3 LYS 55 84.461 -3.287 -3.287
398 H GLU 56 HN GLU 56 79.834 -7.389 -7.389
399 HA GLU 56 HA GLU 56 80.746 -7.478 -7.478
400 1HB GLU 56 HB2 GLU 56 80.152 -9.233 -9.233
401 2HB GLU 56 HB1 GLU 56 79.395 -9.867 -9.867
402 1HG GLU 56 HG2 GLU 56 81.763 -9.241 -9.241
403 2HG GLU 56 HG1 GLU 56 82.292 -9.455 -9.455
404 H GLU 57 HN GLU 57 77.619 -7.176 -7.176
405 HA GLU 57 HA GLU 57 76.094 -8.055 -8.055
406 1HB GLU 57 HB2 GLU 57 75.587 -6.962 -6.962
407 2HB GLU 57 HB1 GLU 57 74.282 -6.872 -6.872
408 1HG GLU 57 HG2 GLU 57 75.792 -9.439 -9.439
409 2HG GLU 57 HG1 GLU 57 74.375 -8.990 -8.990
410 H LEU 58 HN LEU 58 77.006 -4.964 -4.964
411 HA LEU 58 HA LEU 58 75.446 -3.260 -3.260
412 1HB LEU 58 HB2 LEU 58 78.092 -2.726 -2.726
413 2HB LEU 58 HB1 LEU 58 76.884 -1.524 -1.524
414 HG LEU 58 HG LEU 58 76.627 -3.699 -3.699
415 HD1 LEU 58 HD1 LEU 58 77.696 -1.347 -1.347
416 HD1 LEU 58 HD1 LEU 58 76.491 -1.943 -1.943
417 HD1 LEU 58 HD1 LEU 58 76.034 -0.766 -0.766
418 HD2 LEU 58 HD2 LEU 58 74.548 -2.061 -2.061
419 HD2 LEU 58 HD2 LEU 58 74.288 -2.532 -2.532
420 HD2 LEU 58 HD2 LEU 58 74.503 -3.768 -3.768
421 H ASP 59 HN ASP 59 78.880 -4.267 -4.267
422 HA ASP 59 HA ASP 59 79.558 -2.872 -2.872
423 1HB ASP 59 HB2 ASP 59 80.630 -4.856 -4.856
424 2HB ASP 59 HB1 ASP 59 80.976 -5.328 -5.328
425 H ALA 60 HN ALA 60 77.862 -5.914 -5.914
426 HA ALA 60 HA ALA 60 78.006 -6.690 -6.690
427 1HB ALA 60 HB3 ALA 60 78.027 -8.211 -8.211
428 2HB ALA 60 HB2 ALA 60 76.308 -7.849 -7.849
429 3HB ALA 60 HB1 ALA 60 76.910 -8.670 -8.670
430 H ILE 61 HN ILE 61 75.557 -5.494 -5.494
431 HA ILE 61 HA ILE 61 73.384 -5.494 -5.494
432 HB ILE 61 HB ILE 61 73.891 -4.204 -4.204
433 1HG1 ILE 61 HG12 ILE 61 71.877 -6.344 -6.344
434 2HG1 ILE 61 HG11 ILE 61 73.571 -6.773 -6.773
435 1HG2 ILE 61 HG23 ILE 61 71.472 -4.100 -4.100
436 2HG2 ILE 61 HG22 ILE 61 71.328 -3.917 -3.917
437 3HG2 ILE 61 HG21 ILE 61 72.285 -2.765 -2.765
438 HD1 ILE 61 HD1 ILE 61 72.369 -4.961 -4.961
439 HD1 ILE 61 HD1 ILE 61 73.510 -6.288 -6.288
440 HD1 ILE 61 HD1 ILE 61 71.791 -6.627 -6.627
441 H ILE 62 HN ILE 62 75.667 -3.033 -3.033
442 HA ILE 62 HA ILE 62 74.538 -0.738 -0.738
443 HB ILE 62 HB ILE 62 77.346 -1.615 -1.615
444 1HG1 ILE 62 HG12 ILE 62 75.461 0.434 0.434
445 2HG1 ILE 62 HG11 ILE 62 75.716 -1.196 -1.196
446 1HG2 ILE 62 HG23 ILE 62 76.420 0.773 0.773
447 2HG2 ILE 62 HG22 ILE 62 77.541 1.087 1.087
448 3HG2 ILE 62 HG21 ILE 62 78.004 0.000 0.000
449 HD1 ILE 62 HD1 ILE 62 77.222 -0.003 -0.003
450 HD1 ILE 62 HD1 ILE 62 77.579 1.152 1.152
451 HD1 ILE 62 HD1 ILE 62 78.260 -0.474 -0.474
452 H GLU 63 HN GLU 63 77.366 -2.559 -2.559
453 HA GLU 63 HA GLU 63 77.527 -1.483 -1.483
454 1HB GLU 63 HB2 GLU 63 78.837 -3.363 -3.363
455 2HB GLU 63 HB1 GLU 63 77.751 -4.451 -4.451
456 1HG GLU 63 HG2 GLU 63 78.612 -2.650 -2.650
457 2HG GLU 63 HG1 GLU 63 80.058 -2.979 -2.979
458 H GLU 64 HN GLU 64 75.355 -4.078 -4.078
459 HA GLU 64 HA GLU 64 74.178 -4.701 -4.701
460 1HB GLU 64 HB2 GLU 64 73.834 -6.239 -6.239
461 2HB GLU 64 HB1 GLU 64 73.458 -4.975 -4.975
462 1HG GLU 64 HG2 GLU 64 71.260 -4.818 -4.818
463 2HG GLU 64 HG1 GLU 64 71.628 -5.238 -5.238
464 H VAL 65 HN VAL 65 72.997 -2.587 -2.587
465 HA VAL 65 HA VAL 65 70.825 -1.525 -1.525
466 HB VAL 65 HB VAL 65 70.328 -0.280 -0.280
467 1HG1 VAL 65 HG13 VAL 65 71.480 -3.015 -3.015
468 2HG1 VAL 65 HG12 VAL 65 70.440 -2.108 -2.108
469 3HG1 VAL 65 HG11 VAL 65 69.818 -2.650 -2.650
470 1HG2 VAL 65 HG22 VAL 65 73.135 -1.047 -1.047
471 2HG2 VAL 65 HG21 VAL 65 72.585 0.575 0.575
472 3HG2 VAL 65 HG23 VAL 65 71.954 -0.226 -0.226
473 H ASP 66 HN ASP 66 74.148 -0.879 -0.879
474 HA ASP 66 HA ASP 66 74.023 2.017 2.017
475 1HB ASP 66 HB2 ASP 66 75.849 0.759 0.759
476 2HB ASP 66 HB1 ASP 66 76.286 0.030 0.030
477 H GLU 67 HN GLU 67 73.287 -0.578 -0.578
478 HA GLU 67 HA GLU 67 74.629 0.168 0.168
479 1HB GLU 67 HB2 GLU 67 73.153 -1.963 -1.963
480 2HB GLU 67 HB1 GLU 67 72.109 -1.298 -1.298
481 1HG GLU 67 HG2 GLU 67 73.733 -1.620 -1.620
482 2HG GLU 67 HG1 GLU 67 75.038 -1.802 -1.802
483 H ASP 68 HN ASP 68 72.288 1.762 1.762
484 HA ASP 68 HA ASP 68 70.345 2.484 2.484
485 1HB ASP 68 HB2 ASP 68 70.038 4.438 4.438
486 2HB ASP 68 HB1 ASP 68 69.953 2.839 2.839
487 H GLY 69 HN GLY 69 73.571 3.711 3.711
488 1HA GLY 69 HA2 GLY 69 74.909 4.863 4.863
489 2HA GLY 69 HA1 GLY 69 73.422 5.373 5.373
490 H SER 70 HN SER 70 73.204 5.697 5.697
491 HA SER 70 HA SER 70 73.811 8.629 8.629
492 1HB SER 70 HB2 SER 70 71.414 7.852 7.852
493 2HB SER 70 HB1 SER 70 71.877 7.210 7.210
494 HG SER 70 HG SER 70 71.888 9.892 9.892
495 H GLY 71 HN GLY 71 74.145 5.712 5.712
496 1HA GLY 71 HA2 GLY 71 76.030 5.317 5.317
497 2HA GLY 71 HA1 GLY 71 76.315 7.057 7.057
498 H THR 72 HN THR 72 73.032 6.467 6.467
499 HA THR 72 HA THR 72 73.267 6.426 6.426
500 HB THR 72 HB THR 72 71.336 8.062 8.062
501 HG1 THR 72 HG1 THR 72 70.928 9.012 9.012
502 1HG2 THR 72 HG23 THR 72 73.894 8.605 8.605
503 2HG2 THR 72 HG22 THR 72 73.650 9.179 9.179
504 3HG2 THR 72 HG21 THR 72 72.749 9.908 9.908
505 H ILE 73 HN ILE 73 71.030 5.881 5.881
506 HA ILE 73 HA ILE 73 69.804 3.664 3.664
507 HB ILE 73 HB ILE 73 70.992 3.243 3.243
508 1HG1 ILE 73 HG12 ILE 73 68.795 2.078 2.078
509 2HG1 ILE 73 HG11 ILE 73 68.150 2.528 2.528
510 1HG2 ILE 73 HG22 ILE 73 69.679 5.483 5.483
511 2HG2 ILE 73 HG21 ILE 73 68.629 4.223 4.223
512 3HG2 ILE 73 HG23 ILE 73 70.335 4.265 4.265
513 HD1 ILE 73 HD1 ILE 73 70.727 1.473 1.473
514 HD1 ILE 73 HD1 ILE 73 69.177 0.728 0.728
515 HD1 ILE 73 HD1 ILE 73 69.956 0.377 0.377
516 H ASP 74 HN ASP 74 67.543 3.625 3.625
517 HA ASP 74 HA ASP 74 66.139 6.183 6.183
518 1HB ASP 74 HB2 ASP 74 65.706 3.635 3.635
519 2HB ASP 74 HB1 ASP 74 64.337 4.710 4.710
520 H PHE 75 HN PHE 75 64.817 6.487 6.487
521 HA PHE 75 HA PHE 75 64.497 4.845 4.845
522 1HB PHE 75 HB2 PHE 75 63.688 7.244 7.244
523 2HB PHE 75 HB1 PHE 75 62.231 6.489 6.489
524 HD1 PHE 75 HD2 PHE 75 60.919 4.890 4.890
525 HD2 PHE 75 HD1 PHE 75 63.984 7.510 7.510
526 HE1 PHE 75 HE2 PHE 75 60.028 4.633 4.633
527 HE2 PHE 75 HE1 PHE 75 63.093 7.253 7.253
528 HZ PHE 75 HZ PHE 75 61.114 5.815 5.815
529 H GLU 76 HN GLU 76 62.227 4.958 4.958
530 HA GLU 76 HA GLU 76 60.451 2.932 2.932
531 1HB GLU 76 HB2 GLU 76 60.134 2.664 2.664
532 2HB GLU 76 HB1 GLU 76 60.053 4.330 4.330
533 1HG GLU 76 HG2 GLU 76 62.705 4.161 4.161
534 2HG GLU 76 HG1 GLU 76 62.115 3.005 3.005
535 H GLU 77 HN GLU 77 63.492 2.581 2.581
536 HA GLU 77 HA GLU 77 63.316 -0.335 -0.335
537 1HB GLU 77 HB2 GLU 77 64.411 0.897 0.897
538 2HB GLU 77 HB1 GLU 77 65.484 1.693 1.693
539 1HG GLU 77 HG2 GLU 77 66.688 -0.290 -0.290
540 2HG GLU 77 HG1 GLU 77 65.415 -1.313 -1.313
541 H PHE 78 HN PHE 78 65.010 2.112 2.112
542 HA PHE 78 HA PHE 78 66.742 0.360 0.360
543 1HB PHE 78 HB2 PHE 78 67.117 2.708 2.708
544 2HB PHE 78 HB1 PHE 78 65.445 3.041 3.041
545 HD1 PHE 78 HD1 PHE 78 68.279 0.912 0.912
546 HD2 PHE 78 HD2 PHE 78 65.119 3.664 3.664
547 HE1 PHE 78 HE1 PHE 78 68.908 0.806 0.806
548 HE2 PHE 78 HE2 PHE 78 65.750 3.558 3.558
549 HZ PHE 78 HZ PHE 78 67.644 2.128 2.128
550 H LEU 79 HN LEU 79 63.353 1.299 1.299
551 HA LEU 79 HA LEU 79 62.787 0.466 0.466
552 1HB LEU 79 HB2 LEU 79 61.416 0.488 0.488
553 2HB LEU 79 HB1 LEU 79 60.684 -0.566 -0.566
554 HG LEU 79 HG LEU 79 61.488 2.190 2.190
555 HD1 LEU 79 HD1 LEU 79 58.734 2.045 2.045
556 HD1 LEU 79 HD1 LEU 79 59.905 1.833 1.833
557 HD1 LEU 79 HD1 LEU 79 59.959 3.280 3.280
558 HD2 LEU 79 HD2 LEU 79 60.228 1.636 1.636
559 HD2 LEU 79 HD2 LEU 79 60.120 0.008 0.008
560 HD2 LEU 79 HD2 LEU 79 58.864 1.194 1.194
561 H VAL 80 HN VAL 80 63.371 -1.593 -1.593
562 HA VAL 80 HA VAL 80 62.696 -4.112 -4.112
563 HB VAL 80 HB VAL 80 64.871 -3.456 -3.456
564 1HG1 VAL 80 HG12 VAL 80 63.514 -5.914 -5.914
565 2HG1 VAL 80 HG11 VAL 80 63.626 -5.742 -5.742
566 3HG1 VAL 80 HG13 VAL 80 65.089 -5.719 -5.719
567 1HG2 VAL 80 HG22 VAL 80 62.231 -2.670 -2.670
568 2HG2 VAL 80 HG21 VAL 80 63.286 -2.947 -2.947
569 3HG2 VAL 80 HG23 VAL 80 62.209 -4.228 -4.228
570 H MET 81 HN MET 81 65.889 -2.502 -2.502
571 HA MET 81 HA MET 81 67.434 -4.390 -4.390
572 1HB MET 81 HB2 MET 81 67.519 -1.475 -1.475
573 2HB MET 81 HB1 MET 81 68.631 -2.051 -2.051
574 1HG MET 81 HG2 MET 81 69.600 -2.121 -2.121
575 2HG MET 81 HG1 MET 81 69.568 -3.694 -3.694
576 1HE MET 81 HE2 MET 81 68.417 -5.662 -5.662
577 2HE MET 81 HE1 MET 81 68.024 -5.881 -5.881
578 3HE MET 81 HE3 MET 81 69.622 -5.289 -5.289
579 H MET 82 HN MET 82 65.248 -1.882 -1.882
580 HA MET 82 HA MET 82 66.073 -1.862 -1.862
581 1HB MET 82 HB2 MET 82 63.327 -1.394 -1.394
582 2HB MET 82 HB1 MET 82 63.931 -0.739 -0.739
583 1HG MET 82 HG2 MET 82 65.782 0.370 0.370
584 2HG MET 82 HG1 MET 82 64.871 -0.077 -0.077
585 1HE MET 82 HE3 MET 82 65.580 1.884 1.884
586 2HE MET 82 HE2 MET 82 64.617 3.353 3.353
587 3HE MET 82 HE1 MET 82 64.031 2.008 2.008
588 H VAL 83 HN VAL 83 63.335 -3.557 -3.557
589 HA VAL 83 HA VAL 83 62.774 -5.167 -5.167
590 HB VAL 83 HB VAL 83 61.022 -6.050 -6.050
591 1HG1 VAL 83 HG13 VAL 83 61.029 -3.525 -3.525
592 2HG1 VAL 83 HG12 VAL 83 61.465 -3.299 -3.299
593 3HG1 VAL 83 HG11 VAL 83 59.940 -4.076 -4.076
594 1HG2 VAL 83 HG23 VAL 83 62.626 -5.017 -5.017
595 2HG2 VAL 83 HG22 VAL 83 62.425 -6.710 -6.710
596 3HG2 VAL 83 HG21 VAL 83 61.036 -5.773 -5.773
597 H ARG 84 HN ARG 84 64.366 -5.706 -5.706
598 HA ARG 84 HA ARG 84 64.788 -8.465 -8.465
599 1HB ARG 84 HB2 ARG 84 66.578 -6.159 -6.159
600 2HB ARG 84 HB1 ARG 84 66.915 -7.840 -7.840
601 1HG ARG 84 HG2 ARG 84 64.165 -6.890 -6.890
602 2HG ARG 84 HG1 ARG 84 65.449 -6.189 -6.189
603 1HD ARG 84 HD2 ARG 84 66.122 -8.305 -8.305
604 2HD ARG 84 HD1 ARG 84 65.254 -9.177 -9.177
605 HE ARG 84 HE ARG 84 63.967 -7.777 -7.777
606 1HH1 ARG 84 HH2 ARG 84 64.044 -10.652 -10.652
607 2HH1 ARG 84 HH2 ARG 84 62.338 -10.787 -10.787
608 1HH2 ARG 84 HH1 ARG 84 61.657 -7.538 -7.538
609 2HH2 ARG 84 HH1 ARG 84 60.986 -9.024 -9.024
610 H GLN 85 HN GLN 85 66.768 -5.956 -5.956
611 HA GLN 85 HA GLN 85 68.617 -7.835 -7.835
612 1HB GLN 85 HB2 GLN 85 68.845 -5.312 -5.312
613 2HB GLN 85 HB1 GLN 85 67.899 -5.068 -5.068
614 1HG GLN 85 HG2 GLN 85 70.386 -5.009 -5.009
615 2HG GLN 85 HG1 GLN 85 69.548 -6.235 -6.235
616 1HE2 GLN 85 HE22 GLN 85 71.218 -7.908 -7.908
617 2HE2 GLN 85 HE21 GLN 85 70.077 -6.660 -6.660
618 H MET 86 HN MET 86 66.177 -5.748 -5.748
619 HA MET 86 HA MET 86 66.158 -7.075 -7.075
620 1HB MET 86 HB2 MET 86 64.697 -5.065 -5.065
621 2HB MET 86 HB1 MET 86 63.537 -6.137 -6.137
622 1HG MET 86 HG2 MET 86 64.548 -5.790 -5.790
623 2HG MET 86 HG1 MET 86 65.927 -4.959 -4.959
624 1HE MET 86 HE3 MET 86 63.303 -4.881 -4.881
625 2HE MET 86 HE2 MET 86 63.850 -3.281 -3.281
626 3HE MET 86 HE1 MET 86 62.253 -3.475 -3.475
627 H LYS 87 HN LYS 87 64.680 -7.988 -7.988
628 HA LYS 87 HA LYS 87 62.611 -9.709 -9.709
629 1HB LYS 87 HB2 LYS 87 64.585 -9.482 -9.482
630 2HB LYS 87 HB1 LYS 87 63.839 -11.072 -11.072
631 1HG LYS 87 HG2 LYS 87 61.784 -9.120 -9.120
632 2HG LYS 87 HG1 LYS 87 62.706 -8.698 -8.698
633 1HD LYS 87 HD2 LYS 87 62.458 -11.459 -11.459
634 2HD LYS 87 HD1 LYS 87 60.892 -10.947 -10.947
635 1HE LYS 87 HE2 LYS 87 61.962 -9.272 -9.272
636 2HE LYS 87 HE1 LYS 87 61.490 -10.922 -10.922
637 1HZ LYS 87 HZ2 LYS 87 59.399 -10.577 -10.577
638 2HZ LYS 87 HZ1 LYS 87 59.838 -8.960 -8.960
639 3HZ LYS 87 HZ3 LYS 87 59.562 -9.500 -9.500
640 H GLU 88 HN GLU 88 66.045 -10.037 -10.037
641 HA GLU 88 HA GLU 88 65.798 -12.886 -12.886
642 1HB GLU 88 HB2 GLU 88 68.186 -11.015 -11.015
643 2HB GLU 88 HB1 GLU 88 68.245 -12.771 -12.771
644 1HG GLU 88 HG2 GLU 88 66.645 -11.767 -11.767
645 2HG GLU 88 HG1 GLU 88 68.382 -11.473 -11.473
646 H ASP 89 HN ASP 89 66.624 -9.677 -9.677
647 HA ASP 89 HA ASP 89 67.143 -10.673 -10.673
648 1HB ASP 89 HB2 ASP 89 68.131 -8.621 -8.621
649 2HB ASP 89 HB1 ASP 89 66.524 -7.892 -7.892
650 H ALA 90 HN ALA 90 64.359 -9.387 -9.387
651 HA ALA 90 HA ALA 90 62.707 -9.128 -9.128
652 1HB ALA 90 HB1 ALA 90 62.295 -8.864 -8.864
653 2HB ALA 90 HB3 ALA 90 60.962 -8.694 -8.694
654 3HB ALA 90 HB2 ALA 90 62.327 -7.580 -7.580
Start of MODEL 31
1 1H ALA 1 HT2 ALA 1 64.412 -5.270 -5.270
2 2H ALA 1 HT1 ALA 1 65.148 -3.959 -3.959
3 3H ALA 1 HT3 ALA 1 65.990 -4.797 -4.797
4 HA ALA 1 HA ALA 1 66.454 -6.592 -6.592
5 1HB ALA 1 HB2 ALA 1 66.620 -3.914 -3.914
6 2HB ALA 1 HB1 ALA 1 66.465 -5.091 -5.091
7 3HB ALA 1 HB3 ALA 1 67.781 -5.234 -5.234
8 H SER 2 HN SER 2 65.963 -7.695 -7.695
9 HA SER 2 HA SER 2 63.055 -8.136 -8.136
10 1HB SER 2 HB2 SER 2 65.025 -9.838 -9.838
11 2HB SER 2 HB1 SER 2 65.210 -9.349 -9.349
12 HG SER 2 HG SER 2 63.804 -11.064 -11.064
13 H MET 3 HN MET 3 65.313 -6.092 -6.092
14 HA MET 3 HA MET 3 64.435 -6.057 -6.057
15 1HB MET 3 HB2 MET 3 65.876 -4.290 -4.290
16 2HB MET 3 HB1 MET 3 65.279 -3.536 -3.536
17 1HG MET 3 HG2 MET 3 67.628 -4.468 -4.468
18 2HG MET 3 HG1 MET 3 66.505 -5.084 -5.084
19 1HE MET 3 HE3 MET 3 69.023 -5.594 -5.594
20 2HE MET 3 HE2 MET 3 68.998 -7.251 -7.251
21 3HE MET 3 HE1 MET 3 67.991 -6.029 -6.029
22 H THR 4 HN THR 4 63.324 -4.233 -4.233
23 HA THR 4 HA THR 4 61.535 -2.423 -2.423
24 HB THR 4 HB THR 4 62.026 -2.589 -2.589
25 HG1 THR 4 HG1 THR 4 59.300 -3.254 -3.254
26 1HG2 THR 4 HG21 THR 4 62.022 -5.195 -5.195
27 2HG2 THR 4 HG23 THR 4 60.303 -5.046 -5.046
28 3HG2 THR 4 HG22 THR 4 61.507 -4.446 -4.446
29 H ASP 5 HN ASP 5 61.251 -5.911 -5.911
30 HA ASP 5 HA ASP 5 58.390 -5.876 -5.876
31 1HB ASP 5 HB2 ASP 5 60.434 -7.774 -7.774
32 2HB ASP 5 HB1 ASP 5 59.252 -8.472 -8.472
33 H GLN 6 HN GLN 6 61.539 -6.196 -6.196
34 HA GLN 6 HA GLN 6 60.583 -7.453 -7.453
35 1HB GLN 6 HB2 GLN 6 63.002 -6.990 -6.990
36 2HB GLN 6 HB1 GLN 6 63.087 -5.942 -5.942
37 1HG GLN 6 HG2 GLN 6 63.963 -8.243 -8.243
38 2HG GLN 6 HG1 GLN 6 62.599 -7.816 -7.816
39 1HE2 GLN 6 HE22 GLN 6 60.503 -10.353 -10.353
40 2HE2 GLN 6 HE21 GLN 6 60.672 -9.059 -9.059
41 H GLN 7 HN GLN 7 60.499 -4.269 -4.269
42 HA GLN 7 HA GLN 7 60.665 -2.851 -2.851
43 1HB GLN 7 HB2 GLN 7 60.312 -2.296 -2.296
44 2HB GLN 7 HB1 GLN 7 59.501 -1.153 -1.153
45 1HG GLN 7 HG2 GLN 7 61.563 -0.151 -0.151
46 2HG GLN 7 HG1 GLN 7 61.878 -1.341 -1.341
47 1HE2 GLN 7 HE22 GLN 7 64.531 -2.666 -2.666
48 2HE2 GLN 7 HE21 GLN 7 63.942 -2.173 -2.173
49 H ALA 8 HN ALA 8 58.155 -4.346 -4.346
50 HA ALA 8 HA ALA 8 55.855 -2.976 -2.976
51 1HB ALA 8 HB1 ALA 8 56.581 -5.492 -5.492
52 2HB ALA 8 HB3 ALA 8 55.114 -5.626 -5.626
53 3HB ALA 8 HB2 ALA 8 55.218 -4.417 -4.417
54 H GLU 9 HN GLU 9 57.093 -6.144 -6.144
55 HA GLU 9 HA GLU 9 55.488 -6.013 -6.013
56 1HB GLU 9 HB2 GLU 9 57.570 -7.820 -7.820
57 2HB GLU 9 HB1 GLU 9 57.049 -8.074 -8.074
58 1HG GLU 9 HG2 GLU 9 55.213 -9.133 -9.133
59 2HG GLU 9 HG1 GLU 9 54.708 -7.654 -7.654
60 H ALA 10 HN ALA 10 58.788 -5.199 -5.199
61 HA ALA 10 HA ALA 10 60.106 -5.183 -5.183
62 1HB ALA 10 HB2 ALA 10 60.214 -3.494 -3.494
63 2HB ALA 10 HB1 ALA 10 61.289 -3.147 -3.147
64 3HB ALA 10 HB3 ALA 10 61.359 -4.717 -4.717
65 H ARG 11 HN ARG 11 57.959 -2.707 -2.707
66 HA ARG 11 HA ARG 11 58.178 -1.069 -1.069
67 1HB ARG 11 HB2 ARG 11 57.022 0.593 0.593
68 2HB ARG 11 HB1 ARG 11 58.330 -0.115 -0.115
69 1HG ARG 11 HG2 ARG 11 56.374 -1.836 -1.836
70 2HG ARG 11 HG1 ARG 11 55.382 -0.418 -0.418
71 1HD ARG 11 HD2 ARG 11 57.792 -0.366 -0.366
72 2HD ARG 11 HD1 ARG 11 56.118 -0.558 -0.558
73 HE ARG 11 HE ARG 11 56.785 1.757 1.757
74 1HH1 ARG 11 HH1 ARG 11 54.265 2.299 2.299
75 2HH1 ARG 11 HH1 ARG 11 54.361 2.974 2.974
76 1HH2 ARG 11 HH2 ARG 11 57.578 1.819 1.819
77 2HH2 ARG 11 HH2 ARG 11 56.237 2.701 2.701
78 H ALA 12 HN ALA 12 55.927 -3.157 -3.157
79 HA ALA 12 HA ALA 12 53.585 -2.383 -2.383
80 1HB ALA 12 HB3 ALA 12 53.895 -3.461 -3.461
81 2HB ALA 12 HB2 ALA 12 53.913 -4.976 -4.976
82 3HB ALA 12 HB1 ALA 12 52.505 -3.917 -3.917
83 H PHE 13 HN PHE 13 56.327 -4.275 -4.275
84 HA PHE 13 HA PHE 13 55.266 -6.455 -6.455
85 1HB PHE 13 HB2 PHE 13 57.577 -6.422 -6.422
86 2HB PHE 13 HB1 PHE 13 57.796 -4.805 -4.805
87 HD1 PHE 13 HD1 PHE 13 56.630 -8.206 -8.206
88 HD2 PHE 13 HD2 PHE 13 58.759 -4.618 -4.618
89 HE1 PHE 13 HE1 PHE 13 57.235 -9.190 -9.190
90 HE2 PHE 13 HE2 PHE 13 59.365 -5.602 -5.602
91 HZ PHE 13 HZ PHE 13 58.602 -7.888 -7.888
92 H LEU 14 HN LEU 14 55.907 -3.084 -3.084
93 HA LEU 14 HA LEU 14 54.524 -3.635 -3.635
94 1HB LEU 14 HB2 LEU 14 55.999 -1.573 -1.573
95 2HB LEU 14 HB1 LEU 14 56.753 -3.161 -3.161
96 HG LEU 14 HG LEU 14 57.480 -2.616 -2.616
97 HD1 LEU 14 HD1 LEU 14 57.331 0.088 0.088
98 HD1 LEU 14 HD1 LEU 14 55.803 -0.240 -0.240
99 HD1 LEU 14 HD1 LEU 14 56.165 -1.023 -1.023
100 HD2 LEU 14 HD2 LEU 14 58.726 -1.961 -1.961
101 HD2 LEU 14 HD2 LEU 14 58.384 -0.317 -0.317
102 HD2 LEU 14 HD2 LEU 14 59.340 -1.397 -1.397
103 H SER 15 HN SER 15 53.047 -2.009 -2.009
104 HA SER 15 HA SER 15 51.572 -0.635 -0.635
105 1HB SER 15 HB2 SER 15 50.525 0.433 0.433
106 2HB SER 15 HB1 SER 15 50.557 -1.327 -1.327
107 HG SER 15 HG SER 15 51.398 -0.819 -0.819
108 H GLU 16 HN GLU 16 51.213 1.799 1.799
109 HA GLU 16 HA GLU 16 53.543 3.258 3.258
110 1HB GLU 16 HB2 GLU 16 51.267 3.892 3.892
111 2HB GLU 16 HB1 GLU 16 50.841 4.149 4.149
112 1HG GLU 16 HG2 GLU 16 52.238 6.052 6.052
113 2HG GLU 16 HG1 GLU 16 53.120 5.648 5.648
114 H GLU 17 HN GLU 17 51.905 2.841 2.841
115 HA GLU 17 HA GLU 17 53.009 4.819 4.819
116 1HB GLU 17 HB2 GLU 17 51.469 3.117 3.117
117 2HB GLU 17 HB1 GLU 17 52.666 1.851 1.851
118 1HG GLU 17 HG2 GLU 17 53.741 3.986 3.986
119 2HG GLU 17 HG1 GLU 17 52.287 3.286 3.286
120 H MET 18 HN MET 18 54.587 1.682 1.682
121 HA MET 18 HA MET 18 57.073 2.351 2.351
122 1HB MET 18 HB2 MET 18 56.055 0.077 0.077
123 2HB MET 18 HB1 MET 18 56.652 0.400 0.400
124 1HG MET 18 HG2 MET 18 58.552 -0.603 -0.603
125 2HG MET 18 HG1 MET 18 58.871 0.974 0.974
126 1HE MET 18 HE3 MET 18 58.680 1.705 1.705
127 2HE MET 18 HE2 MET 18 57.361 1.221 1.221
128 3HE MET 18 HE1 MET 18 59.016 0.763 0.763
129 H ILE 19 HN ILE 19 56.081 2.346 2.346
130 HA ILE 19 HA ILE 19 58.424 3.085 3.085
131 HB ILE 19 HB ILE 19 55.555 3.986 3.986
132 1HG1 ILE 19 HG12 ILE 19 57.336 2.017 2.017
133 2HG1 ILE 19 HG11 ILE 19 56.016 1.607 1.607
134 1HG2 ILE 19 HG21 ILE 19 57.107 5.682 5.682
135 2HG2 ILE 19 HG23 ILE 19 57.848 4.406 4.406
136 3HG2 ILE 19 HG22 ILE 19 56.160 4.844 4.844
137 HD1 ILE 19 HD1 ILE 19 54.910 1.461 1.461
138 HD1 ILE 19 HD1 ILE 19 55.897 2.718 2.718
139 HD1 ILE 19 HD1 ILE 19 54.619 3.156 3.156
140 H ALA 20 HN ALA 20 56.269 5.201 5.201
141 HA ALA 20 HA ALA 20 57.747 7.638 7.638
142 1HB ALA 20 HB1 ALA 20 55.282 7.025 7.025
143 2HB ALA 20 HB3 ALA 20 56.091 7.341 7.341
144 3HB ALA 20 HB2 ALA 20 56.038 8.591 8.591
145 H GLU 21 HN GLU 21 57.973 5.084 5.084
146 HA GLU 21 HA GLU 21 59.520 6.489 6.489
147 1HB GLU 21 HB2 GLU 21 58.401 4.417 4.417
148 2HB GLU 21 HB1 GLU 21 59.230 3.583 3.583
149 1HG GLU 21 HG2 GLU 21 60.207 3.096 3.096
150 2HG GLU 21 HG1 GLU 21 61.366 3.800 3.800
151 H PHE 22 HN PHE 22 60.516 4.330 4.330
152 HA PHE 22 HA PHE 22 63.355 4.776 4.776
153 1HB PHE 22 HB2 PHE 22 61.881 3.746 3.746
154 2HB PHE 22 HB1 PHE 22 63.564 3.435 3.435
155 HD1 PHE 22 HD2 PHE 22 62.504 3.358 3.358
156 HD2 PHE 22 HD1 PHE 22 61.698 1.195 1.195
157 HE1 PHE 22 HE2 PHE 22 61.805 1.386 1.386
158 HE2 PHE 22 HE1 PHE 22 61.000 -0.776 -0.776
159 HZ PHE 22 HZ PHE 22 61.053 -0.681 -0.681
160 H LYS 23 HN LYS 23 60.866 6.258 6.258
161 HA LYS 23 HA LYS 23 62.366 7.624 7.624
162 1HB LYS 23 HB2 LYS 23 59.842 7.543 7.543
163 2HB LYS 23 HB1 LYS 23 60.110 8.840 8.840
164 1HG LYS 23 HG2 LYS 23 59.550 9.952 9.952
165 2HG LYS 23 HG1 LYS 23 61.305 10.083 10.083
166 1HD LYS 23 HD2 LYS 23 61.502 9.051 9.051
167 2HD LYS 23 HD1 LYS 23 60.735 7.618 7.618
168 1HE LYS 23 HE2 LYS 23 59.178 9.990 9.990
169 2HE LYS 23 HE1 LYS 23 59.517 8.514 8.514
170 1HZ LYS 23 HZ2 LYS 23 58.394 8.347 8.347
171 2HZ LYS 23 HZ1 LYS 23 57.368 8.617 8.617
172 3HZ LYS 23 HZ3 LYS 23 58.311 7.210 7.210
173 H ALA 24 HN ALA 24 61.294 9.230 9.230
174 HA ALA 24 HA ALA 24 62.941 11.460 11.460
175 1HB ALA 24 HB2 ALA 24 61.159 10.656 10.656
176 2HB ALA 24 HB1 ALA 24 62.474 9.794 9.794
177 3HB ALA 24 HB3 ALA 24 62.524 11.552 11.552
178 H ALA 25 HN ALA 25 63.874 8.137 8.137
179 HA ALA 25 HA ALA 25 66.518 8.822 8.822
180 1HB ALA 25 HB3 ALA 25 64.867 6.419 6.419
181 2HB ALA 25 HB2 ALA 25 66.615 6.186 6.186
182 3HB ALA 25 HB1 ALA 25 65.802 6.804 6.804
183 H PHE 26 HN PHE 26 65.328 7.226 7.226
184 HA PHE 26 HA PHE 26 67.852 7.102 7.102
185 1HB PHE 26 HB2 PHE 26 65.991 5.777 5.777
186 2HB PHE 26 HB1 PHE 26 64.968 7.203 7.203
187 HD1 PHE 26 HD2 PHE 26 67.922 5.413 5.413
188 HD2 PHE 26 HD1 PHE 26 65.053 8.549 8.549
189 HE1 PHE 26 HE2 PHE 26 68.688 5.651 5.651
190 HE2 PHE 26 HE1 PHE 26 65.819 8.789 8.789
191 HZ PHE 26 HZ PHE 26 67.637 7.339 7.339
192 H ASP 27 HN ASP 27 65.466 9.689 9.689
193 HA ASP 27 HA ASP 27 66.496 11.347 11.347
194 1HB ASP 27 HB2 ASP 27 64.377 11.298 11.298
195 2HB ASP 27 HB1 ASP 27 65.258 12.794 12.794
196 H MET 28 HN MET 28 67.882 10.443 10.443
197 HA MET 28 HA MET 28 69.043 12.857 12.857
198 1HB MET 28 HB2 MET 28 69.789 9.929 9.929
199 2HB MET 28 HB1 MET 28 70.785 11.136 11.136
200 1HG MET 28 HG2 MET 28 67.966 11.506 11.506
201 2HG MET 28 HG1 MET 28 68.507 9.884 9.884
202 1HE MET 28 HE3 MET 28 69.379 9.267 9.267
203 2HE MET 28 HE2 MET 28 69.903 10.252 10.252
204 3HE MET 28 HE1 MET 28 68.226 10.322 10.322
205 H PHE 29 HN PHE 29 69.871 10.810 10.810
206 HA PHE 29 HA PHE 29 72.308 12.493 12.493
207 1HB PHE 29 HB2 PHE 29 71.707 9.781 9.781
208 2HB PHE 29 HB1 PHE 29 73.275 10.563 10.563
209 HD1 PHE 29 HD2 PHE 29 70.573 8.721 8.721
210 HD2 PHE 29 HD1 PHE 29 74.395 10.619 10.619
211 HE1 PHE 29 HE2 PHE 29 70.834 7.628 7.628
212 HE2 PHE 29 HE1 PHE 29 74.655 9.525 9.525
213 HZ PHE 29 HZ PHE 29 72.875 8.030 8.030
214 H ASP 30 HN ASP 30 69.494 13.139 13.139
215 HA ASP 30 HA ASP 30 69.620 12.845 12.845
216 1HB ASP 30 HB2 ASP 30 67.532 13.137 13.137
217 2HB ASP 30 HB1 ASP 30 67.195 13.927 13.927
218 H ALA 31 HN ALA 31 71.331 14.764 14.764
219 HA ALA 31 HA ALA 31 70.241 17.422 17.422
220 1HB ALA 31 HB2 ALA 31 72.761 16.040 16.040
221 2HB ALA 31 HB1 ALA 31 73.013 17.533 17.533
222 3HB ALA 31 HB3 ALA 31 72.203 17.579 17.579
223 H ASP 32 HN ASP 32 71.612 15.304 15.304
224 HA ASP 32 HA ASP 32 71.174 17.461 17.461
225 1HB ASP 32 HB2 ASP 32 73.553 15.891 15.891
226 2HB ASP 32 HB1 ASP 32 73.211 15.882 15.882
227 H GLY 33 HN GLY 33 69.593 15.010 15.010
228 1HA GLY 33 HA2 GLY 33 69.248 13.817 13.817
229 2HA GLY 33 HA1 GLY 33 69.345 12.765 12.765
230 H GLY 34 HN GLY 34 67.864 14.398 14.398
231 1HA GLY 34 HA2 GLY 34 65.655 15.036 15.036
232 2HA GLY 34 HA1 GLY 34 65.283 15.048 15.048
233 H GLY 35 HN GLY 35 65.674 12.547 12.547
234 1HA GLY 35 HA2 GLY 35 64.094 10.817 10.817
235 2HA GLY 35 HA1 GLY 35 63.709 10.910 10.910
236 H ASP 36 HN ASP 36 67.053 11.105 11.105
237 HA ASP 36 HA ASP 36 67.559 8.214 8.214
238 1HB ASP 36 HB2 ASP 36 68.778 8.504 8.504
239 2HB ASP 36 HB1 ASP 36 67.016 8.549 8.549
240 H ILE 37 HN ILE 37 69.394 7.962 7.962
241 HA ILE 37 HA ILE 37 71.233 10.279 10.279
242 HB ILE 37 HB ILE 37 71.973 9.031 9.031
243 1HG1 ILE 37 HG12 ILE 37 70.181 6.802 6.802
244 2HG1 ILE 37 HG11 ILE 37 71.944 6.792 6.792
245 1HG2 ILE 37 HG23 ILE 37 68.971 8.955 8.955
246 2HG2 ILE 37 HG22 ILE 37 69.752 8.711 8.711
247 3HG2 ILE 37 HG21 ILE 37 69.909 10.258 10.258
248 HD1 ILE 37 HD1 ILE 37 72.182 6.440 6.440
249 HD1 ILE 37 HD1 ILE 37 70.595 5.697 5.697
250 HD1 ILE 37 HD1 ILE 37 70.726 7.349 7.349
251 H SER 38 HN SER 38 73.646 9.450 9.450
252 HA SER 38 HA SER 38 74.588 8.492 8.492
253 1HB SER 38 HB2 SER 38 75.915 8.538 8.538
254 2HB SER 38 HB1 SER 38 76.754 8.456 8.456
255 HG SER 38 HG SER 38 75.308 10.468 10.468
256 H THR 39 HN THR 39 74.803 6.411 6.411
257 HA THR 39 HA THR 39 73.714 4.128 4.128
258 HB THR 39 HB THR 39 75.534 2.978 2.978
259 HG1 THR 39 HG1 THR 39 77.081 4.520 4.520
260 1HG2 THR 39 HG23 THR 39 73.213 3.542 3.542
261 2HG2 THR 39 HG22 THR 39 73.797 5.123 5.123
262 3HG2 THR 39 HG21 THR 39 74.393 3.663 3.663
263 H LYS 40 HN LYS 40 76.839 5.610 5.610
264 HA LYS 40 HA LYS 40 77.934 3.353 3.353
265 1HB LYS 40 HB2 LYS 40 79.177 5.232 5.232
266 2HB LYS 40 HB1 LYS 40 78.640 6.299 6.299
267 1HG LYS 40 HG2 LYS 40 80.294 5.565 5.565
268 2HG LYS 40 HG1 LYS 40 79.733 3.903 3.903
269 1HD LYS 40 HD2 LYS 40 81.697 3.550 3.550
270 2HD LYS 40 HD1 LYS 40 80.936 4.382 4.382
271 1HE LYS 40 HE2 LYS 40 82.230 6.052 6.052
272 2HE LYS 40 HE1 LYS 40 83.264 5.243 5.243
273 1HZ LYS 40 HZ2 LYS 40 81.383 6.108 6.108
274 2HZ LYS 40 HZ1 LYS 40 81.222 7.298 7.298
275 3HZ LYS 40 HZ3 LYS 40 82.709 7.086 7.086
276 H GLU 41 HN GLU 41 75.582 5.742 5.742
277 HA GLU 41 HA GLU 41 76.087 5.655 5.655
278 1HB GLU 41 HB2 GLU 41 75.476 7.716 7.716
279 2HB GLU 41 HB1 GLU 41 73.856 7.028 7.028
280 1HG GLU 41 HG2 GLU 41 73.717 8.437 8.437
281 2HG GLU 41 HG1 GLU 41 73.999 6.845 6.845
282 H LEU 42 HN LEU 42 74.639 3.629 3.629
283 HA LEU 42 HA LEU 42 72.035 3.114 3.114
284 1HB LEU 42 HB2 LEU 42 73.801 2.098 2.098
285 2HB LEU 42 HB1 LEU 42 73.568 0.748 0.748
286 HG LEU 42 HG LEU 42 71.014 1.536 1.536
287 HD1 LEU 42 HD1 LEU 42 70.787 3.127 3.127
288 HD1 LEU 42 HD1 LEU 42 71.147 1.860 1.860
289 HD1 LEU 42 HD1 LEU 42 72.441 2.895 2.895
290 HD2 LEU 42 HD2 LEU 42 72.417 -0.638 -0.638
291 HD2 LEU 42 HD2 LEU 42 71.994 -0.019 -0.019
292 HD2 LEU 42 HD2 LEU 42 70.723 -0.413 -0.413
293 H GLY 43 HN GLY 43 75.056 1.340 1.340
294 1HA GLY 43 HA2 GLY 43 74.052 -0.257 -0.257
295 2HA GLY 43 HA1 GLY 43 75.714 0.334 0.334
296 H THR 44 HN THR 44 75.235 3.096 3.096
297 HA THR 44 HA THR 44 75.116 3.510 3.510
298 HB THR 44 HB THR 44 74.537 5.242 5.242
299 HG1 THR 44 HG1 THR 44 76.674 5.178 5.178
300 1HG2 THR 44 HG23 THR 44 74.688 6.047 6.047
301 2HG2 THR 44 HG22 THR 44 74.768 7.181 7.181
302 3HG2 THR 44 HG21 THR 44 73.305 6.235 6.235
303 H VAL 45 HN VAL 45 72.515 4.494 4.494
304 HA VAL 45 HA VAL 45 70.492 5.034 5.034
305 HB VAL 45 HB VAL 45 70.449 3.727 3.727
306 1HG1 VAL 45 HG11 VAL 45 68.360 3.282 3.282
307 2HG1 VAL 45 HG13 VAL 45 68.111 5.027 5.027
308 3HG1 VAL 45 HG12 VAL 45 68.091 4.168 4.168
309 1HG2 VAL 45 HG22 VAL 45 70.141 6.549 6.549
310 2HG2 VAL 45 HG21 VAL 45 71.336 5.943 5.943
311 3HG2 VAL 45 HG23 VAL 45 69.646 6.091 6.091
312 H MET 46 HN MET 46 71.023 1.852 1.852
313 HA MET 46 HA MET 46 69.093 0.330 0.330
314 1HB MET 46 HB2 MET 46 71.945 -0.334 -0.334
315 2HB MET 46 HB1 MET 46 70.727 -1.546 -1.546
316 1HG MET 46 HG2 MET 46 69.345 -0.890 -0.890
317 2HG MET 46 HG1 MET 46 70.323 0.546 0.546
318 1HE MET 46 HE3 MET 46 69.404 -2.748 -2.748
319 2HE MET 46 HE2 MET 46 70.726 -3.593 -3.593
320 3HE MET 46 HE1 MET 46 70.679 -3.515 -3.515
321 H ARG 47 HN ARG 47 72.422 1.019 1.019
322 HA ARG 47 HA ARG 47 72.032 -0.360 -0.360
323 1HB ARG 47 HB2 ARG 47 74.111 0.999 0.999
324 2HB ARG 47 HB1 ARG 47 74.202 1.401 1.401
325 1HG ARG 47 HG2 ARG 47 74.026 -1.086 -1.086
326 2HG ARG 47 HG1 ARG 47 74.243 -1.357 -1.357
327 1HD ARG 47 HD2 ARG 47 76.237 0.504 0.504
328 2HD ARG 47 HD1 ARG 47 76.302 -1.074 -1.074
329 HE ARG 47 HE ARG 47 75.982 -1.697 -1.697
330 1HH1 ARG 47 HH1 ARG 47 78.295 -0.359 -0.359
331 2HH1 ARG 47 HH1 ARG 47 79.594 -0.404 -0.404
332 1HH2 ARG 47 HH2 ARG 47 77.609 -1.544 -1.544
333 2HH2 ARG 47 HH2 ARG 47 79.206 -1.075 -1.075
334 H MET 48 HN MET 48 72.050 3.051 3.051
335 HA MET 48 HA MET 48 71.808 4.284 4.284
336 1HB MET 48 HB2 MET 48 71.961 5.047 5.047
337 2HB MET 48 HB1 MET 48 70.282 5.443 5.443
338 1HG MET 48 HG2 MET 48 72.694 6.349 6.349
339 2HG MET 48 HG1 MET 48 71.762 7.354 7.354
340 1HE MET 48 HE3 MET 48 72.675 6.933 6.933
341 2HE MET 48 HE2 MET 48 71.366 7.262 7.262
342 3HE MET 48 HE1 MET 48 71.666 5.609 5.609
343 H LEU 49 HN LEU 49 69.576 2.313 2.313
344 HA LEU 49 HA LEU 49 67.191 3.419 3.419
345 1HB LEU 49 HB2 LEU 49 67.806 1.369 1.369
346 2HB LEU 49 HB1 LEU 49 66.220 1.374 1.374
347 HG LEU 49 HG LEU 49 67.294 3.987 3.987
348 HD1 LEU 49 HD1 LEU 49 65.767 2.419 2.419
349 HD1 LEU 49 HD1 LEU 49 67.429 1.891 1.891
350 HD1 LEU 49 HD1 LEU 49 67.099 3.552 3.552
351 HD2 LEU 49 HD2 LEU 49 65.118 4.596 4.596
352 HD2 LEU 49 HD2 LEU 49 64.918 3.085 3.085
353 HD2 LEU 49 HD2 LEU 49 64.547 3.152 3.152
354 H GLY 50 HN GLY 50 69.324 0.593 0.593
355 1HA GLY 50 HA2 GLY 50 69.356 -0.195 -0.195
356 2HA GLY 50 HA1 GLY 50 67.660 -0.554 -0.554
357 H GLN 51 HN GLN 51 68.966 -1.100 -1.100
358 HA GLN 51 HA GLN 51 69.121 -4.013 -4.013
359 1HB GLN 51 HB2 GLN 51 69.489 -2.510 -2.510
360 2HB GLN 51 HB1 GLN 51 68.857 -4.140 -4.140
361 1HG GLN 51 HG2 GLN 51 67.516 -1.514 -1.514
362 2HG GLN 51 HG1 GLN 51 66.950 -2.778 -2.778
363 1HE2 GLN 51 HE22 GLN 51 65.776 -2.935 -2.935
364 2HE2 GLN 51 HE21 GLN 51 66.377 -1.542 -1.542
365 H ASN 52 HN ASN 52 70.927 -4.932 -4.932
366 HA ASN 52 HA ASN 52 73.485 -3.490 -3.490
367 1HB ASN 52 HB2 ASN 52 72.793 -4.812 -4.812
368 2HB ASN 52 HB1 ASN 52 73.402 -6.193 -6.193
369 HD2 ASN 52 HD2 ASN 52 74.928 -5.691 -5.691
370 HD2 ASN 52 HD2 ASN 52 76.354 -4.861 -4.861
371 HA PRO 53 HA PRO 53 73.088 -6.368 -6.368
372 1HB PRO 53 HB2 PRO 53 74.005 -4.577 -4.577
373 2HB PRO 53 HB1 PRO 53 72.301 -4.670 -4.670
374 1HG PRO 53 HG2 PRO 53 74.410 -2.747 -2.747
375 2HG PRO 53 HG1 PRO 53 72.690 -2.472 -2.472
376 1HD PRO 53 HD2 PRO 53 73.762 -2.690 -2.690
377 2HD PRO 53 HD1 PRO 53 72.074 -3.082 -3.082
378 H THR 54 HN THR 54 74.816 -7.735 -7.735
379 HA THR 54 HA THR 54 77.432 -7.257 -7.257
380 HB THR 54 HB THR 54 77.936 -9.240 -9.240
381 HG1 THR 54 HG1 THR 54 76.140 -10.111 -10.111
382 1HG2 THR 54 HG22 THR 54 75.600 -9.357 -9.357
383 2HG2 THR 54 HG21 THR 54 76.476 -10.767 -10.767
384 3HG2 THR 54 HG23 THR 54 77.304 -9.574 -9.574
385 H LYS 55 HN LYS 55 79.298 -6.433 -6.433
386 HA LYS 55 HA LYS 55 79.266 -4.452 -4.452
387 1HB LYS 55 HB2 LYS 55 81.136 -5.467 -5.467
388 2HB LYS 55 HB1 LYS 55 81.507 -6.461 -6.461
389 1HG LYS 55 HG2 LYS 55 81.708 -4.391 -4.391
390 2HG LYS 55 HG1 LYS 55 81.434 -3.430 -3.430
391 1HD LYS 55 HD2 LYS 55 83.531 -3.813 -3.813
392 2HD LYS 55 HD1 LYS 55 83.548 -5.484 -5.484
393 1HE LYS 55 HE2 LYS 55 84.476 -4.924 -4.924
394 2HE LYS 55 HE1 LYS 55 83.597 -3.385 -3.385
395 1HZ LYS 55 HZ1 LYS 55 85.036 -2.818 -2.818
396 2HZ LYS 55 HZ3 LYS 55 86.064 -4.026 -4.026
397 3HZ LYS 55 HZ2 LYS 55 85.706 -2.668 -2.668
398 H GLU 56 HN GLU 56 79.845 -7.933 -7.933
399 HA GLU 56 HA GLU 56 80.187 -7.798 -7.798
400 1HB GLU 56 HB2 GLU 56 78.874 -9.903 -9.903
401 2HB GLU 56 HB1 GLU 56 79.466 -10.182 -10.182
402 1HG GLU 56 HG2 GLU 56 81.645 -10.220 -10.220
403 2HG GLU 56 HG1 GLU 56 81.417 -8.919 -8.919
404 H GLU 57 HN GLU 57 77.181 -8.095 -8.095
405 HA GLU 57 HA GLU 57 75.343 -8.418 -8.418
406 1HB GLU 57 HB2 GLU 57 75.368 -7.499 -7.499
407 2HB GLU 57 HB1 GLU 57 73.997 -6.926 -6.926
408 1HG GLU 57 HG2 GLU 57 74.676 -9.782 -9.782
409 2HG GLU 57 HG1 GLU 57 74.068 -9.358 -9.358
410 H LEU 58 HN LEU 58 76.463 -5.388 -5.388
411 HA LEU 58 HA LEU 58 75.004 -3.536 -3.536
412 1HB LEU 58 HB2 LEU 58 77.849 -3.343 -3.343
413 2HB LEU 58 HB1 LEU 58 76.787 -1.983 -1.983
414 HG LEU 58 HG LEU 58 76.451 -4.062 -4.062
415 HD1 LEU 58 HD1 LEU 58 77.627 -2.403 -2.403
416 HD1 LEU 58 HD1 LEU 58 76.053 -1.613 -1.613
417 HD1 LEU 58 HD1 LEU 58 77.188 -1.197 -1.197
418 HD2 LEU 58 HD2 LEU 58 74.468 -2.203 -2.203
419 HD2 LEU 58 HD2 LEU 58 74.333 -2.561 -2.561
420 HD2 LEU 58 HD2 LEU 58 74.243 -3.867 -3.867
421 H ASP 59 HN ASP 59 78.387 -4.589 -4.589
422 HA ASP 59 HA ASP 59 78.805 -3.351 -3.351
423 1HB ASP 59 HB2 ASP 59 80.402 -4.676 -4.676
424 2HB ASP 59 HB1 ASP 59 79.683 -6.144 -6.144
425 H ALA 60 HN ALA 60 77.240 -6.492 -6.492
426 HA ALA 60 HA ALA 60 76.842 -7.252 -7.252
427 1HB ALA 60 HB2 ALA 60 76.120 -8.086 -8.086
428 2HB ALA 60 HB1 ALA 60 74.759 -8.296 -8.296
429 3HB ALA 60 HB3 ALA 60 76.304 -9.070 -9.070
430 H ILE 61 HN ILE 61 74.661 -5.623 -5.623
431 HA ILE 61 HA ILE 61 72.496 -5.267 -5.267
432 HB ILE 61 HB ILE 61 73.346 -4.010 -4.010
433 1HG1 ILE 61 HG12 ILE 61 70.798 -5.239 -5.239
434 2HG1 ILE 61 HG11 ILE 61 71.830 -6.326 -6.326
435 1HG2 ILE 61 HG22 ILE 61 70.898 -3.411 -3.411
436 2HG2 ILE 61 HG21 ILE 61 71.042 -2.984 -2.984
437 3HG2 ILE 61 HG23 ILE 61 72.135 -2.267 -2.267
438 HD1 ILE 61 HD1 ILE 61 73.041 -6.897 -6.897
439 HD1 ILE 61 HD1 ILE 61 71.752 -6.153 -6.153
440 HD1 ILE 61 HD1 ILE 61 73.187 -5.219 -5.219
441 H ILE 62 HN ILE 62 75.066 -3.043 -3.043
442 HA ILE 62 HA ILE 62 74.405 -0.718 -0.718
443 HB ILE 62 HB ILE 62 77.050 -2.074 -2.074
444 1HG1 ILE 62 HG12 ILE 62 75.656 0.305 0.305
445 2HG1 ILE 62 HG11 ILE 62 75.620 -1.336 -1.336
446 1HG2 ILE 62 HG23 ILE 62 76.502 0.233 0.233
447 2HG2 ILE 62 HG22 ILE 62 77.471 0.689 0.689
448 3HG2 ILE 62 HG21 ILE 62 78.038 -0.575 -0.575
449 HD1 ILE 62 HD1 ILE 62 78.319 -0.300 -0.300
450 HD1 ILE 62 HD1 ILE 62 77.758 -1.216 -1.216
451 HD1 ILE 62 HD1 ILE 62 77.489 0.525 0.525
452 H GLU 63 HN GLU 63 76.865 -2.986 -2.986
453 HA GLU 63 HA GLU 63 76.994 -2.123 -2.123
454 1HB GLU 63 HB2 GLU 63 78.357 -3.909 -3.909
455 2HB GLU 63 HB1 GLU 63 76.945 -4.966 -4.966
456 1HG GLU 63 HG2 GLU 63 76.798 -5.049 -5.049
457 2HG GLU 63 HG1 GLU 63 78.006 -3.776 -3.776
458 H GLU 64 HN GLU 64 74.528 -4.245 -4.245
459 HA GLU 64 HA GLU 64 73.117 -4.842 -4.842
460 1HB GLU 64 HB2 GLU 64 72.710 -6.249 -6.249
461 2HB GLU 64 HB1 GLU 64 72.577 -4.898 -4.898
462 1HG GLU 64 HG2 GLU 64 70.398 -4.358 -4.358
463 2HG GLU 64 HG1 GLU 64 70.574 -5.242 -5.242
464 H VAL 65 HN VAL 65 72.197 -2.634 -2.634
465 HA VAL 65 HA VAL 65 70.140 -1.298 -1.298
466 HB VAL 65 HB VAL 65 70.106 0.172 0.172
467 1HG1 VAL 65 HG12 VAL 65 69.251 -2.164 -2.164
468 2HG1 VAL 65 HG11 VAL 65 70.836 -2.653 -2.653
469 3HG1 VAL 65 HG13 VAL 65 69.858 -1.509 -1.509
470 1HG2 VAL 65 HG23 VAL 65 72.873 -0.208 -0.208
471 2HG2 VAL 65 HG22 VAL 65 71.970 0.665 0.665
472 3HG2 VAL 65 HG21 VAL 65 72.356 -1.041 -1.041
473 H ASP 66 HN ASP 66 73.559 -1.040 -1.040
474 HA ASP 66 HA ASP 66 73.802 1.774 1.774
475 1HB ASP 66 HB2 ASP 66 75.548 0.218 0.218
476 2HB ASP 66 HB1 ASP 66 75.663 -0.538 -0.538
477 H GLU 67 HN GLU 67 71.973 1.658 1.658
478 HA GLU 67 HA GLU 67 72.427 0.261 0.261
479 1HB GLU 67 HB2 GLU 67 70.467 1.529 1.529
480 2HB GLU 67 HB1 GLU 67 70.230 1.007 1.007
481 1HG GLU 67 HG2 GLU 67 71.611 3.512 3.512
482 2HG GLU 67 HG1 GLU 67 70.213 3.671 3.671
483 H ASP 68 HN ASP 68 73.590 3.239 3.239
484 HA ASP 68 HA ASP 68 74.461 4.175 4.175
485 1HB ASP 68 HB2 ASP 68 74.182 5.590 5.590
486 2HB ASP 68 HB1 ASP 68 74.677 6.363 6.363
487 H GLY 69 HN GLY 69 75.616 3.887 3.887
488 1HA GLY 69 HA2 GLY 69 77.890 2.600 2.600
489 2HA GLY 69 HA1 GLY 69 78.412 3.924 3.924
490 H SER 70 HN SER 70 77.647 6.181 6.181
491 HA SER 70 HA SER 70 78.425 6.107 6.107
492 1HB SER 70 HB2 SER 70 80.216 6.885 6.885
493 2HB SER 70 HB1 SER 70 79.130 8.119 8.119
494 HG SER 70 HG SER 70 80.672 8.206 8.206
495 H GLY 71 HN GLY 71 75.719 6.248 6.248
496 1HA GLY 71 HA2 GLY 71 74.821 8.999 8.999
497 2HA GLY 71 HA1 GLY 71 73.812 7.674 7.674
498 H THR 72 HN THR 72 72.171 7.838 7.838
499 HA THR 72 HA THR 72 72.998 7.264 7.264
500 HB THR 72 HB THR 72 70.867 8.627 8.627
501 HG1 THR 72 HG1 THR 72 70.508 10.155 10.155
502 1HG2 THR 72 HG21 THR 72 73.259 9.948 9.948
503 2HG2 THR 72 HG23 THR 72 72.077 10.783 10.783
504 3HG2 THR 72 HG22 THR 72 73.099 9.525 9.525
505 H ILE 73 HN ILE 73 70.620 6.683 6.683
506 HA ILE 73 HA ILE 73 69.572 4.401 4.401
507 HB ILE 73 HB ILE 73 70.858 3.778 3.778
508 1HG1 ILE 73 HG12 ILE 73 68.802 2.757 2.757
509 2HG1 ILE 73 HG11 ILE 73 67.889 3.355 3.355
510 1HG2 ILE 73 HG22 ILE 73 69.377 6.022 6.022
511 2HG2 ILE 73 HG21 ILE 73 69.238 4.590 4.590
512 3HG2 ILE 73 HG23 ILE 73 70.829 5.231 5.231
513 HD1 ILE 73 HD1 ILE 73 70.144 1.346 1.346
514 HD1 ILE 73 HD1 ILE 73 69.643 2.167 2.167
515 HD1 ILE 73 HD1 ILE 73 68.503 1.137 1.137
516 H ASP 74 HN ASP 74 67.315 4.182 4.182
517 HA ASP 74 HA ASP 74 65.716 6.560 6.560
518 1HB ASP 74 HB2 ASP 74 64.852 3.963 3.963
519 2HB ASP 74 HB1 ASP 74 64.106 5.553 5.553
520 H PHE 75 HN PHE 75 64.425 6.658 6.658
521 HA PHE 75 HA PHE 75 64.440 4.884 4.884
522 1HB PHE 75 HB2 PHE 75 63.384 7.234 7.234
523 2HB PHE 75 HB1 PHE 75 61.944 6.351 6.351
524 HD1 PHE 75 HD2 PHE 75 61.088 4.481 4.481
525 HD2 PHE 75 HD1 PHE 75 63.799 7.587 7.587
526 HE1 PHE 75 HE2 PHE 75 60.496 4.077 4.077
527 HE2 PHE 75 HE1 PHE 75 63.208 7.183 7.183
528 HZ PHE 75 HZ PHE 75 61.556 5.427 5.427
529 H GLU 76 HN GLU 76 62.114 4.885 4.885
530 HA GLU 76 HA GLU 76 60.465 2.748 2.748
531 1HB GLU 76 HB2 GLU 76 60.062 2.525 2.525
532 2HB GLU 76 HB1 GLU 76 60.092 4.216 4.216
533 1HG GLU 76 HG2 GLU 76 62.515 4.303 4.303
534 2HG GLU 76 HG1 GLU 76 62.345 2.674 2.674
535 H GLU 77 HN GLU 77 63.629 2.669 2.669
536 HA GLU 77 HA GLU 77 63.639 -0.245 -0.245
537 1HB GLU 77 HB2 GLU 77 64.779 1.475 1.475
538 2HB GLU 77 HB1 GLU 77 65.926 1.740 1.740
539 1HG GLU 77 HG2 GLU 77 67.104 -0.055 -0.055
540 2HG GLU 77 HG1 GLU 77 65.690 -1.079 -1.079
541 H PHE 78 HN PHE 78 65.237 2.141 2.141
542 HA PHE 78 HA PHE 78 66.774 0.252 0.252
543 1HB PHE 78 HB2 PHE 78 67.207 2.656 2.656
544 2HB PHE 78 HB1 PHE 78 65.616 2.980 2.980
545 HD1 PHE 78 HD2 PHE 78 65.109 2.393 2.393
546 HD2 PHE 78 HD1 PHE 78 69.023 1.809 1.809
547 HE1 PHE 78 HE2 PHE 78 66.041 2.124 2.124
548 HE2 PHE 78 HE1 PHE 78 69.955 1.539 1.539
549 HZ PHE 78 HZ PHE 78 68.463 1.697 1.697
550 H LEU 79 HN LEU 79 63.415 1.249 1.249
551 HA LEU 79 HA LEU 79 62.591 0.653 0.653
552 1HB LEU 79 HB2 LEU 79 61.497 0.561 0.561
553 2HB LEU 79 HB1 LEU 79 60.666 -0.528 -0.528
554 HG LEU 79 HG LEU 79 61.274 2.265 2.265
555 HD1 LEU 79 HD1 LEU 79 59.372 1.459 1.459
556 HD1 LEU 79 HD1 LEU 79 60.188 3.002 3.002
557 HD1 LEU 79 HD1 LEU 79 58.766 2.584 2.584
558 HD2 LEU 79 HD2 LEU 79 59.790 -0.015 -0.015
559 HD2 LEU 79 HD2 LEU 79 58.662 1.313 1.313
560 HD2 LEU 79 HD2 LEU 79 60.031 1.529 1.529
561 H VAL 80 HN VAL 80 63.280 -1.692 -1.692
562 HA VAL 80 HA VAL 80 62.543 -4.040 -4.040
563 HB VAL 80 HB VAL 80 62.923 -3.688 -3.688
564 1HG1 VAL 80 HG12 VAL 80 65.244 -2.675 -2.675
565 2HG1 VAL 80 HG11 VAL 80 65.791 -4.334 -4.334
566 3HG1 VAL 80 HG13 VAL 80 65.127 -3.839 -3.839
567 1HG2 VAL 80 HG22 VAL 80 63.157 -5.952 -5.952
568 2HG2 VAL 80 HG21 VAL 80 62.858 -5.941 -5.941
569 3HG2 VAL 80 HG23 VAL 80 64.508 -6.066 -6.066
570 H MET 81 HN MET 81 65.588 -2.227 -2.227
571 HA MET 81 HA MET 81 67.322 -4.075 -4.075
572 1HB MET 81 HB2 MET 81 67.283 -1.037 -1.037
573 2HB MET 81 HB1 MET 81 68.684 -2.026 -2.026
574 1HG MET 81 HG2 MET 81 67.245 -1.943 -1.943
575 2HG MET 81 HG1 MET 81 68.882 -1.377 -1.377
576 1HE MET 81 HE3 MET 81 70.217 -2.794 -2.794
577 2HE MET 81 HE2 MET 81 69.602 -4.360 -4.360
578 3HE MET 81 HE1 MET 81 70.899 -4.285 -4.285
579 H MET 82 HN MET 82 64.822 -1.996 -1.996
580 HA MET 82 HA MET 82 65.753 -1.937 -1.937
581 1HB MET 82 HB2 MET 82 63.031 -1.490 -1.490
582 2HB MET 82 HB1 MET 82 63.478 -1.016 -1.016
583 1HG MET 82 HG2 MET 82 65.107 0.554 0.554
584 2HG MET 82 HG1 MET 82 64.958 -0.053 -0.053
585 1HE MET 82 HE2 MET 82 64.441 2.450 2.450
586 2HE MET 82 HE1 MET 82 64.514 3.232 3.232
587 3HE MET 82 HE3 MET 82 63.098 3.455 3.455
588 H VAL 83 HN VAL 83 62.831 -3.478 -3.478
589 HA VAL 83 HA VAL 83 62.427 -5.261 -5.261
590 HB VAL 83 HB VAL 83 60.634 -4.712 -4.712
591 1HG1 VAL 83 HG11 VAL 83 62.608 -4.781 -4.781
592 2HG1 VAL 83 HG13 VAL 83 61.558 -6.137 -6.137
593 3HG1 VAL 83 HG12 VAL 83 60.888 -4.512 -4.512
594 1HG2 VAL 83 HG21 VAL 83 60.650 -7.035 -7.035
595 2HG2 VAL 83 HG23 VAL 83 59.848 -6.935 -6.935
596 3HG2 VAL 83 HG22 VAL 83 61.491 -7.568 -7.568
597 H ARG 84 HN ARG 84 64.154 -5.677 -5.677
598 HA ARG 84 HA ARG 84 64.664 -8.460 -8.460
599 1HB ARG 84 HB2 ARG 84 66.265 -6.122 -6.122
600 2HB ARG 84 HB1 ARG 84 66.661 -7.809 -7.809
601 1HG ARG 84 HG2 ARG 84 63.861 -6.839 -6.839
602 2HG ARG 84 HG1 ARG 84 65.116 -6.472 -6.472
603 1HD ARG 84 HD2 ARG 84 65.352 -9.239 -9.239
604 2HD ARG 84 HD1 ARG 84 63.684 -8.907 -8.907
605 HE ARG 84 HE ARG 84 64.624 -7.931 -7.931
606 1HH1 ARG 84 HH2 ARG 84 67.146 -7.364 -7.364
607 2HH1 ARG 84 HH2 ARG 84 68.064 -8.816 -8.816
608 1HH2 ARG 84 HH1 ARG 84 65.594 -10.885 -10.885
609 2HH2 ARG 84 HH1 ARG 84 67.186 -10.809 -10.809
610 H GLN 85 HN GLN 85 66.351 -5.715 -5.715
611 HA GLN 85 HA GLN 85 68.364 -7.485 -7.485
612 1HB GLN 85 HB2 GLN 85 68.826 -5.186 -5.186
613 2HB GLN 85 HB1 GLN 85 67.790 -4.525 -4.525
614 1HG GLN 85 HG2 GLN 85 70.112 -4.408 -4.408
615 2HG GLN 85 HG1 GLN 85 69.258 -5.604 -5.604
616 1HE2 GLN 85 HE22 GLN 85 71.628 -7.193 -7.193
617 2HE2 GLN 85 HE21 GLN 85 70.622 -5.874 -5.874
618 H MET 86 HN MET 86 65.381 -5.818 -5.818
619 HA MET 86 HA MET 86 65.662 -6.189 -6.189
620 1HB MET 86 HB2 MET 86 63.812 -5.011 -5.011
621 2HB MET 86 HB1 MET 86 62.993 -5.735 -5.735
622 1HG MET 86 HG2 MET 86 64.435 -4.438 -4.438
623 2HG MET 86 HG1 MET 86 65.243 -3.706 -3.706
624 1HE MET 86 HE2 MET 86 62.895 -3.432 -3.432
625 2HE MET 86 HE1 MET 86 61.493 -2.496 -2.496
626 3HE MET 86 HE3 MET 86 61.613 -4.212 -4.212
627 H LYS 87 HN LYS 87 64.516 -8.082 -8.082
628 HA LYS 87 HA LYS 87 62.595 -9.780 -9.780
629 1HB LYS 87 HB2 LYS 87 64.914 -10.220 -10.220
630 2HB LYS 87 HB1 LYS 87 63.748 -11.498 -11.498
631 1HG LYS 87 HG2 LYS 87 62.281 -9.111 -9.111
632 2HG LYS 87 HG1 LYS 87 63.481 -9.300 -9.300
633 1HD LYS 87 HD2 LYS 87 62.421 -11.881 -11.881
634 2HD LYS 87 HD1 LYS 87 61.043 -10.782 -10.782
635 1HE LYS 87 HE2 LYS 87 61.500 -10.135 -10.135
636 2HE LYS 87 HE1 LYS 87 63.214 -10.584 -10.584
637 1HZ LYS 87 HZ3 LYS 87 62.204 -12.917 -12.917
638 2HZ LYS 87 HZ2 LYS 87 60.861 -12.312 -12.312
639 3HZ LYS 87 HZ1 LYS 87 62.378 -12.402 -12.402
640 H GLU 88 HN GLU 88 66.028 -9.583 -9.583
641 HA GLU 88 HA GLU 88 65.947 -12.064 -12.064
642 1HB GLU 88 HB2 GLU 88 67.812 -10.804 -10.804
643 2HB GLU 88 HB1 GLU 88 68.433 -10.544 -10.544
644 1HG GLU 88 HG2 GLU 88 67.419 -13.272 -13.272
645 2HG GLU 88 HG1 GLU 88 68.958 -12.788 -12.788
646 H ASP 89 HN ASP 89 66.197 -8.556 -8.556
647 HA ASP 89 HA ASP 89 66.814 -8.625 -8.625
648 1HB ASP 89 HB2 ASP 89 67.718 -6.927 -6.927
649 2HB ASP 89 HB1 ASP 89 66.075 -6.377 -6.377
650 H ALA 90 HN ALA 90 64.004 -8.539 -8.539
651 HA ALA 90 HA ALA 90 62.255 -7.458 -7.458
652 1HB ALA 90 HB3 ALA 90 62.284 -7.262 -7.262
653 2HB ALA 90 HB2 ALA 90 61.171 -8.615 -8.615
654 3HB ALA 90 HB1 ALA 90 60.819 -7.066 -7.066
Start of MODEL 32
1 1H ALA 1 HT2 ALA 1 63.474 -2.488 -2.488
2 2H ALA 1 HT1 ALA 1 64.757 -2.578 -2.578
3 3H ALA 1 HT3 ALA 1 63.422 -3.610 -3.610
4 HA ALA 1 HA ALA 1 65.236 -4.864 -4.864
5 1HB ALA 1 HB3 ALA 1 65.488 -2.288 -2.288
6 2HB ALA 1 HB2 ALA 1 65.657 -3.654 -3.654
7 3HB ALA 1 HB1 ALA 1 66.718 -3.517 -3.517
8 H SER 2 HN SER 2 65.068 -6.051 -6.051
9 HA SER 2 HA SER 2 62.209 -6.601 -6.601
10 1HB SER 2 HB2 SER 2 64.748 -7.937 -7.937
11 2HB SER 2 HB1 SER 2 63.951 -8.045 -8.045
12 HG SER 2 HG SER 2 63.283 -9.737 -9.737
13 H MET 3 HN MET 3 64.612 -4.587 -4.587
14 HA MET 3 HA MET 3 64.166 -4.628 -4.628
15 1HB MET 3 HB2 MET 3 64.987 -2.627 -2.627
16 2HB MET 3 HB1 MET 3 64.725 -2.065 -2.065
17 1HG MET 3 HG2 MET 3 66.825 -2.762 -2.762
18 2HG MET 3 HG1 MET 3 66.211 -4.408 -4.408
19 1HE MET 3 HE1 MET 3 67.825 -5.701 -5.701
20 2HE MET 3 HE3 MET 3 66.739 -6.032 -6.032
21 3HE MET 3 HE2 MET 3 68.462 -5.801 -5.801
22 H THR 4 HN THR 4 62.437 -2.781 -2.781
23 HA THR 4 HA THR 4 60.683 -1.293 -1.293
24 HB THR 4 HB THR 4 61.064 -1.210 -1.210
25 HG1 THR 4 HG1 THR 4 59.271 -0.140 -0.140
26 1HG2 THR 4 HG21 THR 4 60.217 -3.876 -3.876
27 2HG2 THR 4 HG23 THR 4 58.887 -3.028 -3.028
28 3HG2 THR 4 HG22 THR 4 60.507 -2.959 -2.959
29 H ASP 5 HN ASP 5 60.745 -4.717 -4.717
30 HA ASP 5 HA ASP 5 57.938 -5.114 -5.114
31 1HB ASP 5 HB2 ASP 5 59.120 -6.412 -6.412
32 2HB ASP 5 HB1 ASP 5 60.148 -7.113 -7.113
33 H GLN 6 HN GLN 6 61.212 -5.971 -5.971
34 HA GLN 6 HA GLN 6 60.370 -7.191 -7.191
35 1HB GLN 6 HB2 GLN 6 62.709 -6.737 -6.737
36 2HB GLN 6 HB1 GLN 6 62.926 -5.738 -5.738
37 1HG GLN 6 HG2 GLN 6 63.440 -7.587 -7.587
38 2HG GLN 6 HG1 GLN 6 61.809 -8.193 -8.193
39 1HE2 GLN 6 HE22 GLN 6 64.942 -9.714 -9.714
40 2HE2 GLN 6 HE21 GLN 6 65.169 -8.404 -8.404
41 H GLN 7 HN GLN 7 60.244 -3.926 -3.926
42 HA GLN 7 HA GLN 7 60.669 -2.709 -2.709
43 1HB GLN 7 HB2 GLN 7 61.034 -1.709 -1.709
44 2HB GLN 7 HB1 GLN 7 59.279 -1.559 -1.559
45 1HG GLN 7 HG2 GLN 7 60.588 -0.517 -0.517
46 2HG GLN 7 HG1 GLN 7 60.813 0.410 0.410
47 1HE2 GLN 7 HE22 GLN 7 57.331 1.276 1.276
48 2HE2 GLN 7 HE21 GLN 7 58.728 0.998 0.998
49 H ALA 8 HN ALA 8 57.801 -3.286 -3.286
50 HA ALA 8 HA ALA 8 55.807 -2.254 -2.254
51 1HB ALA 8 HB3 ALA 8 56.045 -3.805 -3.805
52 2HB ALA 8 HB2 ALA 8 54.995 -4.728 -4.728
53 3HB ALA 8 HB1 ALA 8 54.573 -3.073 -3.073
54 H GLU 9 HN GLU 9 57.231 -5.534 -5.534
55 HA GLU 9 HA GLU 9 55.645 -6.346 -6.346
56 1HB GLU 9 HB2 GLU 9 56.837 -7.589 -7.589
57 2HB GLU 9 HB1 GLU 9 57.956 -7.966 -7.966
58 1HG GLU 9 HG2 GLU 9 56.008 -8.748 -8.748
59 2HG GLU 9 HG1 GLU 9 54.973 -8.501 -8.501
60 H ALA 10 HN ALA 10 58.595 -4.699 -4.699
61 HA ALA 10 HA ALA 10 60.059 -5.639 -5.639
62 1HB ALA 10 HB2 ALA 10 60.239 -3.429 -3.429
63 2HB ALA 10 HB1 ALA 10 61.260 -3.356 -3.356
64 3HB ALA 10 HB3 ALA 10 61.387 -4.727 -4.727
65 H ARG 11 HN ARG 11 57.944 -2.877 -2.877
66 HA ARG 11 HA ARG 11 58.170 -2.006 -2.006
67 1HB ARG 11 HB2 ARG 11 56.727 -0.055 -0.055
68 2HB ARG 11 HB1 ARG 11 58.475 -0.118 -0.118
69 1HG ARG 11 HG2 ARG 11 57.268 0.306 0.306
70 2HG ARG 11 HG1 ARG 11 58.238 -1.166 -1.166
71 1HD ARG 11 HD2 ARG 11 56.040 -1.635 -1.635
72 2HD ARG 11 HD1 ARG 11 56.148 -2.466 -2.466
73 HE ARG 11 HE ARG 11 55.156 0.117 0.117
74 1HH1 ARG 11 HH2 ARG 11 54.139 -1.687 -1.687
75 2HH1 ARG 11 HH2 ARG 11 52.500 -1.875 -1.875
76 1HH2 ARG 11 HH1 ARG 11 53.089 -0.550 -0.550
77 2HH2 ARG 11 HH1 ARG 11 51.905 -1.231 -1.231
78 H ALA 12 HN ALA 12 56.354 -4.133 -4.133
79 HA ALA 12 HA ALA 12 53.686 -3.320 -3.320
80 1HB ALA 12 HB1 ALA 12 54.900 -5.177 -5.177
81 2HB ALA 12 HB3 ALA 12 53.653 -5.968 -5.968
82 3HB ALA 12 HB2 ALA 12 53.259 -4.530 -4.530
83 H PHE 13 HN PHE 13 56.387 -5.236 -5.236
84 HA PHE 13 HA PHE 13 55.008 -7.040 -7.040
85 1HB PHE 13 HB2 PHE 13 57.158 -7.717 -7.717
86 2HB PHE 13 HB1 PHE 13 57.783 -6.071 -6.071
87 HD1 PHE 13 HD1 PHE 13 56.648 -8.832 -8.832
88 HD2 PHE 13 HD2 PHE 13 58.822 -5.141 -5.141
89 HE1 PHE 13 HE1 PHE 13 57.523 -9.147 -9.147
90 HE2 PHE 13 HE2 PHE 13 59.697 -5.454 -5.454
91 HZ PHE 13 HZ PHE 13 59.047 -7.459 -7.459
92 H LEU 14 HN LEU 14 55.744 -3.674 -3.674
93 HA LEU 14 HA LEU 14 55.235 -3.661 -3.661
94 1HB LEU 14 HB2 LEU 14 56.945 -2.053 -2.053
95 2HB LEU 14 HB1 LEU 14 56.372 -1.303 -1.303
96 HG LEU 14 HG LEU 14 57.655 -4.024 -4.024
97 HD1 LEU 14 HD1 LEU 14 59.420 -2.907 -2.907
98 HD1 LEU 14 HD1 LEU 14 59.750 -2.564 -2.564
99 HD1 LEU 14 HD1 LEU 14 58.969 -1.347 -1.347
100 HD2 LEU 14 HD2 LEU 14 56.938 -1.832 -1.832
101 HD2 LEU 14 HD2 LEU 14 58.400 -2.751 -2.751
102 HD2 LEU 14 HD2 LEU 14 56.847 -3.579 -3.579
103 H SER 15 HN SER 15 53.728 -2.089 -2.089
104 HA SER 15 HA SER 15 51.605 -1.366 -1.366
105 1HB SER 15 HB2 SER 15 52.034 -1.695 -1.695
106 2HB SER 15 HB1 SER 15 51.331 -0.104 -0.104
107 HG SER 15 HG SER 15 49.956 -2.177 -2.177
108 H GLU 16 HN GLU 16 50.884 0.868 0.868
109 HA GLU 16 HA GLU 16 52.814 2.711 2.711
110 1HB GLU 16 HB2 GLU 16 50.395 2.779 2.779
111 2HB GLU 16 HB1 GLU 16 50.060 3.221 3.221
112 1HG GLU 16 HG2 GLU 16 51.387 5.279 5.279
113 2HG GLU 16 HG1 GLU 16 51.740 4.840 4.840
114 H GLU 17 HN GLU 17 51.763 1.994 1.994
115 HA GLU 17 HA GLU 17 52.518 4.445 4.445
116 1HB GLU 17 HB2 GLU 17 51.144 2.349 2.349
117 2HB GLU 17 HB1 GLU 17 52.716 1.703 1.703
118 1HG GLU 17 HG2 GLU 17 52.448 2.838 2.838
119 2HG GLU 17 HG1 GLU 17 52.766 4.296 4.296
120 H MET 18 HN MET 18 54.313 1.450 1.450
121 HA MET 18 HA MET 18 56.739 2.310 2.310
122 1HB MET 18 HB2 MET 18 56.164 -0.037 -0.037
123 2HB MET 18 HB1 MET 18 56.099 0.157 0.157
124 1HG MET 18 HG2 MET 18 58.263 -0.526 -0.526
125 2HG MET 18 HG1 MET 18 58.610 1.116 1.116
126 1HE MET 18 HE3 MET 18 58.408 1.878 1.878
127 2HE MET 18 HE2 MET 18 57.070 0.915 0.915
128 3HE MET 18 HE1 MET 18 58.625 0.892 0.892
129 H ILE 19 HN ILE 19 55.759 2.076 2.076
130 HA ILE 19 HA ILE 19 58.071 2.901 2.901
131 HB ILE 19 HB ILE 19 55.136 3.486 3.486
132 1HG1 ILE 19 HG12 ILE 19 56.516 2.040 2.040
133 2HG1 ILE 19 HG11 ILE 19 56.859 1.305 1.305
134 1HG2 ILE 19 HG23 ILE 19 57.442 4.738 4.738
135 2HG2 ILE 19 HG22 ILE 19 56.307 3.974 3.974
136 3HG2 ILE 19 HG21 ILE 19 55.745 5.221 5.221
137 HD1 ILE 19 HD1 ILE 19 54.531 1.011 1.011
138 HD1 ILE 19 HD1 ILE 19 54.770 0.443 0.443
139 HD1 ILE 19 HD1 ILE 19 54.058 2.030 2.030
140 H ALA 20 HN ALA 20 55.647 5.025 5.025
141 HA ALA 20 HA ALA 20 56.954 7.504 7.504
142 1HB ALA 20 HB3 ALA 20 55.114 6.702 6.702
143 2HB ALA 20 HB2 ALA 20 55.448 8.361 8.361
144 3HB ALA 20 HB1 ALA 20 54.599 7.268 7.268
145 H GLU 21 HN GLU 21 57.811 4.997 4.997
146 HA GLU 21 HA GLU 21 59.153 6.674 6.674
147 1HB GLU 21 HB2 GLU 21 58.130 4.431 4.431
148 2HB GLU 21 HB1 GLU 21 59.351 3.708 3.708
149 1HG GLU 21 HG2 GLU 21 61.079 4.113 4.113
150 2HG GLU 21 HG1 GLU 21 60.243 5.470 5.470
151 H PHE 22 HN PHE 22 60.256 4.418 4.418
152 HA PHE 22 HA PHE 22 63.049 5.027 5.027
153 1HB PHE 22 HB2 PHE 22 61.466 4.032 4.032
154 2HB PHE 22 HB1 PHE 22 63.200 3.835 3.835
155 HD1 PHE 22 HD2 PHE 22 62.602 3.497 3.497
156 HD2 PHE 22 HD1 PHE 22 61.324 1.522 1.522
157 HE1 PHE 22 HE2 PHE 22 62.184 1.421 1.421
158 HE2 PHE 22 HE1 PHE 22 60.904 -0.556 -0.556
159 HZ PHE 22 HZ PHE 22 61.334 -0.605 -0.605
160 H LYS 23 HN LYS 23 60.437 6.769 6.769
161 HA LYS 23 HA LYS 23 61.752 8.186 8.186
162 1HB LYS 23 HB2 LYS 23 59.264 8.035 8.035
163 2HB LYS 23 HB1 LYS 23 59.702 9.421 9.421
164 1HG LYS 23 HG2 LYS 23 58.794 10.252 10.252
165 2HG LYS 23 HG1 LYS 23 60.530 10.573 10.573
166 1HD LYS 23 HD2 LYS 23 60.966 9.051 9.051
167 2HD LYS 23 HD1 LYS 23 59.681 7.961 7.961
168 1HE LYS 23 HE2 LYS 23 58.127 8.951 8.951
169 2HE LYS 23 HE1 LYS 23 58.755 10.582 10.582
170 1HZ LYS 23 HZ2 LYS 23 60.728 9.986 9.986
171 2HZ LYS 23 HZ1 LYS 23 59.986 8.512 8.512
172 3HZ LYS 23 HZ3 LYS 23 59.295 9.976 9.976
173 H ALA 24 HN ALA 24 60.959 9.569 9.569
174 HA ALA 24 HA ALA 24 62.645 11.803 11.803
175 1HB ALA 24 HB3 ALA 24 60.915 10.695 10.695
176 2HB ALA 24 HB2 ALA 24 62.435 10.314 10.314
177 3HB ALA 24 HB1 ALA 24 62.025 11.991 11.991
178 H ALA 25 HN ALA 25 63.460 8.455 8.455
179 HA ALA 25 HA ALA 25 66.155 9.042 9.042
180 1HB ALA 25 HB1 ALA 25 64.339 6.807 6.807
181 2HB ALA 25 HB3 ALA 25 65.951 6.373 6.373
182 3HB ALA 25 HB2 ALA 25 65.724 6.955 6.955
183 H PHE 26 HN PHE 26 64.766 7.830 7.830
184 HA PHE 26 HA PHE 26 67.217 7.433 7.433
185 1HB PHE 26 HB2 PHE 26 64.931 6.639 6.639
186 2HB PHE 26 HB1 PHE 26 64.499 8.302 8.302
187 HD1 PHE 26 HD2 PHE 26 66.171 9.536 9.536
188 HD2 PHE 26 HD1 PHE 26 65.798 5.272 5.272
189 HE1 PHE 26 HE2 PHE 26 67.174 9.261 9.261
190 HE2 PHE 26 HE1 PHE 26 66.801 4.996 4.996
191 HZ PHE 26 HZ PHE 26 67.490 6.990 6.990
192 H ASP 27 HN ASP 27 65.165 10.315 10.315
193 HA ASP 27 HA ASP 27 66.522 11.993 11.993
194 1HB ASP 27 HB2 ASP 27 64.484 12.124 12.124
195 2HB ASP 27 HB1 ASP 27 65.510 13.559 13.559
196 H MET 28 HN MET 28 67.613 10.697 10.697
197 HA MET 28 HA MET 28 69.194 12.872 12.872
198 1HB MET 28 HB2 MET 28 69.357 9.849 9.849
199 2HB MET 28 HB1 MET 28 70.376 10.929 10.929
200 1HG MET 28 HG2 MET 28 67.621 11.776 11.776
201 2HG MET 28 HG1 MET 28 67.757 10.075 10.075
202 1HE MET 28 HE3 MET 28 68.093 9.298 9.298
203 2HE MET 28 HE2 MET 28 68.747 10.019 10.019
204 3HE MET 28 HE1 MET 28 67.185 10.552 10.552
205 H PHE 29 HN PHE 29 69.650 10.635 10.635
206 HA PHE 29 HA PHE 29 72.435 11.699 11.699
207 1HB PHE 29 HB2 PHE 29 71.511 9.036 9.036
208 2HB PHE 29 HB1 PHE 29 73.135 9.539 9.539
209 HD1 PHE 29 HD1 PHE 29 73.784 9.651 9.651
210 HD2 PHE 29 HD2 PHE 29 69.905 8.260 8.260
211 HE1 PHE 29 HE1 PHE 29 73.409 8.713 8.713
212 HE2 PHE 29 HE2 PHE 29 69.532 7.323 7.323
213 HZ PHE 29 HZ PHE 29 71.283 7.547 7.547
214 H ASP 30 HN ASP 30 70.014 12.890 12.890
215 HA ASP 30 HA ASP 30 69.467 12.077 12.077
216 1HB ASP 30 HB2 ASP 30 68.465 14.339 14.339
217 2HB ASP 30 HB1 ASP 30 68.054 13.552 13.552
218 H ALA 31 HN ALA 31 71.614 11.693 11.693
219 HA ALA 31 HA ALA 31 73.690 13.658 13.658
220 1HB ALA 31 HB3 ALA 31 73.192 11.020 11.020
221 2HB ALA 31 HB2 ALA 31 73.475 11.884 11.884
222 3HB ALA 31 HB1 ALA 31 74.696 11.910 11.910
223 H ASP 32 HN ASP 32 70.837 13.042 13.042
224 HA ASP 32 HA ASP 32 71.634 15.175 15.175
225 1HB ASP 32 HB2 ASP 32 70.750 13.012 13.012
226 2HB ASP 32 HB1 ASP 32 69.273 13.267 13.267
227 H GLY 33 HN GLY 33 69.610 14.661 14.661
228 1HA GLY 33 HA2 GLY 33 68.956 16.950 16.950
229 2HA GLY 33 HA1 GLY 33 68.155 17.210 17.210
230 H GLY 34 HN GLY 34 67.761 14.030 14.030
231 1HA GLY 34 HA2 GLY 34 66.172 13.085 13.085
232 2HA GLY 34 HA1 GLY 34 65.123 14.410 14.410
233 H GLY 35 HN GLY 35 65.982 11.184 11.184
234 1HA GLY 35 HA2 GLY 35 64.048 10.260 10.260
235 2HA GLY 35 HA1 GLY 35 64.883 11.238 11.238
236 H ASP 36 HN ASP 36 67.511 10.603 10.603
237 HA ASP 36 HA ASP 36 67.889 7.725 7.725
238 1HB ASP 36 HB2 ASP 36 69.329 7.996 7.996
239 2HB ASP 36 HB1 ASP 36 67.591 8.171 8.171
240 H ILE 37 HN ILE 37 69.625 7.302 7.302
241 HA ILE 37 HA ILE 37 71.435 9.509 9.509
242 HB ILE 37 HB ILE 37 71.297 6.602 6.602
243 1HG1 ILE 37 HG12 ILE 37 70.167 8.890 8.890
244 2HG1 ILE 37 HG11 ILE 37 69.209 8.201 8.201
245 1HG2 ILE 37 HG22 ILE 37 72.606 9.079 9.079
246 2HG2 ILE 37 HG21 ILE 37 72.337 7.618 7.618
247 3HG2 ILE 37 HG23 ILE 37 73.382 7.567 7.567
248 HD1 ILE 37 HD1 ILE 37 68.734 6.350 6.350
249 HD1 ILE 37 HD1 ILE 37 69.382 7.207 7.207
250 HD1 ILE 37 HD1 ILE 37 70.422 6.134 6.134
251 H SER 38 HN SER 38 73.846 8.902 8.902
252 HA SER 38 HA SER 38 74.834 8.184 8.184
253 1HB SER 38 HB2 SER 38 76.178 8.413 8.413
254 2HB SER 38 HB1 SER 38 77.026 8.372 8.372
255 HG SER 38 HG SER 38 75.940 10.453 10.453
256 H THR 39 HN THR 39 75.448 6.175 6.175
257 HA THR 39 HA THR 39 74.632 3.753 3.753
258 HB THR 39 HB THR 39 76.507 2.844 2.844
259 HG1 THR 39 HG1 THR 39 77.362 4.485 4.485
260 1HG2 THR 39 HG22 THR 39 74.147 4.514 4.514
261 2HG2 THR 39 HG21 THR 39 75.259 4.119 4.119
262 3HG2 THR 39 HG23 THR 39 74.490 2.828 2.828
263 H LYS 40 HN LYS 40 77.370 5.730 5.730
264 HA LYS 40 HA LYS 40 78.836 3.562 3.562
265 1HB LYS 40 HB2 LYS 40 80.465 5.272 5.272
266 2HB LYS 40 HB1 LYS 40 79.775 5.621 5.621
267 1HG LYS 40 HG2 LYS 40 79.618 7.722 7.722
268 2HG LYS 40 HG1 LYS 40 78.068 7.057 7.057
269 1HD LYS 40 HD2 LYS 40 78.679 7.052 7.052
270 2HD LYS 40 HD1 LYS 40 80.264 6.370 6.370
271 1HE LYS 40 HE2 LYS 40 81.217 8.501 8.501
272 2HE LYS 40 HE1 LYS 40 79.628 9.267 9.267
273 1HZ LYS 40 HZ3 LYS 40 80.613 7.994 7.994
274 2HZ LYS 40 HZ2 LYS 40 80.592 9.668 9.668
275 3HZ LYS 40 HZ1 LYS 40 79.134 8.799 8.799
276 H GLU 41 HN GLU 41 76.440 5.970 5.970
277 HA GLU 41 HA GLU 41 76.885 5.605 5.605
278 1HB GLU 41 HB2 GLU 41 76.640 7.873 7.873
279 2HB GLU 41 HB1 GLU 41 75.164 7.447 7.447
280 1HG GLU 41 HG2 GLU 41 73.904 7.735 7.735
281 2HG GLU 41 HG1 GLU 41 74.983 6.724 6.724
282 H LEU 42 HN LEU 42 75.133 4.159 4.159
283 HA LEU 42 HA LEU 42 72.520 3.801 3.801
284 1HB LEU 42 HB2 LEU 42 73.657 3.097 3.097
285 2HB LEU 42 HB1 LEU 42 74.173 1.653 1.653
286 HG LEU 42 HG LEU 42 71.307 2.373 2.373
287 HD1 LEU 42 HD1 LEU 42 72.423 2.446 2.446
288 HD1 LEU 42 HD1 LEU 42 70.718 2.212 2.212
289 HD1 LEU 42 HD1 LEU 42 71.765 0.815 0.815
290 HD2 LEU 42 HD2 LEU 42 71.581 0.312 0.312
291 HD2 LEU 42 HD2 LEU 42 73.085 0.021 0.021
292 HD2 LEU 42 HD2 LEU 42 71.536 -0.268 -0.268
293 H GLY 43 HN GLY 43 75.519 2.649 2.649
294 1HA GLY 43 HA2 GLY 43 74.370 0.355 0.355
295 2HA GLY 43 HA1 GLY 43 76.006 0.985 0.985
296 H THR 44 HN THR 44 75.014 3.745 3.745
297 HA THR 44 HA THR 44 74.657 3.563 3.563
298 HB THR 44 HB THR 44 74.602 5.795 5.795
299 HG1 THR 44 HG1 THR 44 76.460 4.775 4.775
300 1HG2 THR 44 HG22 THR 44 73.203 6.347 6.347
301 2HG2 THR 44 HG21 THR 44 74.607 6.044 6.044
302 3HG2 THR 44 HG23 THR 44 74.633 7.368 7.368
303 H VAL 45 HN VAL 45 72.571 4.775 4.775
304 HA VAL 45 HA VAL 45 70.287 5.503 5.503
305 HB VAL 45 HB VAL 45 70.650 5.649 5.649
306 1HG1 VAL 45 HG12 VAL 45 70.133 2.661 2.661
307 2HG1 VAL 45 HG11 VAL 45 70.287 3.634 3.634
308 3HG1 VAL 45 HG13 VAL 45 71.671 3.431 3.431
309 1HG2 VAL 45 HG21 VAL 45 68.275 5.288 5.288
310 2HG2 VAL 45 HG23 VAL 45 68.406 5.651 5.651
311 3HG2 VAL 45 HG22 VAL 45 68.204 3.983 3.983
312 H MET 46 HN MET 46 71.355 2.204 2.204
313 HA MET 46 HA MET 46 68.941 0.957 0.957
314 1HB MET 46 HB2 MET 46 71.624 0.075 0.075
315 2HB MET 46 HB1 MET 46 70.539 -1.088 -1.088
316 1HG MET 46 HG2 MET 46 69.163 0.634 0.634
317 2HG MET 46 HG1 MET 46 70.455 -0.313 -0.313
318 1HE MET 46 HE2 MET 46 70.806 -2.461 -2.461
319 2HE MET 46 HE1 MET 46 70.454 -3.288 -3.288
320 3HE MET 46 HE3 MET 46 69.609 -3.754 -3.754
321 H ARG 47 HN ARG 47 72.165 1.789 1.789
322 HA ARG 47 HA ARG 47 71.996 0.183 0.183
323 1HB ARG 47 HB2 ARG 47 73.776 2.328 2.328
324 2HB ARG 47 HB1 ARG 47 73.978 1.820 1.820
325 1HG ARG 47 HG2 ARG 47 74.613 -0.343 -0.343
326 2HG ARG 47 HG1 ARG 47 73.801 -0.265 -0.265
327 1HD ARG 47 HD2 ARG 47 75.534 1.567 1.567
328 2HD ARG 47 HD1 ARG 47 76.443 0.965 0.965
329 HE ARG 47 HE ARG 47 75.513 -1.172 -1.172
330 1HH1 ARG 47 HH1 ARG 47 77.829 -2.077 -2.077
331 2HH1 ARG 47 HH1 ARG 47 79.128 -1.527 -1.527
332 1HH2 ARG 47 HH2 ARG 47 77.241 0.947 0.947
333 2HH2 ARG 47 HH2 ARG 47 78.795 0.187 0.187
334 H MET 48 HN MET 48 71.569 3.642 3.642
335 HA MET 48 HA MET 48 71.015 4.498 4.498
336 1HB MET 48 HB2 MET 48 70.706 5.531 5.531
337 2HB MET 48 HB1 MET 48 69.863 6.381 6.381
338 1HG MET 48 HG2 MET 48 72.802 5.691 5.691
339 2HG MET 48 HG1 MET 48 72.223 7.211 7.211
340 1HE MET 48 HE1 MET 48 72.999 8.845 8.845
341 2HE MET 48 HE3 MET 48 72.889 9.165 9.165
342 3HE MET 48 HE2 MET 48 74.052 7.992 7.992
343 H LEU 49 HN LEU 49 69.185 2.645 2.645
344 HA LEU 49 HA LEU 49 66.551 3.551 3.551
345 1HB LEU 49 HB2 LEU 49 67.649 1.672 1.672
346 2HB LEU 49 HB1 LEU 49 65.973 1.479 1.479
347 HG LEU 49 HG LEU 49 67.048 4.176 4.176
348 HD1 LEU 49 HD1 LEU 49 65.513 2.485 2.485
349 HD1 LEU 49 HD1 LEU 49 67.242 2.183 2.183
350 HD1 LEU 49 HD1 LEU 49 66.672 3.777 3.777
351 HD2 LEU 49 HD2 LEU 49 64.938 4.783 4.783
352 HD2 LEU 49 HD2 LEU 49 64.560 3.117 3.117
353 HD2 LEU 49 HD2 LEU 49 64.331 3.664 3.664
354 H GLY 50 HN GLY 50 68.608 0.634 0.634
355 1HA GLY 50 HA2 GLY 50 68.292 -0.183 -0.183
356 2HA GLY 50 HA1 GLY 50 66.737 -0.658 -0.658
357 H GLN 51 HN GLN 51 68.306 -1.045 -1.045
358 HA GLN 51 HA GLN 51 68.993 -3.878 -3.878
359 1HB GLN 51 HB2 GLN 51 68.940 -2.427 -2.427
360 2HB GLN 51 HB1 GLN 51 68.699 -4.149 -4.149
361 1HG GLN 51 HG2 GLN 51 66.839 -1.887 -1.887
362 2HG GLN 51 HG1 GLN 51 66.532 -3.162 -3.162
363 1HE2 GLN 51 HE22 GLN 51 65.426 -3.854 -3.854
364 2HE2 GLN 51 HE21 GLN 51 65.623 -2.320 -2.320
365 H ASN 52 HN ASN 52 70.885 -4.506 -4.506
366 HA ASN 52 HA ASN 52 73.095 -2.564 -2.564
367 1HB ASN 52 HB2 ASN 52 72.723 -3.947 -3.947
368 2HB ASN 52 HB1 ASN 52 73.726 -5.103 -5.103
369 HD2 ASN 52 HD2 ASN 52 75.812 -4.131 -4.131
370 HD2 ASN 52 HD2 ASN 52 76.589 -2.909 -2.909
371 HA PRO 53 HA PRO 53 73.279 -5.563 -5.563
372 1HB PRO 53 HB2 PRO 53 74.212 -3.756 -3.756
373 2HB PRO 53 HB1 PRO 53 72.489 -3.938 -3.938
374 1HG PRO 53 HG2 PRO 53 74.426 -1.882 -1.882
375 2HG PRO 53 HG1 PRO 53 72.718 -1.711 -1.711
376 1HD PRO 53 HD2 PRO 53 73.632 -1.822 -1.822
377 2HD PRO 53 HD1 PRO 53 71.996 -2.315 -2.315
378 H THR 54 HN THR 54 75.101 -6.843 -6.843
379 HA THR 54 HA THR 54 77.620 -6.108 -6.108
380 HB THR 54 HB THR 54 78.053 -8.149 -8.149
381 HG1 THR 54 HG1 THR 54 76.075 -9.401 -9.401
382 1HG2 THR 54 HG21 THR 54 77.181 -8.126 -8.126
383 2HG2 THR 54 HG23 THR 54 77.589 -9.619 -9.619
384 3HG2 THR 54 HG22 THR 54 78.805 -8.358 -8.358
385 H LYS 55 HN LYS 55 79.580 -5.458 -5.458
386 HA LYS 55 HA LYS 55 79.504 -3.605 -3.605
387 1HB LYS 55 HB2 LYS 55 81.330 -4.407 -4.407
388 2HB LYS 55 HB1 LYS 55 81.903 -5.358 -5.358
389 1HG LYS 55 HG2 LYS 55 82.700 -3.531 -3.531
390 2HG LYS 55 HG1 LYS 55 81.254 -2.587 -2.587
391 1HD LYS 55 HD2 LYS 55 83.194 -3.204 -3.204
392 2HD LYS 55 HD1 LYS 55 83.559 -1.902 -1.902
393 1HE LYS 55 HE2 LYS 55 80.817 -1.623 -1.623
394 2HE LYS 55 HE1 LYS 55 81.777 -1.819 -1.819
395 1HZ LYS 55 HZ3 LYS 55 83.358 -0.184 -0.184
396 2HZ LYS 55 HZ2 LYS 55 82.345 0.062 0.062
397 3HZ LYS 55 HZ1 LYS 55 81.814 0.484 0.484
398 H GLU 56 HN GLU 56 80.672 -6.996 -6.996
399 HA GLU 56 HA GLU 56 81.090 -7.177 -7.177
400 1HB GLU 56 HB2 GLU 56 80.869 -8.876 -8.876
401 2HB GLU 56 HB1 GLU 56 79.659 -9.487 -9.487
402 1HG GLU 56 HG2 GLU 56 82.495 -8.857 -8.857
403 2HG GLU 56 HG1 GLU 56 82.010 -10.451 -10.451
404 H GLU 57 HN GLU 57 77.983 -7.397 -7.397
405 HA GLU 57 HA GLU 57 76.381 -8.047 -8.047
406 1HB GLU 57 HB2 GLU 57 75.858 -6.802 -6.802
407 2HB GLU 57 HB1 GLU 57 74.559 -7.159 -7.159
408 1HG GLU 57 HG2 GLU 57 75.844 -9.528 -9.528
409 2HG GLU 57 HG1 GLU 57 76.254 -9.022 -9.022
410 H LEU 58 HN LEU 58 77.023 -4.942 -4.942
411 HA LEU 58 HA LEU 58 75.481 -3.196 -3.196
412 1HB LEU 58 HB2 LEU 58 78.265 -2.943 -2.943
413 2HB LEU 58 HB1 LEU 58 77.357 -1.565 -1.565
414 HG LEU 58 HG LEU 58 76.549 -3.395 -3.395
415 HD1 LEU 58 HD1 LEU 58 77.496 -0.552 -0.552
416 HD1 LEU 58 HD1 LEU 58 78.007 -1.797 -1.797
417 HD1 LEU 58 HD1 LEU 58 76.440 -1.011 -1.011
418 HD2 LEU 58 HD2 LEU 58 74.688 -1.446 -1.446
419 HD2 LEU 58 HD2 LEU 58 74.462 -2.957 -2.957
420 HD2 LEU 58 HD2 LEU 58 75.007 -1.512 -1.512
421 H ASP 59 HN ASP 59 78.879 -4.140 -4.140
422 HA ASP 59 HA ASP 59 79.067 -2.831 -2.831
423 1HB ASP 59 HB2 ASP 59 80.963 -3.675 -3.675
424 2HB ASP 59 HB1 ASP 59 80.408 -5.331 -5.331
425 H ALA 60 HN ALA 60 77.704 -5.933 -5.933
426 HA ALA 60 HA ALA 60 77.471 -6.959 -6.959
427 1HB ALA 60 HB1 ALA 60 76.408 -7.736 -7.736
428 2HB ALA 60 HB3 ALA 60 76.036 -8.660 -8.660
429 3HB ALA 60 HB2 ALA 60 77.707 -8.508 -8.508
430 H ILE 61 HN ILE 61 75.298 -5.436 -5.436
431 HA ILE 61 HA ILE 61 72.943 -5.621 -5.621
432 HB ILE 61 HB ILE 61 73.676 -4.078 -4.078
433 1HG1 ILE 61 HG12 ILE 61 71.545 -6.035 -6.035
434 2HG1 ILE 61 HG11 ILE 61 72.998 -6.772 -6.772
435 1HG2 ILE 61 HG23 ILE 61 71.380 -3.817 -3.817
436 2HG2 ILE 61 HG22 ILE 61 70.906 -4.208 -4.208
437 3HG2 ILE 61 HG21 ILE 61 71.884 -2.776 -2.776
438 HD1 ILE 61 HD1 ILE 61 72.544 -6.358 -6.358
439 HD1 ILE 61 HD1 ILE 61 73.545 -4.973 -4.973
440 HD1 ILE 61 HD1 ILE 61 74.128 -6.609 -6.609
441 H ILE 62 HN ILE 62 75.269 -3.037 -3.037
442 HA ILE 62 HA ILE 62 74.072 -0.864 -0.864
443 HB ILE 62 HB ILE 62 76.933 -1.738 -1.738
444 1HG1 ILE 62 HG12 ILE 62 75.216 0.451 0.451
445 2HG1 ILE 62 HG11 ILE 62 75.545 -1.114 -1.114
446 1HG2 ILE 62 HG23 ILE 62 75.886 0.454 0.454
447 2HG2 ILE 62 HG22 ILE 62 77.055 0.972 0.972
448 3HG2 ILE 62 HG21 ILE 62 77.498 -0.261 -0.261
449 HD1 ILE 62 HD1 ILE 62 77.622 0.972 0.972
450 HD1 ILE 62 HD1 ILE 62 77.969 -0.606 -0.606
451 HD1 ILE 62 HD1 ILE 62 77.068 0.594 0.594
452 H GLU 63 HN GLU 63 76.559 -3.076 -3.076
453 HA GLU 63 HA GLU 63 76.570 -2.202 -2.202
454 1HB GLU 63 HB2 GLU 63 77.966 -3.974 -3.974
455 2HB GLU 63 HB1 GLU 63 76.644 -5.096 -5.096
456 1HG GLU 63 HG2 GLU 63 77.173 -5.273 -5.273
457 2HG GLU 63 HG1 GLU 63 77.496 -3.545 -3.545
458 H GLU 64 HN GLU 64 74.317 -4.464 -4.464
459 HA GLU 64 HA GLU 64 72.839 -5.243 -5.243
460 1HB GLU 64 HB2 GLU 64 72.509 -6.510 -6.510
461 2HB GLU 64 HB1 GLU 64 72.386 -5.082 -5.082
462 1HG GLU 64 HG2 GLU 64 70.177 -4.610 -4.610
463 2HG GLU 64 HG1 GLU 64 70.316 -5.705 -5.705
464 H VAL 65 HN VAL 65 72.464 -2.503 -2.503
465 HA VAL 65 HA VAL 65 70.168 -1.463 -1.463
466 HB VAL 65 HB VAL 65 69.872 -0.022 -0.022
467 1HG1 VAL 65 HG13 VAL 65 70.147 -2.821 -2.821
468 2HG1 VAL 65 HG12 VAL 65 70.883 -2.116 -2.116
469 3HG1 VAL 65 HG11 VAL 65 69.212 -1.735 -1.735
470 1HG2 VAL 65 HG23 VAL 65 72.283 0.666 0.666
471 2HG2 VAL 65 HG22 VAL 65 71.588 0.309 0.309
472 3HG2 VAL 65 HG21 VAL 65 72.641 -0.867 -0.867
473 H ASP 66 HN ASP 66 73.538 -1.232 -1.232
474 HA ASP 66 HA ASP 66 73.563 1.590 1.590
475 1HB ASP 66 HB2 ASP 66 75.157 0.812 0.812
476 2HB ASP 66 HB1 ASP 66 75.786 -0.386 -0.386
477 H GLU 67 HN GLU 67 72.268 0.295 0.295
478 HA GLU 67 HA GLU 67 73.855 -1.206 -1.206
479 1HB GLU 67 HB2 GLU 67 71.305 -1.059 -1.059
480 2HB GLU 67 HB1 GLU 67 71.387 0.446 0.446
481 1HG GLU 67 HG2 GLU 67 71.293 -0.785 -0.785
482 2HG GLU 67 HG1 GLU 67 72.901 -1.392 -1.392
483 H ASP 68 HN ASP 68 73.988 2.045 2.045
484 HA ASP 68 HA ASP 68 74.837 2.919 2.919
485 1HB ASP 68 HB2 ASP 68 73.711 4.201 4.201
486 2HB ASP 68 HB1 ASP 68 74.723 5.186 5.186
487 H GLY 69 HN GLY 69 75.927 2.518 2.518
488 1HA GLY 69 HA2 GLY 69 78.281 2.089 2.089
489 2HA GLY 69 HA1 GLY 69 78.707 3.059 3.059
490 H SER 70 HN SER 70 76.912 5.253 5.253
491 HA SER 70 HA SER 70 78.196 6.345 6.345
492 1HB SER 70 HB2 SER 70 78.334 7.137 7.137
493 2HB SER 70 HB1 SER 70 77.553 8.418 8.418
494 HG SER 70 HG SER 70 80.134 7.733 7.733
495 H GLY 71 HN GLY 71 75.344 5.274 5.274
496 1HA GLY 71 HA2 GLY 71 73.676 7.587 7.587
497 2HA GLY 71 HA1 GLY 71 73.084 6.027 6.027
498 H THR 72 HN THR 72 72.473 7.703 7.703
499 HA THR 72 HA THR 72 73.423 6.070 6.070
500 HB THR 72 HB THR 72 71.604 7.594 7.594
501 HG1 THR 72 HG1 THR 72 70.773 9.111 9.111
502 1HG2 THR 72 HG23 THR 72 74.240 7.869 7.869
503 2HG2 THR 72 HG22 THR 72 73.719 9.225 9.225
504 3HG2 THR 72 HG21 THR 72 73.259 9.155 9.155
505 H ILE 73 HN ILE 73 71.164 5.763 5.763
506 HA ILE 73 HA ILE 73 69.647 3.682 3.682
507 HB ILE 73 HB ILE 73 70.884 2.952 2.952
508 1HG1 ILE 73 HG12 ILE 73 68.725 2.455 2.455
509 2HG1 ILE 73 HG11 ILE 73 67.898 3.035 3.035
510 1HG2 ILE 73 HG22 ILE 73 69.818 5.469 5.469
511 2HG2 ILE 73 HG21 ILE 73 69.641 4.119 4.119
512 3HG2 ILE 73 HG23 ILE 73 71.236 4.549 4.549
513 HD1 ILE 73 HD1 ILE 73 69.947 1.301 1.301
514 HD1 ILE 73 HD1 ILE 73 68.207 1.011 1.011
515 HD1 ILE 73 HD1 ILE 73 69.161 0.482 0.482
516 H ASP 74 HN ASP 74 67.403 3.826 3.826
517 HA ASP 74 HA ASP 74 66.161 6.412 6.412
518 1HB ASP 74 HB2 ASP 74 65.158 3.836 3.836
519 2HB ASP 74 HB1 ASP 74 64.247 5.346 5.346
520 H PHE 75 HN PHE 75 64.809 6.784 6.784
521 HA PHE 75 HA PHE 75 64.709 5.224 5.224
522 1HB PHE 75 HB2 PHE 75 63.922 7.587 7.587
523 2HB PHE 75 HB1 PHE 75 62.473 6.940 6.940
524 HD1 PHE 75 HD2 PHE 75 60.947 5.416 5.416
525 HD2 PHE 75 HD1 PHE 75 64.134 7.648 7.648
526 HE1 PHE 75 HE2 PHE 75 59.902 5.095 5.095
527 HE2 PHE 75 HE1 PHE 75 63.090 7.326 7.326
528 HZ PHE 75 HZ PHE 75 60.974 6.049 6.049
529 H GLU 76 HN GLU 76 62.182 5.291 5.291
530 HA GLU 76 HA GLU 76 60.519 3.257 3.257
531 1HB GLU 76 HB2 GLU 76 61.096 4.572 4.572
532 2HB GLU 76 HB1 GLU 76 60.370 2.972 2.972
533 1HG GLU 76 HG2 GLU 76 58.818 3.993 3.993
534 2HG GLU 76 HG1 GLU 76 59.214 5.475 5.475
535 H GLU 77 HN GLU 77 63.226 2.916 2.916
536 HA GLU 77 HA GLU 77 63.080 0.023 0.023
537 1HB GLU 77 HB2 GLU 77 64.025 1.346 1.346
538 2HB GLU 77 HB1 GLU 77 65.224 2.046 2.046
539 1HG GLU 77 HG2 GLU 77 66.214 0.228 0.228
540 2HG GLU 77 HG1 GLU 77 66.197 -0.191 -0.191
541 H PHE 78 HN PHE 78 64.605 2.352 2.352
542 HA PHE 78 HA PHE 78 66.593 0.566 0.566
543 1HB PHE 78 HB2 PHE 78 66.939 2.920 2.920
544 2HB PHE 78 HB1 PHE 78 65.311 3.199 3.199
545 HD1 PHE 78 HD1 PHE 78 68.548 1.526 1.526
546 HD2 PHE 78 HD2 PHE 78 64.901 3.250 3.250
547 HE1 PHE 78 HE1 PHE 78 69.393 1.320 1.320
548 HE2 PHE 78 HE2 PHE 78 65.745 3.043 3.043
549 HZ PHE 78 HZ PHE 78 67.994 2.080 2.080
550 H LEU 79 HN LEU 79 63.196 1.191 1.191
551 HA LEU 79 HA LEU 79 62.787 0.374 0.374
552 1HB LEU 79 HB2 LEU 79 61.323 0.388 0.388
553 2HB LEU 79 HB1 LEU 79 60.688 -0.741 -0.741
554 HG LEU 79 HG LEU 79 60.207 0.961 0.961
555 HD1 LEU 79 HD1 LEU 79 61.145 3.393 3.393
556 HD1 LEU 79 HD1 LEU 79 62.458 2.319 2.319
557 HD1 LEU 79 HD1 LEU 79 61.945 2.385 2.385
558 HD2 LEU 79 HD2 LEU 79 58.685 2.267 2.267
559 HD2 LEU 79 HD2 LEU 79 59.045 1.079 1.079
560 HD2 LEU 79 HD2 LEU 79 59.831 2.658 2.658
561 H VAL 80 HN VAL 80 63.682 -1.550 -1.550
562 HA VAL 80 HA VAL 80 63.023 -4.145 -4.145
563 HB VAL 80 HB VAL 80 64.282 -4.932 -4.932
564 1HG1 VAL 80 HG13 VAL 80 62.447 -2.675 -2.675
565 2HG1 VAL 80 HG12 VAL 80 63.551 -2.747 -2.747
566 3HG1 VAL 80 HG11 VAL 80 62.538 -4.136 -4.136
567 1HG2 VAL 80 HG21 VAL 80 65.597 -2.231 -2.231
568 2HG2 VAL 80 HG23 VAL 80 66.351 -3.822 -3.822
569 3HG2 VAL 80 HG22 VAL 80 65.606 -3.096 -3.096
570 H MET 81 HN MET 81 65.862 -2.038 -2.038
571 HA MET 81 HA MET 81 67.653 -4.017 -4.017
572 1HB MET 81 HB2 MET 81 67.531 -1.079 -1.079
573 2HB MET 81 HB1 MET 81 68.667 -1.627 -1.627
574 1HG MET 81 HG2 MET 81 68.753 -3.295 -3.295
575 2HG MET 81 HG1 MET 81 69.132 -1.608 -1.608
576 1HE MET 81 HE3 MET 81 69.395 -3.765 -3.765
577 2HE MET 81 HE2 MET 81 70.209 -4.870 -4.870
578 3HE MET 81 HE1 MET 81 71.116 -4.116 -4.116
579 H MET 82 HN MET 82 65.287 -1.763 -1.763
580 HA MET 82 HA MET 82 66.155 -1.997 -1.997
581 1HB MET 82 HB2 MET 82 63.569 -1.125 -1.125
582 2HB MET 82 HB1 MET 82 63.945 -0.876 -0.876
583 1HG MET 82 HG2 MET 82 65.529 0.211 0.211
584 2HG MET 82 HG1 MET 82 64.478 1.147 1.147
585 1HE MET 82 HE1 MET 82 64.671 0.696 0.696
586 2HE MET 82 HE3 MET 82 65.358 -0.934 -0.934
587 3HE MET 82 HE2 MET 82 66.185 0.373 0.373
588 H VAL 83 HN VAL 83 63.472 -3.425 -3.425
589 HA VAL 83 HA VAL 83 62.522 -5.094 -5.094
590 HB VAL 83 HB VAL 83 62.176 -5.325 -5.325
591 1HG1 VAL 83 HG13 VAL 83 60.771 -6.491 -6.491
592 2HG1 VAL 83 HG12 VAL 83 59.888 -6.229 -6.229
593 3HG1 VAL 83 HG11 VAL 83 61.293 -7.296 -7.296
594 1HG2 VAL 83 HG21 VAL 83 61.327 -3.304 -3.304
595 2HG2 VAL 83 HG23 VAL 83 61.074 -3.364 -3.364
596 3HG2 VAL 83 HG22 VAL 83 59.922 -4.142 -4.142
597 H ARG 84 HN ARG 84 64.104 -6.009 -6.009
598 HA ARG 84 HA ARG 84 64.627 -8.682 -8.682
599 1HB ARG 84 HB2 ARG 84 66.488 -6.556 -6.556
600 2HB ARG 84 HB1 ARG 84 66.638 -8.286 -8.286
601 1HG ARG 84 HG2 ARG 84 63.957 -7.140 -7.140
602 2HG ARG 84 HG1 ARG 84 65.236 -6.591 -6.591
603 1HD ARG 84 HD2 ARG 84 65.125 -8.557 -8.557
604 2HD ARG 84 HD1 ARG 84 65.521 -9.429 -9.429
605 HE ARG 84 HE ARG 84 62.792 -8.571 -8.571
606 1HH1 ARG 84 HH2 ARG 84 63.866 -11.357 -11.357
607 2HH1 ARG 84 HH2 ARG 84 63.082 -12.285 -12.285
608 1HH2 ARG 84 HH1 ARG 84 62.206 -9.518 -9.518
609 2HH2 ARG 84 HH1 ARG 84 62.142 -11.245 -11.245
610 H GLN 85 HN GLN 85 66.253 -5.939 -5.939
611 HA GLN 85 HA GLN 85 68.256 -7.655 -7.655
612 1HB GLN 85 HB2 GLN 85 68.802 -5.384 -5.384
613 2HB GLN 85 HB1 GLN 85 67.510 -4.721 -4.721
614 1HG GLN 85 HG2 GLN 85 69.628 -4.459 -4.459
615 2HG GLN 85 HG1 GLN 85 68.657 -5.671 -5.671
616 1HE2 GLN 85 HE22 GLN 85 71.849 -7.015 -7.015
617 2HE2 GLN 85 HE21 GLN 85 71.025 -5.618 -5.618
618 H MET 86 HN MET 86 65.320 -5.834 -5.834
619 HA MET 86 HA MET 86 65.445 -6.454 -6.454
620 1HB MET 86 HB2 MET 86 63.756 -5.072 -5.072
621 2HB MET 86 HB1 MET 86 62.777 -6.006 -6.006
622 1HG MET 86 HG2 MET 86 64.434 -4.968 -4.968
623 2HG MET 86 HG1 MET 86 64.650 -3.734 -3.734
624 1HE MET 86 HE2 MET 86 62.974 -5.369 -5.369
625 2HE MET 86 HE1 MET 86 62.083 -4.017 -4.017
626 3HE MET 86 HE3 MET 86 61.232 -5.260 -5.260
627 H LYS 87 HN LYS 87 64.124 -8.085 -8.085
628 HA LYS 87 HA LYS 87 62.314 -9.903 -9.903
629 1HB LYS 87 HB2 LYS 87 64.403 -10.075 -10.075
630 2HB LYS 87 HB1 LYS 87 63.342 -11.443 -11.443
631 1HG LYS 87 HG2 LYS 87 62.197 -8.688 -8.688
632 2HG LYS 87 HG1 LYS 87 62.590 -9.713 -9.713
633 1HD LYS 87 HD2 LYS 87 61.028 -10.948 -10.948
634 2HD LYS 87 HD1 LYS 87 60.187 -9.803 -9.803
635 1HE LYS 87 HE2 LYS 87 61.479 -11.285 -11.285
636 2HE LYS 87 HE1 LYS 87 61.214 -12.515 -12.515
637 1HZ LYS 87 HZ1 LYS 87 59.043 -10.643 -10.643
638 2HZ LYS 87 HZ3 LYS 87 59.324 -11.936 -11.936
639 3HZ LYS 87 HZ2 LYS 87 58.957 -12.242 -12.242
640 H GLU 88 HN GLU 88 65.776 -9.712 -9.712
641 HA GLU 88 HA GLU 88 65.892 -12.360 -12.360
642 1HB GLU 88 HB2 GLU 88 67.580 -10.861 -10.861
643 2HB GLU 88 HB1 GLU 88 68.343 -10.798 -10.798
644 1HG GLU 88 HG2 GLU 88 68.440 -13.179 -13.179
645 2HG GLU 88 HG1 GLU 88 67.349 -13.384 -13.384
646 H ASP 89 HN ASP 89 66.392 -8.881 -8.881
647 HA ASP 89 HA ASP 89 67.183 -9.195 -9.195
648 1HB ASP 89 HB2 ASP 89 67.346 -7.261 -7.261
649 2HB ASP 89 HB1 ASP 89 65.992 -6.658 -6.658
650 H ALA 90 HN ALA 90 64.144 -8.685 -8.685
651 HA ALA 90 HA ALA 90 62.519 -7.922 -7.922
652 1HB ALA 90 HB3 ALA 90 62.130 -7.883 -7.883
653 2HB ALA 90 HB2 ALA 90 61.598 -9.552 -9.552
654 3HB ALA 90 HB1 ALA 90 60.751 -8.247 -8.247
Start of MODEL 33
1 1H ALA 1 HT3 ALA 1 64.710 -4.366 -4.366
2 2H ALA 1 HT2 ALA 1 65.458 -3.183 -3.183
3 3H ALA 1 HT1 ALA 1 66.304 -3.889 -3.889
4 HA ALA 1 HA ALA 1 66.670 -5.864 -5.864
5 1HB ALA 1 HB3 ALA 1 66.901 -3.331 -3.331
6 2HB ALA 1 HB2 ALA 1 66.821 -4.705 -4.705
7 3HB ALA 1 HB1 ALA 1 68.072 -4.643 -4.643
8 H SER 2 HN SER 2 66.127 -7.198 -7.198
9 HA SER 2 HA SER 2 63.219 -7.551 -7.551
10 1HB SER 2 HB2 SER 2 64.214 -9.607 -9.607
11 2HB SER 2 HB1 SER 2 65.713 -8.953 -8.953
12 HG SER 2 HG SER 2 63.414 -9.852 -9.852
13 H MET 3 HN MET 3 65.285 -5.457 -5.457
14 HA MET 3 HA MET 3 64.433 -5.697 -5.697
15 1HB MET 3 HB2 MET 3 66.122 -4.046 -4.046
16 2HB MET 3 HB1 MET 3 65.242 -3.060 -3.060
17 1HG MET 3 HG2 MET 3 66.478 -5.582 -5.582
18 2HG MET 3 HG1 MET 3 67.565 -4.247 -4.247
19 1HE MET 3 HE1 MET 3 66.613 -5.982 -5.982
20 2HE MET 3 HE3 MET 3 66.642 -4.965 -4.965
21 3HE MET 3 HE2 MET 3 65.104 -5.470 -5.470
22 H THR 4 HN THR 4 63.345 -3.737 -3.737
23 HA THR 4 HA THR 4 61.563 -1.968 -1.968
24 HB THR 4 HB THR 4 62.160 -2.096 -2.096
25 HG1 THR 4 HG1 THR 4 60.238 -1.021 -1.021
26 1HG2 THR 4 HG22 THR 4 61.094 -4.754 -4.754
27 2HG2 THR 4 HG21 THR 4 60.215 -3.916 -3.916
28 3HG2 THR 4 HG23 THR 4 61.969 -4.079 -4.079
29 H ASP 5 HN ASP 5 61.305 -5.434 -5.434
30 HA ASP 5 HA ASP 5 58.414 -5.500 -5.500
31 1HB ASP 5 HB2 ASP 5 60.297 -7.142 -7.142
32 2HB ASP 5 HB1 ASP 5 59.980 -7.960 -7.960
33 H GLN 6 HN GLN 6 61.425 -6.440 -6.440
34 HA GLN 6 HA GLN 6 60.129 -7.189 -7.189
35 1HB GLN 6 HB2 GLN 6 62.634 -7.337 -7.337
36 2HB GLN 6 HB1 GLN 6 62.879 -6.141 -6.141
37 1HG GLN 6 HG2 GLN 6 61.723 -8.923 -8.923
38 2HG GLN 6 HG1 GLN 6 63.304 -8.368 -8.368
39 1HE2 GLN 6 HE22 GLN 6 62.031 -6.982 -6.982
40 2HE2 GLN 6 HE21 GLN 6 63.392 -7.430 -7.430
41 H GLN 7 HN GLN 7 60.672 -4.144 -4.144
42 HA GLN 7 HA GLN 7 61.140 -2.528 -2.528
43 1HB GLN 7 HB2 GLN 7 61.621 -1.767 -1.767
44 2HB GLN 7 HB1 GLN 7 59.935 -1.981 -1.981
45 1HG GLN 7 HG2 GLN 7 59.538 -0.343 -0.343
46 2HG GLN 7 HG1 GLN 7 61.180 0.160 0.160
47 1HE2 GLN 7 HE21 GLN 7 57.900 0.628 0.628
48 2HE2 GLN 7 HE22 GLN 7 58.130 1.411 1.411
49 H ALA 8 HN ALA 8 58.168 -2.515 -2.515
50 HA ALA 8 HA ALA 8 56.423 -1.372 -1.372
51 1HB ALA 8 HB3 ALA 8 56.320 -2.986 -2.986
52 2HB ALA 8 HB2 ALA 8 54.959 -3.351 -3.351
53 3HB ALA 8 HB1 ALA 8 55.236 -1.696 -1.696
54 H GLU 9 HN GLU 9 57.470 -4.758 -4.758
55 HA GLU 9 HA GLU 9 55.636 -5.637 -5.637
56 1HB GLU 9 HB2 GLU 9 56.699 -6.881 -6.881
57 2HB GLU 9 HB1 GLU 9 58.052 -7.142 -7.142
58 1HG GLU 9 HG2 GLU 9 55.229 -7.767 -7.767
59 2HG GLU 9 HG1 GLU 9 56.176 -8.937 -8.937
60 H ALA 10 HN ALA 10 58.923 -4.449 -4.449
61 HA ALA 10 HA ALA 10 59.971 -5.484 -5.484
62 1HB ALA 10 HB1 ALA 10 60.575 -3.425 -3.425
63 2HB ALA 10 HB3 ALA 10 61.223 -3.070 -3.070
64 3HB ALA 10 HB2 ALA 10 61.656 -4.574 -4.574
65 H ARG 11 HN ARG 11 58.042 -2.588 -2.588
66 HA ARG 11 HA ARG 11 58.271 -1.508 -1.508
67 1HB ARG 11 HB2 ARG 11 56.149 -0.769 -0.769
68 2HB ARG 11 HB1 ARG 11 57.012 0.274 0.274
69 1HG ARG 11 HG2 ARG 11 58.384 0.827 0.827
70 2HG ARG 11 HG1 ARG 11 59.009 -0.821 -0.821
71 1HD ARG 11 HD2 ARG 11 58.268 -0.521 -0.521
72 2HD ARG 11 HD1 ARG 11 56.959 -1.435 -1.435
73 HE ARG 11 HE ARG 11 56.739 1.506 1.506
74 1HH1 ARG 11 HH2 ARG 11 54.454 -0.453 -0.453
75 2HH1 ARG 11 HH2 ARG 11 53.632 -0.271 -0.271
76 1HH2 ARG 11 HH1 ARG 11 56.293 1.319 1.319
77 2HH2 ARG 11 HH1 ARG 11 54.673 0.732 0.732
78 H ALA 12 HN ALA 12 55.819 -3.264 -3.264
79 HA ALA 12 HA ALA 12 53.631 -3.196 -3.196
80 1HB ALA 12 HB1 ALA 12 54.627 -4.731 -4.731
81 2HB ALA 12 HB3 ALA 12 53.859 -5.818 -5.818
82 3HB ALA 12 HB2 ALA 12 52.952 -4.463 -4.463
83 H PHE 13 HN PHE 13 56.669 -4.903 -4.903
84 HA PHE 13 HA PHE 13 56.003 -6.964 -6.964
85 1HB PHE 13 HB2 PHE 13 58.227 -6.743 -6.743
86 2HB PHE 13 HB1 PHE 13 58.362 -5.086 -5.086
87 HD1 PHE 13 HD1 PHE 13 57.205 -8.274 -8.274
88 HD2 PHE 13 HD2 PHE 13 59.955 -4.978 -4.978
89 HE1 PHE 13 HE1 PHE 13 58.129 -9.108 -9.108
90 HE2 PHE 13 HE2 PHE 13 60.882 -5.809 -5.809
91 HZ PHE 13 HZ PHE 13 59.968 -7.875 -7.875
92 H LEU 14 HN LEU 14 56.453 -3.494 -3.494
93 HA LEU 14 HA LEU 14 55.661 -3.953 -3.953
94 1HB LEU 14 HB2 LEU 14 56.903 -1.561 -1.561
95 2HB LEU 14 HB1 LEU 14 56.688 -1.743 -1.743
96 HG LEU 14 HG LEU 14 58.174 -3.873 -3.873
97 HD1 LEU 14 HD1 LEU 14 60.279 -2.598 -2.598
98 HD1 LEU 14 HD1 LEU 14 59.332 -1.206 -1.206
99 HD1 LEU 14 HD1 LEU 14 59.198 -1.787 -1.787
100 HD2 LEU 14 HD2 LEU 14 59.370 -3.998 -3.998
101 HD2 LEU 14 HD2 LEU 14 57.627 -4.151 -4.151
102 HD2 LEU 14 HD2 LEU 14 58.432 -2.625 -2.625
103 H SER 15 HN SER 15 54.177 -2.234 -2.234
104 HA SER 15 HA SER 15 51.841 -1.892 -1.892
105 1HB SER 15 HB2 SER 15 52.263 -0.512 -0.512
106 2HB SER 15 HB1 SER 15 50.814 -1.296 -1.296
107 HG SER 15 HG SER 15 51.626 -3.236 -3.236
108 H GLU 16 HN GLU 16 50.838 0.295 0.295
109 HA GLU 16 HA GLU 16 52.576 2.140 2.140
110 1HB GLU 16 HB2 GLU 16 50.170 1.940 1.940
111 2HB GLU 16 HB1 GLU 16 49.816 2.468 2.468
112 1HG GLU 16 HG2 GLU 16 50.721 4.660 4.660
113 2HG GLU 16 HG1 GLU 16 51.357 4.151 4.151
114 H GLU 17 HN GLU 17 51.278 2.086 2.086
115 HA GLU 17 HA GLU 17 52.123 4.664 4.664
116 1HB GLU 17 HB2 GLU 17 52.020 3.572 3.572
117 2HB GLU 17 HB1 GLU 17 50.606 3.236 3.236
118 1HG GLU 17 HG2 GLU 17 51.003 1.032 1.032
119 2HG GLU 17 HG1 GLU 17 52.564 1.253 1.253
120 H MET 18 HN MET 18 53.940 1.707 1.707
121 HA MET 18 HA MET 18 56.285 2.584 2.584
122 1HB MET 18 HB2 MET 18 55.877 0.244 0.244
123 2HB MET 18 HB1 MET 18 55.601 0.328 0.328
124 1HG MET 18 HG2 MET 18 57.852 -0.616 -0.616
125 2HG MET 18 HG1 MET 18 57.933 0.784 0.784
126 1HE MET 18 HE2 MET 18 58.101 -0.596 -0.596
127 2HE MET 18 HE1 MET 18 59.665 -0.787 -0.787
128 3HE MET 18 HE3 MET 18 59.511 0.242 0.242
129 H ILE 19 HN ILE 19 55.424 2.293 2.293
130 HA ILE 19 HA ILE 19 57.806 3.034 3.034
131 HB ILE 19 HB ILE 19 54.904 3.694 3.694
132 1HG1 ILE 19 HG12 ILE 19 56.844 1.877 1.877
133 2HG1 ILE 19 HG11 ILE 19 55.802 1.324 1.324
134 1HG2 ILE 19 HG21 ILE 19 57.228 4.932 4.932
135 2HG2 ILE 19 HG23 ILE 19 56.410 3.944 3.944
136 3HG2 ILE 19 HG22 ILE 19 55.525 5.213 5.213
137 HD1 ILE 19 HD1 ILE 19 54.005 2.646 2.646
138 HD1 ILE 19 HD1 ILE 19 54.305 0.910 0.910
139 HD1 ILE 19 HD1 ILE 19 55.116 1.993 1.993
140 H ALA 20 HN ALA 20 55.566 5.091 5.091
141 HA ALA 20 HA ALA 20 56.815 7.603 7.603
142 1HB ALA 20 HB1 ALA 20 54.591 6.607 6.607
143 2HB ALA 20 HB3 ALA 20 55.390 7.993 7.993
144 3HB ALA 20 HB2 ALA 20 54.731 8.124 8.124
145 H GLU 21 HN GLU 21 57.710 5.114 5.114
146 HA GLU 21 HA GLU 21 59.037 6.823 6.823
147 1HB GLU 21 HB2 GLU 21 58.074 4.742 4.742
148 2HB GLU 21 HB1 GLU 21 58.883 3.852 3.852
149 1HG GLU 21 HG2 GLU 21 60.066 3.502 3.502
150 2HG GLU 21 HG1 GLU 21 61.080 4.427 4.427
151 H PHE 22 HN PHE 22 60.111 4.452 4.452
152 HA PHE 22 HA PHE 22 62.915 5.023 5.023
153 1HB PHE 22 HB2 PHE 22 61.223 3.876 3.876
154 2HB PHE 22 HB1 PHE 22 62.985 3.828 3.828
155 HD1 PHE 22 HD2 PHE 22 62.253 3.658 3.658
156 HD2 PHE 22 HD1 PHE 22 61.839 1.272 1.272
157 HE1 PHE 22 HE2 PHE 22 62.179 1.606 1.606
158 HE2 PHE 22 HE1 PHE 22 61.764 -0.781 -0.781
159 HZ PHE 22 HZ PHE 22 61.934 -0.614 -0.614
160 H LYS 23 HN LYS 23 60.341 6.457 6.457
161 HA LYS 23 HA LYS 23 61.681 7.859 7.859
162 1HB LYS 23 HB2 LYS 23 59.207 7.815 7.815
163 2HB LYS 23 HB1 LYS 23 59.611 9.105 9.105
164 1HG LYS 23 HG2 LYS 23 58.829 10.147 10.147
165 2HG LYS 23 HG1 LYS 23 60.572 10.398 10.398
166 1HD LYS 23 HD2 LYS 23 61.020 8.874 8.874
167 2HD LYS 23 HD1 LYS 23 59.534 7.966 7.966
168 1HE LYS 23 HE2 LYS 23 58.201 9.559 9.559
169 2HE LYS 23 HE1 LYS 23 59.452 10.813 10.813
170 1HZ LYS 23 HZ2 LYS 23 60.902 9.221 9.221
171 2HZ LYS 23 HZ1 LYS 23 59.488 8.346 8.346
172 3HZ LYS 23 HZ3 LYS 23 59.641 9.950 9.950
173 H ALA 24 HN ALA 24 60.975 9.356 9.356
174 HA ALA 24 HA ALA 24 62.774 11.536 11.536
175 1HB ALA 24 HB2 ALA 24 61.203 10.174 10.174
176 2HB ALA 24 HB1 ALA 24 62.630 11.001 11.001
177 3HB ALA 24 HB3 ALA 24 61.420 11.900 11.900
178 H ALA 25 HN ALA 25 63.332 8.198 8.198
179 HA ALA 25 HA ALA 25 65.978 8.672 8.672
180 1HB ALA 25 HB2 ALA 25 64.335 6.800 6.800
181 2HB ALA 25 HB1 ALA 25 64.745 6.107 6.107
182 3HB ALA 25 HB3 ALA 25 65.985 6.268 6.268
183 H PHE 26 HN PHE 26 64.718 7.428 7.428
184 HA PHE 26 HA PHE 26 67.300 6.885 6.885
185 1HB PHE 26 HB2 PHE 26 65.363 5.810 5.810
186 2HB PHE 26 HB1 PHE 26 64.495 7.338 7.338
187 HD1 PHE 26 HD2 PHE 26 65.036 8.922 8.922
188 HD2 PHE 26 HD1 PHE 26 67.040 5.139 5.139
189 HE1 PHE 26 HE2 PHE 26 65.901 9.179 9.179
190 HE2 PHE 26 HE1 PHE 26 67.908 5.396 5.396
191 HZ PHE 26 HZ PHE 26 67.341 7.417 7.417
192 H ASP 27 HN ASP 27 65.190 9.740 9.740
193 HA ASP 27 HA ASP 27 66.621 11.250 11.250
194 1HB ASP 27 HB2 ASP 27 64.252 11.510 11.510
195 2HB ASP 27 HB1 ASP 27 65.067 12.380 12.380
196 H MET 28 HN MET 28 67.589 10.256 10.256
197 HA MET 28 HA MET 28 68.859 12.504 12.504
198 1HB MET 28 HB2 MET 28 69.384 9.536 9.536
199 2HB MET 28 HB1 MET 28 70.458 10.608 10.608
200 1HG MET 28 HG2 MET 28 68.029 11.507 11.507
201 2HG MET 28 HG1 MET 28 67.674 9.800 9.800
202 1HE MET 28 HE2 MET 28 69.333 12.494 12.494
203 2HE MET 28 HE1 MET 28 69.431 12.006 12.006
204 3HE MET 28 HE3 MET 28 70.856 11.890 11.890
205 H PHE 29 HN PHE 29 69.732 10.627 10.627
206 HA PHE 29 HA PHE 29 72.267 12.224 12.224
207 1HB PHE 29 HB2 PHE 29 71.819 9.543 9.543
208 2HB PHE 29 HB1 PHE 29 73.338 10.294 10.294
209 HD1 PHE 29 HD2 PHE 29 70.378 8.430 8.430
210 HD2 PHE 29 HD1 PHE 29 74.088 10.244 10.244
211 HE1 PHE 29 HE2 PHE 29 70.260 7.251 7.251
212 HE2 PHE 29 HE1 PHE 29 73.969 9.065 9.065
213 HZ PHE 29 HZ PHE 29 72.054 7.568 7.568
214 H ASP 30 HN ASP 30 69.268 12.277 12.277
215 HA ASP 30 HA ASP 30 69.988 12.490 12.490
216 1HB ASP 30 HB2 ASP 30 67.852 11.363 11.363
217 2HB ASP 30 HB1 ASP 30 67.184 12.812 12.812
218 H ALA 31 HN ALA 31 70.927 14.592 14.592
219 HA ALA 31 HA ALA 31 69.042 16.800 16.800
220 1HB ALA 31 HB2 ALA 31 72.044 16.479 16.479
221 2HB ALA 31 HB1 ALA 31 71.258 18.048 18.048
222 3HB ALA 31 HB3 ALA 31 70.892 16.749 16.749
223 H ASP 32 HN ASP 32 71.092 15.465 15.465
224 HA ASP 32 HA ASP 32 70.530 17.852 17.852
225 1HB ASP 32 HB2 ASP 32 72.902 15.998 15.998
226 2HB ASP 32 HB1 ASP 32 72.679 17.005 17.005
227 H GLY 33 HN GLY 33 70.055 14.501 14.501
228 1HA GLY 33 HA2 GLY 33 69.715 13.862 13.862
229 2HA GLY 33 HA1 GLY 33 69.443 12.758 12.758
230 H GLY 34 HN GLY 34 67.709 14.588 14.588
231 1HA GLY 34 HA2 GLY 34 65.464 15.294 15.294
232 2HA GLY 34 HA1 GLY 34 65.475 15.324 15.324
233 H GLY 35 HN GLY 35 66.528 12.383 12.383
234 1HA GLY 35 HA2 GLY 35 64.368 10.884 10.884
235 2HA GLY 35 HA1 GLY 35 64.159 11.009 11.009
236 H ASP 36 HN ASP 36 67.248 11.144 11.144
237 HA ASP 36 HA ASP 36 67.822 8.258 8.258
238 1HB ASP 36 HB2 ASP 36 68.898 8.281 8.281
239 2HB ASP 36 HB1 ASP 36 67.136 8.354 8.354
240 H ILE 37 HN ILE 37 69.764 8.077 8.077
241 HA ILE 37 HA ILE 37 71.604 10.420 10.420
242 HB ILE 37 HB ILE 37 72.471 9.375 9.375
243 1HG1 ILE 37 HG12 ILE 37 70.779 7.010 7.010
244 2HG1 ILE 37 HG11 ILE 37 72.537 7.060 7.060
245 1HG2 ILE 37 HG21 ILE 37 69.452 9.165 9.165
246 2HG2 ILE 37 HG23 ILE 37 70.352 9.130 9.130
247 3HG2 ILE 37 HG22 ILE 37 70.378 10.577 10.577
248 HD1 ILE 37 HD1 ILE 37 71.505 5.953 5.953
249 HD1 ILE 37 HD1 ILE 37 70.604 7.431 7.431
250 HD1 ILE 37 HD1 ILE 37 72.363 7.425 7.425
251 H SER 38 HN SER 38 74.030 9.670 9.670
252 HA SER 38 HA SER 38 74.812 8.492 8.492
253 1HB SER 38 HB2 SER 38 76.286 8.746 8.746
254 2HB SER 38 HB1 SER 38 77.049 8.487 8.487
255 HG SER 38 HG SER 38 76.896 10.549 10.549
256 H THR 39 HN THR 39 75.091 6.362 6.362
257 HA THR 39 HA THR 39 74.008 4.174 4.174
258 HB THR 39 HB THR 39 75.597 2.869 2.869
259 HG1 THR 39 HG1 THR 39 77.313 4.337 4.337
260 1HG2 THR 39 HG23 THR 39 73.570 4.827 4.827
261 2HG2 THR 39 HG22 THR 39 74.726 4.577 4.577
262 3HG2 THR 39 HG21 THR 39 73.838 3.206 3.206
263 H LYS 40 HN LYS 40 77.146 5.702 5.702
264 HA LYS 40 HA LYS 40 78.343 3.551 3.551
265 1HB LYS 40 HB2 LYS 40 78.929 6.272 6.272
266 2HB LYS 40 HB1 LYS 40 79.594 5.938 5.938
267 1HG LYS 40 HG2 LYS 40 81.297 4.916 4.916
268 2HG LYS 40 HG1 LYS 40 80.152 3.617 3.617
269 1HD LYS 40 HD2 LYS 40 79.768 4.327 4.327
270 2HD LYS 40 HD1 LYS 40 80.146 6.010 6.010
271 1HE LYS 40 HE2 LYS 40 82.130 5.532 5.532
272 2HE LYS 40 HE1 LYS 40 82.558 4.791 4.791
273 1HZ LYS 40 HZ3 LYS 40 81.103 2.851 2.851
274 2HZ LYS 40 HZ2 LYS 40 81.706 3.524 3.524
275 3HZ LYS 40 HZ1 LYS 40 82.778 2.960 2.960
276 H GLU 41 HN GLU 41 76.245 6.267 6.267
277 HA GLU 41 HA GLU 41 76.682 5.962 5.962
278 1HB GLU 41 HB2 GLU 41 76.583 8.198 8.198
279 2HB GLU 41 HB1 GLU 41 75.027 7.839 7.839
280 1HG GLU 41 HG2 GLU 41 73.908 8.303 8.303
281 2HG GLU 41 HG1 GLU 41 74.989 7.294 7.294
282 H LEU 42 HN LEU 42 75.055 4.157 4.157
283 HA LEU 42 HA LEU 42 72.335 4.179 4.179
284 1HB LEU 42 HB2 LEU 42 72.889 3.348 3.348
285 2HB LEU 42 HB1 LEU 42 74.022 2.178 2.178
286 HG LEU 42 HG LEU 42 71.294 2.009 2.009
287 HD1 LEU 42 HD1 LEU 42 70.155 1.327 1.327
288 HD1 LEU 42 HD1 LEU 42 71.626 0.824 0.824
289 HD1 LEU 42 HD1 LEU 42 71.216 2.536 2.536
290 HD2 LEU 42 HD2 LEU 42 72.003 -0.101 -0.101
291 HD2 LEU 42 HD2 LEU 42 73.586 0.430 0.430
292 HD2 LEU 42 HD2 LEU 42 72.460 -0.340 -0.340
293 H GLY 43 HN GLY 43 75.000 1.810 1.810
294 1HA GLY 43 HA2 GLY 43 73.824 0.124 0.124
295 2HA GLY 43 HA1 GLY 43 75.547 0.497 0.497
296 H THR 44 HN THR 44 74.851 3.422 3.422
297 HA THR 44 HA THR 44 75.035 3.411 3.411
298 HB THR 44 HB THR 44 74.681 5.443 5.443
299 HG1 THR 44 HG1 THR 44 76.701 6.058 6.058
300 1HG2 THR 44 HG21 THR 44 74.686 5.994 5.994
301 2HG2 THR 44 HG23 THR 44 74.883 7.223 7.223
302 3HG2 THR 44 HG22 THR 44 73.369 6.327 6.327
303 H VAL 45 HN VAL 45 72.438 4.587 4.587
304 HA VAL 45 HA VAL 45 70.502 5.320 5.320
305 HB VAL 45 HB VAL 45 70.379 3.911 3.911
306 1HG1 VAL 45 HG12 VAL 45 68.333 3.401 3.401
307 2HG1 VAL 45 HG11 VAL 45 68.033 5.136 5.136
308 3HG1 VAL 45 HG13 VAL 45 67.998 4.315 4.315
309 1HG2 VAL 45 HG22 VAL 45 71.224 6.292 6.292
310 2HG2 VAL 45 HG21 VAL 45 69.828 6.108 6.108
311 3HG2 VAL 45 HG23 VAL 45 69.615 6.731 6.731
312 H MET 46 HN MET 46 70.299 2.127 2.127
313 HA MET 46 HA MET 46 68.587 0.879 0.879
314 1HB MET 46 HB2 MET 46 69.660 -1.214 -1.214
315 2HB MET 46 HB1 MET 46 69.288 -0.056 -0.056
316 1HG MET 46 HG2 MET 46 71.696 0.809 0.809
317 2HG MET 46 HG1 MET 46 71.971 -0.694 -0.694
318 1HE MET 46 HE2 MET 46 71.215 -2.905 -2.905
319 2HE MET 46 HE1 MET 46 69.799 -2.614 -2.614
320 3HE MET 46 HE3 MET 46 71.203 -3.461 -3.461
321 H ARG 47 HN ARG 47 71.968 1.673 1.673
322 HA ARG 47 HA ARG 47 72.383 -0.124 -0.124
323 1HB ARG 47 HB2 ARG 47 73.895 1.912 1.912
324 2HB ARG 47 HB1 ARG 47 74.476 1.554 1.554
325 1HG ARG 47 HG2 ARG 47 74.480 -0.874 -0.874
326 2HG ARG 47 HG1 ARG 47 74.017 -0.457 -0.457
327 1HD ARG 47 HD2 ARG 47 76.114 0.318 0.318
328 2HD ARG 47 HD1 ARG 47 76.393 0.972 0.972
329 HE ARG 47 HE ARG 47 76.421 -1.977 -1.977
330 1HH1 ARG 47 HH1 ARG 47 76.953 -2.363 -2.363
331 2HH1 ARG 47 HH1 ARG 47 78.512 -1.734 -1.734
332 1HH2 ARG 47 HH2 ARG 47 78.755 0.256 0.256
333 2HH2 ARG 47 HH2 ARG 47 79.532 -0.252 -0.252
334 H MET 48 HN MET 48 71.949 3.388 3.388
335 HA MET 48 HA MET 48 72.115 4.082 4.082
336 1HB MET 48 HB2 MET 48 72.143 5.366 5.366
337 2HB MET 48 HB1 MET 48 70.542 5.795 5.795
338 1HG MET 48 HG2 MET 48 73.075 6.083 6.083
339 2HG MET 48 HG1 MET 48 72.383 7.393 7.393
340 1HE MET 48 HE1 MET 48 72.423 5.116 5.116
341 2HE MET 48 HE3 MET 48 72.499 6.561 6.561
342 3HE MET 48 HE2 MET 48 71.114 5.478 5.478
343 H LEU 49 HN LEU 49 69.734 2.438 2.438
344 HA LEU 49 HA LEU 49 67.398 3.537 3.537
345 1HB LEU 49 HB2 LEU 49 68.044 1.515 1.515
346 2HB LEU 49 HB1 LEU 49 66.558 1.245 1.245
347 HG LEU 49 HG LEU 49 67.183 3.953 3.953
348 HD1 LEU 49 HD1 LEU 49 66.366 3.388 3.388
349 HD1 LEU 49 HD1 LEU 49 65.392 2.057 2.057
350 HD1 LEU 49 HD1 LEU 49 67.132 1.858 1.858
351 HD2 LEU 49 HD2 LEU 49 64.871 4.343 4.343
352 HD2 LEU 49 HD2 LEU 49 65.331 3.431 3.431
353 HD2 LEU 49 HD2 LEU 49 64.506 2.622 2.622
354 H GLY 50 HN GLY 50 69.450 0.637 0.637
355 1HA GLY 50 HA2 GLY 50 69.510 0.093 0.093
356 2HA GLY 50 HA1 GLY 50 67.844 -0.368 -0.368
357 H GLN 51 HN GLN 51 69.039 -1.105 -1.105
358 HA GLN 51 HA GLN 51 69.547 -3.928 -3.928
359 1HB GLN 51 HB2 GLN 51 69.446 -2.692 -2.692
360 2HB GLN 51 HB1 GLN 51 69.041 -4.344 -4.344
361 1HG GLN 51 HG2 GLN 51 67.488 -1.818 -1.818
362 2HG GLN 51 HG1 GLN 51 66.956 -3.208 -3.208
363 1HE2 GLN 51 HE22 GLN 51 66.392 -3.226 -3.226
364 2HE2 GLN 51 HE21 GLN 51 66.891 -1.846 -1.846
365 H ASN 52 HN ASN 52 71.238 -4.799 -4.799
366 HA ASN 52 HA ASN 52 73.624 -3.083 -3.083
367 1HB ASN 52 HB2 ASN 52 73.875 -3.866 -3.866
368 2HB ASN 52 HB1 ASN 52 73.403 -5.505 -5.505
369 HD2 ASN 52 HD2 ASN 52 75.579 -6.099 -6.099
370 HD2 ASN 52 HD2 ASN 52 76.969 -5.972 -5.972
371 HA PRO 53 HA PRO 53 73.263 -6.079 -6.079
372 1HB PRO 53 HB2 PRO 53 74.194 -4.357 -4.357
373 2HB PRO 53 HB1 PRO 53 72.497 -4.393 -4.393
374 1HG PRO 53 HG2 PRO 53 74.667 -2.505 -2.505
375 2HG PRO 53 HG1 PRO 53 72.948 -2.196 -2.196
376 1HD PRO 53 HD2 PRO 53 74.075 -2.387 -2.387
377 2HD PRO 53 HD1 PRO 53 72.365 -2.729 -2.729
378 H THR 54 HN THR 54 74.955 -7.445 -7.445
379 HA THR 54 HA THR 54 77.638 -6.887 -6.887
380 HB THR 54 HB THR 54 78.021 -9.109 -9.109
381 HG1 THR 54 HG1 THR 54 76.038 -10.121 -10.121
382 1HG2 THR 54 HG23 THR 54 76.977 -8.539 -8.539
383 2HG2 THR 54 HG22 THR 54 75.747 -9.605 -9.605
384 3HG2 THR 54 HG21 THR 54 77.419 -10.153 -10.153
385 H LYS 55 HN LYS 55 79.419 -6.205 -6.205
386 HA LYS 55 HA LYS 55 79.253 -4.605 -4.605
387 1HB LYS 55 HB2 LYS 55 81.220 -5.373 -5.373
388 2HB LYS 55 HB1 LYS 55 81.548 -6.524 -6.524
389 1HG LYS 55 HG2 LYS 55 82.137 -4.877 -4.877
390 2HG LYS 55 HG1 LYS 55 81.074 -3.677 -3.677
391 1HD LYS 55 HD2 LYS 55 82.898 -4.238 -4.238
392 2HD LYS 55 HD1 LYS 55 83.888 -4.258 -4.258
393 1HE LYS 55 HE2 LYS 55 83.844 -1.969 -1.969
394 2HE LYS 55 HE1 LYS 55 82.782 -2.035 -2.035
395 1HZ LYS 55 HZ2 LYS 55 81.715 -2.621 -2.621
396 2HZ LYS 55 HZ1 LYS 55 81.873 -1.010 -1.010
397 3HZ LYS 55 HZ3 LYS 55 80.889 -2.081 -2.081
398 H GLU 56 HN GLU 56 79.531 -8.156 -8.156
399 HA GLU 56 HA GLU 56 79.837 -8.523 -8.523
400 1HB GLU 56 HB2 GLU 56 78.888 -10.175 -10.175
401 2HB GLU 56 HB1 GLU 56 78.864 -10.839 -10.839
402 1HG GLU 56 HG2 GLU 56 81.345 -9.546 -9.546
403 2HG GLU 56 HG1 GLU 56 80.989 -11.252 -11.252
404 H GLU 57 HN GLU 57 77.072 -7.801 -7.801
405 HA GLU 57 HA GLU 57 75.080 -8.703 -8.703
406 1HB GLU 57 HB2 GLU 57 75.207 -7.450 -7.450
407 2HB GLU 57 HB1 GLU 57 73.752 -7.119 -7.119
408 1HG GLU 57 HG2 GLU 57 74.669 -9.939 -9.939
409 2HG GLU 57 HG1 GLU 57 74.050 -9.333 -9.333
410 H LEU 58 HN LEU 58 76.374 -5.559 -5.559
411 HA LEU 58 HA LEU 58 74.733 -3.909 -3.909
412 1HB LEU 58 HB2 LEU 58 77.557 -3.441 -3.441
413 2HB LEU 58 HB1 LEU 58 76.376 -2.202 -2.202
414 HG LEU 58 HG LEU 58 76.260 -4.154 -4.154
415 HD1 LEU 58 HD1 LEU 58 76.107 -2.108 -2.108
416 HD1 LEU 58 HD1 LEU 58 76.075 -1.128 -1.128
417 HD1 LEU 58 HD1 LEU 58 77.530 -2.028 -2.028
418 HD2 LEU 58 HD2 LEU 58 74.020 -4.206 -4.206
419 HD2 LEU 58 HD2 LEU 58 74.098 -2.748 -2.748
420 HD2 LEU 58 HD2 LEU 58 74.034 -2.617 -2.617
421 H ASP 59 HN ASP 59 78.045 -5.192 -5.192
422 HA ASP 59 HA ASP 59 78.616 -4.052 -4.052
423 1HB ASP 59 HB2 ASP 59 79.365 -6.497 -6.497
424 2HB ASP 59 HB1 ASP 59 79.816 -6.459 -6.459
425 H ALA 60 HN ALA 60 76.592 -6.836 -6.836
426 HA ALA 60 HA ALA 60 76.239 -7.687 -7.687
427 1HB ALA 60 HB2 ALA 60 75.928 -8.759 -8.759
428 2HB ALA 60 HB1 ALA 60 74.260 -8.509 -8.509
429 3HB ALA 60 HB3 ALA 60 75.345 -9.503 -9.503
430 H ILE 61 HN ILE 61 74.094 -6.159 -6.159
431 HA ILE 61 HA ILE 61 71.938 -5.680 -5.680
432 HB ILE 61 HB ILE 61 72.722 -4.568 -4.568
433 1HG1 ILE 61 HG12 ILE 61 70.290 -6.071 -6.071
434 2HG1 ILE 61 HG11 ILE 61 71.516 -6.997 -6.997
435 1HG2 ILE 61 HG22 ILE 61 70.377 -3.971 -3.971
436 2HG2 ILE 61 HG21 ILE 61 70.170 -3.955 -3.955
437 3HG2 ILE 61 HG23 ILE 61 71.329 -2.865 -2.865
438 HD1 ILE 61 HD1 ILE 61 72.613 -7.480 -7.480
439 HD1 ILE 61 HD1 ILE 61 71.230 -6.815 -6.815
440 HD1 ILE 61 HD1 ILE 61 72.613 -5.787 -5.787
441 H ILE 62 HN ILE 62 74.618 -3.664 -3.664
442 HA ILE 62 HA ILE 62 73.895 -1.169 -1.169
443 HB ILE 62 HB ILE 62 76.525 -2.592 -2.592
444 1HG1 ILE 62 HG12 ILE 62 75.093 -0.318 -0.318
445 2HG1 ILE 62 HG11 ILE 62 75.222 -1.978 -1.978
446 1HG2 ILE 62 HG21 ILE 62 75.994 -0.102 -0.102
447 2HG2 ILE 62 HG23 ILE 62 77.109 0.111 0.111
448 3HG2 ILE 62 HG22 ILE 62 77.472 -1.060 -1.060
449 HD1 ILE 62 HD1 ILE 62 77.349 -1.679 -1.679
450 HD1 ILE 62 HD1 ILE 62 76.974 0.042 0.042
451 HD1 ILE 62 HD1 ILE 62 77.808 -0.753 -0.753
452 H GLU 63 HN GLU 63 76.262 -3.383 -3.383
453 HA GLU 63 HA GLU 63 76.485 -2.260 -2.260
454 1HB GLU 63 HB2 GLU 63 77.577 -4.338 -4.338
455 2HB GLU 63 HB1 GLU 63 76.070 -5.210 -5.210
456 1HG GLU 63 HG2 GLU 63 76.353 -4.129 -4.129
457 2HG GLU 63 HG1 GLU 63 78.054 -4.147 -4.147
458 H GLU 64 HN GLU 64 73.834 -4.402 -4.402
459 HA GLU 64 HA GLU 64 72.395 -4.532 -4.532
460 1HB GLU 64 HB2 GLU 64 71.756 -5.992 -5.992
461 2HB GLU 64 HB1 GLU 64 71.737 -4.701 -4.701
462 1HG GLU 64 HG2 GLU 64 69.639 -3.964 -3.964
463 2HG GLU 64 HG1 GLU 64 69.835 -4.481 -4.481
464 H VAL 65 HN VAL 65 71.994 -2.273 -2.273
465 HA VAL 65 HA VAL 65 70.127 -0.590 -0.590
466 HB VAL 65 HB VAL 65 69.953 0.585 0.585
467 1HG1 VAL 65 HG13 VAL 65 69.115 -1.806 -1.806
468 2HG1 VAL 65 HG12 VAL 65 70.608 -2.278 -2.278
469 3HG1 VAL 65 HG11 VAL 65 69.471 -1.196 -1.196
470 1HG2 VAL 65 HG22 VAL 65 72.430 0.828 0.828
471 2HG2 VAL 65 HG21 VAL 65 71.590 0.359 0.359
472 3HG2 VAL 65 HG23 VAL 65 72.487 -0.845 -0.845
473 H ASP 66 HN ASP 66 73.497 -0.894 -0.894
474 HA ASP 66 HA ASP 66 73.991 1.995 1.995
475 1HB ASP 66 HB2 ASP 66 75.266 0.141 0.141
476 2HB ASP 66 HB1 ASP 66 76.212 0.038 0.038
477 H GLU 67 HN GLU 67 72.864 1.632 1.632
478 HA GLU 67 HA GLU 67 73.828 -0.096 -0.096
479 1HB GLU 67 HB2 GLU 67 72.471 2.591 2.591
480 2HB GLU 67 HB1 GLU 67 72.913 1.881 1.881
481 1HG GLU 67 HG2 GLU 67 71.738 -0.265 -0.265
482 2HG GLU 67 HG1 GLU 67 70.932 0.907 0.907
483 H ASP 68 HN ASP 68 74.841 3.242 3.242
484 HA ASP 68 HA ASP 68 77.066 3.047 3.047
485 1HB ASP 68 HB2 ASP 68 75.936 5.254 5.254
486 2HB ASP 68 HB1 ASP 68 77.298 5.478 5.478
487 H GLY 69 HN GLY 69 76.471 3.041 3.041
488 1HA GLY 69 HA2 GLY 69 78.125 1.994 1.994
489 2HA GLY 69 HA1 GLY 69 79.394 2.602 2.602
490 H SER 70 HN SER 70 77.815 5.221 5.221
491 HA SER 70 HA SER 70 78.666 6.299 6.299
492 1HB SER 70 HB2 SER 70 80.154 6.948 6.948
493 2HB SER 70 HB1 SER 70 78.780 7.490 7.490
494 HG SER 70 HG SER 70 80.053 8.677 8.677
495 H GLY 71 HN GLY 71 76.024 5.692 5.692
496 1HA GLY 71 HA2 GLY 71 74.500 8.106 8.106
497 2HA GLY 71 HA1 GLY 71 73.820 6.503 6.503
498 H THR 72 HN THR 72 72.108 7.128 7.128
499 HA THR 72 HA THR 72 72.998 6.807 6.807
500 HB THR 72 HB THR 72 71.130 8.393 8.393
501 HG1 THR 72 HG1 THR 72 71.048 9.161 9.161
502 1HG2 THR 72 HG21 THR 72 73.611 8.985 8.985
503 2HG2 THR 72 HG23 THR 72 72.400 10.233 10.233
504 3HG2 THR 72 HG22 THR 72 72.863 9.829 9.829
505 H ILE 73 HN ILE 73 70.795 6.331 6.331
506 HA ILE 73 HA ILE 73 69.426 4.089 4.089
507 HB ILE 73 HB ILE 73 70.932 3.553 3.553
508 1HG1 ILE 73 HG12 ILE 73 69.107 2.302 2.302
509 2HG1 ILE 73 HG11 ILE 73 67.961 3.034 3.034
510 1HG2 ILE 73 HG22 ILE 73 69.916 5.823 5.823
511 2HG2 ILE 73 HG21 ILE 73 68.952 4.594 4.594
512 3HG2 ILE 73 HG23 ILE 73 70.712 4.549 4.549
513 HD1 ILE 73 HD1 ILE 73 69.936 2.068 2.068
514 HD1 ILE 73 HD1 ILE 73 68.400 1.269 1.269
515 HD1 ILE 73 HD1 ILE 73 69.841 0.827 0.827
516 H ASP 74 HN ASP 74 67.187 4.164 4.164
517 HA ASP 74 HA ASP 74 65.831 6.606 6.606
518 1HB ASP 74 HB2 ASP 74 64.927 4.071 4.071
519 2HB ASP 74 HB1 ASP 74 63.913 5.496 5.496
520 H PHE 75 HN PHE 75 64.307 6.712 6.712
521 HA PHE 75 HA PHE 75 64.535 5.004 5.004
522 1HB PHE 75 HB2 PHE 75 63.603 7.269 7.269
523 2HB PHE 75 HB1 PHE 75 62.243 6.750 6.750
524 HD1 PHE 75 HD2 PHE 75 60.659 4.987 4.987
525 HD2 PHE 75 HD1 PHE 75 63.592 6.955 6.955
526 HE1 PHE 75 HE2 PHE 75 59.432 4.284 4.284
527 HE2 PHE 75 HE1 PHE 75 62.367 6.250 6.250
528 HZ PHE 75 HZ PHE 75 60.287 4.916 4.916
529 H GLU 76 HN GLU 76 61.802 5.106 5.106
530 HA GLU 76 HA GLU 76 60.398 2.852 2.852
531 1HB GLU 76 HB2 GLU 76 59.569 2.784 2.784
532 2HB GLU 76 HB1 GLU 76 59.522 4.390 4.390
533 1HG GLU 76 HG2 GLU 76 61.991 4.505 4.505
534 2HG GLU 76 HG1 GLU 76 61.295 3.339 3.339
535 H GLU 77 HN GLU 77 63.026 2.974 2.974
536 HA GLU 77 HA GLU 77 63.065 0.093 0.093
537 1HB GLU 77 HB2 GLU 77 63.823 1.985 1.985
538 2HB GLU 77 HB1 GLU 77 65.260 2.107 2.107
539 1HG GLU 77 HG2 GLU 77 66.180 0.425 0.425
540 2HG GLU 77 HG1 GLU 77 64.924 -0.645 -0.645
541 H PHE 78 HN PHE 78 64.626 2.352 2.352
542 HA PHE 78 HA PHE 78 66.723 0.550 0.550
543 1HB PHE 78 HB2 PHE 78 67.178 2.818 2.818
544 2HB PHE 78 HB1 PHE 78 65.518 3.187 3.187
545 HD1 PHE 78 HD1 PHE 78 68.410 1.102 1.102
546 HD2 PHE 78 HD2 PHE 78 65.086 3.614 3.614
547 HE1 PHE 78 HE1 PHE 78 69.034 0.929 0.929
548 HE2 PHE 78 HE2 PHE 78 65.710 3.442 3.442
549 HZ PHE 78 HZ PHE 78 67.683 2.099 2.099
550 H LEU 79 HN LEU 79 63.360 1.053 1.053
551 HA LEU 79 HA LEU 79 63.072 0.201 0.201
552 1HB LEU 79 HB2 LEU 79 61.570 0.063 0.063
553 2HB LEU 79 HB1 LEU 79 61.128 -1.223 -1.223
554 HG LEU 79 HG LEU 79 59.737 0.765 0.765
555 HD1 LEU 79 HD1 LEU 79 59.845 -0.113 -0.113
556 HD1 LEU 79 HD1 LEU 79 60.953 1.213 1.213
557 HD1 LEU 79 HD1 LEU 79 61.587 -0.368 -0.368
558 HD2 LEU 79 HD2 LEU 79 61.204 2.714 2.714
559 HD2 LEU 79 HD2 LEU 79 60.896 2.662 2.662
560 HD2 LEU 79 HD2 LEU 79 62.426 2.065 2.065
561 H VAL 80 HN VAL 80 63.778 -1.846 -1.846
562 HA VAL 80 HA VAL 80 63.528 -4.399 -4.399
563 HB VAL 80 HB VAL 80 65.196 -5.023 -5.023
564 1HG1 VAL 80 HG11 VAL 80 62.838 -3.240 -3.240
565 2HG1 VAL 80 HG13 VAL 80 63.834 -3.760 -3.760
566 3HG1 VAL 80 HG12 VAL 80 63.033 -4.959 -4.959
567 1HG2 VAL 80 HG21 VAL 80 65.569 -2.056 -2.056
568 2HG2 VAL 80 HG23 VAL 80 66.763 -3.328 -3.328
569 3HG2 VAL 80 HG22 VAL 80 65.684 -2.860 -2.860
570 H MET 81 HN MET 81 66.333 -2.177 -2.177
571 HA MET 81 HA MET 81 68.161 -3.918 -3.918
572 1HB MET 81 HB2 MET 81 67.808 -0.957 -0.957
573 2HB MET 81 HB1 MET 81 69.079 -1.540 -1.540
574 1HG MET 81 HG2 MET 81 68.901 -2.916 -2.916
575 2HG MET 81 HG1 MET 81 69.414 -1.230 -1.230
576 1HE MET 81 HE2 MET 81 70.037 -4.757 -4.757
577 2HE MET 81 HE1 MET 81 71.499 -4.843 -4.843
578 3HE MET 81 HE3 MET 81 69.979 -4.294 -4.294
579 H MET 82 HN MET 82 65.482 -1.990 -1.990
580 HA MET 82 HA MET 82 66.304 -2.109 -2.109
581 1HB MET 82 HB2 MET 82 63.717 -1.276 -1.276
582 2HB MET 82 HB1 MET 82 64.185 -0.906 -0.906
583 1HG MET 82 HG2 MET 82 66.360 0.037 0.037
584 2HG MET 82 HG1 MET 82 65.150 0.280 0.280
585 1HE MET 82 HE2 MET 82 62.744 1.223 1.223
586 2HE MET 82 HE1 MET 82 62.827 2.897 2.897
587 3HE MET 82 HE3 MET 82 63.858 2.342 2.342
588 H VAL 83 HN VAL 83 63.381 -3.267 -3.267
589 HA VAL 83 HA VAL 83 62.464 -4.988 -4.988
590 HB VAL 83 HB VAL 83 60.987 -5.821 -5.821
591 1HG1 VAL 83 HG11 VAL 83 61.611 -3.037 -3.037
592 2HG1 VAL 83 HG13 VAL 83 61.185 -3.392 -3.392
593 3HG1 VAL 83 HG12 VAL 83 60.058 -3.785 -3.785
594 1HG2 VAL 83 HG22 VAL 83 63.087 -4.895 -4.895
595 2HG2 VAL 83 HG21 VAL 83 62.664 -6.567 -6.567
596 3HG2 VAL 83 HG23 VAL 83 61.498 -5.520 -5.520
597 H ARG 84 HN ARG 84 64.543 -5.706 -5.706
598 HA ARG 84 HA ARG 84 64.782 -8.507 -8.507
599 1HB ARG 84 HB2 ARG 84 66.719 -6.454 -6.454
600 2HB ARG 84 HB1 ARG 84 66.835 -8.195 -8.195
601 1HG ARG 84 HG2 ARG 84 64.212 -6.924 -6.924
602 2HG ARG 84 HG1 ARG 84 65.543 -6.563 -6.563
603 1HD ARG 84 HD2 ARG 84 64.920 -9.408 -9.408
604 2HD ARG 84 HD1 ARG 84 64.134 -8.644 -8.644
605 HE ARG 84 HE ARG 84 66.883 -9.521 -9.521
606 1HH1 ARG 84 HH1 ARG 84 67.874 -6.981 -6.981
607 2HH1 ARG 84 HH1 ARG 84 67.530 -6.541 -6.541
608 1HH2 ARG 84 HH2 ARG 84 65.099 -8.978 -8.978
609 2HH2 ARG 84 HH2 ARG 84 65.959 -7.672 -7.672
610 H GLN 85 HN GLN 85 66.465 -5.799 -5.799
611 HA GLN 85 HA GLN 85 68.329 -7.631 -7.631
612 1HB GLN 85 HB2 GLN 85 68.975 -5.402 -5.402
613 2HB GLN 85 HB1 GLN 85 67.926 -4.630 -4.630
614 1HG GLN 85 HG2 GLN 85 70.323 -4.710 -4.710
615 2HG GLN 85 HG1 GLN 85 69.242 -5.553 -5.553
616 1HE2 GLN 85 HE22 GLN 85 70.929 -8.610 -8.610
617 2HE2 GLN 85 HE21 GLN 85 69.874 -7.648 -7.648
618 H MET 86 HN MET 86 65.382 -5.812 -5.812
619 HA MET 86 HA MET 86 65.572 -6.197 -6.197
620 1HB MET 86 HB2 MET 86 64.224 -4.495 -4.495
621 2HB MET 86 HB1 MET 86 63.017 -5.281 -5.281
622 1HG MET 86 HG2 MET 86 64.884 -4.631 -4.631
623 2HG MET 86 HG1 MET 86 65.093 -3.302 -3.302
624 1HE MET 86 HE3 MET 86 64.556 -2.010 -2.010
625 2HE MET 86 HE2 MET 86 63.952 -1.139 -1.139
626 3HE MET 86 HE1 MET 86 62.969 -1.231 -1.231
627 H LYS 87 HN LYS 87 63.828 -7.579 -7.579
628 HA LYS 87 HA LYS 87 61.776 -8.995 -8.995
629 1HB LYS 87 HB2 LYS 87 62.260 -10.708 -10.708
630 2HB LYS 87 HB1 LYS 87 62.022 -9.046 -9.046
631 1HG LYS 87 HG2 LYS 87 64.026 -9.171 -9.171
632 2HG LYS 87 HG1 LYS 87 64.763 -9.238 -9.238
633 1HD LYS 87 HD2 LYS 87 65.231 -11.446 -11.446
634 2HD LYS 87 HD1 LYS 87 63.640 -11.808 -11.808
635 1HE LYS 87 HE2 LYS 87 64.594 -10.594 -10.594
636 2HE LYS 87 HE1 LYS 87 66.160 -11.031 -11.031
637 1HZ LYS 87 HZ3 LYS 87 64.073 -13.063 -13.063
638 2HZ LYS 87 HZ2 LYS 87 64.748 -12.727 -12.727
639 3HZ LYS 87 HZ1 LYS 87 65.742 -13.235 -13.235
640 H GLU 88 HN GLU 88 65.229 -9.505 -9.505
641 HA GLU 88 HA GLU 88 64.892 -12.091 -12.091
642 1HB GLU 88 HB2 GLU 88 67.071 -10.593 -10.593
643 2HB GLU 88 HB1 GLU 88 67.528 -11.772 -11.772
644 1HG GLU 88 HG2 GLU 88 65.460 -12.824 -12.824
645 2HG GLU 88 HG1 GLU 88 66.886 -12.325 -12.325
646 H ASP 89 HN ASP 89 66.099 -8.773 -8.773
647 HA ASP 89 HA ASP 89 67.031 -9.227 -9.227
648 1HB ASP 89 HB2 ASP 89 66.594 -6.841 -6.841
649 2HB ASP 89 HB1 ASP 89 67.164 -6.658 -6.658
650 H ALA 90 HN ALA 90 64.102 -8.012 -8.012
651 HA ALA 90 HA ALA 90 62.909 -6.976 -6.976
652 1HB ALA 90 HB3 ALA 90 62.024 -7.567 -7.567
653 2HB ALA 90 HB2 ALA 90 60.858 -7.052 -7.052
654 3HB ALA 90 HB1 ALA 90 62.206 -6.000 -6.000
Start of MODEL 34
1 1H ALA 1 HT2 ALA 1 63.339 -3.254 -3.254
2 2H ALA 1 HT1 ALA 1 64.306 -3.304 -3.304
3 3H ALA 1 HT3 ALA 1 62.762 -4.003 -4.003
4 HA ALA 1 HA ALA 1 64.288 -5.797 -5.797
5 1HB ALA 1 HB1 ALA 1 65.771 -3.716 -3.716
6 2HB ALA 1 HB3 ALA 1 65.591 -4.946 -4.946
7 3HB ALA 1 HB2 ALA 1 66.319 -5.366 -5.366
8 H SER 2 HN SER 2 64.816 -6.857 -6.857
9 HA SER 2 HA SER 2 62.064 -7.423 -7.423
10 1HB SER 2 HB2 SER 2 64.778 -8.409 -8.409
11 2HB SER 2 HB1 SER 2 63.225 -9.131 -9.131
12 HG SER 2 HG SER 2 64.686 -9.219 -9.219
13 H MET 3 HN MET 3 64.608 -5.286 -5.286
14 HA MET 3 HA MET 3 64.288 -5.090 -5.090
15 1HB MET 3 HB2 MET 3 65.281 -3.389 -3.389
16 2HB MET 3 HB1 MET 3 65.080 -2.636 -2.636
17 1HG MET 3 HG2 MET 3 66.729 -3.928 -3.928
18 2HG MET 3 HG1 MET 3 66.474 -5.277 -5.277
19 1HE MET 3 HE1 MET 3 67.368 -5.799 -5.799
20 2HE MET 3 HE3 MET 3 68.536 -4.982 -4.982
21 3HE MET 3 HE2 MET 3 69.059 -5.685 -5.685
22 H THR 4 HN THR 4 62.864 -3.048 -3.048
23 HA THR 4 HA THR 4 61.232 -1.377 -1.377
24 HB THR 4 HB THR 4 61.609 -1.521 -1.521
25 HG1 THR 4 HG1 THR 4 59.754 -0.445 -0.445
26 1HG2 THR 4 HG23 THR 4 59.362 -3.539 -3.539
27 2HG2 THR 4 HG22 THR 4 59.975 -2.880 -2.880
28 3HG2 THR 4 HG21 THR 4 61.012 -3.894 -3.894
29 H ASP 5 HN ASP 5 60.701 -4.784 -4.784
30 HA ASP 5 HA ASP 5 57.968 -4.900 -4.900
31 1HB ASP 5 HB2 ASP 5 60.078 -6.655 -6.655
32 2HB ASP 5 HB1 ASP 5 59.039 -7.450 -7.450
33 H GLN 6 HN GLN 6 61.137 -5.773 -5.773
34 HA GLN 6 HA GLN 6 60.208 -6.815 -6.815
35 1HB GLN 6 HB2 GLN 6 62.546 -6.757 -6.757
36 2HB GLN 6 HB1 GLN 6 62.710 -5.162 -5.162
37 1HG GLN 6 HG2 GLN 6 62.395 -6.076 -6.076
38 2HG GLN 6 HG1 GLN 6 62.003 -7.664 -7.664
39 1HE2 GLN 6 HE22 GLN 6 65.375 -8.641 -8.641
40 2HE2 GLN 6 HE21 GLN 6 63.739 -9.093 -9.093
41 H GLN 7 HN GLN 7 60.293 -3.553 -3.553
42 HA GLN 7 HA GLN 7 60.361 -2.168 -2.168
43 1HB GLN 7 HB2 GLN 7 60.766 -1.382 -1.382
44 2HB GLN 7 HB1 GLN 7 59.013 -1.205 -1.205
45 1HG GLN 7 HG2 GLN 7 59.722 -0.018 -0.018
46 2HG GLN 7 HG1 GLN 7 60.980 0.500 0.500
47 1HE2 GLN 7 HE22 GLN 7 58.718 2.367 2.367
48 2HE2 GLN 7 HE21 GLN 7 60.196 1.529 1.529
49 H ALA 8 HN ALA 8 57.928 -4.006 -4.006
50 HA ALA 8 HA ALA 8 55.625 -2.606 -2.606
51 1HB ALA 8 HB2 ALA 8 56.095 -4.314 -4.314
52 2HB ALA 8 HB1 ALA 8 55.366 -5.403 -5.403
53 3HB ALA 8 HB3 ALA 8 54.493 -3.964 -3.964
54 H GLU 9 HN GLU 9 57.139 -5.815 -5.815
55 HA GLU 9 HA GLU 9 55.603 -6.167 -6.167
56 1HB GLU 9 HB2 GLU 9 57.090 -7.741 -7.741
57 2HB GLU 9 HB1 GLU 9 57.614 -8.130 -8.130
58 1HG GLU 9 HG2 GLU 9 55.686 -9.209 -9.209
59 2HG GLU 9 HG1 GLU 9 54.722 -7.859 -7.859
60 H ALA 10 HN ALA 10 58.386 -4.501 -4.501
61 HA ALA 10 HA ALA 10 60.042 -5.175 -5.175
62 1HB ALA 10 HB2 ALA 10 60.043 -3.181 -3.181
63 2HB ALA 10 HB1 ALA 10 61.171 -2.984 -2.984
64 3HB ALA 10 HB3 ALA 10 61.218 -4.447 -4.447
65 H ARG 11 HN ARG 11 57.630 -2.738 -2.738
66 HA ARG 11 HA ARG 11 58.084 -1.405 -1.405
67 1HB ARG 11 HB2 ARG 11 56.244 0.146 0.146
68 2HB ARG 11 HB1 ARG 11 57.983 0.377 0.377
69 1HG ARG 11 HG2 ARG 11 57.040 0.354 0.354
70 2HG ARG 11 HG1 ARG 11 57.993 -1.112 -1.112
71 1HD ARG 11 HD2 ARG 11 55.976 -1.896 -1.896
72 2HD ARG 11 HD1 ARG 11 55.725 -2.181 -2.181
73 HE ARG 11 HE ARG 11 54.892 0.477 0.477
74 1HH1 ARG 11 HH1 ARG 11 53.367 -1.910 -1.910
75 2HH1 ARG 11 HH1 ARG 11 51.982 -1.978 -1.978
76 1HH2 ARG 11 HH2 ARG 11 53.395 0.016 0.016
77 2HH2 ARG 11 HH2 ARG 11 51.998 -0.888 -0.888
78 H ALA 12 HN ALA 12 56.094 -3.696 -3.696
79 HA ALA 12 HA ALA 12 53.606 -3.016 -3.016
80 1HB ALA 12 HB2 ALA 12 54.604 -4.852 -4.852
81 2HB ALA 12 HB1 ALA 12 53.570 -5.689 -5.689
82 3HB ALA 12 HB3 ALA 12 52.953 -4.294 -4.294
83 H PHE 13 HN PHE 13 56.536 -4.611 -4.611
84 HA PHE 13 HA PHE 13 55.426 -6.464 -6.464
85 1HB PHE 13 HB2 PHE 13 57.463 -7.106 -7.106
86 2HB PHE 13 HB1 PHE 13 58.143 -5.483 -5.483
87 HD1 PHE 13 HD1 PHE 13 56.830 -8.242 -8.242
88 HD2 PHE 13 HD2 PHE 13 59.653 -5.038 -5.038
89 HE1 PHE 13 HE1 PHE 13 57.881 -8.852 -8.852
90 HE2 PHE 13 HE2 PHE 13 60.704 -5.647 -5.647
91 HZ PHE 13 HZ PHE 13 59.819 -7.555 -7.555
92 H LEU 14 HN LEU 14 56.470 -3.130 -3.130
93 HA LEU 14 HA LEU 14 56.377 -3.021 -3.021
94 1HB LEU 14 HB2 LEU 14 57.473 -1.056 -1.056
95 2HB LEU 14 HB1 LEU 14 57.697 -0.978 -0.978
96 HG LEU 14 HG LEU 14 58.495 -3.509 -3.509
97 HD1 LEU 14 HD1 LEU 14 59.564 -2.122 -2.122
98 HD1 LEU 14 HD1 LEU 14 60.804 -2.320 -2.320
99 HD1 LEU 14 HD1 LEU 14 59.841 -0.844 -0.844
100 HD2 LEU 14 HD2 LEU 14 60.252 -2.074 -2.074
101 HD2 LEU 14 HD2 LEU 14 59.754 -3.766 -3.766
102 HD2 LEU 14 HD2 LEU 14 58.675 -2.535 -2.535
103 H SER 15 HN SER 15 54.551 -2.127 -2.127
104 HA SER 15 HA SER 15 52.466 -0.973 -0.973
105 1HB SER 15 HB2 SER 15 52.904 -0.959 -0.959
106 2HB SER 15 HB1 SER 15 51.370 -0.682 -0.682
107 HG SER 15 HG SER 15 52.928 -3.041 -3.041
108 H GLU 16 HN GLU 16 51.660 1.256 1.256
109 HA GLU 16 HA GLU 16 53.429 3.323 3.323
110 1HB GLU 16 HB2 GLU 16 50.833 3.189 3.189
111 2HB GLU 16 HB1 GLU 16 50.975 3.699 3.699
112 1HG GLU 16 HG2 GLU 16 52.158 5.718 5.718
113 2HG GLU 16 HG1 GLU 16 52.199 5.189 5.189
114 H GLU 17 HN GLU 17 52.377 2.132 2.132
115 HA GLU 17 HA GLU 17 53.418 4.062 4.062
116 1HB GLU 17 HB2 GLU 17 53.523 1.033 1.033
117 2HB GLU 17 HB1 GLU 17 53.681 2.138 2.138
118 1HG GLU 17 HG2 GLU 17 51.363 2.958 2.958
119 2HG GLU 17 HG1 GLU 17 51.276 1.197 1.197
120 H MET 18 HN MET 18 55.224 1.192 1.192
121 HA MET 18 HA MET 18 57.767 2.208 2.208
122 1HB MET 18 HB2 MET 18 57.326 -0.166 -0.166
123 2HB MET 18 HB1 MET 18 56.936 -0.042 -0.042
124 1HG MET 18 HG2 MET 18 59.117 -0.078 -0.078
125 2HG MET 18 HG1 MET 18 59.582 1.038 1.038
126 1HE MET 18 HE1 MET 18 60.123 0.732 0.732
127 2HE MET 18 HE3 MET 18 59.215 -0.466 -0.466
128 3HE MET 18 HE2 MET 18 60.945 -0.673 -0.673
129 H ILE 19 HN ILE 19 56.314 1.850 1.850
130 HA ILE 19 HA ILE 19 58.346 2.720 2.720
131 HB ILE 19 HB ILE 19 55.386 3.326 3.326
132 1HG1 ILE 19 HG12 ILE 19 56.980 1.625 1.625
133 2HG1 ILE 19 HG11 ILE 19 56.352 0.985 0.985
134 1HG2 ILE 19 HG23 ILE 19 57.432 4.107 4.107
135 2HG2 ILE 19 HG22 ILE 19 55.710 3.976 3.976
136 3HG2 ILE 19 HG21 ILE 19 56.279 5.155 5.155
137 HD1 ILE 19 HD1 ILE 19 54.083 1.456 1.456
138 HD1 ILE 19 HD1 ILE 19 54.842 0.628 0.628
139 HD1 ILE 19 HD1 ILE 19 54.615 2.376 2.376
140 H ALA 20 HN ALA 20 56.454 4.685 4.685
141 HA ALA 20 HA ALA 20 57.431 7.252 7.252
142 1HB ALA 20 HB1 ALA 20 55.683 6.114 6.114
143 2HB ALA 20 HB3 ALA 20 56.646 7.436 7.436
144 3HB ALA 20 HB2 ALA 20 55.621 7.711 7.711
145 H GLU 21 HN GLU 21 58.438 4.934 4.934
146 HA GLU 21 HA GLU 21 60.362 6.531 6.531
147 1HB GLU 21 HB2 GLU 21 59.589 4.391 4.391
148 2HB GLU 21 HB1 GLU 21 60.180 3.565 3.565
149 1HG GLU 21 HG2 GLU 21 62.062 3.178 3.178
150 2HG GLU 21 HG1 GLU 21 62.437 4.876 4.876
151 H PHE 22 HN PHE 22 60.645 4.537 4.537
152 HA PHE 22 HA PHE 22 63.501 4.966 4.966
153 1HB PHE 22 HB2 PHE 22 61.356 4.152 4.152
154 2HB PHE 22 HB1 PHE 22 63.088 3.867 3.867
155 HD1 PHE 22 HD2 PHE 22 62.816 3.500 3.500
156 HD2 PHE 22 HD1 PHE 22 61.424 1.544 1.544
157 HE1 PHE 22 HE2 PHE 22 62.584 1.374 1.374
158 HE2 PHE 22 HE1 PHE 22 61.194 -0.582 -0.582
159 HZ PHE 22 HZ PHE 22 61.774 -0.666 -0.666
160 H LYS 23 HN LYS 23 60.617 6.727 6.727
161 HA LYS 23 HA LYS 23 61.652 8.285 8.285
162 1HB LYS 23 HB2 LYS 23 59.504 8.634 8.634
163 2HB LYS 23 HB1 LYS 23 59.788 9.865 9.865
164 1HG LYS 23 HG2 LYS 23 59.351 6.957 6.957
165 2HG LYS 23 HG1 LYS 23 58.017 8.102 8.102
166 1HD LYS 23 HD2 LYS 23 60.262 9.088 9.088
167 2HD LYS 23 HD1 LYS 23 59.456 7.671 7.671
168 1HE LYS 23 HE2 LYS 23 57.252 9.012 9.012
169 2HE LYS 23 HE1 LYS 23 58.341 10.411 10.411
170 1HZ LYS 23 HZ1 LYS 23 59.188 9.215 9.215
171 2HZ LYS 23 HZ3 LYS 23 57.675 8.450 8.450
172 3HZ LYS 23 HZ2 LYS 23 57.767 10.143 10.143
173 H ALA 24 HN ALA 24 60.860 9.770 9.770
174 HA ALA 24 HA ALA 24 62.518 11.980 11.980
175 1HB ALA 24 HB1 ALA 24 60.867 11.404 11.404
176 2HB ALA 24 HB3 ALA 24 61.982 10.190 10.190
177 3HB ALA 24 HB2 ALA 24 62.411 11.900 11.900
178 H ALA 25 HN ALA 25 63.483 8.647 8.647
179 HA ALA 25 HA ALA 25 66.182 9.333 9.333
180 1HB ALA 25 HB2 ALA 25 64.807 7.308 7.308
181 2HB ALA 25 HB1 ALA 25 65.048 6.702 6.702
182 3HB ALA 25 HB3 ALA 25 66.432 6.927 6.927
183 H PHE 26 HN PHE 26 64.879 7.687 7.687
184 HA PHE 26 HA PHE 26 67.253 7.502 7.502
185 1HB PHE 26 HB2 PHE 26 65.050 6.522 6.522
186 2HB PHE 26 HB1 PHE 26 64.435 8.135 8.135
187 HD1 PHE 26 HD1 PHE 26 65.670 9.507 9.507
188 HD2 PHE 26 HD2 PHE 26 66.191 5.276 5.276
189 HE1 PHE 26 HE1 PHE 26 66.583 9.337 9.337
190 HE2 PHE 26 HE2 PHE 26 67.104 5.105 5.105
191 HZ PHE 26 HZ PHE 26 67.301 7.135 7.135
192 H ASP 27 HN ASP 27 64.998 10.260 10.260
193 HA ASP 27 HA ASP 27 66.318 11.932 11.932
194 1HB ASP 27 HB2 ASP 27 64.015 12.236 12.236
195 2HB ASP 27 HB1 ASP 27 64.626 12.578 12.578
196 H MET 28 HN MET 28 67.350 10.871 10.871
197 HA MET 28 HA MET 28 68.659 13.181 13.181
198 1HB MET 28 HB2 MET 28 69.257 10.209 10.209
199 2HB MET 28 HB1 MET 28 70.026 11.414 11.414
200 1HG MET 28 HG2 MET 28 67.031 11.331 11.331
201 2HG MET 28 HG1 MET 28 67.868 10.157 10.157
202 1HE MET 28 HE3 MET 28 65.942 11.462 11.462
203 2HE MET 28 HE2 MET 28 66.445 12.359 12.359
204 3HE MET 28 HE1 MET 28 65.908 13.230 13.230
205 H PHE 29 HN PHE 29 69.472 11.060 11.060
206 HA PHE 29 HA PHE 29 72.114 12.466 12.466
207 1HB PHE 29 HB2 PHE 29 71.535 9.780 9.780
208 2HB PHE 29 HB1 PHE 29 73.068 10.431 10.431
209 HD1 PHE 29 HD1 PHE 29 73.589 10.487 10.487
210 HD2 PHE 29 HD2 PHE 29 69.980 8.702 8.702
211 HE1 PHE 29 HE1 PHE 29 73.243 9.359 9.359
212 HE2 PHE 29 HE2 PHE 29 69.634 7.572 7.572
213 HZ PHE 29 HZ PHE 29 71.266 7.901 7.901
214 H ASP 30 HN ASP 30 69.335 13.087 13.087
215 HA ASP 30 HA ASP 30 69.878 12.729 12.729
216 1HB ASP 30 HB2 ASP 30 67.476 13.282 13.282
217 2HB ASP 30 HB1 ASP 30 67.419 13.641 13.641
218 H ALA 31 HN ALA 31 71.214 14.759 14.759
219 HA ALA 31 HA ALA 31 70.207 17.374 17.374
220 1HB ALA 31 HB3 ALA 31 72.957 16.144 16.144
221 2HB ALA 31 HB2 ALA 31 72.758 17.892 17.892
222 3HB ALA 31 HB1 ALA 31 72.069 17.019 17.019
223 H ASP 32 HN ASP 32 72.003 15.341 15.341
224 HA ASP 32 HA ASP 32 71.446 17.382 17.382
225 1HB ASP 32 HB2 ASP 32 73.984 16.068 16.068
226 2HB ASP 32 HB1 ASP 32 73.785 16.393 16.393
227 H GLY 33 HN GLY 33 70.420 14.554 14.554
228 1HA GLY 33 HA2 GLY 33 70.966 12.963 12.963
229 2HA GLY 33 HA1 GLY 33 70.035 12.427 12.427
230 H GLY 34 HN GLY 34 68.250 14.649 14.649
231 1HA GLY 34 HA2 GLY 34 66.284 15.495 15.495
232 2HA GLY 34 HA1 GLY 34 66.964 15.092 15.092
233 H GLY 35 HN GLY 35 66.672 12.688 12.688
234 1HA GLY 35 HA2 GLY 35 64.507 11.350 11.350
235 2HA GLY 35 HA1 GLY 35 64.531 11.371 11.371
236 H ASP 36 HN ASP 36 67.671 11.160 11.160
237 HA ASP 36 HA ASP 36 67.759 8.266 8.266
238 1HB ASP 36 HB2 ASP 36 69.156 7.976 7.976
239 2HB ASP 36 HB1 ASP 36 67.428 8.240 8.240
240 H ILE 37 HN ILE 37 69.425 8.039 8.039
241 HA ILE 37 HA ILE 37 71.518 10.119 10.119
242 HB ILE 37 HB ILE 37 72.065 8.923 8.923
243 1HG1 ILE 37 HG12 ILE 37 69.959 6.909 6.909
244 2HG1 ILE 37 HG11 ILE 37 71.696 6.629 6.629
245 1HG2 ILE 37 HG23 ILE 37 70.107 10.466 10.466
246 2HG2 ILE 37 HG22 ILE 37 69.063 9.090 9.090
247 3HG2 ILE 37 HG21 ILE 37 69.916 9.169 9.169
248 HD1 ILE 37 HD1 ILE 37 70.325 5.875 5.875
249 HD1 ILE 37 HD1 ILE 37 70.642 7.545 7.545
250 HD1 ILE 37 HD1 ILE 37 71.986 6.459 6.459
251 H SER 38 HN SER 38 73.799 9.578 9.578
252 HA SER 38 HA SER 38 74.601 7.965 7.965
253 1HB SER 38 HB2 SER 38 76.481 8.285 8.285
254 2HB SER 38 HB1 SER 38 76.669 8.758 8.758
255 HG SER 38 HG SER 38 75.993 10.267 10.267
256 H THR 39 HN THR 39 74.944 5.777 5.777
257 HA THR 39 HA THR 39 74.006 3.812 3.812
258 HB THR 39 HB THR 39 75.534 2.323 2.323
259 HG1 THR 39 HG1 THR 39 77.315 3.066 3.066
260 1HG2 THR 39 HG21 THR 39 73.875 4.397 4.397
261 2HG2 THR 39 HG23 THR 39 75.103 3.766 3.766
262 3HG2 THR 39 HG22 THR 39 73.947 2.668 2.668
263 H LYS 40 HN LYS 40 77.072 5.548 5.548
264 HA LYS 40 HA LYS 40 78.504 3.891 3.891
265 1HB LYS 40 HB2 LYS 40 78.528 6.598 6.598
266 2HB LYS 40 HB1 LYS 40 78.990 6.592 6.592
267 1HG LYS 40 HG2 LYS 40 80.974 5.608 5.608
268 2HG LYS 40 HG1 LYS 40 80.223 4.401 4.401
269 1HD LYS 40 HD2 LYS 40 80.320 5.811 5.811
270 2HD LYS 40 HD1 LYS 40 80.600 7.250 7.250
271 1HE LYS 40 HE2 LYS 40 82.847 6.891 6.891
272 2HE LYS 40 HE1 LYS 40 82.639 5.157 5.157
273 1HZ LYS 40 HZ1 LYS 40 81.803 6.129 6.129
274 2HZ LYS 40 HZ3 LYS 40 83.475 6.062 6.062
275 3HZ LYS 40 HZ2 LYS 40 82.532 4.656 4.656
276 H GLU 41 HN GLU 41 75.832 6.118 6.118
277 HA GLU 41 HA GLU 41 76.111 5.907 5.907
278 1HB GLU 41 HB2 GLU 41 75.558 8.039 8.039
279 2HB GLU 41 HB1 GLU 41 74.106 7.300 7.300
280 1HG GLU 41 HG2 GLU 41 73.309 8.421 8.421
281 2HG GLU 41 HG1 GLU 41 73.496 6.757 6.757
282 H LEU 42 HN LEU 42 74.525 4.259 4.259
283 HA LEU 42 HA LEU 42 72.039 3.477 3.477
284 1HB LEU 42 HB2 LEU 42 73.267 2.871 2.871
285 2HB LEU 42 HB1 LEU 42 74.065 1.598 1.598
286 HG LEU 42 HG LEU 42 71.291 1.439 1.439
287 HD1 LEU 42 HD1 LEU 42 70.396 2.347 2.347
288 HD1 LEU 42 HD1 LEU 42 70.847 0.799 0.799
289 HD1 LEU 42 HD1 LEU 42 71.904 2.198 2.198
290 HD2 LEU 42 HD2 LEU 42 71.839 -0.740 -0.740
291 HD2 LEU 42 HD2 LEU 42 73.456 -0.217 -0.217
292 HD2 LEU 42 HD2 LEU 42 72.232 -0.523 -0.523
293 H GLY 43 HN GLY 43 75.202 2.672 2.672
294 1HA GLY 43 HA2 GLY 43 74.324 0.361 0.361
295 2HA GLY 43 HA1 GLY 43 75.873 1.189 1.189
296 H THR 44 HN THR 44 74.681 3.826 3.826
297 HA THR 44 HA THR 44 74.276 3.668 3.668
298 HB THR 44 HB THR 44 74.107 5.852 5.852
299 HG1 THR 44 HG1 THR 44 76.159 4.957 4.957
300 1HG2 THR 44 HG22 THR 44 73.887 6.065 6.065
301 2HG2 THR 44 HG21 THR 44 74.092 7.434 7.434
302 3HG2 THR 44 HG23 THR 44 72.626 6.455 6.455
303 H VAL 45 HN VAL 45 72.153 4.843 4.843
304 HA VAL 45 HA VAL 45 69.808 5.328 5.328
305 HB VAL 45 HB VAL 45 70.194 5.636 5.636
306 1HG1 VAL 45 HG12 VAL 45 71.250 3.246 3.246
307 2HG1 VAL 45 HG11 VAL 45 69.587 2.713 2.713
308 3HG1 VAL 45 HG13 VAL 45 70.330 3.847 3.847
309 1HG2 VAL 45 HG21 VAL 45 67.866 5.463 5.463
310 2HG2 VAL 45 HG23 VAL 45 67.954 5.148 5.148
311 3HG2 VAL 45 HG22 VAL 45 67.822 3.804 3.804
312 H MET 46 HN MET 46 71.107 2.166 2.166
313 HA MET 46 HA MET 46 68.793 0.651 0.651
314 1HB MET 46 HB2 MET 46 71.634 0.105 0.105
315 2HB MET 46 HB1 MET 46 70.654 -1.197 -1.197
316 1HG MET 46 HG2 MET 46 68.979 -0.924 -0.924
317 2HG MET 46 HG1 MET 46 69.769 0.533 0.533
318 1HE MET 46 HE2 MET 46 69.240 -2.947 -2.947
319 2HE MET 46 HE1 MET 46 69.142 -2.623 -2.623
320 3HE MET 46 HE3 MET 46 70.368 -3.733 -3.733
321 H ARG 47 HN ARG 47 72.053 1.250 1.250
322 HA ARG 47 HA ARG 47 71.655 -0.211 -0.211
323 1HB ARG 47 HB2 ARG 47 73.572 1.581 1.581
324 2HB ARG 47 HB1 ARG 47 73.435 1.916 1.916
325 1HG ARG 47 HG2 ARG 47 73.554 -0.952 -0.952
326 2HG ARG 47 HG1 ARG 47 75.036 -0.026 -0.026
327 1HD ARG 47 HD2 ARG 47 73.869 0.666 0.666
328 2HD ARG 47 HD1 ARG 47 74.106 -1.089 -1.089
329 HE ARG 47 HE ARG 47 76.444 -0.139 -0.139
330 1HH1 ARG 47 HH2 ARG 47 74.875 -0.203 -0.203
331 2HH1 ARG 47 HH2 ARG 47 76.153 0.591 0.591
332 1HH2 ARG 47 HH1 ARG 47 78.015 1.245 1.245
333 2HH2 ARG 47 HH1 ARG 47 77.931 1.411 1.411
334 H MET 48 HN MET 48 71.335 3.290 3.290
335 HA MET 48 HA MET 48 70.440 4.039 4.039
336 1HB MET 48 HB2 MET 48 70.838 5.175 5.175
337 2HB MET 48 HB1 MET 48 69.360 5.804 5.804
338 1HG MET 48 HG2 MET 48 71.280 5.772 5.772
339 2HG MET 48 HG1 MET 48 72.108 6.422 6.422
340 1HE MET 48 HE2 MET 48 70.045 6.662 6.662
341 2HE MET 48 HE1 MET 48 69.438 8.312 8.312
342 3HE MET 48 HE3 MET 48 68.480 7.062 7.062
343 H LEU 49 HN LEU 49 68.913 2.259 2.259
344 HA LEU 49 HA LEU 49 66.164 3.108 3.108
345 1HB LEU 49 HB2 LEU 49 67.605 1.671 1.671
346 2HB LEU 49 HB1 LEU 49 66.134 0.822 0.822
347 HG LEU 49 HG LEU 49 64.765 2.715 2.715
348 HD1 LEU 49 HD1 LEU 49 67.361 4.165 4.165
349 HD1 LEU 49 HD1 LEU 49 65.762 4.636 4.636
350 HD1 LEU 49 HD1 LEU 49 66.171 4.807 4.807
351 HD2 LEU 49 HD2 LEU 49 66.257 1.464 1.464
352 HD2 LEU 49 HD2 LEU 49 66.603 3.163 3.163
353 HD2 LEU 49 HD2 LEU 49 64.936 2.587 2.587
354 H GLY 50 HN GLY 50 68.203 0.185 0.185
355 1HA GLY 50 HA2 GLY 50 67.792 -0.802 -0.802
356 2HA GLY 50 HA1 GLY 50 66.141 -0.984 -0.984
357 H GLN 51 HN GLN 51 69.089 -1.456 -1.456
358 HA GLN 51 HA GLN 51 68.447 -4.384 -4.384
359 1HB GLN 51 HB2 GLN 51 69.211 -2.482 -2.482
360 2HB GLN 51 HB1 GLN 51 68.975 -4.221 -4.221
361 1HG GLN 51 HG2 GLN 51 66.745 -3.959 -3.959
362 2HG GLN 51 HG1 GLN 51 66.711 -3.055 -3.055
363 1HE2 GLN 51 HE22 GLN 51 65.946 -1.018 -1.018
364 2HE2 GLN 51 HE21 GLN 51 65.665 -2.674 -2.674
365 H ASN 52 HN ASN 52 70.610 -4.952 -4.952
366 HA ASN 52 HA ASN 52 73.078 -3.946 -3.946
367 1HB ASN 52 HB2 ASN 52 71.875 -6.681 -6.681
368 2HB ASN 52 HB1 ASN 52 73.630 -6.498 -6.498
369 HD2 ASN 52 HD2 ASN 52 74.572 -5.174 -5.174
370 HD2 ASN 52 HD2 ASN 52 73.678 -4.810 -4.810
371 HA PRO 53 HA PRO 53 73.391 -5.140 -5.140
372 1HB PRO 53 HB2 PRO 53 74.456 -2.760 -2.760
373 2HB PRO 53 HB1 PRO 53 72.708 -3.053 -3.053
374 1HG PRO 53 HG2 PRO 53 74.498 -1.595 -1.595
375 2HG PRO 53 HG1 PRO 53 72.838 -1.228 -1.228
376 1HD PRO 53 HD2 PRO 53 73.486 -2.397 -2.397
377 2HD PRO 53 HD1 PRO 53 71.927 -2.629 -2.629
378 H THR 54 HN THR 54 75.122 -6.585 -6.585
379 HA THR 54 HA THR 54 77.690 -5.723 -5.723
380 HB THR 54 HB THR 54 77.907 -8.133 -8.133
381 HG1 THR 54 HG1 THR 54 75.706 -8.230 -8.230
382 1HG2 THR 54 HG21 THR 54 78.052 -7.181 -7.181
383 2HG2 THR 54 HG23 THR 54 77.299 -8.774 -8.774
384 3HG2 THR 54 HG22 THR 54 78.905 -8.527 -8.527
385 H LYS 55 HN LYS 55 79.671 -5.470 -5.470
386 HA LYS 55 HA LYS 55 79.627 -3.999 -3.999
387 1HB LYS 55 HB2 LYS 55 81.488 -4.720 -4.720
388 2HB LYS 55 HB1 LYS 55 81.872 -5.909 -5.909
389 1HG LYS 55 HG2 LYS 55 83.148 -4.214 -4.214
390 2HG LYS 55 HG1 LYS 55 81.611 -3.679 -3.679
391 1HD LYS 55 HD2 LYS 55 81.911 -2.785 -2.785
392 2HD LYS 55 HD1 LYS 55 83.248 -2.225 -2.225
393 1HE LYS 55 HE2 LYS 55 81.224 -1.690 -1.690
394 2HE LYS 55 HE1 LYS 55 80.351 -1.533 -1.533
395 1HZ LYS 55 HZ2 LYS 55 82.436 -0.252 -0.252
396 2HZ LYS 55 HZ1 LYS 55 82.745 -0.073 -0.073
397 3HZ LYS 55 HZ3 LYS 55 81.313 0.547 0.547
398 H GLU 56 HN GLU 56 80.173 -7.528 -7.528
399 HA GLU 56 HA GLU 56 80.440 -8.128 -8.128
400 1HB GLU 56 HB2 GLU 56 80.571 -9.467 -9.467
401 2HB GLU 56 HB1 GLU 56 79.018 -10.051 -10.051
402 1HG GLU 56 HG2 GLU 56 80.817 -11.524 -11.524
403 2HG GLU 56 HG1 GLU 56 80.100 -10.672 -10.672
404 H GLU 57 HN GLU 57 77.532 -7.933 -7.933
405 HA GLU 57 HA GLU 57 75.740 -8.651 -8.651
406 1HB GLU 57 HB2 GLU 57 75.190 -7.506 -7.506
407 2HB GLU 57 HB1 GLU 57 74.030 -8.337 -8.337
408 1HG GLU 57 HG2 GLU 57 76.482 -9.508 -9.508
409 2HG GLU 57 HG1 GLU 57 74.797 -9.962 -9.962
410 H LEU 58 HN LEU 58 77.067 -5.736 -5.736
411 HA LEU 58 HA LEU 58 75.039 -3.942 -3.942
412 1HB LEU 58 HB2 LEU 58 76.188 -3.312 -3.312
413 2HB LEU 58 HB1 LEU 58 77.765 -3.628 -3.628
414 HG LEU 58 HG LEU 58 77.543 -1.757 -1.757
415 HD1 LEU 58 HD1 LEU 58 75.281 -0.361 -0.361
416 HD1 LEU 58 HD1 LEU 58 74.689 -2.006 -2.006
417 HD1 LEU 58 HD1 LEU 58 75.400 -1.531 -1.531
418 HD2 LEU 58 HD2 LEU 58 78.305 -1.059 -1.059
419 HD2 LEU 58 HD2 LEU 58 76.675 -1.134 -1.134
420 HD2 LEU 58 HD2 LEU 58 77.093 0.122 0.122
421 H ASP 59 HN ASP 59 78.368 -4.916 -4.916
422 HA ASP 59 HA ASP 59 78.671 -3.165 -3.165
423 1HB ASP 59 HB2 ASP 59 80.559 -4.233 -4.233
424 2HB ASP 59 HB1 ASP 59 79.875 -5.835 -5.835
425 H ALA 60 HN ALA 60 77.556 -6.549 -6.549
426 HA ALA 60 HA ALA 60 77.197 -7.112 -7.112
427 1HB ALA 60 HB1 ALA 60 76.703 -8.282 -8.282
428 2HB ALA 60 HB3 ALA 60 75.118 -8.202 -8.202
429 3HB ALA 60 HB2 ALA 60 76.446 -9.039 -9.039
430 H ILE 61 HN ILE 61 75.178 -5.298 -5.298
431 HA ILE 61 HA ILE 61 72.884 -5.128 -5.128
432 HB ILE 61 HB ILE 61 73.753 -3.737 -3.737
433 1HG1 ILE 61 HG12 ILE 61 71.526 -5.720 -5.720
434 2HG1 ILE 61 HG11 ILE 61 73.107 -6.163 -6.163
435 1HG2 ILE 61 HG21 ILE 61 71.204 -3.436 -3.436
436 2HG2 ILE 61 HG23 ILE 61 71.365 -2.920 -2.920
437 3HG2 ILE 61 HG22 ILE 61 72.351 -2.166 -2.166
438 HD1 ILE 61 HD1 ILE 61 71.827 -3.951 -3.951
439 HD1 ILE 61 HD1 ILE 61 72.594 -5.411 -5.411
440 HD1 ILE 61 HD1 ILE 61 70.920 -5.462 -5.462
441 H ILE 62 HN ILE 62 75.241 -2.684 -2.684
442 HA ILE 62 HA ILE 62 74.535 -0.503 -0.503
443 HB ILE 62 HB ILE 62 77.205 -1.629 -1.629
444 1HG1 ILE 62 HG12 ILE 62 76.126 0.959 0.959
445 2HG1 ILE 62 HG11 ILE 62 75.211 -0.477 -0.477
446 1HG2 ILE 62 HG22 ILE 62 76.591 0.708 0.708
447 2HG2 ILE 62 HG21 ILE 62 77.780 0.962 0.962
448 3HG2 ILE 62 HG23 ILE 62 78.040 -0.295 -0.295
449 HD1 ILE 62 HD1 ILE 62 77.449 -1.495 -1.495
450 HD1 ILE 62 HD1 ILE 62 76.839 -0.180 -0.180
451 HD1 ILE 62 HD1 ILE 62 78.122 0.126 0.126
452 H GLU 63 HN GLU 63 76.888 -3.040 -3.040
453 HA GLU 63 HA GLU 63 77.372 -2.206 -2.206
454 1HB GLU 63 HB2 GLU 63 78.473 -4.040 -4.040
455 2HB GLU 63 HB1 GLU 63 77.069 -5.052 -5.052
456 1HG GLU 63 HG2 GLU 63 77.779 -5.491 -5.491
457 2HG GLU 63 HG1 GLU 63 78.149 -3.794 -3.794
458 H GLU 64 HN GLU 64 74.693 -4.127 -4.127
459 HA GLU 64 HA GLU 64 73.483 -4.798 -4.798
460 1HB GLU 64 HB2 GLU 64 72.836 -6.129 -6.129
461 2HB GLU 64 HB1 GLU 64 72.734 -4.756 -4.756
462 1HG GLU 64 HG2 GLU 64 70.497 -5.721 -5.721
463 2HG GLU 64 HG1 GLU 64 70.675 -4.005 -4.005
464 H VAL 65 HN VAL 65 72.722 -2.284 -2.284
465 HA VAL 65 HA VAL 65 70.783 -0.981 -0.981
466 HB VAL 65 HB VAL 65 70.479 0.469 0.469
467 1HG1 VAL 65 HG11 VAL 65 69.800 -1.970 -1.970
468 2HG1 VAL 65 HG13 VAL 65 71.282 -2.218 -2.218
469 3HG1 VAL 65 HG12 VAL 65 70.040 -1.121 -1.121
470 1HG2 VAL 65 HG21 VAL 65 73.198 -0.576 -0.576
471 2HG2 VAL 65 HG23 VAL 65 72.743 1.094 1.094
472 3HG2 VAL 65 HG22 VAL 65 72.128 0.286 0.286
473 H ASP 66 HN ASP 66 74.133 -1.025 -1.025
474 HA ASP 66 HA ASP 66 74.464 1.822 1.822
475 1HB ASP 66 HB2 ASP 66 75.924 0.871 0.871
476 2HB ASP 66 HB1 ASP 66 76.414 -0.415 -0.415
477 H GLU 67 HN GLU 67 74.083 -1.285 -1.285
478 HA GLU 67 HA GLU 67 75.777 -0.991 -0.991
479 1HB GLU 67 HB2 GLU 67 74.123 -2.923 -2.923
480 2HB GLU 67 HB1 GLU 67 73.496 -2.718 -2.718
481 1HG GLU 67 HG2 GLU 67 76.137 -2.784 -2.784
482 2HG GLU 67 HG1 GLU 67 76.122 -3.783 -3.783
483 H ASP 68 HN ASP 68 73.073 0.721 0.721
484 HA ASP 68 HA ASP 68 71.476 0.787 0.787
485 1HB ASP 68 HB2 ASP 68 71.403 1.812 1.812
486 2HB ASP 68 HB1 ASP 68 71.741 3.261 3.261
487 H GLY 69 HN GLY 69 74.244 2.784 2.784
488 1HA GLY 69 HA2 GLY 69 75.592 3.226 3.226
489 2HA GLY 69 HA1 GLY 69 74.193 4.269 4.269
490 H SER 70 HN SER 70 74.037 4.789 4.789
491 HA SER 70 HA SER 70 76.237 6.823 6.823
492 1HB SER 70 HB2 SER 70 73.463 6.689 6.689
493 2HB SER 70 HB1 SER 70 74.612 7.984 7.984
494 HG SER 70 HG SER 70 74.636 8.397 8.397
495 H GLY 71 HN GLY 71 74.263 5.947 5.947
496 1HA GLY 71 HA2 GLY 71 75.546 3.951 3.951
497 2HA GLY 71 HA1 GLY 71 76.683 5.285 5.285
498 H THR 72 HN THR 72 73.143 5.516 5.516
499 HA THR 72 HA THR 72 73.215 6.406 6.406
500 HB THR 72 HB THR 72 71.367 7.996 7.996
501 HG1 THR 72 HG1 THR 72 71.477 8.384 8.384
502 1HG2 THR 72 HG23 THR 72 74.271 8.118 8.118
503 2HG2 THR 72 HG22 THR 72 73.249 9.337 9.337
504 3HG2 THR 72 HG21 THR 72 73.286 9.190 9.190
505 H ILE 73 HN ILE 73 71.142 6.071 6.071
506 HA ILE 73 HA ILE 73 69.553 3.820 3.820
507 HB ILE 73 HB ILE 73 71.042 3.481 3.481
508 1HG1 ILE 73 HG12 ILE 73 69.013 2.411 2.411
509 2HG1 ILE 73 HG11 ILE 73 68.098 2.895 2.895
510 1HG2 ILE 73 HG22 ILE 73 70.126 5.805 5.805
511 2HG2 ILE 73 HG21 ILE 73 68.848 4.795 4.795
512 3HG2 ILE 73 HG23 ILE 73 70.528 4.512 4.512
513 HD1 ILE 73 HD1 ILE 73 70.696 1.480 1.480
514 HD1 ILE 73 HD1 ILE 73 69.225 1.433 1.433
515 HD1 ILE 73 HD1 ILE 73 69.313 0.527 0.527
516 H ASP 74 HN ASP 74 67.379 4.199 4.199
517 HA ASP 74 HA ASP 74 66.280 6.820 6.820
518 1HB ASP 74 HB2 ASP 74 65.639 4.598 4.598
519 2HB ASP 74 HB1 ASP 74 64.288 5.581 5.581
520 H PHE 75 HN PHE 75 64.312 6.976 6.976
521 HA PHE 75 HA PHE 75 64.145 5.244 5.244
522 1HB PHE 75 HB2 PHE 75 63.332 7.681 7.681
523 2HB PHE 75 HB1 PHE 75 61.869 6.914 6.914
524 HD1 PHE 75 HD2 PHE 75 60.891 4.985 4.985
525 HD2 PHE 75 HD1 PHE 75 63.433 8.177 8.177
526 HE1 PHE 75 HE2 PHE 75 60.077 4.658 4.658
527 HE2 PHE 75 HE1 PHE 75 62.619 7.850 7.850
528 HZ PHE 75 HZ PHE 75 60.941 6.090 6.090
529 H GLU 76 HN GLU 76 61.972 5.515 5.515
530 HA GLU 76 HA GLU 76 60.161 3.461 3.461
531 1HB GLU 76 HB2 GLU 76 59.930 3.323 3.323
532 2HB GLU 76 HB1 GLU 76 59.835 4.957 4.957
533 1HG GLU 76 HG2 GLU 76 61.384 5.392 5.392
534 2HG GLU 76 HG1 GLU 76 62.507 4.784 4.784
535 H GLU 77 HN GLU 77 63.285 3.197 3.197
536 HA GLU 77 HA GLU 77 63.096 0.286 0.286
537 1HB GLU 77 HB2 GLU 77 64.242 1.858 1.858
538 2HB GLU 77 HB1 GLU 77 65.458 2.155 2.155
539 1HG GLU 77 HG2 GLU 77 66.383 0.054 0.054
540 2HG GLU 77 HG1 GLU 77 64.854 -0.688 -0.688
541 H PHE 78 HN PHE 78 65.180 2.553 2.553
542 HA PHE 78 HA PHE 78 66.714 0.775 0.775
543 1HB PHE 78 HB2 PHE 78 67.045 3.130 3.130
544 2HB PHE 78 HB1 PHE 78 65.372 3.403 3.403
545 HD1 PHE 78 HD1 PHE 78 68.480 1.624 1.624
546 HD2 PHE 78 HD2 PHE 78 64.821 3.533 3.533
547 HE1 PHE 78 HE1 PHE 78 69.133 1.396 1.396
548 HE2 PHE 78 HE2 PHE 78 65.471 3.306 3.306
549 HZ PHE 78 HZ PHE 78 67.627 2.237 2.237
550 H LEU 79 HN LEU 79 63.298 1.578 1.578
551 HA LEU 79 HA LEU 79 62.679 0.686 0.686
552 1HB LEU 79 HB2 LEU 79 61.383 0.516 0.516
553 2HB LEU 79 HB1 LEU 79 60.615 -0.335 -0.335
554 HG LEU 79 HG LEU 79 61.477 2.540 2.540
555 HD1 LEU 79 HD1 LEU 79 58.628 2.052 2.052
556 HD1 LEU 79 HD1 LEU 79 59.685 1.748 1.748
557 HD1 LEU 79 HD1 LEU 79 59.687 3.329 3.329
558 HD2 LEU 79 HD2 LEU 79 60.834 1.084 1.084
559 HD2 LEU 79 HD2 LEU 79 59.216 0.982 0.982
560 HD2 LEU 79 HD2 LEU 79 59.863 2.544 2.544
561 H VAL 80 HN VAL 80 63.602 -1.303 -1.303
562 HA VAL 80 HA VAL 80 62.914 -3.856 -3.856
563 HB VAL 80 HB VAL 80 64.147 -4.711 -4.711
564 1HG1 VAL 80 HG13 VAL 80 62.378 -2.465 -2.465
565 2HG1 VAL 80 HG12 VAL 80 63.593 -2.393 -2.393
566 3HG1 VAL 80 HG11 VAL 80 62.593 -3.833 -3.833
567 1HG2 VAL 80 HG21 VAL 80 65.524 -2.007 -2.007
568 2HG2 VAL 80 HG23 VAL 80 66.261 -3.545 -3.545
569 3HG2 VAL 80 HG22 VAL 80 65.745 -3.264 -3.264
570 H MET 81 HN MET 81 65.944 -1.965 -1.965
571 HA MET 81 HA MET 81 67.687 -3.804 -3.804
572 1HB MET 81 HB2 MET 81 67.451 -0.917 -0.917
573 2HB MET 81 HB1 MET 81 68.390 -1.301 -1.301
574 1HG MET 81 HG2 MET 81 69.866 -1.213 -1.213
575 2HG MET 81 HG1 MET 81 69.776 -2.864 -2.864
576 1HE MET 81 HE3 MET 81 69.615 -4.590 -4.590
577 2HE MET 81 HE2 MET 81 67.877 -4.781 -4.781
578 3HE MET 81 HE1 MET 81 68.946 -4.929 -4.929
579 H MET 82 HN MET 82 65.203 -1.723 -1.723
580 HA MET 82 HA MET 82 65.993 -2.052 -2.052
581 1HB MET 82 HB2 MET 82 63.237 -1.537 -1.537
582 2HB MET 82 HB1 MET 82 63.846 -1.028 -1.028
583 1HG MET 82 HG2 MET 82 65.725 0.084 0.084
584 2HG MET 82 HG1 MET 82 64.332 0.142 0.142
585 1HE MET 82 HE1 MET 82 63.639 1.999 1.999
586 2HE MET 82 HE3 MET 82 62.126 2.025 2.025
587 3HE MET 82 HE2 MET 82 63.249 3.379 3.379
588 H VAL 83 HN VAL 83 63.167 -3.465 -3.465
589 HA VAL 83 HA VAL 83 62.639 -5.444 -5.444
590 HB VAL 83 HB VAL 83 61.029 -4.627 -4.627
591 1HG1 VAL 83 HG11 VAL 83 62.736 -4.456 -4.456
592 2HG1 VAL 83 HG13 VAL 83 62.677 -6.213 -6.213
593 3HG1 VAL 83 HG12 VAL 83 61.240 -5.249 -5.249
594 1HG2 VAL 83 HG21 VAL 83 61.063 -7.060 -7.060
595 2HG2 VAL 83 HG23 VAL 83 59.935 -6.671 -6.671
596 3HG2 VAL 83 HG22 VAL 83 61.431 -7.535 -7.535
597 H ARG 84 HN ARG 84 64.416 -5.624 -5.624
598 HA ARG 84 HA ARG 84 65.022 -8.385 -8.385
599 1HB ARG 84 HB2 ARG 84 66.632 -5.978 -5.978
600 2HB ARG 84 HB1 ARG 84 66.944 -7.640 -7.640
601 1HG ARG 84 HG2 ARG 84 64.137 -6.891 -6.891
602 2HG ARG 84 HG1 ARG 84 65.220 -5.861 -5.861
603 1HD ARG 84 HD2 ARG 84 64.779 -7.699 -7.699
604 2HD ARG 84 HD1 ARG 84 66.351 -8.101 -8.101
605 HE ARG 84 HE ARG 84 63.986 -9.049 -9.049
606 1HH1 ARG 84 HH1 ARG 84 67.072 -9.870 -9.870
607 2HH1 ARG 84 HH1 ARG 84 66.776 -11.495 -11.495
608 1HH2 ARG 84 HH2 ARG 84 63.343 -11.072 -11.072
609 2HH2 ARG 84 HH2 ARG 84 64.664 -12.175 -12.175
610 H GLN 85 HN GLN 85 66.595 -5.685 -5.685
611 HA GLN 85 HA GLN 85 68.737 -7.389 -7.389
612 1HB GLN 85 HB2 GLN 85 69.103 -5.028 -5.028
613 2HB GLN 85 HB1 GLN 85 67.820 -4.547 -4.547
614 1HG GLN 85 HG2 GLN 85 70.061 -4.276 -4.276
615 2HG GLN 85 HG1 GLN 85 69.090 -5.468 -5.468
616 1HE2 GLN 85 HE22 GLN 85 71.739 -7.256 -7.256
617 2HE2 GLN 85 HE21 GLN 85 70.637 -6.107 -6.107
618 H MET 86 HN MET 86 65.812 -5.754 -5.754
619 HA MET 86 HA MET 86 66.087 -6.649 -6.649
620 1HB MET 86 HB2 MET 86 64.219 -5.228 -5.228
621 2HB MET 86 HB1 MET 86 63.363 -6.297 -6.297
622 1HG MET 86 HG2 MET 86 65.279 -5.198 -5.198
623 2HG MET 86 HG1 MET 86 64.897 -3.850 -3.850
624 1HE MET 86 HE1 MET 86 63.581 -2.403 -2.403
625 2HE MET 86 HE3 MET 86 61.951 -2.915 -2.915
626 3HE MET 86 HE2 MET 86 62.244 -2.233 -2.233
627 H LYS 87 HN LYS 87 64.953 -8.192 -8.192
628 HA LYS 87 HA LYS 87 63.185 -10.159 -10.159
629 1HB LYS 87 HB2 LYS 87 65.309 -9.937 -9.937
630 2HB LYS 87 HB1 LYS 87 64.620 -11.534 -11.534
631 1HG LYS 87 HG2 LYS 87 62.836 -9.135 -9.135
632 2HG LYS 87 HG1 LYS 87 63.470 -10.011 -10.011
633 1HD LYS 87 HD2 LYS 87 61.824 -11.522 -11.522
634 2HD LYS 87 HD1 LYS 87 62.528 -11.973 -11.973
635 1HE LYS 87 HE2 LYS 87 61.204 -10.252 -10.252
636 2HE LYS 87 HE1 LYS 87 60.538 -9.711 -9.711
637 1HZ LYS 87 HZ2 LYS 87 60.311 -12.461 -12.461
638 2HZ LYS 87 HZ1 LYS 87 59.062 -11.310 -11.310
639 3HZ LYS 87 HZ3 LYS 87 59.673 -11.930 -11.930
640 H GLU 88 HN GLU 88 66.606 -9.811 -9.811
641 HA GLU 88 HA GLU 88 66.801 -12.528 -12.528
642 1HB GLU 88 HB2 GLU 88 68.482 -11.071 -11.071
643 2HB GLU 88 HB1 GLU 88 69.015 -10.532 -10.532
644 1HG GLU 88 HG2 GLU 88 70.351 -12.432 -12.432
645 2HG GLU 88 HG1 GLU 88 69.079 -13.033 -13.033
646 H ASP 89 HN ASP 89 66.932 -9.088 -9.088
647 HA ASP 89 HA ASP 89 67.509 -9.608 -9.608
648 1HB ASP 89 HB2 ASP 89 66.822 -7.279 -7.279
649 2HB ASP 89 HB1 ASP 89 66.719 -7.078 -7.078
650 H ALA 90 HN ALA 90 64.628 -9.155 -9.155
651 HA ALA 90 HA ALA 90 62.831 -8.859 -8.859
652 1HB ALA 90 HB1 ALA 90 62.655 -8.991 -8.991
653 2HB ALA 90 HB3 ALA 90 61.185 -9.230 -9.230
654 3HB ALA 90 HB2 ALA 90 62.093 -7.726 -7.726
Start of MODEL 35
1 1H ALA 1 HT2 ALA 1 65.153 -4.470 -4.470
2 2H ALA 1 HT1 ALA 1 65.886 -3.825 -3.825
3 3H ALA 1 HT3 ALA 1 66.842 -4.312 -4.312
4 HA ALA 1 HA ALA 1 66.270 -6.617 -6.617
5 1HB ALA 1 HB1 ALA 1 67.150 -5.002 -5.002
6 2HB ALA 1 HB3 ALA 1 67.341 -6.752 -6.752
7 3HB ALA 1 HB2 ALA 1 68.185 -5.687 -5.687
8 H SER 2 HN SER 2 65.679 -7.747 -7.747
9 HA SER 2 HA SER 2 62.746 -7.522 -7.522
10 1HB SER 2 HB2 SER 2 64.790 -9.429 -9.429
11 2HB SER 2 HB1 SER 2 63.818 -9.192 -9.192
12 HG SER 2 HG SER 2 63.107 -10.785 -10.785
13 H MET 3 HN MET 3 65.318 -5.984 -5.984
14 HA MET 3 HA MET 3 64.533 -5.715 -5.715
15 1HB MET 3 HB2 MET 3 66.070 -4.226 -4.226
16 2HB MET 3 HB1 MET 3 65.490 -3.234 -3.234
17 1HG MET 3 HG2 MET 3 67.764 -4.283 -4.283
18 2HG MET 3 HG1 MET 3 66.570 -4.651 -4.651
19 1HE MET 3 HE1 MET 3 65.970 -6.505 -6.505
20 2HE MET 3 HE3 MET 3 66.339 -8.162 -8.162
21 3HE MET 3 HE2 MET 3 67.617 -7.119 -7.119
22 H THR 4 HN THR 4 63.369 -3.919 -3.919
23 HA THR 4 HA THR 4 61.764 -1.976 -1.976
24 HB THR 4 HB THR 4 62.330 -2.270 -2.270
25 HG1 THR 4 HG1 THR 4 60.808 -0.789 -0.789
26 1HG2 THR 4 HG21 THR 4 61.680 -4.716 -4.716
27 2HG2 THR 4 HG23 THR 4 59.995 -4.197 -4.197
28 3HG2 THR 4 HG22 THR 4 61.018 -3.776 -3.776
29 H ASP 5 HN ASP 5 61.292 -5.422 -5.422
30 HA ASP 5 HA ASP 5 58.414 -5.316 -5.316
31 1HB ASP 5 HB2 ASP 5 59.379 -7.040 -7.040
32 2HB ASP 5 HB1 ASP 5 60.458 -7.555 -7.555
33 H GLN 6 HN GLN 6 61.410 -6.315 -6.315
34 HA GLN 6 HA GLN 6 60.136 -7.021 -7.021
35 1HB GLN 6 HB2 GLN 6 62.825 -6.613 -6.613
36 2HB GLN 6 HB1 GLN 6 62.724 -6.261 -6.261
37 1HG GLN 6 HG2 GLN 6 61.871 -8.830 -8.830
38 2HG GLN 6 HG1 GLN 6 63.259 -8.621 -8.621
39 1HE2 GLN 6 HE22 GLN 6 60.101 -9.842 -9.842
40 2HE2 GLN 6 HE21 GLN 6 60.731 -10.315 -10.315
41 H GLN 7 HN GLN 7 60.663 -3.991 -3.991
42 HA GLN 7 HA GLN 7 61.129 -2.358 -2.358
43 1HB GLN 7 HB2 GLN 7 61.501 -1.853 -1.853
44 2HB GLN 7 HB1 GLN 7 59.762 -1.580 -1.580
45 1HG GLN 7 HG2 GLN 7 60.515 -0.123 -0.123
46 2HG GLN 7 HG1 GLN 7 61.840 0.144 0.144
47 1HE2 GLN 7 HE22 GLN 7 59.144 1.218 1.218
48 2HE2 GLN 7 HE21 GLN 7 60.082 -0.194 -0.194
49 H ALA 8 HN ALA 8 58.291 -3.850 -3.850
50 HA ALA 8 HA ALA 8 56.372 -2.060 -2.060
51 1HB ALA 8 HB2 ALA 8 56.431 -4.382 -4.382
52 2HB ALA 8 HB1 ALA 8 55.047 -4.367 -4.367
53 3HB ALA 8 HB3 ALA 8 55.335 -3.001 -3.001
54 H GLU 9 HN GLU 9 56.748 -5.605 -5.605
55 HA GLU 9 HA GLU 9 55.471 -5.869 -5.869
56 1HB GLU 9 HB2 GLU 9 56.250 -7.649 -7.649
57 2HB GLU 9 HB1 GLU 9 57.881 -7.422 -7.422
58 1HG GLU 9 HG2 GLU 9 57.429 -8.609 -8.609
59 2HG GLU 9 HG1 GLU 9 55.904 -7.759 -7.759
60 H ALA 10 HN ALA 10 58.793 -4.894 -4.894
61 HA ALA 10 HA ALA 10 59.989 -5.166 -5.166
62 1HB ALA 10 HB2 ALA 10 60.288 -3.304 -3.304
63 2HB ALA 10 HB1 ALA 10 61.285 -3.075 -3.075
64 3HB ALA 10 HB3 ALA 10 61.371 -4.589 -4.589
65 H ARG 11 HN ARG 11 58.818 -2.040 -2.040
66 HA ARG 11 HA ARG 11 58.690 -0.752 -0.752
67 1HB ARG 11 HB2 ARG 11 57.623 1.006 1.006
68 2HB ARG 11 HB1 ARG 11 58.807 0.250 0.250
69 1HG ARG 11 HG2 ARG 11 56.606 -1.301 -1.301
70 2HG ARG 11 HG1 ARG 11 55.859 0.269 0.269
71 1HD ARG 11 HD2 ARG 11 58.251 0.404 0.404
72 2HD ARG 11 HD1 ARG 11 56.890 -0.495 -0.495
73 HE ARG 11 HE ARG 11 56.643 2.290 2.290
74 1HH1 ARG 11 HH1 ARG 11 54.143 0.618 0.618
75 2HH1 ARG 11 HH1 ARG 11 53.644 1.124 1.124
76 1HH2 ARG 11 HH2 ARG 11 56.698 2.560 2.560
77 2HH2 ARG 11 HH2 ARG 11 55.090 2.223 2.223
78 H ALA 12 HN ALA 12 56.425 -2.811 -2.811
79 HA ALA 12 HA ALA 12 54.118 -2.039 -2.039
80 1HB ALA 12 HB3 ALA 12 54.000 -2.766 -2.766
81 2HB ALA 12 HB2 ALA 12 54.577 -4.361 -4.361
82 3HB ALA 12 HB1 ALA 12 53.012 -3.778 -3.778
83 H PHE 13 HN PHE 13 56.848 -3.763 -3.763
84 HA PHE 13 HA PHE 13 55.838 -6.154 -6.154
85 1HB PHE 13 HB2 PHE 13 58.142 -6.044 -6.044
86 2HB PHE 13 HB1 PHE 13 58.320 -4.448 -4.448
87 HD1 PHE 13 HD1 PHE 13 56.839 -7.676 -7.676
88 HD2 PHE 13 HD2 PHE 13 59.725 -4.559 -4.559
89 HE1 PHE 13 HE1 PHE 13 57.497 -8.724 -8.724
90 HE2 PHE 13 HE2 PHE 13 60.384 -5.607 -5.607
91 HZ PHE 13 HZ PHE 13 59.270 -7.689 -7.689
92 H LEU 14 HN LEU 14 56.427 -2.855 -2.855
93 HA LEU 14 HA LEU 14 55.217 -3.651 -3.651
94 1HB LEU 14 HB2 LEU 14 56.876 -1.218 -1.218
95 2HB LEU 14 HB1 LEU 14 56.486 -1.790 -1.790
96 HG LEU 14 HG LEU 14 57.997 -3.494 -3.494
97 HD1 LEU 14 HD1 LEU 14 59.543 -2.281 -2.281
98 HD1 LEU 14 HD1 LEU 14 58.947 -1.102 -1.102
99 HD1 LEU 14 HD1 LEU 14 59.951 -2.449 -2.449
100 HD2 LEU 14 HD2 LEU 14 57.145 -3.671 -3.671
101 HD2 LEU 14 HD2 LEU 14 58.796 -4.200 -4.200
102 HD2 LEU 14 HD2 LEU 14 57.444 -4.959 -4.959
103 H SER 15 HN SER 15 54.056 -1.629 -1.629
104 HA SER 15 HA SER 15 51.881 -0.873 -0.873
105 1HB SER 15 HB2 SER 15 51.838 0.619 0.619
106 2HB SER 15 HB1 SER 15 50.920 -0.837 -0.837
107 HG SER 15 HG SER 15 52.912 -0.530 -0.530
108 H GLU 16 HN GLU 16 51.293 1.393 1.393
109 HA GLU 16 HA GLU 16 53.382 2.987 2.987
110 1HB GLU 16 HB2 GLU 16 51.132 3.273 3.273
111 2HB GLU 16 HB1 GLU 16 50.545 3.535 3.535
112 1HG GLU 16 HG2 GLU 16 51.367 5.707 5.707
113 2HG GLU 16 HG1 GLU 16 52.618 5.396 5.396
114 H GLU 17 HN GLU 17 52.354 2.599 2.599
115 HA GLU 17 HA GLU 17 53.139 5.193 5.193
116 1HB GLU 17 HB2 GLU 17 51.603 3.722 3.722
117 2HB GLU 17 HB1 GLU 17 52.814 2.441 2.441
118 1HG GLU 17 HG2 GLU 17 52.804 3.533 3.533
119 2HG GLU 17 HG1 GLU 17 54.286 4.005 4.005
120 H MET 18 HN MET 18 54.745 1.982 1.982
121 HA MET 18 HA MET 18 57.171 2.789 2.789
122 1HB MET 18 HB2 MET 18 56.712 0.481 0.481
123 2HB MET 18 HB1 MET 18 56.376 0.650 0.650
124 1HG MET 18 HG2 MET 18 58.611 -0.399 -0.399
125 2HG MET 18 HG1 MET 18 58.711 1.058 1.058
126 1HE MET 18 HE1 MET 18 59.224 -0.834 -0.834
127 2HE MET 18 HE3 MET 18 60.490 -0.032 -0.032
128 3HE MET 18 HE2 MET 18 58.793 0.293 0.293
129 H ILE 19 HN ILE 19 56.306 2.708 2.708
130 HA ILE 19 HA ILE 19 58.692 3.413 3.413
131 HB ILE 19 HB ILE 19 55.849 4.363 4.363
132 1HG1 ILE 19 HG12 ILE 19 57.642 2.356 2.356
133 2HG1 ILE 19 HG11 ILE 19 56.271 1.977 1.977
134 1HG2 ILE 19 HG21 ILE 19 58.368 5.039 5.039
135 2HG2 ILE 19 HG23 ILE 19 56.854 4.866 4.866
136 3HG2 ILE 19 HG22 ILE 19 56.993 6.074 6.074
137 HD1 ILE 19 HD1 ILE 19 56.006 3.653 3.653
138 HD1 ILE 19 HD1 ILE 19 54.712 2.927 2.927
139 HD1 ILE 19 HD1 ILE 19 55.791 1.902 1.902
140 H ALA 20 HN ALA 20 56.497 5.570 5.570
141 HA ALA 20 HA ALA 20 57.835 8.035 8.035
142 1HB ALA 20 HB2 ALA 20 55.603 7.210 7.210
143 2HB ALA 20 HB1 ALA 20 56.660 7.541 7.541
144 3HB ALA 20 HB3 ALA 20 56.300 8.818 8.818
145 H GLU 21 HN GLU 21 58.418 5.474 5.474
146 HA GLU 21 HA GLU 21 60.377 6.869 6.869
147 1HB GLU 21 HB2 GLU 21 59.351 4.916 4.916
148 2HB GLU 21 HB1 GLU 21 59.686 3.977 3.977
149 1HG GLU 21 HG2 GLU 21 61.238 3.330 3.330
150 2HG GLU 21 HG1 GLU 21 62.118 4.135 4.135
151 H PHE 22 HN PHE 22 60.593 4.823 4.823
152 HA PHE 22 HA PHE 22 63.511 4.870 4.870
153 1HB PHE 22 HB2 PHE 22 61.345 4.127 4.127
154 2HB PHE 22 HB1 PHE 22 63.062 3.812 3.812
155 HD1 PHE 22 HD2 PHE 22 62.872 3.519 3.519
156 HD2 PHE 22 HD1 PHE 22 61.421 1.497 1.497
157 HE1 PHE 22 HE2 PHE 22 62.669 1.416 1.416
158 HE2 PHE 22 HE1 PHE 22 61.219 -0.605 -0.605
159 HZ PHE 22 HZ PHE 22 61.841 -0.646 -0.646
160 H LYS 23 HN LYS 23 60.900 6.852 6.852
161 HA LYS 23 HA LYS 23 62.325 8.192 8.192
162 1HB LYS 23 HB2 LYS 23 59.813 8.072 8.072
163 2HB LYS 23 HB1 LYS 23 60.136 9.346 9.346
164 1HG LYS 23 HG2 LYS 23 59.488 10.501 10.501
165 2HG LYS 23 HG1 LYS 23 61.247 10.621 10.621
166 1HD LYS 23 HD2 LYS 23 61.483 9.354 9.354
167 2HD LYS 23 HD1 LYS 23 60.254 8.201 8.201
168 1HE LYS 23 HE2 LYS 23 59.392 9.298 9.298
169 2HE LYS 23 HE1 LYS 23 58.515 9.985 9.985
170 1HZ LYS 23 HZ1 LYS 23 60.336 11.692 11.692
171 2HZ LYS 23 HZ3 LYS 23 60.853 11.135 11.135
172 3HZ LYS 23 HZ2 LYS 23 59.305 11.815 11.815
173 H ALA 24 HN ALA 24 61.354 9.630 9.630
174 HA ALA 24 HA ALA 24 63.082 11.840 11.840
175 1HB ALA 24 HB3 ALA 24 61.230 10.712 10.712
176 2HB ALA 24 HB2 ALA 24 62.718 10.520 10.520
177 3HB ALA 24 HB1 ALA 24 62.209 12.125 12.125
178 H ALA 25 HN ALA 25 63.861 8.486 8.486
179 HA ALA 25 HA ALA 25 66.486 9.082 9.082
180 1HB ALA 25 HB2 ALA 25 65.103 6.524 6.524
181 2HB ALA 25 HB1 ALA 25 66.615 6.594 6.594
182 3HB ALA 25 HB3 ALA 25 65.122 7.186 7.186
183 H PHE 26 HN PHE 26 65.190 7.690 7.690
184 HA PHE 26 HA PHE 26 67.762 7.248 7.248
185 1HB PHE 26 HB2 PHE 26 65.752 6.083 6.083
186 2HB PHE 26 HB1 PHE 26 64.943 7.608 7.608
187 HD1 PHE 26 HD1 PHE 26 65.920 9.110 9.110
188 HD2 PHE 26 HD2 PHE 26 67.123 5.025 5.025
189 HE1 PHE 26 HE1 PHE 26 66.857 9.069 9.069
190 HE2 PHE 26 HE2 PHE 26 68.060 4.985 4.985
191 HZ PHE 26 HZ PHE 26 67.927 7.007 7.007
192 H ASP 27 HN ASP 27 65.465 9.964 9.964
193 HA ASP 27 HA ASP 27 66.807 11.505 11.505
194 1HB ASP 27 HB2 ASP 27 65.325 13.275 13.275
195 2HB ASP 27 HB1 ASP 27 64.441 11.749 11.749
196 H MET 28 HN MET 28 67.778 10.675 10.675
197 HA MET 28 HA MET 28 68.924 13.052 13.052
198 1HB MET 28 HB2 MET 28 69.688 10.123 10.123
199 2HB MET 28 HB1 MET 28 70.475 11.355 11.355
200 1HG MET 28 HG2 MET 28 67.500 11.339 11.339
201 2HG MET 28 HG1 MET 28 68.303 10.004 10.004
202 1HE MET 28 HE3 MET 28 66.403 12.033 12.033
203 2HE MET 28 HE2 MET 28 67.217 10.731 10.731
204 3HE MET 28 HE1 MET 28 67.263 12.371 12.371
205 H PHE 29 HN PHE 29 69.975 10.945 10.945
206 HA PHE 29 HA PHE 29 72.488 12.568 12.568
207 1HB PHE 29 HB2 PHE 29 72.002 9.862 9.862
208 2HB PHE 29 HB1 PHE 29 73.535 10.606 10.606
209 HD1 PHE 29 HD1 PHE 29 74.240 10.704 10.704
210 HD2 PHE 29 HD2 PHE 29 70.622 8.721 8.721
211 HE1 PHE 29 HE1 PHE 29 74.126 9.581 9.581
212 HE2 PHE 29 HE2 PHE 29 70.508 7.597 7.597
213 HZ PHE 29 HZ PHE 29 72.262 8.027 8.027
214 H ASP 30 HN ASP 30 69.798 13.268 13.268
215 HA ASP 30 HA ASP 30 70.197 12.889 12.889
216 1HB ASP 30 HB2 ASP 30 67.954 13.134 13.134
217 2HB ASP 30 HB1 ASP 30 67.763 14.146 14.146
218 H ALA 31 HN ALA 31 71.977 14.710 14.710
219 HA ALA 31 HA ALA 31 71.040 17.427 17.427
220 1HB ALA 31 HB2 ALA 31 73.497 15.898 15.898
221 2HB ALA 31 HB1 ALA 31 73.761 17.366 17.366
222 3HB ALA 31 HB3 ALA 31 73.110 17.472 17.472
223 H ASP 32 HN ASP 32 72.101 15.287 15.287
224 HA ASP 32 HA ASP 32 71.494 17.466 17.466
225 1HB ASP 32 HB2 ASP 32 73.959 15.949 15.949
226 2HB ASP 32 HB1 ASP 32 73.474 15.928 15.928
227 H GLY 33 HN GLY 33 70.123 14.903 14.903
228 1HA GLY 33 HA2 GLY 33 69.671 13.646 13.646
229 2HA GLY 33 HA1 GLY 33 69.664 12.707 12.707
230 H GLY 34 HN GLY 34 68.261 14.804 14.804
231 1HA GLY 34 HA2 GLY 34 66.004 15.106 15.106
232 2HA GLY 34 HA1 GLY 34 65.866 15.736 15.736
233 H GLY 35 HN GLY 35 66.703 12.394 12.394
234 1HA GLY 35 HA2 GLY 35 64.253 11.106 11.106
235 2HA GLY 35 HA1 GLY 35 64.522 11.442 11.442
236 H ASP 36 HN ASP 36 67.499 11.215 11.215
237 HA ASP 36 HA ASP 36 67.771 8.303 8.303
238 1HB ASP 36 HB2 ASP 36 68.993 8.114 8.114
239 2HB ASP 36 HB1 ASP 36 67.264 8.434 8.434
240 H ILE 37 HN ILE 37 69.581 8.035 8.035
241 HA ILE 37 HA ILE 37 71.583 10.229 10.229
242 HB ILE 37 HB ILE 37 72.261 9.057 9.057
243 1HG1 ILE 37 HG12 ILE 37 70.149 7.006 7.006
244 2HG1 ILE 37 HG11 ILE 37 71.881 6.753 6.753
245 1HG2 ILE 37 HG22 ILE 37 70.042 10.474 10.474
246 2HG2 ILE 37 HG21 ILE 37 69.266 8.924 8.924
247 3HG2 ILE 37 HG23 ILE 37 70.375 9.617 9.617
248 HD1 ILE 37 HD1 ILE 37 72.128 7.324 7.324
249 HD1 ILE 37 HD1 ILE 37 71.382 5.772 5.772
250 HD1 ILE 37 HD1 ILE 37 70.378 7.139 7.139
251 H SER 38 HN SER 38 73.933 9.500 9.500
252 HA SER 38 HA SER 38 74.772 8.146 8.146
253 1HB SER 38 HB2 SER 38 75.896 9.189 9.189
254 2HB SER 38 HB1 SER 38 76.809 7.823 7.823
255 HG SER 38 HG SER 38 76.424 10.369 10.369
256 H THR 39 HN THR 39 75.054 5.985 5.985
257 HA THR 39 HA THR 39 73.831 3.892 3.892
258 HB THR 39 HB THR 39 75.611 2.517 2.517
259 HG1 THR 39 HG1 THR 39 77.192 3.702 3.702
260 1HG2 THR 39 HG21 THR 39 73.486 4.339 4.339
261 2HG2 THR 39 HG23 THR 39 74.566 3.656 3.656
262 3HG2 THR 39 HG22 THR 39 73.636 2.590 2.590
263 H LYS 40 HN LYS 40 76.978 5.363 5.363
264 HA LYS 40 HA LYS 40 78.071 3.258 3.258
265 1HB LYS 40 HB2 LYS 40 79.081 5.359 5.359
266 2HB LYS 40 HB1 LYS 40 78.833 6.142 6.142
267 1HG LYS 40 HG2 LYS 40 80.896 5.276 5.276
268 2HG LYS 40 HG1 LYS 40 79.973 3.814 3.814
269 1HD LYS 40 HD2 LYS 40 80.264 3.622 3.622
270 2HD LYS 40 HD1 LYS 40 81.780 4.399 4.399
271 1HE LYS 40 HE2 LYS 40 82.474 2.586 2.586
272 2HE LYS 40 HE1 LYS 40 80.814 2.025 2.025
273 1HZ LYS 40 HZ3 LYS 40 80.709 1.696 1.696
274 2HZ LYS 40 HZ2 LYS 40 82.399 1.869 1.869
275 3HZ LYS 40 HZ1 LYS 40 81.676 0.596 0.596
276 H GLU 41 HN GLU 41 75.650 5.628 5.628
277 HA GLU 41 HA GLU 41 76.080 5.737 5.737
278 1HB GLU 41 HB2 GLU 41 75.435 7.659 7.659
279 2HB GLU 41 HB1 GLU 41 73.812 6.975 6.975
280 1HG GLU 41 HG2 GLU 41 73.749 8.504 8.504
281 2HG GLU 41 HG1 GLU 41 74.289 7.055 7.055
282 H LEU 42 HN LEU 42 74.154 4.081 4.081
283 HA LEU 42 HA LEU 42 71.766 3.443 3.443
284 1HB LEU 42 HB2 LEU 42 72.951 2.656 2.656
285 2HB LEU 42 HB1 LEU 42 73.466 1.287 1.287
286 HG LEU 42 HG LEU 42 70.657 1.853 1.853
287 HD1 LEU 42 HD1 LEU 42 69.970 1.045 1.045
288 HD1 LEU 42 HD1 LEU 42 71.609 1.424 1.424
289 HD1 LEU 42 HD1 LEU 42 70.559 2.705 2.705
290 HD2 LEU 42 HD2 LEU 42 71.036 -0.325 -0.325
291 HD2 LEU 42 HD2 LEU 42 72.491 -0.384 -0.384
292 HD2 LEU 42 HD2 LEU 42 70.906 -0.618 -0.618
293 H GLY 43 HN GLY 43 74.961 1.988 1.988
294 1HA GLY 43 HA2 GLY 43 74.142 -0.001 -0.001
295 2HA GLY 43 HA1 GLY 43 75.722 0.786 0.786
296 H THR 44 HN THR 44 74.940 3.428 3.428
297 HA THR 44 HA THR 44 74.689 3.435 3.435
298 HB THR 44 HB THR 44 74.228 5.462 5.462
299 HG1 THR 44 HG1 THR 44 76.264 5.830 5.830
300 1HG2 THR 44 HG21 THR 44 74.019 5.820 5.820
301 2HG2 THR 44 HG23 THR 44 74.309 7.162 7.162
302 3HG2 THR 44 HG22 THR 44 72.816 6.231 6.231
303 H VAL 45 HN VAL 45 72.216 4.585 4.585
304 HA VAL 45 HA VAL 45 70.039 4.886 4.886
305 HB VAL 45 HB VAL 45 70.255 3.736 3.736
306 1HG1 VAL 45 HG12 VAL 45 68.095 3.123 3.123
307 2HG1 VAL 45 HG11 VAL 45 67.778 4.847 4.847
308 3HG1 VAL 45 HG13 VAL 45 67.887 4.149 4.149
309 1HG2 VAL 45 HG21 VAL 45 71.073 6.067 6.067
310 2HG2 VAL 45 HG23 VAL 45 69.684 6.009 6.009
311 3HG2 VAL 45 HG22 VAL 45 69.468 6.489 6.489
312 H MET 46 HN MET 46 70.790 1.829 1.829
313 HA MET 46 HA MET 46 68.876 0.137 0.137
314 1HB MET 46 HB2 MET 46 71.794 -0.213 -0.213
315 2HB MET 46 HB1 MET 46 70.814 -1.585 -1.585
316 1HG MET 46 HG2 MET 46 69.128 -0.755 -0.755
317 2HG MET 46 HG1 MET 46 70.518 0.115 0.115
318 1HE MET 46 HE1 MET 46 69.338 -2.936 -2.936
319 2HE MET 46 HE3 MET 46 68.844 -3.621 -3.621
320 3HE MET 46 HE2 MET 46 70.210 -4.307 -4.307
321 H ARG 47 HN ARG 47 72.141 0.636 0.636
322 HA ARG 47 HA ARG 47 71.609 -0.753 -0.753
323 1HB ARG 47 HB2 ARG 47 73.604 1.250 1.250
324 2HB ARG 47 HB1 ARG 47 73.631 0.791 0.791
325 1HG ARG 47 HG2 ARG 47 73.714 -1.618 -1.618
326 2HG ARG 47 HG1 ARG 47 73.896 -1.056 -1.056
327 1HD ARG 47 HD2 ARG 47 76.137 -1.286 -1.286
328 2HD ARG 47 HD1 ARG 47 75.859 0.399 0.399
329 HE ARG 47 HE ARG 47 75.970 -1.929 -1.929
330 1HH1 ARG 47 HH1 ARG 47 73.863 -0.420 -0.420
331 2HH1 ARG 47 HH1 ARG 47 74.655 0.838 0.838
332 1HH2 ARG 47 HH2 ARG 47 77.669 0.491 0.491
333 2HH2 ARG 47 HH2 ARG 47 76.809 1.353 1.353
334 H MET 48 HN MET 48 71.648 2.759 2.759
335 HA MET 48 HA MET 48 70.896 3.692 3.692
336 1HB MET 48 HB2 MET 48 71.602 4.807 4.807
337 2HB MET 48 HB1 MET 48 69.856 5.016 5.016
338 1HG MET 48 HG2 MET 48 70.807 5.717 5.717
339 2HG MET 48 HG1 MET 48 71.606 6.672 6.672
340 1HE MET 48 HE3 MET 48 71.141 8.520 8.520
341 2HE MET 48 HE2 MET 48 69.760 9.104 9.104
342 3HE MET 48 HE1 MET 48 69.802 9.335 9.335
343 H LEU 49 HN LEU 49 69.072 1.934 1.934
344 HA LEU 49 HA LEU 49 66.442 2.896 2.896
345 1HB LEU 49 HB2 LEU 49 67.615 1.441 1.441
346 2HB LEU 49 HB1 LEU 49 66.292 0.491 0.491
347 HG LEU 49 HG LEU 49 64.735 2.289 2.289
348 HD1 LEU 49 HD1 LEU 49 67.133 3.887 3.887
349 HD1 LEU 49 HD1 LEU 49 65.455 4.408 4.408
350 HD1 LEU 49 HD1 LEU 49 66.217 4.307 4.307
351 HD2 LEU 49 HD2 LEU 49 66.185 1.159 1.159
352 HD2 LEU 49 HD2 LEU 49 65.940 2.857 2.857
353 HD2 LEU 49 HD2 LEU 49 64.554 1.828 1.828
354 H GLY 50 HN GLY 50 68.325 -0.148 -0.148
355 1HA GLY 50 HA2 GLY 50 67.861 -0.852 -0.852
356 2HA GLY 50 HA1 GLY 50 66.352 -1.323 -1.323
357 H GLN 51 HN GLN 51 67.897 -1.923 -1.923
358 HA GLN 51 HA GLN 51 68.491 -4.721 -4.721
359 1HB GLN 51 HB2 GLN 51 68.987 -3.373 -3.373
360 2HB GLN 51 HB1 GLN 51 68.440 -5.020 -5.020
361 1HG GLN 51 HG2 GLN 51 66.356 -4.245 -4.245
362 2HG GLN 51 HG1 GLN 51 66.466 -3.468 -3.468
363 1HE2 GLN 51 HE22 GLN 51 65.668 -0.672 -0.672
364 2HE2 GLN 51 HE21 GLN 51 64.891 -1.980 -1.980
365 H ASN 52 HN ASN 52 70.591 -5.543 -5.543
366 HA ASN 52 HA ASN 52 72.884 -3.692 -3.692
367 1HB ASN 52 HB2 ASN 52 72.136 -5.228 -5.228
368 2HB ASN 52 HB1 ASN 52 73.058 -6.443 -6.443
369 HD2 ASN 52 HD2 ASN 52 73.544 -4.551 -4.551
370 HD2 ASN 52 HD2 ASN 52 75.143 -4.040 -4.040
371 HA PRO 53 HA PRO 53 73.244 -6.385 -6.385
372 1HB PRO 53 HB2 PRO 53 74.192 -4.403 -4.403
373 2HB PRO 53 HB1 PRO 53 72.460 -4.689 -4.689
374 1HG PRO 53 HG2 PRO 53 74.249 -2.639 -2.639
375 2HG PRO 53 HG1 PRO 53 72.568 -2.495 -2.495
376 1HD PRO 53 HD2 PRO 53 73.284 -2.767 -2.767
377 2HD PRO 53 HD1 PRO 53 71.727 -3.324 -3.324
378 H THR 54 HN THR 54 75.134 -7.553 -7.553
379 HA THR 54 HA THR 54 77.545 -6.897 -6.897
380 HB THR 54 HB THR 54 78.447 -8.717 -8.717
381 HG1 THR 54 HG1 THR 54 77.104 -9.534 -9.534
382 1HG2 THR 54 HG23 THR 54 76.681 -8.842 -8.842
383 2HG2 THR 54 HG22 THR 54 75.929 -9.874 -9.874
384 3HG2 THR 54 HG21 THR 54 77.577 -10.200 -10.200
385 H LYS 55 HN LYS 55 79.496 -5.953 -5.953
386 HA LYS 55 HA LYS 55 79.508 -3.777 -3.777
387 1HB LYS 55 HB2 LYS 55 81.376 -4.415 -4.415
388 2HB LYS 55 HB1 LYS 55 81.657 -5.868 -5.868
389 1HG LYS 55 HG2 LYS 55 82.872 -4.725 -4.725
390 2HG LYS 55 HG1 LYS 55 81.615 -3.500 -3.500
391 1HD LYS 55 HD2 LYS 55 82.422 -2.387 -2.387
392 2HD LYS 55 HD1 LYS 55 83.689 -3.605 -3.605
393 1HE LYS 55 HE2 LYS 55 83.462 -2.096 -2.096
394 2HE LYS 55 HE1 LYS 55 84.242 -1.317 -1.317
395 1HZ LYS 55 HZ2 LYS 55 85.332 -3.686 -3.686
396 2HZ LYS 55 HZ1 LYS 55 85.040 -3.723 -3.723
397 3HZ LYS 55 HZ3 LYS 55 86.003 -2.496 -2.496
398 H GLU 56 HN GLU 56 80.160 -7.163 -7.163
399 HA GLU 56 HA GLU 56 80.653 -6.654 -6.654
400 1HB GLU 56 HB2 GLU 56 80.717 -8.784 -8.784
401 2HB GLU 56 HB1 GLU 56 79.261 -9.154 -9.154
402 1HG GLU 56 HG2 GLU 56 80.713 -8.603 -8.603
403 2HG GLU 56 HG1 GLU 56 82.084 -8.814 -8.814
404 H GLU 57 HN GLU 57 77.633 -7.334 -7.334
405 HA GLU 57 HA GLU 57 75.866 -7.584 -7.584
406 1HB GLU 57 HB2 GLU 57 75.748 -6.827 -6.827
407 2HB GLU 57 HB1 GLU 57 74.347 -6.386 -6.386
408 1HG GLU 57 HG2 GLU 57 75.524 -9.162 -9.162
409 2HG GLU 57 HG1 GLU 57 74.330 -8.721 -8.721
410 H LEU 58 HN LEU 58 77.035 -4.670 -4.670
411 HA LEU 58 HA LEU 58 75.415 -2.748 -2.748
412 1HB LEU 58 HB2 LEU 58 78.248 -2.559 -2.559
413 2HB LEU 58 HB1 LEU 58 77.172 -1.193 -1.193
414 HG LEU 58 HG LEU 58 76.820 -3.416 -3.416
415 HD1 LEU 58 HD1 LEU 58 76.373 -0.942 -0.942
416 HD1 LEU 58 HD1 LEU 58 77.683 -0.617 -0.617
417 HD1 LEU 58 HD1 LEU 58 77.873 -1.864 -1.864
418 HD2 LEU 58 HD2 LEU 58 74.853 -1.521 -1.521
419 HD2 LEU 58 HD2 LEU 58 74.700 -1.884 -1.884
420 HD2 LEU 58 HD2 LEU 58 74.618 -3.185 -3.185
421 H ASP 59 HN ASP 59 78.782 -3.774 -3.774
422 HA ASP 59 HA ASP 59 79.101 -2.291 -2.291
423 1HB ASP 59 HB2 ASP 59 80.450 -4.275 -4.275
424 2HB ASP 59 HB1 ASP 59 80.472 -4.806 -4.806
425 H ALA 60 HN ALA 60 77.722 -5.514 -5.514
426 HA ALA 60 HA ALA 60 77.401 -6.248 -6.248
427 1HB ALA 60 HB2 ALA 60 76.157 -7.090 -7.090
428 2HB ALA 60 HB1 ALA 60 75.726 -7.862 -7.862
429 3HB ALA 60 HB3 ALA 60 77.387 -7.938 -7.938
430 H ILE 61 HN ILE 61 75.175 -4.807 -4.807
431 HA ILE 61 HA ILE 61 72.889 -4.638 -4.638
432 HB ILE 61 HB ILE 61 73.862 -3.140 -3.140
433 1HG1 ILE 61 HG12 ILE 61 71.579 -5.096 -5.096
434 2HG1 ILE 61 HG11 ILE 61 73.173 -5.544 -5.544
435 1HG2 ILE 61 HG22 ILE 61 71.433 -2.696 -2.696
436 2HG2 ILE 61 HG21 ILE 61 71.307 -2.480 -2.480
437 3HG2 ILE 61 HG23 ILE 61 72.452 -1.511 -1.511
438 HD1 ILE 61 HD1 ILE 61 72.554 -3.440 -3.440
439 HD1 ILE 61 HD1 ILE 61 72.254 -5.130 -5.130
440 HD1 ILE 61 HD1 ILE 61 70.959 -4.143 -4.143
441 H ILE 62 HN ILE 62 75.434 -2.236 -2.236
442 HA ILE 62 HA ILE 62 74.488 -0.085 -0.085
443 HB ILE 62 HB ILE 62 77.270 -1.079 -1.079
444 1HG1 ILE 62 HG12 ILE 62 75.729 1.262 1.262
445 2HG1 ILE 62 HG11 ILE 62 75.592 -0.365 -0.365
446 1HG2 ILE 62 HG23 ILE 62 76.369 1.173 1.173
447 2HG2 ILE 62 HG22 ILE 62 77.494 1.628 1.628
448 3HG2 ILE 62 HG21 ILE 62 77.955 0.405 0.405
449 HD1 ILE 62 HD1 ILE 62 77.505 1.484 1.484
450 HD1 ILE 62 HD1 ILE 62 78.369 0.485 0.485
451 HD1 ILE 62 HD1 ILE 62 77.632 -0.256 -0.256
452 H GLU 63 HN GLU 63 77.144 -2.275 -2.275
453 HA GLU 63 HA GLU 63 77.269 -1.650 -1.650
454 1HB GLU 63 HB2 GLU 63 78.472 -3.412 -3.412
455 2HB GLU 63 HB1 GLU 63 77.309 -4.526 -4.526
456 1HG GLU 63 HG2 GLU 63 79.152 -4.665 -4.665
457 2HG GLU 63 HG1 GLU 63 78.085 -3.519 -3.519
458 H GLU 64 HN GLU 64 74.920 -3.764 -3.764
459 HA GLU 64 HA GLU 64 73.613 -4.777 -4.777
460 1HB GLU 64 HB2 GLU 64 73.137 -5.888 -5.888
461 2HB GLU 64 HB1 GLU 64 72.998 -4.391 -4.391
462 1HG GLU 64 HG2 GLU 64 70.784 -5.393 -5.393
463 2HG GLU 64 HG1 GLU 64 70.869 -3.891 -3.891
464 H VAL 65 HN VAL 65 73.012 -1.885 -1.885
465 HA VAL 65 HA VAL 65 70.852 -1.003 -1.003
466 HB VAL 65 HB VAL 65 70.488 0.672 0.672
467 1HG1 VAL 65 HG13 VAL 65 71.181 -2.050 -2.050
468 2HG1 VAL 65 HG12 VAL 65 70.204 -0.832 -0.832
469 3HG1 VAL 65 HG11 VAL 65 69.624 -1.566 -1.566
470 1HG2 VAL 65 HG21 VAL 65 72.988 1.040 1.040
471 2HG2 VAL 65 HG23 VAL 65 72.014 1.014 1.014
472 3HG2 VAL 65 HG22 VAL 65 72.968 -0.399 -0.399
473 H ASP 66 HN ASP 66 74.222 -0.664 -0.664
474 HA ASP 66 HA ASP 66 74.358 2.080 2.080
475 1HB ASP 66 HB2 ASP 66 75.929 0.527 0.527
476 2HB ASP 66 HB1 ASP 66 76.759 0.357 0.357
477 H GLU 67 HN GLU 67 75.208 -1.234 -1.234
478 HA GLU 67 HA GLU 67 76.260 -0.770 -0.770
479 1HB GLU 67 HB2 GLU 67 75.595 -2.923 -2.923
480 2HB GLU 67 HB1 GLU 67 74.161 -2.880 -2.880
481 1HG GLU 67 HG2 GLU 67 75.392 -3.951 -3.951
482 2HG GLU 67 HG1 GLU 67 76.269 -2.436 -2.436
483 H ASP 68 HN ASP 68 72.913 -0.414 -0.414
484 HA ASP 68 HA ASP 68 71.740 -0.279 -0.279
485 1HB ASP 68 HB2 ASP 68 70.984 -0.177 -0.177
486 2HB ASP 68 HB1 ASP 68 70.265 1.211 1.211
487 H GLY 69 HN GLY 69 73.887 1.790 1.790
488 1HA GLY 69 HA2 GLY 69 74.685 3.851 3.851
489 2HA GLY 69 HA1 GLY 69 73.203 3.974 3.974
490 H SER 70 HN SER 70 72.465 3.132 3.132
491 HA SER 70 HA SER 70 71.550 5.907 5.907
492 1HB SER 70 HB2 SER 70 70.610 3.227 3.227
493 2HB SER 70 HB1 SER 70 70.757 4.012 4.012
494 HG SER 70 HG SER 70 69.685 5.849 5.849
495 H GLY 71 HN GLY 71 73.787 6.642 6.642
496 1HA GLY 71 HA2 GLY 71 75.538 5.611 5.611
497 2HA GLY 71 HA1 GLY 71 75.241 7.344 7.344
498 H THR 72 HN THR 72 72.565 7.453 7.453
499 HA THR 72 HA THR 72 72.928 6.888 6.888
500 HB THR 72 HB THR 72 71.151 8.580 8.580
501 HG1 THR 72 HG1 THR 72 69.917 8.131 8.131
502 1HG2 THR 72 HG23 THR 72 73.721 8.993 8.993
503 2HG2 THR 72 HG22 THR 72 72.675 9.998 9.998
504 3HG2 THR 72 HG21 THR 72 72.683 10.208 10.208
505 H ILE 73 HN ILE 73 70.838 6.237 6.237
506 HA ILE 73 HA ILE 73 69.452 4.118 4.118
507 HB ILE 73 HB ILE 73 70.833 3.533 3.533
508 1HG1 ILE 73 HG12 ILE 73 68.942 2.231 2.231
509 2HG1 ILE 73 HG11 ILE 73 67.848 3.032 3.032
510 1HG2 ILE 73 HG22 ILE 73 69.588 5.777 5.777
511 2HG2 ILE 73 HG21 ILE 73 68.796 4.428 4.428
512 3HG2 ILE 73 HG23 ILE 73 70.550 4.599 4.599
513 HD1 ILE 73 HD1 ILE 73 68.356 1.088 1.088
514 HD1 ILE 73 HD1 ILE 73 70.006 1.024 1.024
515 HD1 ILE 73 HD1 ILE 73 69.578 2.195 2.195
516 H ASP 74 HN ASP 74 67.190 4.103 4.103
517 HA ASP 74 HA ASP 74 65.816 6.605 6.605
518 1HB ASP 74 HB2 ASP 74 65.394 4.159 4.159
519 2HB ASP 74 HB1 ASP 74 63.923 4.845 4.845
520 H PHE 75 HN PHE 75 64.524 6.896 6.896
521 HA PHE 75 HA PHE 75 64.586 5.360 5.360
522 1HB PHE 75 HB2 PHE 75 63.586 7.625 7.625
523 2HB PHE 75 HB1 PHE 75 62.207 6.883 6.883
524 HD1 PHE 75 HD2 PHE 75 64.058 7.068 7.068
525 HD2 PHE 75 HD1 PHE 75 60.465 5.804 5.804
526 HE1 PHE 75 HE2 PHE 75 62.998 6.621 6.621
527 HE2 PHE 75 HE1 PHE 75 59.407 5.357 5.357
528 HZ PHE 75 HZ PHE 75 60.673 5.765 5.765
529 H GLU 76 HN GLU 76 61.811 5.258 5.258
530 HA GLU 76 HA GLU 76 60.527 2.989 2.989
531 1HB GLU 76 HB2 GLU 76 60.780 4.183 4.183
532 2HB GLU 76 HB1 GLU 76 59.740 2.791 2.791
533 1HG GLU 76 HG2 GLU 76 58.138 4.188 4.188
534 2HG GLU 76 HG1 GLU 76 59.202 4.667 4.667
535 H GLU 77 HN GLU 77 63.129 3.152 3.152
536 HA GLU 77 HA GLU 77 63.216 0.305 0.305
537 1HB GLU 77 HB2 GLU 77 64.082 2.277 2.277
538 2HB GLU 77 HB1 GLU 77 65.461 2.312 2.312
539 1HG GLU 77 HG2 GLU 77 66.199 0.176 0.176
540 2HG GLU 77 HG1 GLU 77 64.630 -0.255 -0.255
541 H PHE 78 HN PHE 78 64.996 2.485 2.485
542 HA PHE 78 HA PHE 78 66.852 0.521 0.521
543 1HB PHE 78 HB2 PHE 78 67.388 2.781 2.781
544 2HB PHE 78 HB1 PHE 78 65.753 3.181 3.181
545 HD1 PHE 78 HD1 PHE 78 68.700 1.078 1.078
546 HD2 PHE 78 HD2 PHE 78 65.276 3.313 3.313
547 HE1 PHE 78 HE1 PHE 78 69.369 0.717 0.717
548 HE2 PHE 78 HE2 PHE 78 65.945 2.953 2.953
549 HZ PHE 78 HZ PHE 78 67.993 1.655 1.655
550 H LEU 79 HN LEU 79 63.557 1.431 1.431
551 HA LEU 79 HA LEU 79 63.219 0.331 0.331
552 1HB LEU 79 HB2 LEU 79 61.617 0.674 0.674
553 2HB LEU 79 HB1 LEU 79 60.992 -0.556 -0.556
554 HG LEU 79 HG LEU 79 61.024 1.056 1.056
555 HD1 LEU 79 HD1 LEU 79 62.982 2.344 2.344
556 HD1 LEU 79 HD1 LEU 79 61.854 3.225 3.225
557 HD1 LEU 79 HD1 LEU 79 61.660 3.262 3.262
558 HD2 LEU 79 HD2 LEU 79 59.426 2.808 2.808
559 HD2 LEU 79 HD2 LEU 79 58.928 1.125 1.125
560 HD2 LEU 79 HD2 LEU 79 59.574 1.702 1.702
561 H VAL 80 HN VAL 80 63.584 -1.436 -1.436
562 HA VAL 80 HA VAL 80 62.953 -4.049 -4.049
563 HB VAL 80 HB VAL 80 63.222 -3.154 -3.154
564 1HG1 VAL 80 HG11 VAL 80 65.579 -2.281 -2.281
565 2HG1 VAL 80 HG13 VAL 80 66.106 -3.957 -3.957
566 3HG1 VAL 80 HG12 VAL 80 65.388 -3.136 -3.136
567 1HG2 VAL 80 HG23 VAL 80 63.712 -5.751 -5.751
568 2HG2 VAL 80 HG22 VAL 80 62.962 -5.354 -5.354
569 3HG2 VAL 80 HG21 VAL 80 64.711 -5.549 -5.549
570 H MET 81 HN MET 81 65.958 -2.158 -2.158
571 HA MET 81 HA MET 81 67.717 -4.270 -4.270
572 1HB MET 81 HB2 MET 81 67.784 -1.250 -1.250
573 2HB MET 81 HB1 MET 81 69.166 -2.312 -2.312
574 1HG MET 81 HG2 MET 81 67.670 -1.938 -1.938
575 2HG MET 81 HG1 MET 81 69.313 -1.406 -1.406
576 1HE MET 81 HE3 MET 81 68.305 -2.717 -2.717
577 2HE MET 81 HE2 MET 81 69.418 -4.016 -4.016
578 3HE MET 81 HE1 MET 81 67.787 -4.404 -4.404
579 H MET 82 HN MET 82 66.535 -1.500 -1.500
580 HA MET 82 HA MET 82 67.230 -2.484 -2.484
581 1HB MET 82 HB2 MET 82 65.190 -0.998 -0.998
582 2HB MET 82 HB1 MET 82 66.539 -0.234 -0.234
583 1HG MET 82 HG2 MET 82 65.218 0.319 0.319
584 2HG MET 82 HG1 MET 82 64.654 -1.344 -1.344
585 1HE MET 82 HE1 MET 82 63.852 1.851 1.851
586 2HE MET 82 HE3 MET 82 62.284 2.105 2.105
587 3HE MET 82 HE2 MET 82 63.769 2.242 2.242
588 H VAL 83 HN VAL 83 64.494 -3.351 -3.351
589 HA VAL 83 HA VAL 83 63.066 -4.726 -4.726
590 HB VAL 83 HB VAL 83 62.728 -4.552 -4.552
591 1HG1 VAL 83 HG13 VAL 83 61.264 -6.069 -6.069
592 2HG1 VAL 83 HG12 VAL 83 60.299 -5.278 -5.278
593 3HG1 VAL 83 HG11 VAL 83 61.518 -6.472 -6.472
594 1HG2 VAL 83 HG22 VAL 83 62.391 -2.582 -2.582
595 2HG2 VAL 83 HG21 VAL 83 61.350 -2.752 -2.752
596 3HG2 VAL 83 HG23 VAL 83 60.821 -3.372 -3.372
597 H ARG 84 HN ARG 84 64.420 -5.882 -5.882
598 HA ARG 84 HA ARG 84 64.311 -8.622 -8.622
599 1HB ARG 84 HB2 ARG 84 66.500 -6.893 -6.893
600 2HB ARG 84 HB1 ARG 84 66.409 -8.640 -8.640
601 1HG ARG 84 HG2 ARG 84 64.251 -8.452 -8.452
602 2HG ARG 84 HG1 ARG 84 64.170 -6.727 -6.727
603 1HD ARG 84 HD2 ARG 84 65.670 -6.169 -6.169
604 2HD ARG 84 HD1 ARG 84 66.557 -7.700 -7.700
605 HE ARG 84 HE ARG 84 63.790 -7.621 -7.621
606 1HH1 ARG 84 HH1 ARG 84 64.445 -10.287 -10.287
607 2HH1 ARG 84 HH1 ARG 84 65.458 -10.544 -10.544
608 1HH2 ARG 84 HH2 ARG 84 66.251 -7.188 -7.188
609 2HH2 ARG 84 HH2 ARG 84 66.480 -8.790 -8.790
610 H GLN 85 HN GLN 85 66.387 -6.293 -6.293
611 HA GLN 85 HA GLN 85 68.159 -8.317 -8.317
612 1HB GLN 85 HB2 GLN 85 68.888 -6.018 -6.018
613 2HB GLN 85 HB1 GLN 85 67.709 -5.364 -5.364
614 1HG GLN 85 HG2 GLN 85 69.907 -5.441 -5.441
615 2HG GLN 85 HG1 GLN 85 68.841 -6.616 -6.616
616 1HE2 GLN 85 HE22 GLN 85 71.998 -7.945 -7.945
617 2HE2 GLN 85 HE21 GLN 85 71.490 -6.331 -6.331
618 H MET 86 HN MET 86 65.432 -6.273 -6.273
619 HA MET 86 HA MET 86 65.456 -7.194 -7.194
620 1HB MET 86 HB2 MET 86 64.040 -5.351 -5.351
621 2HB MET 86 HB1 MET 86 62.900 -6.248 -6.248
622 1HG MET 86 HG2 MET 86 65.090 -5.566 -5.566
623 2HG MET 86 HG1 MET 86 64.661 -4.110 -4.110
624 1HE MET 86 HE3 MET 86 64.664 -5.614 -5.614
625 2HE MET 86 HE2 MET 86 63.637 -4.472 -4.472
626 3HE MET 86 HE1 MET 86 63.096 -6.134 -6.134
627 H LYS 87 HN LYS 87 63.967 -8.315 -8.315
628 HA LYS 87 HA LYS 87 61.852 -9.900 -9.900
629 1HB LYS 87 HB2 LYS 87 63.867 -9.999 -9.999
630 2HB LYS 87 HB1 LYS 87 62.922 -11.465 -11.465
631 1HG LYS 87 HG2 LYS 87 61.188 -9.165 -9.165
632 2HG LYS 87 HG1 LYS 87 62.109 -9.133 -9.133
633 1HD LYS 87 HD2 LYS 87 61.447 -11.753 -11.753
634 2HD LYS 87 HD1 LYS 87 60.065 -11.078 -11.078
635 1HE LYS 87 HE2 LYS 87 61.023 -9.941 -9.941
636 2HE LYS 87 HE1 LYS 87 59.793 -11.217 -11.217
637 1HZ LYS 87 HZ3 LYS 87 58.876 -9.590 -9.590
638 2HZ LYS 87 HZ2 LYS 87 59.656 -8.433 -8.433
639 3HZ LYS 87 HZ1 LYS 87 58.442 -9.420 -9.420
640 H GLU 88 HN GLU 88 65.313 -10.401 -10.401
641 HA GLU 88 HA GLU 88 64.899 -13.071 -13.071
642 1HB GLU 88 HB2 GLU 88 67.072 -11.559 -11.559
643 2HB GLU 88 HB1 GLU 88 67.581 -12.620 -12.620
644 1HG GLU 88 HG2 GLU 88 67.637 -14.013 -14.013
645 2HG GLU 88 HG1 GLU 88 66.105 -14.415 -14.415
646 H ASP 89 HN ASP 89 66.063 -9.785 -9.785
647 HA ASP 89 HA ASP 89 66.932 -10.402 -10.402
648 1HB ASP 89 HB2 ASP 89 67.665 -8.550 -8.550
649 2HB ASP 89 HB1 ASP 89 66.233 -7.687 -7.687
650 H ALA 90 HN ALA 90 63.957 -9.328 -9.328
651 HA ALA 90 HA ALA 90 62.699 -8.489 -8.489
652 1HB ALA 90 HB2 ALA 90 62.226 -7.451 -7.451
653 2HB ALA 90 HB1 ALA 90 61.613 -8.995 -8.995
654 3HB ALA 90 HB3 ALA 90 60.763 -8.144 -8.144
Start of MODEL 36
1 1H ALA 1 HT1 ALA 1 63.371 -7.542 -7.542
2 2H ALA 1 HT3 ALA 1 63.624 -5.938 -5.938
3 3H ALA 1 HT2 ALA 1 64.815 -6.748 -6.748
4 HA ALA 1 HA ALA 1 65.265 -8.248 -8.248
5 1HB ALA 1 HB3 ALA 1 65.569 -5.391 -5.391
6 2HB ALA 1 HB2 ALA 1 65.417 -5.895 -5.895
7 3HB ALA 1 HB1 ALA 1 66.680 -6.589 -6.589
8 H SER 2 HN SER 2 64.866 -8.679 -8.679
9 HA SER 2 HA SER 2 61.980 -8.673 -8.673
10 1HB SER 2 HB2 SER 2 64.178 -9.656 -9.656
11 2HB SER 2 HB1 SER 2 62.568 -10.328 -10.328
12 HG SER 2 HG SER 2 63.524 -11.585 -11.585
13 H MET 3 HN MET 3 64.595 -6.600 -6.600
14 HA MET 3 HA MET 3 64.185 -5.745 -5.745
15 1HB MET 3 HB2 MET 3 65.380 -4.759 -4.759
16 2HB MET 3 HB1 MET 3 64.910 -3.484 -3.484
17 1HG MET 3 HG2 MET 3 66.186 -5.650 -5.650
18 2HG MET 3 HG1 MET 3 67.229 -5.084 -5.084
19 1HE MET 3 HE2 MET 3 68.244 -3.176 -3.176
20 2HE MET 3 HE1 MET 3 67.004 -1.924 -1.924
21 3HE MET 3 HE3 MET 3 68.415 -1.786 -1.786
22 H THR 4 HN THR 4 62.678 -4.560 -4.560
23 HA THR 4 HA THR 4 61.094 -2.484 -2.484
24 HB THR 4 HB THR 4 61.367 -2.957 -2.957
25 HG1 THR 4 HG1 THR 4 59.349 -2.460 -2.460
26 1HG2 THR 4 HG22 THR 4 60.993 -5.592 -5.592
27 2HG2 THR 4 HG21 THR 4 59.504 -5.215 -5.215
28 3HG2 THR 4 HG23 THR 4 61.063 -5.005 -5.005
29 H ASP 5 HN ASP 5 60.685 -5.959 -5.959
30 HA ASP 5 HA ASP 5 57.919 -5.716 -5.716
31 1HB ASP 5 HB2 ASP 5 59.841 -7.873 -7.873
32 2HB ASP 5 HB1 ASP 5 58.512 -8.299 -8.299
33 H GLN 6 HN GLN 6 61.183 -6.491 -6.491
34 HA GLN 6 HA GLN 6 60.460 -7.266 -7.266
35 1HB GLN 6 HB2 GLN 6 62.677 -7.395 -7.395
36 2HB GLN 6 HB1 GLN 6 62.993 -5.803 -5.803
37 1HG GLN 6 HG2 GLN 6 63.959 -7.165 -7.165
38 2HG GLN 6 HG1 GLN 6 62.325 -7.008 -7.008
39 1HE2 GLN 6 HE22 GLN 6 63.509 -10.590 -10.590
40 2HE2 GLN 6 HE21 GLN 6 64.397 -9.185 -9.185
41 H GLN 7 HN GLN 7 60.493 -4.177 -4.177
42 HA GLN 7 HA GLN 7 60.920 -2.547 -2.547
43 1HB GLN 7 HB2 GLN 7 60.124 -2.230 -2.230
44 2HB GLN 7 HB1 GLN 7 59.690 -0.917 -0.917
45 1HG GLN 7 HG2 GLN 7 61.852 -0.268 -0.268
46 2HG GLN 7 HG1 GLN 7 62.442 -1.930 -1.930
47 1HE2 GLN 7 HE22 GLN 7 62.211 -0.003 -0.003
48 2HE2 GLN 7 HE21 GLN 7 61.357 0.613 0.613
49 H ALA 8 HN ALA 8 57.973 -2.936 -2.936
50 HA ALA 8 HA ALA 8 56.098 -1.778 -1.778
51 1HB ALA 8 HB2 ALA 8 56.107 -4.010 -4.010
52 2HB ALA 8 HB1 ALA 8 54.640 -3.755 -3.755
53 3HB ALA 8 HB3 ALA 8 55.274 -2.457 -2.457
54 H GLU 9 HN GLU 9 57.389 -5.098 -5.098
55 HA GLU 9 HA GLU 9 55.714 -5.801 -5.801
56 1HB GLU 9 HB2 GLU 9 56.770 -7.221 -7.221
57 2HB GLU 9 HB1 GLU 9 58.151 -7.312 -7.312
58 1HG GLU 9 HG2 GLU 9 56.304 -7.948 -7.948
59 2HG GLU 9 HG1 GLU 9 55.386 -8.414 -8.414
60 H ALA 10 HN ALA 10 58.707 -4.191 -4.191
61 HA ALA 10 HA ALA 10 59.971 -4.954 -4.954
62 1HB ALA 10 HB3 ALA 10 60.452 -3.107 -3.107
63 2HB ALA 10 HB2 ALA 10 61.320 -2.790 -2.790
64 3HB ALA 10 HB1 ALA 10 61.510 -4.340 -4.340
65 H ARG 11 HN ARG 11 57.781 -2.427 -2.427
66 HA ARG 11 HA ARG 11 58.194 -0.832 -0.832
67 1HB ARG 11 HB2 ARG 11 56.173 -0.374 -0.374
68 2HB ARG 11 HB1 ARG 11 56.938 0.822 0.822
69 1HG ARG 11 HG2 ARG 11 58.534 1.123 1.123
70 2HG ARG 11 HG1 ARG 11 59.024 -0.559 -0.559
71 1HD ARG 11 HD2 ARG 11 58.461 -0.491 -0.491
72 2HD ARG 11 HD1 ARG 11 56.927 -1.023 -1.023
73 HE ARG 11 HE ARG 11 57.257 1.444 1.444
74 1HH1 ARG 11 HH1 ARG 11 57.260 3.043 3.043
75 2HH1 ARG 11 HH1 ARG 11 55.631 3.072 3.072
76 1HH2 ARG 11 HH2 ARG 11 54.664 0.249 0.249
77 2HH2 ARG 11 HH2 ARG 11 54.161 1.489 1.489
78 H ALA 12 HN ALA 12 55.618 -2.679 -2.679
79 HA ALA 12 HA ALA 12 53.591 -2.222 -2.222
80 1HB ALA 12 HB1 ALA 12 53.787 -3.293 -3.293
81 2HB ALA 12 HB3 ALA 12 53.559 -4.745 -4.745
82 3HB ALA 12 HB2 ALA 12 52.364 -3.448 -3.448
83 H PHE 13 HN PHE 13 56.436 -4.100 -4.100
84 HA PHE 13 HA PHE 13 55.671 -6.405 -6.405
85 1HB PHE 13 HB2 PHE 13 57.875 -6.272 -6.272
86 2HB PHE 13 HB1 PHE 13 58.125 -4.659 -4.659
87 HD1 PHE 13 HD1 PHE 13 57.309 -8.140 -8.140
88 HD2 PHE 13 HD2 PHE 13 59.370 -4.459 -4.459
89 HE1 PHE 13 HE1 PHE 13 58.284 -9.132 -9.132
90 HE2 PHE 13 HE2 PHE 13 60.340 -5.446 -5.446
91 HZ PHE 13 HZ PHE 13 59.800 -7.784 -7.784
92 H LEU 14 HN LEU 14 55.841 -3.060 -3.060
93 HA LEU 14 HA LEU 14 55.165 -3.911 -3.911
94 1HB LEU 14 HB2 LEU 14 56.400 -1.749 -1.749
95 2HB LEU 14 HB1 LEU 14 57.391 -3.095 -3.095
96 HG LEU 14 HG LEU 14 57.976 -0.802 -0.802
97 HD1 LEU 14 HD1 LEU 14 57.876 -3.376 -3.376
98 HD1 LEU 14 HD1 LEU 14 59.034 -2.075 -2.075
99 HD1 LEU 14 HD1 LEU 14 57.559 -2.158 -2.158
100 HD2 LEU 14 HD2 LEU 14 55.621 -0.085 -0.085
101 HD2 LEU 14 HD2 LEU 14 55.487 -1.304 -1.304
102 HD2 LEU 14 HD2 LEU 14 56.619 0.032 0.032
103 H SER 15 HN SER 15 54.296 -1.736 -1.736
104 HA SER 15 HA SER 15 51.854 -1.027 -1.027
105 1HB SER 15 HB2 SER 15 52.919 0.109 0.109
106 2HB SER 15 HB1 SER 15 51.237 -0.068 -0.068
107 HG SER 15 HG SER 15 51.695 -2.383 -2.383
108 H GLU 16 HN GLU 16 51.271 1.119 1.119
109 HA GLU 16 HA GLU 16 53.274 2.709 2.709
110 1HB GLU 16 HB2 GLU 16 50.857 2.674 2.674
111 2HB GLU 16 HB1 GLU 16 50.502 3.448 3.448
112 1HG GLU 16 HG2 GLU 16 51.441 5.483 5.483
113 2HG GLU 16 HG1 GLU 16 52.459 4.734 4.734
114 H GLU 17 HN GLU 17 51.845 2.879 2.879
115 HA GLU 17 HA GLU 17 52.714 5.436 5.436
116 1HB GLU 17 HB2 GLU 17 52.659 2.861 2.861
117 2HB GLU 17 HB1 GLU 17 52.475 4.498 4.498
118 1HG GLU 17 HG2 GLU 17 50.588 4.066 4.066
119 2HG GLU 17 HG1 GLU 17 50.428 2.787 2.787
120 H MET 18 HN MET 18 54.508 2.367 2.367
121 HA MET 18 HA MET 18 56.887 3.412 3.412
122 1HB MET 18 HB2 MET 18 56.134 1.013 1.013
123 2HB MET 18 HB1 MET 18 56.531 1.026 1.026
124 1HG MET 18 HG2 MET 18 58.810 2.076 2.076
125 2HG MET 18 HG1 MET 18 58.309 0.800 0.800
126 1HE MET 18 HE1 MET 18 59.830 1.875 1.875
127 2HE MET 18 HE3 MET 18 59.818 0.504 0.504
128 3HE MET 18 HE2 MET 18 58.333 1.395 1.395
129 H ILE 19 HN ILE 19 55.890 2.900 2.900
130 HA ILE 19 HA ILE 19 58.200 3.369 3.369
131 HB ILE 19 HB ILE 19 55.390 4.448 4.448
132 1HG1 ILE 19 HG12 ILE 19 56.908 2.085 2.085
133 2HG1 ILE 19 HG11 ILE 19 55.558 2.016 2.016
134 1HG2 ILE 19 HG23 ILE 19 57.769 5.169 5.169
135 2HG2 ILE 19 HG22 ILE 19 56.764 4.184 4.184
136 3HG2 ILE 19 HG21 ILE 19 56.106 5.651 5.651
137 HD1 ILE 19 HD1 ILE 19 55.511 2.919 2.919
138 HD1 ILE 19 HD1 ILE 19 54.189 3.252 3.252
139 HD1 ILE 19 HD1 ILE 19 54.618 1.586 1.586
140 H ALA 20 HN ALA 20 56.302 5.773 5.773
141 HA ALA 20 HA ALA 20 57.760 8.085 8.085
142 1HB ALA 20 HB1 ALA 20 55.441 7.613 7.613
143 2HB ALA 20 HB3 ALA 20 56.479 8.101 8.101
144 3HB ALA 20 HB2 ALA 20 56.234 9.187 9.187
145 H GLU 21 HN GLU 21 58.093 5.919 5.919
146 HA GLU 21 HA GLU 21 60.012 7.390 7.390
147 1HB GLU 21 HB2 GLU 21 58.884 5.450 5.450
148 2HB GLU 21 HB1 GLU 21 59.512 4.427 4.427
149 1HG GLU 21 HG2 GLU 21 61.430 4.061 4.061
150 2HG GLU 21 HG1 GLU 21 61.670 5.789 5.789
151 H PHE 22 HN PHE 22 60.542 4.866 4.866
152 HA PHE 22 HA PHE 22 63.406 5.047 5.047
153 1HB PHE 22 HB2 PHE 22 61.343 4.142 4.142
154 2HB PHE 22 HB1 PHE 22 63.074 3.902 3.902
155 HD1 PHE 22 HD2 PHE 22 62.424 3.823 3.823
156 HD2 PHE 22 HD1 PHE 22 62.002 1.436 1.436
157 HE1 PHE 22 HE2 PHE 22 62.316 1.774 1.774
158 HE2 PHE 22 HE1 PHE 22 61.893 -0.613 -0.613
159 HZ PHE 22 HZ PHE 22 62.049 -0.443 -0.443
160 H LYS 23 HN LYS 23 60.890 6.856 6.856
161 HA LYS 23 HA LYS 23 62.475 8.091 8.091
162 1HB LYS 23 HB2 LYS 23 59.946 8.057 8.057
163 2HB LYS 23 HB1 LYS 23 60.180 9.326 9.326
164 1HG LYS 23 HG2 LYS 23 59.750 10.544 10.544
165 2HG LYS 23 HG1 LYS 23 61.512 10.541 10.541
166 1HD LYS 23 HD2 LYS 23 61.730 9.023 9.023
167 2HD LYS 23 HD1 LYS 23 60.148 8.299 8.299
168 1HE LYS 23 HE2 LYS 23 59.006 10.160 10.160
169 2HE LYS 23 HE1 LYS 23 60.495 11.127 11.127
170 1HZ LYS 23 HZ1 LYS 23 61.323 8.943 8.943
171 2HZ LYS 23 HZ3 LYS 23 59.689 8.889 8.889
172 3HZ LYS 23 HZ2 LYS 23 60.629 10.252 10.252
173 H ALA 24 HN ALA 24 61.334 9.748 9.748
174 HA ALA 24 HA ALA 24 63.013 11.949 11.949
175 1HB ALA 24 HB2 ALA 24 61.407 10.454 10.454
176 2HB ALA 24 HB1 ALA 24 62.895 10.925 10.925
177 3HB ALA 24 HB3 ALA 24 61.864 12.155 12.155
178 H ALA 25 HN ALA 25 63.792 8.778 8.778
179 HA ALA 25 HA ALA 25 66.475 9.441 9.441
180 1HB ALA 25 HB2 ALA 25 64.952 6.896 6.896
181 2HB ALA 25 HB1 ALA 25 66.636 6.861 6.861
182 3HB ALA 25 HB3 ALA 25 65.400 7.561 7.561
183 H PHE 26 HN PHE 26 65.116 7.965 7.965
184 HA PHE 26 HA PHE 26 67.625 7.392 7.392
185 1HB PHE 26 HB2 PHE 26 65.668 6.305 6.305
186 2HB PHE 26 HB1 PHE 26 64.767 7.818 7.818
187 HD1 PHE 26 HD2 PHE 26 65.391 9.522 9.522
188 HD2 PHE 26 HD1 PHE 26 67.001 5.540 5.540
189 HE1 PHE 26 HE2 PHE 26 66.082 9.785 9.785
190 HE2 PHE 26 HE1 PHE 26 67.693 5.804 5.804
191 HZ PHE 26 HZ PHE 26 67.235 7.926 7.926
192 H ASP 27 HN ASP 27 65.555 10.269 10.269
193 HA ASP 27 HA ASP 27 66.899 11.724 11.724
194 1HB ASP 27 HB2 ASP 27 65.010 12.272 12.272
195 2HB ASP 27 HB1 ASP 27 65.780 13.648 13.648
196 H MET 28 HN MET 28 67.991 10.767 10.767
197 HA MET 28 HA MET 28 69.383 13.045 13.045
198 1HB MET 28 HB2 MET 28 69.925 10.064 10.064
199 2HB MET 28 HB1 MET 28 70.818 11.238 11.238
200 1HG MET 28 HG2 MET 28 67.800 10.985 10.985
201 2HG MET 28 HG1 MET 28 68.864 10.179 10.179
202 1HE MET 28 HE3 MET 28 66.491 12.101 12.101
203 2HE MET 28 HE2 MET 28 66.859 13.731 13.731
204 3HE MET 28 HE1 MET 28 66.864 13.378 13.378
205 H PHE 29 HN PHE 29 70.025 10.989 10.989
206 HA PHE 29 HA PHE 29 72.661 12.382 12.382
207 1HB PHE 29 HB2 PHE 29 72.027 9.679 9.679
208 2HB PHE 29 HB1 PHE 29 73.592 10.349 10.349
209 HD1 PHE 29 HD1 PHE 29 74.306 10.399 10.399
210 HD2 PHE 29 HD2 PHE 29 70.553 8.671 8.671
211 HE1 PHE 29 HE1 PHE 29 74.117 9.311 9.311
212 HE2 PHE 29 HE2 PHE 29 70.363 7.583 7.583
213 HZ PHE 29 HZ PHE 29 72.144 7.901 7.901
214 H ASP 30 HN ASP 30 69.768 12.875 12.875
215 HA ASP 30 HA ASP 30 70.242 12.589 12.589
216 1HB ASP 30 HB2 ASP 30 67.855 12.851 12.851
217 2HB ASP 30 HB1 ASP 30 68.145 11.764 11.764
218 H ALA 31 HN ALA 31 71.890 14.514 14.514
219 HA ALA 31 HA ALA 31 70.739 17.145 17.145
220 1HB ALA 31 HB3 ALA 31 73.373 15.839 15.839
221 2HB ALA 31 HB2 ALA 31 73.322 17.489 17.489
222 3HB ALA 31 HB1 ALA 31 72.876 17.160 17.160
223 H ASP 32 HN ASP 32 71.868 15.239 15.239
224 HA ASP 32 HA ASP 32 70.776 17.365 17.365
225 1HB ASP 32 HB2 ASP 32 73.248 17.471 17.471
226 2HB ASP 32 HB1 ASP 32 73.345 15.777 15.777
227 H GLY 33 HN GLY 33 70.458 14.256 14.256
228 1HA GLY 33 HA2 GLY 33 70.108 12.968 12.968
229 2HA GLY 33 HA1 GLY 33 69.799 12.227 12.227
230 H GLY 34 HN GLY 34 68.058 14.230 14.230
231 1HA GLY 34 HA2 GLY 34 65.787 14.816 14.816
232 2HA GLY 34 HA1 GLY 34 65.909 14.881 14.881
233 H GLY 35 HN GLY 35 66.685 11.979 11.979
234 1HA GLY 35 HA2 GLY 35 64.503 10.484 10.484
235 2HA GLY 35 HA1 GLY 35 64.492 10.584 10.584
236 H ASP 36 HN ASP 36 67.611 10.720 10.720
237 HA ASP 36 HA ASP 36 68.073 7.821 7.821
238 1HB ASP 36 HB2 ASP 36 69.429 7.800 7.800
239 2HB ASP 36 HB1 ASP 36 67.692 7.994 7.994
240 H ILE 37 HN ILE 37 69.765 7.708 7.708
241 HA ILE 37 HA ILE 37 71.611 10.013 10.013
242 HB ILE 37 HB ILE 37 72.242 8.879 8.879
243 1HG1 ILE 37 HG12 ILE 37 70.530 6.595 6.595
244 2HG1 ILE 37 HG11 ILE 37 72.288 6.577 6.577
245 1HG2 ILE 37 HG21 ILE 37 69.358 9.161 9.161
246 2HG2 ILE 37 HG23 ILE 37 69.741 8.382 8.382
247 3HG2 ILE 37 HG22 ILE 37 70.301 10.024 10.024
248 HD1 ILE 37 HD1 ILE 37 72.186 6.122 6.122
249 HD1 ILE 37 HD1 ILE 37 70.471 5.791 5.791
250 HD1 ILE 37 HD1 ILE 37 70.995 7.393 7.393
251 H SER 38 HN SER 38 74.003 9.400 9.400
252 HA SER 38 HA SER 38 75.102 8.263 8.263
253 1HB SER 38 HB2 SER 38 76.386 8.274 8.274
254 2HB SER 38 HB1 SER 38 77.176 8.473 8.473
255 HG SER 38 HG SER 38 76.939 10.508 10.508
256 H THR 39 HN THR 39 75.321 6.154 6.154
257 HA THR 39 HA THR 39 74.204 3.914 3.914
258 HB THR 39 HB THR 39 76.158 2.738 2.738
259 HG1 THR 39 HG1 THR 39 76.869 4.515 4.515
260 1HG2 THR 39 HG23 THR 39 73.768 4.136 4.136
261 2HG2 THR 39 HG22 THR 39 74.979 4.229 4.229
262 3HG2 THR 39 HG21 THR 39 74.464 2.658 2.658
263 H LYS 40 HN LYS 40 77.262 5.465 5.465
264 HA LYS 40 HA LYS 40 78.344 3.290 3.290
265 1HB LYS 40 HB2 LYS 40 79.142 5.768 5.768
266 2HB LYS 40 HB1 LYS 40 79.175 5.994 5.994
267 1HG LYS 40 HG2 LYS 40 80.321 3.447 3.447
268 2HG LYS 40 HG1 LYS 40 81.237 4.913 4.913
269 1HD LYS 40 HD2 LYS 40 80.327 5.019 5.019
270 2HD LYS 40 HD1 LYS 40 81.142 3.479 3.479
271 1HE LYS 40 HE2 LYS 40 82.951 4.971 4.971
272 2HE LYS 40 HE1 LYS 40 82.251 6.264 6.264
273 1HZ LYS 40 HZ1 LYS 40 82.414 4.668 4.668
274 2HZ LYS 40 HZ3 LYS 40 83.369 3.675 3.675
275 3HZ LYS 40 HZ2 LYS 40 83.903 5.237 5.237
276 H GLU 41 HN GLU 41 75.799 5.508 5.508
277 HA GLU 41 HA GLU 41 76.088 5.477 5.477
278 1HB GLU 41 HB2 GLU 41 75.453 7.474 7.474
279 2HB GLU 41 HB1 GLU 41 73.865 6.710 6.710
280 1HG GLU 41 HG2 GLU 41 73.624 8.151 8.151
281 2HG GLU 41 HG1 GLU 41 74.051 6.627 6.627
282 H LEU 42 HN LEU 42 75.090 3.237 3.237
283 HA LEU 42 HA LEU 42 72.376 2.645 2.645
284 1HB LEU 42 HB2 LEU 42 74.487 1.622 1.622
285 2HB LEU 42 HB1 LEU 42 73.762 0.294 0.294
286 HG LEU 42 HG LEU 42 71.560 1.781 1.781
287 HD1 LEU 42 HD1 LEU 42 73.417 1.588 1.588
288 HD1 LEU 42 HD1 LEU 42 73.178 3.080 3.080
289 HD1 LEU 42 HD1 LEU 42 71.821 2.336 2.336
290 HD2 LEU 42 HD2 LEU 42 72.067 -0.191 -0.191
291 HD2 LEU 42 HD2 LEU 42 71.037 -0.334 -0.334
292 HD2 LEU 42 HD2 LEU 42 72.738 -0.791 -0.791
293 H GLY 43 HN GLY 43 75.537 1.877 1.877
294 1HA GLY 43 HA2 GLY 43 74.589 -0.222 -0.222
295 2HA GLY 43 HA1 GLY 43 76.141 0.607 0.607
296 H THR 44 HN THR 44 75.053 3.279 3.279
297 HA THR 44 HA THR 44 74.495 3.379 3.379
298 HB THR 44 HB THR 44 74.421 5.457 5.457
299 HG1 THR 44 HG1 THR 44 76.503 5.688 5.688
300 1HG2 THR 44 HG23 THR 44 73.212 5.895 5.895
301 2HG2 THR 44 HG22 THR 44 74.851 6.039 6.039
302 3HG2 THR 44 HG21 THR 44 74.302 7.121 7.121
303 H VAL 45 HN VAL 45 72.584 4.452 4.452
304 HA VAL 45 HA VAL 45 70.190 5.145 5.145
305 HB VAL 45 HB VAL 45 70.829 5.182 5.182
306 1HG1 VAL 45 HG11 VAL 45 71.415 2.606 2.606
307 2HG1 VAL 45 HG13 VAL 45 69.718 2.408 2.408
308 3HG1 VAL 45 HG12 VAL 45 70.816 3.260 3.260
309 1HG2 VAL 45 HG21 VAL 45 68.453 5.461 5.461
310 2HG2 VAL 45 HG23 VAL 45 68.579 5.053 5.053
311 3HG2 VAL 45 HG22 VAL 45 68.171 3.805 3.805
312 H MET 46 HN MET 46 71.497 1.904 1.904
313 HA MET 46 HA MET 46 69.027 0.520 0.520
314 1HB MET 46 HB2 MET 46 71.939 -0.253 -0.253
315 2HB MET 46 HB1 MET 46 70.679 -1.423 -1.423
316 1HG MET 46 HG2 MET 46 70.568 0.414 0.414
317 2HG MET 46 HG1 MET 46 71.192 -1.235 -1.235
318 1HE MET 46 HE2 MET 46 70.046 -3.011 -3.011
319 2HE MET 46 HE1 MET 46 68.348 -3.423 -3.423
320 3HE MET 46 HE3 MET 46 69.452 -3.427 -3.427
321 H ARG 47 HN ARG 47 72.229 0.486 0.486
322 HA ARG 47 HA ARG 47 71.347 -0.464 -0.464
323 1HB ARG 47 HB2 ARG 47 73.634 1.255 1.255
324 2HB ARG 47 HB1 ARG 47 73.485 0.823 0.823
325 1HG ARG 47 HG2 ARG 47 73.187 -1.615 -1.615
326 2HG ARG 47 HG1 ARG 47 73.960 -0.966 -0.966
327 1HD ARG 47 HD2 ARG 47 75.551 0.022 0.022
328 2HD ARG 47 HD1 ARG 47 75.160 -1.628 -1.628
329 HE ARG 47 HE ARG 47 75.746 -1.792 -1.792
330 1HH1 ARG 47 HH2 ARG 47 77.208 -3.307 -3.307
331 2HH1 ARG 47 HH2 ARG 47 78.823 -2.708 -2.708
332 1HH2 ARG 47 HH1 ARG 47 77.876 0.039 0.039
333 2HH2 ARG 47 HH1 ARG 47 79.202 -0.814 -0.814
334 H MET 48 HN MET 48 71.035 2.714 2.714
335 HA MET 48 HA MET 48 70.654 4.167 4.167
336 1HB MET 48 HB2 MET 48 71.387 5.119 5.119
337 2HB MET 48 HB1 MET 48 69.778 4.791 4.791
338 1HG MET 48 HG2 MET 48 69.823 7.101 7.101
339 2HG MET 48 HG1 MET 48 68.832 6.206 6.206
340 1HE MET 48 HE3 MET 48 72.320 7.328 7.328
341 2HE MET 48 HE2 MET 48 71.559 8.792 8.792
342 3HE MET 48 HE1 MET 48 72.936 8.098 8.098
343 H LEU 49 HN LEU 49 68.785 1.820 1.820
344 HA LEU 49 HA LEU 49 66.235 3.026 3.026
345 1HB LEU 49 HB2 LEU 49 66.617 0.865 0.865
346 2HB LEU 49 HB1 LEU 49 65.136 1.756 1.756
347 HG LEU 49 HG LEU 49 67.682 3.101 3.101
348 HD1 LEU 49 HD1 LEU 49 65.379 1.919 1.919
349 HD1 LEU 49 HD1 LEU 49 67.108 1.747 1.747
350 HD1 LEU 49 HD1 LEU 49 66.303 3.277 3.277
351 HD2 LEU 49 HD2 LEU 49 65.971 4.878 4.878
352 HD2 LEU 49 HD2 LEU 49 66.182 4.626 4.626
353 HD2 LEU 49 HD2 LEU 49 64.782 3.941 3.941
354 H GLY 50 HN GLY 50 67.982 -0.076 -0.076
355 1HA GLY 50 HA2 GLY 50 67.736 -1.039 -1.039
356 2HA GLY 50 HA1 GLY 50 66.219 -1.496 -1.496
357 H GLN 51 HN GLN 51 67.650 -1.740 -1.740
358 HA GLN 51 HA GLN 51 68.429 -4.553 -4.553
359 1HB GLN 51 HB2 GLN 51 68.632 -2.846 -2.846
360 2HB GLN 51 HB1 GLN 51 68.306 -4.575 -4.575
361 1HG GLN 51 HG2 GLN 51 66.127 -3.990 -3.990
362 2HG GLN 51 HG1 GLN 51 66.250 -3.500 -3.500
363 1HE2 GLN 51 HE22 GLN 51 65.027 -0.418 -0.418
364 2HE2 GLN 51 HE21 GLN 51 64.491 -1.885 -1.885
365 H ASN 52 HN ASN 52 70.483 -5.149 -5.149
366 HA ASN 52 HA ASN 52 72.694 -3.215 -3.215
367 1HB ASN 52 HB2 ASN 52 72.505 -4.035 -4.035
368 2HB ASN 52 HB1 ASN 52 72.530 -5.704 -5.704
369 HD2 ASN 52 HD2 ASN 52 74.571 -6.670 -6.670
370 HD2 ASN 52 HD2 ASN 52 76.044 -5.832 -5.832
371 HA PRO 53 HA PRO 53 73.131 -6.250 -6.250
372 1HB PRO 53 HB2 PRO 53 74.246 -4.468 -4.468
373 2HB PRO 53 HB1 PRO 53 72.493 -4.628 -4.628
374 1HG PRO 53 HG2 PRO 53 74.366 -2.591 -2.591
375 2HG PRO 53 HG1 PRO 53 72.710 -2.398 -2.398
376 1HD PRO 53 HD2 PRO 53 73.358 -2.500 -2.500
377 2HD PRO 53 HD1 PRO 53 71.780 -3.000 -3.000
378 H THR 54 HN THR 54 74.948 -7.534 -7.534
379 HA THR 54 HA THR 54 77.355 -6.927 -6.927
380 HB THR 54 HB THR 54 78.175 -8.920 -8.920
381 HG1 THR 54 HG1 THR 54 76.761 -9.793 -9.793
382 1HG2 THR 54 HG21 THR 54 76.128 -8.730 -8.730
383 2HG2 THR 54 HG23 THR 54 75.801 -10.105 -10.105
384 3HG2 THR 54 HG22 THR 54 77.351 -9.982 -9.982
385 H LYS 55 HN LYS 55 79.288 -5.992 -5.992
386 HA LYS 55 HA LYS 55 79.473 -4.078 -4.078
387 1HB LYS 55 HB2 LYS 55 81.195 -4.452 -4.452
388 2HB LYS 55 HB1 LYS 55 81.542 -6.052 -6.052
389 1HG LYS 55 HG2 LYS 55 82.521 -5.170 -5.170
390 2HG LYS 55 HG1 LYS 55 81.795 -3.582 -3.582
391 1HD LYS 55 HD2 LYS 55 83.794 -4.764 -4.764
392 2HD LYS 55 HD1 LYS 55 84.284 -3.777 -3.777
393 1HE LYS 55 HE2 LYS 55 82.412 -2.132 -2.132
394 2HE LYS 55 HE1 LYS 55 82.840 -2.964 -2.964
395 1HZ LYS 55 HZ1 LYS 55 85.237 -2.631 -2.631
396 2HZ LYS 55 HZ3 LYS 55 84.595 -1.449 -1.449
397 3HZ LYS 55 HZ2 LYS 55 84.424 -1.288 -1.288
398 H GLU 56 HN GLU 56 80.222 -7.555 -7.555
399 HA GLU 56 HA GLU 56 81.032 -7.478 -7.478
400 1HB GLU 56 HB2 GLU 56 80.840 -9.332 -9.332
401 2HB GLU 56 HB1 GLU 56 79.422 -9.776 -9.776
402 1HG GLU 56 HG2 GLU 56 81.191 -11.045 -11.045
403 2HG GLU 56 HG1 GLU 56 80.985 -9.685 -9.685
404 H GLU 57 HN GLU 57 77.809 -7.515 -7.515
405 HA GLU 57 HA GLU 57 76.364 -8.082 -8.082
406 1HB GLU 57 HB2 GLU 57 75.778 -7.088 -7.088
407 2HB GLU 57 HB1 GLU 57 74.519 -6.969 -6.969
408 1HG GLU 57 HG2 GLU 57 75.989 -9.561 -9.561
409 2HG GLU 57 HG1 GLU 57 74.747 -9.154 -9.154
410 H LEU 58 HN LEU 58 77.117 -5.071 -5.071
411 HA LEU 58 HA LEU 58 75.721 -3.189 -3.189
412 1HB LEU 58 HB2 LEU 58 78.528 -3.077 -3.077
413 2HB LEU 58 HB1 LEU 58 77.576 -1.664 -1.664
414 HG LEU 58 HG LEU 58 76.929 -3.690 -3.690
415 HD1 LEU 58 HD1 LEU 58 78.341 -2.099 -2.099
416 HD1 LEU 58 HD1 LEU 58 76.758 -1.376 -1.376
417 HD1 LEU 58 HD1 LEU 58 77.760 -0.805 -0.805
418 HD2 LEU 58 HD2 LEU 58 75.223 -1.733 -1.733
419 HD2 LEU 58 HD2 LEU 58 74.976 -1.875 -1.875
420 HD2 LEU 58 HD2 LEU 58 74.789 -3.290 -3.290
421 H ASP 59 HN ASP 59 79.020 -4.430 -4.430
422 HA ASP 59 HA ASP 59 79.436 -3.002 -3.002
423 1HB ASP 59 HB2 ASP 59 81.118 -4.234 -4.234
424 2HB ASP 59 HB1 ASP 59 80.439 -5.751 -5.751
425 H ALA 60 HN ALA 60 77.866 -6.118 -6.118
426 HA ALA 60 HA ALA 60 77.549 -6.891 -6.891
427 1HB ALA 60 HB2 ALA 60 77.477 -8.282 -8.282
428 2HB ALA 60 HB1 ALA 60 75.823 -7.698 -7.698
429 3HB ALA 60 HB3 ALA 60 76.269 -8.667 -8.667
430 H ILE 61 HN ILE 61 75.483 -5.190 -5.190
431 HA ILE 61 HA ILE 61 73.177 -5.011 -5.011
432 HB ILE 61 HB ILE 61 74.093 -3.506 -3.506
433 1HG1 ILE 61 HG12 ILE 61 71.775 -5.205 -5.205
434 2HG1 ILE 61 HG11 ILE 61 73.106 -6.128 -6.128
435 1HG2 ILE 61 HG23 ILE 61 71.696 -3.224 -3.224
436 2HG2 ILE 61 HG22 ILE 61 71.413 -3.210 -3.210
437 3HG2 ILE 61 HG21 ILE 61 72.497 -2.023 -2.023
438 HD1 ILE 61 HD1 ILE 61 74.278 -4.550 -4.550
439 HD1 ILE 61 HD1 ILE 61 73.982 -6.288 -6.288
440 HD1 ILE 61 HD1 ILE 61 72.783 -5.168 -5.168
441 H ILE 62 HN ILE 62 75.558 -2.549 -2.549
442 HA ILE 62 HA ILE 62 74.798 -0.343 -0.343
443 HB ILE 62 HB ILE 62 77.539 -1.533 -1.533
444 1HG1 ILE 62 HG12 ILE 62 75.962 0.669 0.669
445 2HG1 ILE 62 HG11 ILE 62 76.170 -0.971 -0.971
446 1HG2 ILE 62 HG22 ILE 62 76.713 1.140 1.140
447 2HG2 ILE 62 HG21 ILE 62 78.244 0.934 0.934
448 3HG2 ILE 62 HG23 ILE 62 77.919 0.014 0.014
449 HD1 ILE 62 HD1 ILE 62 77.813 1.104 1.104
450 HD1 ILE 62 HD1 ILE 62 78.676 0.422 0.422
451 HD1 ILE 62 HD1 ILE 62 78.316 -0.587 -0.587
452 H GLU 63 HN GLU 63 77.246 -2.642 -2.642
453 HA GLU 63 HA GLU 63 77.364 -1.784 -1.784
454 1HB GLU 63 HB2 GLU 63 78.513 -3.722 -3.722
455 2HB GLU 63 HB1 GLU 63 77.213 -4.713 -4.713
456 1HG GLU 63 HG2 GLU 63 78.724 -2.925 -2.925
457 2HG GLU 63 HG1 GLU 63 79.495 -4.415 -4.415
458 H GLU 64 HN GLU 64 74.938 -3.962 -3.962
459 HA GLU 64 HA GLU 64 73.511 -4.506 -4.506
460 1HB GLU 64 HB2 GLU 64 73.163 -5.994 -5.994
461 2HB GLU 64 HB1 GLU 64 73.006 -4.689 -4.689
462 1HG GLU 64 HG2 GLU 64 70.807 -4.186 -4.186
463 2HG GLU 64 HG1 GLU 64 70.994 -4.984 -4.984
464 H VAL 65 HN VAL 65 72.688 -2.348 -2.348
465 HA VAL 65 HA VAL 65 70.558 -1.023 -1.023
466 HB VAL 65 HB VAL 65 70.432 0.318 0.318
467 1HG1 VAL 65 HG12 VAL 65 71.021 -2.619 -2.619
468 2HG1 VAL 65 HG11 VAL 65 70.599 -1.636 -1.636
469 3HG1 VAL 65 HG13 VAL 65 69.465 -1.793 -1.793
470 1HG2 VAL 65 HG23 VAL 65 73.238 -0.078 -0.078
471 2HG2 VAL 65 HG22 VAL 65 72.285 0.858 0.858
472 3HG2 VAL 65 HG21 VAL 65 72.622 -0.845 -0.845
473 H ASP 66 HN ASP 66 73.874 -0.821 -0.821
474 HA ASP 66 HA ASP 66 74.135 2.085 2.085
475 1HB ASP 66 HB2 ASP 66 75.972 0.652 0.652
476 2HB ASP 66 HB1 ASP 66 75.902 -0.270 -0.270
477 H GLU 67 HN GLU 67 72.500 -0.069 -0.069
478 HA GLU 67 HA GLU 67 73.516 0.436 0.436
479 1HB GLU 67 HB2 GLU 67 71.410 -0.664 -0.664
480 2HB GLU 67 HB1 GLU 67 72.146 -1.519 -1.519
481 1HG GLU 67 HG2 GLU 67 69.993 -1.328 -1.328
482 2HG GLU 67 HG1 GLU 67 70.656 0.194 0.194
483 H ASP 68 HN ASP 68 72.084 2.519 2.519
484 HA ASP 68 HA ASP 68 70.138 3.900 3.900
485 1HB ASP 68 HB2 ASP 68 71.320 4.019 4.019
486 2HB ASP 68 HB1 ASP 68 71.638 5.593 5.593
487 H GLY 69 HN GLY 69 73.662 4.214 4.214
488 1HA GLY 69 HA2 GLY 69 75.043 5.043 5.043
489 2HA GLY 69 HA1 GLY 69 73.631 5.862 5.862
490 H SER 70 HN SER 70 73.101 6.712 6.712
491 HA SER 70 HA SER 70 74.642 9.236 9.236
492 1HB SER 70 HB2 SER 70 72.955 10.085 10.085
493 2HB SER 70 HB1 SER 70 72.104 8.914 8.914
494 HG SER 70 HG SER 70 71.814 7.690 7.690
495 H GLY 71 HN GLY 71 74.074 6.610 6.610
496 1HA GLY 71 HA2 GLY 71 76.178 5.817 5.817
497 2HA GLY 71 HA1 GLY 71 76.535 7.524 7.524
498 H THR 72 HN THR 72 73.216 6.965 6.965
499 HA THR 72 HA THR 72 73.383 6.647 6.647
500 HB THR 72 HB THR 72 71.491 8.311 8.311
501 HG1 THR 72 HG1 THR 72 70.919 7.898 7.898
502 1HG2 THR 72 HG22 THR 72 74.260 8.865 8.865
503 2HG2 THR 72 HG21 THR 72 73.113 10.196 10.196
504 3HG2 THR 72 HG23 THR 72 73.401 9.459 9.459
505 H ILE 73 HN ILE 73 71.381 5.749 5.749
506 HA ILE 73 HA ILE 73 70.058 3.832 3.832
507 HB ILE 73 HB ILE 73 71.263 3.188 3.188
508 1HG1 ILE 73 HG12 ILE 73 68.312 2.495 2.495
509 2HG1 ILE 73 HG11 ILE 73 69.493 1.798 1.798
510 1HG2 ILE 73 HG23 ILE 73 70.245 5.213 5.213
511 2HG2 ILE 73 HG22 ILE 73 68.773 4.250 4.250
512 3HG2 ILE 73 HG21 ILE 73 70.263 3.683 3.683
513 HD1 ILE 73 HD1 ILE 73 69.796 1.683 1.683
514 HD1 ILE 73 HD1 ILE 73 70.715 0.785 0.785
515 HD1 ILE 73 HD1 ILE 73 69.013 0.408 0.408
516 H ASP 74 HN ASP 74 67.804 3.845 3.845
517 HA ASP 74 HA ASP 74 66.402 6.328 6.328
518 1HB ASP 74 HB2 ASP 74 66.047 3.953 3.953
519 2HB ASP 74 HB1 ASP 74 64.573 4.773 4.773
520 H PHE 75 HN PHE 75 65.015 6.528 6.528
521 HA PHE 75 HA PHE 75 64.795 4.782 4.782
522 1HB PHE 75 HB2 PHE 75 63.939 7.187 7.187
523 2HB PHE 75 HB1 PHE 75 62.483 6.441 6.441
524 HD1 PHE 75 HD2 PHE 75 60.990 5.108 5.108
525 HD2 PHE 75 HD1 PHE 75 64.499 6.990 6.990
526 HE1 PHE 75 HE2 PHE 75 60.140 4.725 4.725
527 HE2 PHE 75 HE1 PHE 75 63.650 6.607 6.607
528 HZ PHE 75 HZ PHE 75 61.471 5.474 5.474
529 H GLU 76 HN GLU 76 62.499 4.960 4.960
530 HA GLU 76 HA GLU 76 60.749 2.887 2.887
531 1HB GLU 76 HB2 GLU 76 60.369 2.714 2.714
532 2HB GLU 76 HB1 GLU 76 60.398 4.383 4.383
533 1HG GLU 76 HG2 GLU 76 62.811 4.511 4.511
534 2HG GLU 76 HG1 GLU 76 62.678 2.891 2.891
535 H GLU 77 HN GLU 77 63.839 2.667 2.667
536 HA GLU 77 HA GLU 77 63.716 -0.245 -0.245
537 1HB GLU 77 HB2 GLU 77 64.855 1.154 1.154
538 2HB GLU 77 HB1 GLU 77 65.909 1.817 1.817
539 1HG GLU 77 HG2 GLU 77 66.987 -0.292 -0.292
540 2HG GLU 77 HG1 GLU 77 65.776 -1.141 -1.141
541 H PHE 78 HN PHE 78 65.752 2.046 2.046
542 HA PHE 78 HA PHE 78 67.249 0.243 0.243
543 1HB PHE 78 HB2 PHE 78 67.732 2.542 2.542
544 2HB PHE 78 HB1 PHE 78 66.049 2.965 2.965
545 HD1 PHE 78 HD1 PHE 78 68.843 0.951 0.951
546 HD2 PHE 78 HD2 PHE 78 65.375 3.390 3.390
547 HE1 PHE 78 HE1 PHE 78 69.261 0.851 0.851
548 HE2 PHE 78 HE2 PHE 78 65.794 3.290 3.290
549 HZ PHE 78 HZ PHE 78 67.736 2.021 2.021
550 H LEU 79 HN LEU 79 63.880 1.272 1.272
551 HA LEU 79 HA LEU 79 63.269 0.378 0.378
552 1HB LEU 79 HB2 LEU 79 61.933 0.728 0.728
553 2HB LEU 79 HB1 LEU 79 61.198 -0.577 -0.577
554 HG LEU 79 HG LEU 79 61.867 1.908 1.908
555 HD1 LEU 79 HD1 LEU 79 60.651 3.297 3.297
556 HD1 LEU 79 HD1 LEU 79 59.249 2.251 2.251
557 HD1 LEU 79 HD1 LEU 79 60.342 1.991 1.991
558 HD2 LEU 79 HD2 LEU 79 60.333 -0.449 -0.449
559 HD2 LEU 79 HD2 LEU 79 59.182 0.886 0.886
560 HD2 LEU 79 HD2 LEU 79 60.480 0.908 0.908
561 H VAL 80 HN VAL 80 63.981 -1.603 -1.603
562 HA VAL 80 HA VAL 80 63.100 -4.129 -4.129
563 HB VAL 80 HB VAL 80 64.377 -5.007 -5.007
564 1HG1 VAL 80 HG11 VAL 80 62.823 -2.599 -2.599
565 2HG1 VAL 80 HG13 VAL 80 64.105 -2.620 -2.620
566 3HG1 VAL 80 HG12 VAL 80 62.966 -3.961 -3.961
567 1HG2 VAL 80 HG22 VAL 80 65.994 -2.460 -2.460
568 2HG2 VAL 80 HG21 VAL 80 66.557 -4.119 -4.119
569 3HG2 VAL 80 HG23 VAL 80 66.116 -3.524 -3.524
570 H MET 81 HN MET 81 66.166 -2.355 -2.355
571 HA MET 81 HA MET 81 67.663 -4.439 -4.439
572 1HB MET 81 HB2 MET 81 67.830 -1.555 -1.555
573 2HB MET 81 HB1 MET 81 68.685 -2.031 -2.031
574 1HG MET 81 HG2 MET 81 69.012 -3.559 -3.559
575 2HG MET 81 HG1 MET 81 70.005 -2.149 -2.149
576 1HE MET 81 HE3 MET 81 71.129 -1.779 -1.779
577 2HE MET 81 HE2 MET 81 72.221 -3.002 -3.002
578 3HE MET 81 HE1 MET 81 72.353 -2.515 -2.515
579 H MET 82 HN MET 82 65.603 -1.805 -1.805
580 HA MET 82 HA MET 82 66.141 -2.106 -2.106
581 1HB MET 82 HB2 MET 82 63.581 -1.342 -1.342
582 2HB MET 82 HB1 MET 82 63.971 -0.945 -0.945
583 1HG MET 82 HG2 MET 82 65.979 0.301 0.301
584 2HG MET 82 HG1 MET 82 65.479 -0.020 -0.020
585 1HE MET 82 HE2 MET 82 65.814 2.027 2.027
586 2HE MET 82 HE1 MET 82 64.836 3.458 3.458
587 3HE MET 82 HE3 MET 82 64.241 2.200 2.200
588 H VAL 83 HN VAL 83 63.693 -3.676 -3.676
589 HA VAL 83 HA VAL 83 62.687 -5.333 -5.333
590 HB VAL 83 HB VAL 83 62.222 -5.350 -5.350
591 1HG1 VAL 83 HG12 VAL 83 60.883 -6.757 -6.757
592 2HG1 VAL 83 HG11 VAL 83 60.037 -6.466 -6.466
593 3HG1 VAL 83 HG13 VAL 83 61.495 -7.456 -7.456
594 1HG2 VAL 83 HG22 VAL 83 61.194 -3.719 -3.719
595 2HG2 VAL 83 HG21 VAL 83 61.261 -3.346 -3.346
596 3HG2 VAL 83 HG23 VAL 83 59.960 -4.352 -4.352
597 H ARG 84 HN ARG 84 64.207 -6.090 -6.090
598 HA ARG 84 HA ARG 84 64.687 -8.794 -8.794
599 1HB ARG 84 HB2 ARG 84 66.535 -6.595 -6.595
600 2HB ARG 84 HB1 ARG 84 66.747 -8.305 -8.305
601 1HG ARG 84 HG2 ARG 84 64.020 -7.363 -7.363
602 2HG ARG 84 HG1 ARG 84 65.230 -6.515 -6.515
603 1HD ARG 84 HD2 ARG 84 65.175 -8.313 -8.313
604 2HD ARG 84 HD1 ARG 84 66.030 -9.197 -9.197
605 HE ARG 84 HE ARG 84 63.074 -8.992 -8.992
606 1HH1 ARG 84 HH1 ARG 84 65.718 -10.795 -10.795
607 2HH1 ARG 84 HH1 ARG 84 65.046 -12.335 -12.335
608 1HH2 ARG 84 HH2 ARG 84 62.280 -10.991 -10.991
609 2HH2 ARG 84 HH2 ARG 84 63.099 -12.446 -12.446
610 H GLN 85 HN GLN 85 66.242 -6.216 -6.216
611 HA GLN 85 HA GLN 85 68.265 -8.056 -8.056
612 1HB GLN 85 HB2 GLN 85 68.800 -5.717 -5.717
613 2HB GLN 85 HB1 GLN 85 67.604 -5.136 -5.136
614 1HG GLN 85 HG2 GLN 85 69.961 -5.108 -5.108
615 2HG GLN 85 HG1 GLN 85 68.853 -6.080 -6.080
616 1HE2 GLN 85 HE22 GLN 85 71.268 -8.273 -8.273
617 2HE2 GLN 85 HE21 GLN 85 70.478 -6.897 -6.897
618 H MET 86 HN MET 86 65.449 -6.131 -6.131
619 HA MET 86 HA MET 86 65.561 -6.982 -6.982
620 1HB MET 86 HB2 MET 86 63.917 -5.385 -5.385
621 2HB MET 86 HB1 MET 86 62.909 -6.341 -6.341
622 1HG MET 86 HG2 MET 86 65.114 -5.291 -5.291
623 2HG MET 86 HG1 MET 86 64.363 -3.968 -3.968
624 1HE MET 86 HE1 MET 86 64.595 -3.587 -3.587
625 2HE MET 86 HE3 MET 86 63.012 -3.112 -3.112
626 3HE MET 86 HE2 MET 86 63.816 -4.551 -4.551
627 H LYS 87 HN LYS 87 64.227 -8.401 -8.401
628 HA LYS 87 HA LYS 87 62.284 -10.165 -10.165
629 1HB LYS 87 HB2 LYS 87 64.506 -10.630 -10.630
630 2HB LYS 87 HB1 LYS 87 63.041 -11.605 -11.605
631 1HG LYS 87 HG2 LYS 87 62.332 -8.813 -8.813
632 2HG LYS 87 HG1 LYS 87 63.385 -9.199 -9.199
633 1HD LYS 87 HD2 LYS 87 61.201 -9.687 -9.687
634 2HD LYS 87 HD1 LYS 87 61.878 -11.258 -11.258
635 1HE LYS 87 HE2 LYS 87 60.798 -10.792 -10.792
636 2HE LYS 87 HE1 LYS 87 59.789 -9.643 -9.643
637 1HZ LYS 87 HZ2 LYS 87 60.257 -12.427 -12.427
638 2HZ LYS 87 HZ1 LYS 87 58.938 -11.996 -11.996
639 3HZ LYS 87 HZ3 LYS 87 59.096 -11.326 -11.326
640 H GLU 88 HN GLU 88 65.748 -10.198 -10.198
641 HA GLU 88 HA GLU 88 65.663 -12.873 -12.873
642 1HB GLU 88 HB2 GLU 88 67.411 -12.382 -12.382
643 2HB GLU 88 HB1 GLU 88 67.900 -10.957 -10.957
644 1HG GLU 88 HG2 GLU 88 67.816 -13.414 -13.414
645 2HG GLU 88 HG1 GLU 88 68.995 -13.467 -13.467
646 H ASP 89 HN ASP 89 66.358 -9.448 -9.448
647 HA ASP 89 HA ASP 89 67.126 -9.828 -9.828
648 1HB ASP 89 HB2 ASP 89 67.700 -7.924 -7.924
649 2HB ASP 89 HB1 ASP 89 66.046 -7.350 -7.350
650 H ALA 90 HN ALA 90 64.099 -9.276 -9.276
651 HA ALA 90 HA ALA 90 62.567 -8.641 -8.641
652 1HB ALA 90 HB2 ALA 90 62.199 -7.961 -7.961
653 2HB ALA 90 HB1 ALA 90 61.491 -9.566 -9.566
654 3HB ALA 90 HB3 ALA 90 60.780 -8.412 -8.412
Start of MODEL 37
1 1H ALA 1 HT3 ALA 1 63.494 -6.731 -6.731
2 2H ALA 1 HT2 ALA 1 64.542 -5.663 -5.663
3 3H ALA 1 HT1 ALA 1 65.115 -6.613 -6.613
4 HA ALA 1 HA ALA 1 65.019 -8.591 -8.591
5 1HB ALA 1 HB1 ALA 1 66.424 -6.246 -6.246
6 2HB ALA 1 HB3 ALA 1 65.937 -7.038 -7.038
7 3HB ALA 1 HB2 ALA 1 66.896 -7.916 -7.916
8 H SER 2 HN SER 2 64.781 -9.191 -9.191
9 HA SER 2 HA SER 2 61.910 -8.932 -8.932
10 1HB SER 2 HB2 SER 2 64.011 -10.748 -10.748
11 2HB SER 2 HB1 SER 2 63.534 -10.150 -10.150
12 HG SER 2 HG SER 2 62.285 -11.957 -11.957
13 H MET 3 HN MET 3 64.735 -7.200 -7.200
14 HA MET 3 HA MET 3 64.148 -6.345 -6.345
15 1HB MET 3 HB2 MET 3 65.851 -5.494 -5.494
16 2HB MET 3 HB1 MET 3 65.671 -4.382 -4.382
17 1HG MET 3 HG2 MET 3 67.639 -5.897 -5.897
18 2HG MET 3 HG1 MET 3 66.466 -6.081 -6.081
19 1HE MET 3 HE3 MET 3 68.805 -7.452 -7.452
20 2HE MET 3 HE2 MET 3 68.540 -9.194 -9.194
21 3HE MET 3 HE1 MET 3 68.227 -8.316 -8.316
22 H THR 4 HN THR 4 63.728 -4.646 -4.646
23 HA THR 4 HA THR 4 62.364 -2.365 -2.365
24 HB THR 4 HB THR 4 62.061 -4.021 -4.021
25 HG1 THR 4 HG1 THR 4 64.009 -3.231 -3.231
26 1HG2 THR 4 HG23 THR 4 60.411 -1.927 -1.927
27 2HG2 THR 4 HG22 THR 4 61.511 -1.191 -1.191
28 3HG2 THR 4 HG21 THR 4 60.516 -2.569 -2.569
29 H ASP 5 HN ASP 5 61.119 -5.626 -5.626
30 HA ASP 5 HA ASP 5 58.321 -4.895 -4.895
31 1HB ASP 5 HB2 ASP 5 58.893 -6.771 -6.771
32 2HB ASP 5 HB1 ASP 5 59.892 -7.483 -7.483
33 H GLN 6 HN GLN 6 60.968 -6.036 -6.036
34 HA GLN 6 HA GLN 6 59.460 -6.921 -6.921
35 1HB GLN 6 HB2 GLN 6 62.122 -6.658 -6.658
36 2HB GLN 6 HB1 GLN 6 61.998 -5.595 -5.595
37 1HG GLN 6 HG2 GLN 6 61.099 -7.404 -7.404
38 2HG GLN 6 HG1 GLN 6 61.049 -8.474 -8.474
39 1HE2 GLN 6 HE22 GLN 6 64.416 -9.434 -9.434
40 2HE2 GLN 6 HE21 GLN 6 62.912 -9.700 -9.700
41 H GLN 7 HN GLN 7 60.041 -3.759 -3.759
42 HA GLN 7 HA GLN 7 59.972 -2.118 -2.118
43 1HB GLN 7 HB2 GLN 7 60.136 -1.751 -1.751
44 2HB GLN 7 HB1 GLN 7 58.433 -1.345 -1.345
45 1HG GLN 7 HG2 GLN 7 59.525 0.027 0.027
46 2HG GLN 7 HG1 GLN 7 60.850 0.104 0.104
47 1HE2 GLN 7 HE22 GLN 7 57.255 1.782 1.782
48 2HE2 GLN 7 HE21 GLN 7 57.245 0.431 0.431
49 H ALA 8 HN ALA 8 57.513 -4.156 -4.156
50 HA ALA 8 HA ALA 8 55.278 -2.677 -2.677
51 1HB ALA 8 HB1 ALA 8 55.081 -3.826 -3.826
52 2HB ALA 8 HB3 ALA 8 55.467 -5.363 -5.363
53 3HB ALA 8 HB2 ALA 8 53.969 -4.523 -4.523
54 H GLU 9 HN GLU 9 56.997 -5.777 -5.777
55 HA GLU 9 HA GLU 9 55.454 -6.371 -6.371
56 1HB GLU 9 HB2 GLU 9 56.971 -7.752 -7.752
57 2HB GLU 9 HB1 GLU 9 57.746 -8.052 -8.052
58 1HG GLU 9 HG2 GLU 9 55.241 -8.421 -8.421
59 2HG GLU 9 HG1 GLU 9 54.989 -8.775 -8.775
60 H ALA 10 HN ALA 10 58.395 -4.763 -4.763
61 HA ALA 10 HA ALA 10 59.877 -5.228 -5.228
62 1HB ALA 10 HB2 ALA 10 59.944 -3.417 -3.417
63 2HB ALA 10 HB1 ALA 10 60.876 -2.926 -2.926
64 3HB ALA 10 HB3 ALA 10 61.205 -4.474 -4.474
65 H ARG 11 HN ARG 11 57.690 -2.643 -2.643
66 HA ARG 11 HA ARG 11 57.824 -1.417 -1.417
67 1HB ARG 11 HB2 ARG 11 56.375 0.348 0.348
68 2HB ARG 11 HB1 ARG 11 58.117 0.273 0.273
69 1HG ARG 11 HG2 ARG 11 56.807 0.393 0.393
70 2HG ARG 11 HG1 ARG 11 57.845 -1.026 -1.026
71 1HD ARG 11 HD2 ARG 11 55.592 -1.643 -1.643
72 2HD ARG 11 HD1 ARG 11 55.879 -2.371 -2.371
73 HE ARG 11 HE ARG 11 54.525 -0.565 -0.565
74 1HH1 ARG 11 HH1 ARG 11 54.013 1.719 1.719
75 2HH1 ARG 11 HH1 ARG 11 52.815 1.538 1.538
76 1HH2 ARG 11 HH2 ARG 11 53.213 -1.899 -1.899
77 2HH2 ARG 11 HH2 ARG 11 52.363 -0.511 -0.511
78 H ALA 12 HN ALA 12 56.126 -3.812 -3.812
79 HA ALA 12 HA ALA 12 53.402 -2.974 -2.974
80 1HB ALA 12 HB2 ALA 12 54.736 -5.386 -5.386
81 2HB ALA 12 HB1 ALA 12 53.073 -5.493 -5.493
82 3HB ALA 12 HB3 ALA 12 53.496 -4.343 -4.343
83 H PHE 13 HN PHE 13 56.112 -4.761 -4.761
84 HA PHE 13 HA PHE 13 54.548 -6.047 -6.047
85 1HB PHE 13 HB2 PHE 13 56.373 -7.324 -7.324
86 2HB PHE 13 HB1 PHE 13 57.388 -5.908 -5.908
87 HD1 PHE 13 HD1 PHE 13 55.862 -8.047 -8.047
88 HD2 PHE 13 HD2 PHE 13 58.814 -5.069 -5.069
89 HE1 PHE 13 HE1 PHE 13 56.866 -8.336 -8.336
90 HE2 PHE 13 HE2 PHE 13 59.818 -5.358 -5.358
91 HZ PHE 13 HZ PHE 13 58.844 -6.991 -6.991
92 H LEU 14 HN LEU 14 56.062 -3.003 -3.003
93 HA LEU 14 HA LEU 14 56.405 -2.458 -2.458
94 1HB LEU 14 HB2 LEU 14 56.969 -0.786 -0.786
95 2HB LEU 14 HB1 LEU 14 57.529 -0.442 -0.442
96 HG LEU 14 HG LEU 14 58.195 -3.012 -3.012
97 HD1 LEU 14 HD1 LEU 14 59.530 -0.320 -0.320
98 HD1 LEU 14 HD1 LEU 14 59.296 -1.456 -1.456
99 HD1 LEU 14 HD1 LEU 14 60.515 -1.781 -1.781
100 HD2 LEU 14 HD2 LEU 14 58.323 -2.564 -2.564
101 HD2 LEU 14 HD2 LEU 14 59.825 -1.754 -1.754
102 HD2 LEU 14 HD2 LEU 14 59.596 -3.460 -3.460
103 H SER 15 HN SER 15 54.506 -1.859 -1.859
104 HA SER 15 HA SER 15 52.176 -0.834 -0.834
105 1HB SER 15 HB2 SER 15 53.224 -1.364 -1.364
106 2HB SER 15 HB1 SER 15 52.380 0.182 0.182
107 HG SER 15 HG SER 15 51.407 -2.345 -2.345
108 H GLU 16 HN GLU 16 51.295 1.461 1.461
109 HA GLU 16 HA GLU 16 52.850 3.459 3.459
110 1HB GLU 16 HB2 GLU 16 50.445 3.595 3.595
111 2HB GLU 16 HB1 GLU 16 50.547 3.566 3.566
112 1HG GLU 16 HG2 GLU 16 51.883 5.712 5.712
113 2HG GLU 16 HG1 GLU 16 51.482 5.769 5.769
114 H GLU 17 HN GLU 17 52.499 2.660 2.660
115 HA GLU 17 HA GLU 17 53.880 4.897 4.897
116 1HB GLU 17 HB2 GLU 17 53.909 2.035 2.035
117 2HB GLU 17 HB1 GLU 17 54.000 3.506 3.506
118 1HG GLU 17 HG2 GLU 17 51.757 3.571 3.571
119 2HG GLU 17 HG1 GLU 17 51.655 3.659 3.659
120 H MET 18 HN MET 18 55.083 1.773 1.773
121 HA MET 18 HA MET 18 57.855 2.315 2.315
122 1HB MET 18 HB2 MET 18 56.661 0.073 0.073
123 2HB MET 18 HB1 MET 18 56.759 0.349 0.349
124 1HG MET 18 HG2 MET 18 58.835 -0.523 -0.523
125 2HG MET 18 HG1 MET 18 59.339 0.889 0.889
126 1HE MET 18 HE2 MET 18 58.193 1.011 1.011
127 2HE MET 18 HE1 MET 18 58.942 -0.100 -0.100
128 3HE MET 18 HE3 MET 18 59.948 0.855 0.855
129 H ILE 19 HN ILE 19 56.079 2.204 2.204
130 HA ILE 19 HA ILE 19 58.142 2.961 2.961
131 HB ILE 19 HB ILE 19 55.178 3.557 3.557
132 1HG1 ILE 19 HG12 ILE 19 56.879 1.672 1.672
133 2HG1 ILE 19 HG11 ILE 19 55.876 1.205 1.205
134 1HG2 ILE 19 HG21 ILE 19 57.183 4.788 4.788
135 2HG2 ILE 19 HG23 ILE 19 56.117 3.784 3.784
136 3HG2 ILE 19 HG22 ILE 19 55.441 5.064 5.064
137 HD1 ILE 19 HD1 ILE 19 53.862 1.814 1.814
138 HD1 ILE 19 HD1 ILE 19 54.814 0.854 0.854
139 HD1 ILE 19 HD1 ILE 19 54.765 2.609 2.609
140 H ALA 20 HN ALA 20 55.765 5.237 5.237
141 HA ALA 20 HA ALA 20 57.100 7.627 7.627
142 1HB ALA 20 HB1 ALA 20 54.746 7.199 7.199
143 2HB ALA 20 HB3 ALA 20 55.510 7.202 7.202
144 3HB ALA 20 HB2 ALA 20 55.573 8.646 8.646
145 H GLU 21 HN GLU 21 57.626 5.438 5.438
146 HA GLU 21 HA GLU 21 59.270 7.181 7.181
147 1HB GLU 21 HB2 GLU 21 58.206 5.181 5.181
148 2HB GLU 21 HB1 GLU 21 59.055 4.168 4.168
149 1HG GLU 21 HG2 GLU 21 60.493 3.883 3.883
150 2HG GLU 21 HG1 GLU 21 61.176 5.382 5.382
151 H PHE 22 HN PHE 22 60.069 4.677 4.677
152 HA PHE 22 HA PHE 22 62.901 4.869 4.869
153 1HB PHE 22 HB2 PHE 22 60.972 4.215 4.215
154 2HB PHE 22 HB1 PHE 22 62.712 3.961 3.961
155 HD1 PHE 22 HD2 PHE 22 61.977 3.521 3.521
156 HD2 PHE 22 HD1 PHE 22 61.450 1.561 1.561
157 HE1 PHE 22 HE2 PHE 22 61.737 1.343 1.343
158 HE2 PHE 22 HE1 PHE 22 61.210 -0.617 -0.617
159 HZ PHE 22 HZ PHE 22 61.353 -0.725 -0.725
160 H LYS 23 HN LYS 23 60.520 6.879 6.879
161 HA LYS 23 HA LYS 23 62.129 8.277 8.277
162 1HB LYS 23 HB2 LYS 23 59.830 9.149 9.149
163 2HB LYS 23 HB1 LYS 23 60.434 10.110 10.110
164 1HG LYS 23 HG2 LYS 23 59.524 7.239 7.239
165 2HG LYS 23 HG1 LYS 23 58.450 8.618 8.618
166 1HD LYS 23 HD2 LYS 23 61.091 8.520 8.520
167 2HD LYS 23 HD1 LYS 23 59.718 7.612 7.612
168 1HE LYS 23 HE2 LYS 23 58.435 9.907 9.907
169 2HE LYS 23 HE1 LYS 23 60.072 10.581 10.581
170 1HZ LYS 23 HZ3 LYS 23 60.221 8.859 8.859
171 2HZ LYS 23 HZ2 LYS 23 58.535 9.067 9.067
172 3HZ LYS 23 HZ1 LYS 23 59.564 10.402 10.402
173 H ALA 24 HN ALA 24 61.125 9.911 9.911
174 HA ALA 24 HA ALA 24 63.064 11.852 11.852
175 1HB ALA 24 HB3 ALA 24 61.937 10.101 10.101
176 2HB ALA 24 HB2 ALA 24 62.692 11.675 11.675
177 3HB ALA 24 HB1 ALA 24 61.187 11.554 11.554
178 H ALA 25 HN ALA 25 63.485 8.416 8.416
179 HA ALA 25 HA ALA 25 66.134 8.734 8.734
180 1HB ALA 25 HB3 ALA 25 64.221 6.867 6.867
181 2HB ALA 25 HB2 ALA 25 65.152 6.174 6.174
182 3HB ALA 25 HB1 ALA 25 65.919 6.456 6.456
183 H PHE 26 HN PHE 26 64.869 7.683 7.683
184 HA PHE 26 HA PHE 26 67.443 7.114 7.114
185 1HB PHE 26 HB2 PHE 26 65.457 6.144 6.144
186 2HB PHE 26 HB1 PHE 26 64.669 7.716 7.716
187 HD1 PHE 26 HD2 PHE 26 65.691 9.451 9.451
188 HD2 PHE 26 HD1 PHE 26 66.753 5.289 5.289
189 HE1 PHE 26 HE2 PHE 26 66.599 9.713 9.713
190 HE2 PHE 26 HE1 PHE 26 67.661 5.551 5.551
191 HZ PHE 26 HZ PHE 26 67.583 7.764 7.764
192 H ASP 27 HN ASP 27 65.364 10.005 10.005
193 HA ASP 27 HA ASP 27 66.960 11.549 11.549
194 1HB ASP 27 HB2 ASP 27 64.632 11.822 11.822
195 2HB ASP 27 HB1 ASP 27 65.581 13.306 13.306
196 H MET 28 HN MET 28 67.680 10.474 10.474
197 HA MET 28 HA MET 28 68.903 12.794 12.794
198 1HB MET 28 HB2 MET 28 69.263 9.799 9.799
199 2HB MET 28 HB1 MET 28 70.087 10.962 10.962
200 1HG MET 28 HG2 MET 28 67.480 11.861 11.861
201 2HG MET 28 HG1 MET 28 67.276 10.110 10.110
202 1HE MET 28 HE1 MET 28 68.061 13.117 13.117
203 2HE MET 28 HE3 MET 28 67.400 12.699 12.699
204 3HE MET 28 HE2 MET 28 69.135 12.925 12.925
205 H PHE 29 HN PHE 29 69.835 10.832 10.832
206 HA PHE 29 HA PHE 29 72.645 11.877 11.877
207 1HB PHE 29 HB2 PHE 29 71.860 9.414 9.414
208 2HB PHE 29 HB1 PHE 29 73.407 9.802 9.802
209 HD1 PHE 29 HD1 PHE 29 73.684 9.628 9.628
210 HD2 PHE 29 HD2 PHE 29 70.065 8.417 8.417
211 HE1 PHE 29 HE1 PHE 29 72.984 8.405 8.405
212 HE2 PHE 29 HE2 PHE 29 69.365 7.194 7.194
213 HZ PHE 29 HZ PHE 29 70.824 7.186 7.186
214 H ASP 30 HN ASP 30 69.764 12.177 12.177
215 HA ASP 30 HA ASP 30 70.633 12.271 12.271
216 1HB ASP 30 HB2 ASP 30 68.309 12.918 12.918
217 2HB ASP 30 HB1 ASP 30 68.513 14.057 14.057
218 H ALA 31 HN ALA 31 72.722 13.468 13.468
219 HA ALA 31 HA ALA 31 72.950 16.112 16.112
220 1HB ALA 31 HB1 ALA 31 74.605 14.237 14.237
221 2HB ALA 31 HB3 ALA 31 74.500 15.294 15.294
222 3HB ALA 31 HB2 ALA 31 75.078 15.931 15.931
223 H ASP 32 HN ASP 32 71.996 14.947 14.947
224 HA ASP 32 HA ASP 32 71.638 17.746 17.746
225 1HB ASP 32 HB2 ASP 32 72.803 16.103 16.103
226 2HB ASP 32 HB1 ASP 32 71.402 15.033 15.033
227 H GLY 33 HN GLY 33 69.776 14.826 14.826
228 1HA GLY 33 HA2 GLY 33 67.492 14.850 14.850
229 2HA GLY 33 HA1 GLY 33 67.322 16.480 16.480
230 H GLY 34 HN GLY 34 68.809 13.978 13.978
231 1HA GLY 34 HA2 GLY 34 66.613 14.244 14.244
232 2HA GLY 34 HA1 GLY 34 68.160 13.442 13.442
233 H GLY 35 HN GLY 35 66.381 12.712 12.712
234 1HA GLY 35 HA2 GLY 35 65.261 10.764 10.764
235 2HA GLY 35 HA1 GLY 35 64.839 10.509 10.509
236 H ASP 36 HN ASP 36 68.194 10.877 10.877
237 HA ASP 36 HA ASP 36 68.708 8.007 8.007
238 1HB ASP 36 HB2 ASP 36 69.842 7.777 7.777
239 2HB ASP 36 HB1 ASP 36 68.149 8.223 8.223
240 H ILE 37 HN ILE 37 70.511 7.943 7.943
241 HA ILE 37 HA ILE 37 72.306 10.306 10.306
242 HB ILE 37 HB ILE 37 72.371 7.746 7.746
243 1HG1 ILE 37 HG12 ILE 37 71.089 9.963 9.963
244 2HG1 ILE 37 HG11 ILE 37 70.243 9.610 9.610
245 1HG2 ILE 37 HG23 ILE 37 73.596 10.460 10.460
246 2HG2 ILE 37 HG22 ILE 37 73.105 9.709 9.709
247 3HG2 ILE 37 HG21 ILE 37 74.266 8.898 8.898
248 HD1 ILE 37 HD1 ILE 37 70.819 7.714 7.714
249 HD1 ILE 37 HD1 ILE 37 70.289 7.157 7.157
250 HD1 ILE 37 HD1 ILE 37 69.244 8.204 8.204
251 H SER 38 HN SER 38 74.765 9.492 9.492
252 HA SER 38 HA SER 38 75.655 8.407 8.407
253 1HB SER 38 HB2 SER 38 76.825 9.923 9.923
254 2HB SER 38 HB1 SER 38 77.198 8.439 8.439
255 HG SER 38 HG SER 38 77.758 8.748 8.748
256 H THR 39 HN THR 39 76.078 6.309 6.309
257 HA THR 39 HA THR 39 74.960 4.057 4.057
258 HB THR 39 HB THR 39 76.810 2.848 2.848
259 HG1 THR 39 HG1 THR 39 78.415 4.426 4.426
260 1HG2 THR 39 HG22 THR 39 75.309 5.133 5.133
261 2HG2 THR 39 HG21 THR 39 76.174 3.904 3.904
262 3HG2 THR 39 HG23 THR 39 74.810 3.445 3.445
263 H LYS 40 HN LYS 40 77.872 5.715 5.715
264 HA LYS 40 HA LYS 40 78.860 3.508 3.508
265 1HB LYS 40 HB2 LYS 40 79.763 5.974 5.974
266 2HB LYS 40 HB1 LYS 40 79.810 6.153 6.153
267 1HG LYS 40 HG2 LYS 40 81.450 4.581 4.581
268 2HG LYS 40 HG1 LYS 40 80.827 3.575 3.575
269 1HD LYS 40 HD2 LYS 40 81.807 4.999 4.999
270 2HD LYS 40 HD1 LYS 40 82.218 6.223 6.223
271 1HE LYS 40 HE2 LYS 40 84.242 4.970 4.970
272 2HE LYS 40 HE1 LYS 40 83.691 4.469 4.469
273 1HZ LYS 40 HZ3 LYS 40 82.526 3.064 3.064
274 2HZ LYS 40 HZ2 LYS 40 84.163 2.734 2.734
275 3HZ LYS 40 HZ1 LYS 40 82.992 2.468 2.468
276 H GLU 41 HN GLU 41 76.147 5.301 5.301
277 HA GLU 41 HA GLU 41 76.361 5.409 5.409
278 1HB GLU 41 HB2 GLU 41 76.232 7.590 7.590
279 2HB GLU 41 HB1 GLU 41 74.622 7.095 7.095
280 1HG GLU 41 HG2 GLU 41 74.103 8.335 8.335
281 2HG GLU 41 HG1 GLU 41 74.230 6.714 6.714
282 H LEU 42 HN LEU 42 74.850 3.953 3.953
283 HA LEU 42 HA LEU 42 72.161 3.605 3.605
284 1HB LEU 42 HB2 LEU 42 73.332 2.770 2.770
285 2HB LEU 42 HB1 LEU 42 74.136 1.546 1.546
286 HG LEU 42 HG LEU 42 71.249 1.545 1.545
287 HD1 LEU 42 HD1 LEU 42 70.791 2.067 2.067
288 HD1 LEU 42 HD1 LEU 42 71.070 0.334 0.334
289 HD1 LEU 42 HD1 LEU 42 72.350 1.475 1.475
290 HD2 LEU 42 HD2 LEU 42 72.315 -0.381 -0.381
291 HD2 LEU 42 HD2 LEU 42 73.475 -0.367 -0.367
292 HD2 LEU 42 HD2 LEU 42 71.818 -0.904 -0.904
293 H GLY 43 HN GLY 43 74.956 1.711 1.711
294 1HA GLY 43 HA2 GLY 43 73.512 -0.116 -0.116
295 2HA GLY 43 HA1 GLY 43 75.166 0.402 0.402
296 H THR 44 HN THR 44 74.932 3.032 3.032
297 HA THR 44 HA THR 44 74.179 3.162 3.162
298 HB THR 44 HB THR 44 74.379 5.150 5.150
299 HG1 THR 44 HG1 THR 44 76.306 5.388 5.388
300 1HG2 THR 44 HG23 THR 44 73.621 5.745 5.745
301 2HG2 THR 44 HG22 THR 44 74.203 6.959 6.959
302 3HG2 THR 44 HG21 THR 44 72.681 6.121 6.121
303 H VAL 45 HN VAL 45 72.185 4.344 4.344
304 HA VAL 45 HA VAL 45 69.882 5.138 5.138
305 HB VAL 45 HB VAL 45 70.326 3.600 3.600
306 1HG1 VAL 45 HG11 VAL 45 67.982 3.296 3.296
307 2HG1 VAL 45 HG13 VAL 45 67.790 5.046 5.046
308 3HG1 VAL 45 HG12 VAL 45 68.061 4.102 4.102
309 1HG2 VAL 45 HG23 VAL 45 70.960 6.171 6.171
310 2HG2 VAL 45 HG22 VAL 45 70.642 5.650 5.650
311 3HG2 VAL 45 HG21 VAL 45 69.356 6.390 6.390
312 H MET 46 HN MET 46 70.249 1.801 1.801
313 HA MET 46 HA MET 46 68.022 0.817 0.817
314 1HB MET 46 HB2 MET 46 68.488 -1.224 -1.224
315 2HB MET 46 HB1 MET 46 68.959 0.031 0.031
316 1HG MET 46 HG2 MET 46 70.996 -0.928 -0.928
317 2HG MET 46 HG1 MET 46 71.241 -0.397 -0.397
318 1HE MET 46 HE1 MET 46 69.377 -2.597 -2.597
319 2HE MET 46 HE3 MET 46 69.924 -4.242 -4.242
320 3HE MET 46 HE2 MET 46 68.533 -3.572 -3.572
321 H ARG 47 HN ARG 47 71.422 1.221 1.221
322 HA ARG 47 HA ARG 47 71.590 -0.822 -0.822
323 1HB ARG 47 HB2 ARG 47 73.458 -0.080 -0.080
324 2HB ARG 47 HB1 ARG 47 73.435 1.483 1.483
325 1HG ARG 47 HG2 ARG 47 73.508 -0.666 -0.666
326 2HG ARG 47 HG1 ARG 47 74.844 -0.821 -0.821
327 1HD ARG 47 HD2 ARG 47 75.194 1.734 1.734
328 2HD ARG 47 HD1 ARG 47 74.218 1.469 1.469
329 HE ARG 47 HE ARG 47 75.876 -0.370 -0.370
330 1HH1 ARG 47 HH1 ARG 47 76.882 1.048 1.048
331 2HH1 ARG 47 HH1 ARG 47 78.489 1.415 1.415
332 1HH2 ARG 47 HH2 ARG 47 77.867 0.581 0.581
333 2HH2 ARG 47 HH2 ARG 47 79.047 1.150 1.150
334 H MET 48 HN MET 48 71.671 2.764 2.764
335 HA MET 48 HA MET 48 71.567 3.033 3.033
336 1HB MET 48 HB2 MET 48 71.978 4.618 4.618
337 2HB MET 48 HB1 MET 48 70.582 5.317 5.317
338 1HG MET 48 HG2 MET 48 72.024 6.309 6.309
339 2HG MET 48 HG1 MET 48 72.395 4.705 4.705
340 1HE MET 48 HE3 MET 48 74.551 5.211 5.211
341 2HE MET 48 HE2 MET 48 74.766 3.689 3.689
342 3HE MET 48 HE1 MET 48 75.987 4.952 4.952
343 H LEU 49 HN LEU 49 69.238 2.038 2.038
344 HA LEU 49 HA LEU 49 66.917 3.411 3.411
345 1HB LEU 49 HB2 LEU 49 67.586 1.449 1.449
346 2HB LEU 49 HB1 LEU 49 65.985 1.246 1.246
347 HG LEU 49 HG LEU 49 67.024 3.908 3.908
348 HD1 LEU 49 HD1 LEU 49 66.387 1.686 1.686
349 HD1 LEU 49 HD1 LEU 49 66.447 3.364 3.364
350 HD1 LEU 49 HD1 LEU 49 64.918 2.663 2.663
351 HD2 LEU 49 HD2 LEU 49 64.285 2.852 2.852
352 HD2 LEU 49 HD2 LEU 49 64.563 4.422 4.422
353 HD2 LEU 49 HD2 LEU 49 65.215 4.085 4.085
354 H GLY 50 HN GLY 50 68.677 0.435 0.435
355 1HA GLY 50 HA2 GLY 50 68.055 -0.183 -0.183
356 2HA GLY 50 HA1 GLY 50 66.514 -0.583 -0.583
357 H GLN 51 HN GLN 51 68.267 -1.323 -1.323
358 HA GLN 51 HA GLN 51 68.643 -4.150 -4.150
359 1HB GLN 51 HB2 GLN 51 68.888 -2.978 -2.978
360 2HB GLN 51 HB1 GLN 51 68.432 -4.621 -4.621
361 1HG GLN 51 HG2 GLN 51 66.800 -2.092 -2.092
362 2HG GLN 51 HG1 GLN 51 66.398 -3.537 -3.537
363 1HE2 GLN 51 HE21 GLN 51 66.655 -5.639 -5.639
364 2HE2 GLN 51 HE22 GLN 51 65.757 -5.452 -5.452
365 H ASN 52 HN ASN 52 70.566 -4.937 -4.937
366 HA ASN 52 HA ASN 52 72.941 -3.215 -3.215
367 1HB ASN 52 HB2 ASN 52 72.451 -4.507 -4.507
368 2HB ASN 52 HB1 ASN 52 73.014 -5.922 -5.922
369 HD2 ASN 52 HD2 ASN 52 74.143 -2.489 -2.489
370 HD2 ASN 52 HD2 ASN 52 75.761 -2.885 -2.885
371 HA PRO 53 HA PRO 53 73.046 -5.932 -5.932
372 1HB PRO 53 HB2 PRO 53 74.311 -4.112 -4.112
373 2HB PRO 53 HB1 PRO 53 72.555 -4.113 -4.113
374 1HG PRO 53 HG2 PRO 53 74.647 -2.386 -2.386
375 2HG PRO 53 HG1 PRO 53 73.000 -1.980 -1.980
376 1HD PRO 53 HD2 PRO 53 73.738 -2.413 -2.413
377 2HD PRO 53 HD1 PRO 53 72.089 -2.648 -2.648
378 H THR 54 HN THR 54 74.756 -7.311 -7.311
379 HA THR 54 HA THR 54 77.265 -7.011 -7.011
380 HB THR 54 HB THR 54 77.716 -9.046 -9.046
381 HG1 THR 54 HG1 THR 54 75.800 -9.893 -9.893
382 1HG2 THR 54 HG22 THR 54 76.239 -8.726 -8.726
383 2HG2 THR 54 HG21 THR 54 75.766 -10.175 -10.175
384 3HG2 THR 54 HG23 THR 54 77.454 -9.926 -9.926
385 H LYS 55 HN LYS 55 79.270 -6.355 -6.355
386 HA LYS 55 HA LYS 55 79.482 -4.472 -4.472
387 1HB LYS 55 HB2 LYS 55 81.158 -5.321 -5.321
388 2HB LYS 55 HB1 LYS 55 81.622 -6.524 -6.524
389 1HG LYS 55 HG2 LYS 55 81.516 -4.050 -4.050
390 2HG LYS 55 HG1 LYS 55 82.371 -3.742 -3.742
391 1HD LYS 55 HD2 LYS 55 83.308 -6.233 -6.233
392 2HD LYS 55 HD1 LYS 55 83.339 -5.074 -5.074
393 1HE LYS 55 HE2 LYS 55 84.301 -3.852 -3.852
394 2HE LYS 55 HE1 LYS 55 85.255 -5.286 -5.286
395 1HZ LYS 55 HZ1 LYS 55 85.433 -4.456 -4.456
396 2HZ LYS 55 HZ3 LYS 55 84.527 -3.080 -3.080
397 3HZ LYS 55 HZ2 LYS 55 86.063 -3.317 -3.317
398 H GLU 56 HN GLU 56 80.502 -7.891 -7.891
399 HA GLU 56 HA GLU 56 80.988 -8.032 -8.032
400 1HB GLU 56 HB2 GLU 56 79.334 -10.011 -10.011
401 2HB GLU 56 HB1 GLU 56 80.354 -10.377 -10.377
402 1HG GLU 56 HG2 GLU 56 82.052 -10.734 -10.734
403 2HG GLU 56 HG1 GLU 56 82.029 -9.006 -9.006
404 H GLU 57 HN GLU 57 77.803 -7.922 -7.922
405 HA GLU 57 HA GLU 57 76.299 -8.352 -8.352
406 1HB GLU 57 HB2 GLU 57 75.749 -7.473 -7.473
407 2HB GLU 57 HB1 GLU 57 74.472 -7.396 -7.396
408 1HG GLU 57 HG2 GLU 57 74.583 -9.559 -9.559
409 2HG GLU 57 HG1 GLU 57 74.583 -9.751 -9.751
410 H LEU 58 HN LEU 58 77.267 -5.494 -5.494
411 HA LEU 58 HA LEU 58 75.801 -3.527 -3.527
412 1HB LEU 58 HB2 LEU 58 78.455 -3.485 -3.485
413 2HB LEU 58 HB1 LEU 58 77.623 -2.028 -2.028
414 HG LEU 58 HG LEU 58 76.651 -4.068 -4.068
415 HD1 LEU 58 HD1 LEU 58 77.488 -1.183 -1.183
416 HD1 LEU 58 HD1 LEU 58 77.926 -2.486 -2.486
417 HD1 LEU 58 HD1 LEU 58 76.318 -1.766 -1.766
418 HD2 LEU 58 HD2 LEU 58 75.170 -2.003 -2.003
419 HD2 LEU 58 HD2 LEU 58 74.649 -2.359 -2.359
420 HD2 LEU 58 HD2 LEU 58 74.672 -3.639 -3.639
421 H ASP 59 HN ASP 59 79.156 -4.697 -4.697
422 HA ASP 59 HA ASP 59 79.764 -3.078 -3.078
423 1HB ASP 59 HB2 ASP 59 80.918 -5.129 -5.129
424 2HB ASP 59 HB1 ASP 59 81.057 -5.649 -5.649
425 H ALA 60 HN ALA 60 77.945 -6.058 -6.058
426 HA ALA 60 HA ALA 60 77.994 -6.703 -6.703
427 1HB ALA 60 HB2 ALA 60 77.380 -7.950 -7.950
428 2HB ALA 60 HB1 ALA 60 75.899 -7.980 -7.980
429 3HB ALA 60 HB3 ALA 60 77.378 -8.693 -8.693
430 H ILE 61 HN ILE 61 75.498 -5.590 -5.590
431 HA ILE 61 HA ILE 61 73.441 -5.192 -5.192
432 HB ILE 61 HB ILE 61 73.969 -3.957 -3.957
433 1HG1 ILE 61 HG12 ILE 61 71.864 -5.992 -5.992
434 2HG1 ILE 61 HG11 ILE 61 73.499 -6.589 -6.589
435 1HG2 ILE 61 HG23 ILE 61 71.559 -3.927 -3.927
436 2HG2 ILE 61 HG22 ILE 61 71.404 -3.710 -3.710
437 3HG2 ILE 61 HG21 ILE 61 72.348 -2.563 -2.563
438 HD1 ILE 61 HD1 ILE 61 73.511 -6.850 -6.850
439 HD1 ILE 61 HD1 ILE 61 72.243 -5.649 -5.649
440 HD1 ILE 61 HD1 ILE 61 73.909 -5.132 -5.132
441 H ILE 62 HN ILE 62 75.780 -2.942 -2.942
442 HA ILE 62 HA ILE 62 74.983 -0.522 -0.522
443 HB ILE 62 HB ILE 62 77.654 -1.739 -1.739
444 1HG1 ILE 62 HG12 ILE 62 75.863 0.377 0.377
445 2HG1 ILE 62 HG11 ILE 62 76.181 -1.238 -1.238
446 1HG2 ILE 62 HG21 ILE 62 77.048 0.997 0.997
447 2HG2 ILE 62 HG23 ILE 62 78.466 0.700 0.700
448 3HG2 ILE 62 HG22 ILE 62 78.279 -0.150 -0.150
449 HD1 ILE 62 HD1 ILE 62 78.713 -0.051 -0.051
450 HD1 ILE 62 HD1 ILE 62 77.926 -0.389 -0.389
451 HD1 ILE 62 HD1 ILE 62 77.714 1.183 1.183
452 H GLU 63 HN GLU 63 77.769 -2.339 -2.339
453 HA GLU 63 HA GLU 63 77.930 -1.156 -1.156
454 1HB GLU 63 HB2 GLU 63 79.432 -2.892 -2.892
455 2HB GLU 63 HB1 GLU 63 78.200 -4.110 -4.110
456 1HG GLU 63 HG2 GLU 63 78.562 -2.665 -2.665
457 2HG GLU 63 HG1 GLU 63 80.177 -3.018 -3.018
458 H GLU 64 HN GLU 64 75.700 -3.735 -3.735
459 HA GLU 64 HA GLU 64 74.556 -4.211 -4.211
460 1HB GLU 64 HB2 GLU 64 74.280 -5.889 -5.889
461 2HB GLU 64 HB1 GLU 64 73.825 -4.729 -4.729
462 1HG GLU 64 HG2 GLU 64 71.648 -4.498 -4.498
463 2HG GLU 64 HG1 GLU 64 72.092 -5.049 -5.049
464 H VAL 65 HN VAL 65 73.406 -2.303 -2.303
465 HA VAL 65 HA VAL 65 71.203 -1.148 -1.148
466 HB VAL 65 HB VAL 65 70.607 -0.173 -0.173
467 1HG1 VAL 65 HG13 VAL 65 71.050 -2.891 -2.891
468 2HG1 VAL 65 HG12 VAL 65 71.831 -2.542 -2.542
469 3HG1 VAL 65 HG11 VAL 65 70.125 -2.155 -2.155
470 1HG2 VAL 65 HG22 VAL 65 73.471 -0.790 -0.790
471 2HG2 VAL 65 HG21 VAL 65 72.744 0.807 0.807
472 3HG2 VAL 65 HG23 VAL 65 72.231 -0.256 -0.256
473 H ASP 66 HN ASP 66 74.483 -0.517 -0.517
474 HA ASP 66 HA ASP 66 74.415 2.403 2.403
475 1HB ASP 66 HB2 ASP 66 76.398 0.208 0.208
476 2HB ASP 66 HB1 ASP 66 76.826 1.853 1.853
477 H GLU 67 HN GLU 67 72.706 2.579 2.579
478 HA GLU 67 HA GLU 67 72.874 1.766 1.766
479 1HB GLU 67 HB2 GLU 67 71.861 4.103 4.103
480 2HB GLU 67 HB1 GLU 67 72.112 4.397 4.397
481 1HG GLU 67 HG2 GLU 67 70.235 3.261 3.261
482 2HG GLU 67 HG1 GLU 67 70.890 1.825 1.825
483 H ASP 68 HN ASP 68 74.917 1.630 1.630
484 HA ASP 68 HA ASP 68 77.008 3.575 3.575
485 1HB ASP 68 HB2 ASP 68 77.923 2.325 2.325
486 2HB ASP 68 HB1 ASP 68 77.364 1.257 1.257
487 H GLY 69 HN GLY 69 75.191 5.399 5.399
488 1HA GLY 69 HA2 GLY 69 75.876 6.897 6.897
489 2HA GLY 69 HA1 GLY 69 74.522 5.909 5.909
490 H SER 70 HN SER 70 73.092 5.873 5.873
491 HA SER 70 HA SER 70 71.836 8.529 8.529
492 1HB SER 70 HB2 SER 70 70.495 6.490 6.490
493 2HB SER 70 HB1 SER 70 71.263 6.027 6.027
494 HG SER 70 HG SER 70 69.208 7.744 7.744
495 H GLY 71 HN GLY 71 72.017 6.883 6.883
496 1HA GLY 71 HA2 GLY 71 73.970 8.860 8.860
497 2HA GLY 71 HA1 GLY 71 72.356 8.869 8.869
498 H THR 72 HN THR 72 71.889 7.366 7.366
499 HA THR 72 HA THR 72 73.928 5.215 5.215
500 HB THR 72 HB THR 72 72.537 7.169 7.169
501 HG1 THR 72 HG1 THR 72 74.587 7.661 7.661
502 1HG2 THR 72 HG23 THR 72 73.711 4.474 4.474
503 2HG2 THR 72 HG22 THR 72 73.792 5.777 5.777
504 3HG2 THR 72 HG21 THR 72 72.232 5.206 5.206
505 H ILE 73 HN ILE 73 71.025 5.854 5.854
506 HA ILE 73 HA ILE 73 69.736 3.420 3.420
507 HB ILE 73 HB ILE 73 70.981 2.879 2.879
508 1HG1 ILE 73 HG12 ILE 73 68.768 2.277 2.277
509 2HG1 ILE 73 HG11 ILE 73 67.998 2.755 2.755
510 1HG2 ILE 73 HG21 ILE 73 70.427 5.365 5.365
511 2HG2 ILE 73 HG23 ILE 73 69.093 4.527 4.527
512 3HG2 ILE 73 HG22 ILE 73 70.759 4.061 4.061
513 HD1 ILE 73 HD1 ILE 73 70.267 0.756 0.756
514 HD1 ILE 73 HD1 ILE 73 69.273 1.128 1.128
515 HD1 ILE 73 HD1 ILE 73 68.565 0.299 0.299
516 H ASP 74 HN ASP 74 67.411 3.438 3.438
517 HA ASP 74 HA ASP 74 66.258 6.158 6.158
518 1HB ASP 74 HB2 ASP 74 65.347 3.606 3.606
519 2HB ASP 74 HB1 ASP 74 64.328 5.041 5.041
520 H PHE 75 HN PHE 75 65.086 6.562 6.562
521 HA PHE 75 HA PHE 75 64.764 4.947 4.947
522 1HB PHE 75 HB2 PHE 75 64.166 7.373 7.373
523 2HB PHE 75 HB1 PHE 75 62.683 6.861 6.861
524 HD1 PHE 75 HD2 PHE 75 61.183 5.157 5.157
525 HD2 PHE 75 HD1 PHE 75 64.191 7.615 7.615
526 HE1 PHE 75 HE2 PHE 75 60.087 4.853 4.853
527 HE2 PHE 75 HE1 PHE 75 63.095 7.311 7.311
528 HZ PHE 75 HZ PHE 75 61.044 5.930 5.930
529 H GLU 76 HN GLU 76 62.301 5.285 5.285
530 HA GLU 76 HA GLU 76 60.444 3.384 3.384
531 1HB GLU 76 HB2 GLU 76 61.288 4.559 4.559
532 2HB GLU 76 HB1 GLU 76 60.257 3.129 3.129
533 1HG GLU 76 HG2 GLU 76 59.647 5.658 5.658
534 2HG GLU 76 HG1 GLU 76 58.900 5.190 5.190
535 H GLU 77 HN GLU 77 63.163 2.826 2.826
536 HA GLU 77 HA GLU 77 62.792 -0.051 -0.051
537 1HB GLU 77 HB2 GLU 77 63.821 1.219 1.219
538 2HB GLU 77 HB1 GLU 77 65.098 1.780 1.780
539 1HG GLU 77 HG2 GLU 77 66.224 -0.200 -0.200
540 2HG GLU 77 HG1 GLU 77 64.742 -1.156 -1.156
541 H PHE 78 HN PHE 78 64.556 2.176 2.176
542 HA PHE 78 HA PHE 78 66.386 0.231 0.231
543 1HB PHE 78 HB2 PHE 78 66.956 2.536 2.536
544 2HB PHE 78 HB1 PHE 78 65.363 2.978 2.978
545 HD1 PHE 78 HD1 PHE 78 68.310 0.826 0.826
546 HD2 PHE 78 HD2 PHE 78 65.078 3.274 3.274
547 HE1 PHE 78 HE1 PHE 78 69.128 0.557 0.557
548 HE2 PHE 78 HE2 PHE 78 65.897 3.005 3.005
549 HZ PHE 78 HZ PHE 78 67.922 1.646 1.646
550 H LEU 79 HN LEU 79 63.096 1.277 1.277
551 HA LEU 79 HA LEU 79 62.653 0.495 0.495
552 1HB LEU 79 HB2 LEU 79 61.149 0.477 0.477
553 2HB LEU 79 HB1 LEU 79 60.464 -0.529 -0.529
554 HG LEU 79 HG LEU 79 61.367 2.161 2.161
555 HD1 LEU 79 HD1 LEU 79 59.259 1.707 1.707
556 HD1 LEU 79 HD1 LEU 79 60.384 3.054 3.054
557 HD1 LEU 79 HD1 LEU 79 58.975 2.938 2.938
558 HD2 LEU 79 HD2 LEU 79 59.516 0.067 0.067
559 HD2 LEU 79 HD2 LEU 79 58.693 1.626 1.626
560 HD2 LEU 79 HD2 LEU 79 60.116 1.426 1.426
561 H VAL 80 HN VAL 80 63.412 -1.576 -1.576
562 HA VAL 80 HA VAL 80 62.594 -4.086 -4.086
563 HB VAL 80 HB VAL 80 63.866 -5.009 -5.009
564 1HG1 VAL 80 HG11 VAL 80 62.206 -2.638 -2.638
565 2HG1 VAL 80 HG13 VAL 80 63.357 -2.835 -2.835
566 3HG1 VAL 80 HG12 VAL 80 62.231 -4.134 -4.134
567 1HG2 VAL 80 HG22 VAL 80 65.272 -2.321 -2.321
568 2HG2 VAL 80 HG21 VAL 80 65.986 -3.879 -3.879
569 3HG2 VAL 80 HG23 VAL 80 65.470 -3.556 -3.556
570 H MET 81 HN MET 81 65.716 -2.339 -2.339
571 HA MET 81 HA MET 81 67.281 -4.289 -4.289
572 1HB MET 81 HB2 MET 81 67.333 -1.411 -1.411
573 2HB MET 81 HB1 MET 81 68.266 -1.838 -1.838
574 1HG MET 81 HG2 MET 81 68.522 -3.239 -3.239
575 2HG MET 81 HG1 MET 81 69.604 -1.964 -1.964
576 1HE MET 81 HE1 MET 81 70.013 -4.971 -4.971
577 2HE MET 81 HE3 MET 81 70.472 -6.129 -6.129
578 3HE MET 81 HE2 MET 81 68.775 -5.734 -5.734
579 H MET 82 HN MET 82 64.869 -2.033 -2.033
580 HA MET 82 HA MET 82 65.633 -2.155 -2.155
581 1HB MET 82 HB2 MET 82 62.977 -1.457 -1.457
582 2HB MET 82 HB1 MET 82 63.562 -0.920 -0.920
583 1HG MET 82 HG2 MET 82 65.606 -0.149 -0.149
584 2HG MET 82 HG1 MET 82 64.170 0.130 0.130
585 1HE MET 82 HE2 MET 82 63.777 2.018 2.018
586 2HE MET 82 HE1 MET 82 62.483 2.625 2.625
587 3HE MET 82 HE3 MET 82 64.028 3.481 3.481
588 H VAL 83 HN VAL 83 62.850 -3.525 -3.525
589 HA VAL 83 HA VAL 83 62.046 -5.260 -5.260
590 HB VAL 83 HB VAL 83 60.492 -4.436 -4.436
591 1HG1 VAL 83 HG11 VAL 83 62.597 -4.860 -4.860
592 2HG1 VAL 83 HG13 VAL 83 61.446 -6.120 -6.120
593 3HG1 VAL 83 HG12 VAL 83 60.951 -4.428 -4.428
594 1HG2 VAL 83 HG23 VAL 83 60.592 -7.006 -7.006
595 2HG2 VAL 83 HG22 VAL 83 59.283 -6.372 -6.372
596 3HG2 VAL 83 HG21 VAL 83 60.602 -7.275 -7.275
597 H ARG 84 HN ARG 84 64.184 -5.589 -5.589
598 HA ARG 84 HA ARG 84 64.376 -8.457 -8.457
599 1HB ARG 84 HB2 ARG 84 66.137 -6.160 -6.160
600 2HB ARG 84 HB1 ARG 84 66.576 -7.842 -7.842
601 1HG ARG 84 HG2 ARG 84 63.802 -7.116 -7.116
602 2HG ARG 84 HG1 ARG 84 65.061 -6.353 -6.353
603 1HD ARG 84 HD2 ARG 84 65.315 -9.288 -9.288
604 2HD ARG 84 HD1 ARG 84 64.141 -8.760 -8.760
605 HE ARG 84 HE ARG 84 66.561 -7.324 -7.324
606 1HH1 ARG 84 HH1 ARG 84 67.124 -10.384 -10.384
607 2HH1 ARG 84 HH1 ARG 84 67.379 -10.962 -10.962
608 1HH2 ARG 84 HH2 ARG 84 66.093 -8.115 -8.115
609 2HH2 ARG 84 HH2 ARG 84 66.794 -9.677 -9.677
610 H GLN 85 HN GLN 85 66.271 -5.930 -5.930
611 HA GLN 85 HA GLN 85 68.087 -7.849 -7.849
612 1HB GLN 85 HB2 GLN 85 68.768 -5.566 -5.566
613 2HB GLN 85 HB1 GLN 85 67.458 -4.915 -4.915
614 1HG GLN 85 HG2 GLN 85 69.725 -4.935 -4.935
615 2HG GLN 85 HG1 GLN 85 68.450 -5.774 -5.774
616 1HE2 GLN 85 HE22 GLN 85 71.399 -8.011 -8.011
617 2HE2 GLN 85 HE21 GLN 85 71.065 -6.454 -6.454
618 H MET 86 HN MET 86 65.190 -6.034 -6.034
619 HA MET 86 HA MET 86 65.265 -6.845 -6.845
620 1HB MET 86 HB2 MET 86 63.636 -5.302 -5.302
621 2HB MET 86 HB1 MET 86 62.619 -6.283 -6.283
622 1HG MET 86 HG2 MET 86 64.118 -5.421 -5.421
623 2HG MET 86 HG1 MET 86 64.652 -4.195 -4.195
624 1HE MET 86 HE3 MET 86 62.334 -5.099 -5.099
625 2HE MET 86 HE2 MET 86 63.261 -3.606 -3.606
626 3HE MET 86 HE1 MET 86 61.501 -3.544 -3.544
627 H LYS 87 HN LYS 87 64.049 -8.306 -8.306
628 HA LYS 87 HA LYS 87 62.121 -10.111 -10.111
629 1HB LYS 87 HB2 LYS 87 64.260 -10.095 -10.095
630 2HB LYS 87 HB1 LYS 87 63.400 -11.610 -11.610
631 1HG LYS 87 HG2 LYS 87 61.508 -9.443 -9.443
632 2HG LYS 87 HG1 LYS 87 62.513 -9.386 -9.386
633 1HD LYS 87 HD2 LYS 87 61.245 -11.950 -11.950
634 2HD LYS 87 HD1 LYS 87 60.421 -10.858 -10.858
635 1HE LYS 87 HE2 LYS 87 62.314 -11.046 -11.046
636 2HE LYS 87 HE1 LYS 87 63.121 -12.172 -12.172
637 1HZ LYS 87 HZ2 LYS 87 60.843 -13.366 -13.366
638 2HZ LYS 87 HZ1 LYS 87 60.613 -12.532 -12.532
639 3HZ LYS 87 HZ3 LYS 87 61.919 -13.601 -13.601
640 H GLU 88 HN GLU 88 65.551 -10.053 -10.053
641 HA GLU 88 HA GLU 88 65.480 -12.775 -12.775
642 1HB GLU 88 HB2 GLU 88 67.286 -11.929 -11.929
643 2HB GLU 88 HB1 GLU 88 67.795 -10.841 -10.841
644 1HG GLU 88 HG2 GLU 88 68.623 -12.550 -12.550
645 2HG GLU 88 HG1 GLU 88 67.438 -13.715 -13.715
646 H ASP 89 HN ASP 89 66.013 -9.355 -9.355
647 HA ASP 89 HA ASP 89 66.586 -9.876 -9.876
648 1HB ASP 89 HB2 ASP 89 67.402 -7.924 -7.924
649 2HB ASP 89 HB1 ASP 89 65.737 -7.356 -7.356
650 H ALA 90 HN ALA 90 63.725 -9.181 -9.181
651 HA ALA 90 HA ALA 90 61.994 -8.584 -8.584
652 1HB ALA 90 HB1 ALA 90 61.687 -7.742 -7.742
653 2HB ALA 90 HB3 ALA 90 61.388 -9.394 -9.394
654 3HB ALA 90 HB2 ALA 90 60.266 -8.612 -8.612
Start of MODEL 38
1 1H ALA 1 HT3 ALA 1 64.034 -6.354 -6.354
2 2H ALA 1 HT2 ALA 1 64.516 -4.901 -4.901
3 3H ALA 1 HT1 ALA 1 65.509 -5.637 -5.637
4 HA ALA 1 HA ALA 1 66.158 -7.350 -7.350
5 1HB ALA 1 HB3 ALA 1 66.458 -4.652 -4.652
6 2HB ALA 1 HB2 ALA 1 65.956 -5.334 -5.334
7 3HB ALA 1 HB1 ALA 1 67.389 -5.958 -5.958
8 H SER 2 HN SER 2 65.913 -8.112 -8.112
9 HA SER 2 HA SER 2 63.088 -8.869 -8.869
10 1HB SER 2 HB2 SER 2 65.766 -9.609 -9.609
11 2HB SER 2 HB1 SER 2 64.302 -10.097 -10.097
12 HG SER 2 HG SER 2 65.125 -11.606 -11.606
13 H MET 3 HN MET 3 65.100 -6.350 -6.350
14 HA MET 3 HA MET 3 64.158 -6.035 -6.035
15 1HB MET 3 HB2 MET 3 65.632 -4.468 -4.468
16 2HB MET 3 HB1 MET 3 64.977 -3.580 -3.580
17 1HG MET 3 HG2 MET 3 66.113 -5.808 -5.808
18 2HG MET 3 HG1 MET 3 67.246 -5.434 -5.434
19 1HE MET 3 HE2 MET 3 68.483 -5.523 -5.523
20 2HE MET 3 HE1 MET 3 69.019 -4.041 -4.041
21 3HE MET 3 HE3 MET 3 67.585 -4.893 -4.893
22 H THR 4 HN THR 4 63.153 -4.624 -4.624
23 HA THR 4 HA THR 4 61.243 -2.761 -2.761
24 HB THR 4 HB THR 4 62.024 -3.230 -3.230
25 HG1 THR 4 HG1 THR 4 59.335 -3.025 -3.025
26 1HG2 THR 4 HG21 THR 4 61.371 -5.821 -5.821
27 2HG2 THR 4 HG23 THR 4 59.963 -5.314 -5.314
28 3HG2 THR 4 HG22 THR 4 61.578 -5.184 -5.184
29 H ASP 5 HN ASP 5 61.126 -6.239 -6.239
30 HA ASP 5 HA ASP 5 58.201 -6.320 -6.320
31 1HB ASP 5 HB2 ASP 5 59.823 -8.017 -8.017
32 2HB ASP 5 HB1 ASP 5 60.133 -8.581 -8.581
33 H GLN 6 HN GLN 6 61.191 -6.869 -6.869
34 HA GLN 6 HA GLN 6 59.721 -7.358 -7.358
35 1HB GLN 6 HB2 GLN 6 62.533 -7.240 -7.240
36 2HB GLN 6 HB1 GLN 6 62.285 -6.991 -6.991
37 1HG GLN 6 HG2 GLN 6 62.549 -9.331 -9.331
38 2HG GLN 6 HG1 GLN 6 60.802 -9.107 -9.107
39 1HE2 GLN 6 HE22 GLN 6 60.225 -10.449 -10.449
40 2HE2 GLN 6 HE21 GLN 6 59.568 -9.894 -9.894
41 H GLN 7 HN GLN 7 60.365 -4.583 -4.583
42 HA GLN 7 HA GLN 7 61.087 -2.788 -2.788
43 1HB GLN 7 HB2 GLN 7 61.643 -2.527 -2.527
44 2HB GLN 7 HB1 GLN 7 59.937 -2.192 -2.192
45 1HG GLN 7 HG2 GLN 7 60.588 -0.519 -0.519
46 2HG GLN 7 HG1 GLN 7 62.004 -0.439 -0.439
47 1HE2 GLN 7 HE22 GLN 7 60.142 0.963 0.963
48 2HE2 GLN 7 HE21 GLN 7 61.427 -0.095 -0.095
49 H ALA 8 HN ALA 8 58.130 -4.029 -4.029
50 HA ALA 8 HA ALA 8 56.433 -1.929 -1.929
51 1HB ALA 8 HB2 ALA 8 55.990 -3.066 -3.066
52 2HB ALA 8 HB1 ALA 8 55.772 -4.586 -4.586
53 3HB ALA 8 HB3 ALA 8 54.652 -3.249 -3.249
54 H GLU 9 HN GLU 9 57.062 -5.409 -5.409
55 HA GLU 9 HA GLU 9 55.370 -5.457 -5.457
56 1HB GLU 9 HB2 GLU 9 56.637 -7.280 -7.280
57 2HB GLU 9 HB1 GLU 9 56.998 -7.762 -7.762
58 1HG GLU 9 HG2 GLU 9 54.191 -6.957 -6.957
59 2HG GLU 9 HG1 GLU 9 54.714 -8.466 -8.466
60 H ALA 10 HN ALA 10 58.412 -4.262 -4.262
61 HA ALA 10 HA ALA 10 59.823 -5.290 -5.290
62 1HB ALA 10 HB2 ALA 10 60.263 -3.495 -3.495
63 2HB ALA 10 HB1 ALA 10 61.127 -3.016 -3.016
64 3HB ALA 10 HB3 ALA 10 61.380 -4.620 -4.620
65 H ARG 11 HN ARG 11 57.851 -2.463 -2.463
66 HA ARG 11 HA ARG 11 58.373 -1.356 -1.356
67 1HB ARG 11 HB2 ARG 11 56.735 0.416 0.416
68 2HB ARG 11 HB1 ARG 11 58.455 0.589 0.589
69 1HG ARG 11 HG2 ARG 11 58.273 0.751 0.751
70 2HG ARG 11 HG1 ARG 11 58.784 -0.914 -0.914
71 1HD ARG 11 HD2 ARG 11 56.950 -0.970 -0.970
72 2HD ARG 11 HD1 ARG 11 56.303 -1.545 -1.545
73 HE ARG 11 HE ARG 11 55.916 1.170 1.170
74 1HH1 ARG 11 HH1 ARG 11 55.805 -0.253 -0.253
75 2HH1 ARG 11 HH1 ARG 11 54.148 0.134 0.134
76 1HH2 ARG 11 HH2 ARG 11 53.506 1.276 1.276
77 2HH2 ARG 11 HH2 ARG 11 52.849 1.003 1.003
78 H ALA 12 HN ALA 12 55.950 -2.888 -2.888
79 HA ALA 12 HA ALA 12 53.590 -2.041 -2.041
80 1HB ALA 12 HB2 ALA 12 54.346 -4.560 -4.560
81 2HB ALA 12 HB1 ALA 12 52.698 -4.182 -4.182
82 3HB ALA 12 HB3 ALA 12 53.529 -3.138 -3.138
83 H PHE 13 HN PHE 13 55.989 -4.554 -4.554
84 HA PHE 13 HA PHE 13 54.730 -6.192 -6.192
85 1HB PHE 13 HB2 PHE 13 56.956 -6.670 -6.670
86 2HB PHE 13 HB1 PHE 13 57.498 -5.028 -5.028
87 HD1 PHE 13 HD1 PHE 13 55.559 -7.560 -7.560
88 HD2 PHE 13 HD2 PHE 13 59.018 -5.023 -5.023
89 HE1 PHE 13 HE1 PHE 13 56.206 -8.244 -8.244
90 HE2 PHE 13 HE2 PHE 13 59.663 -5.706 -5.706
91 HZ PHE 13 HZ PHE 13 58.258 -7.317 -7.317
92 H LEU 14 HN LEU 14 55.867 -2.867 -2.867
93 HA LEU 14 HA LEU 14 54.910 -2.944 -2.944
94 1HB LEU 14 HB2 LEU 14 56.661 -0.920 -0.920
95 2HB LEU 14 HB1 LEU 14 56.417 -1.064 -1.064
96 HG LEU 14 HG LEU 14 57.521 -3.346 -3.346
97 HD1 LEU 14 HD1 LEU 14 59.299 -1.967 -1.967
98 HD1 LEU 14 HD1 LEU 14 59.693 -2.340 -2.340
99 HD1 LEU 14 HD1 LEU 14 58.836 -0.850 -0.850
100 HD2 LEU 14 HD2 LEU 14 56.898 -4.162 -4.162
101 HD2 LEU 14 HD2 LEU 14 57.256 -2.639 -2.639
102 HD2 LEU 14 HD2 LEU 14 58.572 -3.694 -3.694
103 H SER 15 HN SER 15 53.740 -0.959 -0.959
104 HA SER 15 HA SER 15 51.723 -0.145 -0.145
105 1HB SER 15 HB2 SER 15 52.095 0.805 0.805
106 2HB SER 15 HB1 SER 15 50.595 0.709 0.709
107 HG SER 15 HG SER 15 50.818 -1.046 -1.046
108 H GLU 16 HN GLU 16 51.193 2.209 2.209
109 HA GLU 16 HA GLU 16 53.308 3.777 3.777
110 1HB GLU 16 HB2 GLU 16 51.052 4.312 4.312
111 2HB GLU 16 HB1 GLU 16 50.585 4.418 4.418
112 1HG GLU 16 HG2 GLU 16 51.752 6.464 6.464
113 2HG GLU 16 HG1 GLU 16 52.649 6.269 6.269
114 H GLU 17 HN GLU 17 52.314 3.246 3.246
115 HA GLU 17 HA GLU 17 53.402 5.601 5.601
116 1HB GLU 17 HB2 GLU 17 52.938 2.754 2.754
117 2HB GLU 17 HB1 GLU 17 53.403 4.060 4.060
118 1HG GLU 17 HG2 GLU 17 51.389 5.345 5.345
119 2HG GLU 17 HG1 GLU 17 50.869 3.797 3.797
120 H MET 18 HN MET 18 54.810 2.331 2.331
121 HA MET 18 HA MET 18 57.361 2.881 2.881
122 1HB MET 18 HB2 MET 18 56.046 0.741 0.741
123 2HB MET 18 HB1 MET 18 57.190 1.070 1.070
124 1HG MET 18 HG2 MET 18 58.849 0.138 0.138
125 2HG MET 18 HG1 MET 18 58.571 1.291 1.291
126 1HE MET 18 HE2 MET 18 56.936 1.034 1.034
127 2HE MET 18 HE1 MET 18 57.025 -0.506 -0.506
128 3HE MET 18 HE3 MET 18 58.507 0.312 0.312
129 H ILE 19 HN ILE 19 56.301 3.035 3.035
130 HA ILE 19 HA ILE 19 58.639 3.772 3.772
131 HB ILE 19 HB ILE 19 55.751 4.585 4.585
132 1HG1 ILE 19 HG12 ILE 19 56.918 3.450 3.450
133 2HG1 ILE 19 HG11 ILE 19 57.457 2.499 2.499
134 1HG2 ILE 19 HG21 ILE 19 58.086 5.670 5.670
135 2HG2 ILE 19 HG23 ILE 19 56.459 5.600 5.600
136 3HG2 ILE 19 HG22 ILE 19 56.777 6.569 6.569
137 HD1 ILE 19 HD1 ILE 19 54.589 3.174 3.174
138 HD1 ILE 19 HD1 ILE 19 55.082 2.337 2.337
139 HD1 ILE 19 HD1 ILE 19 55.350 1.586 1.586
140 H ALA 20 HN ALA 20 56.502 5.910 5.910
141 HA ALA 20 HA ALA 20 57.996 8.328 8.328
142 1HB ALA 20 HB3 ALA 20 55.691 7.390 7.390
143 2HB ALA 20 HB2 ALA 20 56.689 8.274 8.274
144 3HB ALA 20 HB1 ALA 20 56.147 9.061 9.061
145 H GLU 21 HN GLU 21 58.236 5.715 5.715
146 HA GLU 21 HA GLU 21 60.110 7.019 7.019
147 1HB GLU 21 HB2 GLU 21 58.825 5.143 5.143
148 2HB GLU 21 HB1 GLU 21 59.342 4.152 4.152
149 1HG GLU 21 HG2 GLU 21 61.468 3.803 3.803
150 2HG GLU 21 HG1 GLU 21 61.412 5.267 5.267
151 H PHE 22 HN PHE 22 60.551 4.605 4.605
152 HA PHE 22 HA PHE 22 63.446 4.663 4.663
153 1HB PHE 22 HB2 PHE 22 61.524 3.822 3.822
154 2HB PHE 22 HB1 PHE 22 63.217 3.350 3.350
155 HD1 PHE 22 HD2 PHE 22 62.471 3.455 3.455
156 HD2 PHE 22 HD1 PHE 22 61.342 1.194 1.194
157 HE1 PHE 22 HE2 PHE 22 61.835 1.547 1.547
158 HE2 PHE 22 HE1 PHE 22 60.707 -0.714 -0.714
159 HZ PHE 22 HZ PHE 22 60.952 -0.537 -0.537
160 H LYS 23 HN LYS 23 61.030 6.199 6.199
161 HA LYS 23 HA LYS 23 62.812 7.480 7.480
162 1HB LYS 23 HB2 LYS 23 60.493 7.417 7.417
163 2HB LYS 23 HB1 LYS 23 60.056 8.064 8.064
164 1HG LYS 23 HG2 LYS 23 61.801 9.925 9.925
165 2HG LYS 23 HG1 LYS 23 60.465 9.512 9.512
166 1HD LYS 23 HD2 LYS 23 59.043 9.821 9.821
167 2HD LYS 23 HD1 LYS 23 60.403 10.855 10.855
168 1HE LYS 23 HE2 LYS 23 59.943 11.679 11.679
169 2HE LYS 23 HE1 LYS 23 58.297 11.301 11.301
170 1HZ LYS 23 HZ3 LYS 23 58.745 12.567 12.567
171 2HZ LYS 23 HZ2 LYS 23 60.282 12.985 12.985
172 3HZ LYS 23 HZ1 LYS 23 58.884 13.544 13.544
173 H ALA 24 HN ALA 24 61.457 8.639 8.639
174 HA ALA 24 HA ALA 24 62.622 11.226 11.226
175 1HB ALA 24 HB2 ALA 24 61.884 9.216 9.216
176 2HB ALA 24 HB1 ALA 24 62.429 10.847 10.847
177 3HB ALA 24 HB3 ALA 24 60.952 10.612 10.612
178 H ALA 25 HN ALA 25 63.922 8.102 8.102
179 HA ALA 25 HA ALA 25 66.469 9.273 9.273
180 1HB ALA 25 HB2 ALA 25 65.106 6.628 6.628
181 2HB ALA 25 HB1 ALA 25 66.870 6.597 6.597
182 3HB ALA 25 HB3 ALA 25 65.994 7.382 7.382
183 H PHE 26 HN PHE 26 65.174 7.694 7.694
184 HA PHE 26 HA PHE 26 67.692 7.111 7.111
185 1HB PHE 26 HB2 PHE 26 65.608 6.023 6.023
186 2HB PHE 26 HB1 PHE 26 64.866 7.576 7.576
187 HD1 PHE 26 HD2 PHE 26 66.075 9.027 9.027
188 HD2 PHE 26 HD1 PHE 26 66.686 4.805 4.805
189 HE1 PHE 26 HE2 PHE 26 66.956 8.878 8.878
190 HE2 PHE 26 HE1 PHE 26 67.568 4.656 4.656
191 HZ PHE 26 HZ PHE 26 67.703 6.694 6.694
192 H ASP 27 HN ASP 27 65.450 9.882 9.882
193 HA ASP 27 HA ASP 27 66.819 11.337 11.337
194 1HB ASP 27 HB2 ASP 27 64.483 11.550 11.550
195 2HB ASP 27 HB1 ASP 27 65.412 12.752 12.752
196 H MET 28 HN MET 28 67.759 10.605 10.605
197 HA MET 28 HA MET 28 69.095 12.950 12.950
198 1HB MET 28 HB2 MET 28 69.574 9.981 9.981
199 2HB MET 28 HB1 MET 28 70.548 11.180 11.180
200 1HG MET 28 HG2 MET 28 67.555 11.375 11.375
201 2HG MET 28 HG1 MET 28 68.384 10.209 10.209
202 1HE MET 28 HE2 MET 28 68.945 10.535 10.535
203 2HE MET 28 HE1 MET 28 69.153 12.021 12.021
204 3HE MET 28 HE3 MET 28 67.552 11.565 11.565
205 H PHE 29 HN PHE 29 69.840 10.798 10.798
206 HA PHE 29 HA PHE 29 72.511 12.135 12.135
207 1HB PHE 29 HB2 PHE 29 71.853 9.390 9.390
208 2HB PHE 29 HB1 PHE 29 73.426 10.061 10.061
209 HD1 PHE 29 HD2 PHE 29 70.279 8.645 8.645
210 HD2 PHE 29 HD1 PHE 29 74.215 10.067 10.067
211 HE1 PHE 29 HE2 PHE 29 70.068 7.679 7.679
212 HE2 PHE 29 HE1 PHE 29 74.004 9.100 9.100
213 HZ PHE 29 HZ PHE 29 71.930 7.907 7.907
214 H ASP 30 HN ASP 30 70.106 13.194 13.194
215 HA ASP 30 HA ASP 30 69.628 12.299 12.299
216 1HB ASP 30 HB2 ASP 30 68.433 14.448 14.448
217 2HB ASP 30 HB1 ASP 30 68.108 13.681 13.681
218 H ALA 31 HN ALA 31 72.040 12.085 12.085
219 HA ALA 31 HA ALA 31 73.875 14.187 14.187
220 1HB ALA 31 HB2 ALA 31 73.435 11.541 11.541
221 2HB ALA 31 HB1 ALA 31 74.002 12.559 12.559
222 3HB ALA 31 HB3 ALA 31 74.963 12.412 12.412
223 H ASP 32 HN ASP 32 71.146 13.386 13.386
224 HA ASP 32 HA ASP 32 71.781 15.795 15.795
225 1HB ASP 32 HB2 ASP 32 70.799 13.094 13.094
226 2HB ASP 32 HB1 ASP 32 69.718 14.296 14.296
227 H GLY 33 HN GLY 33 69.199 14.196 14.196
228 1HA GLY 33 HA2 GLY 33 67.570 15.468 15.468
229 2HA GLY 33 HA1 GLY 33 67.813 16.823 16.823
230 H GLY 34 HN GLY 34 67.379 13.512 13.512
231 1HA GLY 34 HA2 GLY 34 64.621 14.220 14.220
232 2HA GLY 34 HA1 GLY 34 65.778 13.528 13.528
233 H GLY 35 HN GLY 35 64.959 12.737 12.737
234 1HA GLY 35 HA2 GLY 35 64.396 10.677 10.677
235 2HA GLY 35 HA1 GLY 35 63.572 10.324 10.324
236 H ASP 36 HN ASP 36 67.035 10.832 10.832
237 HA ASP 36 HA ASP 36 67.709 8.026 8.026
238 1HB ASP 36 HB2 ASP 36 68.882 8.448 8.448
239 2HB ASP 36 HB1 ASP 36 67.129 8.613 8.613
240 H ILE 37 HN ILE 37 69.806 7.663 7.663
241 HA ILE 37 HA ILE 37 71.454 10.098 10.098
242 HB ILE 37 HB ILE 37 72.137 8.891 8.891
243 1HG1 ILE 37 HG12 ILE 37 70.405 6.672 6.672
244 2HG1 ILE 37 HG11 ILE 37 72.151 6.621 6.621
245 1HG2 ILE 37 HG22 ILE 37 69.991 10.184 10.184
246 2HG2 ILE 37 HG21 ILE 37 69.132 8.688 8.688
247 3HG2 ILE 37 HG23 ILE 37 69.998 8.853 8.853
248 HD1 ILE 37 HD1 ILE 37 71.361 5.530 5.530
249 HD1 ILE 37 HD1 ILE 37 69.943 6.571 6.571
250 HD1 ILE 37 HD1 ILE 37 71.533 7.189 7.189
251 H SER 38 HN SER 38 73.856 9.404 9.404
252 HA SER 38 HA SER 38 74.943 8.377 8.377
253 1HB SER 38 HB2 SER 38 75.994 8.537 8.537
254 2HB SER 38 HB1 SER 38 77.012 8.141 8.141
255 HG SER 38 HG SER 38 76.142 10.538 10.538
256 H THR 39 HN THR 39 75.061 6.304 6.304
257 HA THR 39 HA THR 39 73.901 4.034 4.034
258 HB THR 39 HB THR 39 75.498 2.813 2.813
259 HG1 THR 39 HG1 THR 39 76.816 4.497 4.497
260 1HG2 THR 39 HG23 THR 39 73.682 4.960 4.960
261 2HG2 THR 39 HG22 THR 39 74.969 4.846 4.846
262 3HG2 THR 39 HG21 THR 39 73.966 3.439 3.439
263 H LYS 40 HN LYS 40 76.995 5.475 5.475
264 HA LYS 40 HA LYS 40 78.023 3.154 3.154
265 1HB LYS 40 HB2 LYS 40 78.741 5.999 5.999
266 2HB LYS 40 HB1 LYS 40 79.463 5.249 5.249
267 1HG LYS 40 HG2 LYS 40 79.799 3.272 3.272
268 2HG LYS 40 HG1 LYS 40 79.954 4.712 4.712
269 1HD LYS 40 HD2 LYS 40 81.526 4.105 4.105
270 2HD LYS 40 HD1 LYS 40 82.151 4.103 4.103
271 1HE LYS 40 HE2 LYS 40 80.922 6.614 6.614
272 2HE LYS 40 HE1 LYS 40 81.807 6.356 6.356
273 1HZ LYS 40 HZ2 LYS 40 83.742 5.680 5.680
274 2HZ LYS 40 HZ1 LYS 40 82.902 5.972 5.972
275 3HZ LYS 40 HZ3 LYS 40 83.273 7.261 7.261
276 H GLU 41 HN GLU 41 75.497 5.225 5.225
277 HA GLU 41 HA GLU 41 76.003 5.388 5.388
278 1HB GLU 41 HB2 GLU 41 74.805 7.012 7.012
279 2HB GLU 41 HB1 GLU 41 73.438 6.346 6.346
280 1HG GLU 41 HG2 GLU 41 74.034 8.298 8.298
281 2HG GLU 41 HG1 GLU 41 74.755 6.977 6.977
282 H LEU 42 HN LEU 42 74.396 3.391 3.391
283 HA LEU 42 HA LEU 42 72.065 2.479 2.479
284 1HB LEU 42 HB2 LEU 42 74.068 1.554 1.554
285 2HB LEU 42 HB1 LEU 42 73.602 0.205 0.205
286 HG LEU 42 HG LEU 42 71.157 1.118 1.118
287 HD1 LEU 42 HD1 LEU 42 71.008 1.969 1.969
288 HD1 LEU 42 HD1 LEU 42 72.769 2.022 2.022
289 HD1 LEU 42 HD1 LEU 42 71.905 3.073 3.073
290 HD2 LEU 42 HD2 LEU 42 71.526 -1.079 -1.079
291 HD2 LEU 42 HD2 LEU 42 72.958 -0.669 -0.669
292 HD2 LEU 42 HD2 LEU 42 71.352 -0.316 -0.316
293 H GLY 43 HN GLY 43 75.393 1.709 1.709
294 1HA GLY 43 HA2 GLY 43 74.633 -0.232 -0.232
295 2HA GLY 43 HA1 GLY 43 76.192 0.589 0.589
296 H THR 44 HN THR 44 75.167 3.272 3.272
297 HA THR 44 HA THR 44 74.906 3.548 3.548
298 HB THR 44 HB THR 44 74.838 5.352 5.352
299 HG1 THR 44 HG1 THR 44 76.676 6.177 6.177
300 1HG2 THR 44 HG23 THR 44 73.914 5.937 5.937
301 2HG2 THR 44 HG22 THR 44 75.007 7.122 7.122
302 3HG2 THR 44 HG21 THR 44 73.492 6.722 6.722
303 H VAL 45 HN VAL 45 72.677 4.208 4.208
304 HA VAL 45 HA VAL 45 70.430 4.952 4.952
305 HB VAL 45 HB VAL 45 70.876 5.302 5.302
306 1HG1 VAL 45 HG13 VAL 45 71.353 2.745 2.745
307 2HG1 VAL 45 HG12 VAL 45 69.600 2.596 2.596
308 3HG1 VAL 45 HG11 VAL 45 70.482 3.560 3.560
309 1HG2 VAL 45 HG23 VAL 45 68.600 5.455 5.455
310 2HG2 VAL 45 HG22 VAL 45 68.595 5.541 5.541
311 3HG2 VAL 45 HG21 VAL 45 68.181 4.030 4.030
312 H MET 46 HN MET 46 71.747 1.835 1.835
313 HA MET 46 HA MET 46 69.331 0.319 0.319
314 1HB MET 46 HB2 MET 46 72.207 -0.271 -0.271
315 2HB MET 46 HB1 MET 46 71.123 -1.565 -1.565
316 1HG MET 46 HG2 MET 46 69.615 -1.135 -1.135
317 2HG MET 46 HG1 MET 46 70.461 0.353 0.353
318 1HE MET 46 HE2 MET 46 69.578 -2.702 -2.702
319 2HE MET 46 HE1 MET 46 70.845 -3.496 -3.496
320 3HE MET 46 HE3 MET 46 70.758 -3.722 -3.722
321 H ARG 47 HN ARG 47 72.512 0.873 0.873
322 HA ARG 47 HA ARG 47 71.770 -0.639 -0.639
323 1HB ARG 47 HB2 ARG 47 74.091 0.640 0.640
324 2HB ARG 47 HB1 ARG 47 74.016 0.953 0.953
325 1HG ARG 47 HG2 ARG 47 73.360 -1.726 -1.726
326 2HG ARG 47 HG1 ARG 47 74.575 -1.555 -1.555
327 1HD ARG 47 HD2 ARG 47 74.994 -0.434 -0.434
328 2HD ARG 47 HD1 ARG 47 75.500 -2.074 -2.074
329 HE ARG 47 HE ARG 47 76.365 -0.061 -0.061
330 1HH1 ARG 47 HH2 ARG 47 78.213 -2.127 -2.127
331 2HH1 ARG 47 HH2 ARG 47 79.403 -1.653 -1.653
332 1HH2 ARG 47 HH1 ARG 47 77.398 0.775 0.775
333 2HH2 ARG 47 HH1 ARG 47 78.942 -0.009 -0.009
334 H MET 48 HN MET 48 71.435 2.636 2.636
335 HA MET 48 HA MET 48 71.342 3.928 3.928
336 1HB MET 48 HB2 MET 48 70.580 4.560 4.560
337 2HB MET 48 HB1 MET 48 70.081 5.651 5.651
338 1HG MET 48 HG2 MET 48 72.942 4.724 4.724
339 2HG MET 48 HG1 MET 48 72.354 6.119 6.119
340 1HE MET 48 HE1 MET 48 73.948 7.391 7.391
341 2HE MET 48 HE3 MET 48 72.887 8.667 8.667
342 3HE MET 48 HE2 MET 48 74.224 8.080 8.080
343 H LEU 49 HN LEU 49 69.057 2.101 2.101
344 HA LEU 49 HA LEU 49 66.702 3.141 3.141
345 1HB LEU 49 HB2 LEU 49 67.057 0.825 0.825
346 2HB LEU 49 HB1 LEU 49 65.526 1.576 1.576
347 HG LEU 49 HG LEU 49 67.804 3.109 3.109
348 HD1 LEU 49 HD1 LEU 49 65.421 1.720 1.720
349 HD1 LEU 49 HD1 LEU 49 67.126 1.472 1.472
350 HD1 LEU 49 HD1 LEU 49 66.337 2.986 2.986
351 HD2 LEU 49 HD2 LEU 49 64.950 3.673 3.673
352 HD2 LEU 49 HD2 LEU 49 65.672 4.535 4.535
353 HD2 LEU 49 HD2 LEU 49 66.385 4.670 4.670
354 H GLY 50 HN GLY 50 68.710 0.196 0.196
355 1HA GLY 50 HA2 GLY 50 68.668 -0.574 -0.574
356 2HA GLY 50 HA1 GLY 50 67.024 -1.009 -1.009
357 H GLN 51 HN GLN 51 68.357 -1.501 -1.501
358 HA GLN 51 HA GLN 51 68.757 -4.379 -4.379
359 1HB GLN 51 HB2 GLN 51 69.111 -2.884 -2.884
360 2HB GLN 51 HB1 GLN 51 68.541 -4.535 -4.535
361 1HG GLN 51 HG2 GLN 51 67.071 -1.951 -1.951
362 2HG GLN 51 HG1 GLN 51 66.583 -3.290 -3.290
363 1HE2 GLN 51 HE22 GLN 51 64.833 -3.447 -3.447
364 2HE2 GLN 51 HE21 GLN 51 65.040 -2.172 -2.172
365 H ASN 52 HN ASN 52 70.671 -5.160 -5.160
366 HA ASN 52 HA ASN 52 73.117 -3.543 -3.543
367 1HB ASN 52 HB2 ASN 52 72.510 -4.850 -4.850
368 2HB ASN 52 HB1 ASN 52 73.093 -6.257 -6.257
369 HD2 ASN 52 HD2 ASN 52 74.200 -4.205 -4.205
370 HD2 ASN 52 HD2 ASN 52 75.820 -4.040 -4.040
371 HA PRO 53 HA PRO 53 73.126 -6.315 -6.315
372 1HB PRO 53 HB2 PRO 53 74.314 -4.501 -4.501
373 2HB PRO 53 HB1 PRO 53 72.564 -4.536 -4.536
374 1HG PRO 53 HG2 PRO 53 74.642 -2.737 -2.737
375 2HG PRO 53 HG1 PRO 53 72.976 -2.378 -2.378
376 1HD PRO 53 HD2 PRO 53 73.775 -2.739 -2.739
377 2HD PRO 53 HD1 PRO 53 72.120 -3.027 -3.027
378 H THR 54 HN THR 54 74.877 -7.635 -7.635
379 HA THR 54 HA THR 54 77.366 -7.355 -7.355
380 HB THR 54 HB THR 54 77.933 -9.388 -9.388
381 HG1 THR 54 HG1 THR 54 76.240 -9.969 -9.969
382 1HG2 THR 54 HG21 THR 54 75.502 -9.000 -9.000
383 2HG2 THR 54 HG23 THR 54 75.146 -10.084 -10.084
384 3HG2 THR 54 HG22 THR 54 76.411 -10.499 -10.499
385 H LYS 55 HN LYS 55 79.399 -6.678 -6.678
386 HA LYS 55 HA LYS 55 79.691 -4.564 -4.564
387 1HB LYS 55 HB2 LYS 55 81.370 -5.842 -5.842
388 2HB LYS 55 HB1 LYS 55 81.684 -6.830 -6.830
389 1HG LYS 55 HG2 LYS 55 82.740 -5.131 -5.131
390 2HG LYS 55 HG1 LYS 55 81.698 -3.890 -3.890
391 1HD LYS 55 HD2 LYS 55 83.091 -3.535 -3.535
392 2HD LYS 55 HD1 LYS 55 83.423 -5.256 -5.256
393 1HE LYS 55 HE2 LYS 55 85.157 -5.238 -5.238
394 2HE LYS 55 HE1 LYS 55 84.574 -3.738 -3.738
395 1HZ LYS 55 HZ2 LYS 55 85.001 -2.618 -2.618
396 2HZ LYS 55 HZ1 LYS 55 85.738 -4.041 -4.041
397 3HZ LYS 55 HZ3 LYS 55 86.415 -3.197 -3.197
398 H GLU 56 HN GLU 56 79.880 -8.024 -8.024
399 HA GLU 56 HA GLU 56 80.365 -7.618 -7.618
400 1HB GLU 56 HB2 GLU 56 80.031 -9.719 -9.719
401 2HB GLU 56 HB1 GLU 56 78.755 -9.958 -9.958
402 1HG GLU 56 HG2 GLU 56 80.847 -11.106 -11.106
403 2HG GLU 56 HG1 GLU 56 80.411 -9.838 -9.838
404 H GLU 57 HN GLU 57 77.326 -8.042 -8.042
405 HA GLU 57 HA GLU 57 75.463 -8.117 -8.117
406 1HB GLU 57 HB2 GLU 57 75.583 -7.296 -7.296
407 2HB GLU 57 HB1 GLU 57 74.263 -6.556 -6.556
408 1HG GLU 57 HG2 GLU 57 73.588 -8.818 -8.818
409 2HG GLU 57 HG1 GLU 57 74.852 -9.523 -9.523
410 H LEU 58 HN LEU 58 76.985 -5.253 -5.253
411 HA LEU 58 HA LEU 58 75.555 -3.291 -3.291
412 1HB LEU 58 HB2 LEU 58 78.333 -3.147 -3.147
413 2HB LEU 58 HB1 LEU 58 77.244 -1.794 -1.794
414 HG LEU 58 HG LEU 58 76.921 -4.009 -4.009
415 HD1 LEU 58 HD1 LEU 58 78.074 -2.311 -2.311
416 HD1 LEU 58 HD1 LEU 58 76.423 -1.746 -1.746
417 HD1 LEU 58 HD1 LEU 58 77.400 -1.058 -1.058
418 HD2 LEU 58 HD2 LEU 58 74.721 -3.883 -3.883
419 HD2 LEU 58 HD2 LEU 58 74.891 -2.213 -2.213
420 HD2 LEU 58 HD2 LEU 58 74.729 -2.571 -2.571
421 H ASP 59 HN ASP 59 79.016 -4.189 -4.189
422 HA ASP 59 HA ASP 59 79.579 -3.018 -3.018
423 1HB ASP 59 HB2 ASP 59 80.774 -4.769 -4.769
424 2HB ASP 59 HB1 ASP 59 80.669 -5.730 -5.730
425 H ALA 60 HN ALA 60 77.877 -6.070 -6.070
426 HA ALA 60 HA ALA 60 77.744 -6.842 -6.842
427 1HB ALA 60 HB2 ALA 60 76.319 -7.710 -7.710
428 2HB ALA 60 HB1 ALA 60 76.118 -8.519 -8.519
429 3HB ALA 60 HB3 ALA 60 77.696 -8.501 -8.501
430 H ILE 61 HN ILE 61 75.342 -5.600 -5.600
431 HA ILE 61 HA ILE 61 73.200 -5.312 -5.312
432 HB ILE 61 HB ILE 61 73.885 -4.037 -4.037
433 1HG1 ILE 61 HG12 ILE 61 71.677 -6.000 -6.000
434 2HG1 ILE 61 HG11 ILE 61 73.327 -6.564 -6.564
435 1HG2 ILE 61 HG21 ILE 61 72.379 -2.561 -2.561
436 2HG2 ILE 61 HG23 ILE 61 71.256 -3.909 -3.909
437 3HG2 ILE 61 HG22 ILE 61 71.580 -3.231 -3.231
438 HD1 ILE 61 HD1 ILE 61 71.503 -6.139 -6.139
439 HD1 ILE 61 HD1 ILE 61 72.361 -4.598 -4.598
440 HD1 ILE 61 HD1 ILE 61 73.251 -6.100 -6.100
441 H ILE 62 HN ILE 62 75.648 -3.001 -3.001
442 HA ILE 62 HA ILE 62 74.770 -0.641 -0.641
443 HB ILE 62 HB ILE 62 77.529 -1.793 -1.793
444 1HG1 ILE 62 HG12 ILE 62 75.806 0.214 0.214
445 2HG1 ILE 62 HG11 ILE 62 76.165 -1.435 -1.435
446 1HG2 ILE 62 HG21 ILE 62 76.659 0.928 0.928
447 2HG2 ILE 62 HG23 ILE 62 78.163 0.715 0.715
448 3HG2 ILE 62 HG22 ILE 62 77.930 -0.113 -0.113
449 HD1 ILE 62 HD1 ILE 62 77.588 0.464 0.464
450 HD1 ILE 62 HD1 ILE 62 78.372 0.546 0.546
451 HD1 ILE 62 HD1 ILE 62 78.445 -0.942 -0.942
452 H GLU 63 HN GLU 63 77.469 -2.548 -2.548
453 HA GLU 63 HA GLU 63 77.500 -1.554 -1.554
454 1HB GLU 63 HB2 GLU 63 79.063 -3.208 -3.208
455 2HB GLU 63 HB1 GLU 63 77.787 -4.427 -4.427
456 1HG GLU 63 HG2 GLU 63 78.054 -4.887 -4.887
457 2HG GLU 63 HG1 GLU 63 78.054 -3.175 -3.175
458 H GLU 64 HN GLU 64 75.142 -3.772 -3.772
459 HA GLU 64 HA GLU 64 73.868 -4.462 -4.462
460 1HB GLU 64 HB2 GLU 64 73.630 -6.024 -6.024
461 2HB GLU 64 HB1 GLU 64 73.297 -4.769 -4.769
462 1HG GLU 64 HG2 GLU 64 71.085 -4.508 -4.508
463 2HG GLU 64 HG1 GLU 64 71.407 -5.142 -5.142
464 H VAL 65 HN VAL 65 73.221 -2.177 -2.177
465 HA VAL 65 HA VAL 65 70.943 -1.011 -1.011
466 HB VAL 65 HB VAL 65 70.385 -0.020 -0.020
467 1HG1 VAL 65 HG13 VAL 65 71.518 -2.811 -2.811
468 2HG1 VAL 65 HG12 VAL 65 70.514 -2.024 -2.024
469 3HG1 VAL 65 HG11 VAL 65 69.853 -2.370 -2.370
470 1HG2 VAL 65 HG23 VAL 65 73.209 -0.802 -0.802
471 2HG2 VAL 65 HG22 VAL 65 72.552 0.830 0.830
472 3HG2 VAL 65 HG21 VAL 65 71.995 -0.251 -0.251
473 H ASP 66 HN ASP 66 74.150 -0.659 -0.659
474 HA ASP 66 HA ASP 66 74.625 2.146 2.146
475 1HB ASP 66 HB2 ASP 66 76.684 1.655 1.655
476 2HB ASP 66 HB1 ASP 66 76.333 0.330 0.330
477 H GLU 67 HN GLU 67 72.783 3.197 3.197
478 HA GLU 67 HA GLU 67 71.870 2.924 2.924
479 1HB GLU 67 HB2 GLU 67 72.483 5.409 5.409
480 2HB GLU 67 HB1 GLU 67 71.509 5.428 5.428
481 1HG GLU 67 HG2 GLU 67 70.327 3.389 3.389
482 2HG GLU 67 HG1 GLU 67 70.819 4.456 4.456
483 H ASP 68 HN ASP 68 73.229 2.548 2.548
484 HA ASP 68 HA ASP 68 75.891 3.573 3.573
485 1HB ASP 68 HB2 ASP 68 75.635 2.712 2.712
486 2HB ASP 68 HB1 ASP 68 74.949 1.579 1.579
487 H GLY 69 HN GLY 69 75.069 5.900 5.900
488 1HA GLY 69 HA2 GLY 69 75.541 7.763 7.763
489 2HA GLY 69 HA1 GLY 69 73.827 7.421 7.421
490 H SER 70 HN SER 70 73.075 7.011 7.011
491 HA SER 70 HA SER 70 72.967 9.805 9.805
492 1HB SER 70 HB2 SER 70 71.805 7.204 7.204
493 2HB SER 70 HB1 SER 70 71.379 8.806 8.806
494 HG SER 70 HG SER 70 69.891 8.391 8.391
495 H GLY 71 HN GLY 71 73.841 6.694 6.694
496 1HA GLY 71 HA2 GLY 71 75.866 6.361 6.361
497 2HA GLY 71 HA1 GLY 71 76.019 8.112 8.112
498 H THR 72 HN THR 72 72.818 7.244 7.244
499 HA THR 72 HA THR 72 73.227 7.044 7.044
500 HB THR 72 HB THR 72 71.470 8.663 8.663
501 HG1 THR 72 HG1 THR 72 70.210 9.315 9.315
502 1HG2 THR 72 HG21 THR 72 73.840 9.321 9.321
503 2HG2 THR 72 HG23 THR 72 72.804 9.866 9.866
504 3HG2 THR 72 HG22 THR 72 72.588 10.524 10.524
505 H ILE 73 HN ILE 73 70.910 6.448 6.448
506 HA ILE 73 HA ILE 73 69.884 4.120 4.120
507 HB ILE 73 HB ILE 73 71.031 3.543 3.543
508 1HG1 ILE 73 HG12 ILE 73 68.930 2.689 2.689
509 2HG1 ILE 73 HG11 ILE 73 68.031 3.317 3.317
510 1HG2 ILE 73 HG21 ILE 73 69.201 5.649 5.649
511 2HG2 ILE 73 HG23 ILE 73 69.969 4.428 4.428
512 3HG2 ILE 73 HG22 ILE 73 70.959 5.560 5.560
513 HD1 ILE 73 HD1 ILE 73 68.467 1.328 1.328
514 HD1 ILE 73 HD1 ILE 73 69.713 0.923 0.923
515 HD1 ILE 73 HD1 ILE 73 70.111 1.934 1.934
516 H ASP 74 HN ASP 74 67.585 3.801 3.801
517 HA ASP 74 HA ASP 74 66.011 6.285 6.285
518 1HB ASP 74 HB2 ASP 74 65.447 3.709 3.709
519 2HB ASP 74 HB1 ASP 74 64.391 5.122 5.122
520 H PHE 75 HN PHE 75 64.707 6.382 6.382
521 HA PHE 75 HA PHE 75 64.474 4.530 4.530
522 1HB PHE 75 HB2 PHE 75 63.572 6.948 6.948
523 2HB PHE 75 HB1 PHE 75 62.122 6.170 6.170
524 HD1 PHE 75 HD1 PHE 75 64.337 6.434 6.434
525 HD2 PHE 75 HD2 PHE 75 60.573 5.048 5.048
526 HE1 PHE 75 HE1 PHE 75 63.561 5.981 5.981
527 HE2 PHE 75 HE2 PHE 75 59.796 4.595 4.595
528 HZ PHE 75 HZ PHE 75 61.291 5.061 5.061
529 H GLU 76 HN GLU 76 62.260 4.799 4.799
530 HA GLU 76 HA GLU 76 60.498 2.689 2.689
531 1HB GLU 76 HB2 GLU 76 60.245 2.601 2.601
532 2HB GLU 76 HB1 GLU 76 60.177 4.236 4.236
533 1HG GLU 76 HG2 GLU 76 62.806 4.128 4.128
534 2HG GLU 76 HG1 GLU 76 62.322 2.935 2.935
535 H GLU 77 HN GLU 77 63.642 2.560 2.560
536 HA GLU 77 HA GLU 77 63.544 -0.361 -0.361
537 1HB GLU 77 HB2 GLU 77 64.607 1.184 1.184
538 2HB GLU 77 HB1 GLU 77 65.766 1.671 1.671
539 1HG GLU 77 HG2 GLU 77 66.927 -0.308 -0.308
540 2HG GLU 77 HG1 GLU 77 65.489 -1.251 -1.251
541 H PHE 78 HN PHE 78 64.852 2.003 2.003
542 HA PHE 78 HA PHE 78 66.713 0.211 0.211
543 1HB PHE 78 HB2 PHE 78 67.104 2.553 2.553
544 2HB PHE 78 HB1 PHE 78 65.434 2.889 2.889
545 HD1 PHE 78 HD1 PHE 78 68.519 1.139 1.139
546 HD2 PHE 78 HD2 PHE 78 64.826 3.059 3.059
547 HE1 PHE 78 HE1 PHE 78 69.137 0.995 0.995
548 HE2 PHE 78 HE2 PHE 78 65.445 2.912 2.912
549 HZ PHE 78 HZ PHE 78 67.601 1.881 1.881
550 H LEU 79 HN LEU 79 63.327 1.146 1.146
551 HA LEU 79 HA LEU 79 62.752 0.283 0.283
552 1HB LEU 79 HB2 LEU 79 61.310 0.041 0.041
553 2HB LEU 79 HB1 LEU 79 60.548 -0.497 -0.497
554 HG LEU 79 HG LEU 79 61.803 2.226 2.226
555 HD1 LEU 79 HD1 LEU 79 60.005 1.560 1.560
556 HD1 LEU 79 HD1 LEU 79 60.139 3.177 3.177
557 HD1 LEU 79 HD1 LEU 79 58.916 2.060 2.060
558 HD2 LEU 79 HD2 LEU 79 59.334 2.194 2.194
559 HD2 LEU 79 HD2 LEU 79 60.936 2.184 2.184
560 HD2 LEU 79 HD2 LEU 79 60.104 0.663 0.663
561 H VAL 80 HN VAL 80 63.470 -1.746 -1.746
562 HA VAL 80 HA VAL 80 62.669 -4.253 -4.253
563 HB VAL 80 HB VAL 80 63.108 -3.582 -3.582
564 1HG1 VAL 80 HG12 VAL 80 65.437 -2.721 -2.721
565 2HG1 VAL 80 HG11 VAL 80 65.927 -4.405 -4.405
566 3HG1 VAL 80 HG13 VAL 80 65.349 -3.812 -3.812
567 1HG2 VAL 80 HG22 VAL 80 62.843 -5.967 -5.967
568 2HG2 VAL 80 HG21 VAL 80 63.319 -5.826 -5.826
569 3HG2 VAL 80 HG23 VAL 80 64.539 -6.128 -6.128
570 H MET 81 HN MET 81 65.725 -2.436 -2.436
571 HA MET 81 HA MET 81 67.398 -4.443 -4.443
572 1HB MET 81 HB2 MET 81 67.421 -1.582 -1.582
573 2HB MET 81 HB1 MET 81 68.378 -1.957 -1.957
574 1HG MET 81 HG2 MET 81 69.660 -2.107 -2.107
575 2HG MET 81 HG1 MET 81 69.686 -3.584 -3.584
576 1HE MET 81 HE1 MET 81 67.469 -1.656 -1.656
577 2HE MET 81 HE3 MET 81 68.937 -2.002 -2.002
578 3HE MET 81 HE2 MET 81 67.400 -2.716 -2.716
579 H MET 82 HN MET 82 64.906 -2.427 -2.427
580 HA MET 82 HA MET 82 65.847 -2.477 -2.477
581 1HB MET 82 HB2 MET 82 63.079 -1.853 -1.853
582 2HB MET 82 HB1 MET 82 63.864 -1.203 -1.203
583 1HG MET 82 HG2 MET 82 65.626 -0.238 -0.238
584 2HG MET 82 HG1 MET 82 64.458 -0.585 -0.585
585 1HE MET 82 HE2 MET 82 65.379 0.842 0.842
586 2HE MET 82 HE1 MET 82 64.890 2.529 2.529
587 3HE MET 82 HE3 MET 82 63.858 1.364 1.364
588 H VAL 83 HN VAL 83 62.899 -3.774 -3.774
589 HA VAL 83 HA VAL 83 62.200 -5.551 -5.551
590 HB VAL 83 HB VAL 83 60.671 -4.795 -4.795
591 1HG1 VAL 83 HG11 VAL 83 62.637 -4.994 -4.994
592 2HG1 VAL 83 HG13 VAL 83 62.028 -6.635 -6.635
593 3HG1 VAL 83 HG12 VAL 83 60.977 -5.255 -5.255
594 1HG2 VAL 83 HG21 VAL 83 60.821 -7.343 -7.343
595 2HG2 VAL 83 HG23 VAL 83 59.468 -6.721 -6.721
596 3HG2 VAL 83 HG22 VAL 83 60.739 -7.656 -7.656
597 H ARG 84 HN ARG 84 64.080 -6.063 -6.063
598 HA ARG 84 HA ARG 84 64.495 -8.860 -8.860
599 1HB ARG 84 HB2 ARG 84 66.235 -6.606 -6.606
600 2HB ARG 84 HB1 ARG 84 66.527 -8.314 -8.314
601 1HG ARG 84 HG2 ARG 84 63.771 -7.330 -7.330
602 2HG ARG 84 HG1 ARG 84 65.026 -6.753 -6.753
603 1HD ARG 84 HD2 ARG 84 65.714 -9.075 -9.075
604 2HD ARG 84 HD1 ARG 84 64.472 -9.672 -9.672
605 HE ARG 84 HE ARG 84 63.295 -7.866 -7.866
606 1HH1 ARG 84 HH2 ARG 84 65.142 -9.966 -9.966
607 2HH1 ARG 84 HH2 ARG 84 63.944 -11.128 -11.128
608 1HH2 ARG 84 HH1 ARG 84 61.492 -9.826 -9.826
609 2HH2 ARG 84 HH1 ARG 84 61.878 -11.048 -11.048
610 H GLN 85 HN GLN 85 66.220 -6.135 -6.135
611 HA GLN 85 HA GLN 85 68.185 -7.898 -7.898
612 1HB GLN 85 HB2 GLN 85 68.807 -5.667 -5.667
613 2HB GLN 85 HB1 GLN 85 67.511 -4.943 -4.943
614 1HG GLN 85 HG2 GLN 85 69.358 -4.630 -4.630
615 2HG GLN 85 HG1 GLN 85 68.694 -6.144 -6.144
616 1HE2 GLN 85 HE22 GLN 85 71.854 -7.628 -7.628
617 2HE2 GLN 85 HE21 GLN 85 70.569 -7.300 -7.300
618 H MET 86 HN MET 86 65.158 -6.278 -6.278
619 HA MET 86 HA MET 86 65.374 -6.758 -6.758
620 1HB MET 86 HB2 MET 86 63.636 -5.421 -5.421
621 2HB MET 86 HB1 MET 86 62.716 -6.249 -6.249
622 1HG MET 86 HG2 MET 86 64.285 -5.145 -5.145
623 2HG MET 86 HG1 MET 86 64.851 -4.137 -4.137
624 1HE MET 86 HE1 MET 86 64.171 -2.362 -2.362
625 2HE MET 86 HE3 MET 86 62.639 -2.549 -2.549
626 3HE MET 86 HE2 MET 86 62.776 -1.385 -1.385
627 H LYS 87 HN LYS 87 64.184 -8.491 -8.491
628 HA LYS 87 HA LYS 87 62.251 -10.216 -10.216
629 1HB LYS 87 HB2 LYS 87 64.453 -10.431 -10.431
630 2HB LYS 87 HB1 LYS 87 63.524 -11.877 -11.877
631 1HG LYS 87 HG2 LYS 87 61.821 -9.533 -9.533
632 2HG LYS 87 HG1 LYS 87 62.780 -9.922 -9.922
633 1HD LYS 87 HD2 LYS 87 61.877 -12.401 -12.401
634 2HD LYS 87 HD1 LYS 87 60.487 -11.324 -11.324
635 1HE LYS 87 HE2 LYS 87 61.087 -10.569 -10.569
636 2HE LYS 87 HE1 LYS 87 62.030 -12.072 -12.072
637 1HZ LYS 87 HZ1 LYS 87 60.036 -13.241 -13.241
638 2HZ LYS 87 HZ3 LYS 87 59.151 -11.803 -11.803
639 3HZ LYS 87 HZ2 LYS 87 59.803 -12.557 -12.557
640 H GLU 88 HN GLU 88 65.680 -10.075 -10.075
641 HA GLU 88 HA GLU 88 65.615 -12.657 -12.657
642 1HB GLU 88 HB2 GLU 88 67.436 -11.516 -11.516
643 2HB GLU 88 HB1 GLU 88 68.053 -10.968 -10.968
644 1HG GLU 88 HG2 GLU 88 67.282 -13.750 -13.750
645 2HG GLU 88 HG1 GLU 88 68.416 -13.509 -13.509
646 H ASP 89 HN ASP 89 66.132 -9.169 -9.169
647 HA ASP 89 HA ASP 89 66.710 -9.387 -9.387
648 1HB ASP 89 HB2 ASP 89 67.239 -7.558 -7.558
649 2HB ASP 89 HB1 ASP 89 65.659 -6.925 -6.925
650 H ALA 90 HN ALA 90 63.815 -9.025 -9.025
651 HA ALA 90 HA ALA 90 62.097 -8.224 -8.224
652 1HB ALA 90 HB1 ALA 90 62.030 -8.040 -8.040
653 2HB ALA 90 HB3 ALA 90 60.940 -9.401 -9.401
654 3HB ALA 90 HB2 ALA 90 60.612 -7.844 -7.844
Start of MODEL 39
1 1H ALA 1 HT1 ALA 1 64.540 -5.871 -5.871
2 2H ALA 1 HT3 ALA 1 65.319 -4.973 -4.973
3 3H ALA 1 HT2 ALA 1 66.227 -5.675 -5.675
4 HA ALA 1 HA ALA 1 65.748 -7.883 -7.883
5 1HB ALA 1 HB2 ALA 1 67.320 -5.906 -5.906
6 2HB ALA 1 HB1 ALA 1 66.472 -6.589 -6.589
7 3HB ALA 1 HB3 ALA 1 67.443 -7.631 -7.631
8 H SER 2 HN SER 2 65.333 -8.433 -8.433
9 HA SER 2 HA SER 2 62.386 -8.369 -8.369
10 1HB SER 2 HB2 SER 2 64.439 -10.101 -10.101
11 2HB SER 2 HB1 SER 2 63.821 -9.473 -9.473
12 HG SER 2 HG SER 2 62.750 -11.313 -11.313
13 H MET 3 HN MET 3 64.964 -6.472 -6.472
14 HA MET 3 HA MET 3 64.222 -5.644 -5.644
15 1HB MET 3 HB2 MET 3 65.569 -4.459 -4.459
16 2HB MET 3 HB1 MET 3 65.176 -3.377 -3.377
17 1HG MET 3 HG2 MET 3 66.942 -4.147 -4.147
18 2HG MET 3 HG1 MET 3 66.284 -5.783 -5.783
19 1HE MET 3 HE2 MET 3 67.570 -7.219 -7.219
20 2HE MET 3 HE1 MET 3 67.771 -7.786 -7.786
21 3HE MET 3 HE3 MET 3 69.176 -7.248 -7.248
22 H THR 4 HN THR 4 63.102 -4.310 -4.310
23 HA THR 4 HA THR 4 61.405 -2.274 -2.274
24 HB THR 4 HB THR 4 62.041 -2.953 -2.953
25 HG1 THR 4 HG1 THR 4 59.447 -2.299 -2.299
26 1HG2 THR 4 HG22 THR 4 59.865 -4.985 -4.985
27 2HG2 THR 4 HG21 THR 4 60.410 -4.559 -4.559
28 3HG2 THR 4 HG23 THR 4 61.531 -5.304 -5.304
29 H ASP 5 HN ASP 5 60.925 -5.761 -5.761
30 HA ASP 5 HA ASP 5 58.082 -5.503 -5.503
31 1HB ASP 5 HB2 ASP 5 59.566 -7.337 -7.337
32 2HB ASP 5 HB1 ASP 5 59.486 -8.097 -8.097
33 H GLN 6 HN GLN 6 61.191 -6.504 -6.504
34 HA GLN 6 HA GLN 6 60.159 -7.292 -7.292
35 1HB GLN 6 HB2 GLN 6 62.433 -7.729 -7.729
36 2HB GLN 6 HB1 GLN 6 62.865 -6.081 -6.081
37 1HG GLN 6 HG2 GLN 6 63.571 -7.071 -7.071
38 2HG GLN 6 HG1 GLN 6 61.861 -7.004 -7.004
39 1HE2 GLN 6 HE22 GLN 6 61.346 -10.526 -10.526
40 2HE2 GLN 6 HE21 GLN 6 60.569 -9.027 -9.027
41 H GLN 7 HN GLN 7 60.594 -4.190 -4.190
42 HA GLN 7 HA GLN 7 61.064 -2.562 -2.562
43 1HB GLN 7 HB2 GLN 7 60.126 -2.307 -2.307
44 2HB GLN 7 HB1 GLN 7 59.571 -1.024 -1.024
45 1HG GLN 7 HG2 GLN 7 61.686 -0.203 -0.203
46 2HG GLN 7 HG1 GLN 7 62.434 -1.796 -1.796
47 1HE2 GLN 7 HE22 GLN 7 63.386 -1.244 -1.244
48 2HE2 GLN 7 HE21 GLN 7 63.693 -2.005 -2.005
49 H ALA 8 HN ALA 8 58.013 -3.580 -3.580
50 HA ALA 8 HA ALA 8 56.265 -2.212 -2.212
51 1HB ALA 8 HB3 ALA 8 55.767 -3.127 -3.127
52 2HB ALA 8 HB2 ALA 8 55.771 -4.742 -4.742
53 3HB ALA 8 HB1 ALA 8 54.568 -3.558 -3.558
54 H GLU 9 HN GLU 9 56.902 -5.736 -5.736
55 HA GLU 9 HA GLU 9 55.709 -6.521 -6.521
56 1HB GLU 9 HB2 GLU 9 56.760 -7.835 -7.835
57 2HB GLU 9 HB1 GLU 9 58.265 -7.714 -7.714
58 1HG GLU 9 HG2 GLU 9 57.188 -8.780 -8.780
59 2HG GLU 9 HG1 GLU 9 55.672 -8.891 -8.891
60 H ALA 10 HN ALA 10 58.648 -4.756 -4.756
61 HA ALA 10 HA ALA 10 59.944 -5.422 -5.422
62 1HB ALA 10 HB2 ALA 10 60.270 -3.522 -3.522
63 2HB ALA 10 HB1 ALA 10 61.105 -3.132 -3.132
64 3HB ALA 10 HB3 ALA 10 61.432 -4.659 -4.659
65 H ARG 11 HN ARG 11 58.650 -2.275 -2.275
66 HA ARG 11 HA ARG 11 58.422 -1.184 -1.184
67 1HB ARG 11 HB2 ARG 11 57.369 0.656 0.656
68 2HB ARG 11 HB1 ARG 11 58.664 0.032 0.032
69 1HG ARG 11 HG2 ARG 11 56.529 -1.537 -1.537
70 2HG ARG 11 HG1 ARG 11 55.757 0.019 0.019
71 1HD ARG 11 HD2 ARG 11 58.308 0.139 0.139
72 2HD ARG 11 HD1 ARG 11 56.928 -0.585 -0.585
73 HE ARG 11 HE ARG 11 56.148 1.822 1.822
74 1HH1 ARG 11 HH2 ARG 11 58.687 2.051 2.051
75 2HH1 ARG 11 HH2 ARG 11 57.908 2.783 2.783
76 1HH2 ARG 11 HH1 ARG 11 54.702 2.144 2.144
77 2HH2 ARG 11 HH1 ARG 11 55.651 2.837 2.837
78 H ALA 12 HN ALA 12 56.306 -3.132 -3.132
79 HA ALA 12 HA ALA 12 53.845 -2.499 -2.499
80 1HB ALA 12 HB2 ALA 12 54.317 -3.447 -3.447
81 2HB ALA 12 HB1 ALA 12 54.394 -5.006 -5.006
82 3HB ALA 12 HB3 ALA 12 52.916 -4.047 -4.047
83 H PHE 13 HN PHE 13 56.564 -4.059 -4.059
84 HA PHE 13 HA PHE 13 55.374 -6.385 -6.385
85 1HB PHE 13 HB2 PHE 13 57.640 -6.623 -6.623
86 2HB PHE 13 HB1 PHE 13 58.013 -4.951 -4.951
87 HD1 PHE 13 HD1 PHE 13 56.932 -8.197 -8.197
88 HD2 PHE 13 HD2 PHE 13 58.915 -4.432 -4.432
89 HE1 PHE 13 HE1 PHE 13 57.632 -8.909 -8.909
90 HE2 PHE 13 HE2 PHE 13 59.610 -5.138 -5.138
91 HZ PHE 13 HZ PHE 13 58.972 -7.380 -7.380
92 H LEU 14 HN LEU 14 55.513 -3.027 -3.027
93 HA LEU 14 HA LEU 14 54.668 -3.575 -3.575
94 1HB LEU 14 HB2 LEU 14 55.877 -1.359 -1.359
95 2HB LEU 14 HB1 LEU 14 56.888 -2.760 -2.760
96 HG LEU 14 HG LEU 14 57.563 -0.587 -0.587
97 HD1 LEU 14 HD1 LEU 14 57.531 -3.274 -3.274
98 HD1 LEU 14 HD1 LEU 14 58.694 -2.003 -2.003
99 HD1 LEU 14 HD1 LEU 14 57.267 -2.216 -2.216
100 HD2 LEU 14 HD2 LEU 14 56.343 0.054 0.054
101 HD2 LEU 14 HD2 LEU 14 55.250 0.098 0.098
102 HD2 LEU 14 HD2 LEU 14 55.183 -1.248 -1.248
103 H SER 15 HN SER 15 53.744 -1.278 -1.278
104 HA SER 15 HA SER 15 51.484 -0.657 -0.657
105 1HB SER 15 HB2 SER 15 52.030 -0.798 -0.798
106 2HB SER 15 HB1 SER 15 51.524 0.850 0.850
107 HG SER 15 HG SER 15 49.595 0.145 0.145
108 H GLU 16 HN GLU 16 50.834 1.786 1.786
109 HA GLU 16 HA GLU 16 52.792 3.310 3.310
110 1HB GLU 16 HB2 GLU 16 50.351 3.628 3.628
111 2HB GLU 16 HB1 GLU 16 50.329 4.160 4.160
112 1HG GLU 16 HG2 GLU 16 50.646 6.254 6.254
113 2HG GLU 16 HG1 GLU 16 52.285 5.753 5.753
114 H GLU 17 HN GLU 17 52.118 3.004 3.004
115 HA GLU 17 HA GLU 17 53.394 5.384 5.384
116 1HB GLU 17 HB2 GLU 17 52.936 2.617 2.617
117 2HB GLU 17 HB1 GLU 17 53.624 3.930 3.930
118 1HG GLU 17 HG2 GLU 17 51.531 5.266 5.266
119 2HG GLU 17 HG1 GLU 17 50.858 3.648 3.648
120 H MET 18 HN MET 18 54.721 2.046 2.046
121 HA MET 18 HA MET 18 57.353 2.524 2.524
122 1HB MET 18 HB2 MET 18 56.199 0.355 0.355
123 2HB MET 18 HB1 MET 18 56.470 0.778 0.778
124 1HG MET 18 HG2 MET 18 58.642 0.173 0.173
125 2HG MET 18 HG1 MET 18 58.893 1.062 1.062
126 1HE MET 18 HE3 MET 18 58.190 0.473 0.473
127 2HE MET 18 HE2 MET 18 58.217 -1.147 -1.147
128 3HE MET 18 HE1 MET 18 59.700 -0.447 -0.447
129 H ILE 19 HN ILE 19 56.177 2.597 2.597
130 HA ILE 19 HA ILE 19 58.439 3.455 3.455
131 HB ILE 19 HB ILE 19 55.514 4.176 4.176
132 1HG1 ILE 19 HG12 ILE 19 57.120 2.695 2.695
133 2HG1 ILE 19 HG11 ILE 19 56.730 1.866 1.866
134 1HG2 ILE 19 HG23 ILE 19 57.837 5.318 5.318
135 2HG2 ILE 19 HG22 ILE 19 56.457 4.825 4.825
136 3HG2 ILE 19 HG21 ILE 19 56.246 6.014 6.014
137 HD1 ILE 19 HD1 ILE 19 55.005 1.474 1.474
138 HD1 ILE 19 HD1 ILE 19 54.706 3.211 3.211
139 HD1 ILE 19 HD1 ILE 19 54.344 2.312 2.312
140 H ALA 20 HN ALA 20 56.209 5.496 5.496
141 HA ALA 20 HA ALA 20 57.594 7.981 7.981
142 1HB ALA 20 HB1 ALA 20 55.709 7.093 7.093
143 2HB ALA 20 HB3 ALA 20 56.137 8.768 8.768
144 3HB ALA 20 HB2 ALA 20 55.237 7.828 7.828
145 H GLU 21 HN GLU 21 57.936 5.430 5.430
146 HA GLU 21 HA GLU 21 59.531 6.877 6.877
147 1HB GLU 21 HB2 GLU 21 58.502 4.831 4.831
148 2HB GLU 21 HB1 GLU 21 59.145 3.973 3.973
149 1HG GLU 21 HG2 GLU 21 61.145 3.584 3.584
150 2HG GLU 21 HG1 GLU 21 61.206 5.198 5.198
151 H PHE 22 HN PHE 22 60.398 4.823 4.823
152 HA PHE 22 HA PHE 22 63.263 5.153 5.153
153 1HB PHE 22 HB2 PHE 22 61.665 4.324 4.324
154 2HB PHE 22 HB1 PHE 22 63.358 3.952 3.952
155 HD1 PHE 22 HD2 PHE 22 62.549 3.647 3.647
156 HD2 PHE 22 HD1 PHE 22 61.311 1.830 1.830
157 HE1 PHE 22 HE2 PHE 22 61.867 1.607 1.607
158 HE2 PHE 22 HE1 PHE 22 60.630 -0.212 -0.212
159 HZ PHE 22 HZ PHE 22 60.907 -0.321 -0.321
160 H LYS 23 HN LYS 23 60.750 7.000 7.000
161 HA LYS 23 HA LYS 23 62.252 8.406 8.406
162 1HB LYS 23 HB2 LYS 23 59.686 8.277 8.277
163 2HB LYS 23 HB1 LYS 23 60.105 9.740 9.740
164 1HG LYS 23 HG2 LYS 23 59.288 10.307 10.307
165 2HG LYS 23 HG1 LYS 23 60.987 10.752 10.752
166 1HD LYS 23 HD2 LYS 23 61.724 9.058 9.058
167 2HD LYS 23 HD1 LYS 23 60.338 8.024 8.024
168 1HE LYS 23 HE2 LYS 23 60.312 9.028 9.028
169 2HE LYS 23 HE1 LYS 23 58.879 9.430 9.430
170 1HZ LYS 23 HZ2 LYS 23 61.222 11.153 11.153
171 2HZ LYS 23 HZ1 LYS 23 60.333 11.295 11.295
172 3HZ LYS 23 HZ3 LYS 23 59.571 11.552 11.552
173 H ALA 24 HN ALA 24 61.258 9.687 9.687
174 HA ALA 24 HA ALA 24 62.909 11.948 11.948
175 1HB ALA 24 HB3 ALA 24 61.331 10.336 10.336
176 2HB ALA 24 HB2 ALA 24 62.828 10.779 10.779
177 3HB ALA 24 HB1 ALA 24 61.773 12.034 12.034
178 H ALA 25 HN ALA 25 63.806 8.595 8.595
179 HA ALA 25 HA ALA 25 66.476 9.247 9.247
180 1HB ALA 25 HB3 ALA 25 64.670 7.130 7.130
181 2HB ALA 25 HB2 ALA 25 65.950 6.498 6.498
182 3HB ALA 25 HB1 ALA 25 66.340 7.114 7.114
183 H PHE 26 HN PHE 26 64.970 8.107 8.107
184 HA PHE 26 HA PHE 26 67.388 7.436 7.436
185 1HB PHE 26 HB2 PHE 26 65.030 6.797 6.797
186 2HB PHE 26 HB1 PHE 26 64.740 8.467 8.467
187 HD1 PHE 26 HD1 PHE 26 66.711 5.410 5.410
188 HD2 PHE 26 HD2 PHE 26 65.583 9.331 9.331
189 HE1 PHE 26 HE1 PHE 26 67.697 4.932 4.932
190 HE2 PHE 26 HE2 PHE 26 66.568 8.852 8.852
191 HZ PHE 26 HZ PHE 26 67.625 6.653 6.653
192 H ASP 27 HN ASP 27 65.682 10.481 10.481
193 HA ASP 27 HA ASP 27 67.079 12.018 12.018
194 1HB ASP 27 HB2 ASP 27 65.686 12.797 12.797
195 2HB ASP 27 HB1 ASP 27 66.104 13.911 13.911
196 H MET 28 HN MET 28 68.197 10.584 10.584
197 HA MET 28 HA MET 28 69.856 12.544 12.544
198 1HB MET 28 HB2 MET 28 69.990 9.548 9.548
199 2HB MET 28 HB1 MET 28 71.208 10.414 10.414
200 1HG MET 28 HG2 MET 28 68.459 11.188 11.188
201 2HG MET 28 HG1 MET 28 68.803 9.487 9.487
202 1HE MET 28 HE3 MET 28 69.942 13.061 13.061
203 2HE MET 28 HE2 MET 28 71.120 13.114 13.114
204 3HE MET 28 HE1 MET 28 71.559 12.383 12.383
205 H PHE 29 HN PHE 29 70.202 10.822 10.822
206 HA PHE 29 HA PHE 29 72.895 12.099 12.099
207 1HB PHE 29 HB2 PHE 29 71.999 9.562 9.562
208 2HB PHE 29 HB1 PHE 29 73.641 10.110 10.110
209 HD1 PHE 29 HD2 PHE 29 70.586 8.631 8.631
210 HD2 PHE 29 HD1 PHE 29 74.667 9.759 9.759
211 HE1 PHE 29 HE2 PHE 29 70.567 7.352 7.352
212 HE2 PHE 29 HE1 PHE 29 74.649 8.477 8.477
213 HZ PHE 29 HZ PHE 29 72.599 7.272 7.272
214 H ASP 30 HN ASP 30 69.907 12.701 12.701
215 HA ASP 30 HA ASP 30 69.690 12.529 12.529
216 1HB ASP 30 HB2 ASP 30 67.730 12.908 12.908
217 2HB ASP 30 HB1 ASP 30 68.476 14.205 14.205
218 H ALA 31 HN ALA 31 71.812 13.233 13.233
219 HA ALA 31 HA ALA 31 72.742 15.960 15.960
220 1HB ALA 31 HB1 ALA 31 73.955 13.660 13.660
221 2HB ALA 31 HB3 ALA 31 73.736 14.271 14.271
222 3HB ALA 31 HB2 ALA 31 74.651 15.214 15.214
223 H ASP 32 HN ASP 32 70.694 14.402 14.402
224 HA ASP 32 HA ASP 32 70.931 16.660 16.660
225 1HB ASP 32 HB2 ASP 32 70.509 13.907 13.907
226 2HB ASP 32 HB1 ASP 32 68.922 14.595 14.595
227 H GLY 33 HN GLY 33 68.513 15.106 15.106
228 1HA GLY 33 HA2 GLY 33 66.812 16.353 16.353
229 2HA GLY 33 HA1 GLY 33 66.989 17.653 17.653
230 H GLY 34 HN GLY 34 66.638 14.224 14.224
231 1HA GLY 34 HA2 GLY 34 63.925 14.842 14.842
232 2HA GLY 34 HA1 GLY 34 65.104 13.917 13.917
233 H GLY 35 HN GLY 35 65.965 11.913 11.913
234 1HA GLY 35 HA2 GLY 35 64.637 10.702 10.702
235 2HA GLY 35 HA1 GLY 35 63.756 10.231 10.231
236 H ASP 36 HN ASP 36 67.254 10.745 10.745
237 HA ASP 36 HA ASP 36 67.841 7.879 7.879
238 1HB ASP 36 HB2 ASP 36 68.963 8.081 8.081
239 2HB ASP 36 HB1 ASP 36 67.219 8.335 8.335
240 H ILE 37 HN ILE 37 69.746 7.633 7.633
241 HA ILE 37 HA ILE 37 71.504 10.022 10.022
242 HB ILE 37 HB ILE 37 72.262 8.862 8.862
243 1HG1 ILE 37 HG12 ILE 37 70.649 6.523 6.523
244 2HG1 ILE 37 HG11 ILE 37 72.407 6.599 6.599
245 1HG2 ILE 37 HG23 ILE 37 70.047 9.997 9.997
246 2HG2 ILE 37 HG22 ILE 37 69.271 8.468 8.468
247 3HG2 ILE 37 HG21 ILE 37 70.145 8.629 8.629
248 HD1 ILE 37 HD1 ILE 37 71.105 7.262 7.262
249 HD1 ILE 37 HD1 ILE 37 72.334 6.041 6.041
250 HD1 ILE 37 HD1 ILE 37 70.628 5.663 5.663
251 H SER 38 HN SER 38 73.943 9.157 9.157
252 HA SER 38 HA SER 38 74.907 8.254 8.254
253 1HB SER 38 HB2 SER 38 76.048 9.602 9.602
254 2HB SER 38 HB1 SER 38 76.326 8.062 8.062
255 HG SER 38 HG SER 38 78.086 8.634 8.634
256 H THR 39 HN THR 39 75.200 6.196 6.196
257 HA THR 39 HA THR 39 74.061 3.885 3.885
258 HB THR 39 HB THR 39 75.953 2.788 2.788
259 HG1 THR 39 HG1 THR 39 76.231 5.394 5.394
260 1HG2 THR 39 HG23 THR 39 73.744 4.623 4.623
261 2HG2 THR 39 HG22 THR 39 74.841 4.043 4.043
262 3HG2 THR 39 HG21 THR 39 73.927 2.892 2.892
263 H LYS 40 HN LYS 40 77.179 5.340 5.340
264 HA LYS 40 HA LYS 40 78.206 3.029 3.029
265 1HB LYS 40 HB2 LYS 40 79.355 5.110 5.110
266 2HB LYS 40 HB1 LYS 40 79.101 5.865 5.865
267 1HG LYS 40 HG2 LYS 40 80.276 3.971 3.971
268 2HG LYS 40 HG1 LYS 40 80.569 3.260 3.260
269 1HD LYS 40 HD2 LYS 40 82.555 4.426 4.426
270 2HD LYS 40 HD1 LYS 40 81.597 5.634 5.634
271 1HE LYS 40 HE2 LYS 40 80.821 6.376 6.376
272 2HE LYS 40 HE1 LYS 40 82.268 5.506 5.506
273 1HZ LYS 40 HZ1 LYS 40 82.384 7.383 7.383
274 2HZ LYS 40 HZ3 LYS 40 82.544 7.944 7.944
275 3HZ LYS 40 HZ2 LYS 40 83.655 6.818 6.818
276 H GLU 41 HN GLU 41 75.801 5.298 5.298
277 HA GLU 41 HA GLU 41 76.251 5.119 5.119
278 1HB GLU 41 HB2 GLU 41 76.084 7.351 7.351
279 2HB GLU 41 HB1 GLU 41 74.434 6.932 6.932
280 1HG GLU 41 HG2 GLU 41 73.914 7.972 7.972
281 2HG GLU 41 HG1 GLU 41 74.324 6.402 6.402
282 H LEU 42 HN LEU 42 74.634 3.497 3.497
283 HA LEU 42 HA LEU 42 71.945 3.329 3.329
284 1HB LEU 42 HB2 LEU 42 72.351 2.705 2.705
285 2HB LEU 42 HB1 LEU 42 73.710 1.674 1.674
286 HG LEU 42 HG LEU 42 71.201 0.900 0.900
287 HD1 LEU 42 HD1 LEU 42 71.189 0.036 0.036
288 HD1 LEU 42 HD1 LEU 42 70.857 1.754 1.754
289 HD1 LEU 42 HD1 LEU 42 69.848 0.554 0.554
290 HD2 LEU 42 HD2 LEU 42 73.007 -0.618 -0.618
291 HD2 LEU 42 HD2 LEU 42 73.422 -0.403 -0.403
292 HD2 LEU 42 HD2 LEU 42 71.977 -1.311 -1.311
293 H GLY 43 HN GLY 43 74.948 2.009 2.009
294 1HA GLY 43 HA2 GLY 43 73.777 -0.322 -0.322
295 2HA GLY 43 HA1 GLY 43 75.449 0.222 0.222
296 H THR 44 HN THR 44 74.943 2.908 2.908
297 HA THR 44 HA THR 44 74.553 2.548 2.548
298 HB THR 44 HB THR 44 74.831 4.885 4.885
299 HG1 THR 44 HG1 THR 44 76.847 4.908 4.908
300 1HG2 THR 44 HG23 THR 44 73.378 5.554 5.554
301 2HG2 THR 44 HG22 THR 44 74.644 5.026 5.026
302 3HG2 THR 44 HG21 THR 44 74.938 6.377 6.377
303 H VAL 45 HN VAL 45 72.546 4.045 4.045
304 HA VAL 45 HA VAL 45 70.416 4.984 4.984
305 HB VAL 45 HB VAL 45 70.699 5.438 5.438
306 1HG1 VAL 45 HG11 VAL 45 71.566 3.080 3.080
307 2HG1 VAL 45 HG13 VAL 45 69.877 2.574 2.574
308 3HG1 VAL 45 HG12 VAL 45 70.479 3.758 3.758
309 1HG2 VAL 45 HG22 VAL 45 68.182 4.056 4.056
310 2HG2 VAL 45 HG21 VAL 45 68.453 5.770 5.770
311 3HG2 VAL 45 HG23 VAL 45 68.321 4.635 4.635
312 H MET 46 HN MET 46 70.817 1.729 1.729
313 HA MET 46 HA MET 46 68.369 0.733 0.733
314 1HB MET 46 HB2 MET 46 68.902 -1.264 -1.264
315 2HB MET 46 HB1 MET 46 69.442 0.056 0.056
316 1HG MET 46 HG2 MET 46 71.459 -0.955 -0.955
317 2HG MET 46 HG1 MET 46 71.637 -0.442 -0.442
318 1HE MET 46 HE2 MET 46 69.719 -2.615 -2.615
319 2HE MET 46 HE1 MET 46 70.123 -4.281 -4.281
320 3HE MET 46 HE3 MET 46 68.826 -3.446 -3.446
321 H ARG 47 HN ARG 47 71.760 0.898 0.898
322 HA ARG 47 HA ARG 47 71.636 -1.219 -1.219
323 1HB ARG 47 HB2 ARG 47 73.642 -0.615 -0.615
324 2HB ARG 47 HB1 ARG 47 73.701 0.938 0.938
325 1HG ARG 47 HG2 ARG 47 73.753 -0.442 -0.442
326 2HG ARG 47 HG1 ARG 47 74.139 -1.820 -1.820
327 1HD ARG 47 HD2 ARG 47 75.804 0.383 0.383
328 2HD ARG 47 HD1 ARG 47 75.937 0.170 0.170
329 HE ARG 47 HE ARG 47 76.000 -2.336 -2.336
330 1HH1 ARG 47 HH1 ARG 47 77.303 -1.810 -1.810
331 2HH1 ARG 47 HH1 ARG 47 78.980 -1.774 -1.774
332 1HH2 ARG 47 HH2 ARG 47 78.368 -1.391 -1.391
333 2HH2 ARG 47 HH2 ARG 47 79.583 -1.538 -1.538
334 H MET 48 HN MET 48 71.843 2.359 2.359
335 HA MET 48 HA MET 48 71.707 2.549 2.549
336 1HB MET 48 HB2 MET 48 72.800 4.213 4.213
337 2HB MET 48 HB1 MET 48 71.256 4.556 4.556
338 1HG MET 48 HG2 MET 48 71.804 6.231 6.231
339 2HG MET 48 HG1 MET 48 70.323 5.347 5.347
340 1HE MET 48 HE3 MET 48 71.502 6.921 6.921
341 2HE MET 48 HE2 MET 48 70.213 5.759 5.759
342 3HE MET 48 HE1 MET 48 71.623 5.799 5.799
343 H LEU 49 HN LEU 49 69.402 1.613 1.613
344 HA LEU 49 HA LEU 49 67.135 3.111 3.111
345 1HB LEU 49 HB2 LEU 49 67.676 1.269 1.269
346 2HB LEU 49 HB1 LEU 49 66.023 1.329 1.329
347 HG LEU 49 HG LEU 49 67.622 3.792 3.792
348 HD1 LEU 49 HD1 LEU 49 66.679 3.763 3.763
349 HD1 LEU 49 HD1 LEU 49 65.355 2.705 2.705
350 HD1 LEU 49 HD1 LEU 49 66.976 2.045 2.045
351 HD2 LEU 49 HD2 LEU 49 64.738 3.986 3.986
352 HD2 LEU 49 HD2 LEU 49 65.868 4.931 4.931
353 HD2 LEU 49 HD2 LEU 49 65.236 3.406 3.406
354 H GLY 50 HN GLY 50 68.815 0.130 0.130
355 1HA GLY 50 HA2 GLY 50 68.042 -0.813 -0.813
356 2HA GLY 50 HA1 GLY 50 66.494 -1.008 -1.008
357 H GLN 51 HN GLN 51 68.683 -1.495 -1.495
358 HA GLN 51 HA GLN 51 68.634 -4.457 -4.457
359 1HB GLN 51 HB2 GLN 51 69.097 -2.895 -2.895
360 2HB GLN 51 HB1 GLN 51 68.625 -4.587 -4.587
361 1HG GLN 51 HG2 GLN 51 66.450 -4.026 -4.026
362 2HG GLN 51 HG1 GLN 51 66.746 -2.916 -2.916
363 1HE2 GLN 51 HE22 GLN 51 66.459 -0.062 -0.062
364 2HE2 GLN 51 HE21 GLN 51 66.518 -0.714 -0.714
365 H ASN 52 HN ASN 52 70.605 -5.236 -5.236
366 HA ASN 52 HA ASN 52 73.089 -3.735 -3.735
367 1HB ASN 52 HB2 ASN 52 74.083 -5.572 -5.572
368 2HB ASN 52 HB1 ASN 52 72.665 -4.894 -4.894
369 HD2 ASN 52 HD2 ASN 52 74.062 -7.814 -7.814
370 HD2 ASN 52 HD2 ASN 52 72.676 -8.790 -8.790
371 HA PRO 53 HA PRO 53 73.230 -6.222 -6.222
372 1HB PRO 53 HB2 PRO 53 74.677 -4.391 -4.391
373 2HB PRO 53 HB1 PRO 53 72.915 -4.290 -4.290
374 1HG PRO 53 HG2 PRO 53 75.053 -2.771 -2.771
375 2HG PRO 53 HG1 PRO 53 73.445 -2.244 -2.244
376 1HD PRO 53 HD2 PRO 53 74.117 -2.911 -2.911
377 2HD PRO 53 HD1 PRO 53 72.465 -2.940 -2.940
378 H THR 54 HN THR 54 74.977 -7.514 -7.514
379 HA THR 54 HA THR 54 77.395 -7.506 -7.506
380 HB THR 54 HB THR 54 77.850 -9.578 -9.578
381 HG1 THR 54 HG1 THR 54 76.524 -10.139 -10.139
382 1HG2 THR 54 HG23 THR 54 75.546 -9.046 -9.046
383 2HG2 THR 54 HG22 THR 54 75.013 -10.067 -10.067
384 3HG2 THR 54 HG21 THR 54 76.310 -10.611 -10.611
385 H LYS 55 HN LYS 55 79.444 -6.841 -6.841
386 HA LYS 55 HA LYS 55 79.877 -4.849 -4.849
387 1HB LYS 55 HB2 LYS 55 81.479 -5.819 -5.819
388 2HB LYS 55 HB1 LYS 55 81.756 -7.162 -7.162
389 1HG LYS 55 HG2 LYS 55 83.059 -5.913 -5.913
390 2HG LYS 55 HG1 LYS 55 82.003 -4.507 -4.507
391 1HD LYS 55 HD2 LYS 55 83.877 -3.719 -3.719
392 2HD LYS 55 HD1 LYS 55 82.972 -4.411 -4.411
393 1HE LYS 55 HE2 LYS 55 84.453 -6.152 -6.152
394 2HE LYS 55 HE1 LYS 55 84.785 -6.270 -6.270
395 1HZ LYS 55 HZ3 LYS 55 85.934 -4.108 -4.108
396 2HZ LYS 55 HZ2 LYS 55 85.732 -4.143 -4.143
397 3HZ LYS 55 HZ1 LYS 55 86.691 -5.317 -5.317
398 H GLU 56 HN GLU 56 79.902 -8.360 -8.360
399 HA GLU 56 HA GLU 56 80.723 -8.244 -8.244
400 1HB GLU 56 HB2 GLU 56 80.463 -10.209 -10.209
401 2HB GLU 56 HB1 GLU 56 78.774 -10.236 -10.236
402 1HG GLU 56 HG2 GLU 56 79.457 -10.545 -10.545
403 2HG GLU 56 HG1 GLU 56 81.156 -10.447 -10.447
404 H GLU 57 HN GLU 57 77.394 -8.773 -8.773
405 HA GLU 57 HA GLU 57 75.968 -8.474 -8.474
406 1HB GLU 57 HB2 GLU 57 75.513 -7.997 -7.997
407 2HB GLU 57 HB1 GLU 57 74.339 -7.261 -7.261
408 1HG GLU 57 HG2 GLU 57 75.151 -10.138 -10.138
409 2HG GLU 57 HG1 GLU 57 73.914 -9.700 -9.700
410 H LEU 58 HN LEU 58 77.205 -5.909 -5.909
411 HA LEU 58 HA LEU 58 76.050 -3.628 -3.628
412 1HB LEU 58 HB2 LEU 58 78.186 -4.341 -4.341
413 2HB LEU 58 HB1 LEU 58 78.868 -3.241 -3.241
414 HG LEU 58 HG LEU 58 78.002 -1.958 -1.958
415 HD1 LEU 58 HD1 LEU 58 76.044 -1.683 -1.683
416 HD1 LEU 58 HD1 LEU 58 77.723 -1.155 -1.155
417 HD1 LEU 58 HD1 LEU 58 76.643 -0.412 -0.412
418 HD2 LEU 58 HD2 LEU 58 75.445 -3.463 -3.463
419 HD2 LEU 58 HD2 LEU 58 75.490 -2.013 -2.013
420 HD2 LEU 58 HD2 LEU 58 76.355 -3.465 -3.465
421 H ASP 59 HN ASP 59 79.357 -4.702 -4.702
422 HA ASP 59 HA ASP 59 79.607 -3.207 -3.207
423 1HB ASP 59 HB2 ASP 59 81.484 -4.288 -4.288
424 2HB ASP 59 HB1 ASP 59 80.738 -5.877 -5.877
425 H ALA 60 HN ALA 60 77.808 -6.127 -6.127
426 HA ALA 60 HA ALA 60 77.576 -6.944 -6.944
427 1HB ALA 60 HB1 ALA 60 77.307 -8.154 -8.154
428 2HB ALA 60 HB3 ALA 60 75.614 -7.813 -7.813
429 3HB ALA 60 HB2 ALA 60 76.570 -8.786 -8.786
430 H ILE 61 HN ILE 61 75.350 -5.466 -5.466
431 HA ILE 61 HA ILE 61 73.169 -5.085 -5.085
432 HB ILE 61 HB ILE 61 74.039 -3.771 -3.771
433 1HG1 ILE 61 HG12 ILE 61 71.579 -5.376 -5.376
434 2HG1 ILE 61 HG11 ILE 61 73.031 -6.290 -6.290
435 1HG2 ILE 61 HG23 ILE 61 71.769 -3.177 -3.177
436 2HG2 ILE 61 HG22 ILE 61 71.392 -3.261 -3.261
437 3HG2 ILE 61 HG21 ILE 61 72.602 -2.118 -2.118
438 HD1 ILE 61 HD1 ILE 61 73.876 -6.151 -6.151
439 HD1 ILE 61 HD1 ILE 61 72.194 -5.860 -5.860
440 HD1 ILE 61 HD1 ILE 61 73.298 -4.501 -4.501
441 H ILE 62 HN ILE 62 75.838 -2.944 -2.944
442 HA ILE 62 HA ILE 62 75.097 -0.566 -0.566
443 HB ILE 62 HB ILE 62 77.759 -1.919 -1.919
444 1HG1 ILE 62 HG12 ILE 62 76.281 0.349 0.349
445 2HG1 ILE 62 HG11 ILE 62 76.458 -1.294 -1.294
446 1HG2 ILE 62 HG23 ILE 62 77.140 0.843 0.843
447 2HG2 ILE 62 HG22 ILE 62 78.675 0.446 0.446
448 3HG2 ILE 62 HG21 ILE 62 78.194 -0.380 -0.380
449 HD1 ILE 62 HD1 ILE 62 78.609 0.793 0.793
450 HD1 ILE 62 HD1 ILE 62 78.993 -0.917 -0.917
451 HD1 ILE 62 HD1 ILE 62 78.155 -0.041 -0.041
452 H GLU 63 HN GLU 63 77.633 -2.674 -2.674
453 HA GLU 63 HA GLU 63 77.609 -1.796 -1.796
454 1HB GLU 63 HB2 GLU 63 78.826 -3.758 -3.758
455 2HB GLU 63 HB1 GLU 63 77.656 -4.746 -4.746
456 1HG GLU 63 HG2 GLU 63 78.442 -3.396 -3.396
457 2HG GLU 63 HG1 GLU 63 79.847 -3.001 -3.001
458 H GLU 64 HN GLU 64 75.205 -3.811 -3.811
459 HA GLU 64 HA GLU 64 73.795 -4.548 -4.548
460 1HB GLU 64 HB2 GLU 64 73.577 -6.049 -6.049
461 2HB GLU 64 HB1 GLU 64 73.381 -4.751 -4.751
462 1HG GLU 64 HG2 GLU 64 71.156 -4.249 -4.249
463 2HG GLU 64 HG1 GLU 64 71.351 -5.420 -5.420
464 H VAL 65 HN VAL 65 73.276 -2.221 -2.221
465 HA VAL 65 HA VAL 65 70.998 -1.002 -1.002
466 HB VAL 65 HB VAL 65 70.664 0.152 0.152
467 1HG1 VAL 65 HG13 VAL 65 71.297 -2.798 -2.798
468 2HG1 VAL 65 HG12 VAL 65 70.644 -1.938 -1.938
469 3HG1 VAL 65 HG11 VAL 65 69.717 -2.022 -2.022
470 1HG2 VAL 65 HG22 VAL 65 73.488 -0.624 -0.624
471 2HG2 VAL 65 HG21 VAL 65 72.598 0.714 0.714
472 3HG2 VAL 65 HG23 VAL 65 72.497 -0.899 -0.899
473 H ASP 66 HN ASP 66 74.212 -0.735 -0.735
474 HA ASP 66 HA ASP 66 74.717 2.095 2.095
475 1HB ASP 66 HB2 ASP 66 76.236 -0.083 -0.083
476 2HB ASP 66 HB1 ASP 66 76.172 0.372 0.372
477 H GLU 67 HN GLU 67 73.124 3.305 3.305
478 HA GLU 67 HA GLU 67 71.920 2.919 2.919
479 1HB GLU 67 HB2 GLU 67 72.877 5.234 5.234
480 2HB GLU 67 HB1 GLU 67 72.489 5.581 5.581
481 1HG GLU 67 HG2 GLU 67 70.455 3.871 3.871
482 2HG GLU 67 HG1 GLU 67 70.674 5.276 5.276
483 H ASP 68 HN ASP 68 72.857 2.259 2.259
484 HA ASP 68 HA ASP 68 75.631 2.570 2.570
485 1HB ASP 68 HB2 ASP 68 73.897 0.900 0.900
486 2HB ASP 68 HB1 ASP 68 73.301 2.191 2.191
487 H GLY 69 HN GLY 69 75.509 5.043 5.043
488 1HA GLY 69 HA2 GLY 69 76.044 6.629 6.629
489 2HA GLY 69 HA1 GLY 69 74.317 6.842 6.842
490 H SER 70 HN SER 70 74.246 6.752 6.752
491 HA SER 70 HA SER 70 75.821 9.207 9.207
492 1HB SER 70 HB2 SER 70 73.026 8.289 8.289
493 2HB SER 70 HB1 SER 70 73.734 9.110 9.110
494 HG SER 70 HG SER 70 72.873 10.672 10.672
495 H GLY 71 HN GLY 71 74.001 6.955 6.955
496 1HA GLY 71 HA2 GLY 71 75.473 5.169 5.169
497 2HA GLY 71 HA1 GLY 71 76.498 6.543 6.543
498 H THR 72 HN THR 72 72.944 6.386 6.386
499 HA THR 72 HA THR 72 72.978 6.864 6.864
500 HB THR 72 HB THR 72 71.243 8.528 8.528
501 HG1 THR 72 HG1 THR 72 71.426 7.717 7.717
502 1HG2 THR 72 HG21 THR 72 73.847 8.821 8.821
503 2HG2 THR 72 HG23 THR 72 72.978 9.327 9.327
504 3HG2 THR 72 HG22 THR 72 72.678 10.139 10.139
505 H ILE 73 HN ILE 73 71.034 6.098 6.098
506 HA ILE 73 HA ILE 73 69.737 3.816 3.816
507 HB ILE 73 HB ILE 73 71.010 3.504 3.504
508 1HG1 ILE 73 HG12 ILE 73 69.100 2.293 2.293
509 2HG1 ILE 73 HG11 ILE 73 68.033 2.948 2.948
510 1HG2 ILE 73 HG22 ILE 73 70.416 5.687 5.687
511 2HG2 ILE 73 HG21 ILE 73 68.738 5.161 5.161
512 3HG2 ILE 73 HG23 ILE 73 69.993 4.353 4.353
513 HD1 ILE 73 HD1 ILE 73 69.356 0.573 0.573
514 HD1 ILE 73 HD1 ILE 73 70.496 1.667 1.667
515 HD1 ILE 73 HD1 ILE 73 68.837 1.549 1.549
516 H ASP 74 HN ASP 74 67.497 3.792 3.792
517 HA ASP 74 HA ASP 74 66.055 6.322 6.322
518 1HB ASP 74 HB2 ASP 74 65.091 3.746 3.746
519 2HB ASP 74 HB1 ASP 74 64.444 5.369 5.369
520 H PHE 75 HN PHE 75 64.501 6.563 6.563
521 HA PHE 75 HA PHE 75 64.313 4.890 4.890
522 1HB PHE 75 HB2 PHE 75 63.469 7.286 7.286
523 2HB PHE 75 HB1 PHE 75 62.019 6.520 6.520
524 HD1 PHE 75 HD2 PHE 75 60.662 4.980 4.980
525 HD2 PHE 75 HD1 PHE 75 63.850 7.413 7.413
526 HE1 PHE 75 HE2 PHE 75 59.789 4.668 4.668
527 HE2 PHE 75 HE1 PHE 75 62.977 7.100 7.100
528 HZ PHE 75 HZ PHE 75 60.945 5.728 5.728
529 H GLU 76 HN GLU 76 62.122 4.979 4.979
530 HA GLU 76 HA GLU 76 60.316 2.958 2.958
531 1HB GLU 76 HB2 GLU 76 60.067 2.683 2.683
532 2HB GLU 76 HB1 GLU 76 60.054 4.369 4.369
533 1HG GLU 76 HG2 GLU 76 62.381 4.643 4.643
534 2HG GLU 76 HG1 GLU 76 62.526 2.922 2.922
535 H GLU 77 HN GLU 77 63.564 2.682 2.682
536 HA GLU 77 HA GLU 77 63.385 -0.262 -0.262
537 1HB GLU 77 HB2 GLU 77 64.540 1.002 1.002
538 2HB GLU 77 HB1 GLU 77 65.574 1.772 1.772
539 1HG GLU 77 HG2 GLU 77 66.813 -0.158 -0.158
540 2HG GLU 77 HG1 GLU 77 65.503 -1.221 -1.221
541 H PHE 78 HN PHE 78 65.420 2.140 2.140
542 HA PHE 78 HA PHE 78 66.922 0.457 0.457
543 1HB PHE 78 HB2 PHE 78 67.292 2.800 2.800
544 2HB PHE 78 HB1 PHE 78 65.598 3.141 3.141
545 HD1 PHE 78 HD1 PHE 78 68.437 1.154 1.154
546 HD2 PHE 78 HD2 PHE 78 65.062 3.707 3.707
547 HE1 PHE 78 HE1 PHE 78 68.929 1.104 1.104
548 HE2 PHE 78 HE2 PHE 78 65.553 3.657 3.657
549 HZ PHE 78 HZ PHE 78 67.487 2.356 2.356
550 H LEU 79 HN LEU 79 63.508 1.334 1.334
551 HA LEU 79 HA LEU 79 62.839 0.572 0.572
552 1HB LEU 79 HB2 LEU 79 61.589 0.496 0.496
553 2HB LEU 79 HB1 LEU 79 60.817 -0.531 -0.531
554 HG LEU 79 HG LEU 79 61.549 2.286 2.286
555 HD1 LEU 79 HD1 LEU 79 58.796 1.936 1.936
556 HD1 LEU 79 HD1 LEU 79 59.999 1.778 1.778
557 HD1 LEU 79 HD1 LEU 79 59.932 3.248 3.248
558 HD2 LEU 79 HD2 LEU 79 60.655 1.332 1.332
559 HD2 LEU 79 HD2 LEU 79 59.799 0.092 0.092
560 HD2 LEU 79 HD2 LEU 79 59.124 1.716 1.716
561 H VAL 80 HN VAL 80 63.708 -1.554 -1.554
562 HA VAL 80 HA VAL 80 62.935 -4.045 -4.045
563 HB VAL 80 HB VAL 80 64.263 -4.977 -4.977
564 1HG1 VAL 80 HG11 VAL 80 62.551 -2.749 -2.749
565 2HG1 VAL 80 HG13 VAL 80 63.893 -2.607 -2.607
566 3HG1 VAL 80 HG12 VAL 80 62.912 -4.072 -4.072
567 1HG2 VAL 80 HG22 VAL 80 65.745 -2.328 -2.328
568 2HG2 VAL 80 HG21 VAL 80 66.387 -3.900 -3.900
569 3HG2 VAL 80 HG23 VAL 80 65.989 -3.585 -3.585
570 H MET 81 HN MET 81 65.968 -2.179 -2.179
571 HA MET 81 HA MET 81 67.515 -4.086 -4.086
572 1HB MET 81 HB2 MET 81 67.545 -1.168 -1.168
573 2HB MET 81 HB1 MET 81 68.574 -1.708 -1.708
574 1HG MET 81 HG2 MET 81 68.578 -2.905 -2.905
575 2HG MET 81 HG1 MET 81 69.764 -1.748 -1.748
576 1HE MET 81 HE2 MET 81 70.998 -1.866 -1.866
577 2HE MET 81 HE1 MET 81 71.593 -3.274 -3.274
578 3HE MET 81 HE3 MET 81 72.212 -2.908 -2.908
579 H MET 82 HN MET 82 65.121 -1.692 -1.692
580 HA MET 82 HA MET 82 65.740 -1.671 -1.671
581 1HB MET 82 HB2 MET 82 63.137 -1.135 -1.135
582 2HB MET 82 HB1 MET 82 63.571 -0.540 -0.540
583 1HG MET 82 HG2 MET 82 65.713 0.250 0.250
584 2HG MET 82 HG1 MET 82 64.313 0.504 0.504
585 1HE MET 82 HE1 MET 82 62.602 1.704 1.704
586 2HE MET 82 HE3 MET 82 62.137 2.928 2.928
587 3HE MET 82 HE2 MET 82 63.385 3.282 3.282
588 H VAL 83 HN VAL 83 63.291 -3.433 -3.433
589 HA VAL 83 HA VAL 83 62.412 -4.986 -4.986
590 HB VAL 83 HB VAL 83 60.782 -5.828 -5.828
591 1HG1 VAL 83 HG11 VAL 83 61.146 -3.144 -3.144
592 2HG1 VAL 83 HG13 VAL 83 61.147 -3.257 -3.257
593 3HG1 VAL 83 HG12 VAL 83 59.764 -3.849 -3.849
594 1HG2 VAL 83 HG23 VAL 83 62.654 -4.897 -4.897
595 2HG2 VAL 83 HG22 VAL 83 62.328 -6.572 -6.572
596 3HG2 VAL 83 HG21 VAL 83 61.049 -5.583 -5.583
597 H ARG 84 HN ARG 84 64.241 -5.611 -5.611
598 HA ARG 84 HA ARG 84 64.613 -8.372 -8.372
599 1HB ARG 84 HB2 ARG 84 66.427 -6.085 -6.085
600 2HB ARG 84 HB1 ARG 84 66.885 -7.770 -7.770
601 1HG ARG 84 HG2 ARG 84 64.170 -6.941 -6.941
602 2HG ARG 84 HG1 ARG 84 65.549 -6.377 -6.377
603 1HD ARG 84 HD2 ARG 84 66.336 -8.881 -8.881
604 2HD ARG 84 HD1 ARG 84 64.626 -9.201 -9.201
605 HE ARG 84 HE ARG 84 64.044 -8.154 -8.154
606 1HH1 ARG 84 HH2 ARG 84 66.444 -6.381 -6.381
607 2HH1 ARG 84 HH2 ARG 84 67.345 -7.192 -7.192
608 1HH2 ARG 84 HH1 ARG 84 65.614 -10.178 -10.178
609 2HH2 ARG 84 HH1 ARG 84 66.875 -9.343 -9.343
610 H GLN 85 HN GLN 85 66.616 -5.871 -5.871
611 HA GLN 85 HA GLN 85 68.261 -7.795 -7.795
612 1HB GLN 85 HB2 GLN 85 68.768 -5.374 -5.374
613 2HB GLN 85 HB1 GLN 85 67.677 -4.906 -4.906
614 1HG GLN 85 HG2 GLN 85 69.999 -4.951 -4.951
615 2HG GLN 85 HG1 GLN 85 69.049 -6.208 -6.208
616 1HE2 GLN 85 HE22 GLN 85 71.380 -7.634 -7.634
617 2HE2 GLN 85 HE21 GLN 85 70.382 -6.286 -6.286
618 H MET 86 HN MET 86 65.802 -5.501 -5.501
619 HA MET 86 HA MET 86 65.580 -6.600 -6.600
620 1HB MET 86 HB2 MET 86 64.192 -4.765 -4.765
621 2HB MET 86 HB1 MET 86 63.022 -5.724 -5.724
622 1HG MET 86 HG2 MET 86 64.983 -5.087 -5.087
623 2HG MET 86 HG1 MET 86 64.790 -3.608 -3.608
624 1HE MET 86 HE3 MET 86 62.774 -2.589 -2.589
625 2HE MET 86 HE2 MET 86 61.544 -3.825 -3.825
626 3HE MET 86 HE1 MET 86 61.263 -2.537 -2.537
627 H LYS 87 HN LYS 87 64.227 -7.712 -7.712
628 HA LYS 87 HA LYS 87 62.140 -9.393 -9.393
629 1HB LYS 87 HB2 LYS 87 64.173 -9.276 -9.276
630 2HB LYS 87 HB1 LYS 87 63.431 -10.859 -10.859
631 1HG LYS 87 HG2 LYS 87 61.419 -8.785 -8.785
632 2HG LYS 87 HG1 LYS 87 62.333 -8.656 -8.656
633 1HD LYS 87 HD2 LYS 87 61.177 -11.265 -11.265
634 2HD LYS 87 HD1 LYS 87 60.323 -10.201 -10.201
635 1HE LYS 87 HE2 LYS 87 62.742 -10.372 -10.372
636 2HE LYS 87 HE1 LYS 87 62.641 -11.978 -11.978
637 1HZ LYS 87 HZ3 LYS 87 60.142 -11.683 -11.683
638 2HZ LYS 87 HZ2 LYS 87 60.929 -10.764 -10.764
639 3HZ LYS 87 HZ1 LYS 87 61.344 -12.395 -12.395
640 H GLU 88 HN GLU 88 65.565 -9.691 -9.691
641 HA GLU 88 HA GLU 88 65.283 -12.474 -12.474
642 1HB GLU 88 HB2 GLU 88 67.223 -11.035 -11.035
643 2HB GLU 88 HB1 GLU 88 67.891 -11.174 -11.174
644 1HG GLU 88 HG2 GLU 88 67.397 -13.637 -13.637
645 2HG GLU 88 HG1 GLU 88 66.928 -13.440 -13.440
646 H ASP 89 HN ASP 89 66.145 -9.179 -9.179
647 HA ASP 89 HA ASP 89 66.715 -9.905 -9.905
648 1HB ASP 89 HB2 ASP 89 67.317 -7.827 -7.827
649 2HB ASP 89 HB1 ASP 89 65.869 -7.160 -7.160
650 H ALA 90 HN ALA 90 63.865 -8.819 -8.819
651 HA ALA 90 HA ALA 90 62.233 -8.291 -8.291
652 1HB ALA 90 HB1 ALA 90 62.126 -7.644 -7.644
653 2HB ALA 90 HB3 ALA 90 61.044 -9.037 -9.037
654 3HB ALA 90 HB2 ALA 90 60.689 -7.657 -7.657
Start of MODEL 40
1 1H ALA 1 HT1 ALA 1 62.928 -3.161 -3.161
2 2H ALA 1 HT3 ALA 1 64.384 -2.680 -2.680
3 3H ALA 1 HT2 ALA 1 63.617 -4.110 -4.110
4 HA ALA 1 HA ALA 1 65.220 -4.999 -4.999
5 1HB ALA 1 HB3 ALA 1 64.816 -2.407 -2.407
6 2HB ALA 1 HB2 ALA 1 65.910 -3.680 -3.680
7 3HB ALA 1 HB1 ALA 1 66.202 -2.856 -2.856
8 H SER 2 HN SER 2 64.943 -6.370 -6.370
9 HA SER 2 HA SER 2 62.135 -6.724 -6.724
10 1HB SER 2 HB2 SER 2 64.692 -8.168 -8.168
11 2HB SER 2 HB1 SER 2 63.057 -8.754 -8.754
12 HG SER 2 HG SER 2 63.253 -9.584 -9.584
13 H MET 3 HN MET 3 64.811 -4.977 -4.977
14 HA MET 3 HA MET 3 64.591 -5.250 -5.250
15 1HB MET 3 HB2 MET 3 65.678 -3.397 -3.397
16 2HB MET 3 HB1 MET 3 65.210 -2.587 -2.587
17 1HG MET 3 HG2 MET 3 66.463 -4.834 -4.834
18 2HG MET 3 HG1 MET 3 67.404 -4.491 -4.491
19 1HE MET 3 HE1 MET 3 67.299 -4.239 -4.239
20 2HE MET 3 HE3 MET 3 67.659 -2.600 -2.600
21 3HE MET 3 HE2 MET 3 66.043 -3.004 -3.004
22 H THR 4 HN THR 4 62.743 -3.233 -3.233
23 HA THR 4 HA THR 4 61.322 -1.608 -1.608
24 HB THR 4 HB THR 4 61.383 -1.602 -1.602
25 HG1 THR 4 HG1 THR 4 59.810 -0.497 -0.497
26 1HG2 THR 4 HG23 THR 4 60.824 -4.013 -4.013
27 2HG2 THR 4 HG22 THR 4 59.210 -3.681 -3.681
28 3HG2 THR 4 HG21 THR 4 59.724 -2.972 -2.972
29 H ASP 5 HN ASP 5 61.068 -5.030 -5.030
30 HA ASP 5 HA ASP 5 58.373 -5.299 -5.299
31 1HB ASP 5 HB2 ASP 5 59.236 -6.800 -6.800
32 2HB ASP 5 HB1 ASP 5 60.566 -7.282 -7.282
33 H GLN 6 HN GLN 6 61.598 -6.521 -6.521
34 HA GLN 6 HA GLN 6 60.965 -7.394 -7.394
35 1HB GLN 6 HB2 GLN 6 63.329 -6.389 -6.389
36 2HB GLN 6 HB1 GLN 6 63.472 -6.330 -6.330
37 1HG GLN 6 HG2 GLN 6 64.090 -8.510 -8.510
38 2HG GLN 6 HG1 GLN 6 62.362 -8.810 -8.810
39 1HE2 GLN 6 HE22 GLN 6 63.454 -10.414 -10.414
40 2HE2 GLN 6 HE21 GLN 6 63.030 -10.699 -10.699
41 H GLN 7 HN GLN 7 61.114 -4.129 -4.129
42 HA GLN 7 HA GLN 7 61.406 -2.861 -2.861
43 1HB GLN 7 HB2 GLN 7 62.253 -1.780 -1.780
44 2HB GLN 7 HB1 GLN 7 60.688 -1.917 -1.917
45 1HG GLN 7 HG2 GLN 7 60.569 -0.544 -0.544
46 2HG GLN 7 HG1 GLN 7 61.548 0.296 0.296
47 1HE2 GLN 7 HE22 GLN 7 58.729 0.698 0.698
48 2HE2 GLN 7 HE21 GLN 7 60.381 0.310 0.310
49 H ALA 8 HN ALA 8 58.740 -3.428 -3.428
50 HA ALA 8 HA ALA 8 56.660 -2.026 -2.026
51 1HB ALA 8 HB3 ALA 8 57.043 -4.085 -4.085
52 2HB ALA 8 HB2 ALA 8 55.722 -4.586 -4.586
53 3HB ALA 8 HB1 ALA 8 55.635 -3.043 -3.043
54 H GLU 9 HN GLU 9 57.013 -5.563 -5.563
55 HA GLU 9 HA GLU 9 55.466 -5.632 -5.632
56 1HB GLU 9 HB2 GLU 9 56.747 -7.394 -7.394
57 2HB GLU 9 HB1 GLU 9 57.319 -7.821 -7.821
58 1HG GLU 9 HG2 GLU 9 55.136 -8.245 -8.245
59 2HG GLU 9 HG1 GLU 9 54.388 -7.359 -7.359
60 H ALA 10 HN ALA 10 58.653 -4.576 -4.576
61 HA ALA 10 HA ALA 10 59.933 -5.431 -5.431
62 1HB ALA 10 HB1 ALA 10 60.418 -3.729 -3.729
63 2HB ALA 10 HB3 ALA 10 61.101 -3.038 -3.038
64 3HB ALA 10 HB2 ALA 10 61.567 -4.658 -4.658
65 H ARG 11 HN ARG 11 57.865 -2.701 -2.701
66 HA ARG 11 HA ARG 11 58.280 -1.506 -1.506
67 1HB ARG 11 HB2 ARG 11 56.615 -0.315 -0.315
68 2HB ARG 11 HB1 ARG 11 57.571 0.507 0.507
69 1HG ARG 11 HG2 ARG 11 59.283 0.668 0.668
70 2HG ARG 11 HG1 ARG 11 59.357 -1.084 -1.084
71 1HD ARG 11 HD2 ARG 11 58.955 -0.333 -0.333
72 2HD ARG 11 HD1 ARG 11 57.357 -0.840 -0.840
73 HE ARG 11 HE ARG 11 58.072 1.975 1.975
74 1HH1 ARG 11 HH2 ARG 11 55.647 -0.121 -0.121
75 2HH1 ARG 11 HH2 ARG 11 54.927 0.908 0.908
76 1HH2 ARG 11 HH1 ARG 11 57.506 3.225 3.225
77 2HH2 ARG 11 HH1 ARG 11 55.980 2.802 2.802
78 H ALA 12 HN ALA 12 55.825 -2.875 -2.875
79 HA ALA 12 HA ALA 12 53.518 -2.267 -2.267
80 1HB ALA 12 HB1 ALA 12 54.233 -3.592 -3.592
81 2HB ALA 12 HB3 ALA 12 53.260 -4.722 -4.722
82 3HB ALA 12 HB2 ALA 12 52.617 -3.131 -3.131
83 H PHE 13 HN PHE 13 56.075 -4.547 -4.547
84 HA PHE 13 HA PHE 13 54.734 -6.672 -6.672
85 1HB PHE 13 HB2 PHE 13 56.908 -7.276 -7.276
86 2HB PHE 13 HB1 PHE 13 57.196 -6.334 -6.334
87 HD1 PHE 13 HD1 PHE 13 57.112 -3.603 -3.603
88 HD2 PHE 13 HD2 PHE 13 58.460 -6.851 -6.851
89 HE1 PHE 13 HE1 PHE 13 58.528 -2.033 -2.033
90 HE2 PHE 13 HE2 PHE 13 59.876 -5.281 -5.281
91 HZ PHE 13 HZ PHE 13 59.910 -2.870 -2.870
92 H LEU 14 HN LEU 14 55.094 -3.399 -3.399
93 HA LEU 14 HA LEU 14 54.192 -4.112 -4.112
94 1HB LEU 14 HB2 LEU 14 56.236 -2.139 -2.139
95 2HB LEU 14 HB1 LEU 14 55.469 -1.906 -1.906
96 HG LEU 14 HG LEU 14 57.092 -4.301 -4.301
97 HD1 LEU 14 HD1 LEU 14 58.689 -3.600 -3.600
98 HD1 LEU 14 HD1 LEU 14 57.540 -2.541 -2.541
99 HD1 LEU 14 HD1 LEU 14 58.179 -2.094 -2.094
100 HD2 LEU 14 HD2 LEU 14 55.271 -3.857 -3.857
101 HD2 LEU 14 HD2 LEU 14 56.670 -4.922 -4.922
102 HD2 LEU 14 HD2 LEU 14 55.411 -5.276 -5.276
103 H SER 15 HN SER 15 53.398 -1.758 -1.758
104 HA SER 15 HA SER 15 51.122 -1.018 -1.018
105 1HB SER 15 HB2 SER 15 51.175 0.559 0.559
106 2HB SER 15 HB1 SER 15 50.277 -0.938 -0.938
107 HG SER 15 HG SER 15 51.791 -2.021 -2.021
108 H GLU 16 HN GLU 16 50.618 1.391 1.391
109 HA GLU 16 HA GLU 16 52.758 2.767 2.767
110 1HB GLU 16 HB2 GLU 16 50.387 3.088 3.088
111 2HB GLU 16 HB1 GLU 16 50.093 3.687 3.687
112 1HG GLU 16 HG2 GLU 16 50.697 5.764 5.764
113 2HG GLU 16 HG1 GLU 16 52.257 5.172 5.172
114 H GLU 17 HN GLU 17 52.114 2.376 2.376
115 HA GLU 17 HA GLU 17 53.000 4.973 4.973
116 1HB GLU 17 HB2 GLU 17 51.543 3.282 3.282
117 2HB GLU 17 HB1 GLU 17 52.978 2.276 2.276
118 1HG GLU 17 HG2 GLU 17 53.342 5.082 5.082
119 2HG GLU 17 HG1 GLU 17 52.170 4.187 4.187
120 H MET 18 HN MET 18 54.562 1.740 1.740
121 HA MET 18 HA MET 18 57.109 2.532 2.532
122 1HB MET 18 HB2 MET 18 56.295 0.214 0.214
123 2HB MET 18 HB1 MET 18 56.325 0.403 0.403
124 1HG MET 18 HG2 MET 18 58.465 -0.302 -0.302
125 2HG MET 18 HG1 MET 18 58.874 1.206 1.206
126 1HE MET 18 HE3 MET 18 58.597 1.689 1.689
127 2HE MET 18 HE2 MET 18 57.419 0.722 0.722
128 3HE MET 18 HE1 MET 18 59.124 0.640 0.640
129 H ILE 19 HN ILE 19 55.865 2.408 2.408
130 HA ILE 19 HA ILE 19 58.146 3.018 3.018
131 HB ILE 19 HB ILE 19 55.266 3.923 3.923
132 1HG1 ILE 19 HG12 ILE 19 56.942 1.843 1.843
133 2HG1 ILE 19 HG11 ILE 19 55.669 1.524 1.524
134 1HG2 ILE 19 HG21 ILE 19 57.609 4.808 4.808
135 2HG2 ILE 19 HG23 ILE 19 56.353 4.107 4.107
136 3HG2 ILE 19 HG22 ILE 19 55.975 5.472 5.472
137 HD1 ILE 19 HD1 ILE 19 55.223 1.528 1.528
138 HD1 ILE 19 HD1 ILE 19 54.914 3.228 3.228
139 HD1 ILE 19 HD1 ILE 19 53.988 1.974 1.974
140 H ALA 20 HN ALA 20 56.015 5.343 5.343
141 HA ALA 20 HA ALA 20 57.504 7.693 7.693
142 1HB ALA 20 HB2 ALA 20 55.098 7.193 7.193
143 2HB ALA 20 HB1 ALA 20 55.981 7.524 7.524
144 3HB ALA 20 HB3 ALA 20 55.903 8.747 8.747
145 H GLU 21 HN GLU 21 57.752 5.407 5.407
146 HA GLU 21 HA GLU 21 59.467 6.896 6.896
147 1HB GLU 21 HB2 GLU 21 58.367 4.855 4.855
148 2HB GLU 21 HB1 GLU 21 59.165 3.937 3.937
149 1HG GLU 21 HG2 GLU 21 60.800 3.468 3.468
150 2HG GLU 21 HG1 GLU 21 61.252 5.172 5.172
151 H PHE 22 HN PHE 22 60.325 4.511 4.511
152 HA PHE 22 HA PHE 22 63.147 4.742 4.742
153 1HB PHE 22 HB2 PHE 22 61.366 4.226 4.226
154 2HB PHE 22 HB1 PHE 22 63.076 3.817 3.817
155 HD1 PHE 22 HD2 PHE 22 62.163 3.338 3.338
156 HD2 PHE 22 HD1 PHE 22 61.382 1.624 1.624
157 HE1 PHE 22 HE2 PHE 22 61.582 1.180 1.180
158 HE2 PHE 22 HE1 PHE 22 60.801 -0.533 -0.533
159 HZ PHE 22 HZ PHE 22 60.901 -0.754 -0.754
160 H LYS 23 HN LYS 23 60.816 6.630 6.630
161 HA LYS 23 HA LYS 23 62.423 8.160 8.160
162 1HB LYS 23 HB2 LYS 23 59.845 8.197 8.197
163 2HB LYS 23 HB1 LYS 23 60.428 9.632 9.632
164 1HG LYS 23 HG2 LYS 23 59.585 10.229 10.229
165 2HG LYS 23 HG1 LYS 23 61.321 10.518 10.518
166 1HD LYS 23 HD2 LYS 23 61.833 8.557 8.557
167 2HD LYS 23 HD1 LYS 23 60.199 7.920 7.920
168 1HE LYS 23 HE2 LYS 23 59.873 8.804 8.804
169 2HE LYS 23 HE1 LYS 23 59.712 10.343 10.343
170 1HZ LYS 23 HZ2 LYS 23 62.399 9.320 9.320
171 2HZ LYS 23 HZ1 LYS 23 61.518 10.074 10.074
172 3HZ LYS 23 HZ3 LYS 23 61.872 10.926 10.926
173 H ALA 24 HN ALA 24 61.486 9.422 9.422
174 HA ALA 24 HA ALA 24 63.309 11.493 11.493
175 1HB ALA 24 HB3 ALA 24 61.497 10.735 10.735
176 2HB ALA 24 HB2 ALA 24 62.611 9.498 9.498
177 3HB ALA 24 HB1 ALA 24 62.999 11.205 11.205
178 H ALA 25 HN ALA 25 63.919 8.108 8.108
179 HA ALA 25 HA ALA 25 66.614 8.403 8.403
180 1HB ALA 25 HB2 ALA 25 64.922 6.193 6.193
181 2HB ALA 25 HB1 ALA 25 66.628 5.905 5.905
182 3HB ALA 25 HB3 ALA 25 65.533 6.375 6.375
183 H PHE 26 HN PHE 26 65.324 7.529 7.529
184 HA PHE 26 HA PHE 26 67.901 7.397 7.397
185 1HB PHE 26 HB2 PHE 26 65.681 6.376 6.376
186 2HB PHE 26 HB1 PHE 26 65.189 7.990 7.990
187 HD1 PHE 26 HD1 PHE 26 66.290 9.106 9.106
188 HD2 PHE 26 HD2 PHE 26 67.403 5.138 5.138
189 HE1 PHE 26 HE1 PHE 26 67.505 8.793 8.793
190 HE2 PHE 26 HE2 PHE 26 68.619 4.825 4.825
191 HZ PHE 26 HZ PHE 26 68.670 6.653 6.653
192 H ASP 27 HN ASP 27 65.539 9.998 9.998
193 HA ASP 27 HA ASP 27 66.740 11.891 11.891
194 1HB ASP 27 HB2 ASP 27 64.489 11.655 11.655
195 2HB ASP 27 HB1 ASP 27 65.381 13.025 13.025
196 H MET 28 HN MET 28 67.904 10.593 10.593
197 HA MET 28 HA MET 28 69.106 12.921 12.921
198 1HB MET 28 HB2 MET 28 69.758 9.956 9.956
199 2HB MET 28 HB1 MET 28 70.422 11.152 11.152
200 1HG MET 28 HG2 MET 28 67.578 11.487 11.487
201 2HG MET 28 HG1 MET 28 67.931 9.783 9.783
202 1HE MET 28 HE1 MET 28 68.390 8.807 8.807
203 2HE MET 28 HE3 MET 28 68.241 9.665 9.665
204 3HE MET 28 HE2 MET 28 66.933 9.731 9.731
205 H PHE 29 HN PHE 29 69.996 10.861 10.861
206 HA PHE 29 HA PHE 29 72.608 12.332 12.332
207 1HB PHE 29 HB2 PHE 29 72.166 9.600 9.600
208 2HB PHE 29 HB1 PHE 29 73.658 10.323 10.323
209 HD1 PHE 29 HD1 PHE 29 74.176 10.360 10.360
210 HD2 PHE 29 HD2 PHE 29 70.560 8.576 8.576
211 HE1 PHE 29 HE1 PHE 29 73.825 9.255 9.255
212 HE2 PHE 29 HE2 PHE 29 70.207 7.472 7.472
213 HZ PHE 29 HZ PHE 29 71.840 7.811 7.811
214 H ASP 30 HN ASP 30 69.931 12.968 12.968
215 HA ASP 30 HA ASP 30 69.844 12.185 12.185
216 1HB ASP 30 HB2 ASP 30 68.349 14.208 14.208
217 2HB ASP 30 HB1 ASP 30 67.939 13.116 13.116
218 H ALA 31 HN ALA 31 72.125 12.440 12.440
219 HA ALA 31 HA ALA 31 73.620 14.845 14.845
220 1HB ALA 31 HB1 ALA 31 73.515 12.335 12.335
221 2HB ALA 31 HB3 ALA 31 74.402 13.670 13.670
222 3HB ALA 31 HB2 ALA 31 74.875 13.066 13.066
223 H ASP 32 HN ASP 32 70.987 13.846 13.846
224 HA ASP 32 HA ASP 32 71.377 16.205 16.205
225 1HB ASP 32 HB2 ASP 32 69.569 13.773 13.773
226 2HB ASP 32 HB1 ASP 32 69.400 15.063 15.063
227 H GLY 33 HN GLY 33 69.335 15.044 15.044
228 1HA GLY 33 HA2 GLY 33 68.166 16.739 16.739
229 2HA GLY 33 HA1 GLY 33 67.833 17.625 17.625
230 H GLY 34 HN GLY 34 67.537 14.139 14.139
231 1HA GLY 34 HA2 GLY 34 65.330 13.096 13.096
232 2HA GLY 34 HA1 GLY 34 64.566 14.468 14.468
233 H GLY 35 HN GLY 35 65.932 11.343 11.343
234 1HA GLY 35 HA2 GLY 35 64.797 10.675 10.675
235 2HA GLY 35 HA1 GLY 35 66.212 11.592 11.592
236 H ASP 36 HN ASP 36 68.192 10.856 10.856
237 HA ASP 36 HA ASP 36 68.289 8.024 8.024
238 1HB ASP 36 HB2 ASP 36 69.905 7.518 7.518
239 2HB ASP 36 HB1 ASP 36 68.238 7.806 7.806
240 H ILE 37 HN ILE 37 70.291 7.479 7.479
241 HA ILE 37 HA ILE 37 71.997 9.838 9.838
242 HB ILE 37 HB ILE 37 71.691 7.110 7.110
243 1HG1 ILE 37 HG12 ILE 37 70.638 9.692 9.692
244 2HG1 ILE 37 HG11 ILE 37 69.690 8.818 8.818
245 1HG2 ILE 37 HG21 ILE 37 73.843 8.245 8.245
246 2HG2 ILE 37 HG23 ILE 37 72.963 9.673 9.673
247 3HG2 ILE 37 HG22 ILE 37 72.831 8.163 8.163
248 HD1 ILE 37 HD1 ILE 37 70.019 6.742 6.742
249 HD1 ILE 37 HD1 ILE 37 68.945 7.987 7.987
250 HD1 ILE 37 HD1 ILE 37 70.594 7.847 7.847
251 H SER 38 HN SER 38 74.383 9.282 9.282
252 HA SER 38 HA SER 38 75.569 8.264 8.264
253 1HB SER 38 HB2 SER 38 76.525 9.731 9.731
254 2HB SER 38 HB1 SER 38 76.782 8.245 8.245
255 HG SER 38 HG SER 38 78.217 9.296 9.296
256 H THR 39 HN THR 39 76.094 6.188 6.188
257 HA THR 39 HA THR 39 74.930 3.875 3.875
258 HB THR 39 HB THR 39 76.969 2.785 2.785
259 HG1 THR 39 HG1 THR 39 78.206 4.784 4.784
260 1HG2 THR 39 HG23 THR 39 74.620 4.056 4.056
261 2HG2 THR 39 HG22 THR 39 75.898 4.539 4.539
262 3HG2 THR 39 HG21 THR 39 75.564 2.829 2.829
263 H LYS 40 HN LYS 40 77.822 5.540 5.540
264 HA LYS 40 HA LYS 40 78.793 3.316 3.316
265 1HB LYS 40 HB2 LYS 40 79.675 5.843 5.843
266 2HB LYS 40 HB1 LYS 40 79.804 5.890 5.890
267 1HG LYS 40 HG2 LYS 40 80.758 3.374 3.374
268 2HG LYS 40 HG1 LYS 40 81.343 4.311 4.311
269 1HD LYS 40 HD2 LYS 40 81.784 5.956 5.956
270 2HD LYS 40 HD1 LYS 40 82.263 4.340 4.340
271 1HE LYS 40 HE2 LYS 40 83.335 4.470 4.470
272 2HE LYS 40 HE1 LYS 40 83.565 6.122 6.122
273 1HZ LYS 40 HZ1 LYS 40 84.208 4.858 4.858
274 2HZ LYS 40 HZ3 LYS 40 84.556 3.587 3.587
275 3HZ LYS 40 HZ2 LYS 40 85.357 5.076 5.076
276 H GLU 41 HN GLU 41 76.192 5.397 5.397
277 HA GLU 41 HA GLU 41 76.420 5.659 5.659
278 1HB GLU 41 HB2 GLU 41 75.694 7.428 7.428
279 2HB GLU 41 HB1 GLU 41 74.123 6.657 6.657
280 1HG GLU 41 HG2 GLU 41 74.336 8.570 8.570
281 2HG GLU 41 HG1 GLU 41 74.271 7.065 7.065
282 H LEU 42 HN LEU 42 74.677 3.914 3.914
283 HA LEU 42 HA LEU 42 72.316 3.072 3.072
284 1HB LEU 42 HB2 LEU 42 73.975 2.285 2.285
285 2HB LEU 42 HB1 LEU 42 74.019 0.868 0.868
286 HG LEU 42 HG LEU 42 71.350 2.095 2.095
287 HD1 LEU 42 HD1 LEU 42 72.087 0.125 0.125
288 HD1 LEU 42 HD1 LEU 42 72.998 1.628 1.628
289 HD1 LEU 42 HD1 LEU 42 71.235 1.659 1.659
290 HD2 LEU 42 HD2 LEU 42 71.120 0.194 0.194
291 HD2 LEU 42 HD2 LEU 42 72.567 -0.559 -0.559
292 HD2 LEU 42 HD2 LEU 42 71.064 -0.560 -0.560
293 H GLY 43 HN GLY 43 75.566 1.994 1.994
294 1HA GLY 43 HA2 GLY 43 74.662 -0.022 -0.022
295 2HA GLY 43 HA1 GLY 43 76.267 0.713 0.713
296 H THR 44 HN THR 44 75.306 3.443 3.443
297 HA THR 44 HA THR 44 75.129 3.596 3.596
298 HB THR 44 HB THR 44 74.885 5.490 5.490
299 HG1 THR 44 HG1 THR 44 76.737 6.335 6.335
300 1HG2 THR 44 HG23 THR 44 74.434 6.095 6.095
301 2HG2 THR 44 HG22 THR 44 74.884 7.332 7.332
302 3HG2 THR 44 HG21 THR 44 73.363 6.457 6.457
303 H VAL 45 HN VAL 45 72.772 4.661 4.661
304 HA VAL 45 HA VAL 45 70.570 5.224 5.224
305 HB VAL 45 HB VAL 45 70.759 3.749 3.749
306 1HG1 VAL 45 HG11 VAL 45 68.398 5.158 5.158
307 2HG1 VAL 45 HG13 VAL 45 68.435 4.543 4.543
308 3HG1 VAL 45 HG12 VAL 45 68.534 3.424 3.424
309 1HG2 VAL 45 HG23 VAL 45 71.452 6.360 6.360
310 2HG2 VAL 45 HG22 VAL 45 71.179 5.774 5.774
311 3HG2 VAL 45 HG21 VAL 45 69.859 6.521 6.521
312 H MET 46 HN MET 46 71.310 1.972 1.972
313 HA MET 46 HA MET 46 69.246 0.506 0.506
314 1HB MET 46 HB2 MET 46 72.153 -0.144 -0.144
315 2HB MET 46 HB1 MET 46 70.970 -1.366 -1.366
316 1HG MET 46 HG2 MET 46 70.762 0.459 0.459
317 2HG MET 46 HG1 MET 46 71.187 -1.251 -1.251
318 1HE MET 46 HE2 MET 46 69.715 -3.098 -3.098
319 2HE MET 46 HE1 MET 46 69.522 -2.919 -2.919
320 3HE MET 46 HE3 MET 46 68.109 -3.200 -3.200
321 H ARG 47 HN ARG 47 72.563 0.813 0.813
322 HA ARG 47 HA ARG 47 71.988 -0.276 -0.276
323 1HB ARG 47 HB2 ARG 47 74.012 1.681 1.681
324 2HB ARG 47 HB1 ARG 47 74.049 1.185 1.185
325 1HG ARG 47 HG2 ARG 47 74.052 -1.218 -1.218
326 2HG ARG 47 HG1 ARG 47 74.304 -0.588 -0.588
327 1HD ARG 47 HD2 ARG 47 76.518 -0.365 -0.365
328 2HD ARG 47 HD1 ARG 47 76.167 0.678 0.678
329 HE ARG 47 HE ARG 47 76.184 -2.316 -2.316
330 1HH1 ARG 47 HH1 ARG 47 74.853 -1.430 -1.430
331 2HH1 ARG 47 HH1 ARG 47 76.109 -0.999 -0.999
332 1HH2 ARG 47 HH2 ARG 47 78.563 -0.785 -0.785
333 2HH2 ARG 47 HH2 ARG 47 78.209 -0.634 -0.634
334 H MET 48 HN MET 48 71.747 3.061 3.061
335 HA MET 48 HA MET 48 71.131 4.288 4.288
336 1HB MET 48 HB2 MET 48 71.153 4.926 4.926
337 2HB MET 48 HB1 MET 48 69.977 5.853 5.853
338 1HG MET 48 HG2 MET 48 72.593 5.611 5.611
339 2HG MET 48 HG1 MET 48 72.653 6.474 6.474
340 1HE MET 48 HE1 MET 48 73.392 8.310 8.310
341 2HE MET 48 HE3 MET 48 72.405 9.700 9.700
342 3HE MET 48 HE2 MET 48 73.268 8.771 8.771
343 H LEU 49 HN LEU 49 69.320 2.275 2.275
344 HA LEU 49 HA LEU 49 66.687 3.276 3.276
345 1HB LEU 49 HB2 LEU 49 67.824 1.569 1.569
346 2HB LEU 49 HB1 LEU 49 66.282 0.995 0.995
347 HG LEU 49 HG LEU 49 66.035 3.803 3.803
348 HD1 LEU 49 HD1 LEU 49 67.435 4.306 4.306
349 HD1 LEU 49 HD1 LEU 49 66.396 3.315 3.315
350 HD1 LEU 49 HD1 LEU 49 67.826 2.607 2.607
351 HD2 LEU 49 HD2 LEU 49 64.646 2.703 2.703
352 HD2 LEU 49 HD2 LEU 49 64.055 2.767 2.767
353 HD2 LEU 49 HD2 LEU 49 64.845 1.308 1.308
354 H GLY 50 HN GLY 50 68.751 0.385 0.385
355 1HA GLY 50 HA2 GLY 50 68.382 -0.387 -0.387
356 2HA GLY 50 HA1 GLY 50 66.808 -0.825 -0.825
357 H GLN 51 HN GLN 51 68.478 -1.309 -1.309
358 HA GLN 51 HA GLN 51 68.925 -4.180 -4.180
359 1HB GLN 51 HB2 GLN 51 69.281 -2.835 -2.835
360 2HB GLN 51 HB1 GLN 51 68.699 -4.462 -4.462
361 1HG GLN 51 HG2 GLN 51 67.226 -1.847 -1.847
362 2HG GLN 51 HG1 GLN 51 66.763 -3.231 -3.231
363 1HE2 GLN 51 HE22 GLN 51 66.286 -5.076 -5.076
364 2HE2 GLN 51 HE21 GLN 51 67.510 -5.193 -5.193
365 H ASN 52 HN ASN 52 70.915 -4.878 -4.878
366 HA ASN 52 HA ASN 52 73.254 -3.119 -3.119
367 1HB ASN 52 HB2 ASN 52 73.187 -4.052 -4.052
368 2HB ASN 52 HB1 ASN 52 72.814 -5.661 -5.661
369 HD2 ASN 52 HD2 ASN 52 74.589 -7.034 -7.034
370 HD2 ASN 52 HD2 ASN 52 76.204 -6.529 -6.529
371 HA PRO 53 HA PRO 53 73.427 -5.963 -5.963
372 1HB PRO 53 HB2 PRO 53 74.257 -4.057 -4.057
373 2HB PRO 53 HB1 PRO 53 72.548 -4.334 -4.334
374 1HG PRO 53 HG2 PRO 53 74.385 -2.206 -2.206
375 2HG PRO 53 HG1 PRO 53 72.659 -2.124 -2.124
376 1HD PRO 53 HD2 PRO 53 73.682 -2.271 -2.271
377 2HD PRO 53 HD1 PRO 53 72.043 -2.785 -2.785
378 H THR 54 HN THR 54 75.290 -7.170 -7.170
379 HA THR 54 HA THR 54 77.802 -6.268 -6.268
380 HB THR 54 HB THR 54 78.575 -8.418 -8.418
381 HG1 THR 54 HG1 THR 54 77.357 -9.201 -9.201
382 1HG2 THR 54 HG21 THR 54 76.735 -7.995 -7.995
383 2HG2 THR 54 HG23 THR 54 76.197 -9.427 -9.427
384 3HG2 THR 54 HG22 THR 54 77.834 -9.356 -9.356
385 H LYS 55 HN LYS 55 79.650 -5.485 -5.485
386 HA LYS 55 HA LYS 55 79.523 -3.821 -3.821
387 1HB LYS 55 HB2 LYS 55 81.427 -4.488 -4.488
388 2HB LYS 55 HB1 LYS 55 81.903 -5.615 -5.615
389 1HG LYS 55 HG2 LYS 55 82.436 -3.917 -3.917
390 2HG LYS 55 HG1 LYS 55 81.359 -2.755 -2.755
391 1HD LYS 55 HD2 LYS 55 82.983 -2.040 -2.040
392 2HD LYS 55 HD1 LYS 55 83.452 -3.690 -3.690
393 1HE LYS 55 HE2 LYS 55 84.843 -3.863 -3.863
394 2HE LYS 55 HE1 LYS 55 84.254 -2.299 -2.299
395 1HZ LYS 55 HZ1 LYS 55 85.455 -2.548 -2.548
396 2HZ LYS 55 HZ3 LYS 55 86.435 -2.321 -2.321
397 3HZ LYS 55 HZ2 LYS 55 85.269 -1.156 -1.156
398 H GLU 56 HN GLU 56 80.562 -7.255 -7.255
399 HA GLU 56 HA GLU 56 80.930 -7.602 -7.602
400 1HB GLU 56 HB2 GLU 56 80.021 -9.220 -9.220
401 2HB GLU 56 HB1 GLU 56 79.594 -9.887 -9.887
402 1HG GLU 56 HG2 GLU 56 82.195 -9.095 -9.095
403 2HG GLU 56 HG1 GLU 56 82.237 -9.629 -9.629
404 H GLU 57 HN GLU 57 77.810 -7.517 -7.517
405 HA GLU 57 HA GLU 57 76.195 -8.099 -8.099
406 1HB GLU 57 HB2 GLU 57 75.842 -7.143 -7.143
407 2HB GLU 57 HB1 GLU 57 74.499 -6.897 -6.897
408 1HG GLU 57 HG2 GLU 57 75.814 -9.582 -9.582
409 2HG GLU 57 HG1 GLU 57 74.739 -9.165 -9.165
410 H LEU 58 HN LEU 58 77.024 -5.066 -5.066
411 HA LEU 58 HA LEU 58 75.541 -3.246 -3.246
412 1HB LEU 58 HB2 LEU 58 78.288 -3.015 -3.015
413 2HB LEU 58 HB1 LEU 58 77.311 -1.641 -1.641
414 HG LEU 58 HG LEU 58 76.642 -3.665 -3.665
415 HD1 LEU 58 HD1 LEU 58 76.396 -1.479 -1.479
416 HD1 LEU 58 HD1 LEU 58 77.173 -0.687 -0.687
417 HD1 LEU 58 HD1 LEU 58 78.040 -1.924 -1.924
418 HD2 LEU 58 HD2 LEU 58 74.573 -2.065 -2.065
419 HD2 LEU 58 HD2 LEU 58 74.555 -3.347 -3.347
420 HD2 LEU 58 HD2 LEU 58 74.932 -1.690 -1.690
421 H ASP 59 HN ASP 59 78.860 -4.466 -4.466
422 HA ASP 59 HA ASP 59 79.364 -2.999 -2.999
423 1HB ASP 59 HB2 ASP 59 80.360 -5.675 -5.675
424 2HB ASP 59 HB1 ASP 59 81.105 -4.786 -4.786
425 H ALA 60 HN ALA 60 77.638 -6.009 -6.009
426 HA ALA 60 HA ALA 60 77.505 -6.846 -6.846
427 1HB ALA 60 HB2 ALA 60 77.105 -7.967 -7.967
428 2HB ALA 60 HB1 ALA 60 75.451 -7.783 -7.783
429 3HB ALA 60 HB3 ALA 60 76.620 -8.715 -8.715
430 H ILE 61 HN ILE 61 75.204 -5.325 -5.325
431 HA ILE 61 HA ILE 61 73.054 -5.065 -5.065
432 HB ILE 61 HB ILE 61 73.759 -3.520 -3.520
433 1HG1 ILE 61 HG12 ILE 61 71.639 -5.569 -5.569
434 2HG1 ILE 61 HG11 ILE 61 73.252 -6.214 -6.214
435 1HG2 ILE 61 HG22 ILE 61 71.929 -2.706 -2.706
436 2HG2 ILE 61 HG21 ILE 61 70.960 -3.945 -3.945
437 3HG2 ILE 61 HG23 ILE 61 71.633 -2.611 -2.611
438 HD1 ILE 61 HD1 ILE 61 73.321 -4.206 -4.206
439 HD1 ILE 61 HD1 ILE 61 73.868 -5.882 -5.882
440 HD1 ILE 61 HD1 ILE 61 72.184 -5.495 -5.495
441 H ILE 62 HN ILE 62 75.537 -2.747 -2.747
442 HA ILE 62 HA ILE 62 74.785 -0.457 -0.457
443 HB ILE 62 HB ILE 62 77.467 -1.692 -1.692
444 1HG1 ILE 62 HG12 ILE 62 75.874 0.618 0.618
445 2HG1 ILE 62 HG11 ILE 62 76.054 -0.979 -0.979
446 1HG2 ILE 62 HG21 ILE 62 76.810 0.890 0.890
447 2HG2 ILE 62 HG23 ILE 62 78.227 0.788 0.788
448 3HG2 ILE 62 HG22 ILE 62 78.088 -0.271 -0.271
449 HD1 ILE 62 HD1 ILE 62 78.308 -0.638 -0.638
450 HD1 ILE 62 HD1 ILE 62 77.627 0.965 0.965
451 HD1 ILE 62 HD1 ILE 62 78.500 0.618 0.618
452 H GLU 63 HN GLU 63 77.396 -2.583 -2.583
453 HA GLU 63 HA GLU 63 77.508 -1.751 -1.751
454 1HB GLU 63 HB2 GLU 63 78.567 -3.753 -3.753
455 2HB GLU 63 HB1 GLU 63 77.508 -4.688 -4.688
456 1HG GLU 63 HG2 GLU 63 78.635 -4.027 -4.027
457 2HG GLU 63 HG1 GLU 63 79.293 -2.577 -2.577
458 H GLU 64 HN GLU 64 75.107 -3.919 -3.919
459 HA GLU 64 HA GLU 64 73.786 -4.645 -4.645
460 1HB GLU 64 HB2 GLU 64 73.445 -6.058 -6.058
461 2HB GLU 64 HB1 GLU 64 73.183 -4.704 -4.704
462 1HG GLU 64 HG2 GLU 64 70.996 -4.323 -4.323
463 2HG GLU 64 HG1 GLU 64 71.281 -5.226 -5.226
464 H VAL 65 HN VAL 65 73.049 -2.234 -2.234
465 HA VAL 65 HA VAL 65 70.877 -1.076 -1.076
466 HB VAL 65 HB VAL 65 70.462 0.203 0.203
467 1HG1 VAL 65 HG11 VAL 65 70.243 -2.444 -2.444
468 2HG1 VAL 65 HG13 VAL 65 71.482 -2.351 -2.351
469 3HG1 VAL 65 HG12 VAL 65 69.929 -1.551 -1.551
470 1HG2 VAL 65 HG23 VAL 65 73.305 -0.578 -0.578
471 2HG2 VAL 65 HG22 VAL 65 72.567 1.024 1.024
472 3HG2 VAL 65 HG21 VAL 65 72.192 -0.149 -0.149
473 H ASP 66 HN ASP 66 74.167 -0.823 -0.823
474 HA ASP 66 HA ASP 66 74.272 2.125 2.125
475 1HB ASP 66 HB2 ASP 66 75.973 0.940 0.940
476 2HB ASP 66 HB1 ASP 66 76.386 -0.056 -0.056
477 H GLU 67 HN GLU 67 74.565 -0.899 -0.899
478 HA GLU 67 HA GLU 67 75.432 0.378 0.378
479 1HB GLU 67 HB2 GLU 67 75.292 -2.183 -2.183
480 2HB GLU 67 HB1 GLU 67 74.127 -2.226 -2.226
481 1HG GLU 67 HG2 GLU 67 75.741 -1.800 -1.800
482 2HG GLU 67 HG1 GLU 67 76.818 -0.993 -0.993
483 H ASP 68 HN ASP 68 72.557 0.588 0.588
484 HA ASP 68 HA ASP 68 70.585 0.026 0.026
485 1HB ASP 68 HB2 ASP 68 70.843 1.486 1.486
486 2HB ASP 68 HB1 ASP 68 69.514 2.014 2.014
487 H GLY 69 HN GLY 69 72.917 2.555 2.555
488 1HA GLY 69 HA2 GLY 69 73.396 4.263 4.263
489 2HA GLY 69 HA1 GLY 69 71.976 3.767 3.767
490 H SER 70 HN SER 70 71.629 4.400 4.400
491 HA SER 70 HA SER 70 70.216 6.962 6.962
492 1HB SER 70 HB2 SER 70 69.640 4.991 4.991
493 2HB SER 70 HB1 SER 70 68.631 6.344 6.344
494 HG SER 70 HG SER 70 68.855 5.114 5.114
495 H GLY 71 HN GLY 71 72.866 5.649 5.649
496 1HA GLY 71 HA2 GLY 71 74.412 7.261 7.261
497 2HA GLY 71 HA1 GLY 71 72.998 8.024 8.024
498 H THR 72 HN THR 72 72.706 7.498 7.498
499 HA THR 72 HA THR 72 74.069 5.128 5.128
500 HB THR 72 HB THR 72 73.580 6.203 6.203
501 HG1 THR 72 HG1 THR 72 71.751 7.171 7.171
502 1HG2 THR 72 HG22 THR 72 74.718 7.640 7.640
503 2HG2 THR 72 HG21 THR 72 73.869 8.778 8.778
504 3HG2 THR 72 HG23 THR 72 75.133 7.745 7.745
505 H ILE 73 HN ILE 73 71.827 5.166 5.166
506 HA ILE 73 HA ILE 73 70.040 3.262 3.262
507 HB ILE 73 HB ILE 73 71.260 2.350 2.350
508 1HG1 ILE 73 HG12 ILE 73 69.091 2.285 2.285
509 2HG1 ILE 73 HG11 ILE 73 68.339 2.757 2.757
510 1HG2 ILE 73 HG23 ILE 73 70.390 4.909 4.909
511 2HG2 ILE 73 HG22 ILE 73 70.614 3.492 3.492
512 3HG2 ILE 73 HG21 ILE 73 71.957 4.104 4.104
513 HD1 ILE 73 HD1 ILE 73 69.247 0.164 0.164
514 HD1 ILE 73 HD1 ILE 73 70.245 0.705 0.705
515 HD1 ILE 73 HD1 ILE 73 68.491 0.638 0.638
516 H ASP 74 HN ASP 74 67.877 3.746 3.746
517 HA ASP 74 HA ASP 74 66.924 6.388 6.388
518 1HB ASP 74 HB2 ASP 74 66.242 4.253 4.253
519 2HB ASP 74 HB1 ASP 74 64.815 4.926 4.926
520 H PHE 75 HN PHE 75 65.103 6.699 6.699
521 HA PHE 75 HA PHE 75 65.015 5.098 5.098
522 1HB PHE 75 HB2 PHE 75 64.273 7.477 7.477
523 2HB PHE 75 HB1 PHE 75 62.857 6.884 6.884
524 HD1 PHE 75 HD1 PHE 75 64.541 7.061 7.061
525 HD2 PHE 75 HD2 PHE 75 61.062 5.707 5.707
526 HE1 PHE 75 HE1 PHE 75 63.381 6.659 6.659
527 HE2 PHE 75 HE2 PHE 75 59.902 5.307 5.307
528 HZ PHE 75 HZ PHE 75 61.061 5.782 5.782
529 H GLU 76 HN GLU 76 62.585 5.283 5.283
530 HA GLU 76 HA GLU 76 60.846 3.257 3.257
531 1HB GLU 76 HB2 GLU 76 60.281 3.090 3.090
532 2HB GLU 76 HB1 GLU 76 60.448 4.767 4.767
533 1HG GLU 76 HG2 GLU 76 62.873 4.637 4.637
534 2HG GLU 76 HG1 GLU 76 62.454 3.103 3.103
535 H GLU 77 HN GLU 77 63.805 2.945 2.945
536 HA GLU 77 HA GLU 77 63.591 0.032 0.032
537 1HB GLU 77 HB2 GLU 77 64.729 1.829 1.829
538 2HB GLU 77 HB1 GLU 77 66.098 1.631 1.631
539 1HG GLU 77 HG2 GLU 77 66.673 -0.169 -0.169
540 2HG GLU 77 HG1 GLU 77 65.279 -0.981 -0.981
541 H PHE 78 HN PHE 78 65.007 2.370 2.370
542 HA PHE 78 HA PHE 78 66.899 0.558 0.558
543 1HB PHE 78 HB2 PHE 78 67.394 2.842 2.842
544 2HB PHE 78 HB1 PHE 78 65.715 3.278 3.278
545 HD1 PHE 78 HD1 PHE 78 68.486 1.235 1.235
546 HD2 PHE 78 HD2 PHE 78 65.073 3.750 3.750
547 HE1 PHE 78 HE1 PHE 78 68.915 1.145 1.145
548 HE2 PHE 78 HE2 PHE 78 65.503 3.660 3.660
549 HZ PHE 78 HZ PHE 78 67.423 2.358 2.358
550 H LEU 79 HN LEU 79 63.528 1.501 1.501
551 HA LEU 79 HA LEU 79 63.080 0.555 0.555
552 1HB LEU 79 HB2 LEU 79 61.552 0.913 0.913
553 2HB LEU 79 HB1 LEU 79 60.814 -0.180 -0.180
554 HG LEU 79 HG LEU 79 60.899 1.520 1.520
555 HD1 LEU 79 HD1 LEU 79 61.964 3.614 3.614
556 HD1 LEU 79 HD1 LEU 79 62.053 3.462 3.462
557 HD1 LEU 79 HD1 LEU 79 63.101 2.480 2.480
558 HD2 LEU 79 HD2 LEU 79 59.586 3.388 3.388
559 HD2 LEU 79 HD2 LEU 79 58.926 1.755 1.755
560 HD2 LEU 79 HD2 LEU 79 59.805 2.417 2.417
561 H VAL 80 HN VAL 80 63.880 -1.262 -1.262
562 HA VAL 80 HA VAL 80 62.880 -3.832 -3.832
563 HB VAL 80 HB VAL 80 63.428 -2.974 -2.974
564 1HG1 VAL 80 HG13 VAL 80 65.786 -2.307 -2.307
565 2HG1 VAL 80 HG12 VAL 80 66.168 -4.026 -4.026
566 3HG1 VAL 80 HG11 VAL 80 65.677 -3.283 -3.283
567 1HG2 VAL 80 HG23 VAL 80 63.279 -5.519 -5.519
568 2HG2 VAL 80 HG22 VAL 80 63.180 -5.144 -5.144
569 3HG2 VAL 80 HG21 VAL 80 64.730 -5.581 -5.581
570 H MET 81 HN MET 81 65.985 -2.104 -2.104
571 HA MET 81 HA MET 81 67.558 -4.244 -4.244
572 1HB MET 81 HB2 MET 81 67.684 -1.273 -1.273
573 2HB MET 81 HB1 MET 81 68.794 -2.009 -2.009
574 1HG MET 81 HG2 MET 81 68.489 -2.992 -2.992
575 2HG MET 81 HG1 MET 81 69.698 -1.803 -1.803
576 1HE MET 81 HE2 MET 81 70.670 -2.234 -2.234
577 2HE MET 81 HE1 MET 81 71.783 -3.590 -3.590
578 3HE MET 81 HE3 MET 81 71.976 -2.437 -2.437
579 H MET 82 HN MET 82 65.419 -1.822 -1.822
580 HA MET 82 HA MET 82 66.189 -2.113 -2.113
581 1HB MET 82 HB2 MET 82 63.506 -1.434 -1.434
582 2HB MET 82 HB1 MET 82 64.026 -1.010 -1.010
583 1HG MET 82 HG2 MET 82 66.036 -0.128 -0.128
584 2HG MET 82 HG1 MET 82 64.470 0.446 0.446
585 1HE MET 82 HE3 MET 82 66.622 -0.229 -0.229
586 2HE MET 82 HE2 MET 82 66.405 1.090 1.090
587 3HE MET 82 HE1 MET 82 65.191 -0.182 -0.182
588 H VAL 83 HN VAL 83 63.367 -3.489 -3.489
589 HA VAL 83 HA VAL 83 62.644 -5.295 -5.295
590 HB VAL 83 HB VAL 83 61.092 -4.502 -4.502
591 1HG1 VAL 83 HG13 VAL 83 63.030 -4.627 -4.627
592 2HG1 VAL 83 HG12 VAL 83 62.434 -6.266 -6.266
593 3HG1 VAL 83 HG11 VAL 83 61.363 -4.890 -4.890
594 1HG2 VAL 83 HG21 VAL 83 61.618 -7.485 -7.485
595 2HG2 VAL 83 HG23 VAL 83 60.643 -6.688 -6.688
596 3HG2 VAL 83 HG22 VAL 83 60.111 -6.684 -6.684
597 H ARG 84 HN ARG 84 64.410 -5.816 -5.816
598 HA ARG 84 HA ARG 84 64.819 -8.584 -8.584
599 1HB ARG 84 HB2 ARG 84 66.622 -6.324 -6.324
600 2HB ARG 84 HB1 ARG 84 66.926 -8.024 -8.024
601 1HG ARG 84 HG2 ARG 84 64.216 -6.902 -6.902
602 2HG ARG 84 HG1 ARG 84 65.548 -6.509 -6.509
603 1HD ARG 84 HD2 ARG 84 66.034 -8.941 -8.941
604 2HD ARG 84 HD1 ARG 84 64.632 -9.304 -9.304
605 HE ARG 84 HE ARG 84 64.347 -7.700 -7.700
606 1HH1 ARG 84 HH2 ARG 84 61.816 -7.608 -7.608
607 2HH1 ARG 84 HH2 ARG 84 61.100 -9.178 -9.178
608 1HH2 ARG 84 HH1 ARG 84 64.125 -10.865 -10.865
609 2HH2 ARG 84 HH1 ARG 84 62.407 -11.021 -11.021
610 H GLN 85 HN GLN 85 66.479 -5.983 -5.983
611 HA GLN 85 HA GLN 85 68.362 -7.872 -7.872
612 1HB GLN 85 HB2 GLN 85 69.026 -5.590 -5.590
613 2HB GLN 85 HB1 GLN 85 67.820 -4.907 -4.907
614 1HG GLN 85 HG2 GLN 85 70.079 -4.895 -4.895
615 2HG GLN 85 HG1 GLN 85 68.962 -5.919 -5.919
616 1HE2 GLN 85 HE22 GLN 85 71.931 -7.722 -7.722
617 2HE2 GLN 85 HE21 GLN 85 71.410 -6.166 -6.166
618 H MET 86 HN MET 86 65.478 -5.961 -5.961
619 HA MET 86 HA MET 86 65.501 -6.595 -6.595
620 1HB MET 86 HB2 MET 86 63.885 -5.171 -5.171
621 2HB MET 86 HB1 MET 86 62.877 -6.044 -6.044
622 1HG MET 86 HG2 MET 86 64.675 -4.994 -4.994
623 2HG MET 86 HG1 MET 86 64.724 -3.758 -3.758
624 1HE MET 86 HE2 MET 86 62.485 -3.159 -3.159
625 2HE MET 86 HE1 MET 86 61.497 -4.593 -4.593
626 3HE MET 86 HE3 MET 86 60.914 -3.006 -3.006
627 H LYS 87 HN LYS 87 64.516 -8.286 -8.286
628 HA LYS 87 HA LYS 87 62.462 -9.980 -9.980
629 1HB LYS 87 HB2 LYS 87 64.884 -10.280 -10.280
630 2HB LYS 87 HB1 LYS 87 63.816 -11.660 -11.660
631 1HG LYS 87 HG2 LYS 87 62.109 -9.481 -9.481
632 2HG LYS 87 HG1 LYS 87 63.415 -9.337 -9.337
633 1HD LYS 87 HD2 LYS 87 63.059 -11.613 -11.613
634 2HD LYS 87 HD1 LYS 87 61.873 -11.895 -11.895
635 1HE LYS 87 HE2 LYS 87 60.499 -11.401 -11.401
636 2HE LYS 87 HE1 LYS 87 60.656 -9.808 -9.808
637 1HZ LYS 87 HZ2 LYS 87 62.626 -9.414 -9.414
638 2HZ LYS 87 HZ1 LYS 87 62.335 -10.882 -10.882
639 3HZ LYS 87 HZ3 LYS 87 61.213 -9.616 -9.616
640 H GLU 88 HN GLU 88 65.786 -9.861 -9.861
641 HA GLU 88 HA GLU 88 65.544 -12.454 -12.454
642 1HB GLU 88 HB2 GLU 88 67.546 -11.354 -11.354
643 2HB GLU 88 HB1 GLU 88 67.976 -10.743 -10.743
644 1HG GLU 88 HG2 GLU 88 67.511 -13.251 -13.251
645 2HG GLU 88 HG1 GLU 88 67.854 -13.572 -13.572
646 H ASP 89 HN ASP 89 66.133 -8.979 -8.979
647 HA ASP 89 HA ASP 89 66.246 -9.301 -9.301
648 1HB ASP 89 HB2 ASP 89 66.024 -6.962 -6.962
649 2HB ASP 89 HB1 ASP 89 66.165 -6.760 -6.760
650 H ALA 90 HN ALA 90 63.756 -8.703 -8.703
651 HA ALA 90 HA ALA 90 61.782 -7.857 -7.857
652 1HB ALA 90 HB2 ALA 90 61.997 -6.818 -6.818
653 2HB ALA 90 HB1 ALA 90 61.518 -8.361 -8.361
654 3HB ALA 90 HB3 ALA 90 60.387 -7.466 -7.466
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