NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
8926 |
1n4i   |
5573 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ASP 1 HT1 ASP 1 46.094 8.214 3.447
2 2H ASP 1 HT2 ASP 1 47.609 7.924 4.159
3 3H ASP 1 HT3 ASP 1 47.024 6.886 2.948
4 HA ASP 1 HA ASP 1 47.762 9.746 2.562
5 1HB ASP 1 HB2 ASP 1 49.132 7.119 2.413
6 2HB ASP 1 HB1 ASP 1 49.427 8.203 1.053
7 H GLY 2 HN GLY 2 47.590 6.758 0.609
8 1HA GLY 2 HA2 GLY 2 45.959 6.310 -1.121
9 2HA GLY 2 HA1 GLY 2 45.497 8.012 -1.086
10 H SER 3 HN SER 3 45.784 7.859 -3.477
11 HA SER 3 HA SER 3 47.064 8.149 -5.450
12 1HB SER 3 HB2 SER 3 47.655 10.010 -3.467
13 2HB SER 3 HB1 SER 3 49.244 9.471 -4.006
14 HG SER 3 HG SER 3 48.131 9.757 -6.207
15 H CYS 4 HN CYS 4 49.893 8.335 -5.718
16 HA CYS 4 HA CYS 4 51.823 6.976 -5.875
17 1HB CYS 4 HB2 CYS 4 50.648 6.619 -3.285
18 2HB CYS 4 HB1 CYS 4 51.249 5.056 -3.837
19 H THR 5 HN THR 5 52.328 5.119 -7.072
20 HA THR 5 HA THR 5 50.592 2.787 -7.179
21 HB THR 5 HB THR 5 50.676 4.689 -9.547
22 HG1 THR 5 HG1 THR 5 48.324 3.979 -8.246
23 1HG2 THR 5 HG21 THR 5 49.926 2.966 -10.781
24 2HG2 THR 5 HG22 THR 5 48.635 2.651 -9.621
25 3HG2 THR 5 HG23 THR 5 50.217 1.901 -9.402
26 H ASN 6 HN ASN 6 52.756 1.932 -6.735
27 HA ASN 6 HA ASN 6 55.026 2.290 -8.421
28 1HB ASN 6 HB2 ASN 6 55.704 0.137 -7.268
29 2HB ASN 6 HB1 ASN 6 55.115 1.396 -6.178
30 1HD2 ASN 6 HD2 ASN 6 54.249 -0.014 -4.555
31 2HD2 ASN 6 HD2 ASN 6 52.935 -1.048 -4.847
32 H THR 7 HN THR 7 53.670 2.209 -10.515
33 HA THR 7 HA THR 7 53.365 1.097 -12.579
34 HB THR 7 HB THR 7 54.364 -1.388 -11.177
35 HG1 THR 7 HG1 THR 7 55.833 0.827 -12.164
36 1HG2 THR 7 HG21 THR 7 53.589 -1.632 -13.487
37 2HG2 THR 7 HG22 THR 7 55.341 -1.814 -13.412
38 3HG2 THR 7 HG23 THR 7 54.635 -0.305 -13.993
39 H ASN 8 HN ASN 8 51.735 0.542 -9.777
40 HA ASN 8 HA ASN 8 49.328 -0.388 -10.981
41 1HB ASN 8 HB2 ASN 8 50.621 -2.435 -11.380
42 2HB ASN 8 HB1 ASN 8 51.080 -2.492 -9.680
43 1HD2 ASN 8 HD2 ASN 8 47.834 -1.501 -10.616
44 2HD2 ASN 8 HD2 ASN 8 47.048 -2.896 -10.057
45 H SER 9 HN SER 9 51.400 -0.303 -8.136
46 HA SER 9 HA SER 9 50.912 0.460 -5.950
47 1HB SER 9 HB2 SER 9 49.063 1.666 -7.566
48 2HB SER 9 HB1 SER 9 48.019 0.757 -6.477
49 HG SER 9 HG SER 9 48.381 2.462 -5.261
50 H GLN 10 HN GLN 10 51.057 -1.255 -4.589
51 HA GLN 10 HA GLN 10 48.634 -2.968 -4.257
52 1HB GLN 10 HB2 GLN 10 50.888 -3.756 -5.634
53 2HB GLN 10 HB1 GLN 10 51.229 -4.340 -4.002
54 1HG GLN 10 HG2 GLN 10 49.064 -5.478 -3.931
55 2HG GLN 10 HG1 GLN 10 48.682 -4.872 -5.545
56 1HE2 GLN 10 HE21 GLN 10 50.655 -5.409 -7.185
57 2HE2 GLN 10 HE22 GLN 10 51.207 -7.011 -7.108
58 H LEU 11 HN LEU 11 49.771 -0.723 -2.704
59 HA LEU 11 HA LEU 11 51.321 -1.384 -0.486
60 1HB LEU 11 HB2 LEU 11 48.937 0.396 -0.951
61 2HB LEU 11 HB1 LEU 11 49.647 0.292 0.660
62 HG LEU 11 HG LEU 11 50.725 2.132 -0.416
63 1HD1 LEU 11 HD1 LEU 11 52.825 0.155 -1.063
64 2HD1 LEU 11 HD1 LEU 11 52.139 0.020 0.555
65 3HD1 LEU 11 HD1 LEU 11 52.875 1.535 0.033
66 1HD2 LEU 11 HD2 LEU 11 51.361 0.291 -2.739
67 2HD2 LEU 11 HD2 LEU 11 51.671 2.025 -2.640
68 3HD2 LEU 11 HD2 LEU 11 50.014 1.430 -2.733
69 H SER 12 HN SER 12 51.104 -3.166 0.768
70 HA SER 12 HA SER 12 49.176 -5.024 1.118
71 1HB SER 12 HB2 SER 12 50.086 -5.379 3.316
72 2HB SER 12 HB1 SER 12 51.386 -4.707 2.336
73 HG SER 12 HG SER 12 51.144 -2.779 3.326
74 H ALA 13 HN ALA 13 49.189 -2.285 3.446
75 HA ALA 13 HA ALA 13 46.440 -1.566 3.063
76 1HB ALA 13 HB1 ALA 13 45.690 -2.732 5.264
77 2HB ALA 13 HB2 ALA 13 47.112 -3.747 5.032
78 3HB ALA 13 HB3 ALA 13 45.838 -3.721 3.813
79 H ASN 14 HN ASN 14 49.152 -1.856 5.331
80 HA ASN 14 HA ASN 14 48.261 0.699 6.628
81 1HB ASN 14 HB2 ASN 14 49.822 -0.181 8.467
82 2HB ASN 14 HB1 ASN 14 48.342 -1.101 8.197
83 1HD2 ASN 14 HD2 ASN 14 49.546 -3.008 9.110
84 2HD2 ASN 14 HD2 ASN 14 50.617 -3.865 8.112
85 H SER 15 HN SER 15 50.107 -0.039 4.156
86 HA SER 15 HA SER 15 52.759 0.863 4.839
87 1HB SER 15 HB2 SER 15 52.428 -0.413 2.855
88 2HB SER 15 HB1 SER 15 51.118 0.630 2.311
89 HG SER 15 HG SER 15 52.551 2.164 1.763
90 H LYS 16 HN LYS 16 53.453 2.898 3.223
91 HA LYS 16 HA LYS 16 51.564 5.159 3.676
92 1HB LYS 16 HB2 LYS 16 53.644 4.537 5.399
93 2HB LYS 16 HB1 LYS 16 54.365 5.750 4.341
94 1HG LYS 16 HG2 LYS 16 51.805 6.736 4.888
95 2HG LYS 16 HG1 LYS 16 52.370 6.091 6.430
96 1HD LYS 16 HD2 LYS 16 54.458 7.389 6.213
97 2HD LYS 16 HD1 LYS 16 53.897 8.034 4.670
98 1HE LYS 16 HE2 LYS 16 53.400 9.691 6.377
99 2HE LYS 16 HE1 LYS 16 51.860 8.935 5.918
100 1HZ LYS 16 HZ1 LYS 16 52.463 9.058 8.404
101 2HZ LYS 16 HZ2 LYS 16 53.522 7.776 8.062
102 3HZ LYS 16 HZ3 LYS 16 51.854 7.598 7.791
103 H CYS 17 HN CYS 17 51.758 6.749 2.078
104 HA CYS 17 HA CYS 17 54.109 6.758 0.279
105 1HB CYS 17 HB2 CYS 17 51.936 5.141 -0.258
106 2HB CYS 17 HB1 CYS 17 51.551 6.600 -1.169
107 H GLU 18 HN GLU 18 54.528 8.886 -0.170
108 HA GLU 18 HA GLU 18 52.226 10.812 -0.132
109 1HB GLU 18 HB2 GLU 18 54.818 10.696 1.287
110 2HB GLU 18 HB1 GLU 18 54.422 12.274 0.605
111 1HG GLU 18 HG2 GLU 18 52.273 10.815 2.081
112 2HG GLU 18 HG1 GLU 18 53.562 11.561 3.027
113 H LYS 19 HN LYS 19 55.625 10.446 -1.237
114 HA LYS 19 HA LYS 19 54.891 11.314 -3.946
115 1HB LYS 19 HB2 LYS 19 56.255 13.363 -3.836
116 2HB LYS 19 HB1 LYS 19 54.983 13.413 -2.617
117 1HG LYS 19 HG2 LYS 19 56.460 13.312 -0.889
118 2HG LYS 19 HG1 LYS 19 57.492 12.146 -1.717
119 1HD LYS 19 HD2 LYS 19 58.848 14.055 -1.667
120 2HD LYS 19 HD1 LYS 19 58.101 14.169 -3.261
121 1HE LYS 19 HE2 LYS 19 56.260 15.424 -1.567
122 2HE LYS 19 HE1 LYS 19 57.845 15.981 -0.993
123 1HZ LYS 19 HZ1 LYS 19 58.369 16.183 -3.489
124 2HZ LYS 19 HZ2 LYS 19 57.424 17.394 -2.763
125 3HZ LYS 19 HZ3 LYS 19 56.687 16.183 -3.699
126 H SER 20 HN SER 20 56.019 8.921 -3.368
127 HA SER 20 HA SER 20 58.974 9.204 -3.682
128 1HB SER 20 HB2 SER 20 59.040 6.957 -2.896
129 2HB SER 20 HB1 SER 20 57.763 7.719 -1.952
130 HG SER 20 HG SER 20 56.252 6.737 -3.211
131 H THR 21 HN THR 21 59.665 7.028 -5.112
132 HA THR 21 HA THR 21 58.069 7.120 -7.646
133 HB THR 21 HB THR 21 61.088 7.149 -7.551
134 HG1 THR 21 HG1 THR 21 60.922 9.412 -7.735
135 1HG2 THR 21 HG21 THR 21 59.191 8.286 -9.609
136 2HG2 THR 21 HG22 THR 21 59.741 6.612 -9.654
137 3HG2 THR 21 HG23 THR 21 60.907 7.925 -9.798
138 H LEU 22 HN LEU 22 57.535 4.983 -6.258
139 HA LEU 22 HA LEU 22 59.522 2.847 -6.417
140 1HB LEU 22 HB2 LEU 22 56.538 2.596 -6.009
141 2HB LEU 22 HB1 LEU 22 57.809 1.572 -5.352
142 HG LEU 22 HG LEU 22 56.981 4.337 -4.502
143 1HD1 LEU 22 HD1 LEU 22 56.022 2.828 -3.052
144 2HD1 LEU 22 HD1 LEU 22 57.594 2.983 -2.268
145 3HD1 LEU 22 HD1 LEU 22 57.269 1.612 -3.330
146 1HD2 LEU 22 HD2 LEU 22 59.719 3.112 -4.385
147 2HD2 LEU 22 HD2 LEU 22 59.166 4.088 -3.027
148 3HD2 LEU 22 HD2 LEU 22 59.262 4.796 -4.639
149 H THR 23 HN THR 23 58.527 0.679 -7.452
150 HA THR 23 HA THR 23 57.004 1.061 -9.925
151 HB THR 23 HB THR 23 59.998 0.587 -9.917
152 HG1 THR 23 HG1 THR 23 59.098 2.391 -11.660
153 1HG2 THR 23 HG21 THR 23 59.720 0.379 -12.408
154 2HG2 THR 23 HG22 THR 23 57.977 0.286 -12.153
155 3HG2 THR 23 HG23 THR 23 59.032 -0.967 -11.499
156 H ASN 24 HN ASN 24 55.810 -0.801 -9.946
157 HA ASN 24 HA ASN 24 55.257 -3.092 -9.758
158 1HB ASN 24 HB2 ASN 24 58.123 -2.903 -10.552
159 2HB ASN 24 HB1 ASN 24 57.571 -4.478 -9.985
160 1HD2 ASN 24 HD2 ASN 24 55.069 -4.800 -10.973
161 2HD2 ASN 24 HD2 ASN 24 55.030 -4.634 -12.662
162 H CYS 25 HN CYS 25 55.523 -1.718 -7.308
163 HA CYS 25 HA CYS 25 57.075 -3.587 -5.568
164 1HB CYS 25 HB2 CYS 25 56.668 -0.766 -5.678
165 2HB CYS 25 HB1 CYS 25 55.928 -1.340 -4.195
166 H TYR 26 HN TYR 26 55.623 -2.906 -3.231
167 HA TYR 26 HA TYR 26 52.800 -3.534 -3.490
168 1HB TYR 26 HB2 TYR 26 53.539 -5.747 -3.961
169 2HB TYR 26 HB1 TYR 26 54.881 -5.624 -2.823
170 HD1 TYR 26 HD1 TYR 26 54.432 -5.623 -0.356
171 HD2 TYR 26 HD2 TYR 26 51.353 -6.411 -3.247
172 HE1 TYR 26 HE1 TYR 26 53.011 -6.607 1.424
173 HE2 TYR 26 HE2 TYR 26 49.934 -7.395 -1.467
174 HH TYR 26 HH TYR 26 50.546 -6.983 1.807
175 H VAL 27 HN VAL 27 55.721 -3.607 -1.533
176 HA VAL 27 HA VAL 27 56.192 -2.830 0.628
177 HB VAL 27 HB VAL 27 53.789 -1.084 0.056
178 1HG1 VAL 27 HG11 VAL 27 54.455 -0.191 2.025
179 2HG1 VAL 27 HG12 VAL 27 55.864 0.412 1.152
180 3HG1 VAL 27 HG13 VAL 27 55.957 -1.120 2.024
181 1HG2 VAL 27 HG21 VAL 27 55.302 -1.225 -1.933
182 2HG2 VAL 27 HG22 VAL 27 56.657 -0.757 -0.905
183 3HG2 VAL 27 HG23 VAL 27 55.335 0.375 -1.188
184 H ASP 28 HN ASP 28 55.581 -3.079 2.786
185 HA ASP 28 HA ASP 28 52.820 -3.818 3.515
186 1HB ASP 28 HB2 ASP 28 54.279 -5.815 2.545
187 2HB ASP 28 HB1 ASP 28 54.994 -5.791 4.156
188 H LYS 29 HN LYS 29 52.544 -2.766 5.466
189 HA LYS 29 HA LYS 29 53.117 -1.711 7.513
190 1HB LYS 29 HB2 LYS 29 54.950 -4.135 7.478
191 2HB LYS 29 HB1 LYS 29 54.564 -3.189 8.918
192 1HG LYS 29 HG2 LYS 29 52.312 -3.870 8.914
193 2HG LYS 29 HG1 LYS 29 52.370 -4.367 7.223
194 1HD LYS 29 HD2 LYS 29 52.478 -6.429 8.307
195 2HD LYS 29 HD1 LYS 29 54.189 -6.065 8.081
196 1HE LYS 29 HE2 LYS 29 54.316 -6.461 10.337
197 2HE LYS 29 HE1 LYS 29 53.682 -4.809 10.475
198 1HZ LYS 29 HZ1 LYS 29 51.447 -6.158 9.973
199 2HZ LYS 29 HZ2 LYS 29 52.005 -5.847 11.547
200 3HZ LYS 29 HZ3 LYS 29 52.309 -7.352 10.816
201 H SER 30 HN SER 30 54.304 -0.338 5.492
202 HA SER 30 HA SER 30 57.008 0.285 6.596
203 1HB SER 30 HB2 SER 30 56.249 -0.395 3.744
204 2HB SER 30 HB1 SER 30 57.759 0.413 4.156
205 HG SER 30 HG SER 30 56.844 -2.152 4.933
206 H GLU 31 HN GLU 31 57.799 2.335 5.121
207 HA GLU 31 HA GLU 31 55.467 4.217 4.940
208 1HB GLU 31 HB2 GLU 31 58.091 4.341 6.379
209 2HB GLU 31 HB1 GLU 31 57.417 5.845 5.752
210 1HG GLU 31 HG2 GLU 31 55.580 5.774 7.157
211 2HG GLU 31 HG1 GLU 31 55.603 4.014 7.269
212 H VAL 32 HN VAL 32 58.982 4.357 4.239
213 HA VAL 32 HA VAL 32 60.114 4.953 2.249
214 HB VAL 32 HB VAL 32 57.472 4.300 0.924
215 1HG1 VAL 32 HG11 VAL 32 58.770 4.799 -0.871
216 2HG1 VAL 32 HG12 VAL 32 59.543 3.245 -0.557
217 3HG1 VAL 32 HG13 VAL 32 60.257 4.729 0.075
218 1HG2 VAL 32 HG21 VAL 32 59.196 2.048 0.939
219 2HG2 VAL 32 HG22 VAL 32 57.641 2.210 1.753
220 3HG2 VAL 32 HG23 VAL 32 59.126 2.635 2.602
221 H TYR 33 HN TYR 33 60.279 6.776 0.802
222 HA TYR 33 HA TYR 33 58.045 8.736 0.789
223 1HB TYR 33 HB2 TYR 33 60.680 8.954 2.210
224 2HB TYR 33 HB1 TYR 33 59.963 10.415 1.530
225 HD1 TYR 33 HD1 TYR 33 57.804 11.262 2.342
226 HD2 TYR 33 HD2 TYR 33 59.626 7.769 4.055
227 HE1 TYR 33 HE1 TYR 33 56.254 11.401 4.274
228 HE2 TYR 33 HE2 TYR 33 58.076 7.908 5.987
229 HH TYR 33 HH TYR 33 56.304 10.609 6.728
230 H GLY 34 HN GLY 34 61.427 8.057 -0.155
231 1HA GLY 34 HA2 GLY 34 60.795 9.168 -2.847
232 2HA GLY 34 HA1 GLY 34 62.245 9.723 -2.007
233 H THR 35 HN THR 35 61.179 6.430 -1.622
234 HA THR 35 HA THR 35 63.712 5.381 -2.547
235 HB THR 35 HB THR 35 61.031 4.215 -1.768
236 HG1 THR 35 HG1 THR 35 62.265 5.063 -0.101
237 1HG2 THR 35 HG21 THR 35 63.586 2.751 -2.489
238 2HG2 THR 35 HG22 THR 35 62.065 2.687 -3.381
239 3HG2 THR 35 HG23 THR 35 62.163 2.007 -1.757
240 H THR 36 HN THR 36 64.088 4.099 -4.443
241 HA THR 36 HA THR 36 62.150 4.610 -6.669
242 HB THR 36 HB THR 36 65.106 3.914 -6.708
243 HG1 THR 36 HG1 THR 36 63.680 6.305 -6.547
244 1HG2 THR 36 HG21 THR 36 63.283 4.988 -8.879
245 2HG2 THR 36 HG22 THR 36 63.836 3.318 -8.761
246 3HG2 THR 36 HG23 THR 36 64.997 4.612 -9.049
247 H CYS 37 HN CYS 37 61.306 2.540 -5.166
248 HA CYS 37 HA CYS 37 62.261 -0.029 -5.285
249 1HB CYS 37 HB2 CYS 37 60.123 0.536 -4.317
250 2HB CYS 37 HB1 CYS 37 59.494 1.055 -5.878
251 H THR 38 HN THR 38 62.572 -1.610 -6.860
252 HA THR 38 HA THR 38 61.929 -0.849 -9.694
253 HB THR 38 HB THR 38 64.309 -2.333 -8.526
254 HG1 THR 38 HG1 THR 38 65.147 -0.288 -9.783
255 1HG2 THR 38 HG21 THR 38 64.817 -1.545 -11.174
256 2HG2 THR 38 HG22 THR 38 63.196 -2.241 -11.202
257 3HG2 THR 38 HG23 THR 38 64.552 -3.190 -10.593
258 H GLY 39 HN GLY 39 60.794 -2.735 -7.393
259 1HA GLY 39 HA2 GLY 39 59.185 -4.480 -8.337
260 2HA GLY 39 HA1 GLY 39 60.620 -5.196 -9.071
261 H SER 40 HN SER 40 59.941 -3.872 -5.818
262 HA SER 40 HA SER 40 60.712 -6.531 -4.670
263 1HB SER 40 HB2 SER 40 61.536 -3.907 -3.446
264 2HB SER 40 HB1 SER 40 62.279 -5.493 -3.257
265 HG SER 40 HG SER 40 63.536 -4.288 -4.651
266 H ARG 41 HN ARG 41 60.369 -6.009 -2.020
267 HA ARG 41 HA ARG 41 57.745 -4.652 -1.658
268 1HB ARG 41 HB2 ARG 41 56.705 -6.654 -0.842
269 2HB ARG 41 HB1 ARG 41 57.506 -7.106 -2.347
270 1HG ARG 41 HG2 ARG 41 58.463 -8.757 -1.120
271 2HG ARG 41 HG1 ARG 41 59.510 -7.483 -0.496
272 1HD ARG 41 HD2 ARG 41 58.349 -7.328 1.516
273 2HD ARG 41 HD1 ARG 41 56.833 -7.912 0.803
274 HE ARG 41 HE ARG 41 59.141 -9.786 0.945
275 1HH1 ARG 41 HH2 ARG 41 55.842 -9.596 0.717
276 2HH1 ARG 41 HH2 ARG 41 55.490 -10.741 1.969
277 1HH2 ARG 41 HH1 ARG 41 58.767 -10.927 3.085
278 2HH2 ARG 41 HH1 ARG 41 57.147 -11.494 3.309
279 H PHE 42 HN PHE 42 57.169 -4.697 0.773
280 HA PHE 42 HA PHE 42 59.648 -4.730 2.458
281 1HB PHE 42 HB2 PHE 42 57.400 -2.691 2.475
282 2HB PHE 42 HB1 PHE 42 58.866 -2.633 3.455
283 HD1 PHE 42 HD1 PHE 42 60.932 -3.486 1.532
284 HD2 PHE 42 HD2 PHE 42 57.574 -0.863 1.000
285 HE1 PHE 42 HE1 PHE 42 62.121 -2.338 -0.317
286 HE2 PHE 42 HE2 PHE 42 58.762 0.286 -0.848
287 HZ PHE 42 HZ PHE 42 61.035 -0.453 -1.506
288 H ASP 43 HN ASP 43 58.848 -4.495 4.899
289 HA ASP 43 HA ASP 43 56.237 -5.607 5.538
290 1HB ASP 43 HB2 ASP 43 58.078 -7.404 4.582
291 2HB ASP 43 HB1 ASP 43 58.360 -7.508 6.321
292 H GLY 44 HN GLY 44 56.967 -3.429 6.697
293 1HA GLY 44 HA2 GLY 44 56.947 -2.842 9.065
294 2HA GLY 44 HA1 GLY 44 57.969 -4.243 9.382
295 H VAL 45 HN VAL 45 58.278 -1.558 7.014
296 HA VAL 45 HA VAL 45 60.957 -1.036 8.261
297 HB VAL 45 HB VAL 45 61.933 -1.039 6.148
298 1HG1 VAL 45 HG11 VAL 45 61.038 -2.957 4.880
299 2HG1 VAL 45 HG12 VAL 45 59.534 -2.860 5.801
300 3HG1 VAL 45 HG13 VAL 45 61.039 -3.287 6.613
301 1HG2 VAL 45 HG21 VAL 45 60.380 -0.867 4.051
302 2HG2 VAL 45 HG22 VAL 45 60.759 0.599 4.960
303 3HG2 VAL 45 HG23 VAL 45 59.209 -0.207 5.193
304 H THR 46 HN THR 46 61.770 1.173 7.155
305 HA THR 46 HA THR 46 59.623 3.202 6.967
306 HB THR 46 HB THR 46 61.742 3.076 9.139
307 HG1 THR 46 HG1 THR 46 60.079 2.688 10.458
308 1HG2 THR 46 HG21 THR 46 61.607 5.363 8.697
309 2HG2 THR 46 HG22 THR 46 60.340 5.162 9.908
310 3HG2 THR 46 HG23 THR 46 59.918 5.268 8.198
311 H ILE 47 HN ILE 47 61.209 2.535 4.885
312 HA ILE 47 HA ILE 47 63.726 4.019 4.869
313 HB ILE 47 HB ILE 47 63.389 1.896 3.679
314 1HG1 ILE 47 HG12 ILE 47 63.602 3.986 1.523
315 2HG1 ILE 47 HG11 ILE 47 64.851 3.863 2.764
316 1HG2 ILE 47 HG21 ILE 47 61.925 2.330 1.460
317 2HG2 ILE 47 HG22 ILE 47 61.088 3.415 2.568
318 3HG2 ILE 47 HG23 ILE 47 61.224 1.700 2.950
319 1HD1 ILE 47 HD1 ILE 47 64.956 1.369 2.202
320 2HD1 ILE 47 HD1 ILE 47 65.599 2.470 0.981
321 3HD1 ILE 47 HD1 ILE 47 64.000 1.756 0.770
322 H THR 48 HN THR 48 64.069 5.543 2.895
323 HA THR 48 HA THR 48 61.679 7.200 2.267
324 HB THR 48 HB THR 48 63.000 9.213 3.015
325 HG1 THR 48 HG1 THR 48 64.692 8.114 4.645
326 1HG2 THR 48 HG21 THR 48 62.182 9.034 5.140
327 2HG2 THR 48 HG22 THR 48 62.940 7.464 5.408
328 3HG2 THR 48 HG23 THR 48 61.441 7.572 4.486
329 H THR 49 HN THR 49 63.899 9.249 1.436
330 HA THR 49 HA THR 49 64.042 8.619 -1.327
331 HB THR 49 HB THR 49 65.876 10.256 0.454
332 HG1 THR 49 HG1 THR 49 63.456 10.632 0.215
333 1HG2 THR 49 HG21 THR 49 66.414 11.481 -1.619
334 2HG2 THR 49 HG22 THR 49 65.410 10.362 -2.540
335 3HG2 THR 49 HG23 THR 49 66.874 9.783 -1.742
336 H SER 50 HN SER 50 64.733 6.269 -1.241
337 HA SER 50 HA SER 50 67.715 6.090 -1.155
338 1HB SER 50 HB2 SER 50 66.905 5.364 1.016
339 2HB SER 50 HB1 SER 50 65.694 4.330 0.265
340 HG SER 50 HG SER 50 67.243 2.948 -0.355
341 H THR 51 HN THR 51 68.568 4.590 -2.649
342 HA THR 51 HA THR 51 66.608 3.521 -4.627
343 HB THR 51 HB THR 51 69.518 3.248 -5.053
344 HG1 THR 51 HG1 THR 51 69.860 5.432 -5.243
345 1HG2 THR 51 HG21 THR 51 67.070 3.701 -6.546
346 2HG2 THR 51 HG22 THR 51 68.627 3.096 -7.112
347 3HG2 THR 51 HG23 THR 51 68.333 4.833 -7.029
348 H SER 52 HN SER 52 66.155 1.367 -4.644
349 HA SER 52 HA SER 52 68.161 -0.560 -3.557
350 1HB SER 52 HB2 SER 52 66.745 -1.260 -1.893
351 2HB SER 52 HB1 SER 52 66.053 0.349 -2.088
352 HG SER 52 HG SER 52 64.597 -1.567 -2.221
353 H THR 53 HN THR 53 68.361 -2.298 -4.937
354 HA THR 53 HA THR 53 66.268 -2.645 -7.051
355 HB THR 53 HB THR 53 68.970 -3.950 -7.073
356 HG1 THR 53 HG1 THR 53 69.839 -2.004 -7.862
357 1HG2 THR 53 HG21 THR 53 68.394 -2.703 -9.503
358 2HG2 THR 53 HG22 THR 53 66.830 -3.285 -8.931
359 3HG2 THR 53 HG23 THR 53 68.172 -4.412 -9.129
360 H GLY 54 HN GLY 54 64.790 -4.141 -6.230
361 1HA GLY 54 HA2 GLY 54 63.991 -6.149 -5.300
362 2HA GLY 54 HA1 GLY 54 65.387 -6.883 -6.095
363 H SER 55 HN SER 55 64.183 -5.560 -3.078
364 HA SER 55 HA SER 55 66.303 -7.021 -1.619
365 1HB SER 55 HB2 SER 55 66.786 -4.811 -0.377
366 2HB SER 55 HB1 SER 55 67.422 -4.959 -2.013
367 HG SER 55 HG SER 55 66.358 -3.149 -2.270
368 H ARG 56 HN ARG 56 65.165 -8.072 -0.046
369 HA ARG 56 HA ARG 56 62.516 -7.247 0.812
370 1HB ARG 56 HB2 ARG 56 63.846 -9.568 0.705
371 2HB ARG 56 HB1 ARG 56 64.244 -9.135 2.368
372 1HG ARG 56 HG2 ARG 56 61.481 -8.599 2.032
373 2HG ARG 56 HG1 ARG 56 61.776 -10.192 1.334
374 1HD ARG 56 HD2 ARG 56 63.059 -9.589 3.970
375 2HD ARG 56 HD1 ARG 56 61.315 -9.917 3.951
376 HE ARG 56 HE ARG 56 62.607 -11.846 2.294
377 1HH1 ARG 56 HH2 ARG 56 64.355 -11.516 4.855
378 2HH1 ARG 56 HH2 ARG 56 63.733 -12.819 5.811
379 1HH2 ARG 56 HH1 ARG 56 60.915 -13.272 3.839
380 2HH2 ARG 56 HH1 ARG 56 61.786 -13.813 5.236
381 H ILE 57 HN ILE 57 62.529 -5.242 1.894
382 HA ILE 57 HA ILE 57 64.599 -4.619 3.886
383 HB ILE 57 HB ILE 57 62.016 -3.157 3.287
384 1HG1 ILE 57 HG12 ILE 57 62.954 -3.520 1.125
385 2HG1 ILE 57 HG11 ILE 57 63.498 -1.909 1.595
386 1HG2 ILE 57 HG21 ILE 57 63.279 -2.284 5.171
387 2HG2 ILE 57 HG22 ILE 57 63.476 -1.184 3.806
388 3HG2 ILE 57 HG23 ILE 57 64.769 -2.306 4.229
389 1HD1 ILE 57 HD1 ILE 57 65.379 -3.181 0.672
390 2HD1 ILE 57 HD1 ILE 57 65.100 -4.475 1.836
391 3HD1 ILE 57 HD1 ILE 57 65.642 -2.891 2.392
392 H SER 58 HN SER 58 62.250 -6.781 4.094
393 HA SER 58 HA SER 58 60.437 -6.275 6.113
394 1HB SER 58 HB2 SER 58 62.090 -8.556 5.212
395 2HB SER 58 HB1 SER 58 61.409 -8.728 6.826
396 HG SER 58 HG SER 58 60.054 -8.217 4.385
397 H GLY 59 HN GLY 59 60.511 -6.379 8.451
398 1HA GLY 59 HA2 GLY 59 62.583 -6.927 10.162
399 2HA GLY 59 HA1 GLY 59 62.985 -5.308 9.593
400 HA PRO 60 HA PRO 60 59.491 -5.294 12.813
401 1HB PRO 60 HB2 PRO 60 60.835 -5.459 15.189
402 2HB PRO 60 HB1 PRO 60 60.191 -6.883 14.347
403 1HG PRO 60 HG2 PRO 60 62.976 -5.873 14.498
404 2HG PRO 60 HG1 PRO 60 62.377 -7.536 14.427
405 1HD PRO 60 HD2 PRO 60 63.447 -6.152 12.290
406 2HD PRO 60 HD1 PRO 60 62.374 -7.562 12.154
407 H GLY 61 HN GLY 61 60.592 -3.227 11.440
408 1HA GLY 61 HA2 GLY 61 60.283 -0.850 12.293
409 2HA GLY 61 HA1 GLY 61 61.461 -1.274 13.535
410 H CYS 62 HN CYS 62 61.934 -2.585 10.365
411 HA CYS 62 HA CYS 62 64.555 -1.766 9.975
412 1HB CYS 62 HB2 CYS 62 62.496 -3.020 8.559
413 2HB CYS 62 HB1 CYS 62 62.985 -1.681 7.523
414 H LYS 63 HN LYS 63 65.473 0.241 9.803
415 HA LYS 63 HA LYS 63 63.779 2.510 8.803
416 1HB LYS 63 HB2 LYS 63 66.354 2.768 10.352
417 2HB LYS 63 HB1 LYS 63 65.000 3.894 10.272
418 1HG LYS 63 HG2 LYS 63 64.870 1.157 11.564
419 2HG LYS 63 HG1 LYS 63 65.126 2.663 12.443
420 1HD LYS 63 HD2 LYS 63 62.709 2.005 10.738
421 2HD LYS 63 HD1 LYS 63 62.749 2.063 12.500
422 1HE LYS 63 HE2 LYS 63 63.833 4.526 11.693
423 2HE LYS 63 HE1 LYS 63 62.445 4.261 10.620
424 1HZ LYS 63 HZ1 LYS 63 61.287 4.975 12.405
425 2HZ LYS 63 HZ2 LYS 63 62.515 4.577 13.510
426 3HZ LYS 63 HZ3 LYS 63 61.468 3.372 12.928
427 H ILE 64 HN ILE 64 64.667 3.820 7.132
428 HA ILE 64 HA ILE 64 67.424 3.303 6.208
429 HB ILE 64 HB ILE 64 64.951 2.679 4.567
430 1HG1 ILE 64 HG12 ILE 64 67.108 0.991 5.851
431 2HG1 ILE 64 HG11 ILE 64 65.366 0.888 6.101
432 1HG2 ILE 64 HG21 ILE 64 66.625 1.912 2.870
433 2HG2 ILE 64 HG22 ILE 64 67.902 2.602 3.873
434 3HG2 ILE 64 HG23 ILE 64 66.679 3.651 3.154
435 1HD1 ILE 64 HD1 ILE 64 65.062 0.159 3.773
436 2HD1 ILE 64 HD1 ILE 64 66.172 -0.919 4.621
437 3HD1 ILE 64 HD1 ILE 64 66.800 0.290 3.499
438 H SER 65 HN SER 65 68.235 5.253 5.576
439 HA SER 65 HA SER 65 66.371 7.247 4.358
440 1HB SER 65 HB2 SER 65 66.520 8.401 6.296
441 2HB SER 65 HB1 SER 65 67.753 7.305 6.918
442 HG SER 65 HG SER 65 68.201 9.705 6.349
443 H THR 66 HN THR 66 67.239 7.190 2.299
444 HA THR 66 HA THR 66 68.787 7.737 0.601
445 HB THR 66 HB THR 66 70.757 8.563 2.697
446 HG1 THR 66 HG1 THR 66 69.411 9.915 3.543
447 1HG2 THR 66 HG21 THR 66 70.249 8.996 -0.095
448 2HG2 THR 66 HG22 THR 66 71.620 9.546 0.870
449 3HG2 THR 66 HG23 THR 66 70.171 10.544 0.749
450 H CYS 67 HN CYS 67 68.934 5.337 0.398
451 HA CYS 67 HA CYS 67 71.707 4.395 1.025
452 1HB CYS 67 HB2 CYS 67 69.630 3.626 2.538
453 2HB CYS 67 HB1 CYS 67 69.407 2.489 1.213
454 H ILE 68 HN ILE 68 72.594 3.840 -0.930
455 HA ILE 68 HA ILE 68 70.829 3.216 -3.217
456 HB ILE 68 HB ILE 68 73.842 3.486 -2.919
457 1HG1 ILE 68 HG12 ILE 68 73.391 5.623 -4.211
458 2HG1 ILE 68 HG11 ILE 68 71.671 5.350 -3.932
459 1HG2 ILE 68 HG21 ILE 68 72.911 3.882 -5.584
460 2HG2 ILE 68 HG22 ILE 68 72.223 2.366 -4.999
461 3HG2 ILE 68 HG23 ILE 68 73.973 2.604 -4.987
462 1HD1 ILE 68 HD1 ILE 68 71.849 5.711 -1.637
463 2HD1 ILE 68 HD1 ILE 68 73.034 6.859 -2.264
464 3HD1 ILE 68 HD1 ILE 68 73.565 5.311 -1.605
465 H ILE 69 HN ILE 69 70.078 1.223 -2.187
466 HA ILE 69 HA ILE 69 72.010 -0.977 -1.841
467 HB ILE 69 HB ILE 69 68.986 -1.022 -1.675
468 1HG1 ILE 69 HG12 ILE 69 70.811 -0.369 0.652
469 2HG1 ILE 69 HG11 ILE 69 70.147 0.904 -0.366
470 1HG2 ILE 69 HG21 ILE 69 70.649 -3.087 -1.488
471 2HG2 ILE 69 HG22 ILE 69 69.254 -2.949 -0.419
472 3HG2 ILE 69 HG23 ILE 69 70.853 -2.479 0.154
473 1HD1 ILE 69 HD1 ILE 69 68.798 -0.800 1.625
474 2HD1 ILE 69 HD1 ILE 69 67.913 -0.581 0.115
475 3HD1 ILE 69 HD1 ILE 69 68.395 0.824 1.067
476 H THR 70 HN THR 70 71.897 -2.940 -3.096
477 HA THR 70 HA THR 70 70.188 -2.940 -5.530
478 HB THR 70 HB THR 70 73.206 -2.789 -5.416
479 HG1 THR 70 HG1 THR 70 72.174 -1.349 -7.335
480 1HG2 THR 70 HG21 THR 70 71.438 -3.714 -7.695
481 2HG2 THR 70 HG22 THR 70 72.711 -4.638 -6.896
482 3HG2 THR 70 HG23 THR 70 73.126 -3.240 -7.888
483 H GLY 71 HN GLY 71 69.225 -4.920 -4.929
484 1HA GLY 71 HA2 GLY 71 69.208 -7.302 -5.143
485 2HA GLY 71 HA1 GLY 71 70.972 -7.288 -5.140
486 H GLY 72 HN GLY 72 69.000 -5.626 -2.742
487 1HA GLY 72 HA2 GLY 72 68.629 -6.143 -0.464
488 2HA GLY 72 HA1 GLY 72 69.283 -7.752 -0.762
489 H VAL 73 HN VAL 73 71.254 -5.207 -1.909
490 HA VAL 73 HA VAL 73 73.006 -5.437 0.522
491 HB VAL 73 HB VAL 73 74.877 -5.556 -1.012
492 1HG1 VAL 73 HG11 VAL 73 72.623 -7.400 -1.190
493 2HG1 VAL 73 HG12 VAL 73 74.349 -7.750 -1.096
494 3HG1 VAL 73 HG13 VAL 73 73.600 -7.411 -2.656
495 1HG2 VAL 73 HG21 VAL 73 74.527 -4.175 -2.814
496 2HG2 VAL 73 HG22 VAL 73 72.810 -4.572 -2.916
497 3HG2 VAL 73 HG23 VAL 73 74.015 -5.685 -3.567
498 HA PRO 74 HA PRO 74 72.681 -0.990 0.289
499 1HB PRO 74 HB2 PRO 74 74.321 -0.452 2.408
500 2HB PRO 74 HB1 PRO 74 72.647 -0.999 2.606
501 1HG PRO 74 HG2 PRO 74 75.180 -2.522 2.873
502 2HG PRO 74 HG1 PRO 74 73.666 -2.680 3.774
503 1HD PRO 74 HD2 PRO 74 74.460 -4.367 1.747
504 2HD PRO 74 HD1 PRO 74 72.777 -4.132 2.262
505 H ALA 75 HN ALA 75 74.018 0.617 -0.626
506 HA ALA 75 HA ALA 75 76.645 -0.299 -1.645
507 1HB ALA 75 HB1 ALA 75 75.220 0.743 -3.245
508 2HB ALA 75 HB2 ALA 75 76.400 1.986 -2.833
509 3HB ALA 75 HB3 ALA 75 74.785 2.037 -2.127
510 HA PRO 76 HA PRO 76 79.038 1.992 1.232
511 1HB PRO 76 HB2 PRO 76 81.021 3.027 -0.354
512 2HB PRO 76 HB1 PRO 76 80.938 1.313 0.103
513 1HG PRO 76 HG2 PRO 76 80.094 2.636 -2.432
514 2HG PRO 76 HG1 PRO 76 80.927 1.093 -2.190
515 1HD PRO 76 HD2 PRO 76 78.277 1.251 -2.723
516 2HD PRO 76 HD1 PRO 76 78.981 -0.042 -1.723
517 H SER 77 HN SER 77 76.930 3.471 1.064
518 HA SER 77 HA SER 77 77.660 6.158 -0.035
519 1HB SER 77 HB2 SER 77 75.419 4.564 -0.301
520 2HB SER 77 HB1 SER 77 74.937 5.681 0.973
521 HG SER 77 HG SER 77 75.807 7.352 -0.505
522 H ALA 78 HN ALA 78 78.238 7.693 1.444
523 HA ALA 78 HA ALA 78 78.177 7.195 4.297
524 1HB ALA 78 HB1 ALA 78 78.790 9.766 4.156
525 2HB ALA 78 HB2 ALA 78 78.895 9.433 2.427
526 3HB ALA 78 HB3 ALA 78 79.925 8.556 3.558
527 H ALA 79 HN ALA 79 75.705 8.035 2.204
528 HA ALA 79 HA ALA 79 74.346 9.905 4.066
529 1HB ALA 79 HB1 ALA 79 73.505 8.738 1.392
530 2HB ALA 79 HB2 ALA 79 74.427 10.230 1.583
531 3HB ALA 79 HB3 ALA 79 72.780 10.125 2.204
532 H CYS 80 HN CYS 80 74.295 6.531 3.122
533 HA CYS 80 HA CYS 80 71.619 5.950 4.092
534 1HB CYS 80 HB2 CYS 80 72.824 4.596 2.428
535 2HB CYS 80 HB1 CYS 80 74.068 4.221 3.606
536 H LYS 81 HN LYS 81 71.314 4.432 6.040
537 HA LYS 81 HA LYS 81 73.072 5.395 8.258
538 1HB LYS 81 HB2 LYS 81 71.153 5.659 9.458
539 2HB LYS 81 HB1 LYS 81 70.390 5.633 7.874
540 1HG LYS 81 HG2 LYS 81 70.823 3.059 9.401
541 2HG LYS 81 HG1 LYS 81 69.440 4.089 9.744
542 1HD LYS 81 HD2 LYS 81 68.436 3.672 7.726
543 2HD LYS 81 HD1 LYS 81 69.967 3.472 6.878
544 1HE LYS 81 HE2 LYS 81 68.684 1.310 7.123
545 2HE LYS 81 HE1 LYS 81 70.276 1.251 7.902
546 1HZ LYS 81 HZ1 LYS 81 67.724 1.956 9.252
547 2HZ LYS 81 HZ2 LYS 81 69.253 1.908 9.990
548 3HZ LYS 81 HZ3 LYS 81 68.539 0.478 9.411
549 H ILE 82 HN ILE 82 71.485 2.426 7.041
550 HA ILE 82 HA ILE 82 71.892 0.160 7.618
551 HB ILE 82 HB ILE 82 74.675 1.327 7.960
552 1HG1 ILE 82 HG12 ILE 82 73.765 2.095 5.845
553 2HG1 ILE 82 HG11 ILE 82 74.890 0.778 5.507
554 1HG2 ILE 82 HG21 ILE 82 73.756 -1.414 7.040
555 2HG2 ILE 82 HG22 ILE 82 74.356 -1.049 8.659
556 3HG2 ILE 82 HG23 ILE 82 75.426 -0.889 7.265
557 1HD1 ILE 82 HD1 ILE 82 71.876 0.513 5.717
558 2HD1 ILE 82 HD1 ILE 82 73.000 -0.807 5.394
559 3HD1 ILE 82 HD1 ILE 82 72.809 0.495 4.221
560 H SER 83 HN SER 83 70.645 0.694 9.739
561 HA SER 83 HA SER 83 72.515 0.389 12.070
562 1HB SER 83 HB2 SER 83 70.516 2.385 11.411
563 2HB SER 83 HB1 SER 83 70.127 1.597 12.936
564 HG SER 83 HG SER 83 71.672 2.725 13.778
565 H GLY 84 HN GLY 84 68.968 0.381 11.997
566 1HA GLY 84 HA2 GLY 84 69.065 -2.401 13.079
567 2HA GLY 84 HA1 GLY 84 67.781 -1.241 13.418
568 H CYS 85 HN CYS 85 69.193 -1.932 10.231
569 HA CYS 85 HA CYS 85 66.582 -3.162 9.454
570 1HB CYS 85 HB2 CYS 85 66.953 -0.679 8.868
571 2HB CYS 85 HB1 CYS 85 68.184 -1.242 7.747
572 H THR 86 HN THR 86 66.950 -4.123 7.066
573 HA THR 86 HA THR 86 69.604 -5.022 6.361
574 HB THR 86 HB THR 86 69.430 -6.346 8.346
575 HG1 THR 86 HG1 THR 86 70.099 -7.851 7.046
576 1HG2 THR 86 HG21 THR 86 67.410 -7.748 8.791
577 2HG2 THR 86 HG22 THR 86 66.626 -7.006 7.396
578 3HG2 THR 86 HG23 THR 86 67.056 -6.021 8.794
579 H PHE 87 HN PHE 87 69.515 -6.356 4.427
580 HA PHE 87 HA PHE 87 66.770 -6.573 3.231
581 1HB PHE 87 HB2 PHE 87 69.075 -6.239 1.403
582 2HB PHE 87 HB1 PHE 87 67.486 -5.490 1.344
583 HD1 PHE 87 HD1 PHE 87 67.248 -4.057 3.867
584 HD2 PHE 87 HD2 PHE 87 70.687 -4.579 1.345
585 HE1 PHE 87 HE1 PHE 87 68.228 -1.954 4.767
586 HE2 PHE 87 HE2 PHE 87 71.658 -2.493 2.241
587 HZ PHE 87 HZ PHE 87 70.436 -1.176 3.950
588 H SER 88 HN SER 88 66.557 -8.324 1.653
589 HA SER 88 HA SER 88 68.698 -10.403 1.749
590 1HB SER 88 HB2 SER 88 67.001 -10.766 3.557
591 2HB SER 88 HB1 SER 88 65.747 -10.845 2.322
592 HG SER 88 HG SER 88 66.479 -12.750 1.685
593 H ALA 89 HN ALA 89 67.399 -8.468 -0.275
594 HA ALA 89 HA ALA 89 66.771 -8.553 -2.551
595 1HB ALA 89 HB1 ALA 89 68.363 -10.979 -1.909
596 2HB ALA 89 HB2 ALA 89 68.659 -9.732 -3.118
597 3HB ALA 89 HB3 ALA 89 67.487 -11.010 -3.440
598 H ASN 90 HN ASN 90 64.473 -8.531 -1.776
599 HA ASN 90 HA ASN 90 62.969 -10.949 -1.366
600 1HB ASN 90 HB2 ASN 90 61.161 -9.450 -1.205
601 2HB ASN 90 HB1 ASN 90 62.536 -8.430 -0.797
602 1HD2 ASN 90 HD2 ASN 90 63.613 -7.962 -3.384
603 2HD2 ASN 90 HD2 ASN 90 62.487 -7.077 -4.296
Start of MODEL 2
1 1H ASP 1 HT1 ASP 1 48.097 4.426 2.770
2 2H ASP 1 HT2 ASP 1 49.063 3.932 4.078
3 3H ASP 1 HT3 ASP 1 49.397 5.393 3.274
4 HA ASP 1 HA ASP 1 47.869 5.106 5.542
5 1HB ASP 1 HB2 ASP 1 49.222 7.009 4.325
6 2HB ASP 1 HB1 ASP 1 47.655 7.414 3.622
7 H GLY 2 HN GLY 2 46.715 5.795 2.219
8 1HA GLY 2 HA2 GLY 2 43.963 5.113 3.177
9 2HA GLY 2 HA1 GLY 2 44.267 6.354 1.961
10 H SER 3 HN SER 3 44.856 5.697 -0.170
11 HA SER 3 HA SER 3 44.322 2.800 -0.739
12 1HB SER 3 HB2 SER 3 43.712 5.387 -2.168
13 2HB SER 3 HB1 SER 3 43.684 3.848 -3.026
14 HG SER 3 HG SER 3 41.636 4.349 -2.177
15 H CYS 4 HN CYS 4 45.651 5.303 -2.873
16 HA CYS 4 HA CYS 4 47.695 5.376 -4.062
17 1HB CYS 4 HB2 CYS 4 48.210 5.007 -1.396
18 2HB CYS 4 HB1 CYS 4 49.033 3.617 -2.098
19 H THR 5 HN THR 5 49.434 3.773 -5.009
20 HA THR 5 HA THR 5 48.639 0.950 -5.146
21 HB THR 5 HB THR 5 48.259 2.889 -7.450
22 HG1 THR 5 HG1 THR 5 46.124 1.794 -7.297
23 1HG2 THR 5 HG21 THR 5 48.735 -0.022 -7.396
24 2HG2 THR 5 HG22 THR 5 48.899 1.118 -8.731
25 3HG2 THR 5 HG23 THR 5 47.314 0.465 -8.318
26 H ASN 6 HN ASN 6 51.031 3.005 -4.847
27 HA ASN 6 HA ASN 6 53.248 3.248 -5.706
28 1HB ASN 6 HB2 ASN 6 54.300 0.909 -5.494
29 2HB ASN 6 HB1 ASN 6 53.424 1.504 -4.084
30 1HD2 ASN 6 HD2 ASN 6 52.865 -0.460 -7.048
31 2HD2 ASN 6 HD2 ASN 6 51.718 -1.475 -6.324
32 H THR 7 HN THR 7 51.868 3.669 -7.921
33 HA THR 7 HA THR 7 52.129 3.560 -10.274
34 HB THR 7 HB THR 7 53.954 1.208 -10.048
35 HG1 THR 7 HG1 THR 7 54.484 3.787 -9.001
36 1HG2 THR 7 HG21 THR 7 55.302 2.790 -11.553
37 2HG2 THR 7 HG22 THR 7 53.880 3.833 -11.541
38 3HG2 THR 7 HG23 THR 7 53.770 2.201 -12.199
39 H ASN 8 HN ASN 8 52.277 0.258 -8.840
40 HA ASN 8 HA ASN 8 49.667 -0.540 -9.571
41 1HB ASN 8 HB2 ASN 8 51.472 -0.172 -11.769
42 2HB ASN 8 HB1 ASN 8 51.075 -1.884 -11.640
43 1HD2 ASN 8 HD2 ASN 8 49.406 -2.260 -13.115
44 2HD2 ASN 8 HD2 ASN 8 48.012 -1.301 -13.262
45 H SER 9 HN SER 9 50.127 -1.710 -7.550
46 HA SER 9 HA SER 9 50.994 -4.435 -8.008
47 1HB SER 9 HB2 SER 9 52.983 -2.457 -7.403
48 2HB SER 9 HB1 SER 9 52.872 -3.574 -6.046
49 HG SER 9 HG SER 9 53.946 -4.896 -7.261
50 H GLN 10 HN GLN 10 51.681 -2.717 -4.966
51 HA GLN 10 HA GLN 10 49.083 -3.237 -3.786
52 1HB GLN 10 HB2 GLN 10 51.079 -5.350 -3.981
53 2HB GLN 10 HB1 GLN 10 50.616 -5.047 -2.307
54 1HG GLN 10 HG2 GLN 10 48.466 -5.763 -2.628
55 2HG GLN 10 HG1 GLN 10 48.395 -5.144 -4.278
56 1HE2 GLN 10 HE21 GLN 10 50.641 -6.450 -5.420
57 2HE2 GLN 10 HE22 GLN 10 50.373 -8.125 -5.409
58 H LEU 11 HN LEU 11 49.243 -1.287 -2.649
59 HA LEU 11 HA LEU 11 51.632 -0.839 -0.913
60 1HB LEU 11 HB2 LEU 11 50.816 0.907 -2.547
61 2HB LEU 11 HB1 LEU 11 49.317 0.997 -1.620
62 HG LEU 11 HG LEU 11 50.455 1.789 0.327
63 1HD1 LEU 11 HD1 LEU 11 52.938 0.934 -1.166
64 2HD1 LEU 11 HD1 LEU 11 52.395 0.427 0.433
65 3HD1 LEU 11 HD1 LEU 11 53.020 2.059 0.191
66 1HD2 LEU 11 HD2 LEU 11 50.349 3.772 -0.777
67 2HD2 LEU 11 HD2 LEU 11 50.988 3.077 -2.266
68 3HD2 LEU 11 HD2 LEU 11 52.090 3.577 -0.984
69 H SER 12 HN SER 12 51.135 -2.202 0.847
70 HA SER 12 HA SER 12 48.836 -2.921 2.102
71 1HB SER 12 HB2 SER 12 50.386 -3.594 3.595
72 2HB SER 12 HB1 SER 12 51.573 -2.599 2.758
73 HG SER 12 HG SER 12 51.492 -1.872 4.839
74 H ALA 13 HN ALA 13 47.149 -1.962 3.163
75 HA ALA 13 HA ALA 13 46.483 0.742 3.008
76 1HB ALA 13 HB1 ALA 13 45.837 -1.364 5.093
77 2HB ALA 13 HB2 ALA 13 44.925 -1.011 3.626
78 3HB ALA 13 HB3 ALA 13 44.964 0.161 4.944
79 H ASN 14 HN ASN 14 48.751 -0.777 5.174
80 HA ASN 14 HA ASN 14 48.794 1.573 6.990
81 1HB ASN 14 HB2 ASN 14 48.808 -0.533 8.079
82 2HB ASN 14 HB1 ASN 14 49.980 -1.202 6.944
83 1HD2 ASN 14 HD2 ASN 14 52.236 -0.176 7.040
84 2HD2 ASN 14 HD2 ASN 14 52.791 0.376 8.546
85 H SER 15 HN SER 15 50.275 0.713 4.087
86 HA SER 15 HA SER 15 53.004 1.527 4.660
87 1HB SER 15 HB2 SER 15 52.212 0.051 2.780
88 2HB SER 15 HB1 SER 15 51.498 1.471 2.022
89 HG SER 15 HG SER 15 54.221 1.311 2.803
90 H LYS 16 HN LYS 16 53.670 3.428 2.798
91 HA LYS 16 HA LYS 16 51.852 5.756 3.169
92 1HB LYS 16 HB2 LYS 16 54.090 5.135 4.820
93 2HB LYS 16 HB1 LYS 16 54.535 6.533 3.841
94 1HG LYS 16 HG2 LYS 16 53.289 7.840 5.178
95 2HG LYS 16 HG1 LYS 16 51.854 6.935 4.698
96 1HD LYS 16 HD2 LYS 16 52.804 5.177 6.457
97 2HD LYS 16 HD1 LYS 16 53.571 6.618 7.126
98 1HE LYS 16 HE2 LYS 16 51.261 7.725 7.049
99 2HE LYS 16 HE1 LYS 16 50.609 6.101 6.745
100 1HZ LYS 16 HZ1 LYS 16 52.513 6.644 8.946
101 2HZ LYS 16 HZ2 LYS 16 51.508 5.292 8.735
102 3HZ LYS 16 HZ3 LYS 16 50.838 6.794 9.164
103 H CYS 17 HN CYS 17 51.887 6.999 1.333
104 HA CYS 17 HA CYS 17 54.354 7.036 -0.349
105 1HB CYS 17 HB2 CYS 17 52.810 6.760 -2.342
106 2HB CYS 17 HB1 CYS 17 52.927 5.334 -1.312
107 H GLU 18 HN GLU 18 53.816 8.751 -2.242
108 HA GLU 18 HA GLU 18 51.994 10.878 -1.887
109 1HB GLU 18 HB2 GLU 18 54.034 10.677 0.137
110 2HB GLU 18 HB1 GLU 18 54.274 12.167 -0.773
111 1HG GLU 18 HG2 GLU 18 51.548 12.147 -0.443
112 2HG GLU 18 HG1 GLU 18 52.102 11.428 1.069
113 H LYS 19 HN LYS 19 55.497 11.390 -1.963
114 HA LYS 19 HA LYS 19 55.286 12.010 -4.892
115 1HB LYS 19 HB2 LYS 19 55.916 13.651 -2.652
116 2HB LYS 19 HB1 LYS 19 57.413 13.420 -3.555
117 1HG LYS 19 HG2 LYS 19 55.012 13.959 -5.202
118 2HG LYS 19 HG1 LYS 19 55.557 15.301 -4.194
119 1HD LYS 19 HD2 LYS 19 57.875 14.958 -5.111
120 2HD LYS 19 HD1 LYS 19 57.199 13.772 -6.229
121 1HE LYS 19 HE2 LYS 19 55.504 15.773 -6.760
122 2HE LYS 19 HE1 LYS 19 56.886 16.745 -6.214
123 1HZ LYS 19 HZ1 LYS 19 58.316 15.538 -7.720
124 2HZ LYS 19 HZ2 LYS 19 57.024 16.213 -8.594
125 3HZ LYS 19 HZ3 LYS 19 57.026 14.556 -8.221
126 H SER 20 HN SER 20 56.322 9.692 -2.979
127 HA SER 20 HA SER 20 59.164 9.500 -3.596
128 1HB SER 20 HB2 SER 20 57.707 7.051 -2.901
129 2HB SER 20 HB1 SER 20 59.019 7.851 -2.042
130 HG SER 20 HG SER 20 56.289 8.049 -1.724
131 H THR 21 HN THR 21 58.959 6.603 -4.244
132 HA THR 21 HA THR 21 57.712 6.553 -6.929
133 HB THR 21 HB THR 21 60.683 6.460 -6.355
134 HG1 THR 21 HG1 THR 21 59.388 7.937 -8.353
135 1HG2 THR 21 HG21 THR 21 59.848 4.629 -7.930
136 2HG2 THR 21 HG22 THR 21 61.067 5.719 -8.588
137 3HG2 THR 21 HG23 THR 21 59.371 5.928 -9.024
138 H LEU 22 HN LEU 22 56.491 4.779 -5.968
139 HA LEU 22 HA LEU 22 58.081 2.336 -5.285
140 1HB LEU 22 HB2 LEU 22 55.333 3.406 -4.659
141 2HB LEU 22 HB1 LEU 22 55.672 1.686 -4.473
142 HG LEU 22 HG LEU 22 56.021 3.115 -2.390
143 1HD1 LEU 22 HD1 LEU 22 58.594 2.099 -2.376
144 2HD1 LEU 22 HD1 LEU 22 57.787 1.113 -3.596
145 3HD1 LEU 22 HD1 LEU 22 57.138 1.196 -1.959
146 1HD2 LEU 22 HD2 LEU 22 57.902 4.558 -2.262
147 2HD2 LEU 22 HD2 LEU 22 57.145 4.961 -3.803
148 3HD2 LEU 22 HD2 LEU 22 58.581 3.938 -3.766
149 H THR 23 HN THR 23 58.479 1.687 -7.511
150 HA THR 23 HA THR 23 56.135 1.268 -9.278
151 HB THR 23 HB THR 23 59.059 0.657 -9.770
152 HG1 THR 23 HG1 THR 23 57.824 3.032 -9.347
153 1HG2 THR 23 HG21 THR 23 56.595 0.986 -11.429
154 2HG2 THR 23 HG22 THR 23 57.910 -0.177 -11.594
155 3HG2 THR 23 HG23 THR 23 58.140 1.493 -12.112
156 H ASN 24 HN ASN 24 55.330 -0.737 -9.820
157 HA ASN 24 HA ASN 24 54.779 -3.008 -9.359
158 1HB ASN 24 HB2 ASN 24 57.637 -2.790 -10.280
159 2HB ASN 24 HB1 ASN 24 56.949 -4.375 -9.929
160 1HD2 ASN 24 HD2 ASN 24 55.832 -1.386 -11.639
161 2HD2 ASN 24 HD2 ASN 24 55.198 -2.222 -12.974
162 H CYS 25 HN CYS 25 55.377 -1.625 -6.898
163 HA CYS 25 HA CYS 25 57.277 -3.251 -5.372
164 1HB CYS 25 HB2 CYS 25 56.088 -0.726 -5.194
165 2HB CYS 25 HB1 CYS 25 55.384 -1.625 -3.854
166 H TYR 26 HN TYR 26 55.667 -3.312 -2.975
167 HA TYR 26 HA TYR 26 53.228 -4.789 -3.212
168 1HB TYR 26 HB2 TYR 26 54.892 -6.352 -4.324
169 2HB TYR 26 HB1 TYR 26 55.746 -6.440 -2.789
170 HD1 TYR 26 HD1 TYR 26 52.659 -7.356 -4.589
171 HD2 TYR 26 HD2 TYR 26 54.810 -7.623 -0.880
172 HE1 TYR 26 HE1 TYR 26 51.115 -9.140 -3.821
173 HE2 TYR 26 HE2 TYR 26 53.266 -9.402 -0.112
174 HH TYR 26 HH TYR 26 50.657 -10.609 -2.218
175 H VAL 27 HN VAL 27 54.303 -2.729 -1.679
176 HA VAL 27 HA VAL 27 55.496 -3.270 0.789
177 HB VAL 27 HB VAL 27 53.238 -1.314 0.318
178 1HG1 VAL 27 HG11 VAL 27 53.904 -0.964 2.496
179 2HG1 VAL 27 HG12 VAL 27 55.107 0.036 1.681
180 3HG1 VAL 27 HG13 VAL 27 55.528 -1.592 2.212
181 1HG2 VAL 27 HG21 VAL 27 55.325 0.155 -0.389
182 2HG2 VAL 27 HG22 VAL 27 54.527 -0.878 -1.578
183 3HG2 VAL 27 HG23 VAL 27 56.024 -1.410 -0.806
184 H ASP 28 HN ASP 28 54.698 -3.728 2.864
185 HA ASP 28 HA ASP 28 51.870 -4.704 3.061
186 1HB ASP 28 HB2 ASP 28 54.331 -6.159 3.166
187 2HB ASP 28 HB1 ASP 28 53.632 -6.172 4.786
188 H LYS 29 HN LYS 29 54.673 -3.222 4.592
189 HA LYS 29 HA LYS 29 53.033 -1.777 6.508
190 1HB LYS 29 HB2 LYS 29 54.175 -4.391 7.155
191 2HB LYS 29 HB1 LYS 29 54.743 -3.138 8.256
192 1HG LYS 29 HG2 LYS 29 52.512 -2.526 8.869
193 2HG LYS 29 HG1 LYS 29 51.818 -3.491 7.568
194 1HD LYS 29 HD2 LYS 29 53.210 -4.485 10.064
195 2HD LYS 29 HD1 LYS 29 51.539 -4.766 9.578
196 1HE LYS 29 HE2 LYS 29 52.602 -5.874 7.452
197 2HE LYS 29 HE1 LYS 29 54.055 -5.990 8.463
198 1HZ LYS 29 HZ1 LYS 29 52.254 -6.761 10.216
199 2HZ LYS 29 HZ2 LYS 29 52.999 -7.862 9.159
200 3HZ LYS 29 HZ3 LYS 29 51.447 -7.266 8.811
201 H SER 30 HN SER 30 54.515 -0.385 4.944
202 HA SER 30 HA SER 30 57.036 0.213 6.435
203 1HB SER 30 HB2 SER 30 58.243 0.250 4.333
204 2HB SER 30 HB1 SER 30 57.411 -1.294 4.465
205 HG SER 30 HG SER 30 57.135 0.693 2.656
206 H GLU 31 HN GLU 31 57.972 2.310 5.724
207 HA GLU 31 HA GLU 31 55.873 4.271 4.849
208 1HB GLU 31 HB2 GLU 31 57.585 4.068 7.232
209 2HB GLU 31 HB1 GLU 31 57.728 5.630 6.424
210 1HG GLU 31 HG2 GLU 31 55.404 6.071 6.631
211 2HG GLU 31 HG1 GLU 31 55.043 4.391 7.031
212 H VAL 32 HN VAL 32 56.531 4.904 2.808
213 HA VAL 32 HA VAL 32 59.474 5.111 2.295
214 HB VAL 32 HB VAL 32 57.187 4.860 0.329
215 1HG1 VAL 32 HG11 VAL 32 59.023 5.410 -0.952
216 2HG1 VAL 32 HG12 VAL 32 59.284 3.670 -0.833
217 3HG1 VAL 32 HG13 VAL 32 60.169 4.768 0.227
218 1HG2 VAL 32 HG21 VAL 32 58.091 2.950 2.261
219 2HG2 VAL 32 HG22 VAL 32 58.657 2.417 0.677
220 3HG2 VAL 32 HG23 VAL 32 56.938 2.702 0.948
221 H TYR 33 HN TYR 33 60.278 6.989 1.244
222 HA TYR 33 HA TYR 33 58.356 9.283 1.036
223 1HB TYR 33 HB2 TYR 33 61.075 9.017 2.320
224 2HB TYR 33 HB1 TYR 33 60.439 10.595 1.859
225 HD1 TYR 33 HD1 TYR 33 59.918 7.643 4.031
226 HD2 TYR 33 HD2 TYR 33 58.581 11.600 3.027
227 HE1 TYR 33 HE1 TYR 33 58.543 7.701 6.094
228 HE2 TYR 33 HE2 TYR 33 57.205 11.657 5.090
229 HH TYR 33 HH TYR 33 57.202 10.545 7.326
230 H GLY 34 HN GLY 34 61.174 7.624 -0.276
231 1HA GLY 34 HA2 GLY 34 60.799 8.896 -2.857
232 2HA GLY 34 HA1 GLY 34 62.236 9.507 -2.036
233 H THR 35 HN THR 35 61.057 6.207 -1.692
234 HA THR 35 HA THR 35 63.668 5.161 -2.535
235 HB THR 35 HB THR 35 61.058 4.010 -1.542
236 HG1 THR 35 HG1 THR 35 63.308 4.907 -0.434
237 1HG2 THR 35 HG21 THR 35 63.296 2.654 -2.909
238 2HG2 THR 35 HG22 THR 35 61.623 2.135 -2.698
239 3HG2 THR 35 HG23 THR 35 62.788 1.917 -1.390
240 H THR 36 HN THR 36 64.047 3.919 -4.403
241 HA THR 36 HA THR 36 62.004 4.195 -6.559
242 HB THR 36 HB THR 36 64.885 3.298 -6.783
243 HG1 THR 36 HG1 THR 36 65.423 5.454 -6.968
244 1HG2 THR 36 HG21 THR 36 62.708 4.102 -8.601
245 2HG2 THR 36 HG22 THR 36 64.122 3.094 -8.913
246 3HG2 THR 36 HG23 THR 36 64.266 4.852 -8.949
247 H CYS 37 HN CYS 37 60.697 2.408 -5.749
248 HA CYS 37 HA CYS 37 61.772 -0.252 -5.352
249 1HB CYS 37 HB2 CYS 37 59.707 0.752 -4.344
250 2HB CYS 37 HB1 CYS 37 58.953 0.706 -5.934
251 H THR 38 HN THR 38 62.811 -1.071 -7.204
252 HA THR 38 HA THR 38 61.508 -0.872 -9.854
253 HB THR 38 HB THR 38 63.922 -0.573 -9.655
254 HG1 THR 38 HG1 THR 38 63.711 -1.557 -11.514
255 1HG2 THR 38 HG21 THR 38 63.748 -3.216 -8.214
256 2HG2 THR 38 HG22 THR 38 64.494 -1.713 -7.669
257 3HG2 THR 38 HG23 THR 38 65.259 -2.665 -8.939
258 H GLY 39 HN GLY 39 60.297 -2.491 -7.598
259 1HA GLY 39 HA2 GLY 39 58.853 -4.434 -8.187
260 2HA GLY 39 HA1 GLY 39 60.246 -5.123 -9.022
261 H SER 40 HN SER 40 59.485 -3.837 -5.777
262 HA SER 40 HA SER 40 60.691 -6.293 -4.578
263 1HB SER 40 HB2 SER 40 62.472 -4.716 -4.510
264 2HB SER 40 HB1 SER 40 61.385 -3.383 -4.131
265 HG SER 40 HG SER 40 62.633 -4.273 -2.332
266 H ARG 41 HN ARG 41 60.305 -5.858 -1.952
267 HA ARG 41 HA ARG 41 57.656 -4.613 -1.501
268 1HB ARG 41 HB2 ARG 41 56.554 -6.641 -0.978
269 2HB ARG 41 HB1 ARG 41 57.480 -7.028 -2.426
270 1HG ARG 41 HG2 ARG 41 59.346 -7.708 -0.685
271 2HG ARG 41 HG1 ARG 41 57.974 -7.855 0.413
272 1HD ARG 41 HD2 ARG 41 56.966 -9.560 -0.875
273 2HD ARG 41 HD1 ARG 41 57.928 -9.162 -2.314
274 HE ARG 41 HE ARG 41 59.674 -9.832 -0.131
275 1HH1 ARG 41 HH1 ARG 41 57.091 -11.667 -1.103
276 2HH1 ARG 41 HH1 ARG 41 58.014 -13.000 -1.712
277 1HH2 ARG 41 HH2 ARG 41 61.051 -11.343 -1.484
278 2HH2 ARG 41 HH2 ARG 41 60.258 -12.817 -1.927
279 H PHE 42 HN PHE 42 57.180 -4.372 0.764
280 HA PHE 42 HA PHE 42 59.527 -4.866 2.570
281 1HB PHE 42 HB2 PHE 42 57.434 -2.703 2.883
282 2HB PHE 42 HB1 PHE 42 59.047 -2.768 3.591
283 HD1 PHE 42 HD1 PHE 42 57.347 -0.874 1.430
284 HD2 PHE 42 HD2 PHE 42 60.789 -3.444 1.377
285 HE1 PHE 42 HE1 PHE 42 58.246 0.372 -0.513
286 HE2 PHE 42 HE2 PHE 42 61.687 -2.197 -0.570
287 HZ PHE 42 HZ PHE 42 60.413 -0.291 -1.514
288 H ASP 43 HN ASP 43 58.339 -4.406 4.985
289 HA ASP 43 HA ASP 43 55.719 -5.487 5.363
290 1HB ASP 43 HB2 ASP 43 57.369 -7.382 4.400
291 2HB ASP 43 HB1 ASP 43 57.738 -7.548 6.117
292 H GLY 44 HN GLY 44 56.625 -3.400 6.618
293 1HA GLY 44 HA2 GLY 44 56.431 -2.888 9.010
294 2HA GLY 44 HA1 GLY 44 57.321 -4.376 9.345
295 H VAL 45 HN VAL 45 57.893 -1.475 7.285
296 HA VAL 45 HA VAL 45 60.518 -1.172 8.684
297 HB VAL 45 HB VAL 45 61.729 -1.303 6.689
298 1HG1 VAL 45 HG11 VAL 45 60.844 -3.508 7.081
299 2HG1 VAL 45 HG12 VAL 45 60.787 -3.207 5.343
300 3HG1 VAL 45 HG13 VAL 45 59.317 -3.086 6.304
301 1HG2 VAL 45 HG21 VAL 45 59.828 -1.329 4.569
302 2HG2 VAL 45 HG22 VAL 45 61.069 -0.121 4.893
303 3HG2 VAL 45 HG23 VAL 45 59.462 0.062 5.581
304 H THR 46 HN THR 46 61.423 0.907 6.963
305 HA THR 46 HA THR 46 59.411 3.001 6.728
306 HB THR 46 HB THR 46 61.421 3.027 9.007
307 HG1 THR 46 HG1 THR 46 59.388 3.249 10.187
308 1HG2 THR 46 HG21 THR 46 61.216 5.262 9.079
309 2HG2 THR 46 HG22 THR 46 59.457 5.143 9.040
310 3HG2 THR 46 HG23 THR 46 60.370 5.185 7.533
311 H ILE 47 HN ILE 47 61.058 2.221 4.724
312 HA ILE 47 HA ILE 47 63.643 3.562 4.745
313 HB ILE 47 HB ILE 47 63.104 1.545 3.410
314 1HG1 ILE 47 HG12 ILE 47 63.692 3.944 1.648
315 2HG1 ILE 47 HG11 ILE 47 64.881 3.161 2.687
316 1HG2 ILE 47 HG21 ILE 47 60.782 2.012 2.863
317 2HG2 ILE 47 HG22 ILE 47 61.691 1.860 1.359
318 3HG2 ILE 47 HG23 ILE 47 61.246 3.455 1.962
319 1HD1 ILE 47 HD1 ILE 47 63.526 1.167 1.112
320 2HD1 ILE 47 HD1 ILE 47 65.243 1.569 1.141
321 3HD1 ILE 47 HD1 ILE 47 64.154 2.427 0.051
322 H THR 48 HN THR 48 64.180 5.352 3.214
323 HA THR 48 HA THR 48 61.844 7.147 2.663
324 HB THR 48 HB THR 48 63.398 8.999 3.452
325 HG1 THR 48 HG1 THR 48 65.336 8.483 4.048
326 1HG2 THR 48 HG21 THR 48 61.685 8.280 4.947
327 2HG2 THR 48 HG22 THR 48 63.173 8.335 5.894
328 3HG2 THR 48 HG23 THR 48 62.547 6.787 5.324
329 H THR 49 HN THR 49 64.219 9.074 1.868
330 HA THR 49 HA THR 49 64.116 8.575 -0.955
331 HB THR 49 HB THR 49 66.031 10.194 0.756
332 HG1 THR 49 HG1 THR 49 63.767 11.086 -0.670
333 1HG2 THR 49 HG21 THR 49 66.254 11.543 -1.361
334 2HG2 THR 49 HG22 THR 49 65.383 10.260 -2.201
335 3HG2 THR 49 HG23 THR 49 66.950 9.926 -1.460
336 H SER 50 HN SER 50 64.814 6.122 -0.421
337 HA SER 50 HA SER 50 67.788 5.992 -0.811
338 1HB SER 50 HB2 SER 50 67.445 5.172 1.356
339 2HB SER 50 HB1 SER 50 65.878 4.478 0.950
340 HG SER 50 HG SER 50 68.461 3.499 0.519
341 H THR 51 HN THR 51 68.468 4.653 -2.481
342 HA THR 51 HA THR 51 66.382 3.547 -4.271
343 HB THR 51 HB THR 51 69.252 3.183 -4.879
344 HG1 THR 51 HG1 THR 51 68.175 5.795 -4.682
345 1HG2 THR 51 HG21 THR 51 67.648 2.910 -6.632
346 2HG2 THR 51 HG22 THR 51 68.468 4.438 -6.950
347 3HG2 THR 51 HG23 THR 51 66.856 4.435 -6.235
348 H SER 52 HN SER 52 66.236 1.297 -4.757
349 HA SER 52 HA SER 52 68.098 -0.584 -3.416
350 1HB SER 52 HB2 SER 52 65.895 0.309 -2.083
351 2HB SER 52 HB1 SER 52 65.221 -1.092 -2.909
352 HG SER 52 HG SER 52 67.183 -2.196 -2.075
353 H THR 53 HN THR 53 68.392 -2.344 -4.758
354 HA THR 53 HA THR 53 66.350 -2.794 -6.913
355 HB THR 53 HB THR 53 69.054 -3.950 -7.177
356 HG1 THR 53 HG1 THR 53 68.658 -1.141 -7.124
357 1HG2 THR 53 HG21 THR 53 67.174 -2.282 -8.850
358 2HG2 THR 53 HG22 THR 53 67.664 -3.958 -9.100
359 3HG2 THR 53 HG23 THR 53 68.813 -2.651 -9.383
360 H GLY 54 HN GLY 54 65.081 -4.525 -6.313
361 1HA GLY 54 HA2 GLY 54 64.484 -6.634 -5.463
362 2HA GLY 54 HA1 GLY 54 66.041 -7.159 -6.111
363 H SER 55 HN SER 55 64.529 -5.664 -3.261
364 HA SER 55 HA SER 55 66.530 -7.057 -1.557
365 1HB SER 55 HB2 SER 55 66.834 -4.817 -0.356
366 2HB SER 55 HB1 SER 55 67.564 -4.937 -1.954
367 HG SER 55 HG SER 55 65.652 -3.932 -2.773
368 H ARG 56 HN ARG 56 65.542 -7.810 0.302
369 HA ARG 56 HA ARG 56 62.684 -7.182 0.718
370 1HB ARG 56 HB2 ARG 56 64.373 -9.405 0.986
371 2HB ARG 56 HB1 ARG 56 63.967 -8.950 2.641
372 1HG ARG 56 HG2 ARG 56 61.669 -9.249 2.302
373 2HG ARG 56 HG1 ARG 56 61.810 -9.092 0.551
374 1HD ARG 56 HD2 ARG 56 62.618 -11.282 0.286
375 2HD ARG 56 HD1 ARG 56 63.165 -11.384 1.972
376 HE ARG 56 HE ARG 56 60.511 -11.039 2.348
377 1HH1 ARG 56 HH1 ARG 56 62.482 -13.372 0.838
378 2HH1 ARG 56 HH1 ARG 56 61.178 -14.439 0.437
379 1HH2 ARG 56 HH2 ARG 56 58.709 -12.267 1.539
380 2HH2 ARG 56 HH2 ARG 56 59.043 -13.813 0.833
381 H ILE 57 HN ILE 57 62.365 -5.285 1.872
382 HA ILE 57 HA ILE 57 64.243 -4.492 4.012
383 HB ILE 57 HB ILE 57 61.639 -3.242 3.074
384 1HG1 ILE 57 HG12 ILE 57 63.008 -3.439 1.121
385 2HG1 ILE 57 HG11 ILE 57 63.237 -1.790 1.700
386 1HG2 ILE 57 HG21 ILE 57 62.825 -1.149 3.869
387 2HG2 ILE 57 HG22 ILE 57 64.055 -2.197 4.576
388 3HG2 ILE 57 HG23 ILE 57 62.390 -2.278 5.150
389 1HD1 ILE 57 HD1 ILE 57 65.130 -4.102 1.762
390 2HD1 ILE 57 HD1 ILE 57 65.213 -2.928 3.077
391 3HD1 ILE 57 HD1 ILE 57 65.446 -2.403 1.410
392 H SER 58 HN SER 58 61.654 -6.584 3.811
393 HA SER 58 HA SER 58 59.849 -6.150 5.853
394 1HB SER 58 HB2 SER 58 61.300 -8.488 4.729
395 2HB SER 58 HB1 SER 58 60.447 -8.761 6.244
396 HG SER 58 HG SER 58 59.396 -8.790 3.902
397 H GLY 59 HN GLY 59 59.829 -6.458 8.151
398 1HA GLY 59 HA2 GLY 59 61.773 -7.539 9.797
399 2HA GLY 59 HA1 GLY 59 62.361 -5.907 9.486
400 HA PRO 60 HA PRO 60 58.878 -6.049 12.723
401 1HB PRO 60 HB2 PRO 60 60.332 -6.334 15.027
402 2HB PRO 60 HB1 PRO 60 59.648 -7.712 14.140
403 1HG PRO 60 HG2 PRO 60 62.438 -6.679 14.172
404 2HG PRO 60 HG1 PRO 60 61.851 -8.349 14.111
405 1HD PRO 60 HD2 PRO 60 62.783 -6.982 11.932
406 2HD PRO 60 HD1 PRO 60 61.615 -8.318 11.838
407 H GLY 61 HN GLY 61 61.675 -4.421 11.888
408 1HA GLY 61 HA2 GLY 61 60.735 -1.864 12.729
409 2HA GLY 61 HA1 GLY 61 61.979 -2.412 13.857
410 H CYS 62 HN CYS 62 61.910 -3.226 10.425
411 HA CYS 62 HA CYS 62 64.652 -2.489 10.016
412 1HB CYS 62 HB2 CYS 62 62.842 -4.015 8.740
413 2HB CYS 62 HB1 CYS 62 62.703 -2.560 7.755
414 H LYS 63 HN LYS 63 65.525 -0.502 9.562
415 HA LYS 63 HA LYS 63 63.709 1.618 8.472
416 1HB LYS 63 HB2 LYS 63 63.942 1.870 10.910
417 2HB LYS 63 HB1 LYS 63 65.700 1.852 10.753
418 1HG LYS 63 HG2 LYS 63 65.389 3.832 9.129
419 2HG LYS 63 HG1 LYS 63 63.758 3.951 9.790
420 1HD LYS 63 HD2 LYS 63 64.497 4.652 11.855
421 2HD LYS 63 HD1 LYS 63 66.011 3.755 11.735
422 1HE LYS 63 HE2 LYS 63 65.557 6.036 9.836
423 2HE LYS 63 HE1 LYS 63 66.032 6.396 11.508
424 1HZ LYS 63 HZ1 LYS 63 67.528 5.056 9.411
425 2HZ LYS 63 HZ2 LYS 63 67.633 4.337 10.948
426 3HZ LYS 63 HZ3 LYS 63 68.088 5.959 10.732
427 H ILE 64 HN ILE 64 64.601 2.469 6.646
428 HA ILE 64 HA ILE 64 67.586 2.440 6.376
429 HB ILE 64 HB ILE 64 65.366 1.729 4.458
430 1HG1 ILE 64 HG12 ILE 64 67.849 0.158 4.560
431 2HG1 ILE 64 HG11 ILE 64 66.993 0.217 6.102
432 1HG2 ILE 64 HG21 ILE 64 67.324 1.532 2.781
433 2HG2 ILE 64 HG22 ILE 64 68.196 2.605 3.875
434 3HG2 ILE 64 HG23 ILE 64 66.702 3.149 3.112
435 1HD1 ILE 64 HD1 ILE 64 64.892 -0.406 4.877
436 2HD1 ILE 64 HD1 ILE 64 66.131 -1.661 4.848
437 3HD1 ILE 64 HD1 ILE 64 65.869 -0.644 3.430
438 H SER 65 HN SER 65 68.481 4.318 5.406
439 HA SER 65 HA SER 65 66.578 6.463 4.561
440 1HB SER 65 HB2 SER 65 67.510 8.011 6.109
441 2HB SER 65 HB1 SER 65 67.266 6.534 7.039
442 HG SER 65 HG SER 65 69.663 7.509 5.873
443 H THR 66 HN THR 66 67.280 7.312 2.661
444 HA THR 66 HA THR 66 68.706 7.612 0.786
445 HB THR 66 HB THR 66 70.500 8.559 3.036
446 HG1 THR 66 HG1 THR 66 68.563 10.104 1.703
447 1HG2 THR 66 HG21 THR 66 71.635 9.740 1.447
448 2HG2 THR 66 HG22 THR 66 70.180 10.050 0.499
449 3HG2 THR 66 HG23 THR 66 71.002 8.494 0.369
450 H CYS 67 HN CYS 67 69.095 5.320 0.333
451 HA CYS 67 HA CYS 67 71.949 4.606 0.678
452 1HB CYS 67 HB2 CYS 67 70.333 3.753 2.603
453 2HB CYS 67 HB1 CYS 67 69.895 2.540 1.407
454 H ILE 68 HN ILE 68 72.386 4.356 -1.511
455 HA ILE 68 HA ILE 68 70.417 3.300 -3.378
456 HB ILE 68 HB ILE 68 73.403 3.822 -3.500
457 1HG1 ILE 68 HG12 ILE 68 72.668 5.666 -5.000
458 2HG1 ILE 68 HG11 ILE 68 70.988 5.206 -4.719
459 1HG2 ILE 68 HG21 ILE 68 71.520 3.018 -5.737
460 2HG2 ILE 68 HG22 ILE 68 72.737 1.963 -5.019
461 3HG2 ILE 68 HG23 ILE 68 73.234 3.402 -5.911
462 1HD1 ILE 68 HD1 ILE 68 72.865 5.895 -2.452
463 2HD1 ILE 68 HD1 ILE 68 71.103 5.801 -2.417
464 3HD1 ILE 68 HD1 ILE 68 71.897 7.118 -3.276
465 H ILE 69 HN ILE 69 69.838 1.284 -2.374
466 HA ILE 69 HA ILE 69 71.929 -0.745 -1.971
467 HB ILE 69 HB ILE 69 68.919 -0.961 -1.705
468 1HG1 ILE 69 HG12 ILE 69 70.533 -0.422 0.719
469 2HG1 ILE 69 HG11 ILE 69 70.434 0.930 -0.403
470 1HG2 ILE 69 HG21 ILE 69 70.660 -2.959 -1.580
471 2HG2 ILE 69 HG22 ILE 69 69.322 -2.859 -0.438
472 3HG2 ILE 69 HG23 ILE 69 70.932 -2.324 0.043
473 1HD1 ILE 69 HD1 ILE 69 67.835 -0.029 -0.355
474 2HD1 ILE 69 HD1 ILE 69 68.430 1.369 0.540
475 3HD1 ILE 69 HD1 ILE 69 68.363 -0.211 1.318
476 H THR 70 HN THR 70 71.856 -2.828 -3.063
477 HA THR 70 HA THR 70 70.129 -3.118 -5.448
478 HB THR 70 HB THR 70 73.125 -2.677 -5.488
479 HG1 THR 70 HG1 THR 70 70.918 -1.448 -6.774
480 1HG2 THR 70 HG21 THR 70 72.498 -4.621 -6.908
481 2HG2 THR 70 HG22 THR 70 73.074 -3.250 -7.858
482 3HG2 THR 70 HG23 THR 70 71.348 -3.594 -7.764
483 H GLY 71 HN GLY 71 69.426 -5.175 -4.765
484 1HA GLY 71 HA2 GLY 71 69.701 -7.556 -4.867
485 2HA GLY 71 HA1 GLY 71 71.451 -7.325 -4.863
486 H GLY 72 HN GLY 72 69.445 -5.656 -2.559
487 1HA GLY 72 HA2 GLY 72 69.061 -6.103 -0.265
488 2HA GLY 72 HA1 GLY 72 69.868 -7.654 -0.457
489 H VAL 73 HN VAL 73 71.551 -5.004 -1.767
490 HA VAL 73 HA VAL 73 73.338 -4.870 0.652
491 HB VAL 73 HB VAL 73 75.201 -4.957 -0.881
492 1HG1 VAL 73 HG11 VAL 73 73.028 -6.907 -1.708
493 2HG1 VAL 73 HG12 VAL 73 74.240 -7.154 -0.451
494 3HG1 VAL 73 HG13 VAL 73 74.728 -7.077 -2.144
495 1HG2 VAL 73 HG21 VAL 73 74.448 -5.219 -3.421
496 2HG2 VAL 73 HG22 VAL 73 74.654 -3.622 -2.699
497 3HG2 VAL 73 HG23 VAL 73 73.039 -4.317 -2.850
498 HA PRO 74 HA PRO 74 72.597 -0.517 -0.017
499 1HB PRO 74 HB2 PRO 74 74.128 0.398 2.050
500 2HB PRO 74 HB1 PRO 74 72.524 -0.316 2.286
501 1HG PRO 74 HG2 PRO 74 75.197 -1.466 2.790
502 2HG PRO 74 HG1 PRO 74 73.657 -1.794 3.594
503 1HD PRO 74 HD2 PRO 74 74.895 -3.406 1.668
504 2HD PRO 74 HD1 PRO 74 73.211 -3.536 2.219
505 H ALA 75 HN ALA 75 73.783 1.206 -0.973
506 HA ALA 75 HA ALA 75 76.510 0.502 -1.920
507 1HB ALA 75 HB1 ALA 75 76.025 2.636 -3.299
508 2HB ALA 75 HB2 ALA 75 74.402 2.551 -2.618
509 3HB ALA 75 HB3 ALA 75 75.006 1.231 -3.618
510 HA PRO 76 HA PRO 76 78.412 3.205 0.984
511 1HB PRO 76 HB2 PRO 76 80.701 3.816 -0.386
512 2HB PRO 76 HB1 PRO 76 80.421 2.239 0.380
513 1HG PRO 76 HG2 PRO 76 80.169 3.023 -2.479
514 2HG PRO 76 HG1 PRO 76 80.778 1.521 -1.770
515 1HD PRO 76 HD2 PRO 76 78.283 1.778 -2.850
516 2HD PRO 76 HD1 PRO 76 78.687 0.615 -1.568
517 H SER 77 HN SER 77 77.535 5.226 1.270
518 HA SER 77 HA SER 77 78.019 7.270 -0.865
519 1HB SER 77 HB2 SER 77 75.643 6.127 -0.570
520 2HB SER 77 HB1 SER 77 75.507 7.259 0.774
521 HG SER 77 HG SER 77 76.200 7.939 -1.898
522 H ALA 78 HN ALA 78 78.531 6.394 2.313
523 HA ALA 78 HA ALA 78 79.384 7.627 4.144
524 1HB ALA 78 HB1 ALA 78 80.469 9.626 3.564
525 2HB ALA 78 HB2 ALA 78 79.223 10.072 2.398
526 3HB ALA 78 HB3 ALA 78 80.374 8.794 2.012
527 H ALA 79 HN ALA 79 76.369 7.882 2.922
528 HA ALA 79 HA ALA 79 75.500 9.770 5.081
529 1HB ALA 79 HB1 ALA 79 75.118 11.093 3.232
530 2HB ALA 79 HB2 ALA 79 73.624 10.156 3.185
531 3HB ALA 79 HB3 ALA 79 74.978 9.709 2.146
532 H CYS 80 HN CYS 80 74.767 6.949 3.064
533 HA CYS 80 HA CYS 80 72.167 6.337 4.006
534 1HB CYS 80 HB2 CYS 80 72.924 5.088 2.182
535 2HB CYS 80 HB1 CYS 80 74.515 4.836 2.882
536 H LYS 81 HN LYS 81 71.462 4.951 5.714
537 HA LYS 81 HA LYS 81 73.347 4.850 8.024
538 1HB LYS 81 HB2 LYS 81 71.529 5.475 9.243
539 2HB LYS 81 HB1 LYS 81 70.766 5.819 7.695
540 1HG LYS 81 HG2 LYS 81 70.639 3.124 9.080
541 2HG LYS 81 HG1 LYS 81 69.381 4.352 9.200
542 1HD LYS 81 HD2 LYS 81 68.519 3.718 7.232
543 2HD LYS 81 HD1 LYS 81 70.070 3.956 6.435
544 1HE LYS 81 HE2 LYS 81 70.546 1.603 7.756
545 2HE LYS 81 HE1 LYS 81 68.822 1.436 7.371
546 1HZ LYS 81 HZ1 LYS 81 69.709 2.516 5.121
547 2HZ LYS 81 HZ2 LYS 81 69.638 0.837 5.366
548 3HZ LYS 81 HZ3 LYS 81 71.106 1.667 5.576
549 H ILE 82 HN ILE 82 72.774 2.905 9.516
550 HA ILE 82 HA ILE 82 71.955 0.434 8.130
551 HB ILE 82 HB ILE 82 74.768 0.907 9.183
552 1HG1 ILE 82 HG12 ILE 82 74.384 1.889 6.939
553 2HG1 ILE 82 HG11 ILE 82 75.471 0.510 6.857
554 1HG2 ILE 82 HG21 ILE 82 74.534 -1.323 9.644
555 2HG2 ILE 82 HG22 ILE 82 74.890 -1.471 7.923
556 3HG2 ILE 82 HG23 ILE 82 73.221 -1.532 8.486
557 1HD1 ILE 82 HD1 ILE 82 72.500 0.202 6.410
558 2HD1 ILE 82 HD1 ILE 82 73.793 -0.909 5.965
559 3HD1 ILE 82 HD1 ILE 82 73.599 0.614 5.096
560 H SER 83 HN SER 83 70.944 1.910 10.414
561 HA SER 83 HA SER 83 71.850 0.974 12.934
562 1HB SER 83 HB2 SER 83 69.145 1.828 11.874
563 2HB SER 83 HB1 SER 83 69.472 1.580 13.586
564 HG SER 83 HG SER 83 70.107 3.665 11.979
565 H GLY 84 HN GLY 84 68.586 -0.016 12.536
566 1HA GLY 84 HA2 GLY 84 69.455 -2.876 12.621
567 2HA GLY 84 HA1 GLY 84 68.083 -2.251 13.536
568 H CYS 85 HN CYS 85 69.198 -3.150 10.319
569 HA CYS 85 HA CYS 85 66.354 -3.426 9.523
570 1HB CYS 85 HB2 CYS 85 67.620 -1.150 8.917
571 2HB CYS 85 HB1 CYS 85 68.239 -2.129 7.591
572 H THR 86 HN THR 86 67.199 -3.809 6.714
573 HA THR 86 HA THR 86 69.223 -5.729 6.317
574 HB THR 86 HB THR 86 68.325 -7.239 7.849
575 HG1 THR 86 HG1 THR 86 66.571 -8.057 5.875
576 1HG2 THR 86 HG21 THR 86 65.740 -5.911 7.155
577 2HG2 THR 86 HG22 THR 86 66.405 -6.314 8.738
578 3HG2 THR 86 HG23 THR 86 65.669 -7.571 7.745
579 H PHE 87 HN PHE 87 69.217 -6.347 4.130
580 HA PHE 87 HA PHE 87 66.800 -5.501 2.559
581 1HB PHE 87 HB2 PHE 87 69.635 -5.702 1.549
582 2HB PHE 87 HB1 PHE 87 68.301 -4.789 0.854
583 HD1 PHE 87 HD1 PHE 87 67.317 -3.732 3.637
584 HD2 PHE 87 HD2 PHE 87 71.140 -3.807 1.664
585 HE1 PHE 87 HE1 PHE 87 68.028 -1.746 4.950
586 HE2 PHE 87 HE2 PHE 87 71.842 -1.831 2.984
587 HZ PHE 87 HZ PHE 87 70.293 -0.796 4.616
588 H SER 88 HN SER 88 68.995 -8.107 3.279
589 HA SER 88 HA SER 88 69.184 -10.291 2.368
590 1HB SER 88 HB2 SER 88 66.355 -9.448 2.595
591 2HB SER 88 HB1 SER 88 66.627 -10.865 1.584
592 HG SER 88 HG SER 88 66.913 -10.527 4.306
593 H ALA 89 HN ALA 89 66.517 -9.608 0.211
594 HA ALA 89 HA ALA 89 67.552 -8.533 -2.097
595 1HB ALA 89 HB1 ALA 89 69.357 -9.837 -2.545
596 2HB ALA 89 HB2 ALA 89 68.188 -11.055 -3.061
597 3HB ALA 89 HB3 ALA 89 68.829 -11.090 -1.418
598 H ASN 90 HN ASN 90 65.018 -8.567 -1.502
599 HA ASN 90 HA ASN 90 63.481 -10.879 -2.267
600 1HB ASN 90 HB2 ASN 90 61.920 -9.567 -1.294
601 2HB ASN 90 HB1 ASN 90 63.093 -8.262 -1.201
602 1HD2 ASN 90 HD2 ASN 90 60.038 -8.686 -2.122
603 2HD2 ASN 90 HD2 ASN 90 59.946 -7.668 -3.477
Start of MODEL 3
1 1H ASP 1 HT1 ASP 1 46.630 5.434 -1.526
2 2H ASP 1 HT2 ASP 1 48.285 5.073 -1.636
3 3H ASP 1 HT3 ASP 1 47.575 6.158 -2.733
4 HA ASP 1 HA ASP 1 47.031 7.615 -0.751
5 1HB ASP 1 HB2 ASP 1 48.892 5.515 0.399
6 2HB ASP 1 HB1 ASP 1 48.526 7.037 1.213
7 H GLY 2 HN GLY 2 48.796 9.202 -0.046
8 1HA GLY 2 HA2 GLY 2 50.474 10.664 -0.833
9 2HA GLY 2 HA1 GLY 2 51.462 9.204 -0.776
10 H SER 3 HN SER 3 52.559 10.242 -2.667
11 HA SER 3 HA SER 3 51.161 9.484 -5.203
12 1HB SER 3 HB2 SER 3 52.417 12.084 -4.359
13 2HB SER 3 HB1 SER 3 52.403 11.641 -6.064
14 HG SER 3 HG SER 3 50.199 11.929 -4.300
15 H CYS 4 HN CYS 4 52.447 8.016 -6.237
16 HA CYS 4 HA CYS 4 55.293 8.494 -6.641
17 1HB CYS 4 HB2 CYS 4 55.855 6.279 -5.412
18 2HB CYS 4 HB1 CYS 4 55.533 7.700 -4.422
19 H THR 5 HN THR 5 54.655 5.149 -6.423
20 HA THR 5 HA THR 5 53.390 4.917 -9.060
21 HB THR 5 HB THR 5 56.181 3.838 -8.691
22 HG1 THR 5 HG1 THR 5 55.805 6.111 -10.209
23 1HG2 THR 5 HG21 THR 5 56.117 3.470 -11.001
24 2HG2 THR 5 HG22 THR 5 54.850 4.670 -11.253
25 3HG2 THR 5 HG23 THR 5 54.456 3.112 -10.522
26 H ASN 6 HN ASN 6 54.048 3.652 -5.973
27 HA ASN 6 HA ASN 6 54.135 0.864 -6.322
28 1HB ASN 6 HB2 ASN 6 53.293 0.788 -4.096
29 2HB ASN 6 HB1 ASN 6 54.101 2.350 -4.188
30 1HD2 ASN 6 HD2 ASN 6 50.831 0.910 -4.706
31 2HD2 ASN 6 HD2 ASN 6 49.983 2.270 -4.147
32 H THR 7 HN THR 7 51.667 3.181 -7.046
33 HA THR 7 HA THR 7 49.245 1.866 -7.103
34 HB THR 7 HB THR 7 50.749 3.688 -8.970
35 HG1 THR 7 HG1 THR 7 48.401 3.933 -7.391
36 1HG2 THR 7 HG21 THR 7 49.387 2.508 -10.545
37 2HG2 THR 7 HG22 THR 7 48.531 4.010 -10.195
38 3HG2 THR 7 HG23 THR 7 48.005 2.500 -9.450
39 H ASN 8 HN ASN 8 51.559 1.802 -9.835
40 HA ASN 8 HA ASN 8 50.388 -0.322 -11.285
41 1HB ASN 8 HB2 ASN 8 53.095 0.929 -10.996
42 2HB ASN 8 HB1 ASN 8 52.977 -0.574 -11.911
43 1HD2 ASN 8 HD2 ASN 8 53.205 0.286 -14.046
44 2HD2 ASN 8 HD2 ASN 8 52.107 1.391 -14.720
45 H SER 9 HN SER 9 52.464 -0.284 -8.446
46 HA SER 9 HA SER 9 52.911 -3.205 -8.519
47 1HB SER 9 HB2 SER 9 54.421 -2.735 -6.784
48 2HB SER 9 HB1 SER 9 54.441 -1.238 -7.707
49 HG SER 9 HG SER 9 54.155 -0.989 -5.396
50 H GLN 10 HN GLN 10 52.537 -2.646 -5.324
51 HA GLN 10 HA GLN 10 49.592 -3.221 -5.338
52 1HB GLN 10 HB2 GLN 10 51.578 -5.064 -4.962
53 2HB GLN 10 HB1 GLN 10 51.268 -4.557 -3.301
54 1HG GLN 10 HG2 GLN 10 48.852 -4.996 -3.629
55 2HG GLN 10 HG1 GLN 10 49.184 -5.544 -5.273
56 1HE2 GLN 10 HE21 GLN 10 51.269 -6.211 -2.450
57 2HE2 GLN 10 HE22 GLN 10 51.026 -7.891 -2.464
58 H LEU 11 HN LEU 11 52.072 -2.960 -2.766
59 HA LEU 11 HA LEU 11 52.122 -1.595 -0.836
60 1HB LEU 11 HB2 LEU 11 52.376 0.136 -2.557
61 2HB LEU 11 HB1 LEU 11 50.625 0.200 -2.775
62 HG LEU 11 HG LEU 11 50.522 0.726 -0.246
63 1HD1 LEU 11 HD1 LEU 11 52.912 0.086 0.159
64 2HD1 LEU 11 HD1 LEU 11 52.526 1.714 0.717
65 3HD1 LEU 11 HD1 LEU 11 53.407 1.485 -0.794
66 1HD2 LEU 11 HD2 LEU 11 50.553 3.030 -0.705
67 2HD2 LEU 11 HD2 LEU 11 50.304 2.329 -2.302
68 3HD2 LEU 11 HD2 LEU 11 51.908 2.885 -1.823
69 H SER 12 HN SER 12 50.855 -2.391 0.801
70 HA SER 12 HA SER 12 48.017 -2.856 0.593
71 1HB SER 12 HB2 SER 12 49.334 -4.147 2.107
72 2HB SER 12 HB1 SER 12 50.036 -2.707 2.839
73 HG SER 12 HG SER 12 48.064 -3.967 3.793
74 H ALA 13 HN ALA 13 46.351 -1.739 1.923
75 HA ALA 13 HA ALA 13 46.425 1.126 1.633
76 1HB ALA 13 HB1 ALA 13 44.548 -0.854 2.003
77 2HB ALA 13 HB2 ALA 13 44.208 0.875 2.100
78 3HB ALA 13 HB3 ALA 13 44.534 -0.042 3.570
79 H ASN 14 HN ASN 14 47.839 -0.908 3.945
80 HA ASN 14 HA ASN 14 47.652 1.083 6.150
81 1HB ASN 14 HB2 ASN 14 47.241 -1.227 6.719
82 2HB ASN 14 HB1 ASN 14 48.704 -1.749 5.883
83 1HD2 ASN 14 HD2 ASN 14 50.116 -2.424 7.515
84 2HD2 ASN 14 HD2 ASN 14 50.487 -1.521 8.904
85 H SER 15 HN SER 15 49.724 0.236 3.564
86 HA SER 15 HA SER 15 52.267 0.881 4.838
87 1HB SER 15 HB2 SER 15 52.013 -0.602 2.871
88 2HB SER 15 HB1 SER 15 51.393 0.751 1.930
89 HG SER 15 HG SER 15 53.890 0.865 3.249
90 H LYS 16 HN LYS 16 53.422 2.664 3.015
91 HA LYS 16 HA LYS 16 51.729 5.098 2.946
92 1HB LYS 16 HB2 LYS 16 53.831 4.464 4.914
93 2HB LYS 16 HB1 LYS 16 54.012 6.048 4.158
94 1HG LYS 16 HG2 LYS 16 51.351 6.082 4.652
95 2HG LYS 16 HG1 LYS 16 51.889 5.053 5.980
96 1HD LYS 16 HD2 LYS 16 52.191 7.107 6.979
97 2HD LYS 16 HD1 LYS 16 53.758 6.958 6.186
98 1HE LYS 16 HE2 LYS 16 53.327 8.778 4.914
99 2HE LYS 16 HE1 LYS 16 51.814 8.053 4.335
100 1HZ LYS 16 HZ1 LYS 16 50.994 8.601 6.709
101 2HZ LYS 16 HZ2 LYS 16 51.053 9.847 5.554
102 3HZ LYS 16 HZ3 LYS 16 52.275 9.713 6.728
103 H CYS 17 HN CYS 17 52.294 6.355 1.187
104 HA CYS 17 HA CYS 17 55.010 5.969 -0.017
105 1HB CYS 17 HB2 CYS 17 52.917 4.694 -1.013
106 2HB CYS 17 HB1 CYS 17 52.552 6.268 -1.718
107 H GLU 18 HN GLU 18 53.856 8.152 1.640
108 HA GLU 18 HA GLU 18 52.984 10.402 0.169
109 1HB GLU 18 HB2 GLU 18 53.659 9.756 2.763
110 2HB GLU 18 HB1 GLU 18 54.924 10.909 2.332
111 1HG GLU 18 HG2 GLU 18 52.159 11.639 1.526
112 2HG GLU 18 HG1 GLU 18 52.501 11.671 3.257
113 H LYS 19 HN LYS 19 54.023 11.606 -1.394
114 HA LYS 19 HA LYS 19 55.778 12.250 -2.869
115 1HB LYS 19 HB2 LYS 19 56.574 12.691 -0.019
116 2HB LYS 19 HB1 LYS 19 57.806 12.948 -1.253
117 1HG LYS 19 HG2 LYS 19 55.055 14.218 -1.312
118 2HG LYS 19 HG1 LYS 19 56.506 15.021 -0.713
119 1HD LYS 19 HD2 LYS 19 57.205 15.495 -2.800
120 2HD LYS 19 HD1 LYS 19 56.965 13.828 -3.324
121 1HE LYS 19 HE2 LYS 19 55.016 14.359 -4.357
122 2HE LYS 19 HE1 LYS 19 54.419 15.208 -2.916
123 1HZ LYS 19 HZ1 LYS 19 56.625 16.451 -4.363
124 2HZ LYS 19 HZ2 LYS 19 55.302 17.170 -3.576
125 3HZ LYS 19 HZ3 LYS 19 55.109 16.494 -5.124
126 H SER 20 HN SER 20 56.204 10.150 -3.863
127 HA SER 20 HA SER 20 58.861 9.071 -3.178
128 1HB SER 20 HB2 SER 20 56.294 7.867 -2.386
129 2HB SER 20 HB1 SER 20 57.380 6.750 -3.206
130 HG SER 20 HG SER 20 58.080 6.651 -1.173
131 H THR 21 HN THR 21 58.936 6.808 -4.617
132 HA THR 21 HA THR 21 57.595 7.132 -7.227
133 HB THR 21 HB THR 21 60.614 7.231 -7.017
134 HG1 THR 21 HG1 THR 21 59.692 9.555 -7.774
135 1HG2 THR 21 HG21 THR 21 60.012 8.419 -9.338
136 2HG2 THR 21 HG22 THR 21 58.575 7.407 -9.187
137 3HG2 THR 21 HG23 THR 21 60.176 6.668 -9.206
138 H LEU 22 HN LEU 22 56.943 4.962 -6.144
139 HA LEU 22 HA LEU 22 58.938 2.853 -5.996
140 1HB LEU 22 HB2 LEU 22 55.908 2.764 -6.115
141 2HB LEU 22 HB1 LEU 22 56.952 1.466 -5.552
142 HG LEU 22 HG LEU 22 56.221 4.036 -4.210
143 1HD1 LEU 22 HD1 LEU 22 57.011 1.791 -2.556
144 2HD1 LEU 22 HD1 LEU 22 55.852 1.281 -3.784
145 3HD1 LEU 22 HD1 LEU 22 55.442 2.589 -2.672
146 1HD2 LEU 22 HD2 LEU 22 58.239 3.828 -2.738
147 2HD2 LEU 22 HD2 LEU 22 58.645 4.278 -4.392
148 3HD2 LEU 22 HD2 LEU 22 58.885 2.619 -3.848
149 H THR 23 HN THR 23 56.323 1.495 -7.557
150 HA THR 23 HA THR 23 56.191 1.785 -10.212
151 HB THR 23 HB THR 23 58.998 1.010 -9.470
152 HG1 THR 23 HG1 THR 23 58.138 2.302 -11.805
153 1HG2 THR 23 HG21 THR 23 57.561 0.050 -11.960
154 2HG2 THR 23 HG22 THR 23 58.342 -0.949 -10.734
155 3HG2 THR 23 HG23 THR 23 59.316 0.079 -11.787
156 H ASN 24 HN ASN 24 57.884 -0.861 -8.485
157 HA ASN 24 HA ASN 24 55.525 -2.629 -9.036
158 1HB ASN 24 HB2 ASN 24 58.488 -3.041 -9.487
159 2HB ASN 24 HB1 ASN 24 57.381 -4.408 -9.358
160 1HD2 ASN 24 HD2 ASN 24 58.919 -2.939 -11.724
161 2HD2 ASN 24 HD2 ASN 24 57.722 -2.847 -12.924
162 H CYS 25 HN CYS 25 56.270 -1.174 -6.564
163 HA CYS 25 HA CYS 25 57.613 -2.914 -4.706
164 1HB CYS 25 HB2 CYS 25 56.763 -0.330 -4.734
165 2HB CYS 25 HB1 CYS 25 55.498 -1.051 -3.757
166 H TYR 26 HN TYR 26 55.825 -2.982 -2.566
167 HA TYR 26 HA TYR 26 53.344 -4.374 -3.245
168 1HB TYR 26 HB2 TYR 26 55.830 -5.796 -2.235
169 2HB TYR 26 HB1 TYR 26 54.216 -6.469 -2.014
170 HD1 TYR 26 HD1 TYR 26 52.721 -6.416 -4.258
171 HD2 TYR 26 HD2 TYR 26 57.014 -6.462 -4.118
172 HE1 TYR 26 HE1 TYR 26 52.787 -7.325 -6.566
173 HE2 TYR 26 HE2 TYR 26 57.080 -7.369 -6.426
174 HH TYR 26 HH TYR 26 54.937 -7.174 -8.541
175 H VAL 27 HN VAL 27 55.888 -4.139 -0.804
176 HA VAL 27 HA VAL 27 55.807 -3.612 1.491
177 HB VAL 27 HB VAL 27 53.774 -1.612 0.479
178 1HG1 VAL 27 HG11 VAL 27 54.180 -1.082 2.694
179 2HG1 VAL 27 HG12 VAL 27 55.500 -0.194 1.932
180 3HG1 VAL 27 HG13 VAL 27 55.804 -1.768 2.668
181 1HG2 VAL 27 HG21 VAL 27 56.026 -0.332 -0.075
182 2HG2 VAL 27 HG22 VAL 27 55.336 -1.447 -1.255
183 3HG2 VAL 27 HG23 VAL 27 56.674 -1.964 -0.227
184 H ASP 28 HN ASP 28 54.133 -2.928 3.281
185 HA ASP 28 HA ASP 28 51.425 -3.907 3.182
186 1HB ASP 28 HB2 ASP 28 53.394 -5.878 3.223
187 2HB ASP 28 HB1 ASP 28 52.927 -5.735 4.918
188 H LYS 29 HN LYS 29 54.330 -3.255 5.064
189 HA LYS 29 HA LYS 29 52.742 -1.699 7.032
190 1HB LYS 29 HB2 LYS 29 54.401 -4.179 7.542
191 2HB LYS 29 HB1 LYS 29 54.105 -3.006 8.825
192 1HG LYS 29 HG2 LYS 29 51.641 -3.252 8.395
193 2HG LYS 29 HG1 LYS 29 52.016 -4.541 7.250
194 1HD LYS 29 HD2 LYS 29 53.150 -4.687 10.023
195 2HD LYS 29 HD1 LYS 29 51.461 -5.128 9.762
196 1HE LYS 29 HE2 LYS 29 52.197 -6.720 7.968
197 2HE LYS 29 HE1 LYS 29 53.882 -6.356 8.396
198 1HZ LYS 29 HZ1 LYS 29 53.549 -7.115 10.586
199 2HZ LYS 29 HZ2 LYS 29 52.848 -8.303 9.594
200 3HZ LYS 29 HZ3 LYS 29 51.863 -7.180 10.404
201 H SER 30 HN SER 30 54.350 -0.472 5.202
202 HA SER 30 HA SER 30 56.829 0.163 6.765
203 1HB SER 30 HB2 SER 30 56.494 -0.361 3.804
204 2HB SER 30 HB1 SER 30 57.968 0.273 4.526
205 HG SER 30 HG SER 30 56.683 -2.178 5.186
206 H GLU 31 HN GLU 31 57.785 2.255 6.164
207 HA GLU 31 HA GLU 31 55.764 4.241 5.164
208 1HB GLU 31 HB2 GLU 31 56.980 3.974 7.679
209 2HB GLU 31 HB1 GLU 31 57.887 5.265 6.891
210 1HG GLU 31 HG2 GLU 31 55.692 6.353 6.308
211 2HG GLU 31 HG1 GLU 31 54.890 5.140 7.305
212 H VAL 32 HN VAL 32 56.504 4.663 3.080
213 HA VAL 32 HA VAL 32 59.457 4.949 2.682
214 HB VAL 32 HB VAL 32 57.223 4.519 0.680
215 1HG1 VAL 32 HG11 VAL 32 59.606 5.392 0.034
216 2HG1 VAL 32 HG12 VAL 32 58.899 4.064 -0.881
217 3HG1 VAL 32 HG13 VAL 32 60.108 3.733 0.359
218 1HG2 VAL 32 HG21 VAL 32 57.050 2.474 1.644
219 2HG2 VAL 32 HG22 VAL 32 58.514 2.709 2.599
220 3HG2 VAL 32 HG23 VAL 32 58.629 2.143 0.932
221 H TYR 33 HN TYR 33 60.173 6.685 1.219
222 HA TYR 33 HA TYR 33 58.298 8.890 0.630
223 1HB TYR 33 HB2 TYR 33 60.558 9.054 2.647
224 2HB TYR 33 HB1 TYR 33 59.707 10.461 2.012
225 HD1 TYR 33 HD1 TYR 33 57.220 10.676 2.384
226 HD2 TYR 33 HD2 TYR 33 59.603 7.695 4.353
227 HE1 TYR 33 HE1 TYR 33 55.420 10.345 4.058
228 HE2 TYR 33 HE2 TYR 33 57.804 7.363 6.028
229 HH TYR 33 HH TYR 33 55.898 8.305 6.886
230 H GLY 34 HN GLY 34 59.864 7.290 -1.133
231 1HA GLY 34 HA2 GLY 34 60.915 8.739 -3.056
232 2HA GLY 34 HA1 GLY 34 62.163 9.045 -1.850
233 H THR 35 HN THR 35 60.506 5.942 -2.207
234 HA THR 35 HA THR 35 63.139 4.669 -2.725
235 HB THR 35 HB THR 35 60.386 3.743 -1.894
236 HG1 THR 35 HG1 THR 35 61.875 4.643 -0.362
237 1HG2 THR 35 HG21 THR 35 62.768 2.114 -2.771
238 2HG2 THR 35 HG22 THR 35 61.095 1.977 -3.311
239 3HG2 THR 35 HG23 THR 35 61.543 1.461 -1.685
240 H THR 36 HN THR 36 63.547 3.480 -4.608
241 HA THR 36 HA THR 36 61.707 3.970 -6.891
242 HB THR 36 HB THR 36 64.540 2.921 -6.588
243 HG1 THR 36 HG1 THR 36 64.313 5.129 -6.267
244 1HG2 THR 36 HG21 THR 36 62.681 2.780 -8.839
245 2HG2 THR 36 HG22 THR 36 64.246 1.995 -8.626
246 3HG2 THR 36 HG23 THR 36 64.163 3.647 -9.241
247 H CYS 37 HN CYS 37 60.504 2.200 -5.196
248 HA CYS 37 HA CYS 37 61.116 -0.524 -5.249
249 1HB CYS 37 HB2 CYS 37 58.704 1.171 -5.017
250 2HB CYS 37 HB1 CYS 37 58.391 -0.504 -5.478
251 H THR 38 HN THR 38 62.080 -1.002 -7.346
252 HA THR 38 HA THR 38 60.170 -1.044 -9.647
253 HB THR 38 HB THR 38 62.311 0.101 -9.985
254 HG1 THR 38 HG1 THR 38 61.436 -1.292 -11.652
255 1HG2 THR 38 HG21 THR 38 64.006 -0.634 -8.679
256 2HG2 THR 38 HG22 THR 38 64.266 -1.845 -9.934
257 3HG2 THR 38 HG23 THR 38 63.295 -2.240 -8.516
258 H GLY 39 HN GLY 39 59.989 -2.961 -7.439
259 1HA GLY 39 HA2 GLY 39 59.256 -5.304 -8.148
260 2HA GLY 39 HA1 GLY 39 60.893 -5.470 -8.783
261 H SER 40 HN SER 40 59.712 -4.040 -5.729
262 HA SER 40 HA SER 40 61.165 -6.169 -4.213
263 1HB SER 40 HB2 SER 40 61.510 -3.473 -3.126
264 2HB SER 40 HB1 SER 40 62.723 -4.703 -3.457
265 HG SER 40 HG SER 40 62.665 -2.621 -4.746
266 H ARG 41 HN ARG 41 60.543 -6.030 -1.810
267 HA ARG 41 HA ARG 41 57.951 -4.635 -1.331
268 1HB ARG 41 HB2 ARG 41 56.893 -6.729 -0.686
269 2HB ARG 41 HB1 ARG 41 57.570 -6.922 -2.304
270 1HG ARG 41 HG2 ARG 41 59.565 -8.009 -1.354
271 2HG ARG 41 HG1 ARG 41 58.910 -7.805 0.271
272 1HD ARG 41 HD2 ARG 41 57.609 -9.650 0.053
273 2HD ARG 41 HD1 ARG 41 56.987 -9.095 -1.513
274 HE ARG 41 HE ARG 41 59.486 -9.824 -2.228
275 1HH1 ARG 41 HH1 ARG 41 56.744 -11.536 -1.855
276 2HH1 ARG 41 HH1 ARG 41 57.476 -13.055 -1.463
277 1HH2 ARG 41 HH2 ARG 41 60.637 -11.713 -0.990
278 2HH2 ARG 41 HH2 ARG 41 59.679 -13.154 -0.970
279 H PHE 42 HN PHE 42 57.492 -4.350 0.927
280 HA PHE 42 HA PHE 42 59.808 -4.937 2.746
281 1HB PHE 42 HB2 PHE 42 57.733 -2.753 3.040
282 2HB PHE 42 HB1 PHE 42 59.312 -2.856 3.817
283 HD1 PHE 42 HD1 PHE 42 57.824 -0.801 1.743
284 HD2 PHE 42 HD2 PHE 42 61.051 -3.629 1.549
285 HE1 PHE 42 HE1 PHE 42 58.830 0.477 -0.126
286 HE2 PHE 42 HE2 PHE 42 62.055 -2.349 -0.325
287 HZ PHE 42 HZ PHE 42 60.946 -0.298 -1.154
288 H ASP 43 HN ASP 43 58.630 -4.427 5.161
289 HA ASP 43 HA ASP 43 56.014 -5.545 5.551
290 1HB ASP 43 HB2 ASP 43 57.643 -7.440 4.662
291 2HB ASP 43 HB1 ASP 43 58.169 -7.476 6.345
292 H GLY 44 HN GLY 44 57.115 -3.339 6.686
293 1HA GLY 44 HA2 GLY 44 56.747 -2.774 9.086
294 2HA GLY 44 HA1 GLY 44 57.668 -4.222 9.485
295 H VAL 45 HN VAL 45 58.163 -1.314 7.423
296 HA VAL 45 HA VAL 45 60.778 -0.929 8.819
297 HB VAL 45 HB VAL 45 61.982 -0.948 6.797
298 1HG1 VAL 45 HG11 VAL 45 61.238 -3.210 7.304
299 2HG1 VAL 45 HG12 VAL 45 61.233 -2.980 5.555
300 3HG1 VAL 45 HG13 VAL 45 59.717 -2.933 6.454
301 1HG2 VAL 45 HG21 VAL 45 59.333 -0.669 5.345
302 2HG2 VAL 45 HG22 VAL 45 60.915 -0.774 4.575
303 3HG2 VAL 45 HG23 VAL 45 60.516 0.618 5.584
304 H THR 46 HN THR 46 61.714 1.256 7.503
305 HA THR 46 HA THR 46 59.516 3.240 7.246
306 HB THR 46 HB THR 46 61.798 3.472 9.234
307 HG1 THR 46 HG1 THR 46 60.151 3.130 10.769
308 1HG2 THR 46 HG21 THR 46 59.500 5.228 8.425
309 2HG2 THR 46 HG22 THR 46 61.184 5.663 8.716
310 3HG2 THR 46 HG23 THR 46 60.119 5.304 10.075
311 H ILE 47 HN ILE 47 61.108 2.401 5.149
312 HA ILE 47 HA ILE 47 63.566 3.868 4.814
313 HB ILE 47 HB ILE 47 62.867 1.829 3.573
314 1HG1 ILE 47 HG12 ILE 47 63.109 3.976 1.494
315 2HG1 ILE 47 HG11 ILE 47 64.420 3.774 2.655
316 1HG2 ILE 47 HG21 ILE 47 60.897 3.733 2.269
317 2HG2 ILE 47 HG22 ILE 47 60.484 2.380 3.323
318 3HG2 ILE 47 HG23 ILE 47 61.210 2.079 1.744
319 1HD1 ILE 47 HD1 ILE 47 64.923 1.617 1.917
320 2HD1 ILE 47 HD1 ILE 47 64.457 2.406 0.410
321 3HD1 ILE 47 HD1 ILE 47 63.310 1.364 1.251
322 H THR 48 HN THR 48 63.735 5.509 2.901
323 HA THR 48 HA THR 48 61.364 7.317 2.762
324 HB THR 48 HB THR 48 63.075 9.197 3.228
325 HG1 THR 48 HG1 THR 48 65.020 8.594 3.679
326 1HG2 THR 48 HG21 THR 48 61.598 8.930 4.978
327 2HG2 THR 48 HG22 THR 48 63.089 8.440 5.781
328 3HG2 THR 48 HG23 THR 48 61.973 7.218 5.174
329 H THR 49 HN THR 49 64.492 8.495 1.830
330 HA THR 49 HA THR 49 63.724 8.207 -1.046
331 HB THR 49 HB THR 49 65.546 10.052 0.525
332 HG1 THR 49 HG1 THR 49 63.334 10.577 -1.166
333 1HG2 THR 49 HG21 THR 49 65.603 11.136 -1.919
334 2HG2 THR 49 HG22 THR 49 65.428 9.447 -2.392
335 3HG2 THR 49 HG23 THR 49 66.799 9.947 -1.401
336 H SER 50 HN SER 50 64.575 5.835 -0.628
337 HA SER 50 HA SER 50 67.557 5.822 -0.984
338 1HB SER 50 HB2 SER 50 65.610 4.025 0.450
339 2HB SER 50 HB1 SER 50 67.196 3.427 -0.034
340 HG SER 50 HG SER 50 66.606 4.825 2.096
341 H THR 51 HN THR 51 68.399 4.477 -2.603
342 HA THR 51 HA THR 51 66.430 3.520 -4.635
343 HB THR 51 HB THR 51 69.267 3.336 -5.275
344 HG1 THR 51 HG1 THR 51 68.206 5.807 -4.377
345 1HG2 THR 51 HG21 THR 51 67.821 5.396 -6.673
346 2HG2 THR 51 HG22 THR 51 66.806 3.964 -6.509
347 3HG2 THR 51 HG23 THR 51 68.388 3.840 -7.277
348 H SER 52 HN SER 52 65.984 1.355 -4.597
349 HA SER 52 HA SER 52 68.152 -0.549 -3.814
350 1HB SER 52 HB2 SER 52 65.457 -1.240 -2.866
351 2HB SER 52 HB1 SER 52 66.987 -1.263 -1.996
352 HG SER 52 HG SER 52 66.686 0.771 -1.393
353 H THR 53 HN THR 53 68.186 -2.371 -5.117
354 HA THR 53 HA THR 53 65.853 -2.767 -6.970
355 HB THR 53 HB THR 53 68.738 -3.476 -7.531
356 HG1 THR 53 HG1 THR 53 68.821 -1.422 -8.580
357 1HG2 THR 53 HG21 THR 53 66.186 -3.427 -9.000
358 2HG2 THR 53 HG22 THR 53 67.652 -4.353 -9.319
359 3HG2 THR 53 HG23 THR 53 67.528 -2.681 -9.865
360 H GLY 54 HN GLY 54 64.929 -4.362 -5.510
361 1HA GLY 54 HA2 GLY 54 64.567 -6.687 -5.125
362 2HA GLY 54 HA1 GLY 54 66.170 -7.018 -5.788
363 H SER 55 HN SER 55 64.549 -5.628 -2.939
364 HA SER 55 HA SER 55 66.674 -6.800 -1.221
365 1HB SER 55 HB2 SER 55 66.611 -4.401 -0.111
366 2HB SER 55 HB1 SER 55 67.610 -4.691 -1.532
367 HG SER 55 HG SER 55 65.238 -3.262 -1.256
368 H ARG 56 HN ARG 56 65.630 -7.800 0.452
369 HA ARG 56 HA ARG 56 62.823 -7.089 1.055
370 1HB ARG 56 HB2 ARG 56 64.319 -9.420 0.944
371 2HB ARG 56 HB1 ARG 56 64.175 -9.131 2.677
372 1HG ARG 56 HG2 ARG 56 61.631 -8.584 1.552
373 2HG ARG 56 HG1 ARG 56 62.176 -10.110 0.856
374 1HD ARG 56 HD2 ARG 56 62.600 -9.754 3.791
375 2HD ARG 56 HD1 ARG 56 60.935 -10.028 3.238
376 HE ARG 56 HE ARG 56 63.181 -11.828 2.407
377 1HH1 ARG 56 HH1 ARG 56 60.438 -11.441 4.366
378 2HH1 ARG 56 HH1 ARG 56 59.763 -12.993 4.000
379 1HH2 ARG 56 HH2 ARG 56 62.128 -13.747 1.580
380 2HH2 ARG 56 HH2 ARG 56 60.716 -14.296 2.418
381 H ILE 57 HN ILE 57 62.958 -5.110 2.215
382 HA ILE 57 HA ILE 57 64.825 -4.833 4.473
383 HB ILE 57 HB ILE 57 62.532 -3.097 3.473
384 1HG1 ILE 57 HG12 ILE 57 65.171 -2.117 2.866
385 2HG1 ILE 57 HG11 ILE 57 65.008 -3.764 2.253
386 1HG2 ILE 57 HG21 ILE 57 64.910 -1.929 4.804
387 2HG2 ILE 57 HG22 ILE 57 63.842 -2.856 5.853
388 3HG2 ILE 57 HG23 ILE 57 63.211 -1.483 4.946
389 1HD1 ILE 57 HD1 ILE 57 62.821 -1.748 1.799
390 2HD1 ILE 57 HD1 ILE 57 63.187 -3.210 0.881
391 3HD1 ILE 57 HD1 ILE 57 64.228 -1.794 0.737
392 H SER 58 HN SER 58 62.390 -6.825 4.294
393 HA SER 58 HA SER 58 60.325 -6.295 6.050
394 1HB SER 58 HB2 SER 58 61.834 -8.572 5.081
395 2HB SER 58 HB1 SER 58 61.322 -8.845 6.743
396 HG SER 58 HG SER 58 59.433 -9.231 5.923
397 H GLY 59 HN GLY 59 60.076 -6.404 8.360
398 1HA GLY 59 HA2 GLY 59 61.886 -7.147 10.308
399 2HA GLY 59 HA1 GLY 59 62.414 -5.525 9.865
400 HA PRO 60 HA PRO 60 58.713 -5.449 12.798
401 1HB PRO 60 HB2 PRO 60 60.008 -5.075 15.177
402 2HB PRO 60 HB1 PRO 60 59.589 -6.682 14.553
403 1HG PRO 60 HG2 PRO 60 62.201 -5.269 14.538
404 2HG PRO 60 HG1 PRO 60 61.848 -6.990 14.753
405 1HD PRO 60 HD2 PRO 60 62.762 -5.870 12.414
406 2HD PRO 60 HD1 PRO 60 61.853 -7.395 12.509
407 H GLY 61 HN GLY 61 61.322 -3.639 11.773
408 1HA GLY 61 HA2 GLY 61 60.088 -1.134 11.861
409 2HA GLY 61 HA1 GLY 61 61.018 -1.245 13.357
410 H CYS 62 HN CYS 62 61.984 -2.753 10.306
411 HA CYS 62 HA CYS 62 64.664 -1.934 10.349
412 1HB CYS 62 HB2 CYS 62 63.139 -3.476 8.777
413 2HB CYS 62 HB1 CYS 62 63.194 -2.049 7.744
414 H LYS 63 HN LYS 63 65.553 0.105 10.253
415 HA LYS 63 HA LYS 63 63.887 2.308 9.112
416 1HB LYS 63 HB2 LYS 63 64.625 2.653 11.373
417 2HB LYS 63 HB1 LYS 63 66.272 2.161 10.975
418 1HG LYS 63 HG2 LYS 63 66.218 4.155 9.300
419 2HG LYS 63 HG1 LYS 63 64.843 4.715 10.253
420 1HD LYS 63 HD2 LYS 63 66.329 4.416 12.314
421 2HD LYS 63 HD1 LYS 63 67.677 4.237 11.190
422 1HE LYS 63 HE2 LYS 63 67.815 6.486 10.998
423 2HE LYS 63 HE1 LYS 63 66.138 6.543 10.417
424 1HZ LYS 63 HZ1 LYS 63 67.022 6.426 13.252
425 2HZ LYS 63 HZ2 LYS 63 65.404 6.337 12.740
426 3HZ LYS 63 HZ3 LYS 63 66.303 7.756 12.480
427 H ILE 64 HN ILE 64 64.457 3.151 7.148
428 HA ILE 64 HA ILE 64 67.280 2.797 6.208
429 HB ILE 64 HB ILE 64 64.725 2.406 4.614
430 1HG1 ILE 64 HG12 ILE 64 65.189 0.655 6.366
431 2HG1 ILE 64 HG11 ILE 64 65.214 0.035 4.715
432 1HG2 ILE 64 HG21 ILE 64 66.243 2.924 2.966
433 2HG2 ILE 64 HG22 ILE 64 66.661 1.223 3.168
434 3HG2 ILE 64 HG23 ILE 64 67.630 2.469 3.956
435 1HD1 ILE 64 HD1 ILE 64 67.148 -0.871 5.803
436 2HD1 ILE 64 HD1 ILE 64 67.587 0.699 6.472
437 3HD1 ILE 64 HD1 ILE 64 67.732 0.406 4.738
438 H SER 65 HN SER 65 68.094 4.602 5.127
439 HA SER 65 HA SER 65 66.245 6.756 4.276
440 1HB SER 65 HB2 SER 65 66.651 8.054 6.084
441 2HB SER 65 HB1 SER 65 67.438 6.665 6.824
442 HG SER 65 HG SER 65 68.806 8.514 6.693
443 H THR 66 HN THR 66 67.018 7.523 2.368
444 HA THR 66 HA THR 66 68.500 7.711 0.522
445 HB THR 66 HB THR 66 70.382 8.732 2.640
446 HG1 THR 66 HG1 THR 66 69.026 10.651 2.543
447 1HG2 THR 66 HG21 THR 66 69.859 10.548 0.523
448 2HG2 THR 66 HG22 THR 66 70.068 8.954 -0.205
449 3HG2 THR 66 HG23 THR 66 71.337 9.632 0.818
450 H CYS 67 HN CYS 67 68.712 5.230 0.613
451 HA CYS 67 HA CYS 67 71.593 4.503 1.058
452 1HB CYS 67 HB2 CYS 67 69.069 2.883 1.571
453 2HB CYS 67 HB1 CYS 67 70.714 2.279 1.763
454 H ILE 68 HN ILE 68 72.478 3.812 -0.896
455 HA ILE 68 HA ILE 68 70.623 3.167 -3.122
456 HB ILE 68 HB ILE 68 73.600 3.681 -2.896
457 1HG1 ILE 68 HG12 ILE 68 72.971 5.637 -4.337
458 2HG1 ILE 68 HG11 ILE 68 71.279 5.168 -4.170
459 1HG2 ILE 68 HG21 ILE 68 73.396 2.073 -4.650
460 2HG2 ILE 68 HG22 ILE 68 73.448 3.642 -5.456
461 3HG2 ILE 68 HG23 ILE 68 71.907 2.809 -5.245
462 1HD1 ILE 68 HD1 ILE 68 72.287 6.949 -2.526
463 2HD1 ILE 68 HD1 ILE 68 72.962 5.538 -1.711
464 3HD1 ILE 68 HD1 ILE 68 71.215 5.696 -1.899
465 H ILE 69 HN ILE 69 69.938 1.074 -2.397
466 HA ILE 69 HA ILE 69 72.010 -1.039 -2.118
467 HB ILE 69 HB ILE 69 68.989 -1.115 -1.838
468 1HG1 ILE 69 HG12 ILE 69 70.865 -1.068 0.496
469 2HG1 ILE 69 HG11 ILE 69 70.515 0.456 -0.319
470 1HG2 ILE 69 HG21 ILE 69 70.925 -2.938 -0.451
471 2HG2 ILE 69 HG22 ILE 69 70.507 -3.255 -2.135
472 3HG2 ILE 69 HG23 ILE 69 69.245 -3.231 -0.903
473 1HD1 ILE 69 HD1 ILE 69 68.401 0.530 0.491
474 2HD1 ILE 69 HD1 ILE 69 68.943 -0.692 1.640
475 3HD1 ILE 69 HD1 ILE 69 68.123 -1.179 0.157
476 H THR 70 HN THR 70 71.855 -2.984 -3.438
477 HA THR 70 HA THR 70 70.128 -2.888 -5.848
478 HB THR 70 HB THR 70 73.159 -2.791 -5.835
479 HG1 THR 70 HG1 THR 70 71.102 -1.099 -6.790
480 1HG2 THR 70 HG21 THR 70 73.197 -3.343 -8.089
481 2HG2 THR 70 HG22 THR 70 71.519 -2.862 -8.340
482 3HG2 THR 70 HG23 THR 70 71.889 -4.380 -7.520
483 H GLY 71 HN GLY 71 69.233 -4.894 -5.060
484 1HA GLY 71 HA2 GLY 71 69.221 -7.274 -5.386
485 2HA GLY 71 HA1 GLY 71 70.976 -7.225 -5.575
486 H GLY 72 HN GLY 72 69.293 -5.648 -2.934
487 1HA GLY 72 HA2 GLY 72 69.157 -6.251 -0.647
488 2HA GLY 72 HA1 GLY 72 69.821 -7.834 -1.060
489 H VAL 73 HN VAL 73 71.556 -5.169 -2.328
490 HA VAL 73 HA VAL 73 73.585 -5.420 -0.124
491 HB VAL 73 HB VAL 73 75.271 -5.300 -1.894
492 1HG1 VAL 73 HG11 VAL 73 73.504 -7.413 -1.477
493 2HG1 VAL 73 HG12 VAL 73 75.049 -7.508 -2.322
494 3HG1 VAL 73 HG13 VAL 73 73.561 -7.252 -3.233
495 1HG2 VAL 73 HG21 VAL 73 72.877 -4.524 -3.480
496 2HG2 VAL 73 HG22 VAL 73 74.064 -5.535 -4.304
497 3HG2 VAL 73 HG23 VAL 73 74.548 -3.979 -3.628
498 HA PRO 74 HA PRO 74 72.840 -0.997 -0.102
499 1HB PRO 74 HB2 PRO 74 74.417 -0.473 2.073
500 2HB PRO 74 HB1 PRO 74 72.773 -1.123 2.208
501 1HG PRO 74 HG2 PRO 74 75.386 -2.524 2.429
502 2HG PRO 74 HG1 PRO 74 73.877 -2.795 3.314
503 1HD PRO 74 HD2 PRO 74 74.740 -4.362 1.235
504 2HD PRO 74 HD1 PRO 74 73.038 -4.184 1.712
505 H ALA 75 HN ALA 75 74.080 0.758 -0.869
506 HA ALA 75 HA ALA 75 76.756 0.087 -1.949
507 1HB ALA 75 HB1 ALA 75 76.352 2.451 -2.942
508 2HB ALA 75 HB2 ALA 75 74.736 2.315 -2.252
509 3HB ALA 75 HB3 ALA 75 75.275 1.159 -3.470
510 HA PRO 76 HA PRO 76 78.975 2.367 1.087
511 1HB PRO 76 HB2 PRO 76 80.837 3.729 -0.392
512 2HB PRO 76 HB1 PRO 76 80.915 1.973 -0.124
513 1HG PRO 76 HG2 PRO 76 79.947 3.485 -2.499
514 2HG PRO 76 HG1 PRO 76 80.890 1.989 -2.424
515 1HD PRO 76 HD2 PRO 76 78.215 2.049 -2.928
516 2HD PRO 76 HD1 PRO 76 79.030 0.677 -2.144
517 H SER 77 HN SER 77 76.608 3.632 0.723
518 HA SER 77 HA SER 77 76.966 6.398 -0.197
519 1HB SER 77 HB2 SER 77 74.885 4.550 0.125
520 2HB SER 77 HB1 SER 77 74.563 5.790 1.334
521 HG SER 77 HG SER 77 74.993 7.301 -0.482
522 H ALA 78 HN ALA 78 77.666 8.024 1.109
523 HA ALA 78 HA ALA 78 78.145 7.576 3.961
524 1HB ALA 78 HB1 ALA 78 78.361 10.319 3.035
525 2HB ALA 78 HB2 ALA 78 79.088 9.216 1.868
526 3HB ALA 78 HB3 ALA 78 79.643 9.218 3.540
527 H ALA 79 HN ALA 79 75.474 8.565 2.117
528 HA ALA 79 HA ALA 79 74.354 10.324 4.236
529 1HB ALA 79 HB1 ALA 79 72.494 10.100 2.224
530 2HB ALA 79 HB2 ALA 79 73.999 9.805 1.354
531 3HB ALA 79 HB3 ALA 79 73.783 11.303 2.258
532 H CYS 80 HN CYS 80 74.281 7.030 3.267
533 HA CYS 80 HA CYS 80 71.549 6.444 4.117
534 1HB CYS 80 HB2 CYS 80 72.695 5.115 2.433
535 2HB CYS 80 HB1 CYS 80 74.010 4.763 3.545
536 H LYS 81 HN LYS 81 71.224 4.818 6.008
537 HA LYS 81 HA LYS 81 72.791 5.827 8.319
538 1HB LYS 81 HB2 LYS 81 70.815 5.646 9.446
539 2HB LYS 81 HB1 LYS 81 70.124 5.586 7.831
540 1HG LYS 81 HG2 LYS 81 70.986 3.043 9.217
541 2HG LYS 81 HG1 LYS 81 69.422 3.767 9.554
542 1HD LYS 81 HD2 LYS 81 68.574 3.250 7.499
543 2HD LYS 81 HD1 LYS 81 70.114 3.505 6.683
544 1HE LYS 81 HE2 LYS 81 69.450 1.099 6.643
545 2HE LYS 81 HE1 LYS 81 70.942 1.334 7.573
546 1HZ LYS 81 HZ1 LYS 81 69.804 0.276 9.182
547 2HZ LYS 81 HZ2 LYS 81 68.289 0.616 8.494
548 3HZ LYS 81 HZ3 LYS 81 69.075 1.784 9.439
549 H ILE 82 HN ILE 82 72.049 2.789 6.648
550 HA ILE 82 HA ILE 82 72.777 0.567 7.136
551 HB ILE 82 HB ILE 82 75.293 2.161 7.700
552 1HG1 ILE 82 HG12 ILE 82 74.096 2.966 5.662
553 2HG1 ILE 82 HG11 ILE 82 75.640 2.202 5.284
554 1HG2 ILE 82 HG21 ILE 82 76.189 0.116 6.334
555 2HG2 ILE 82 HG22 ILE 82 74.668 -0.641 6.807
556 3HG2 ILE 82 HG23 ILE 82 75.805 -0.096 8.041
557 1HD1 ILE 82 HD1 ILE 82 73.589 1.518 3.864
558 2HD1 ILE 82 HD1 ILE 82 73.078 0.614 5.289
559 3HD1 ILE 82 HD1 ILE 82 74.609 0.227 4.501
560 H SER 83 HN SER 83 71.412 1.204 9.378
561 HA SER 83 HA SER 83 73.316 0.739 11.648
562 1HB SER 83 HB2 SER 83 70.736 2.223 11.291
563 2HB SER 83 HB1 SER 83 71.130 1.590 12.887
564 HG SER 83 HG SER 83 71.951 3.703 12.571
565 H GLY 84 HN GLY 84 69.927 0.289 12.178
566 1HA GLY 84 HA2 GLY 84 70.412 -2.632 12.478
567 2HA GLY 84 HA1 GLY 84 69.118 -1.727 13.267
568 H CYS 85 HN CYS 85 70.134 -3.214 10.245
569 HA CYS 85 HA CYS 85 67.344 -3.574 9.460
570 1HB CYS 85 HB2 CYS 85 68.839 -1.231 8.691
571 2HB CYS 85 HB1 CYS 85 68.443 -2.175 7.256
572 H THR 86 HN THR 86 67.507 -4.203 6.883
573 HA THR 86 HA THR 86 69.887 -5.521 5.962
574 HB THR 86 HB THR 86 69.523 -6.992 7.852
575 HG1 THR 86 HG1 THR 86 69.878 -8.594 6.572
576 1HG2 THR 86 HG21 THR 86 67.434 -7.967 8.409
577 2HG2 THR 86 HG22 THR 86 66.735 -7.554 6.843
578 3HG2 THR 86 HG23 THR 86 67.053 -6.287 8.028
579 H PHE 87 HN PHE 87 69.450 -6.683 3.944
580 HA PHE 87 HA PHE 87 66.755 -6.010 2.807
581 1HB PHE 87 HB2 PHE 87 69.313 -6.496 1.271
582 2HB PHE 87 HB1 PHE 87 67.875 -5.627 0.741
583 HD1 PHE 87 HD1 PHE 87 70.813 -4.641 0.772
584 HD2 PHE 87 HD2 PHE 87 67.542 -4.152 3.512
585 HE1 PHE 87 HE1 PHE 87 71.808 -2.534 1.580
586 HE2 PHE 87 HE2 PHE 87 68.552 -2.033 4.335
587 HZ PHE 87 HZ PHE 87 70.685 -1.227 3.363
588 H SER 88 HN SER 88 69.435 -8.361 2.378
589 HA SER 88 HA SER 88 69.351 -10.697 2.002
590 1HB SER 88 HB2 SER 88 66.443 -10.794 2.572
591 2HB SER 88 HB1 SER 88 67.753 -11.739 3.272
592 HG SER 88 HG SER 88 68.281 -9.982 4.560
593 H ALA 89 HN ALA 89 68.055 -8.444 0.102
594 HA ALA 89 HA ALA 89 67.015 -8.434 -2.028
595 1HB ALA 89 HB1 ALA 89 67.746 -10.969 -2.965
596 2HB ALA 89 HB2 ALA 89 68.963 -10.583 -1.748
597 3HB ALA 89 HB3 ALA 89 68.698 -9.491 -3.110
598 H ASN 90 HN ASN 90 64.780 -8.531 -1.490
599 HA ASN 90 HA ASN 90 63.374 -10.820 -0.572
600 1HB ASN 90 HB2 ASN 90 61.463 -9.493 -1.026
601 2HB ASN 90 HB1 ASN 90 62.739 -8.307 -0.775
602 1HD2 ASN 90 HD2 ASN 90 63.644 -7.244 -2.702
603 2HD2 ASN 90 HD2 ASN 90 62.786 -7.225 -4.165
Start of MODEL 4
1 1H ASP 1 HT1 ASP 1 48.252 4.050 3.050
2 2H ASP 1 HT2 ASP 1 49.439 5.011 2.307
3 3H ASP 1 HT3 ASP 1 48.128 4.422 1.400
4 HA ASP 1 HA ASP 1 47.453 6.053 3.726
5 1HB ASP 1 HB2 ASP 1 49.366 7.258 2.928
6 2HB ASP 1 HB1 ASP 1 48.912 6.996 1.245
7 H GLY 2 HN GLY 2 47.271 6.131 0.142
8 1HA GLY 2 HA2 GLY 2 44.292 6.033 0.426
9 2HA GLY 2 HA1 GLY 2 45.094 7.040 -0.781
10 H SER 3 HN SER 3 46.339 5.904 -2.477
11 HA SER 3 HA SER 3 45.964 3.013 -2.805
12 1HB SER 3 HB2 SER 3 44.612 3.477 -4.958
13 2HB SER 3 HB1 SER 3 43.765 3.676 -3.426
14 HG SER 3 HG SER 3 43.408 5.475 -4.727
15 H CYS 4 HN CYS 4 48.313 4.541 -2.770
16 HA CYS 4 HA CYS 4 49.314 5.599 -5.161
17 1HB CYS 4 HB2 CYS 4 50.247 4.824 -2.656
18 2HB CYS 4 HB1 CYS 4 51.187 3.832 -3.771
19 H THR 5 HN THR 5 49.437 2.162 -4.137
20 HA THR 5 HA THR 5 49.406 0.203 -5.465
21 HB THR 5 HB THR 5 49.227 2.024 -7.873
22 HG1 THR 5 HG1 THR 5 47.215 1.296 -6.017
23 1HG2 THR 5 HG21 THR 5 47.828 0.145 -8.717
24 2HG2 THR 5 HG22 THR 5 48.143 -0.728 -7.218
25 3HG2 THR 5 HG23 THR 5 49.472 -0.363 -8.321
26 H ASN 6 HN ASN 6 51.692 2.614 -5.434
27 HA ASN 6 HA ASN 6 53.936 2.735 -6.214
28 1HB ASN 6 HB2 ASN 6 54.168 0.964 -4.625
29 2HB ASN 6 HB1 ASN 6 53.263 -0.159 -5.634
30 1HD2 ASN 6 HD2 ASN 6 56.398 1.388 -5.176
31 2HD2 ASN 6 HD2 ASN 6 57.253 0.388 -6.247
32 H THR 7 HN THR 7 51.791 2.595 -8.253
33 HA THR 7 HA THR 7 51.714 2.443 -10.621
34 HB THR 7 HB THR 7 54.448 1.219 -10.647
35 HG1 THR 7 HG1 THR 7 53.751 3.699 -9.546
36 1HG2 THR 7 HG21 THR 7 52.747 2.523 -12.466
37 2HG2 THR 7 HG22 THR 7 54.426 2.058 -12.735
38 3HG2 THR 7 HG23 THR 7 54.044 3.671 -12.134
39 H ASN 8 HN ASN 8 50.235 0.620 -9.720
40 HA ASN 8 HA ASN 8 49.398 -1.562 -10.094
41 1HB ASN 8 HB2 ASN 8 51.429 -1.045 -12.093
42 2HB ASN 8 HB1 ASN 8 51.467 -2.738 -11.610
43 1HD2 ASN 8 HD2 ASN 8 49.962 -0.639 -13.750
44 2HD2 ASN 8 HD2 ASN 8 48.548 -1.530 -14.044
45 H SER 9 HN SER 9 49.740 -2.189 -7.876
46 HA SER 9 HA SER 9 51.748 -4.275 -7.482
47 1HB SER 9 HB2 SER 9 53.216 -3.098 -6.089
48 2HB SER 9 HB1 SER 9 52.794 -1.862 -7.268
49 HG SER 9 HG SER 9 52.537 -1.638 -4.735
50 H GLN 10 HN GLN 10 51.700 -3.488 -4.501
51 HA GLN 10 HA GLN 10 48.874 -4.331 -3.936
52 1HB GLN 10 HB2 GLN 10 51.456 -5.556 -3.383
53 2HB GLN 10 HB1 GLN 10 50.549 -5.285 -1.895
54 1HG GLN 10 HG2 GLN 10 49.602 -7.292 -2.465
55 2HG GLN 10 HG1 GLN 10 48.566 -6.254 -3.446
56 1HE2 GLN 10 HE21 GLN 10 50.894 -8.806 -3.577
57 2HE2 GLN 10 HE22 GLN 10 51.068 -8.857 -5.265
58 H LEU 11 HN LEU 11 51.811 -2.833 -2.536
59 HA LEU 11 HA LEU 11 52.004 -1.301 -0.729
60 1HB LEU 11 HB2 LEU 11 51.178 -0.088 -2.822
61 2HB LEU 11 HB1 LEU 11 49.563 -0.161 -2.118
62 HG LEU 11 HG LEU 11 50.214 1.172 -0.245
63 1HD1 LEU 11 HD1 LEU 11 52.303 0.393 0.447
64 2HD1 LEU 11 HD1 LEU 11 52.720 1.966 -0.236
65 3HD1 LEU 11 HD1 LEU 11 52.989 0.497 -1.174
66 1HD2 LEU 11 HD2 LEU 11 51.103 2.092 -2.945
67 2HD2 LEU 11 HD2 LEU 11 51.545 3.092 -1.560
68 3HD2 LEU 11 HD2 LEU 11 49.847 2.748 -1.894
69 H SER 12 HN SER 12 51.305 -2.839 0.951
70 HA SER 12 HA SER 12 48.742 -3.538 1.744
71 1HB SER 12 HB2 SER 12 49.720 -3.646 4.013
72 2HB SER 12 HB1 SER 12 50.855 -4.240 2.805
73 HG SER 12 HG SER 12 50.792 -1.699 4.067
74 H ALA 13 HN ALA 13 47.378 -2.591 3.519
75 HA ALA 13 HA ALA 13 46.757 0.194 2.971
76 1HB ALA 13 HB1 ALA 13 44.804 -0.696 3.676
77 2HB ALA 13 HB2 ALA 13 45.458 -0.716 5.315
78 3HB ALA 13 HB3 ALA 13 45.638 -2.130 4.276
79 H ASN 14 HN ASN 14 48.922 -1.375 5.133
80 HA ASN 14 HA ASN 14 48.876 0.842 7.105
81 1HB ASN 14 HB2 ASN 14 49.009 -1.586 7.731
82 2HB ASN 14 HB1 ASN 14 50.580 -1.663 6.933
83 1HD2 ASN 14 HD2 ASN 14 52.250 -0.007 7.786
84 2HD2 ASN 14 HD2 ASN 14 52.217 0.344 9.447
85 H SER 15 HN SER 15 50.410 0.157 4.163
86 HA SER 15 HA SER 15 53.062 1.191 4.756
87 1HB SER 15 HB2 SER 15 52.872 -0.227 2.883
88 2HB SER 15 HB1 SER 15 51.411 0.569 2.312
89 HG SER 15 HG SER 15 52.609 2.262 1.603
90 H LYS 16 HN LYS 16 53.689 3.174 3.128
91 HA LYS 16 HA LYS 16 51.621 5.318 3.354
92 1HB LYS 16 HB2 LYS 16 53.138 5.225 5.372
93 2HB LYS 16 HB1 LYS 16 54.495 5.558 4.294
94 1HG LYS 16 HG2 LYS 16 52.644 7.502 3.596
95 2HG LYS 16 HG1 LYS 16 52.469 7.388 5.347
96 1HD LYS 16 HD2 LYS 16 54.225 8.891 5.233
97 2HD LYS 16 HD1 LYS 16 55.130 7.377 5.258
98 1HE LYS 16 HE2 LYS 16 56.054 8.613 3.432
99 2HE LYS 16 HE1 LYS 16 54.948 7.453 2.669
100 1HZ LYS 16 HZ1 LYS 16 54.349 9.528 1.785
101 2HZ LYS 16 HZ2 LYS 16 54.460 10.308 3.291
102 3HZ LYS 16 HZ3 LYS 16 53.188 9.224 2.984
103 H CYS 17 HN CYS 17 51.593 6.543 1.499
104 HA CYS 17 HA CYS 17 54.070 6.666 -0.172
105 1HB CYS 17 HB2 CYS 17 52.399 4.857 -0.850
106 2HB CYS 17 HB1 CYS 17 51.283 6.162 -1.245
107 H GLU 18 HN GLU 18 54.026 8.501 -1.693
108 HA GLU 18 HA GLU 18 51.911 10.476 -1.648
109 1HB GLU 18 HB2 GLU 18 52.742 10.710 0.649
110 2HB GLU 18 HB1 GLU 18 54.389 10.921 0.053
111 1HG GLU 18 HG2 GLU 18 53.660 12.957 -1.174
112 2HG GLU 18 HG1 GLU 18 52.041 12.761 -0.500
113 H LYS 19 HN LYS 19 55.312 11.400 -1.475
114 HA LYS 19 HA LYS 19 55.243 11.914 -4.431
115 1HB LYS 19 HB2 LYS 19 56.136 13.408 -2.029
116 2HB LYS 19 HB1 LYS 19 57.197 13.530 -3.433
117 1HG LYS 19 HG2 LYS 19 54.702 13.824 -4.565
118 2HG LYS 19 HG1 LYS 19 54.510 14.648 -3.017
119 1HD LYS 19 HD2 LYS 19 55.897 16.343 -3.612
120 2HD LYS 19 HD1 LYS 19 57.050 15.247 -4.377
121 1HE LYS 19 HE2 LYS 19 56.123 16.605 -6.146
122 2HE LYS 19 HE1 LYS 19 55.342 15.017 -6.285
123 1HZ LYS 19 HZ1 LYS 19 53.714 16.069 -4.557
124 2HZ LYS 19 HZ2 LYS 19 53.513 16.371 -6.217
125 3HZ LYS 19 HZ3 LYS 19 54.257 17.530 -5.222
126 H SER 20 HN SER 20 56.013 9.521 -4.432
127 HA SER 20 HA SER 20 58.975 9.400 -3.957
128 1HB SER 20 HB2 SER 20 57.719 6.829 -4.254
129 2HB SER 20 HB1 SER 20 58.529 7.491 -2.838
130 HG SER 20 HG SER 20 55.971 7.031 -3.142
131 H THR 21 HN THR 21 59.493 7.103 -5.409
132 HA THR 21 HA THR 21 58.433 7.463 -8.159
133 HB THR 21 HB THR 21 60.301 9.054 -7.971
134 HG1 THR 21 HG1 THR 21 61.489 6.888 -9.265
135 1HG2 THR 21 HG21 THR 21 61.663 8.395 -6.227
136 2HG2 THR 21 HG22 THR 21 62.615 7.800 -7.587
137 3HG2 THR 21 HG23 THR 21 61.591 6.692 -6.676
138 H LEU 22 HN LEU 22 57.780 5.315 -6.798
139 HA LEU 22 HA LEU 22 59.839 3.236 -6.827
140 1HB LEU 22 HB2 LEU 22 56.866 2.918 -6.421
141 2HB LEU 22 HB1 LEU 22 58.168 1.943 -5.745
142 HG LEU 22 HG LEU 22 57.511 4.817 -5.039
143 1HD1 LEU 22 HD1 LEU 22 56.055 3.072 -4.036
144 2HD1 LEU 22 HD1 LEU 22 57.060 3.861 -2.820
145 3HD1 LEU 22 HD1 LEU 22 57.487 2.256 -3.412
146 1HD2 LEU 22 HD2 LEU 22 59.468 4.935 -3.797
147 2HD2 LEU 22 HD2 LEU 22 60.027 3.943 -5.140
148 3HD2 LEU 22 HD2 LEU 22 59.579 3.186 -3.614
149 H THR 23 HN THR 23 58.675 1.010 -7.664
150 HA THR 23 HA THR 23 57.335 1.240 -10.251
151 HB THR 23 HB THR 23 60.306 0.824 -9.944
152 HG1 THR 23 HG1 THR 23 59.921 2.029 -12.089
153 1HG2 THR 23 HG21 THR 23 59.881 -1.134 -11.147
154 2HG2 THR 23 HG22 THR 23 60.124 0.044 -12.437
155 3HG2 THR 23 HG23 THR 23 58.490 -0.438 -11.980
156 H ASN 24 HN ASN 24 55.898 -0.372 -9.568
157 HA ASN 24 HA ASN 24 55.142 -2.555 -9.071
158 1HB ASN 24 HB2 ASN 24 57.814 -2.854 -10.396
159 2HB ASN 24 HB1 ASN 24 57.106 -4.284 -9.646
160 1HD2 ASN 24 HD2 ASN 24 54.994 -1.778 -10.946
161 2HD2 ASN 24 HD2 ASN 24 54.455 -2.670 -12.286
162 H CYS 25 HN CYS 25 54.902 -3.102 -6.923
163 HA CYS 25 HA CYS 25 57.116 -4.152 -5.361
164 1HB CYS 25 HB2 CYS 25 56.868 -1.373 -5.513
165 2HB CYS 25 HB1 CYS 25 56.149 -1.775 -3.959
166 H TYR 26 HN TYR 26 55.955 -3.326 -2.812
167 HA TYR 26 HA TYR 26 53.142 -4.214 -2.830
168 1HB TYR 26 HB2 TYR 26 54.383 -6.315 -3.012
169 2HB TYR 26 HB1 TYR 26 55.434 -5.842 -1.677
170 HD1 TYR 26 HD1 TYR 26 52.297 -7.366 -2.611
171 HD2 TYR 26 HD2 TYR 26 54.399 -5.471 0.621
172 HE1 TYR 26 HE1 TYR 26 50.686 -8.335 -0.995
173 HE2 TYR 26 HE2 TYR 26 52.788 -6.442 2.238
174 HH TYR 26 HH TYR 26 51.216 -8.195 2.435
175 H VAL 27 HN VAL 27 56.070 -3.591 -0.953
176 HA VAL 27 HA VAL 27 56.362 -2.637 1.198
177 HB VAL 27 HB VAL 27 54.229 -0.807 0.084
178 1HG1 VAL 27 HG11 VAL 27 56.310 -0.686 2.172
179 2HG1 VAL 27 HG12 VAL 27 54.840 0.271 1.986
180 3HG1 VAL 27 HG13 VAL 27 56.293 0.704 1.084
181 1HG2 VAL 27 HG21 VAL 27 56.256 0.293 -1.059
182 2HG2 VAL 27 HG22 VAL 27 55.671 -1.208 -1.783
183 3HG2 VAL 27 HG23 VAL 27 57.109 -1.222 -0.759
184 H ASP 28 HN ASP 28 55.511 -3.974 2.820
185 HA ASP 28 HA ASP 28 52.599 -3.972 3.355
186 1HB ASP 28 HB2 ASP 28 54.408 -5.909 3.502
187 2HB ASP 28 HB1 ASP 28 54.698 -5.224 5.100
188 H LYS 29 HN LYS 29 53.736 -4.254 6.345
189 HA LYS 29 HA LYS 29 52.994 -1.631 7.229
190 1HB LYS 29 HB2 LYS 29 54.229 -4.111 8.304
191 2HB LYS 29 HB1 LYS 29 54.558 -2.643 9.224
192 1HG LYS 29 HG2 LYS 29 52.370 -2.378 9.853
193 2HG LYS 29 HG1 LYS 29 51.748 -3.051 8.346
194 1HD LYS 29 HD2 LYS 29 51.891 -5.235 9.098
195 2HD LYS 29 HD1 LYS 29 53.223 -4.878 10.199
196 1HE LYS 29 HE2 LYS 29 51.449 -5.129 11.711
197 2HE LYS 29 HE1 LYS 29 51.375 -3.381 11.406
198 1HZ LYS 29 HZ1 LYS 29 49.914 -5.412 9.806
199 2HZ LYS 29 HZ2 LYS 29 49.767 -3.723 9.694
200 3HZ LYS 29 HZ3 LYS 29 49.215 -4.537 11.079
201 H SER 30 HN SER 30 54.344 -0.292 5.704
202 HA SER 30 HA SER 30 57.035 0.204 6.875
203 1HB SER 30 HB2 SER 30 56.372 -0.679 4.073
204 2HB SER 30 HB1 SER 30 57.855 0.208 4.418
205 HG SER 30 HG SER 30 57.052 -2.356 5.199
206 H GLU 31 HN GLU 31 57.936 2.260 6.198
207 HA GLU 31 HA GLU 31 55.885 4.196 5.166
208 1HB GLU 31 HB2 GLU 31 57.657 4.112 7.514
209 2HB GLU 31 HB1 GLU 31 57.767 5.628 6.617
210 1HG GLU 31 HG2 GLU 31 55.498 6.129 6.932
211 2HG GLU 31 HG1 GLU 31 55.075 4.450 7.269
212 H VAL 32 HN VAL 32 56.488 4.786 3.116
213 HA VAL 32 HA VAL 32 59.420 4.966 2.511
214 HB VAL 32 HB VAL 32 57.045 4.429 0.701
215 1HG1 VAL 32 HG11 VAL 32 59.762 5.129 0.185
216 2HG1 VAL 32 HG12 VAL 32 58.515 4.681 -0.979
217 3HG1 VAL 32 HG13 VAL 32 59.544 3.438 -0.262
218 1HG2 VAL 32 HG21 VAL 32 57.674 2.705 2.557
219 2HG2 VAL 32 HG22 VAL 32 59.115 2.416 1.582
220 3HG2 VAL 32 HG23 VAL 32 57.516 2.123 0.899
221 H TYR 33 HN TYR 33 60.082 6.726 1.079
222 HA TYR 33 HA TYR 33 58.103 8.962 0.833
223 1HB TYR 33 HB2 TYR 33 60.849 8.881 2.069
224 2HB TYR 33 HB1 TYR 33 60.188 10.395 1.457
225 HD1 TYR 33 HD1 TYR 33 58.555 11.607 2.679
226 HD2 TYR 33 HD2 TYR 33 59.512 7.571 3.804
227 HE1 TYR 33 HE1 TYR 33 57.204 11.860 4.743
228 HE2 TYR 33 HE2 TYR 33 58.160 7.826 5.867
229 HH TYR 33 HH TYR 33 56.013 9.533 6.459
230 H GLY 34 HN GLY 34 61.586 8.615 0.033
231 1HA GLY 34 HA2 GLY 34 60.858 9.211 -2.814
232 2HA GLY 34 HA1 GLY 34 62.328 9.821 -2.051
233 H THR 35 HN THR 35 60.931 6.569 -1.837
234 HA THR 35 HA THR 35 63.541 5.372 -2.509
235 HB THR 35 HB THR 35 60.846 4.540 -1.480
236 HG1 THR 35 HG1 THR 35 63.516 4.273 -0.584
237 1HG2 THR 35 HG21 THR 35 61.312 2.752 -2.993
238 2HG2 THR 35 HG22 THR 35 61.735 2.183 -1.380
239 3HG2 THR 35 HG23 THR 35 63.002 2.688 -2.496
240 H THR 36 HN THR 36 63.426 3.402 -4.104
241 HA THR 36 HA THR 36 61.883 4.248 -6.529
242 HB THR 36 HB THR 36 64.354 2.507 -6.383
243 HG1 THR 36 HG1 THR 36 64.354 5.278 -6.884
244 1HG2 THR 36 HG21 THR 36 62.918 4.077 -8.518
245 2HG2 THR 36 HG22 THR 36 63.400 2.381 -8.536
246 3HG2 THR 36 HG23 THR 36 64.619 3.645 -8.697
247 H CYS 37 HN CYS 37 62.184 1.766 -4.193
248 HA CYS 37 HA CYS 37 61.464 -0.512 -4.147
249 1HB CYS 37 HB2 CYS 37 59.475 1.444 -4.505
250 2HB CYS 37 HB1 CYS 37 59.018 0.126 -5.581
251 H THR 38 HN THR 38 63.216 -0.739 -6.073
252 HA THR 38 HA THR 38 62.270 -1.113 -8.757
253 HB THR 38 HB THR 38 64.608 -2.346 -7.263
254 HG1 THR 38 HG1 THR 38 64.768 -0.124 -8.951
255 1HG2 THR 38 HG21 THR 38 64.334 -3.501 -9.332
256 2HG2 THR 38 HG22 THR 38 65.606 -2.310 -9.606
257 3HG2 THR 38 HG23 THR 38 63.971 -2.007 -10.196
258 H GLY 39 HN GLY 39 60.240 -2.357 -8.215
259 1HA GLY 39 HA2 GLY 39 59.026 -4.361 -8.067
260 2HA GLY 39 HA1 GLY 39 60.403 -5.071 -8.905
261 H SER 40 HN SER 40 60.502 -3.588 -5.695
262 HA SER 40 HA SER 40 61.362 -6.237 -4.583
263 1HB SER 40 HB2 SER 40 62.519 -4.858 -2.927
264 2HB SER 40 HB1 SER 40 62.913 -4.269 -4.538
265 HG SER 40 HG SER 40 61.488 -3.083 -2.501
266 H ARG 41 HN ARG 41 60.902 -4.821 -1.871
267 HA ARG 41 HA ARG 41 58.133 -4.275 -1.509
268 1HB ARG 41 HB2 ARG 41 57.625 -6.449 -2.287
269 2HB ARG 41 HB1 ARG 41 59.013 -7.162 -1.465
270 1HG ARG 41 HG2 ARG 41 57.984 -6.948 0.675
271 2HG ARG 41 HG1 ARG 41 56.738 -5.869 0.049
272 1HD ARG 41 HD2 ARG 41 55.597 -7.623 -1.050
273 2HD ARG 41 HD1 ARG 41 57.009 -8.696 -0.986
274 HE ARG 41 HE ARG 41 55.263 -8.012 1.322
275 1HH1 ARG 41 HH1 ARG 41 56.142 -10.762 0.074
276 2HH1 ARG 41 HH1 ARG 41 57.148 -11.346 1.358
277 1HH2 ARG 41 HH2 ARG 41 57.353 -8.277 2.954
278 2HH2 ARG 41 HH2 ARG 41 57.831 -9.941 2.988
279 H PHE 42 HN PHE 42 57.593 -4.077 0.755
280 HA PHE 42 HA PHE 42 59.944 -4.343 2.604
281 1HB PHE 42 HB2 PHE 42 57.663 -2.340 2.653
282 2HB PHE 42 HB1 PHE 42 59.100 -2.316 3.673
283 HD1 PHE 42 HD1 PHE 42 58.060 -0.150 1.669
284 HD2 PHE 42 HD2 PHE 42 61.001 -3.268 1.396
285 HE1 PHE 42 HE1 PHE 42 59.273 1.147 -0.060
286 HE2 PHE 42 HE2 PHE 42 62.215 -1.972 -0.335
287 HZ PHE 42 HZ PHE 42 61.352 0.235 -1.059
288 H ASP 43 HN ASP 43 59.186 -4.523 4.953
289 HA ASP 43 HA ASP 43 56.477 -5.572 5.393
290 1HB ASP 43 HB2 ASP 43 58.309 -7.316 4.414
291 2HB ASP 43 HB1 ASP 43 58.624 -7.483 6.141
292 H GLY 44 HN GLY 44 56.886 -3.554 6.787
293 1HA GLY 44 HA2 GLY 44 56.813 -3.082 9.156
294 2HA GLY 44 HA1 GLY 44 57.858 -4.475 9.431
295 H VAL 45 HN VAL 45 58.204 -1.621 7.262
296 HA VAL 45 HA VAL 45 60.768 -1.048 8.717
297 HB VAL 45 HB VAL 45 61.937 -0.984 6.684
298 1HG1 VAL 45 HG11 VAL 45 61.264 -3.005 5.403
299 2HG1 VAL 45 HG12 VAL 45 59.727 -3.019 6.269
300 3HG1 VAL 45 HG13 VAL 45 61.233 -3.288 7.145
301 1HG2 VAL 45 HG21 VAL 45 59.291 -0.202 5.596
302 2HG2 VAL 45 HG22 VAL 45 60.312 -1.143 4.509
303 3HG2 VAL 45 HG23 VAL 45 60.899 0.382 5.171
304 H THR 46 HN THR 46 61.553 1.151 7.278
305 HA THR 46 HA THR 46 59.369 3.100 7.020
306 HB THR 46 HB THR 46 61.376 3.136 9.300
307 HG1 THR 46 HG1 THR 46 59.078 3.522 10.258
308 1HG2 THR 46 HG21 THR 46 59.716 5.286 8.052
309 2HG2 THR 46 HG22 THR 46 61.311 5.389 8.798
310 3HG2 THR 46 HG23 THR 46 59.872 5.275 9.810
311 H ILE 47 HN ILE 47 60.963 2.461 4.995
312 HA ILE 47 HA ILE 47 63.523 3.807 4.900
313 HB ILE 47 HB ILE 47 62.872 1.860 3.532
314 1HG1 ILE 47 HG12 ILE 47 63.193 4.181 1.631
315 2HG1 ILE 47 HG11 ILE 47 64.501 3.711 2.716
316 1HG2 ILE 47 HG21 ILE 47 61.227 3.407 1.653
317 2HG2 ILE 47 HG22 ILE 47 60.480 3.207 3.239
318 3HG2 ILE 47 HG23 ILE 47 60.965 1.789 2.307
319 1HD1 ILE 47 HD1 ILE 47 65.081 2.143 1.205
320 2HD1 ILE 47 HD1 ILE 47 63.627 2.445 0.256
321 3HD1 ILE 47 HD1 ILE 47 63.582 1.303 1.600
322 H THR 48 HN THR 48 63.860 5.514 3.086
323 HA THR 48 HA THR 48 61.577 7.442 2.977
324 HB THR 48 HB THR 48 63.644 9.113 3.331
325 HG1 THR 48 HG1 THR 48 64.809 7.830 5.128
326 1HG2 THR 48 HG21 THR 48 61.692 7.821 5.066
327 2HG2 THR 48 HG22 THR 48 62.209 9.508 5.023
328 3HG2 THR 48 HG23 THR 48 63.132 8.325 5.952
329 H THR 49 HN THR 49 64.843 8.218 1.993
330 HA THR 49 HA THR 49 63.952 8.080 -0.861
331 HB THR 49 HB THR 49 65.842 9.864 0.683
332 HG1 THR 49 HG1 THR 49 64.219 11.165 0.526
333 1HG2 THR 49 HG21 THR 49 67.100 9.678 -1.243
334 2HG2 THR 49 HG22 THR 49 65.971 10.937 -1.751
335 3HG2 THR 49 HG23 THR 49 65.705 9.262 -2.239
336 H SER 50 HN SER 50 64.721 5.671 -0.361
337 HA SER 50 HA SER 50 67.687 5.472 -0.721
338 1HB SER 50 HB2 SER 50 67.129 4.182 1.123
339 2HB SER 50 HB1 SER 50 65.514 3.837 0.513
340 HG SER 50 HG SER 50 67.990 2.686 -0.216
341 H THR 51 HN THR 51 68.508 4.378 -2.515
342 HA THR 51 HA THR 51 66.618 3.922 -4.755
343 HB THR 51 HB THR 51 69.590 3.517 -4.836
344 HG1 THR 51 HG1 THR 51 68.538 6.082 -5.133
345 1HG2 THR 51 HG21 THR 51 68.726 3.226 -6.959
346 2HG2 THR 51 HG22 THR 51 69.013 4.967 -6.987
347 3HG2 THR 51 HG23 THR 51 67.392 4.345 -6.681
348 H SER 52 HN SER 52 67.049 2.020 -2.328
349 HA SER 52 HA SER 52 68.348 -0.343 -2.773
350 1HB SER 52 HB2 SER 52 66.281 0.534 -1.209
351 2HB SER 52 HB1 SER 52 65.472 -0.681 -2.192
352 HG SER 52 HG SER 52 67.776 -0.981 -0.564
353 H THR 53 HN THR 53 68.459 -1.813 -4.431
354 HA THR 53 HA THR 53 66.269 -1.747 -6.483
355 HB THR 53 HB THR 53 69.104 -2.786 -6.743
356 HG1 THR 53 HG1 THR 53 68.490 -0.368 -7.877
357 1HG2 THR 53 HG21 THR 53 67.058 -3.255 -8.385
358 2HG2 THR 53 HG22 THR 53 68.679 -2.944 -9.006
359 3HG2 THR 53 HG23 THR 53 67.481 -1.649 -8.978
360 H GLY 54 HN GLY 54 64.865 -3.375 -5.748
361 1HA GLY 54 HA2 GLY 54 64.127 -5.560 -5.336
362 2HA GLY 54 HA1 GLY 54 65.577 -6.102 -6.183
363 H SER 55 HN SER 55 64.431 -4.951 -3.017
364 HA SER 55 HA SER 55 66.351 -6.811 -1.718
365 1HB SER 55 HB2 SER 55 66.918 -4.761 -0.201
366 2HB SER 55 HB1 SER 55 67.676 -4.866 -1.788
367 HG SER 55 HG SER 55 66.187 -3.414 -2.572
368 H ARG 56 HN ARG 56 65.155 -7.907 -0.207
369 HA ARG 56 HA ARG 56 62.516 -7.035 0.615
370 1HB ARG 56 HB2 ARG 56 63.827 -9.393 0.446
371 2HB ARG 56 HB1 ARG 56 64.040 -9.069 2.166
372 1HG ARG 56 HG2 ARG 56 61.831 -9.362 2.629
373 2HG ARG 56 HG1 ARG 56 61.313 -8.579 1.137
374 1HD ARG 56 HD2 ARG 56 60.697 -10.811 0.734
375 2HD ARG 56 HD1 ARG 56 62.319 -10.767 0.013
376 HE ARG 56 HE ARG 56 62.834 -11.362 2.652
377 1HH1 ARG 56 HH2 ARG 56 59.942 -12.511 2.265
378 2HH1 ARG 56 HH2 ARG 56 60.328 -14.178 1.997
379 1HH2 ARG 56 HH1 ARG 56 63.696 -13.576 1.425
380 2HH2 ARG 56 HH1 ARG 56 62.455 -14.781 1.518
381 H ILE 57 HN ILE 57 62.497 -5.151 1.852
382 HA ILE 57 HA ILE 57 64.504 -4.707 3.952
383 HB ILE 57 HB ILE 57 61.960 -3.169 3.361
384 1HG1 ILE 57 HG12 ILE 57 63.232 -3.552 1.259
385 2HG1 ILE 57 HG11 ILE 57 63.293 -1.861 1.752
386 1HG2 ILE 57 HG21 ILE 57 63.516 -1.273 4.082
387 2HG2 ILE 57 HG22 ILE 57 64.640 -2.528 4.610
388 3HG2 ILE 57 HG23 ILE 57 63.043 -2.402 5.353
389 1HD1 ILE 57 HD1 ILE 57 65.535 -2.407 1.192
390 2HD1 ILE 57 HD1 ILE 57 65.448 -3.959 2.024
391 3HD1 ILE 57 HD1 ILE 57 65.484 -2.462 2.953
392 H SER 58 HN SER 58 62.125 -6.848 3.873
393 HA SER 58 HA SER 58 60.245 -6.529 5.867
394 1HB SER 58 HB2 SER 58 61.920 -8.714 4.804
395 2HB SER 58 HB1 SER 58 61.249 -9.034 6.401
396 HG SER 58 HG SER 58 59.623 -9.620 5.138
397 H GLY 59 HN GLY 59 60.234 -6.665 8.186
398 1HA GLY 59 HA2 GLY 59 62.170 -7.439 9.959
399 2HA GLY 59 HA1 GLY 59 62.743 -5.846 9.465
400 HA PRO 60 HA PRO 60 59.256 -5.591 12.659
401 1HB PRO 60 HB2 PRO 60 60.684 -5.543 14.991
402 2HB PRO 60 HB1 PRO 60 60.051 -7.043 14.282
403 1HG PRO 60 HG2 PRO 60 62.810 -5.951 14.247
404 2HG PRO 60 HG1 PRO 60 62.259 -7.630 14.336
405 1HD PRO 60 HD2 PRO 60 63.210 -6.412 12.055
406 2HD PRO 60 HD1 PRO 60 62.158 -7.844 12.074
407 H GLY 61 HN GLY 61 60.355 -3.612 11.090
408 1HA GLY 61 HA2 GLY 61 60.023 -1.186 11.675
409 2HA GLY 61 HA1 GLY 61 61.077 -1.480 13.060
410 H CYS 62 HN CYS 62 61.899 -3.129 10.156
411 HA CYS 62 HA CYS 62 64.524 -2.355 9.890
412 1HB CYS 62 HB2 CYS 62 62.811 -3.843 8.466
413 2HB CYS 62 HB1 CYS 62 62.855 -2.433 7.410
414 H LYS 63 HN LYS 63 65.539 -0.410 9.587
415 HA LYS 63 HA LYS 63 63.916 1.894 8.575
416 1HB LYS 63 HB2 LYS 63 66.560 1.914 10.050
417 2HB LYS 63 HB1 LYS 63 65.407 3.237 9.890
418 1HG LYS 63 HG2 LYS 63 64.872 2.487 12.011
419 2HG LYS 63 HG1 LYS 63 63.767 1.502 11.050
420 1HD LYS 63 HD2 LYS 63 64.807 -0.401 11.670
421 2HD LYS 63 HD1 LYS 63 66.389 0.259 11.252
422 1HE LYS 63 HE2 LYS 63 66.864 0.676 13.431
423 2HE LYS 63 HE1 LYS 63 65.311 1.505 13.666
424 1HZ LYS 63 HZ1 LYS 63 65.227 -1.384 13.275
425 2HZ LYS 63 HZ2 LYS 63 64.269 -0.396 14.272
426 3HZ LYS 63 HZ3 LYS 63 65.833 -0.844 14.764
427 H ILE 64 HN ILE 64 64.678 3.093 6.823
428 HA ILE 64 HA ILE 64 67.337 2.419 5.658
429 HB ILE 64 HB ILE 64 64.686 2.406 4.170
430 1HG1 ILE 64 HG12 ILE 64 65.232 0.399 5.683
431 2HG1 ILE 64 HG11 ILE 64 64.925 0.035 3.987
432 1HG2 ILE 64 HG21 ILE 64 66.274 3.155 2.616
433 2HG2 ILE 64 HG22 ILE 64 66.315 1.407 2.379
434 3HG2 ILE 64 HG23 ILE 64 67.568 2.198 3.334
435 1HD1 ILE 64 HD1 ILE 64 66.982 -0.841 3.758
436 2HD1 ILE 64 HD1 ILE 64 67.239 -0.604 5.486
437 3HD1 ILE 64 HD1 ILE 64 67.717 0.651 4.343
438 H SER 65 HN SER 65 68.340 4.368 5.227
439 HA SER 65 HA SER 65 66.605 6.696 4.491
440 1HB SER 65 HB2 SER 65 67.344 7.851 6.300
441 2HB SER 65 HB1 SER 65 67.818 6.276 6.928
442 HG SER 65 HG SER 65 69.353 8.350 6.103
443 H THR 66 HN THR 66 67.250 7.459 2.554
444 HA THR 66 HA THR 66 68.604 7.695 0.619
445 HB THR 66 HB THR 66 70.515 8.675 2.746
446 HG1 THR 66 HG1 THR 66 69.149 10.219 3.155
447 1HG2 THR 66 HG21 THR 66 71.543 9.784 1.052
448 2HG2 THR 66 HG22 THR 66 70.010 10.211 0.286
449 3HG2 THR 66 HG23 THR 66 70.724 8.620 0.007
450 H CYS 67 HN CYS 67 68.778 5.051 1.182
451 HA CYS 67 HA CYS 67 71.720 4.475 1.043
452 1HB CYS 67 HB2 CYS 67 70.214 3.625 3.017
453 2HB CYS 67 HB1 CYS 67 69.621 2.461 1.839
454 H ILE 68 HN ILE 68 72.163 4.199 -1.102
455 HA ILE 68 HA ILE 68 70.365 3.573 -3.164
456 HB ILE 68 HB ILE 68 73.321 3.148 -2.724
457 1HG1 ILE 68 HG12 ILE 68 73.275 4.867 -4.667
458 2HG1 ILE 68 HG11 ILE 68 71.562 5.043 -4.284
459 1HG2 ILE 68 HG21 ILE 68 71.659 1.853 -4.717
460 2HG2 ILE 68 HG22 ILE 68 73.388 1.669 -4.426
461 3HG2 ILE 68 HG23 ILE 68 72.805 2.953 -5.485
462 1HD1 ILE 68 HD1 ILE 68 72.016 5.832 -2.095
463 2HD1 ILE 68 HD1 ILE 68 73.188 6.665 -3.116
464 3HD1 ILE 68 HD1 ILE 68 73.688 5.274 -2.152
465 H ILE 69 HN ILE 69 72.711 1.223 -1.829
466 HA ILE 69 HA ILE 69 72.541 -1.112 -1.558
467 HB ILE 69 HB ILE 69 69.569 -0.598 -1.391
468 1HG1 ILE 69 HG12 ILE 69 71.659 -0.031 0.741
469 2HG1 ILE 69 HG11 ILE 69 70.719 1.184 -0.123
470 1HG2 ILE 69 HG21 ILE 69 69.647 -2.379 0.260
471 2HG2 ILE 69 HG22 ILE 69 71.409 -2.413 0.191
472 3HG2 ILE 69 HG23 ILE 69 70.462 -2.928 -1.204
473 1HD1 ILE 69 HD1 ILE 69 69.877 0.411 2.214
474 2HD1 ILE 69 HD1 ILE 69 69.339 -1.039 1.366
475 3HD1 ILE 69 HD1 ILE 69 68.704 0.539 0.904
476 H THR 70 HN THR 70 71.828 -3.076 -2.756
477 HA THR 70 HA THR 70 70.051 -2.832 -5.053
478 HB THR 70 HB THR 70 73.055 -2.687 -5.350
479 HG1 THR 70 HG1 THR 70 72.540 -0.887 -6.522
480 1HG2 THR 70 HG21 THR 70 72.271 -2.841 -7.902
481 2HG2 THR 70 HG22 THR 70 71.016 -3.852 -7.187
482 3HG2 THR 70 HG23 THR 70 72.714 -4.278 -6.979
483 H GLY 71 HN GLY 71 69.135 -4.856 -4.699
484 1HA GLY 71 HA2 GLY 71 69.083 -7.210 -5.052
485 2HA GLY 71 HA1 GLY 71 70.840 -7.198 -5.194
486 H GLY 72 HN GLY 72 69.237 -5.679 -2.481
487 1HA GLY 72 HA2 GLY 72 68.956 -6.468 -0.261
488 2HA GLY 72 HA1 GLY 72 69.625 -8.023 -0.751
489 H VAL 73 HN VAL 73 71.519 -5.439 -1.834
490 HA VAL 73 HA VAL 73 73.418 -5.797 0.472
491 HB VAL 73 HB VAL 73 75.171 -5.623 -1.215
492 1HG1 VAL 73 HG11 VAL 73 74.897 -7.761 -1.929
493 2HG1 VAL 73 HG12 VAL 73 73.391 -7.378 -2.763
494 3HG1 VAL 73 HG13 VAL 73 73.379 -7.717 -1.032
495 1HG2 VAL 73 HG21 VAL 73 72.876 -4.600 -2.795
496 2HG2 VAL 73 HG22 VAL 73 74.031 -5.597 -3.682
497 3HG2 VAL 73 HG23 VAL 73 74.578 -4.138 -2.856
498 HA PRO 74 HA PRO 74 72.991 -1.380 0.756
499 1HB PRO 74 HB2 PRO 74 74.931 -0.965 2.633
500 2HB PRO 74 HB1 PRO 74 73.338 -1.636 3.023
501 1HG PRO 74 HG2 PRO 74 75.950 -3.007 2.738
502 2HG PRO 74 HG1 PRO 74 74.595 -3.370 3.816
503 1HD PRO 74 HD2 PRO 74 75.186 -4.739 1.485
504 2HD PRO 74 HD1 PRO 74 73.604 -4.731 2.293
505 H ALA 75 HN ALA 75 73.979 0.303 -0.347
506 HA ALA 75 HA ALA 75 76.698 -0.213 -1.490
507 1HB ALA 75 HB1 ALA 75 74.853 1.937 -2.455
508 2HB ALA 75 HB2 ALA 75 74.395 0.263 -2.766
509 3HB ALA 75 HB3 ALA 75 75.925 0.886 -3.381
510 HA PRO 76 HA PRO 76 78.342 3.180 0.767
511 1HB PRO 76 HB2 PRO 76 80.116 4.234 -1.035
512 2HB PRO 76 HB1 PRO 76 80.396 2.699 -0.187
513 1HG PRO 76 HG2 PRO 76 79.440 3.180 -2.964
514 2HG PRO 76 HG1 PRO 76 80.533 1.933 -2.345
515 1HD PRO 76 HD2 PRO 76 77.903 1.483 -2.933
516 2HD PRO 76 HD1 PRO 76 78.817 0.553 -1.724
517 H SER 77 HN SER 77 77.244 5.071 1.174
518 HA SER 77 HA SER 77 76.638 6.877 -1.136
519 1HB SER 77 HB2 SER 77 74.779 5.267 -0.116
520 2HB SER 77 HB1 SER 77 74.683 6.532 1.105
521 HG SER 77 HG SER 77 73.607 7.649 -0.296
522 H ALA 78 HN ALA 78 78.227 6.578 1.730
523 HA ALA 78 HA ALA 78 79.002 8.131 3.341
524 1HB ALA 78 HB1 ALA 78 79.686 9.047 1.063
525 2HB ALA 78 HB2 ALA 78 79.571 10.251 2.347
526 3HB ALA 78 HB3 ALA 78 78.278 10.103 1.157
527 H ALA 79 HN ALA 79 75.992 7.571 3.068
528 HA ALA 79 HA ALA 79 75.118 9.626 4.983
529 1HB ALA 79 HB1 ALA 79 74.305 9.514 2.099
530 2HB ALA 79 HB2 ALA 79 74.596 10.921 3.121
531 3HB ALA 79 HB3 ALA 79 73.100 10.003 3.290
532 H CYS 80 HN CYS 80 74.276 6.896 2.888
533 HA CYS 80 HA CYS 80 71.857 5.986 3.772
534 1HB CYS 80 HB2 CYS 80 73.007 4.702 2.190
535 2HB CYS 80 HB1 CYS 80 74.474 4.650 3.141
536 H LYS 81 HN LYS 81 71.184 4.511 5.467
537 HA LYS 81 HA LYS 81 72.592 4.980 8.056
538 1HB LYS 81 HB2 LYS 81 70.411 4.387 8.998
539 2HB LYS 81 HB1 LYS 81 70.171 5.564 7.706
540 1HG LYS 81 HG2 LYS 81 68.605 4.023 7.033
541 2HG LYS 81 HG1 LYS 81 70.011 3.311 6.243
542 1HD LYS 81 HD2 LYS 81 69.952 2.386 8.949
543 2HD LYS 81 HD1 LYS 81 68.349 2.154 8.253
544 1HE LYS 81 HE2 LYS 81 70.862 1.305 6.782
545 2HE LYS 81 HE1 LYS 81 69.989 0.219 7.879
546 1HZ LYS 81 HZ1 LYS 81 67.933 0.918 6.608
547 2HZ LYS 81 HZ2 LYS 81 69.010 -0.111 5.792
548 3HZ LYS 81 HZ3 LYS 81 68.982 1.550 5.435
549 H ILE 82 HN ILE 82 71.750 2.804 9.508
550 HA ILE 82 HA ILE 82 71.868 0.257 8.262
551 HB ILE 82 HB ILE 82 74.247 1.645 7.996
552 1HG1 ILE 82 HG12 ILE 82 75.180 -0.643 7.429
553 2HG1 ILE 82 HG11 ILE 82 73.666 -1.324 8.025
554 1HG2 ILE 82 HG21 ILE 82 74.459 1.110 10.580
555 2HG2 ILE 82 HG22 ILE 82 75.855 0.942 9.513
556 3HG2 ILE 82 HG23 ILE 82 74.931 -0.484 9.989
557 1HD1 ILE 82 HD1 ILE 82 74.006 0.625 5.725
558 2HD1 ILE 82 HD1 ILE 82 72.441 0.171 6.400
559 3HD1 ILE 82 HD1 ILE 82 73.456 -1.048 5.629
560 H SER 83 HN SER 83 70.709 1.700 10.584
561 HA SER 83 HA SER 83 71.855 0.676 13.032
562 1HB SER 83 HB2 SER 83 70.484 2.618 13.101
563 2HB SER 83 HB1 SER 83 69.202 1.840 12.177
564 HG SER 83 HG SER 83 69.283 2.012 14.720
565 H GLY 84 HN GLY 84 68.492 -0.060 12.730
566 1HA GLY 84 HA2 GLY 84 69.165 -2.965 12.861
567 2HA GLY 84 HA1 GLY 84 67.735 -2.240 13.596
568 H CYS 85 HN CYS 85 69.044 -3.623 10.729
569 HA CYS 85 HA CYS 85 66.382 -3.690 9.504
570 1HB CYS 85 HB2 CYS 85 67.956 -1.485 9.055
571 2HB CYS 85 HB1 CYS 85 68.419 -2.519 7.708
572 H THR 86 HN THR 86 67.271 -4.287 6.879
573 HA THR 86 HA THR 86 69.448 -6.027 6.552
574 HB THR 86 HB THR 86 68.625 -7.398 8.334
575 HG1 THR 86 HG1 THR 86 67.696 -8.458 5.879
576 1HG2 THR 86 HG21 THR 86 66.455 -7.365 8.934
577 2HG2 THR 86 HG22 THR 86 66.003 -8.113 7.401
578 3HG2 THR 86 HG23 THR 86 66.112 -6.358 7.528
579 H PHE 87 HN PHE 87 69.371 -7.043 4.481
580 HA PHE 87 HA PHE 87 66.869 -6.489 2.913
581 1HB PHE 87 HB2 PHE 87 69.541 -6.623 1.573
582 2HB PHE 87 HB1 PHE 87 68.148 -5.620 1.187
583 HD1 PHE 87 HD1 PHE 87 71.309 -5.087 1.759
584 HD2 PHE 87 HD2 PHE 87 67.618 -4.346 3.841
585 HE1 PHE 87 HE1 PHE 87 72.359 -3.193 2.960
586 HE2 PHE 87 HE2 PHE 87 68.676 -2.448 5.039
587 HZ PHE 87 HZ PHE 87 71.047 -1.871 4.599
588 H SER 88 HN SER 88 66.193 -8.188 1.548
589 HA SER 88 HA SER 88 67.819 -10.709 1.685
590 1HB SER 88 HB2 SER 88 65.476 -10.311 2.902
591 2HB SER 88 HB1 SER 88 64.852 -10.705 1.304
592 HG SER 88 HG SER 88 66.577 -12.507 1.601
593 H ALA 89 HN ALA 89 67.135 -8.317 -0.374
594 HA ALA 89 HA ALA 89 67.158 -8.198 -2.736
595 1HB ALA 89 HB1 ALA 89 67.460 -11.181 -2.823
596 2HB ALA 89 HB2 ALA 89 68.747 -10.226 -2.088
597 3HB ALA 89 HB3 ALA 89 68.295 -9.949 -3.770
598 H ASN 90 HN ASN 90 64.696 -7.904 -2.048
599 HA ASN 90 HA ASN 90 63.009 -10.138 -3.074
600 1HB ASN 90 HB2 ASN 90 62.529 -9.150 -0.866
601 2HB ASN 90 HB1 ASN 90 62.355 -7.559 -1.595
602 1HD2 ASN 90 HD2 ASN 90 60.638 -7.568 -3.506
603 2HD2 ASN 90 HD2 ASN 90 59.219 -8.450 -3.212
Start of MODEL 5
1 1H ASP 1 HT1 ASP 1 47.911 2.741 3.730
2 2H ASP 1 HT2 ASP 1 48.942 3.410 2.557
3 3H ASP 1 HT3 ASP 1 47.499 2.645 2.088
4 HA ASP 1 HA ASP 1 47.066 4.796 3.957
5 1HB ASP 1 HB2 ASP 1 48.612 5.119 1.394
6 2HB ASP 1 HB1 ASP 1 47.561 6.420 1.953
7 H GLY 2 HN GLY 2 46.783 4.498 0.409
8 1HA GLY 2 HA2 GLY 2 43.976 3.688 0.590
9 2HA GLY 2 HA1 GLY 2 44.205 5.350 0.046
10 H SER 3 HN SER 3 45.518 5.678 -1.916
11 HA SER 3 HA SER 3 45.164 3.403 -3.809
12 1HB SER 3 HB2 SER 3 45.481 6.399 -4.064
13 2HB SER 3 HB1 SER 3 45.539 5.332 -5.465
14 HG SER 3 HG SER 3 43.412 6.286 -4.254
15 H CYS 4 HN CYS 4 47.401 5.880 -4.695
16 HA CYS 4 HA CYS 4 49.724 5.803 -5.098
17 1HB CYS 4 HB2 CYS 4 49.182 4.496 -2.504
18 2HB CYS 4 HB1 CYS 4 50.731 4.067 -3.228
19 H THR 5 HN THR 5 49.439 2.487 -3.845
20 HA THR 5 HA THR 5 49.867 0.423 -4.893
21 HB THR 5 HB THR 5 48.085 2.011 -6.469
22 HG1 THR 5 HG1 THR 5 47.070 0.172 -6.393
23 1HG2 THR 5 HG21 THR 5 49.839 0.198 -8.149
24 2HG2 THR 5 HG22 THR 5 49.909 1.959 -8.187
25 3HG2 THR 5 HG23 THR 5 48.444 1.123 -8.706
26 H ASN 6 HN ASN 6 51.790 2.909 -5.076
27 HA ASN 6 HA ASN 6 53.895 3.343 -6.060
28 1HB ASN 6 HB2 ASN 6 55.001 1.522 -5.281
29 2HB ASN 6 HB1 ASN 6 53.495 0.614 -5.281
30 1HD2 ASN 6 HD2 ASN 6 52.898 -0.250 -7.624
31 2HD2 ASN 6 HD2 ASN 6 54.189 -0.879 -8.525
32 H THR 7 HN THR 7 51.437 3.267 -7.741
33 HA THR 7 HA THR 7 51.023 3.745 -10.024
34 HB THR 7 HB THR 7 53.789 2.736 -10.667
35 HG1 THR 7 HG1 THR 7 54.562 4.145 -9.341
36 1HG2 THR 7 HG21 THR 7 51.853 4.763 -11.755
37 2HG2 THR 7 HG22 THR 7 52.681 3.456 -12.599
38 3HG2 THR 7 HG23 THR 7 53.575 4.897 -12.115
39 H ASN 8 HN ASN 8 51.762 0.819 -8.612
40 HA ASN 8 HA ASN 8 50.056 -0.818 -10.064
41 1HB ASN 8 HB2 ASN 8 52.524 -0.155 -11.496
42 2HB ASN 8 HB1 ASN 8 52.269 -1.895 -11.356
43 1HD2 ASN 8 HD2 ASN 8 49.670 -2.384 -11.693
44 2HD2 ASN 8 HD2 ASN 8 49.037 -1.679 -13.102
45 H SER 9 HN SER 9 50.047 -1.600 -7.817
46 HA SER 9 HA SER 9 51.628 -3.965 -7.398
47 1HB SER 9 HB2 SER 9 53.015 -3.047 -5.522
48 2HB SER 9 HB1 SER 9 53.407 -2.333 -7.078
49 HG SER 9 HG SER 9 51.795 -1.256 -5.005
50 H GLN 10 HN GLN 10 51.668 -3.652 -4.448
51 HA GLN 10 HA GLN 10 48.717 -3.853 -3.971
52 1HB GLN 10 HB2 GLN 10 50.712 -5.690 -3.650
53 2HB GLN 10 HB1 GLN 10 50.666 -4.973 -2.041
54 1HG GLN 10 HG2 GLN 10 48.252 -5.414 -1.892
55 2HG GLN 10 HG1 GLN 10 48.268 -6.098 -3.518
56 1HE2 GLN 10 HE21 GLN 10 50.662 -6.556 -0.869
57 2HE2 GLN 10 HE22 GLN 10 50.478 -8.241 -0.794
58 H LEU 11 HN LEU 11 51.779 -2.751 -2.479
59 HA LEU 11 HA LEU 11 52.137 -1.221 -0.704
60 1HB LEU 11 HB2 LEU 11 51.403 0.201 -2.604
61 2HB LEU 11 HB1 LEU 11 49.728 0.007 -2.082
62 HG LEU 11 HG LEU 11 50.224 1.078 0.053
63 1HD1 LEU 11 HD1 LEU 11 53.051 1.031 -1.016
64 2HD1 LEU 11 HD1 LEU 11 52.451 0.378 0.509
65 3HD1 LEU 11 HD1 LEU 11 52.561 2.123 0.278
66 1HD2 LEU 11 HD2 LEU 11 50.725 2.372 -2.537
67 2HD2 LEU 11 HD2 LEU 11 51.413 3.247 -1.169
68 3HD2 LEU 11 HD2 LEU 11 49.685 2.889 -1.210
69 H SER 12 HN SER 12 51.470 -2.718 0.997
70 HA SER 12 HA SER 12 48.957 -3.383 1.931
71 1HB SER 12 HB2 SER 12 50.409 -4.205 3.455
72 2HB SER 12 HB1 SER 12 51.639 -3.052 2.953
73 HG SER 12 HG SER 12 50.811 -2.937 5.205
74 H ALA 13 HN ALA 13 47.365 -2.371 3.254
75 HA ALA 13 HA ALA 13 46.874 0.415 2.866
76 1HB ALA 13 HB1 ALA 13 44.934 -0.069 4.044
77 2HB ALA 13 HB2 ALA 13 45.784 -1.059 5.231
78 3HB ALA 13 HB3 ALA 13 45.435 -1.708 3.628
79 H ASN 14 HN ASN 14 48.813 -1.286 5.208
80 HA ASN 14 HA ASN 14 48.870 0.959 7.121
81 1HB ASN 14 HB2 ASN 14 48.918 -1.263 8.012
82 2HB ASN 14 HB1 ASN 14 50.186 -1.757 6.890
83 1HD2 ASN 14 HD2 ASN 14 52.384 -0.834 7.257
84 2HD2 ASN 14 HD2 ASN 14 52.820 -0.280 8.799
85 H SER 15 HN SER 15 50.365 0.284 4.192
86 HA SER 15 HA SER 15 53.061 1.231 4.821
87 1HB SER 15 HB2 SER 15 52.615 -0.359 3.019
88 2HB SER 15 HB1 SER 15 51.515 0.781 2.247
89 HG SER 15 HG SER 15 54.285 1.204 2.738
90 H LYS 16 HN LYS 16 53.554 3.030 2.740
91 HA LYS 16 HA LYS 16 51.613 5.252 2.921
92 1HB LYS 16 HB2 LYS 16 53.400 4.997 4.932
93 2HB LYS 16 HB1 LYS 16 54.385 5.913 3.792
94 1HG LYS 16 HG2 LYS 16 52.885 7.736 3.775
95 2HG LYS 16 HG1 LYS 16 51.568 6.771 4.444
96 1HD LYS 16 HD2 LYS 16 52.738 6.600 6.585
97 2HD LYS 16 HD1 LYS 16 54.111 7.494 5.929
98 1HE LYS 16 HE2 LYS 16 52.992 9.272 6.895
99 2HE LYS 16 HE1 LYS 16 52.115 9.242 5.352
100 1HZ LYS 16 HZ1 LYS 16 51.338 7.976 7.915
101 2HZ LYS 16 HZ2 LYS 16 50.645 7.515 6.434
102 3HZ LYS 16 HZ3 LYS 16 50.463 9.105 7.003
103 H CYS 17 HN CYS 17 52.765 7.271 1.793
104 HA CYS 17 HA CYS 17 54.909 6.930 -0.040
105 1HB CYS 17 HB2 CYS 17 53.410 6.598 -2.114
106 2HB CYS 17 HB1 CYS 17 53.663 5.189 -1.085
107 H GLU 18 HN GLU 18 54.003 9.058 1.521
108 HA GLU 18 HA GLU 18 52.291 10.992 0.577
109 1HB GLU 18 HB2 GLU 18 53.974 10.986 2.519
110 2HB GLU 18 HB1 GLU 18 55.151 11.591 1.353
111 1HG GLU 18 HG2 GLU 18 53.116 13.281 0.831
112 2HG GLU 18 HG1 GLU 18 52.783 12.950 2.531
113 H LYS 19 HN LYS 19 55.652 10.553 -0.618
114 HA LYS 19 HA LYS 19 54.837 11.402 -3.311
115 1HB LYS 19 HB2 LYS 19 55.941 13.217 -1.293
116 2HB LYS 19 HB1 LYS 19 56.883 13.209 -2.785
117 1HG LYS 19 HG2 LYS 19 53.892 13.659 -2.571
118 2HG LYS 19 HG1 LYS 19 55.104 14.890 -2.930
119 1HD LYS 19 HD2 LYS 19 55.357 12.588 -4.699
120 2HD LYS 19 HD1 LYS 19 53.753 13.317 -4.802
121 1HE LYS 19 HE2 LYS 19 55.876 15.335 -4.713
122 2HE LYS 19 HE1 LYS 19 56.016 14.256 -6.114
123 1HZ LYS 19 HZ1 LYS 19 53.625 14.579 -6.510
124 2HZ LYS 19 HZ2 LYS 19 54.492 16.035 -6.629
125 3HZ LYS 19 HZ3 LYS 19 53.571 15.704 -5.240
126 H SER 20 HN SER 20 55.808 9.133 -3.468
127 HA SER 20 HA SER 20 58.806 9.247 -3.524
128 1HB SER 20 HB2 SER 20 57.332 6.663 -3.576
129 2HB SER 20 HB1 SER 20 58.800 7.095 -2.705
130 HG SER 20 HG SER 20 56.836 6.798 -1.411
131 H THR 21 HN THR 21 58.940 6.777 -5.065
132 HA THR 21 HA THR 21 57.558 7.339 -7.617
133 HB THR 21 HB THR 21 60.102 7.262 -8.546
134 HG1 THR 21 HG1 THR 21 60.866 7.194 -6.352
135 1HG2 THR 21 HG21 THR 21 58.355 8.990 -8.984
136 2HG2 THR 21 HG22 THR 21 59.958 9.686 -8.755
137 3HG2 THR 21 HG23 THR 21 58.772 9.757 -7.452
138 H LEU 22 HN LEU 22 56.809 5.125 -6.844
139 HA LEU 22 HA LEU 22 58.836 2.965 -7.105
140 1HB LEU 22 HB2 LEU 22 55.899 2.628 -6.526
141 2HB LEU 22 HB1 LEU 22 57.249 1.650 -5.960
142 HG LEU 22 HG LEU 22 56.481 4.435 -5.050
143 1HD1 LEU 22 HD1 LEU 22 56.635 1.709 -3.754
144 2HD1 LEU 22 HD1 LEU 22 55.232 2.769 -3.892
145 3HD1 LEU 22 HD1 LEU 22 56.557 3.196 -2.809
146 1HD2 LEU 22 HD2 LEU 22 58.800 2.972 -3.860
147 2HD2 LEU 22 HD2 LEU 22 58.524 4.708 -4.003
148 3HD2 LEU 22 HD2 LEU 22 59.059 3.784 -5.404
149 H THR 23 HN THR 23 57.329 0.900 -8.112
150 HA THR 23 HA THR 23 56.051 1.752 -10.640
151 HB THR 23 HB THR 23 58.664 0.218 -10.472
152 HG1 THR 23 HG1 THR 23 59.530 2.036 -11.083
153 1HG2 THR 23 HG21 THR 23 56.904 -0.541 -12.210
154 2HG2 THR 23 HG22 THR 23 58.526 -0.168 -12.795
155 3HG2 THR 23 HG23 THR 23 57.224 1.004 -12.999
156 H ASN 24 HN ASN 24 57.440 -1.047 -8.878
157 HA ASN 24 HA ASN 24 54.872 -2.506 -9.313
158 1HB ASN 24 HB2 ASN 24 57.574 -3.075 -10.407
159 2HB ASN 24 HB1 ASN 24 56.708 -4.464 -9.753
160 1HD2 ASN 24 HD2 ASN 24 57.273 -3.932 -12.615
161 2HD2 ASN 24 HD2 ASN 24 55.762 -3.834 -13.383
162 H CYS 25 HN CYS 25 56.510 -1.298 -6.962
163 HA CYS 25 HA CYS 25 57.636 -3.365 -5.374
164 1HB CYS 25 HB2 CYS 25 57.101 -0.645 -5.155
165 2HB CYS 25 HB1 CYS 25 56.095 -1.347 -3.895
166 H TYR 26 HN TYR 26 56.022 -3.088 -2.998
167 HA TYR 26 HA TYR 26 53.362 -4.197 -3.526
168 1HB TYR 26 HB2 TYR 26 55.736 -5.843 -3.215
169 2HB TYR 26 HB1 TYR 26 54.601 -6.152 -1.900
170 HD1 TYR 26 HD1 TYR 26 55.074 -6.205 -5.562
171 HD2 TYR 26 HD2 TYR 26 52.421 -7.120 -2.313
172 HE1 TYR 26 HE1 TYR 26 53.645 -7.523 -7.103
173 HE2 TYR 26 HE2 TYR 26 50.992 -8.439 -3.850
174 HH TYR 26 HH TYR 26 50.547 -8.428 -6.411
175 H VAL 27 HN VAL 27 55.981 -4.063 -1.140
176 HA VAL 27 HA VAL 27 56.015 -3.365 1.107
177 HB VAL 27 HB VAL 27 53.909 -1.447 0.095
178 1HG1 VAL 27 HG11 VAL 27 55.992 -1.505 2.243
179 2HG1 VAL 27 HG12 VAL 27 54.340 -0.889 2.306
180 3HG1 VAL 27 HG13 VAL 27 55.600 0.045 1.498
181 1HG2 VAL 27 HG21 VAL 27 55.430 -1.280 -1.662
182 2HG2 VAL 27 HG22 VAL 27 56.790 -1.800 -0.668
183 3HG2 VAL 27 HG23 VAL 27 56.163 -0.160 -0.513
184 H ASP 28 HN ASP 28 55.156 -4.555 2.725
185 HA ASP 28 HA ASP 28 52.186 -4.925 2.847
186 1HB ASP 28 HB2 ASP 28 54.371 -6.691 2.963
187 2HB ASP 28 HB1 ASP 28 53.814 -6.557 4.632
188 H LYS 29 HN LYS 29 54.969 -3.559 4.388
189 HA LYS 29 HA LYS 29 53.357 -2.128 6.350
190 1HB LYS 29 HB2 LYS 29 54.719 -4.676 6.996
191 2HB LYS 29 HB1 LYS 29 55.068 -3.360 8.114
192 1HG LYS 29 HG2 LYS 29 52.950 -3.307 8.934
193 2HG LYS 29 HG1 LYS 29 52.224 -3.611 7.357
194 1HD LYS 29 HD2 LYS 29 51.766 -5.557 8.659
195 2HD LYS 29 HD1 LYS 29 53.085 -6.009 7.577
196 1HE LYS 29 HE2 LYS 29 54.271 -4.871 9.911
197 2HE LYS 29 HE1 LYS 29 53.068 -6.060 10.446
198 1HZ LYS 29 HZ1 LYS 29 53.992 -7.705 9.053
199 2HZ LYS 29 HZ2 LYS 29 55.312 -6.995 9.854
200 3HZ LYS 29 HZ3 LYS 29 54.976 -6.588 8.240
201 H SER 30 HN SER 30 54.580 -0.402 5.149
202 HA SER 30 HA SER 30 57.156 0.151 6.469
203 1HB SER 30 HB2 SER 30 56.855 -0.569 3.559
204 2HB SER 30 HB1 SER 30 58.226 0.368 4.137
205 HG SER 30 HG SER 30 57.575 -2.298 4.521
206 H GLU 31 HN GLU 31 58.014 2.277 5.845
207 HA GLU 31 HA GLU 31 55.876 4.140 4.856
208 1HB GLU 31 HB2 GLU 31 57.173 3.951 7.341
209 2HB GLU 31 HB1 GLU 31 57.968 5.299 6.528
210 1HG GLU 31 HG2 GLU 31 55.760 6.321 6.075
211 2HG GLU 31 HG1 GLU 31 54.976 4.980 6.911
212 H VAL 32 HN VAL 32 56.642 4.235 2.687
213 HA VAL 32 HA VAL 32 59.519 4.792 2.221
214 HB VAL 32 HB VAL 32 57.253 4.477 0.236
215 1HG1 VAL 32 HG11 VAL 32 59.041 5.001 -1.089
216 2HG1 VAL 32 HG12 VAL 32 59.464 3.309 -0.831
217 3HG1 VAL 32 HG13 VAL 32 60.216 4.565 0.153
218 1HG2 VAL 32 HG21 VAL 32 58.091 2.583 2.169
219 2HG2 VAL 32 HG22 VAL 32 58.839 2.088 0.651
220 3HG2 VAL 32 HG23 VAL 32 57.089 2.283 0.748
221 H TYR 33 HN TYR 33 60.001 6.576 0.551
222 HA TYR 33 HA TYR 33 58.055 8.825 0.591
223 1HB TYR 33 HB2 TYR 33 60.668 8.630 2.037
224 2HB TYR 33 HB1 TYR 33 60.199 10.195 1.371
225 HD1 TYR 33 HD1 TYR 33 58.384 11.464 2.302
226 HD2 TYR 33 HD2 TYR 33 59.214 7.490 3.705
227 HE1 TYR 33 HE1 TYR 33 56.846 11.819 4.214
228 HE2 TYR 33 HE2 TYR 33 57.678 7.842 5.621
229 HH TYR 33 HH TYR 33 56.347 9.277 6.669
230 H GLY 34 HN GLY 34 61.330 7.753 -0.400
231 1HA GLY 34 HA2 GLY 34 60.834 8.982 -3.061
232 2HA GLY 34 HA1 GLY 34 62.275 9.492 -2.179
233 H THR 35 HN THR 35 61.096 6.197 -1.938
234 HA THR 35 HA THR 35 63.665 5.204 -2.952
235 HB THR 35 HB THR 35 61.158 4.067 -1.738
236 HG1 THR 35 HG1 THR 35 63.815 3.539 -1.014
237 1HG2 THR 35 HG21 THR 35 63.174 2.636 -3.405
238 2HG2 THR 35 HG22 THR 35 61.464 2.282 -3.161
239 3HG2 THR 35 HG23 THR 35 62.642 1.844 -1.922
240 H THR 36 HN THR 36 63.923 3.903 -4.819
241 HA THR 36 HA THR 36 61.900 4.359 -6.950
242 HB THR 36 HB THR 36 64.373 4.878 -7.162
243 HG1 THR 36 HG1 THR 36 64.088 2.971 -9.070
244 1HG2 THR 36 HG21 THR 36 64.743 2.487 -5.943
245 2HG2 THR 36 HG22 THR 36 65.971 3.262 -6.943
246 3HG2 THR 36 HG23 THR 36 64.941 2.006 -7.629
247 H CYS 37 HN CYS 37 60.861 2.590 -5.183
248 HA CYS 37 HA CYS 37 61.391 -0.085 -5.062
249 1HB CYS 37 HB2 CYS 37 59.005 1.611 -5.237
250 2HB CYS 37 HB1 CYS 37 58.710 -0.046 -5.744
251 H THR 38 HN THR 38 62.497 -1.005 -6.850
252 HA THR 38 HA THR 38 61.085 -0.978 -9.484
253 HB THR 38 HB THR 38 63.881 -1.912 -8.779
254 HG1 THR 38 HG1 THR 38 63.298 0.571 -9.935
255 1HG2 THR 38 HG21 THR 38 63.994 -2.440 -10.958
256 2HG2 THR 38 HG22 THR 38 63.590 -0.778 -11.387
257 3HG2 THR 38 HG23 THR 38 62.306 -1.966 -11.156
258 H GLY 39 HN GLY 39 59.561 -2.588 -8.247
259 1HA GLY 39 HA2 GLY 39 58.761 -4.805 -8.308
260 2HA GLY 39 HA1 GLY 39 60.250 -5.273 -9.128
261 H SER 40 HN SER 40 59.374 -3.981 -5.900
262 HA SER 40 HA SER 40 60.936 -6.231 -4.691
263 1HB SER 40 HB2 SER 40 61.079 -3.271 -4.028
264 2HB SER 40 HB1 SER 40 61.911 -4.543 -3.136
265 HG SER 40 HG SER 40 62.651 -5.054 -5.478
266 H ARG 41 HN ARG 41 60.548 -5.664 -2.040
267 HA ARG 41 HA ARG 41 57.776 -4.856 -1.514
268 1HB ARG 41 HB2 ARG 41 57.530 -7.112 -2.486
269 2HB ARG 41 HB1 ARG 41 58.659 -7.751 -1.291
270 1HG ARG 41 HG2 ARG 41 57.166 -7.339 0.509
271 2HG ARG 41 HG1 ARG 41 56.150 -6.283 -0.472
272 1HD ARG 41 HD2 ARG 41 54.854 -8.172 -0.677
273 2HD ARG 41 HD1 ARG 41 56.040 -8.610 -1.923
274 HE ARG 41 HE ARG 41 57.308 -9.813 -0.119
275 1HH1 ARG 41 HH1 ARG 41 55.997 -8.798 2.309
276 2HH1 ARG 41 HH1 ARG 41 54.842 -10.034 2.682
277 1HH2 ARG 41 HH2 ARG 41 54.974 -11.481 -0.465
278 2HH2 ARG 41 HH2 ARG 41 54.273 -11.560 1.116
279 H PHE 42 HN PHE 42 57.483 -4.416 0.673
280 HA PHE 42 HA PHE 42 59.817 -4.973 2.469
281 1HB PHE 42 HB2 PHE 42 57.723 -2.791 2.694
282 2HB PHE 42 HB1 PHE 42 59.259 -2.889 3.556
283 HD1 PHE 42 HD1 PHE 42 57.909 -0.834 1.399
284 HD2 PHE 42 HD2 PHE 42 61.095 -3.714 1.373
285 HE1 PHE 42 HE1 PHE 42 59.020 0.414 -0.430
286 HE2 PHE 42 HE2 PHE 42 62.207 -2.466 -0.459
287 HZ PHE 42 HZ PHE 42 61.167 -0.400 -1.360
288 H ASP 43 HN ASP 43 59.009 -5.000 4.866
289 HA ASP 43 HA ASP 43 56.251 -5.981 5.227
290 1HB ASP 43 HB2 ASP 43 58.323 -7.742 4.580
291 2HB ASP 43 HB1 ASP 43 58.171 -7.884 6.331
292 H GLY 44 HN GLY 44 57.584 -3.711 6.238
293 1HA GLY 44 HA2 GLY 44 57.037 -3.052 8.624
294 2HA GLY 44 HA1 GLY 44 57.981 -4.464 9.096
295 H VAL 45 HN VAL 45 58.294 -1.414 7.245
296 HA VAL 45 HA VAL 45 60.981 -1.043 8.463
297 HB VAL 45 HB VAL 45 62.133 -1.090 6.429
298 1HG1 VAL 45 HG11 VAL 45 61.415 -3.061 5.172
299 2HG1 VAL 45 HG12 VAL 45 59.816 -2.967 5.908
300 3HG1 VAL 45 HG13 VAL 45 61.226 -3.338 6.904
301 1HG2 VAL 45 HG21 VAL 45 60.457 -1.130 4.261
302 2HG2 VAL 45 HG22 VAL 45 61.233 0.323 4.893
303 3HG2 VAL 45 HG23 VAL 45 59.580 -0.066 5.362
304 H THR 46 HN THR 46 61.832 1.122 7.091
305 HA THR 46 HA THR 46 59.658 3.085 6.750
306 HB THR 46 HB THR 46 61.781 3.368 8.901
307 HG1 THR 46 HG1 THR 46 60.428 2.276 10.055
308 1HG2 THR 46 HG21 THR 46 60.597 5.374 7.574
309 2HG2 THR 46 HG22 THR 46 60.939 5.476 9.301
310 3HG2 THR 46 HG23 THR 46 59.320 5.051 8.748
311 H ILE 47 HN ILE 47 61.207 2.377 4.712
312 HA ILE 47 HA ILE 47 63.734 3.845 4.624
313 HB ILE 47 HB ILE 47 63.363 1.708 3.444
314 1HG1 ILE 47 HG12 ILE 47 63.566 3.782 1.278
315 2HG1 ILE 47 HG11 ILE 47 64.802 3.720 2.535
316 1HG2 ILE 47 HG21 ILE 47 61.529 1.322 2.181
317 2HG2 ILE 47 HG22 ILE 47 61.740 2.828 1.290
318 3HG2 ILE 47 HG23 ILE 47 60.886 2.828 2.832
319 1HD1 ILE 47 HD1 ILE 47 63.998 1.192 1.128
320 2HD1 ILE 47 HD1 ILE 47 65.527 1.593 1.909
321 3HD1 ILE 47 HD1 ILE 47 65.122 2.305 0.347
322 H THR 48 HN THR 48 64.092 5.414 2.793
323 HA THR 48 HA THR 48 61.686 7.036 2.110
324 HB THR 48 HB THR 48 62.948 9.042 2.917
325 HG1 THR 48 HG1 THR 48 65.029 8.454 2.834
326 1HG2 THR 48 HG21 THR 48 62.781 6.900 5.050
327 2HG2 THR 48 HG22 THR 48 61.371 7.735 4.398
328 3HG2 THR 48 HG23 THR 48 62.608 8.641 5.270
329 H THR 49 HN THR 49 63.845 9.111 1.287
330 HA THR 49 HA THR 49 64.042 8.451 -1.467
331 HB THR 49 HB THR 49 65.764 10.179 0.336
332 HG1 THR 49 HG1 THR 49 64.250 11.629 0.053
333 1HG2 THR 49 HG21 THR 49 66.698 9.464 -1.959
334 2HG2 THR 49 HG22 THR 49 66.652 11.191 -1.598
335 3HG2 THR 49 HG23 THR 49 65.422 10.474 -2.642
336 H SER 50 HN SER 50 64.801 6.148 -1.400
337 HA SER 50 HA SER 50 67.782 6.035 -1.229
338 1HB SER 50 HB2 SER 50 65.765 4.197 0.092
339 2HB SER 50 HB1 SER 50 67.485 3.837 -0.024
340 HG SER 50 HG SER 50 66.166 5.488 1.673
341 H THR 51 HN THR 51 68.680 4.767 -2.850
342 HA THR 51 HA THR 51 66.831 3.692 -4.891
343 HB THR 51 HB THR 51 69.631 3.230 -5.368
344 HG1 THR 51 HG1 THR 51 68.998 5.911 -4.751
345 1HG2 THR 51 HG21 THR 51 68.345 3.573 -7.266
346 2HG2 THR 51 HG22 THR 51 69.050 5.176 -7.063
347 3HG2 THR 51 HG23 THR 51 67.403 4.862 -6.516
348 H SER 52 HN SER 52 66.162 1.605 -4.671
349 HA SER 52 HA SER 52 68.120 -0.407 -3.630
350 1HB SER 52 HB2 SER 52 66.193 -1.395 -2.388
351 2HB SER 52 HB1 SER 52 66.550 0.248 -1.868
352 HG SER 52 HG SER 52 64.261 -0.607 -2.632
353 H THR 53 HN THR 53 68.473 -1.755 -5.342
354 HA THR 53 HA THR 53 66.262 -2.316 -7.262
355 HB THR 53 HB THR 53 68.997 -3.444 -7.582
356 HG1 THR 53 HG1 THR 53 69.902 -1.607 -7.177
357 1HG2 THR 53 HG21 THR 53 68.466 -2.102 -9.841
358 2HG2 THR 53 HG22 THR 53 66.818 -2.261 -9.234
359 3HG2 THR 53 HG23 THR 53 67.793 -3.701 -9.525
360 H GLY 54 HN GLY 54 65.031 -3.818 -5.938
361 1HA GLY 54 HA2 GLY 54 64.490 -6.025 -5.292
362 2HA GLY 54 HA1 GLY 54 66.016 -6.550 -6.012
363 H SER 55 HN SER 55 64.415 -5.884 -3.077
364 HA SER 55 HA SER 55 66.642 -6.816 -1.484
365 1HB SER 55 HB2 SER 55 67.162 -4.644 -0.428
366 2HB SER 55 HB1 SER 55 67.445 -4.573 -2.164
367 HG SER 55 HG SER 55 65.040 -3.876 -2.061
368 H ARG 56 HN ARG 56 65.151 -8.056 -0.278
369 HA ARG 56 HA ARG 56 62.588 -7.131 0.614
370 1HB ARG 56 HB2 ARG 56 63.051 -9.472 0.589
371 2HB ARG 56 HB1 ARG 56 64.539 -9.262 1.514
372 1HG ARG 56 HG2 ARG 56 63.262 -8.598 3.485
373 2HG ARG 56 HG1 ARG 56 61.755 -8.692 2.572
374 1HD ARG 56 HD2 ARG 56 63.423 -11.144 2.483
375 2HD ARG 56 HD1 ARG 56 62.710 -10.761 4.063
376 HE ARG 56 HE ARG 56 60.929 -10.593 1.695
377 1HH1 ARG 56 HH2 ARG 56 62.161 -13.207 3.221
378 2HH1 ARG 56 HH2 ARG 56 60.688 -13.752 3.952
379 1HH2 ARG 56 HH1 ARG 56 58.933 -10.858 3.194
380 2HH2 ARG 56 HH1 ARG 56 58.858 -12.425 3.930
381 H ILE 57 HN ILE 57 62.526 -5.221 1.801
382 HA ILE 57 HA ILE 57 64.629 -4.583 3.745
383 HB ILE 57 HB ILE 57 61.987 -3.173 3.306
384 1HG1 ILE 57 HG12 ILE 57 63.035 -3.634 1.097
385 2HG1 ILE 57 HG11 ILE 57 63.092 -1.917 1.491
386 1HG2 ILE 57 HG21 ILE 57 64.605 -1.801 3.693
387 2HG2 ILE 57 HG22 ILE 57 63.930 -2.645 5.086
388 3HG2 ILE 57 HG23 ILE 57 63.008 -1.363 4.300
389 1HD1 ILE 57 HD1 ILE 57 65.336 -3.935 1.666
390 2HD1 ILE 57 HD1 ILE 57 65.419 -2.358 2.452
391 3HD1 ILE 57 HD1 ILE 57 65.274 -2.463 0.698
392 H SER 58 HN SER 58 62.346 -6.827 3.970
393 HA SER 58 HA SER 58 60.572 -6.525 6.031
394 1HB SER 58 HB2 SER 58 62.457 -8.631 5.156
395 2HB SER 58 HB1 SER 58 61.825 -8.840 6.785
396 HG SER 58 HG SER 58 60.159 -9.620 5.760
397 H GLY 59 HN GLY 59 60.670 -6.503 8.373
398 1HA GLY 59 HA2 GLY 59 62.902 -6.816 10.000
399 2HA GLY 59 HA1 GLY 59 63.000 -5.144 9.455
400 HA PRO 60 HA PRO 60 59.750 -5.734 12.842
401 1HB PRO 60 HB2 PRO 60 61.229 -5.907 15.137
402 2HB PRO 60 HB1 PRO 60 60.706 -7.332 14.220
403 1HG PRO 60 HG2 PRO 60 63.370 -6.072 14.381
404 2HG PRO 60 HG1 PRO 60 62.931 -7.760 14.098
405 1HD PRO 60 HD2 PRO 60 63.746 -5.920 12.156
406 2HD PRO 60 HD1 PRO 60 62.972 -7.490 11.854
407 H GLY 61 HN GLY 61 60.270 -3.457 11.658
408 1HA GLY 61 HA2 GLY 61 59.899 -1.176 12.501
409 2HA GLY 61 HA1 GLY 61 60.978 -1.553 13.846
410 H CYS 62 HN CYS 62 61.819 -2.641 10.654
411 HA CYS 62 HA CYS 62 64.411 -1.733 10.522
412 1HB CYS 62 HB2 CYS 62 62.389 -2.675 8.757
413 2HB CYS 62 HB1 CYS 62 63.158 -1.303 7.964
414 H LYS 63 HN LYS 63 65.393 0.152 9.415
415 HA LYS 63 HA LYS 63 63.706 2.578 9.136
416 1HB LYS 63 HB2 LYS 63 64.262 2.468 11.521
417 2HB LYS 63 HB1 LYS 63 65.970 2.236 11.134
418 1HG LYS 63 HG2 LYS 63 66.008 4.445 10.024
419 2HG LYS 63 HG1 LYS 63 64.314 4.684 10.453
420 1HD LYS 63 HD2 LYS 63 64.793 4.798 12.766
421 2HD LYS 63 HD1 LYS 63 66.391 4.080 12.559
422 1HE LYS 63 HE2 LYS 63 66.110 6.511 10.969
423 2HE LYS 63 HE1 LYS 63 65.844 6.816 12.697
424 1HZ LYS 63 HZ1 LYS 63 67.850 5.300 13.032
425 2HZ LYS 63 HZ2 LYS 63 68.150 6.876 12.473
426 3HZ LYS 63 HZ3 LYS 63 68.184 5.567 11.389
427 H ILE 64 HN ILE 64 64.410 3.169 7.069
428 HA ILE 64 HA ILE 64 67.379 3.250 6.636
429 HB ILE 64 HB ILE 64 65.217 2.740 4.580
430 1HG1 ILE 64 HG12 ILE 64 66.589 0.371 4.927
431 2HG1 ILE 64 HG11 ILE 64 66.444 0.967 6.580
432 1HG2 ILE 64 HG21 ILE 64 68.227 2.368 4.581
433 2HG2 ILE 64 HG22 ILE 64 67.321 3.571 3.662
434 3HG2 ILE 64 HG23 ILE 64 67.151 1.858 3.279
435 1HD1 ILE 64 HD1 ILE 64 63.937 1.474 5.667
436 2HD1 ILE 64 HD1 ILE 64 64.389 -0.029 6.471
437 3HD1 ILE 64 HD1 ILE 64 64.336 0.047 4.709
438 H SER 65 HN SER 65 68.156 5.007 5.342
439 HA SER 65 HA SER 65 66.272 7.060 4.384
440 1HB SER 65 HB2 SER 65 68.345 8.035 6.295
441 2HB SER 65 HB1 SER 65 66.723 8.652 5.991
442 HG SER 65 HG SER 65 66.186 7.566 7.700
443 H THR 66 HN THR 66 67.157 7.203 2.354
444 HA THR 66 HA THR 66 68.719 7.733 0.673
445 HB THR 66 HB THR 66 70.732 8.633 2.650
446 HG1 THR 66 HG1 THR 66 68.095 9.651 2.494
447 1HG2 THR 66 HG21 THR 66 69.704 10.662 0.934
448 2HG2 THR 66 HG22 THR 66 69.859 9.182 -0.017
449 3HG2 THR 66 HG23 THR 66 71.261 9.837 0.831
450 H CYS 67 HN CYS 67 68.891 5.254 0.643
451 HA CYS 67 HA CYS 67 71.745 4.470 1.193
452 1HB CYS 67 HB2 CYS 67 69.789 3.603 2.748
453 2HB CYS 67 HB1 CYS 67 69.467 2.518 1.404
454 H ILE 68 HN ILE 68 72.657 3.955 -0.780
455 HA ILE 68 HA ILE 68 70.945 3.296 -3.082
456 HB ILE 68 HB ILE 68 73.938 3.558 -2.646
457 1HG1 ILE 68 HG12 ILE 68 73.589 5.581 -4.101
458 2HG1 ILE 68 HG11 ILE 68 71.852 5.285 -4.021
459 1HG2 ILE 68 HG21 ILE 68 73.901 2.115 -4.463
460 2HG2 ILE 68 HG22 ILE 68 73.738 3.661 -5.295
461 3HG2 ILE 68 HG23 ILE 68 72.311 2.665 -4.995
462 1HD1 ILE 68 HD1 ILE 68 72.881 6.957 -2.321
463 2HD1 ILE 68 HD1 ILE 68 73.494 5.518 -1.505
464 3HD1 ILE 68 HD1 ILE 68 71.756 5.741 -1.711
465 H ILE 69 HN ILE 69 70.067 1.305 -2.256
466 HA ILE 69 HA ILE 69 71.929 -0.963 -1.798
467 HB ILE 69 HB ILE 69 68.901 -0.866 -1.679
468 1HG1 ILE 69 HG12 ILE 69 70.670 -0.390 0.722
469 2HG1 ILE 69 HG11 ILE 69 70.225 0.959 -0.315
470 1HG2 ILE 69 HG21 ILE 69 70.313 -3.047 -1.544
471 2HG2 ILE 69 HG22 ILE 69 69.080 -2.773 -0.314
472 3HG2 ILE 69 HG23 ILE 69 70.777 -2.465 0.056
473 1HD1 ILE 69 HD1 ILE 69 68.333 -0.902 1.137
474 2HD1 ILE 69 HD1 ILE 69 67.819 0.305 -0.042
475 3HD1 ILE 69 HD1 ILE 69 68.594 0.812 1.460
476 H THR 70 HN THR 70 71.510 -3.012 -3.000
477 HA THR 70 HA THR 70 69.876 -2.926 -5.441
478 HB THR 70 HB THR 70 72.893 -2.706 -5.440
479 HG1 THR 70 HG1 THR 70 72.261 -1.045 -6.996
480 1HG2 THR 70 HG21 THR 70 71.823 -4.534 -7.009
481 2HG2 THR 70 HG22 THR 70 73.023 -3.419 -7.655
482 3HG2 THR 70 HG23 THR 70 71.308 -3.137 -7.952
483 H GLY 71 HN GLY 71 68.975 -4.926 -4.870
484 1HA GLY 71 HA2 GLY 71 68.991 -7.300 -5.149
485 2HA GLY 71 HA1 GLY 71 70.753 -7.256 -5.189
486 H GLY 72 HN GLY 72 68.779 -5.729 -2.702
487 1HA GLY 72 HA2 GLY 72 68.499 -6.286 -0.426
488 2HA GLY 72 HA1 GLY 72 69.136 -7.892 -0.788
489 H VAL 73 HN VAL 73 71.051 -5.252 -1.875
490 HA VAL 73 HA VAL 73 72.909 -5.655 0.453
491 HB VAL 73 HB VAL 73 74.710 -5.531 -1.165
492 1HG1 VAL 73 HG11 VAL 73 73.446 -7.700 -0.920
493 2HG1 VAL 73 HG12 VAL 73 74.255 -7.514 -2.474
494 3HG1 VAL 73 HG13 VAL 73 72.515 -7.255 -2.349
495 1HG2 VAL 73 HG21 VAL 73 72.472 -4.595 -2.933
496 2HG2 VAL 73 HG22 VAL 73 73.864 -5.398 -3.666
497 3HG2 VAL 73 HG23 VAL 73 74.089 -3.920 -2.732
498 HA PRO 74 HA PRO 74 72.535 -1.208 0.583
499 1HB PRO 74 HB2 PRO 74 73.940 -0.867 2.893
500 2HB PRO 74 HB1 PRO 74 72.268 -1.455 2.865
501 1HG PRO 74 HG2 PRO 74 74.775 -2.934 3.347
502 2HG PRO 74 HG1 PRO 74 73.139 -3.263 3.927
503 1HD PRO 74 HD2 PRO 74 74.456 -4.556 1.806
504 2HD PRO 74 HD1 PRO 74 72.733 -4.677 2.216
505 H ALA 75 HN ALA 75 73.946 0.441 -0.123
506 HA ALA 75 HA ALA 75 76.678 -0.402 -0.904
507 1HB ALA 75 HB1 ALA 75 76.493 1.988 -1.955
508 2HB ALA 75 HB2 ALA 75 74.791 1.866 -1.508
509 3HB ALA 75 HB3 ALA 75 75.498 0.694 -2.620
510 HA PRO 76 HA PRO 76 78.636 1.841 2.333
511 1HB PRO 76 HB2 PRO 76 80.984 2.543 1.121
512 2HB PRO 76 HB1 PRO 76 80.618 0.880 1.621
513 1HG PRO 76 HG2 PRO 76 80.535 2.104 -1.079
514 2HG PRO 76 HG1 PRO 76 80.976 0.461 -0.595
515 1HD PRO 76 HD2 PRO 76 78.547 1.182 -1.694
516 2HD PRO 76 HD1 PRO 76 78.830 -0.280 -0.726
517 H SER 77 HN SER 77 76.735 3.494 1.438
518 HA SER 77 HA SER 77 77.998 5.981 0.398
519 1HB SER 77 HB2 SER 77 75.577 4.623 -0.001
520 2HB SER 77 HB1 SER 77 75.141 6.048 0.938
521 HG SER 77 HG SER 77 75.687 7.290 -0.691
522 H ALA 78 HN ALA 78 78.319 7.741 1.721
523 HA ALA 78 HA ALA 78 78.064 7.534 4.579
524 1HB ALA 78 HB1 ALA 78 79.250 9.502 4.499
525 2HB ALA 78 HB2 ALA 78 78.198 10.198 3.267
526 3HB ALA 78 HB3 ALA 78 79.454 9.050 2.806
527 H ALA 79 HN ALA 79 75.740 8.141 2.188
528 HA ALA 79 HA ALA 79 74.068 9.934 3.844
529 1HB ALA 79 HB1 ALA 79 73.363 10.528 1.784
530 2HB ALA 79 HB2 ALA 79 72.816 8.882 1.469
531 3HB ALA 79 HB3 ALA 79 74.477 9.343 1.101
532 H CYS 80 HN CYS 80 74.433 6.531 3.260
533 HA CYS 80 HA CYS 80 71.663 5.824 3.881
534 1HB CYS 80 HB2 CYS 80 73.079 4.464 2.428
535 2HB CYS 80 HB1 CYS 80 74.238 4.244 3.718
536 H LYS 81 HN LYS 81 71.162 4.415 5.822
537 HA LYS 81 HA LYS 81 72.454 5.615 8.223
538 1HB LYS 81 HB2 LYS 81 70.364 5.384 9.205
539 2HB LYS 81 HB1 LYS 81 69.903 5.524 7.512
540 1HG LYS 81 HG2 LYS 81 70.310 2.895 8.968
541 2HG LYS 81 HG1 LYS 81 68.742 3.643 8.679
542 1HD LYS 81 HD2 LYS 81 69.144 3.547 6.243
543 2HD LYS 81 HD1 LYS 81 70.701 2.792 6.533
544 1HE LYS 81 HE2 LYS 81 68.624 1.362 7.963
545 2HE LYS 81 HE1 LYS 81 68.261 1.449 6.228
546 1HZ LYS 81 HZ1 LYS 81 70.291 0.520 5.664
547 2HZ LYS 81 HZ2 LYS 81 69.851 -0.382 7.036
548 3HZ LYS 81 HZ3 LYS 81 70.996 0.867 7.168
549 H ILE 82 HN ILE 82 72.442 2.646 6.518
550 HA ILE 82 HA ILE 82 72.858 0.385 7.245
551 HB ILE 82 HB ILE 82 75.183 2.089 8.195
552 1HG1 ILE 82 HG12 ILE 82 74.594 2.691 5.917
553 2HG1 ILE 82 HG11 ILE 82 76.030 1.666 5.857
554 1HG2 ILE 82 HG21 ILE 82 76.404 -0.046 7.315
555 2HG2 ILE 82 HG22 ILE 82 74.838 -0.825 7.532
556 3HG2 ILE 82 HG23 ILE 82 75.657 -0.092 8.911
557 1HD1 ILE 82 HD1 ILE 82 74.423 -0.304 5.528
558 2HD1 ILE 82 HD1 ILE 82 74.578 0.812 4.172
559 3HD1 ILE 82 HD1 ILE 82 73.171 0.903 5.232
560 H SER 83 HN SER 83 71.072 1.247 9.170
561 HA SER 83 HA SER 83 72.433 0.619 11.766
562 1HB SER 83 HB2 SER 83 71.157 2.878 11.062
563 2HB SER 83 HB1 SER 83 69.771 1.950 11.625
564 HG SER 83 HG SER 83 72.075 2.780 13.015
565 H GLY 84 HN GLY 84 69.626 0.498 12.900
566 1HA GLY 84 HA2 GLY 84 69.299 -2.312 12.939
567 2HA GLY 84 HA1 GLY 84 68.069 -1.155 13.443
568 H CYS 85 HN CYS 85 69.345 -2.924 10.666
569 HA CYS 85 HA CYS 85 66.753 -3.427 9.592
570 1HB CYS 85 HB2 CYS 85 67.172 -0.878 9.255
571 2HB CYS 85 HB1 CYS 85 68.292 -1.380 7.991
572 H THR 86 HN THR 86 67.078 -4.141 7.110
573 HA THR 86 HA THR 86 69.705 -4.942 6.251
574 HB THR 86 HB THR 86 69.755 -6.349 8.164
575 HG1 THR 86 HG1 THR 86 70.220 -7.482 6.251
576 1HG2 THR 86 HG21 THR 86 66.844 -6.817 7.522
577 2HG2 THR 86 HG22 THR 86 67.562 -6.239 9.026
578 3HG2 THR 86 HG23 THR 86 67.735 -7.929 8.560
579 H PHE 87 HN PHE 87 69.593 -6.272 4.300
580 HA PHE 87 HA PHE 87 66.816 -6.511 3.190
581 1HB PHE 87 HB2 PHE 87 69.303 -6.033 1.556
582 2HB PHE 87 HB1 PHE 87 67.631 -5.690 1.128
583 HD1 PHE 87 HD1 PHE 87 70.297 -3.895 1.310
584 HD2 PHE 87 HD2 PHE 87 66.757 -4.359 3.702
585 HE1 PHE 87 HE1 PHE 87 70.562 -1.580 2.162
586 HE2 PHE 87 HE2 PHE 87 67.029 -2.043 4.557
587 HZ PHE 87 HZ PHE 87 68.931 -0.657 3.783
588 H SER 88 HN SER 88 66.665 -8.205 1.458
589 HA SER 88 HA SER 88 68.743 -10.339 1.621
590 1HB SER 88 HB2 SER 88 66.141 -10.307 2.866
591 2HB SER 88 HB1 SER 88 66.184 -11.573 1.641
592 HG SER 88 HG SER 88 67.564 -11.325 4.024
593 H ALA 89 HN ALA 89 67.252 -8.295 -0.325
594 HA ALA 89 HA ALA 89 66.982 -8.288 -2.682
595 1HB ALA 89 HB1 ALA 89 68.815 -10.126 -2.316
596 2HB ALA 89 HB2 ALA 89 67.971 -10.060 -3.862
597 3HB ALA 89 HB3 ALA 89 67.497 -11.250 -2.649
598 H ASN 90 HN ASN 90 65.137 -9.916 -0.456
599 HA ASN 90 HA ASN 90 63.038 -10.994 -0.532
600 1HB ASN 90 HB2 ASN 90 61.483 -9.462 -1.374
601 2HB ASN 90 HB1 ASN 90 62.915 -8.446 -1.218
602 1HD2 ASN 90 HD2 ASN 90 63.958 -7.722 -3.189
603 2HD2 ASN 90 HD2 ASN 90 63.271 -7.973 -4.721
Start of MODEL 6
1 1H ASP 1 HT1 ASP 1 44.764 6.476 -0.550
2 2H ASP 1 HT2 ASP 1 45.775 5.254 0.058
3 3H ASP 1 HT3 ASP 1 46.201 6.086 -1.360
4 HA ASP 1 HA ASP 1 45.794 7.746 1.000
5 1HB ASP 1 HB2 ASP 1 47.956 7.047 1.942
6 2HB ASP 1 HB1 ASP 1 46.859 5.668 1.859
7 H GLY 2 HN GLY 2 47.956 6.639 -1.640
8 1HA GLY 2 HA2 GLY 2 48.415 9.512 -2.300
9 2HA GLY 2 HA1 GLY 2 49.796 8.422 -2.161
10 H SER 3 HN SER 3 46.861 7.093 -3.410
11 HA SER 3 HA SER 3 46.395 6.179 -5.543
12 1HB SER 3 HB2 SER 3 47.582 8.911 -6.028
13 2HB SER 3 HB1 SER 3 46.998 7.925 -7.365
14 HG SER 3 HG SER 3 45.052 7.738 -5.836
15 H CYS 4 HN CYS 4 49.087 5.588 -4.296
16 HA CYS 4 HA CYS 4 51.023 5.544 -6.485
17 1HB CYS 4 HB2 CYS 4 50.933 4.064 -3.834
18 2HB CYS 4 HB1 CYS 4 52.366 4.335 -4.825
19 H THR 5 HN THR 5 51.250 3.924 -8.004
20 HA THR 5 HA THR 5 49.669 1.408 -7.580
21 HB THR 5 HB THR 5 50.512 2.697 -10.191
22 HG1 THR 5 HG1 THR 5 48.803 3.909 -10.054
23 1HG2 THR 5 HG21 THR 5 49.754 0.163 -9.826
24 2HG2 THR 5 HG22 THR 5 49.234 1.084 -11.236
25 3HG2 THR 5 HG23 THR 5 48.151 0.897 -9.857
26 H ASN 6 HN ASN 6 52.810 2.748 -8.100
27 HA ASN 6 HA ASN 6 54.872 1.725 -8.731
28 1HB ASN 6 HB2 ASN 6 55.240 -0.223 -7.155
29 2HB ASN 6 HB1 ASN 6 54.623 1.234 -6.381
30 1HD2 ASN 6 HD2 ASN 6 52.802 0.946 -5.099
31 2HD2 ASN 6 HD2 ASN 6 51.741 -0.374 -5.198
32 H THR 7 HN THR 7 53.169 1.180 -10.835
33 HA THR 7 HA THR 7 53.120 -0.276 -12.700
34 HB THR 7 HB THR 7 54.695 -2.217 -11.008
35 HG1 THR 7 HG1 THR 7 56.522 -1.023 -11.859
36 1HG2 THR 7 HG21 THR 7 54.373 -3.248 -13.036
37 2HG2 THR 7 HG22 THR 7 55.795 -2.287 -13.444
38 3HG2 THR 7 HG23 THR 7 54.188 -1.722 -13.902
39 H ASN 8 HN ASN 8 51.585 -0.808 -9.820
40 HA ASN 8 HA ASN 8 49.689 -2.665 -11.002
41 1HB ASN 8 HB2 ASN 8 51.480 -4.242 -10.564
42 2HB ASN 8 HB1 ASN 8 51.643 -3.653 -8.907
43 1HD2 ASN 8 HD2 ASN 8 48.382 -3.792 -10.098
44 2HD2 ASN 8 HD2 ASN 8 47.923 -5.196 -9.272
45 H SER 9 HN SER 9 51.025 -1.644 -7.864
46 HA SER 9 HA SER 9 49.946 -0.280 -6.225
47 1HB SER 9 HB2 SER 9 47.774 0.452 -6.555
48 2HB SER 9 HB1 SER 9 48.213 0.018 -8.203
49 HG SER 9 HG SER 9 46.808 -1.578 -6.317
50 H GLN 10 HN GLN 10 50.794 -1.927 -4.803
51 HA GLN 10 HA GLN 10 48.630 -3.686 -3.713
52 1HB GLN 10 HB2 GLN 10 50.835 -5.137 -3.135
53 2HB GLN 10 HB1 GLN 10 49.925 -5.360 -4.625
54 1HG GLN 10 HG2 GLN 10 52.039 -3.265 -4.664
55 2HG GLN 10 HG1 GLN 10 52.580 -4.940 -4.593
56 1HE2 GLN 10 HE21 GLN 10 52.628 -6.060 -6.550
57 2HE2 GLN 10 HE22 GLN 10 51.840 -5.562 -7.968
58 H LEU 11 HN LEU 11 50.146 -1.003 -3.153
59 HA LEU 11 HA LEU 11 51.707 -0.924 -0.896
60 1HB LEU 11 HB2 LEU 11 50.540 0.909 -2.298
61 2HB LEU 11 HB1 LEU 11 49.179 0.712 -1.199
62 HG LEU 11 HG LEU 11 50.458 1.414 0.679
63 1HD1 LEU 11 HD1 LEU 11 52.990 2.013 0.114
64 2HD1 LEU 11 HD1 LEU 11 52.768 0.757 -1.104
65 3HD1 LEU 11 HD1 LEU 11 52.525 0.384 0.604
66 1HD2 LEU 11 HD2 LEU 11 51.013 3.637 0.087
67 2HD2 LEU 11 HD2 LEU 11 49.838 3.156 -1.136
68 3HD2 LEU 11 HD2 LEU 11 51.558 3.163 -1.522
69 H SER 12 HN SER 12 51.535 -2.074 0.971
70 HA SER 12 HA SER 12 49.533 -3.637 1.979
71 1HB SER 12 HB2 SER 12 50.960 -3.671 3.739
72 2HB SER 12 HB1 SER 12 51.885 -2.436 2.895
73 HG SER 12 HG SER 12 50.322 -2.247 5.116
74 H ALA 13 HN ALA 13 47.791 -3.288 3.563
75 HA ALA 13 HA ALA 13 46.053 -1.100 2.911
76 1HB ALA 13 HB1 ALA 13 46.053 -3.538 4.389
77 2HB ALA 13 HB2 ALA 13 44.661 -2.571 3.905
78 3HB ALA 13 HB3 ALA 13 45.443 -2.276 5.458
79 H ASN 14 HN ASN 14 48.817 -1.144 4.882
80 HA ASN 14 HA ASN 14 47.923 1.385 6.207
81 1HB ASN 14 HB2 ASN 14 48.884 0.563 8.305
82 2HB ASN 14 HB1 ASN 14 47.687 -0.589 7.713
83 1HD2 ASN 14 HD2 ASN 14 48.446 -2.686 7.997
84 2HD2 ASN 14 HD2 ASN 14 50.051 -3.185 7.763
85 H SER 15 HN SER 15 49.852 0.585 3.909
86 HA SER 15 HA SER 15 52.493 1.279 5.001
87 1HB SER 15 HB2 SER 15 51.628 -0.232 2.935
88 2HB SER 15 HB1 SER 15 51.901 1.286 2.087
89 HG SER 15 HG SER 15 53.836 0.387 3.893
90 H LYS 16 HN LYS 16 53.421 2.909 2.868
91 HA LYS 16 HA LYS 16 51.702 5.310 2.756
92 1HB LYS 16 HB2 LYS 16 53.122 5.067 4.975
93 2HB LYS 16 HB1 LYS 16 54.444 5.614 3.943
94 1HG LYS 16 HG2 LYS 16 52.480 7.382 3.249
95 2HG LYS 16 HG1 LYS 16 52.100 7.105 4.950
96 1HD LYS 16 HD2 LYS 16 54.358 7.706 5.611
97 2HD LYS 16 HD1 LYS 16 54.857 7.830 3.924
98 1HE LYS 16 HE2 LYS 16 54.429 10.083 4.494
99 2HE LYS 16 HE1 LYS 16 52.892 9.583 3.762
100 1HZ LYS 16 HZ1 LYS 16 52.295 10.494 5.822
101 2HZ LYS 16 HZ2 LYS 16 53.585 9.746 6.636
102 3HZ LYS 16 HZ3 LYS 16 52.273 8.819 6.086
103 H CYS 17 HN CYS 17 52.474 6.829 1.165
104 HA CYS 17 HA CYS 17 55.020 6.405 -0.215
105 1HB CYS 17 HB2 CYS 17 54.014 5.649 -2.311
106 2HB CYS 17 HB1 CYS 17 53.531 4.554 -1.017
107 H GLU 18 HN GLU 18 54.285 8.732 0.923
108 HA GLU 18 HA GLU 18 52.812 10.431 -0.992
109 1HB GLU 18 HB2 GLU 18 52.440 10.723 1.381
110 2HB GLU 18 HB1 GLU 18 54.171 10.872 1.682
111 1HG GLU 18 HG2 GLU 18 53.179 13.094 1.687
112 2HG GLU 18 HG1 GLU 18 54.194 12.927 0.254
113 H LYS 19 HN LYS 19 53.973 11.078 -2.772
114 HA LYS 19 HA LYS 19 55.671 12.178 -3.999
115 1HB LYS 19 HB2 LYS 19 55.604 13.303 -1.480
116 2HB LYS 19 HB1 LYS 19 57.291 12.805 -1.620
117 1HG LYS 19 HG2 LYS 19 57.534 14.030 -3.707
118 2HG LYS 19 HG1 LYS 19 55.816 14.429 -3.711
119 1HD LYS 19 HD2 LYS 19 56.028 15.972 -1.987
120 2HD LYS 19 HD1 LYS 19 57.467 15.194 -1.329
121 1HE LYS 19 HE2 LYS 19 58.503 16.989 -2.354
122 2HE LYS 19 HE1 LYS 19 58.417 15.918 -3.767
123 1HZ LYS 19 HZ1 LYS 19 57.412 17.978 -4.373
124 2HZ LYS 19 HZ2 LYS 19 56.454 17.998 -2.970
125 3HZ LYS 19 HZ3 LYS 19 56.163 16.845 -4.185
126 H SER 20 HN SER 20 55.949 9.499 -4.015
127 HA SER 20 HA SER 20 58.892 9.103 -3.637
128 1HB SER 20 HB2 SER 20 57.310 6.699 -3.190
129 2HB SER 20 HB1 SER 20 58.522 7.438 -2.151
130 HG SER 20 HG SER 20 56.790 7.825 -0.984
131 H THR 21 HN THR 21 59.662 7.189 -4.970
132 HA THR 21 HA THR 21 58.060 6.988 -7.498
133 HB THR 21 HB THR 21 61.006 7.046 -6.838
134 HG1 THR 21 HG1 THR 21 60.042 9.008 -7.271
135 1HG2 THR 21 HG21 THR 21 59.696 6.110 -9.402
136 2HG2 THR 21 HG22 THR 21 60.772 5.179 -8.360
137 3HG2 THR 21 HG23 THR 21 61.397 6.555 -9.269
138 H LEU 22 HN LEU 22 56.922 5.052 -7.176
139 HA LEU 22 HA LEU 22 58.492 2.678 -6.265
140 1HB LEU 22 HB2 LEU 22 55.504 3.166 -6.468
141 2HB LEU 22 HB1 LEU 22 56.273 1.757 -5.739
142 HG LEU 22 HG LEU 22 55.776 3.157 -3.900
143 1HD1 LEU 22 HD1 LEU 22 58.561 4.126 -4.482
144 2HD1 LEU 22 HD1 LEU 22 58.264 2.403 -4.252
145 3HD1 LEU 22 HD1 LEU 22 57.881 3.543 -2.964
146 1HD2 LEU 22 HD2 LEU 22 55.517 5.164 -5.649
147 2HD2 LEU 22 HD2 LEU 22 57.122 5.568 -5.042
148 3HD2 LEU 22 HD2 LEU 22 55.758 5.466 -3.929
149 H THR 23 HN THR 23 58.478 0.778 -7.516
150 HA THR 23 HA THR 23 57.049 0.774 -10.124
151 HB THR 23 HB THR 23 60.049 0.688 -9.692
152 HG1 THR 23 HG1 THR 23 60.013 2.490 -10.900
153 1HG2 THR 23 HG21 THR 23 59.815 0.453 -12.355
154 2HG2 THR 23 HG22 THR 23 58.356 -0.416 -11.877
155 3HG2 THR 23 HG23 THR 23 59.933 -0.952 -11.296
156 H ASN 24 HN ASN 24 55.959 -1.160 -9.856
157 HA ASN 24 HA ASN 24 55.632 -3.481 -9.532
158 1HB ASN 24 HB2 ASN 24 58.425 -3.048 -10.394
159 2HB ASN 24 HB1 ASN 24 58.163 -4.570 -9.543
160 1HD2 ASN 24 HD2 ASN 24 56.007 -5.739 -10.355
161 2HD2 ASN 24 HD2 ASN 24 55.795 -5.764 -12.039
162 H CYS 25 HN CYS 25 55.420 -2.136 -7.209
163 HA CYS 25 HA CYS 25 57.293 -3.442 -5.280
164 1HB CYS 25 HB2 CYS 25 56.198 -0.812 -5.600
165 2HB CYS 25 HB1 CYS 25 55.637 -1.463 -4.068
166 H TYR 26 HN TYR 26 55.933 -3.309 -3.017
167 HA TYR 26 HA TYR 26 53.200 -4.223 -3.022
168 1HB TYR 26 HB2 TYR 26 54.479 -6.155 -4.072
169 2HB TYR 26 HB1 TYR 26 55.370 -6.302 -2.555
170 HD1 TYR 26 HD1 TYR 26 54.278 -7.098 -0.518
171 HD2 TYR 26 HD2 TYR 26 52.099 -6.710 -4.200
172 HE1 TYR 26 HE1 TYR 26 52.424 -8.439 0.438
173 HE2 TYR 26 HE2 TYR 26 50.245 -8.050 -3.243
174 HH TYR 26 HH TYR 26 49.420 -8.498 -0.709
175 H VAL 27 HN VAL 27 54.993 -2.374 -1.776
176 HA VAL 27 HA VAL 27 56.195 -2.717 0.600
177 HB VAL 27 HB VAL 27 53.901 -0.778 0.239
178 1HG1 VAL 27 HG11 VAL 27 56.600 -0.369 1.543
179 2HG1 VAL 27 HG12 VAL 27 55.179 -0.909 2.439
180 3HG1 VAL 27 HG13 VAL 27 55.177 0.668 1.652
181 1HG2 VAL 27 HG21 VAL 27 55.858 0.656 -0.758
182 2HG2 VAL 27 HG22 VAL 27 55.060 -0.525 -1.803
183 3HG2 VAL 27 HG23 VAL 27 56.621 -0.904 -1.066
184 H ASP 28 HN ASP 28 55.730 -3.287 2.701
185 HA ASP 28 HA ASP 28 52.909 -3.900 3.449
186 1HB ASP 28 HB2 ASP 28 55.181 -5.745 2.990
187 2HB ASP 28 HB1 ASP 28 54.277 -6.032 4.477
188 H LYS 29 HN LYS 29 52.587 -2.877 5.395
189 HA LYS 29 HA LYS 29 53.052 -1.937 7.516
190 1HB LYS 29 HB2 LYS 29 54.852 -4.358 7.306
191 2HB LYS 29 HB1 LYS 29 54.750 -3.405 8.786
192 1HG LYS 29 HG2 LYS 29 52.086 -3.821 8.018
193 2HG LYS 29 HG1 LYS 29 52.884 -5.371 7.746
194 1HD LYS 29 HD2 LYS 29 52.515 -5.675 9.975
195 2HD LYS 29 HD1 LYS 29 53.952 -4.668 10.153
196 1HE LYS 29 HE2 LYS 29 51.326 -3.269 9.832
197 2HE LYS 29 HE1 LYS 29 51.681 -4.023 11.399
198 1HZ LYS 29 HZ1 LYS 29 53.185 -1.928 9.970
199 2HZ LYS 29 HZ2 LYS 29 53.991 -2.955 11.056
200 3HZ LYS 29 HZ3 LYS 29 52.711 -1.976 11.597
201 H SER 30 HN SER 30 54.458 -0.748 5.253
202 HA SER 30 HA SER 30 56.941 0.160 6.668
203 1HB SER 30 HB2 SER 30 56.479 -0.690 3.808
204 2HB SER 30 HB1 SER 30 57.851 0.319 4.256
205 HG SER 30 HG SER 30 57.188 -2.272 5.199
206 H GLU 31 HN GLU 31 57.753 2.253 5.392
207 HA GLU 31 HA GLU 31 55.353 4.008 4.962
208 1HB GLU 31 HB2 GLU 31 57.388 4.071 6.897
209 2HB GLU 31 HB1 GLU 31 57.801 5.358 5.762
210 1HG GLU 31 HG2 GLU 31 55.578 6.332 5.992
211 2HG GLU 31 HG1 GLU 31 55.071 4.999 7.030
212 H VAL 32 HN VAL 32 58.885 4.173 4.344
213 HA VAL 32 HA VAL 32 60.060 4.758 2.377
214 HB VAL 32 HB VAL 32 57.439 4.069 1.017
215 1HG1 VAL 32 HG11 VAL 32 59.192 5.027 -0.420
216 2HG1 VAL 32 HG12 VAL 32 58.958 3.318 -0.790
217 3HG1 VAL 32 HG13 VAL 32 60.343 3.831 0.173
218 1HG2 VAL 32 HG21 VAL 32 57.679 1.894 1.598
219 2HG2 VAL 32 HG22 VAL 32 58.859 2.429 2.794
220 3HG2 VAL 32 HG23 VAL 32 59.396 1.914 1.197
221 H TYR 33 HN TYR 33 60.295 6.631 1.018
222 HA TYR 33 HA TYR 33 58.008 8.551 0.974
223 1HB TYR 33 HB2 TYR 33 60.687 8.809 2.287
224 2HB TYR 33 HB1 TYR 33 59.964 10.251 1.583
225 HD1 TYR 33 HD1 TYR 33 57.877 11.176 2.451
226 HD2 TYR 33 HD2 TYR 33 59.646 7.668 4.193
227 HE1 TYR 33 HE1 TYR 33 56.395 11.407 4.425
228 HE2 TYR 33 HE2 TYR 33 58.163 7.901 6.165
229 HH TYR 33 HH TYR 33 55.938 10.660 6.477
230 H GLY 34 HN GLY 34 61.401 8.014 -0.086
231 1HA GLY 34 HA2 GLY 34 60.583 9.079 -2.757
232 2HA GLY 34 HA1 GLY 34 62.084 9.617 -2.006
233 H THR 35 HN THR 35 61.165 6.327 -1.484
234 HA THR 35 HA THR 35 63.582 5.291 -2.653
235 HB THR 35 HB THR 35 60.956 4.124 -1.701
236 HG1 THR 35 HG1 THR 35 62.076 4.646 0.025
237 1HG2 THR 35 HG21 THR 35 63.404 2.709 -2.774
238 2HG2 THR 35 HG22 THR 35 61.736 2.546 -3.323
239 3HG2 THR 35 HG23 THR 35 62.210 1.918 -1.745
240 H THR 36 HN THR 36 63.770 3.944 -4.569
241 HA THR 36 HA THR 36 61.907 4.750 -6.742
242 HB THR 36 HB THR 36 64.463 3.142 -6.926
243 HG1 THR 36 HG1 THR 36 65.403 5.280 -7.250
244 1HG2 THR 36 HG21 THR 36 64.408 3.643 -9.160
245 2HG2 THR 36 HG22 THR 36 63.662 5.218 -8.895
246 3HG2 THR 36 HG23 THR 36 62.676 3.758 -8.847
247 H CYS 37 HN CYS 37 62.754 2.012 -4.783
248 HA CYS 37 HA CYS 37 62.022 -0.239 -4.806
249 1HB CYS 37 HB2 CYS 37 59.939 0.849 -4.315
250 2HB CYS 37 HB1 CYS 37 59.738 1.354 -5.991
251 H THR 38 HN THR 38 63.738 -0.669 -6.548
252 HA THR 38 HA THR 38 62.811 -0.840 -9.329
253 HB THR 38 HB THR 38 65.256 -2.047 -7.993
254 HG1 THR 38 HG1 THR 38 64.705 0.565 -8.917
255 1HG2 THR 38 HG21 THR 38 66.223 -2.018 -10.170
256 2HG2 THR 38 HG22 THR 38 64.935 -0.996 -10.806
257 3HG2 THR 38 HG23 THR 38 64.602 -2.676 -10.385
258 H GLY 39 HN GLY 39 60.877 -2.225 -8.581
259 1HA GLY 39 HA2 GLY 39 59.834 -4.328 -8.620
260 2HA GLY 39 HA1 GLY 39 61.351 -4.985 -9.236
261 H SER 40 HN SER 40 60.516 -3.376 -6.155
262 HA SER 40 HA SER 40 61.382 -5.855 -4.712
263 1HB SER 40 HB2 SER 40 62.376 -3.945 -3.116
264 2HB SER 40 HB1 SER 40 63.299 -4.580 -4.475
265 HG SER 40 HG SER 40 62.831 -2.808 -5.635
266 H ARG 41 HN ARG 41 60.875 -5.324 -2.185
267 HA ARG 41 HA ARG 41 58.387 -3.744 -1.877
268 1HB ARG 41 HB2 ARG 41 57.174 -5.764 -1.068
269 2HB ARG 41 HB1 ARG 41 57.671 -5.927 -2.754
270 1HG ARG 41 HG2 ARG 41 59.581 -7.279 -2.123
271 2HG ARG 41 HG1 ARG 41 59.268 -6.995 -0.411
272 1HD ARG 41 HD2 ARG 41 58.164 -9.009 -0.568
273 2HD ARG 41 HD1 ARG 41 56.851 -8.001 -1.208
274 HE ARG 41 HE ARG 41 58.889 -8.960 -3.138
275 1HH1 ARG 41 HH1 ARG 41 56.355 -10.415 -1.577
276 2HH1 ARG 41 HH1 ARG 41 55.393 -10.707 -2.987
277 1HH2 ARG 41 HH2 ARG 41 57.383 -8.772 -5.069
278 2HH2 ARG 41 HH2 ARG 41 55.977 -9.777 -4.965
279 H PHE 42 HN PHE 42 57.598 -4.086 0.523
280 HA PHE 42 HA PHE 42 60.007 -4.285 2.304
281 1HB PHE 42 HB2 PHE 42 57.572 -2.491 2.574
282 2HB PHE 42 HB1 PHE 42 59.016 -2.457 3.583
283 HD1 PHE 42 HD1 PHE 42 61.038 -1.386 2.852
284 HD2 PHE 42 HD2 PHE 42 57.701 -1.792 0.183
285 HE1 PHE 42 HE1 PHE 42 62.112 0.187 1.265
286 HE2 PHE 42 HE2 PHE 42 58.772 -0.226 -1.403
287 HZ PHE 42 HZ PHE 42 60.974 0.762 -0.860
288 H ASP 43 HN ASP 43 58.831 -4.229 4.734
289 HA ASP 43 HA ASP 43 56.425 -5.755 5.069
290 1HB ASP 43 HB2 ASP 43 58.099 -7.363 3.925
291 2HB ASP 43 HB1 ASP 43 58.954 -7.364 5.468
292 H GLY 44 HN GLY 44 56.954 -3.631 6.456
293 1HA GLY 44 HA2 GLY 44 56.779 -3.213 8.836
294 2HA GLY 44 HA1 GLY 44 57.787 -4.634 9.128
295 H VAL 45 HN VAL 45 58.096 -1.569 7.255
296 HA VAL 45 HA VAL 45 60.742 -1.198 8.605
297 HB VAL 45 HB VAL 45 61.841 -0.959 6.536
298 1HG1 VAL 45 HG11 VAL 45 61.225 -2.917 5.205
299 2HG1 VAL 45 HG12 VAL 45 59.638 -2.965 5.973
300 3HG1 VAL 45 HG13 VAL 45 61.088 -3.298 6.922
301 1HG2 VAL 45 HG21 VAL 45 60.009 -1.035 4.461
302 2HG2 VAL 45 HG22 VAL 45 60.797 0.421 5.068
303 3HG2 VAL 45 HG23 VAL 45 59.197 -0.028 5.659
304 H THR 46 HN THR 46 61.472 1.065 7.135
305 HA THR 46 HA THR 46 59.377 3.088 7.103
306 HB THR 46 HB THR 46 61.453 3.084 9.324
307 HG1 THR 46 HG1 THR 46 60.007 2.046 10.405
308 1HG2 THR 46 HG21 THR 46 60.416 5.101 10.089
309 2HG2 THR 46 HG22 THR 46 59.082 4.924 8.946
310 3HG2 THR 46 HG23 THR 46 60.700 5.319 8.361
311 H ILE 47 HN ILE 47 60.971 2.511 5.053
312 HA ILE 47 HA ILE 47 63.523 3.948 5.119
313 HB ILE 47 HB ILE 47 63.209 1.878 3.853
314 1HG1 ILE 47 HG12 ILE 47 63.422 4.224 1.938
315 2HG1 ILE 47 HG11 ILE 47 64.743 3.664 2.963
316 1HG2 ILE 47 HG21 ILE 47 60.722 3.106 3.199
317 2HG2 ILE 47 HG22 ILE 47 61.274 1.486 2.773
318 3HG2 ILE 47 HG23 ILE 47 61.590 2.839 1.687
319 1HD1 ILE 47 HD1 ILE 47 63.379 1.601 1.310
320 2HD1 ILE 47 HD1 ILE 47 65.086 1.766 1.721
321 3HD1 ILE 47 HD1 ILE 47 64.384 2.765 0.448
322 H THR 48 HN THR 48 63.944 5.538 3.268
323 HA THR 48 HA THR 48 61.577 7.268 2.702
324 HB THR 48 HB THR 48 63.172 9.199 3.232
325 HG1 THR 48 HG1 THR 48 64.790 8.155 4.857
326 1HG2 THR 48 HG21 THR 48 63.135 8.104 5.826
327 2HG2 THR 48 HG22 THR 48 61.739 7.422 4.991
328 3HG2 THR 48 HG23 THR 48 61.934 9.172 5.099
329 H THR 49 HN THR 49 63.923 9.113 1.619
330 HA THR 49 HA THR 49 63.726 8.293 -1.127
331 HB THR 49 HB THR 49 65.576 10.142 0.406
332 HG1 THR 49 HG1 THR 49 63.546 10.843 -1.410
333 1HG2 THR 49 HG21 THR 49 66.346 11.018 -1.679
334 2HG2 THR 49 HG22 THR 49 65.167 10.071 -2.587
335 3HG2 THR 49 HG23 THR 49 66.517 9.265 -1.787
336 H SER 50 HN SER 50 64.464 6.042 -1.167
337 HA SER 50 HA SER 50 67.445 5.796 -0.921
338 1HB SER 50 HB2 SER 50 65.261 4.419 0.448
339 2HB SER 50 HB1 SER 50 66.356 3.294 -0.348
340 HG SER 50 HG SER 50 67.549 3.646 1.352
341 H THR 51 HN THR 51 68.418 4.716 -2.635
342 HA THR 51 HA THR 51 66.730 4.089 -4.971
343 HB THR 51 HB THR 51 69.679 3.587 -4.757
344 HG1 THR 51 HG1 THR 51 68.547 6.151 -5.123
345 1HG2 THR 51 HG21 THR 51 69.310 3.359 -6.963
346 2HG2 THR 51 HG22 THR 51 69.038 5.101 -7.011
347 3HG2 THR 51 HG23 THR 51 67.673 4.000 -6.819
348 H SER 52 HN SER 52 66.867 2.327 -2.411
349 HA SER 52 HA SER 52 68.113 -0.092 -2.575
350 1HB SER 52 HB2 SER 52 66.050 -1.030 -1.600
351 2HB SER 52 HB1 SER 52 66.370 0.575 -0.950
352 HG SER 52 HG SER 52 64.173 0.220 -1.661
353 H THR 53 HN THR 53 68.457 -1.524 -4.236
354 HA THR 53 HA THR 53 66.397 -1.656 -6.418
355 HB THR 53 HB THR 53 69.253 -2.617 -6.585
356 HG1 THR 53 HG1 THR 53 68.423 0.006 -7.212
357 1HG2 THR 53 HG21 THR 53 67.223 -2.802 -8.343
358 2HG2 THR 53 HG22 THR 53 68.901 -2.609 -8.847
359 3HG2 THR 53 HG23 THR 53 67.833 -1.207 -8.781
360 H GLY 54 HN GLY 54 65.101 -3.429 -6.038
361 1HA GLY 54 HA2 GLY 54 64.480 -5.625 -5.474
362 2HA GLY 54 HA1 GLY 54 66.015 -6.077 -6.218
363 H SER 55 HN SER 55 64.568 -5.001 -3.155
364 HA SER 55 HA SER 55 66.488 -6.702 -1.685
365 1HB SER 55 HB2 SER 55 67.056 -4.623 -0.269
366 2HB SER 55 HB1 SER 55 67.782 -4.720 -1.870
367 HG SER 55 HG SER 55 66.900 -2.760 -1.907
368 H ARG 56 HN ARG 56 65.252 -7.718 -0.164
369 HA ARG 56 HA ARG 56 62.599 -6.754 0.567
370 1HB ARG 56 HB2 ARG 56 63.121 -9.126 0.368
371 2HB ARG 56 HB1 ARG 56 64.408 -8.978 1.565
372 1HG ARG 56 HG2 ARG 56 62.888 -8.643 3.336
373 2HG ARG 56 HG1 ARG 56 61.570 -8.223 2.243
374 1HD ARG 56 HD2 ARG 56 61.668 -10.601 1.355
375 2HD ARG 56 HD1 ARG 56 62.784 -10.970 2.686
376 HE ARG 56 HE ARG 56 60.999 -10.614 4.244
377 1HH1 ARG 56 HH2 ARG 56 59.806 -8.190 2.910
378 2HH1 ARG 56 HH2 ARG 56 58.271 -8.793 2.386
379 1HH2 ARG 56 HH1 ARG 56 59.163 -12.126 2.740
380 2HH2 ARG 56 HH1 ARG 56 57.906 -11.023 2.290
381 H ILE 57 HN ILE 57 62.650 -4.858 1.797
382 HA ILE 57 HA ILE 57 64.666 -4.459 3.895
383 HB ILE 57 HB ILE 57 62.169 -2.838 3.321
384 1HG1 ILE 57 HG12 ILE 57 63.280 -3.238 1.176
385 2HG1 ILE 57 HG11 ILE 57 63.575 -1.578 1.689
386 1HG2 ILE 57 HG21 ILE 57 63.284 -2.004 5.233
387 2HG2 ILE 57 HG22 ILE 57 63.890 -0.998 3.918
388 3HG2 ILE 57 HG23 ILE 57 64.878 -2.316 4.545
389 1HD1 ILE 57 HD1 ILE 57 65.529 -3.737 2.434
390 2HD1 ILE 57 HD1 ILE 57 65.804 -2.005 2.250
391 3HD1 ILE 57 HD1 ILE 57 65.584 -3.020 0.825
392 H SER 58 HN SER 58 62.236 -6.533 3.892
393 HA SER 58 HA SER 58 60.380 -6.100 5.885
394 1HB SER 58 HB2 SER 58 60.399 -8.474 6.135
395 2HB SER 58 HB1 SER 58 60.957 -8.179 4.492
396 HG SER 58 HG SER 58 63.105 -8.336 5.315
397 H GLY 59 HN GLY 59 60.406 -6.688 8.229
398 1HA GLY 59 HA2 GLY 59 62.378 -7.311 9.953
399 2HA GLY 59 HA1 GLY 59 62.855 -5.666 9.529
400 HA PRO 60 HA PRO 60 59.447 -5.734 12.793
401 1HB PRO 60 HB2 PRO 60 60.953 -5.435 15.055
402 2HB PRO 60 HB1 PRO 60 60.488 -7.023 14.412
403 1HG PRO 60 HG2 PRO 60 63.081 -5.592 14.228
404 2HG PRO 60 HG1 PRO 60 62.752 -7.323 14.380
405 1HD PRO 60 HD2 PRO 60 63.446 -6.062 12.029
406 2HD PRO 60 HD1 PRO 60 62.584 -7.612 12.128
407 H GLY 61 HN GLY 61 60.042 -3.677 11.168
408 1HA GLY 61 HA2 GLY 61 59.541 -1.300 11.562
409 2HA GLY 61 HA1 GLY 61 60.510 -1.394 13.036
410 H CYS 62 HN CYS 62 61.672 -3.039 10.241
411 HA CYS 62 HA CYS 62 64.235 -2.100 10.105
412 1HB CYS 62 HB2 CYS 62 62.708 -3.681 8.603
413 2HB CYS 62 HB1 CYS 62 62.677 -2.266 7.554
414 H LYS 63 HN LYS 63 65.156 -0.090 9.873
415 HA LYS 63 HA LYS 63 63.484 2.072 8.630
416 1HB LYS 63 HB2 LYS 63 63.969 2.351 11.019
417 2HB LYS 63 HB1 LYS 63 65.695 2.157 10.708
418 1HG LYS 63 HG2 LYS 63 65.785 4.191 9.444
419 2HG LYS 63 HG1 LYS 63 64.027 4.321 9.405
420 1HD LYS 63 HD2 LYS 63 65.113 5.836 11.093
421 2HD LYS 63 HD1 LYS 63 63.945 4.716 11.794
422 1HE LYS 63 HE2 LYS 63 65.751 3.213 12.499
423 2HE LYS 63 HE1 LYS 63 66.952 4.272 11.733
424 1HZ LYS 63 HZ1 LYS 63 65.390 4.693 14.158
425 2HZ LYS 63 HZ2 LYS 63 65.604 6.049 13.155
426 3HZ LYS 63 HZ3 LYS 63 66.955 5.224 13.772
427 H ILE 64 HN ILE 64 64.401 3.264 6.956
428 HA ILE 64 HA ILE 64 67.286 2.860 6.314
429 HB ILE 64 HB ILE 64 64.933 2.427 4.440
430 1HG1 ILE 64 HG12 ILE 64 65.471 0.593 6.122
431 2HG1 ILE 64 HG11 ILE 64 65.579 0.109 4.432
432 1HG2 ILE 64 HG21 ILE 64 67.011 1.537 3.035
433 2HG2 ILE 64 HG22 ILE 64 67.885 2.705 4.027
434 3HG2 ILE 64 HG23 ILE 64 66.557 3.241 2.999
435 1HD1 ILE 64 HD1 ILE 64 67.593 -0.150 6.359
436 2HD1 ILE 64 HD1 ILE 64 68.098 1.217 5.366
437 3HD1 ILE 64 HD1 ILE 64 67.778 -0.345 4.616
438 H SER 65 HN SER 65 68.191 4.680 5.245
439 HA SER 65 HA SER 65 66.362 6.855 4.373
440 1HB SER 65 HB2 SER 65 68.616 7.495 6.254
441 2HB SER 65 HB1 SER 65 67.132 8.396 5.951
442 HG SER 65 HG SER 65 66.010 6.962 7.160
443 H THR 66 HN THR 66 67.142 7.633 2.478
444 HA THR 66 HA THR 66 68.625 7.858 0.645
445 HB THR 66 HB THR 66 70.624 8.698 2.720
446 HG1 THR 66 HG1 THR 66 68.601 9.398 3.481
447 1HG2 THR 66 HG21 THR 66 70.661 8.884 0.061
448 2HG2 THR 66 HG22 THR 66 71.310 10.176 1.077
449 3HG2 THR 66 HG23 THR 66 69.691 10.320 0.390
450 H CYS 67 HN CYS 67 68.625 5.256 1.037
451 HA CYS 67 HA CYS 67 71.516 4.454 1.214
452 1HB CYS 67 HB2 CYS 67 69.760 3.754 3.027
453 2HB CYS 67 HB1 CYS 67 69.176 2.642 1.791
454 H ILE 68 HN ILE 68 72.105 4.133 -0.932
455 HA ILE 68 HA ILE 68 70.369 3.567 -3.085
456 HB ILE 68 HB ILE 68 73.291 3.090 -2.512
457 1HG1 ILE 68 HG12 ILE 68 73.366 4.772 -4.485
458 2HG1 ILE 68 HG11 ILE 68 71.641 4.988 -4.183
459 1HG2 ILE 68 HG21 ILE 68 73.524 2.537 -4.958
460 2HG2 ILE 68 HG22 ILE 68 71.768 2.392 -5.040
461 3HG2 ILE 68 HG23 ILE 68 72.698 1.288 -4.024
462 1HD1 ILE 68 HD1 ILE 68 72.012 5.809 -1.992
463 2HD1 ILE 68 HD1 ILE 68 73.250 6.596 -2.972
464 3HD1 ILE 68 HD1 ILE 68 73.672 5.213 -1.962
465 H ILE 69 HN ILE 69 72.563 1.192 -1.558
466 HA ILE 69 HA ILE 69 72.333 -1.142 -1.273
467 HB ILE 69 HB ILE 69 69.368 -0.567 -1.274
468 1HG1 ILE 69 HG12 ILE 69 71.348 0.057 0.944
469 2HG1 ILE 69 HG11 ILE 69 70.488 1.250 -0.028
470 1HG2 ILE 69 HG21 ILE 69 71.014 -2.283 0.595
471 2HG2 ILE 69 HG22 ILE 69 70.352 -2.901 -0.918
472 3HG2 ILE 69 HG23 ILE 69 69.268 -2.317 0.344
473 1HD1 ILE 69 HD1 ILE 69 68.726 -0.770 1.175
474 2HD1 ILE 69 HD1 ILE 69 68.563 0.986 1.142
475 3HD1 ILE 69 HD1 ILE 69 69.581 0.217 2.360
476 H THR 70 HN THR 70 71.485 -3.125 -2.349
477 HA THR 70 HA THR 70 70.155 -2.693 -4.970
478 HB THR 70 HB THR 70 72.758 -4.213 -4.685
479 HG1 THR 70 HG1 THR 70 72.253 -1.513 -5.347
480 1HG2 THR 70 HG21 THR 70 71.195 -4.671 -6.625
481 2HG2 THR 70 HG22 THR 70 72.804 -4.113 -7.087
482 3HG2 THR 70 HG23 THR 70 71.439 -2.996 -7.120
483 H GLY 71 HN GLY 71 71.596 -5.650 -5.126
484 1HA GLY 71 HA2 GLY 71 69.188 -7.102 -4.609
485 2HA GLY 71 HA1 GLY 71 70.781 -7.811 -4.856
486 H GLY 72 HN GLY 72 68.777 -6.220 -2.388
487 1HA GLY 72 HA2 GLY 72 68.750 -6.501 -0.062
488 2HA GLY 72 HA1 GLY 72 69.378 -8.123 -0.366
489 H VAL 73 HN VAL 73 71.257 -5.577 -1.666
490 HA VAL 73 HA VAL 73 73.213 -5.837 0.607
491 HB VAL 73 HB VAL 73 74.915 -5.627 -1.193
492 1HG1 VAL 73 HG11 VAL 73 73.966 -7.775 -2.514
493 2HG1 VAL 73 HG12 VAL 73 72.858 -7.780 -1.142
494 3HG1 VAL 73 HG13 VAL 73 74.598 -7.882 -0.871
495 1HG2 VAL 73 HG21 VAL 73 74.283 -4.714 -3.153
496 2HG2 VAL 73 HG22 VAL 73 72.599 -4.718 -2.622
497 3HG2 VAL 73 HG23 VAL 73 73.263 -6.121 -3.462
498 HA PRO 74 HA PRO 74 72.950 -1.397 0.571
499 1HB PRO 74 HB2 PRO 74 74.827 -0.938 2.500
500 2HB PRO 74 HB1 PRO 74 73.201 -1.540 2.868
501 1HG PRO 74 HG2 PRO 74 75.775 -2.960 2.887
502 2HG PRO 74 HG1 PRO 74 74.281 -3.315 3.762
503 1HD PRO 74 HD2 PRO 74 75.247 -4.597 1.426
504 2HD PRO 74 HD1 PRO 74 73.671 -4.833 2.209
505 H ALA 75 HN ALA 75 73.969 -0.021 -0.865
506 HA ALA 75 HA ALA 75 76.605 -0.733 -1.959
507 1HB ALA 75 HB1 ALA 75 75.310 1.850 -2.620
508 2HB ALA 75 HB2 ALA 75 74.326 0.419 -2.924
509 3HB ALA 75 HB3 ALA 75 75.903 0.584 -3.696
510 HA PRO 76 HA PRO 76 79.071 2.123 0.280
511 1HB PRO 76 HB2 PRO 76 80.438 3.515 -1.646
512 2HB PRO 76 HB1 PRO 76 80.783 1.820 -1.246
513 1HG PRO 76 HG2 PRO 76 79.210 2.948 -3.509
514 2HG PRO 76 HG1 PRO 76 80.329 1.577 -3.486
515 1HD PRO 76 HD2 PRO 76 77.624 1.290 -3.459
516 2HD PRO 76 HD1 PRO 76 78.737 0.117 -2.718
517 H SER 77 HN SER 77 76.599 3.116 0.402
518 HA SER 77 HA SER 77 76.436 5.817 -0.774
519 1HB SER 77 HB2 SER 77 74.517 4.213 -0.569
520 2HB SER 77 HB1 SER 77 74.643 4.343 1.183
521 HG SER 77 HG SER 77 74.559 6.769 0.515
522 H ALA 78 HN ALA 78 77.612 7.398 0.253
523 HA ALA 78 HA ALA 78 78.497 7.243 2.995
524 1HB ALA 78 HB1 ALA 78 79.713 8.485 1.307
525 2HB ALA 78 HB2 ALA 78 79.130 9.643 2.503
526 3HB ALA 78 HB3 ALA 78 78.299 9.479 0.957
527 H ALA 79 HN ALA 79 75.443 7.883 1.726
528 HA ALA 79 HA ALA 79 74.706 9.729 3.961
529 1HB ALA 79 HB1 ALA 79 72.541 9.671 2.388
530 2HB ALA 79 HB2 ALA 79 73.726 9.116 1.206
531 3HB ALA 79 HB3 ALA 79 73.934 10.678 1.997
532 H CYS 80 HN CYS 80 74.003 6.557 2.546
533 HA CYS 80 HA CYS 80 71.645 5.797 3.809
534 1HB CYS 80 HB2 CYS 80 72.926 4.401 2.267
535 2HB CYS 80 HB1 CYS 80 74.229 4.257 3.428
536 H LYS 81 HN LYS 81 71.398 4.426 5.852
537 HA LYS 81 HA LYS 81 73.091 5.605 8.013
538 1HB LYS 81 HB2 LYS 81 71.156 5.838 9.196
539 2HB LYS 81 HB1 LYS 81 70.402 5.688 7.616
540 1HG LYS 81 HG2 LYS 81 70.955 3.215 9.256
541 2HG LYS 81 HG1 LYS 81 69.539 4.202 9.585
542 1HD LYS 81 HD2 LYS 81 68.518 3.666 7.605
543 2HD LYS 81 HD1 LYS 81 70.044 3.499 6.738
544 1HE LYS 81 HE2 LYS 81 68.908 1.297 7.050
545 2HE LYS 81 HE1 LYS 81 70.468 1.348 7.893
546 1HZ LYS 81 HZ1 LYS 81 67.786 1.851 9.072
547 2HZ LYS 81 HZ2 LYS 81 69.249 2.119 9.892
548 3HZ LYS 81 HZ3 LYS 81 68.816 0.548 9.415
549 H ILE 82 HN ILE 82 71.667 2.490 6.955
550 HA ILE 82 HA ILE 82 72.228 0.278 7.623
551 HB ILE 82 HB ILE 82 74.853 1.790 7.832
552 1HG1 ILE 82 HG12 ILE 82 73.956 1.829 5.594
553 2HG1 ILE 82 HG11 ILE 82 75.246 0.628 5.622
554 1HG2 ILE 82 HG21 ILE 82 75.285 -0.943 7.239
555 2HG2 ILE 82 HG22 ILE 82 74.192 -0.902 8.623
556 3HG2 ILE 82 HG23 ILE 82 75.749 -0.077 8.703
557 1HD1 ILE 82 HD1 ILE 82 73.050 -0.868 6.350
558 2HD1 ILE 82 HD1 ILE 82 73.708 -0.772 4.716
559 3HD1 ILE 82 HD1 ILE 82 72.359 0.263 5.184
560 H SER 83 HN SER 83 70.891 1.238 9.692
561 HA SER 83 HA SER 83 72.665 1.100 12.098
562 1HB SER 83 HB2 SER 83 71.258 3.131 11.664
563 2HB SER 83 HB1 SER 83 69.823 2.117 11.779
564 HG SER 83 HG SER 83 70.773 3.296 13.745
565 H GLY 84 HN GLY 84 69.194 0.373 11.624
566 1HA GLY 84 HA2 GLY 84 69.719 -2.387 12.632
567 2HA GLY 84 HA1 GLY 84 68.475 -1.395 13.392
568 H CYS 85 HN CYS 85 69.424 -2.515 10.123
569 HA CYS 85 HA CYS 85 66.520 -3.030 9.609
570 1HB CYS 85 HB2 CYS 85 68.018 -0.941 8.571
571 2HB CYS 85 HB1 CYS 85 68.098 -2.154 7.294
572 H THR 86 HN THR 86 67.116 -3.889 6.869
573 HA THR 86 HA THR 86 69.176 -5.859 6.738
574 HB THR 86 HB THR 86 68.113 -6.949 8.562
575 HG1 THR 86 HG1 THR 86 67.845 -8.825 7.624
576 1HG2 THR 86 HG21 THR 86 65.448 -7.400 7.603
577 2HG2 THR 86 HG22 THR 86 65.785 -5.670 7.526
578 3HG2 THR 86 HG23 THR 86 65.954 -6.534 9.054
579 H PHE 87 HN PHE 87 69.195 -6.803 4.716
580 HA PHE 87 HA PHE 87 66.759 -6.438 3.003
581 1HB PHE 87 HB2 PHE 87 69.401 -6.368 1.680
582 2HB PHE 87 HB1 PHE 87 67.985 -5.375 1.382
583 HD1 PHE 87 HD1 PHE 87 67.483 -4.083 3.953
584 HD2 PHE 87 HD2 PHE 87 71.216 -4.957 2.003
585 HE1 PHE 87 HE1 PHE 87 68.560 -2.220 5.183
586 HE2 PHE 87 HE2 PHE 87 72.290 -3.098 3.244
587 HZ PHE 87 HZ PHE 87 70.964 -1.727 4.829
588 H SER 88 HN SER 88 66.510 -8.102 1.376
589 HA SER 88 HA SER 88 68.366 -10.434 1.579
590 1HB SER 88 HB2 SER 88 65.375 -10.786 1.579
591 2HB SER 88 HB1 SER 88 66.616 -11.891 2.166
592 HG SER 88 HG SER 88 65.260 -10.393 3.662
593 H ALA 89 HN ALA 89 67.200 -8.202 -0.389
594 HA ALA 89 HA ALA 89 67.076 -8.107 -2.755
595 1HB ALA 89 HB1 ALA 89 68.522 -10.392 -2.137
596 2HB ALA 89 HB2 ALA 89 68.301 -9.731 -3.758
597 3HB ALA 89 HB3 ALA 89 67.229 -11.005 -3.168
598 H ASN 90 HN ASN 90 64.972 -9.620 -0.689
599 HA ASN 90 HA ASN 90 62.827 -10.610 -0.929
600 1HB ASN 90 HB2 ASN 90 61.400 -8.868 -1.609
601 2HB ASN 90 HB1 ASN 90 62.891 -8.012 -1.221
602 1HD2 ASN 90 HD2 ASN 90 64.310 -7.400 -3.088
603 2HD2 ASN 90 HD2 ASN 90 63.624 -7.197 -4.628
Start of MODEL 7
1 1H ASP 1 HT1 ASP 1 45.658 3.795 1.588
2 2H ASP 1 HT2 ASP 1 47.005 3.900 2.617
3 3H ASP 1 HT3 ASP 1 46.801 5.027 1.363
4 HA ASP 1 HA ASP 1 44.964 4.740 3.689
5 1HB ASP 1 HB2 ASP 1 47.569 5.719 3.562
6 2HB ASP 1 HB1 ASP 1 46.576 7.168 3.389
7 H GLY 2 HN GLY 2 46.074 6.735 0.933
8 1HA GLY 2 HA2 GLY 2 43.264 7.730 0.682
9 2HA GLY 2 HA1 GLY 2 44.650 8.794 0.436
10 H SER 3 HN SER 3 43.394 5.663 -0.755
11 HA SER 3 HA SER 3 43.506 4.720 -2.918
12 1HB SER 3 HB2 SER 3 42.115 6.983 -2.958
13 2HB SER 3 HB1 SER 3 43.455 7.531 -3.962
14 HG SER 3 HG SER 3 41.506 6.367 -4.928
15 H CYS 4 HN CYS 4 45.669 3.944 -2.998
16 HA CYS 4 HA CYS 4 47.445 5.418 -4.813
17 1HB CYS 4 HB2 CYS 4 49.311 5.162 -2.971
18 2HB CYS 4 HB1 CYS 4 48.208 6.532 -2.902
19 H THR 5 HN THR 5 49.309 4.055 -5.459
20 HA THR 5 HA THR 5 49.283 1.224 -4.596
21 HB THR 5 HB THR 5 48.556 2.220 -7.373
22 HG1 THR 5 HG1 THR 5 46.671 1.963 -6.506
23 1HG2 THR 5 HG21 THR 5 48.313 -0.561 -7.326
24 2HG2 THR 5 HG22 THR 5 49.851 -0.254 -6.527
25 3HG2 THR 5 HG23 THR 5 49.570 0.355 -8.160
26 H ASN 6 HN ASN 6 51.133 3.655 -4.746
27 HA ASN 6 HA ASN 6 53.442 3.979 -5.139
28 1HB ASN 6 HB2 ASN 6 54.187 1.933 -4.433
29 2HB ASN 6 HB1 ASN 6 52.921 1.073 -5.294
30 1HD2 ASN 6 HD2 ASN 6 53.590 -0.066 -7.141
31 2HD2 ASN 6 HD2 ASN 6 55.067 0.181 -7.942
32 H THR 7 HN THR 7 52.278 1.773 -7.683
33 HA THR 7 HA THR 7 52.402 3.841 -9.757
34 HB THR 7 HB THR 7 54.315 1.481 -9.833
35 HG1 THR 7 HG1 THR 7 55.070 4.165 -9.489
36 1HG2 THR 7 HG21 THR 7 54.640 2.084 -11.973
37 2HG2 THR 7 HG22 THR 7 55.037 3.726 -11.467
38 3HG2 THR 7 HG23 THR 7 53.363 3.289 -11.808
39 H ASN 8 HN ASN 8 52.233 0.413 -8.898
40 HA ASN 8 HA ASN 8 49.715 -0.067 -10.141
41 1HB ASN 8 HB2 ASN 8 51.969 0.136 -11.891
42 2HB ASN 8 HB1 ASN 8 51.455 -1.550 -11.856
43 1HD2 ASN 8 HD2 ASN 8 48.615 -0.970 -11.339
44 2HD2 ASN 8 HD2 ASN 8 47.984 -0.303 -12.766
45 H SER 9 HN SER 9 51.373 -0.786 -7.769
46 HA SER 9 HA SER 9 51.533 -3.755 -8.119
47 1HB SER 9 HB2 SER 9 52.951 -1.731 -6.397
48 2HB SER 9 HB1 SER 9 52.967 -3.442 -5.975
49 HG SER 9 HG SER 9 53.558 -3.583 -8.393
50 H GLN 10 HN GLN 10 51.609 -2.669 -4.871
51 HA GLN 10 HA GLN 10 48.678 -3.140 -4.544
52 1HB GLN 10 HB2 GLN 10 49.028 -5.022 -3.240
53 2HB GLN 10 HB1 GLN 10 50.425 -5.144 -4.304
54 1HG GLN 10 HG2 GLN 10 51.835 -4.050 -2.623
55 2HG GLN 10 HG1 GLN 10 50.441 -3.846 -1.564
56 1HE2 GLN 10 HE21 GLN 10 51.430 -5.223 0.095
57 2HE2 GLN 10 HE22 GLN 10 51.523 -6.905 -0.107
58 H LEU 11 HN LEU 11 51.721 -2.208 -2.883
59 HA LEU 11 HA LEU 11 52.036 -0.749 -1.032
60 1HB LEU 11 HB2 LEU 11 51.262 0.710 -2.959
61 2HB LEU 11 HB1 LEU 11 49.628 0.592 -2.302
62 HG LEU 11 HG LEU 11 50.284 1.658 -0.250
63 1HD1 LEU 11 HD1 LEU 11 52.404 0.724 0.239
64 2HD1 LEU 11 HD1 LEU 11 52.754 2.424 -0.076
65 3HD1 LEU 11 HD1 LEU 11 53.073 1.213 -1.318
66 1HD2 LEU 11 HD2 LEU 11 51.562 3.745 -1.298
67 2HD2 LEU 11 HD2 LEU 11 49.883 3.405 -1.720
68 3HD2 LEU 11 HD2 LEU 11 51.183 2.923 -2.812
69 H SER 12 HN SER 12 51.259 -2.477 0.445
70 HA SER 12 HA SER 12 48.677 -3.100 1.219
71 1HB SER 12 HB2 SER 12 51.148 -3.643 2.101
72 2HB SER 12 HB1 SER 12 50.666 -2.520 3.370
73 HG SER 12 HG SER 12 49.209 -3.915 4.053
74 H ALA 13 HN ALA 13 47.149 -2.197 2.691
75 HA ALA 13 HA ALA 13 46.854 0.645 2.668
76 1HB ALA 13 HB1 ALA 13 44.847 -0.423 2.992
77 2HB ALA 13 HB2 ALA 13 45.249 -0.186 4.692
78 3HB ALA 13 HB3 ALA 13 45.581 -1.735 3.915
79 H ASN 14 HN ASN 14 48.885 -1.328 4.560
80 HA ASN 14 HA ASN 14 48.878 0.450 6.921
81 1HB ASN 14 HB2 ASN 14 49.073 -2.092 6.910
82 2HB ASN 14 HB1 ASN 14 50.689 -1.880 6.237
83 1HD2 ASN 14 HD2 ASN 14 50.189 -3.048 8.848
84 2HD2 ASN 14 HD2 ASN 14 50.877 -2.016 10.006
85 H SER 15 HN SER 15 50.378 0.397 3.868
86 HA SER 15 HA SER 15 52.982 1.450 4.699
87 1HB SER 15 HB2 SER 15 52.581 0.085 2.655
88 2HB SER 15 HB1 SER 15 51.583 1.381 2.001
89 HG SER 15 HG SER 15 54.197 1.904 2.902
90 H LYS 16 HN LYS 16 53.207 3.555 2.752
91 HA LYS 16 HA LYS 16 51.234 5.586 3.734
92 1HB LYS 16 HB2 LYS 16 53.519 5.454 4.950
93 2HB LYS 16 HB1 LYS 16 54.198 6.110 3.461
94 1HG LYS 16 HG2 LYS 16 52.702 8.054 3.611
95 2HG LYS 16 HG1 LYS 16 51.972 7.393 5.074
96 1HD LYS 16 HD2 LYS 16 54.180 7.481 6.200
97 2HD LYS 16 HD1 LYS 16 54.883 8.187 4.745
98 1HE LYS 16 HE2 LYS 16 54.199 10.244 5.393
99 2HE LYS 16 HE1 LYS 16 52.520 9.677 5.479
100 1HZ LYS 16 HZ1 LYS 16 54.381 8.820 7.571
101 2HZ LYS 16 HZ2 LYS 16 52.711 9.113 7.666
102 3HZ LYS 16 HZ3 LYS 16 53.805 10.414 7.636
103 H CYS 17 HN CYS 17 50.626 7.060 2.151
104 HA CYS 17 HA CYS 17 51.896 6.734 -0.546
105 1HB CYS 17 HB2 CYS 17 49.119 7.721 0.180
106 2HB CYS 17 HB1 CYS 17 49.687 7.218 -1.413
107 H GLU 18 HN GLU 18 52.696 8.576 -1.542
108 HA GLU 18 HA GLU 18 51.848 11.266 -0.819
109 1HB GLU 18 HB2 GLU 18 54.062 11.862 0.213
110 2HB GLU 18 HB1 GLU 18 53.146 10.689 1.159
111 1HG GLU 18 HG2 GLU 18 54.719 9.268 -0.770
112 2HG GLU 18 HG1 GLU 18 55.769 10.395 0.089
113 H LYS 19 HN LYS 19 54.955 11.862 -1.403
114 HA LYS 19 HA LYS 19 54.545 11.929 -4.350
115 1HB LYS 19 HB2 LYS 19 56.436 13.587 -4.183
116 2HB LYS 19 HB1 LYS 19 55.024 14.031 -3.225
117 1HG LYS 19 HG2 LYS 19 56.094 13.676 -1.228
118 2HG LYS 19 HG1 LYS 19 57.072 12.354 -1.867
119 1HD LYS 19 HD2 LYS 19 58.795 13.755 -2.229
120 2HD LYS 19 HD1 LYS 19 57.773 14.787 -3.230
121 1HE LYS 19 HE2 LYS 19 57.830 14.902 -0.193
122 2HE LYS 19 HE1 LYS 19 58.721 16.010 -1.254
123 1HZ LYS 19 HZ1 LYS 19 56.131 16.320 -0.488
124 2HZ LYS 19 HZ2 LYS 19 55.982 15.642 -2.038
125 3HZ LYS 19 HZ3 LYS 19 56.861 17.079 -1.818
126 H SER 20 HN SER 20 55.585 9.562 -2.578
127 HA SER 20 HA SER 20 58.339 9.096 -3.126
128 1HB SER 20 HB2 SER 20 56.362 7.846 -1.779
129 2HB SER 20 HB1 SER 20 56.392 6.838 -3.223
130 HG SER 20 HG SER 20 58.754 6.796 -2.844
131 H THR 21 HN THR 21 59.145 7.413 -4.761
132 HA THR 21 HA THR 21 57.523 7.379 -7.271
133 HB THR 21 HB THR 21 58.971 9.275 -7.517
134 HG1 THR 21 HG1 THR 21 60.107 8.633 -9.260
135 1HG2 THR 21 HG21 THR 21 61.263 9.324 -6.895
136 2HG2 THR 21 HG22 THR 21 61.344 7.568 -6.765
137 3HG2 THR 21 HG23 THR 21 60.452 8.499 -5.563
138 H LEU 22 HN LEU 22 57.209 5.125 -7.107
139 HA LEU 22 HA LEU 22 59.691 3.466 -7.364
140 1HB LEU 22 HB2 LEU 22 57.823 1.823 -6.144
141 2HB LEU 22 HB1 LEU 22 59.123 2.665 -5.307
142 HG LEU 22 HG LEU 22 56.449 3.982 -5.812
143 1HD1 LEU 22 HD1 LEU 22 55.627 3.173 -3.733
144 2HD1 LEU 22 HD1 LEU 22 57.211 2.557 -3.258
145 3HD1 LEU 22 HD1 LEU 22 56.296 1.752 -4.533
146 1HD2 LEU 22 HD2 LEU 22 57.319 5.678 -4.587
147 2HD2 LEU 22 HD2 LEU 22 58.884 4.900 -4.827
148 3HD2 LEU 22 HD2 LEU 22 57.950 4.571 -3.367
149 H THR 23 HN THR 23 58.468 1.017 -7.812
150 HA THR 23 HA THR 23 56.339 1.215 -9.811
151 HB THR 23 HB THR 23 59.215 0.704 -10.646
152 HG1 THR 23 HG1 THR 23 57.464 2.868 -10.798
153 1HG2 THR 23 HG21 THR 23 56.782 0.892 -12.429
154 2HG2 THR 23 HG22 THR 23 57.378 -0.647 -11.806
155 3HG2 THR 23 HG23 THR 23 58.401 0.336 -12.853
156 H ASN 24 HN ASN 24 55.455 -0.828 -10.180
157 HA ASN 24 HA ASN 24 55.022 -3.104 -9.683
158 1HB ASN 24 HB2 ASN 24 57.944 -2.952 -10.462
159 2HB ASN 24 HB1 ASN 24 57.101 -4.487 -10.253
160 1HD2 ASN 24 HD2 ASN 24 56.503 -5.271 -12.277
161 2HD2 ASN 24 HD2 ASN 24 55.871 -4.328 -13.539
162 H CYS 25 HN CYS 25 55.678 -1.475 -7.323
163 HA CYS 25 HA CYS 25 57.546 -3.000 -5.675
164 1HB CYS 25 HB2 CYS 25 56.603 -0.467 -5.653
165 2HB CYS 25 HB1 CYS 25 55.505 -1.186 -4.481
166 H TYR 26 HN TYR 26 55.987 -2.942 -3.286
167 HA TYR 26 HA TYR 26 53.523 -4.355 -3.340
168 1HB TYR 26 HB2 TYR 26 55.733 -5.863 -4.243
169 2HB TYR 26 HB1 TYR 26 55.467 -6.399 -2.585
170 HD1 TYR 26 HD1 TYR 26 54.532 -8.564 -2.986
171 HD2 TYR 26 HD2 TYR 26 52.868 -5.106 -4.914
172 HE1 TYR 26 HE1 TYR 26 52.595 -9.914 -3.729
173 HE2 TYR 26 HE2 TYR 26 50.927 -6.459 -5.659
174 HH TYR 26 HH TYR 26 50.750 -9.377 -6.026
175 H VAL 27 HN VAL 27 54.841 -2.314 -1.951
176 HA VAL 27 HA VAL 27 56.146 -2.836 0.455
177 HB VAL 27 HB VAL 27 54.012 -0.766 -0.145
178 1HG1 VAL 27 HG11 VAL 27 55.799 0.549 1.336
179 2HG1 VAL 27 HG12 VAL 27 56.119 -1.071 1.962
180 3HG1 VAL 27 HG13 VAL 27 54.500 -0.380 2.084
181 1HG2 VAL 27 HG21 VAL 27 56.916 -1.029 -0.921
182 2HG2 VAL 27 HG22 VAL 27 56.169 0.561 -0.767
183 3HG2 VAL 27 HG23 VAL 27 55.540 -0.598 -1.939
184 H ASP 28 HN ASP 28 55.416 -3.037 2.638
185 HA ASP 28 HA ASP 28 52.573 -3.516 3.216
186 1HB ASP 28 HB2 ASP 28 54.132 -5.600 2.269
187 2HB ASP 28 HB1 ASP 28 54.223 -5.812 4.018
188 H LYS 29 HN LYS 29 52.222 -2.787 5.277
189 HA LYS 29 HA LYS 29 52.706 -1.976 7.449
190 1HB LYS 29 HB2 LYS 29 54.429 -4.440 7.113
191 2HB LYS 29 HB1 LYS 29 54.283 -3.601 8.656
192 1HG LYS 29 HG2 LYS 29 51.811 -3.873 8.527
193 2HG LYS 29 HG1 LYS 29 52.015 -4.805 7.045
194 1HD LYS 29 HD2 LYS 29 53.494 -5.582 9.550
195 2HD LYS 29 HD1 LYS 29 51.822 -6.089 9.308
196 1HE LYS 29 HE2 LYS 29 52.625 -7.813 8.073
197 2HE LYS 29 HE1 LYS 29 53.135 -6.620 6.861
198 1HZ LYS 29 HZ1 LYS 29 55.142 -6.234 8.236
199 2HZ LYS 29 HZ2 LYS 29 55.065 -7.806 7.597
200 3HZ LYS 29 HZ3 LYS 29 54.684 -7.529 9.229
201 H SER 30 HN SER 30 54.264 -0.805 5.215
202 HA SER 30 HA SER 30 56.763 -0.101 6.723
203 1HB SER 30 HB2 SER 30 56.282 -0.296 3.735
204 2HB SER 30 HB1 SER 30 57.808 0.137 4.499
205 HG SER 30 HG SER 30 56.413 -2.274 5.026
206 H GLU 31 HN GLU 31 57.550 1.973 5.019
207 HA GLU 31 HA GLU 31 55.269 3.912 5.077
208 1HB GLU 31 HB2 GLU 31 57.114 3.753 7.060
209 2HB GLU 31 HB1 GLU 31 57.947 4.853 5.959
210 1HG GLU 31 HG2 GLU 31 56.335 6.504 6.168
211 2HG GLU 31 HG1 GLU 31 55.052 5.353 6.535
212 H VAL 32 HN VAL 32 58.782 3.910 4.363
213 HA VAL 32 HA VAL 32 59.944 4.576 2.421
214 HB VAL 32 HB VAL 32 57.252 4.094 1.109
215 1HG1 VAL 32 HG11 VAL 32 60.014 3.549 0.026
216 2HG1 VAL 32 HG12 VAL 32 59.245 5.126 -0.165
217 3HG1 VAL 32 HG13 VAL 32 58.499 3.688 -0.866
218 1HG2 VAL 32 HG21 VAL 32 58.424 2.273 2.729
219 2HG2 VAL 32 HG22 VAL 32 59.323 1.956 1.247
220 3HG2 VAL 32 HG23 VAL 32 57.566 1.817 1.259
221 H TYR 33 HN TYR 33 60.155 6.455 0.992
222 HA TYR 33 HA TYR 33 58.037 8.524 1.110
223 1HB TYR 33 HB2 TYR 33 60.597 8.496 2.645
224 2HB TYR 33 HB1 TYR 33 60.095 10.038 1.961
225 HD1 TYR 33 HD1 TYR 33 59.474 7.542 4.524
226 HD2 TYR 33 HD2 TYR 33 57.830 10.972 2.528
227 HE1 TYR 33 HE1 TYR 33 57.839 7.832 6.369
228 HE2 TYR 33 HE2 TYR 33 56.197 11.262 4.373
229 HH TYR 33 HH TYR 33 56.478 9.647 7.346
230 H GLY 34 HN GLY 34 61.348 7.657 0.111
231 1HA GLY 34 HA2 GLY 34 60.837 8.953 -2.514
232 2HA GLY 34 HA1 GLY 34 62.271 9.458 -1.614
233 H THR 35 HN THR 35 60.986 6.179 -1.629
234 HA THR 35 HA THR 35 63.587 5.096 -2.399
235 HB THR 35 HB THR 35 60.900 4.151 -1.503
236 HG1 THR 35 HG1 THR 35 62.762 4.587 -0.153
237 1HG2 THR 35 HG21 THR 35 61.956 1.749 -1.862
238 2HG2 THR 35 HG22 THR 35 62.779 2.551 -3.200
239 3HG2 THR 35 HG23 THR 35 61.016 2.517 -3.142
240 H THR 36 HN THR 36 63.899 3.680 -4.264
241 HA THR 36 HA THR 36 62.203 4.454 -6.611
242 HB THR 36 HB THR 36 64.895 3.229 -6.931
243 HG1 THR 36 HG1 THR 36 65.934 5.080 -6.278
244 1HG2 THR 36 HG21 THR 36 63.135 4.534 -8.565
245 2HG2 THR 36 HG22 THR 36 64.863 4.391 -8.883
246 3HG2 THR 36 HG23 THR 36 64.224 5.846 -8.117
247 H CYS 37 HN CYS 37 61.166 2.397 -5.067
248 HA CYS 37 HA CYS 37 61.898 -0.235 -5.306
249 1HB CYS 37 HB2 CYS 37 59.710 1.002 -4.504
250 2HB CYS 37 HB1 CYS 37 59.122 0.564 -6.105
251 H THR 38 HN THR 38 62.583 -1.439 -7.007
252 HA THR 38 HA THR 38 61.533 -0.794 -9.742
253 HB THR 38 HB THR 38 64.078 -2.239 -8.939
254 HG1 THR 38 HG1 THR 38 64.829 -0.348 -8.504
255 1HG2 THR 38 HG21 THR 38 64.723 -1.529 -11.284
256 2HG2 THR 38 HG22 THR 38 63.041 -1.049 -11.518
257 3HG2 THR 38 HG23 THR 38 63.440 -2.736 -11.197
258 H GLY 39 HN GLY 39 60.491 -2.629 -7.502
259 1HA GLY 39 HA2 GLY 39 59.048 -4.545 -8.313
260 2HA GLY 39 HA1 GLY 39 60.516 -5.179 -9.059
261 H SER 40 HN SER 40 60.157 -3.675 -5.851
262 HA SER 40 HA SER 40 61.168 -6.237 -4.661
263 1HB SER 40 HB2 SER 40 62.211 -3.656 -4.664
264 2HB SER 40 HB1 SER 40 61.446 -3.789 -3.082
265 HG SER 40 HG SER 40 62.636 -5.694 -2.747
266 H ARG 41 HN ARG 41 60.672 -5.475 -1.964
267 HA ARG 41 HA ARG 41 57.864 -4.727 -1.638
268 1HB ARG 41 HB2 ARG 41 57.440 -6.894 -2.496
269 2HB ARG 41 HB1 ARG 41 58.815 -7.591 -1.638
270 1HG ARG 41 HG2 ARG 41 57.702 -7.386 0.483
271 2HG ARG 41 HG1 ARG 41 56.405 -6.423 -0.224
272 1HD ARG 41 HD2 ARG 41 55.650 -8.330 -1.548
273 2HD ARG 41 HD1 ARG 41 57.008 -9.309 -0.961
274 HE ARG 41 HE ARG 41 55.937 -8.593 1.392
275 1HH1 ARG 41 HH2 ARG 41 53.804 -8.323 -1.135
276 2HH1 ARG 41 HH2 ARG 41 52.671 -9.504 -0.564
277 1HH2 ARG 41 HH1 ARG 41 54.741 -10.655 1.969
278 2HH2 ARG 41 HH1 ARG 41 53.200 -10.822 1.194
279 H PHE 42 HN PHE 42 57.406 -4.296 0.551
280 HA PHE 42 HA PHE 42 59.641 -4.809 2.486
281 1HB PHE 42 HB2 PHE 42 57.529 -2.627 2.526
282 2HB PHE 42 HB1 PHE 42 58.981 -2.714 3.527
283 HD1 PHE 42 HD1 PHE 42 58.031 -0.514 1.461
284 HD2 PHE 42 HD2 PHE 42 60.821 -3.775 1.286
285 HE1 PHE 42 HE1 PHE 42 59.310 0.674 -0.300
286 HE2 PHE 42 HE2 PHE 42 62.102 -2.586 -0.474
287 HZ PHE 42 HZ PHE 42 61.345 -0.361 -1.267
288 H ASP 43 HN ASP 43 58.702 -4.867 4.848
289 HA ASP 43 HA ASP 43 55.931 -5.832 5.079
290 1HB ASP 43 HB2 ASP 43 58.033 -7.599 4.414
291 2HB ASP 43 HB1 ASP 43 57.686 -7.890 6.117
292 H GLY 44 HN GLY 44 57.304 -3.678 6.314
293 1HA GLY 44 HA2 GLY 44 56.667 -3.240 8.750
294 2HA GLY 44 HA1 GLY 44 57.633 -4.672 9.114
295 H VAL 45 HN VAL 45 58.099 -1.720 7.110
296 HA VAL 45 HA VAL 45 60.683 -1.310 8.570
297 HB VAL 45 HB VAL 45 61.880 -1.256 6.555
298 1HG1 VAL 45 HG11 VAL 45 60.937 -3.526 6.976
299 2HG1 VAL 45 HG12 VAL 45 61.241 -3.211 5.265
300 3HG1 VAL 45 HG13 VAL 45 59.598 -3.128 5.898
301 1HG2 VAL 45 HG21 VAL 45 60.892 -0.868 4.359
302 2HG2 VAL 45 HG22 VAL 45 60.375 0.408 5.462
303 3HG2 VAL 45 HG23 VAL 45 59.270 -0.906 5.053
304 H THR 46 HN THR 46 61.600 0.907 7.405
305 HA THR 46 HA THR 46 59.455 2.915 7.080
306 HB THR 46 HB THR 46 61.512 2.994 9.321
307 HG1 THR 46 HG1 THR 46 60.036 2.042 10.438
308 1HG2 THR 46 HG21 THR 46 61.065 5.235 8.616
309 2HG2 THR 46 HG22 THR 46 60.058 4.965 10.039
310 3HG2 THR 46 HG23 THR 46 59.343 4.903 8.428
311 H ILE 47 HN ILE 47 61.055 2.270 5.041
312 HA ILE 47 HA ILE 47 63.606 3.709 5.071
313 HB ILE 47 HB ILE 47 63.318 1.646 3.804
314 1HG1 ILE 47 HG12 ILE 47 63.410 3.992 1.876
315 2HG1 ILE 47 HG11 ILE 47 64.781 3.451 2.844
316 1HG2 ILE 47 HG21 ILE 47 60.780 2.795 3.209
317 2HG2 ILE 47 HG22 ILE 47 61.365 1.186 2.790
318 3HG2 ILE 47 HG23 ILE 47 61.613 2.532 1.678
319 1HD1 ILE 47 HD1 ILE 47 63.445 2.095 0.525
320 2HD1 ILE 47 HD1 ILE 47 64.221 1.104 1.762
321 3HD1 ILE 47 HD1 ILE 47 65.165 2.292 0.862
322 H THR 48 HN THR 48 64.009 5.342 3.278
323 HA THR 48 HA THR 48 61.629 6.976 2.558
324 HB THR 48 HB THR 48 62.684 8.965 3.537
325 HG1 THR 48 HG1 THR 48 64.608 8.373 4.915
326 1HG2 THR 48 HG21 THR 48 62.316 8.473 5.809
327 2HG2 THR 48 HG22 THR 48 62.908 6.820 5.635
328 3HG2 THR 48 HG23 THR 48 61.342 7.273 4.957
329 H THR 49 HN THR 49 63.743 9.133 1.950
330 HA THR 49 HA THR 49 64.157 8.634 -0.791
331 HB THR 49 HB THR 49 65.942 10.147 1.145
332 HG1 THR 49 HG1 THR 49 64.018 11.477 -0.307
333 1HG2 THR 49 HG21 THR 49 66.340 11.576 -0.867
334 2HG2 THR 49 HG22 THR 49 65.416 10.415 -1.824
335 3HG2 THR 49 HG23 THR 49 66.930 9.923 -1.057
336 H SER 50 HN SER 50 64.895 6.413 -1.044
337 HA SER 50 HA SER 50 67.813 6.097 -0.627
338 1HB SER 50 HB2 SER 50 65.630 4.647 0.816
339 2HB SER 50 HB1 SER 50 67.067 3.733 0.369
340 HG SER 50 HG SER 50 66.725 5.554 2.329
341 H THR 51 HN THR 51 68.714 4.687 -2.148
342 HA THR 51 HA THR 51 66.849 3.710 -4.262
343 HB THR 51 HB THR 51 69.836 3.601 -4.424
344 HG1 THR 51 HG1 THR 51 69.681 5.612 -3.657
345 1HG2 THR 51 HG21 THR 51 67.940 4.708 -6.467
346 2HG2 THR 51 HG22 THR 51 68.042 2.963 -6.227
347 3HG2 THR 51 HG23 THR 51 69.473 3.874 -6.709
348 H SER 52 HN SER 52 66.554 1.536 -4.597
349 HA SER 52 HA SER 52 68.485 -0.435 -3.535
350 1HB SER 52 HB2 SER 52 66.885 -1.435 -2.028
351 2HB SER 52 HB1 SER 52 66.901 0.294 -1.685
352 HG SER 52 HG SER 52 64.788 -0.896 -2.036
353 H THR 53 HN THR 53 68.544 -2.156 -4.962
354 HA THR 53 HA THR 53 66.224 -2.451 -6.846
355 HB THR 53 HB THR 53 69.075 -3.415 -7.181
356 HG1 THR 53 HG1 THR 53 69.591 -1.433 -7.541
357 1HG2 THR 53 HG21 THR 53 67.838 -4.476 -8.822
358 2HG2 THR 53 HG22 THR 53 68.213 -2.968 -9.652
359 3HG2 THR 53 HG23 THR 53 66.637 -3.188 -8.896
360 H GLY 54 HN GLY 54 64.954 -4.142 -6.169
361 1HA GLY 54 HA2 GLY 54 64.355 -6.252 -5.323
362 2HA GLY 54 HA1 GLY 54 65.839 -6.821 -6.092
363 H SER 55 HN SER 55 64.482 -5.533 -3.098
364 HA SER 55 HA SER 55 66.618 -6.900 -1.574
365 1HB SER 55 HB2 SER 55 67.221 -4.782 -0.430
366 2HB SER 55 HB1 SER 55 67.545 -4.700 -2.157
367 HG SER 55 HG SER 55 66.163 -3.008 -0.833
368 H ARG 56 HN ARG 56 65.334 -8.050 -0.174
369 HA ARG 56 HA ARG 56 62.700 -7.256 0.679
370 1HB ARG 56 HB2 ARG 56 63.675 -9.575 0.558
371 2HB ARG 56 HB1 ARG 56 64.674 -9.178 1.956
372 1HG ARG 56 HG2 ARG 56 62.912 -9.269 3.414
373 2HG ARG 56 HG1 ARG 56 61.767 -8.632 2.232
374 1HD ARG 56 HD2 ARG 56 61.292 -10.725 1.364
375 2HD ARG 56 HD1 ARG 56 62.912 -11.354 1.725
376 HE ARG 56 HE ARG 56 61.240 -10.659 4.061
377 1HH1 ARG 56 HH2 ARG 56 63.641 -12.683 3.305
378 2HH1 ARG 56 HH2 ARG 56 62.859 -14.161 3.755
379 1HH2 ARG 56 HH1 ARG 56 59.721 -12.722 4.057
380 2HH2 ARG 56 HH1 ARG 56 60.641 -14.184 4.182
381 H ILE 57 HN ILE 57 62.297 -5.588 2.091
382 HA ILE 57 HA ILE 57 64.435 -4.745 3.974
383 HB ILE 57 HB ILE 57 61.761 -3.466 3.348
384 1HG1 ILE 57 HG12 ILE 57 63.020 -3.858 1.256
385 2HG1 ILE 57 HG11 ILE 57 62.988 -2.140 1.657
386 1HG2 ILE 57 HG21 ILE 57 64.376 -2.201 4.178
387 2HG2 ILE 57 HG22 ILE 57 63.170 -2.730 5.351
388 3HG2 ILE 57 HG23 ILE 57 62.773 -1.468 4.185
389 1HD1 ILE 57 HD1 ILE 57 65.246 -2.388 1.217
390 2HD1 ILE 57 HD1 ILE 57 65.273 -4.066 1.758
391 3HD1 ILE 57 HD1 ILE 57 65.237 -2.760 2.940
392 H SER 58 HN SER 58 62.186 -7.047 4.162
393 HA SER 58 HA SER 58 60.373 -6.681 6.199
394 1HB SER 58 HB2 SER 58 62.165 -8.849 5.290
395 2HB SER 58 HB1 SER 58 61.525 -9.060 6.916
396 HG SER 58 HG SER 58 59.499 -8.249 5.522
397 H GLY 59 HN GLY 59 60.439 -6.501 8.477
398 1HA GLY 59 HA2 GLY 59 62.673 -6.963 10.137
399 2HA GLY 59 HA1 GLY 59 62.753 -5.272 9.644
400 HA PRO 60 HA PRO 60 59.432 -6.013 12.940
401 1HB PRO 60 HB2 PRO 60 60.844 -6.296 15.267
402 2HB PRO 60 HB1 PRO 60 60.347 -7.677 14.269
403 1HG PRO 60 HG2 PRO 60 63.004 -6.427 14.568
404 2HG PRO 60 HG1 PRO 60 62.577 -8.100 14.193
405 1HD PRO 60 HD2 PRO 60 63.447 -6.168 12.367
406 2HD PRO 60 HD1 PRO 60 62.692 -7.725 11.966
407 H GLY 61 HN GLY 61 61.977 -4.033 12.217
408 1HA GLY 61 HA2 GLY 61 60.792 -1.655 13.251
409 2HA GLY 61 HA1 GLY 61 62.125 -2.134 14.309
410 H CYS 62 HN CYS 62 62.034 -2.775 10.855
411 HA CYS 62 HA CYS 62 64.660 -1.812 10.359
412 1HB CYS 62 HB2 CYS 62 62.554 -3.101 9.008
413 2HB CYS 62 HB1 CYS 62 62.890 -1.651 8.064
414 H LYS 63 HN LYS 63 65.363 0.097 9.302
415 HA LYS 63 HA LYS 63 63.488 2.311 8.797
416 1HB LYS 63 HB2 LYS 63 63.815 2.532 11.188
417 2HB LYS 63 HB1 LYS 63 65.558 2.305 11.018
418 1HG LYS 63 HG2 LYS 63 65.740 4.393 9.758
419 2HG LYS 63 HG1 LYS 63 63.991 4.610 9.821
420 1HD LYS 63 HD2 LYS 63 64.898 4.184 12.490
421 2HD LYS 63 HD1 LYS 63 65.944 5.403 11.757
422 1HE LYS 63 HE2 LYS 63 64.092 6.632 12.654
423 2HE LYS 63 HE1 LYS 63 63.750 6.504 10.915
424 1HZ LYS 63 HZ1 LYS 63 62.849 4.474 12.878
425 2HZ LYS 63 HZ2 LYS 63 62.342 4.668 11.268
426 3HZ LYS 63 HZ3 LYS 63 61.889 5.804 12.446
427 H ILE 64 HN ILE 64 64.278 2.925 6.802
428 HA ILE 64 HA ILE 64 67.256 3.032 6.481
429 HB ILE 64 HB ILE 64 64.993 2.356 4.597
430 1HG1 ILE 64 HG12 ILE 64 67.279 0.597 4.620
431 2HG1 ILE 64 HG11 ILE 64 66.715 0.858 6.270
432 1HG2 ILE 64 HG21 ILE 64 66.406 2.492 2.752
433 2HG2 ILE 64 HG22 ILE 64 67.866 2.357 3.732
434 3HG2 ILE 64 HG23 ILE 64 66.970 3.874 3.689
435 1HD1 ILE 64 HD1 ILE 64 64.560 0.040 5.795
436 2HD1 ILE 64 HD1 ILE 64 65.623 -1.055 4.910
437 3HD1 ILE 64 HD1 ILE 64 64.775 0.234 4.055
438 H SER 65 HN SER 65 68.123 4.830 5.423
439 HA SER 65 HA SER 65 66.346 7.002 4.485
440 1HB SER 65 HB2 SER 65 68.359 8.045 6.309
441 2HB SER 65 HB1 SER 65 66.617 8.299 6.322
442 HG SER 65 HG SER 65 67.703 7.104 8.151
443 H THR 66 HN THR 66 67.276 7.500 2.537
444 HA THR 66 HA THR 66 68.963 7.826 0.892
445 HB THR 66 HB THR 66 70.793 8.601 3.136
446 HG1 THR 66 HG1 THR 66 68.244 9.601 2.615
447 1HG2 THR 66 HG21 THR 66 70.853 8.916 0.424
448 2HG2 THR 66 HG22 THR 66 71.688 9.979 1.561
449 3HG2 THR 66 HG23 THR 66 70.106 10.434 0.926
450 H CYS 67 HN CYS 67 68.947 5.325 0.932
451 HA CYS 67 HA CYS 67 71.731 4.355 1.545
452 1HB CYS 67 HB2 CYS 67 69.035 3.188 2.287
453 2HB CYS 67 HB1 CYS 67 70.503 2.215 2.272
454 H ILE 68 HN ILE 68 72.457 3.869 -0.550
455 HA ILE 68 HA ILE 68 70.637 2.956 -2.645
456 HB ILE 68 HB ILE 68 73.652 3.115 -2.410
457 1HG1 ILE 68 HG12 ILE 68 71.664 5.112 -2.590
458 2HG1 ILE 68 HG11 ILE 68 73.399 5.324 -2.793
459 1HG2 ILE 68 HG21 ILE 68 71.926 2.752 -4.877
460 2HG2 ILE 68 HG22 ILE 68 72.859 1.469 -4.107
461 3HG2 ILE 68 HG23 ILE 68 73.688 2.845 -4.836
462 1HD1 ILE 68 HD1 ILE 68 73.176 4.819 -5.198
463 2HD1 ILE 68 HD1 ILE 68 72.178 6.201 -4.739
464 3HD1 ILE 68 HD1 ILE 68 71.436 4.620 -4.991
465 H ILE 69 HN ILE 69 70.269 0.815 -3.230
466 HA ILE 69 HA ILE 69 72.025 -1.285 -2.077
467 HB ILE 69 HB ILE 69 69.016 -1.392 -1.793
468 1HG1 ILE 69 HG12 ILE 69 71.014 -0.309 0.236
469 2HG1 ILE 69 HG11 ILE 69 69.864 0.671 -0.678
470 1HG2 ILE 69 HG21 ILE 69 70.694 -3.395 -1.514
471 2HG2 ILE 69 HG22 ILE 69 69.421 -3.159 -0.316
472 3HG2 ILE 69 HG23 ILE 69 71.066 -2.625 0.028
473 1HD1 ILE 69 HD1 ILE 69 68.276 -1.331 0.409
474 2HD1 ILE 69 HD1 ILE 69 68.416 0.321 1.009
475 3HD1 ILE 69 HD1 ILE 69 69.417 -0.957 1.701
476 H THR 70 HN THR 70 71.705 -3.383 -3.149
477 HA THR 70 HA THR 70 69.968 -3.483 -5.537
478 HB THR 70 HB THR 70 72.987 -3.294 -5.573
479 HG1 THR 70 HG1 THR 70 72.465 -1.732 -7.166
480 1HG2 THR 70 HG21 THR 70 73.127 -4.653 -7.357
481 2HG2 THR 70 HG22 THR 70 71.860 -3.748 -8.184
482 3HG2 THR 70 HG23 THR 70 71.434 -5.087 -7.123
483 H GLY 71 HN GLY 71 69.049 -5.412 -4.727
484 1HA GLY 71 HA2 GLY 71 69.042 -7.810 -4.836
485 2HA GLY 71 HA1 GLY 71 70.807 -7.783 -4.871
486 H GLY 72 HN GLY 72 69.259 -5.786 -2.526
487 1HA GLY 72 HA2 GLY 72 68.827 -6.193 -0.209
488 2HA GLY 72 HA1 GLY 72 69.428 -7.837 -0.410
489 H VAL 73 HN VAL 73 71.385 -5.444 -1.837
490 HA VAL 73 HA VAL 73 73.295 -5.522 0.487
491 HB VAL 73 HB VAL 73 75.037 -5.786 -1.171
492 1HG1 VAL 73 HG11 VAL 73 74.499 -7.914 -2.027
493 2HG1 VAL 73 HG12 VAL 73 72.813 -7.477 -2.308
494 3HG1 VAL 73 HG13 VAL 73 73.391 -7.757 -0.665
495 1HG2 VAL 73 HG21 VAL 73 74.056 -5.919 -3.660
496 2HG2 VAL 73 HG22 VAL 73 74.554 -4.384 -2.948
497 3HG2 VAL 73 HG23 VAL 73 72.848 -4.833 -2.969
498 HA PRO 74 HA PRO 74 72.882 -1.109 -0.047
499 1HB PRO 74 HB2 PRO 74 74.692 -0.344 1.837
500 2HB PRO 74 HB1 PRO 74 73.077 -0.942 2.245
501 1HG PRO 74 HG2 PRO 74 75.695 -2.332 2.384
502 2HG PRO 74 HG1 PRO 74 74.276 -2.489 3.427
503 1HD PRO 74 HD2 PRO 74 74.989 -4.272 1.436
504 2HD PRO 74 HD1 PRO 74 73.360 -4.115 2.129
505 H ALA 75 HN ALA 75 74.035 0.478 -1.203
506 HA ALA 75 HA ALA 75 76.648 -0.378 -2.352
507 1HB ALA 75 HB1 ALA 75 75.184 2.057 -3.251
508 2HB ALA 75 HB2 ALA 75 74.366 0.512 -3.488
509 3HB ALA 75 HB3 ALA 75 75.949 0.793 -4.213
510 HA PRO 76 HA PRO 76 78.944 2.805 -0.373
511 1HB PRO 76 HB2 PRO 76 80.323 4.037 -2.392
512 2HB PRO 76 HB1 PRO 76 80.698 2.396 -1.828
513 1HG PRO 76 HG2 PRO 76 79.172 3.270 -4.226
514 2HG PRO 76 HG1 PRO 76 80.306 1.923 -4.038
515 1HD PRO 76 HD2 PRO 76 77.588 1.635 -4.053
516 2HD PRO 76 HD1 PRO 76 78.694 0.516 -3.226
517 H SER 77 HN SER 77 77.476 4.341 0.449
518 HA SER 77 HA SER 77 76.729 6.591 -1.392
519 1HB SER 77 HB2 SER 77 75.039 4.877 -0.254
520 2HB SER 77 HB1 SER 77 75.251 5.942 1.134
521 HG SER 77 HG SER 77 73.582 6.361 -0.695
522 H ALA 78 HN ALA 78 78.171 5.667 1.659
523 HA ALA 78 HA ALA 78 79.339 6.955 3.262
524 1HB ALA 78 HB1 ALA 78 80.244 7.798 1.013
525 2HB ALA 78 HB2 ALA 78 80.418 8.902 2.377
526 3HB ALA 78 HB3 ALA 78 79.136 9.157 1.194
527 H ALA 79 HN ALA 79 76.234 7.289 2.574
528 HA ALA 79 HA ALA 79 75.814 9.449 4.597
529 1HB ALA 79 HB1 ALA 79 74.776 9.201 1.786
530 2HB ALA 79 HB2 ALA 79 75.459 10.612 2.593
531 3HB ALA 79 HB3 ALA 79 73.829 10.069 2.995
532 H CYS 80 HN CYS 80 74.918 6.366 3.297
533 HA CYS 80 HA CYS 80 72.239 6.119 4.243
534 1HB CYS 80 HB2 CYS 80 73.236 4.609 2.635
535 2HB CYS 80 HB1 CYS 80 74.494 4.153 3.770
536 H LYS 81 HN LYS 81 71.627 4.622 6.134
537 HA LYS 81 HA LYS 81 73.229 5.407 8.514
538 1HB LYS 81 HB2 LYS 81 71.198 5.573 9.583
539 2HB LYS 81 HB1 LYS 81 70.627 5.759 7.931
540 1HG LYS 81 HG2 LYS 81 70.795 2.990 9.115
541 2HG LYS 81 HG1 LYS 81 69.454 4.038 9.544
542 1HD LYS 81 HD2 LYS 81 68.502 3.884 7.496
543 2HD LYS 81 HD1 LYS 81 70.044 3.958 6.658
544 1HE LYS 81 HE2 LYS 81 70.374 1.523 7.642
545 2HE LYS 81 HE1 LYS 81 68.603 1.552 7.740
546 1HZ LYS 81 HZ1 LYS 81 68.864 2.603 5.375
547 2HZ LYS 81 HZ2 LYS 81 68.863 0.917 5.581
548 3HZ LYS 81 HZ3 LYS 81 70.330 1.750 5.383
549 H ILE 82 HN ILE 82 71.867 2.517 6.935
550 HA ILE 82 HA ILE 82 72.134 0.220 7.496
551 HB ILE 82 HB ILE 82 74.863 1.315 8.255
552 1HG1 ILE 82 HG12 ILE 82 74.046 2.115 6.020
553 2HG1 ILE 82 HG11 ILE 82 75.459 1.066 5.907
554 1HG2 ILE 82 HG21 ILE 82 73.725 -1.378 7.724
555 2HG2 ILE 82 HG22 ILE 82 75.067 -0.911 8.767
556 3HG2 ILE 82 HG23 ILE 82 75.309 -1.049 7.025
557 1HD1 ILE 82 HD1 ILE 82 74.037 0.178 4.265
558 2HD1 ILE 82 HD1 ILE 82 72.591 0.443 5.238
559 3HD1 ILE 82 HD1 ILE 82 73.708 -0.856 5.653
560 H SER 83 HN SER 83 70.694 1.173 9.492
561 HA SER 83 HA SER 83 72.169 0.564 12.027
562 1HB SER 83 HB2 SER 83 69.682 2.212 11.481
563 2HB SER 83 HB1 SER 83 70.465 2.031 13.049
564 HG SER 83 HG SER 83 71.518 3.738 12.371
565 H GLY 84 HN GLY 84 69.144 0.666 13.022
566 1HA GLY 84 HA2 GLY 84 68.843 -2.160 13.318
567 2HA GLY 84 HA1 GLY 84 67.603 -0.958 13.675
568 H CYS 85 HN CYS 85 69.162 -2.426 10.785
569 HA CYS 85 HA CYS 85 66.527 -3.133 9.730
570 1HB CYS 85 HB2 CYS 85 67.078 -0.608 9.314
571 2HB CYS 85 HB1 CYS 85 68.200 -1.214 8.105
572 H THR 86 HN THR 86 67.026 -3.820 7.201
573 HA THR 86 HA THR 86 69.662 -4.791 6.594
574 HB THR 86 HB THR 86 69.345 -6.191 8.523
575 HG1 THR 86 HG1 THR 86 69.862 -7.951 7.500
576 1HG2 THR 86 HG21 THR 86 66.748 -7.198 7.351
577 2HG2 THR 86 HG22 THR 86 66.800 -5.838 8.474
578 3HG2 THR 86 HG23 THR 86 67.369 -7.427 8.986
579 H PHE 87 HN PHE 87 69.644 -6.207 4.665
580 HA PHE 87 HA PHE 87 67.005 -6.242 3.238
581 1HB PHE 87 HB2 PHE 87 69.421 -6.019 1.565
582 2HB PHE 87 HB1 PHE 87 67.910 -5.134 1.452
583 HD1 PHE 87 HD1 PHE 87 67.677 -3.708 3.978
584 HD2 PHE 87 HD2 PHE 87 71.192 -4.527 1.628
585 HE1 PHE 87 HE1 PHE 87 68.810 -1.732 4.985
586 HE2 PHE 87 HE2 PHE 87 72.311 -2.565 2.641
587 HZ PHE 87 HZ PHE 87 71.127 -1.169 4.311
588 H SER 88 HN SER 88 66.792 -8.037 1.702
589 HA SER 88 HA SER 88 68.900 -10.143 1.837
590 1HB SER 88 HB2 SER 88 66.558 -10.090 3.405
591 2HB SER 88 HB1 SER 88 66.240 -11.261 2.129
592 HG SER 88 HG SER 88 67.746 -12.528 2.916
593 H ALA 89 HN ALA 89 67.624 -8.280 -0.247
594 HA ALA 89 HA ALA 89 66.914 -8.440 -2.496
595 1HB ALA 89 HB1 ALA 89 68.852 -10.407 -1.870
596 2HB ALA 89 HB2 ALA 89 68.468 -9.764 -3.466
597 3HB ALA 89 HB3 ALA 89 67.648 -11.210 -2.877
598 H ASN 90 HN ASN 90 64.598 -8.409 -1.866
599 HA ASN 90 HA ASN 90 63.121 -10.775 -1.196
600 1HB ASN 90 HB2 ASN 90 61.276 -9.326 -1.333
601 2HB ASN 90 HB1 ASN 90 62.604 -8.205 -1.045
602 1HD2 ASN 90 HD2 ASN 90 63.777 -7.969 -3.560
603 2HD2 ASN 90 HD2 ASN 90 62.658 -7.349 -4.674
Start of MODEL 8
1 1H ASP 1 HT1 ASP 1 44.912 5.329 3.877
2 2H ASP 1 HT2 ASP 1 44.960 6.731 4.835
3 3H ASP 1 HT3 ASP 1 45.534 5.255 5.454
4 HA ASP 1 HA ASP 1 47.293 6.898 4.694
5 1HB ASP 1 HB2 ASP 1 46.888 4.010 4.049
6 2HB ASP 1 HB1 ASP 1 48.319 4.794 3.378
7 H GLY 2 HN GLY 2 46.220 4.825 1.991
8 1HA GLY 2 HA2 GLY 2 45.374 6.689 0.134
9 2HA GLY 2 HA1 GLY 2 47.135 6.775 0.031
10 H SER 3 HN SER 3 44.581 5.362 -1.424
11 HA SER 3 HA SER 3 45.164 2.608 -1.663
12 1HB SER 3 HB2 SER 3 43.402 2.816 -3.070
13 2HB SER 3 HB1 SER 3 43.477 4.554 -2.794
14 HG SER 3 HG SER 3 43.637 3.950 -5.026
15 H CYS 4 HN CYS 4 46.130 5.156 -3.989
16 HA CYS 4 HA CYS 4 48.002 5.279 -5.421
17 1HB CYS 4 HB2 CYS 4 49.252 3.471 -3.335
18 2HB CYS 4 HB1 CYS 4 50.061 4.673 -4.341
19 H THR 5 HN THR 5 50.011 3.086 -5.576
20 HA THR 5 HA THR 5 48.847 0.580 -6.273
21 HB THR 5 HB THR 5 48.916 2.767 -8.348
22 HG1 THR 5 HG1 THR 5 47.158 0.698 -7.570
23 1HG2 THR 5 HG21 THR 5 49.816 0.005 -8.719
24 2HG2 THR 5 HG22 THR 5 49.982 1.393 -9.794
25 3HG2 THR 5 HG23 THR 5 48.493 0.446 -9.796
26 H ASN 6 HN ASN 6 51.352 3.019 -6.803
27 HA ASN 6 HA ASN 6 53.688 2.796 -7.006
28 1HB ASN 6 HB2 ASN 6 53.952 1.496 -5.120
29 2HB ASN 6 HB1 ASN 6 52.644 0.411 -5.572
30 1HD2 ASN 6 HD2 ASN 6 55.782 1.229 -7.154
31 2HD2 ASN 6 HD2 ASN 6 56.292 -0.383 -7.292
32 H THR 7 HN THR 7 52.430 2.769 -9.372
33 HA THR 7 HA THR 7 52.697 2.077 -11.623
34 HB THR 7 HB THR 7 54.816 0.177 -10.647
35 HG1 THR 7 HG1 THR 7 54.725 2.953 -10.410
36 1HG2 THR 7 HG21 THR 7 54.035 1.442 -13.130
37 2HG2 THR 7 HG22 THR 7 55.200 0.144 -12.863
38 3HG2 THR 7 HG23 THR 7 55.711 1.828 -12.736
39 H ASN 8 HN ASN 8 53.425 -0.831 -9.644
40 HA ASN 8 HA ASN 8 51.742 -2.553 -11.279
41 1HB ASN 8 HB2 ASN 8 53.572 -3.594 -10.204
42 2HB ASN 8 HB1 ASN 8 53.283 -2.739 -8.690
43 1HD2 ASN 8 HD2 ASN 8 50.569 -4.181 -10.402
44 2HD2 ASN 8 HD2 ASN 8 50.316 -5.451 -9.308
45 H SER 9 HN SER 9 51.408 -2.496 -7.767
46 HA SER 9 HA SER 9 49.243 -1.003 -7.130
47 1HB SER 9 HB2 SER 9 47.307 -2.703 -7.676
48 2HB SER 9 HB1 SER 9 47.883 -1.615 -8.936
49 HG SER 9 HG SER 9 48.579 -4.332 -8.496
50 H GLN 10 HN GLN 10 51.029 -2.155 -5.418
51 HA GLN 10 HA GLN 10 49.261 -4.001 -3.883
52 1HB GLN 10 HB2 GLN 10 51.973 -4.519 -5.008
53 2HB GLN 10 HB1 GLN 10 51.611 -5.177 -3.409
54 1HG GLN 10 HG2 GLN 10 49.481 -6.112 -4.371
55 2HG GLN 10 HG1 GLN 10 50.077 -5.654 -5.966
56 1HE2 GLN 10 HE21 GLN 10 51.779 -6.930 -6.904
57 2HE2 GLN 10 HE22 GLN 10 52.367 -8.347 -6.177
58 H LEU 11 HN LEU 11 50.488 -1.115 -3.787
59 HA LEU 11 HA LEU 11 52.173 -0.969 -1.461
60 1HB LEU 11 HB2 LEU 11 51.678 0.791 -3.237
61 2HB LEU 11 HB1 LEU 11 50.115 1.030 -2.459
62 HG LEU 11 HG LEU 11 51.099 1.861 -0.475
63 1HD1 LEU 11 HD1 LEU 11 53.554 0.463 -1.502
64 2HD1 LEU 11 HD1 LEU 11 52.809 0.385 0.093
65 3HD1 LEU 11 HD1 LEU 11 53.733 1.811 -0.375
66 1HD2 LEU 11 HD2 LEU 11 51.256 3.395 -2.447
67 2HD2 LEU 11 HD2 LEU 11 52.901 2.818 -2.719
68 3HD2 LEU 11 HD2 LEU 11 52.506 3.697 -1.241
69 H SER 12 HN SER 12 51.095 -2.591 -0.111
70 HA SER 12 HA SER 12 48.621 -2.966 0.849
71 1HB SER 12 HB2 SER 12 49.646 -3.399 3.039
72 2HB SER 12 HB1 SER 12 50.722 -3.919 1.745
73 HG SER 12 HG SER 12 50.940 -1.800 3.537
74 H ALA 13 HN ALA 13 46.980 -1.849 1.820
75 HA ALA 13 HA ALA 13 46.792 0.937 1.974
76 1HB ALA 13 HB1 ALA 13 44.760 -0.094 2.273
77 2HB ALA 13 HB2 ALA 13 45.153 0.100 3.982
78 3HB ALA 13 HB3 ALA 13 45.467 -1.436 3.174
79 H ASN 14 HN ASN 14 48.418 -1.262 4.127
80 HA ASN 14 HA ASN 14 48.557 0.583 6.393
81 1HB ASN 14 HB2 ASN 14 48.527 -1.924 6.496
82 2HB ASN 14 HB1 ASN 14 50.115 -1.938 5.730
83 1HD2 ASN 14 HD2 ASN 14 49.742 -3.024 8.344
84 2HD2 ASN 14 HD2 ASN 14 50.561 -2.041 9.459
85 H SER 15 HN SER 15 50.206 0.304 3.408
86 HA SER 15 HA SER 15 52.825 1.209 4.336
87 1HB SER 15 HB2 SER 15 52.513 -0.171 2.329
88 2HB SER 15 HB1 SER 15 51.500 1.073 1.607
89 HG SER 15 HG SER 15 54.153 1.547 2.474
90 H LYS 16 HN LYS 16 53.527 3.298 2.759
91 HA LYS 16 HA LYS 16 51.545 5.452 3.433
92 1HB LYS 16 HB2 LYS 16 53.847 5.167 4.666
93 2HB LYS 16 HB1 LYS 16 54.518 5.864 3.191
94 1HG LYS 16 HG2 LYS 16 53.744 7.933 3.689
95 2HG LYS 16 HG1 LYS 16 52.165 7.311 4.169
96 1HD LYS 16 HD2 LYS 16 53.777 6.387 6.197
97 2HD LYS 16 HD1 LYS 16 54.508 7.950 5.829
98 1HE LYS 16 HE2 LYS 16 51.990 8.786 5.838
99 2HE LYS 16 HE1 LYS 16 51.752 7.350 6.855
100 1HZ LYS 16 HZ1 LYS 16 52.640 9.666 7.815
101 2HZ LYS 16 HZ2 LYS 16 54.122 8.942 7.409
102 3HZ LYS 16 HZ3 LYS 16 53.061 8.165 8.485
103 H CYS 17 HN CYS 17 51.714 7.370 1.924
104 HA CYS 17 HA CYS 17 52.754 6.600 -0.779
105 1HB CYS 17 HB2 CYS 17 50.020 7.397 0.150
106 2HB CYS 17 HB1 CYS 17 50.526 7.851 -1.477
107 H GLU 18 HN GLU 18 51.931 9.169 1.506
108 HA GLU 18 HA GLU 18 52.213 11.504 0.061
109 1HB GLU 18 HB2 GLU 18 51.873 11.237 2.526
110 2HB GLU 18 HB1 GLU 18 53.587 10.844 2.685
111 1HG GLU 18 HG2 GLU 18 53.620 13.133 3.110
112 2HG GLU 18 HG1 GLU 18 53.915 13.109 1.371
113 H LYS 19 HN LYS 19 53.724 12.059 -1.458
114 HA LYS 19 HA LYS 19 55.797 12.229 -2.579
115 1HB LYS 19 HB2 LYS 19 56.008 12.975 0.116
116 2HB LYS 19 HB1 LYS 19 57.417 11.954 -0.175
117 1HG LYS 19 HG2 LYS 19 57.106 13.641 -2.449
118 2HG LYS 19 HG1 LYS 19 56.988 14.663 -1.017
119 1HD LYS 19 HD2 LYS 19 59.215 14.543 -0.754
120 2HD LYS 19 HD1 LYS 19 59.095 12.792 -0.573
121 1HE LYS 19 HE2 LYS 19 58.844 12.977 -3.269
122 2HE LYS 19 HE1 LYS 19 59.872 14.390 -2.958
123 1HZ LYS 19 HZ1 LYS 19 60.813 11.892 -3.115
124 2HZ LYS 19 HZ2 LYS 19 60.532 12.005 -1.443
125 3HZ LYS 19 HZ3 LYS 19 61.556 13.121 -2.213
126 H SER 20 HN SER 20 56.271 10.384 -3.766
127 HA SER 20 HA SER 20 58.179 8.472 -2.816
128 1HB SER 20 HB2 SER 20 56.452 6.544 -2.739
129 2HB SER 20 HB1 SER 20 56.502 7.646 -1.366
130 HG SER 20 HG SER 20 54.372 7.178 -2.338
131 H THR 21 HN THR 21 58.870 7.123 -4.504
132 HA THR 21 HA THR 21 57.283 7.109 -7.037
133 HB THR 21 HB THR 21 59.907 7.377 -7.860
134 HG1 THR 21 HG1 THR 21 60.974 8.467 -6.426
135 1HG2 THR 21 HG21 THR 21 59.246 9.770 -8.303
136 2HG2 THR 21 HG22 THR 21 57.787 9.481 -7.356
137 3HG2 THR 21 HG23 THR 21 58.064 8.582 -8.849
138 H LEU 22 HN LEU 22 56.869 4.851 -6.365
139 HA LEU 22 HA LEU 22 59.243 3.045 -6.352
140 1HB LEU 22 HB2 LEU 22 56.316 2.503 -5.781
141 2HB LEU 22 HB1 LEU 22 57.675 1.476 -5.349
142 HG LEU 22 HG LEU 22 57.093 4.242 -4.260
143 1HD1 LEU 22 HD1 LEU 22 56.774 3.032 -2.147
144 2HD1 LEU 22 HD1 LEU 22 57.157 1.507 -2.952
145 3HD1 LEU 22 HD1 LEU 22 55.691 2.389 -3.383
146 1HD2 LEU 22 HD2 LEU 22 59.586 3.451 -4.621
147 2HD2 LEU 22 HD2 LEU 22 59.251 2.413 -3.237
148 3HD2 LEU 22 HD2 LEU 22 59.113 4.163 -3.080
149 H THR 23 HN THR 23 58.399 0.749 -7.286
150 HA THR 23 HA THR 23 56.804 0.912 -9.735
151 HB THR 23 HB THR 23 59.816 0.537 -9.895
152 HG1 THR 23 HG1 THR 23 59.594 2.533 -11.114
153 1HG2 THR 23 HG21 THR 23 59.053 0.919 -12.426
154 2HG2 THR 23 HG22 THR 23 57.552 0.221 -11.814
155 3HG2 THR 23 HG23 THR 23 59.059 -0.688 -11.698
156 H ASN 24 HN ASN 24 55.858 -1.089 -9.849
157 HA ASN 24 HA ASN 24 55.478 -3.383 -9.427
158 1HB ASN 24 HB2 ASN 24 58.425 -3.172 -10.100
159 2HB ASN 24 HB1 ASN 24 57.658 -4.730 -9.796
160 1HD2 ASN 24 HD2 ASN 24 58.105 -2.254 -12.176
161 2HD2 ASN 24 HD2 ASN 24 57.057 -2.898 -13.346
162 H CYS 25 HN CYS 25 55.204 -2.347 -7.110
163 HA CYS 25 HA CYS 25 57.175 -3.674 -5.274
164 1HB CYS 25 HB2 CYS 25 56.650 -0.983 -5.597
165 2HB CYS 25 HB1 CYS 25 55.613 -1.389 -4.240
166 H TYR 26 HN TYR 26 56.157 -4.081 -3.089
167 HA TYR 26 HA TYR 26 53.238 -4.551 -3.099
168 1HB TYR 26 HB2 TYR 26 54.262 -6.575 -4.071
169 2HB TYR 26 HB1 TYR 26 55.379 -6.679 -2.715
170 HD1 TYR 26 HD1 TYR 26 52.181 -5.486 -1.658
171 HD2 TYR 26 HD2 TYR 26 54.324 -9.074 -2.657
172 HE1 TYR 26 HE1 TYR 26 50.514 -6.835 -0.408
173 HE2 TYR 26 HE2 TYR 26 52.661 -10.417 -1.405
174 HH TYR 26 HH TYR 26 50.042 -8.871 0.421
175 H VAL 27 HN VAL 27 55.061 -2.766 -1.871
176 HA VAL 27 HA VAL 27 56.191 -3.001 0.536
177 HB VAL 27 HB VAL 27 53.884 -1.095 0.112
178 1HG1 VAL 27 HG11 VAL 27 56.047 -1.330 2.016
179 2HG1 VAL 27 HG12 VAL 27 54.718 -0.169 1.986
180 3HG1 VAL 27 HG13 VAL 27 56.207 0.173 1.104
181 1HG2 VAL 27 HG21 VAL 27 56.533 -1.313 -1.280
182 2HG2 VAL 27 HG22 VAL 27 55.886 0.292 -0.941
183 3HG2 VAL 27 HG23 VAL 27 54.963 -0.840 -1.938
184 H ASP 28 HN ASP 28 55.640 -3.317 2.692
185 HA ASP 28 HA ASP 28 52.834 -3.903 3.437
186 1HB ASP 28 HB2 ASP 28 54.656 -5.891 2.632
187 2HB ASP 28 HB1 ASP 28 54.633 -5.983 4.390
188 H LYS 29 HN LYS 29 52.562 -2.848 5.373
189 HA LYS 29 HA LYS 29 53.141 -1.725 7.376
190 1HB LYS 29 HB2 LYS 29 54.716 -4.306 7.365
191 2HB LYS 29 HB1 LYS 29 54.750 -3.217 8.752
192 1HG LYS 29 HG2 LYS 29 52.059 -3.830 7.675
193 2HG LYS 29 HG1 LYS 29 52.897 -5.180 8.439
194 1HD LYS 29 HD2 LYS 29 52.615 -2.460 9.740
195 2HD LYS 29 HD1 LYS 29 51.475 -3.778 10.007
196 1HE LYS 29 HE2 LYS 29 53.572 -5.192 10.623
197 2HE LYS 29 HE1 LYS 29 54.383 -3.623 10.803
198 1HZ LYS 29 HZ1 LYS 29 52.890 -4.743 12.722
199 2HZ LYS 29 HZ2 LYS 29 51.722 -3.788 11.940
200 3HZ LYS 29 HZ3 LYS 29 53.128 -3.071 12.568
201 H SER 30 HN SER 30 54.350 -0.425 5.358
202 HA SER 30 HA SER 30 57.069 0.171 6.435
203 1HB SER 30 HB2 SER 30 56.411 -0.225 3.504
204 2HB SER 30 HB1 SER 30 58.000 0.044 4.195
205 HG SER 30 HG SER 30 56.308 -2.208 4.417
206 H GLU 31 HN GLU 31 57.886 2.269 5.346
207 HA GLU 31 HA GLU 31 55.547 4.116 4.976
208 1HB GLU 31 HB2 GLU 31 57.638 4.080 6.834
209 2HB GLU 31 HB1 GLU 31 58.088 5.345 5.690
210 1HG GLU 31 HG2 GLU 31 56.155 6.598 6.112
211 2HG GLU 31 HG1 GLU 31 55.275 5.206 6.744
212 H VAL 32 HN VAL 32 59.046 4.294 4.254
213 HA VAL 32 HA VAL 32 60.157 4.774 2.220
214 HB VAL 32 HB VAL 32 57.491 4.284 0.889
215 1HG1 VAL 32 HG11 VAL 32 59.450 5.001 -0.476
216 2HG1 VAL 32 HG12 VAL 32 58.910 3.372 -0.884
217 3HG1 VAL 32 HG13 VAL 32 60.344 3.602 0.117
218 1HG2 VAL 32 HG21 VAL 32 58.311 1.835 0.881
219 2HG2 VAL 32 HG22 VAL 32 57.630 2.439 2.390
220 3HG2 VAL 32 HG23 VAL 32 59.379 2.315 2.200
221 H TYR 33 HN TYR 33 60.534 6.694 1.076
222 HA TYR 33 HA TYR 33 58.333 8.725 1.018
223 1HB TYR 33 HB2 TYR 33 61.113 8.882 2.186
224 2HB TYR 33 HB1 TYR 33 60.237 10.339 1.719
225 HD1 TYR 33 HD1 TYR 33 59.995 7.263 3.818
226 HD2 TYR 33 HD2 TYR 33 58.551 11.245 3.102
227 HE1 TYR 33 HE1 TYR 33 58.704 7.176 5.935
228 HE2 TYR 33 HE2 TYR 33 57.262 11.158 5.218
229 HH TYR 33 HH TYR 33 56.867 9.998 7.083
230 H GLY 34 HN GLY 34 61.737 8.166 0.001
231 1HA GLY 34 HA2 GLY 34 60.962 9.209 -2.693
232 2HA GLY 34 HA1 GLY 34 62.469 9.709 -1.924
233 H THR 35 HN THR 35 61.483 6.456 -1.361
234 HA THR 35 HA THR 35 63.877 5.392 -2.575
235 HB THR 35 HB THR 35 61.387 4.371 -1.251
236 HG1 THR 35 HG1 THR 35 63.343 5.033 -0.155
237 1HG2 THR 35 HG21 THR 35 63.333 2.688 -2.847
238 2HG2 THR 35 HG22 THR 35 61.578 2.753 -3.014
239 3HG2 THR 35 HG23 THR 35 62.302 2.022 -1.581
240 H THR 36 HN THR 36 63.998 4.002 -4.431
241 HA THR 36 HA THR 36 61.833 4.476 -6.446
242 HB THR 36 HB THR 36 64.645 3.623 -7.080
243 HG1 THR 36 HG1 THR 36 65.425 5.402 -6.321
244 1HG2 THR 36 HG21 THR 36 63.960 5.600 -8.809
245 2HG2 THR 36 HG22 THR 36 62.364 4.962 -8.414
246 3HG2 THR 36 HG23 THR 36 63.597 3.898 -9.088
247 H CYS 37 HN CYS 37 61.131 2.452 -4.855
248 HA CYS 37 HA CYS 37 62.057 -0.106 -4.881
249 1HB CYS 37 HB2 CYS 37 59.869 0.628 -3.991
250 2HB CYS 37 HB1 CYS 37 59.251 0.767 -5.627
251 H THR 38 HN THR 38 62.444 -1.731 -6.355
252 HA THR 38 HA THR 38 61.462 -1.380 -9.154
253 HB THR 38 HB THR 38 64.295 -2.019 -8.261
254 HG1 THR 38 HG1 THR 38 63.043 0.250 -9.384
255 1HG2 THR 38 HG21 THR 38 64.190 -3.145 -10.265
256 2HG2 THR 38 HG22 THR 38 64.519 -1.525 -10.881
257 3HG2 THR 38 HG23 THR 38 62.868 -2.147 -10.875
258 H GLY 39 HN GLY 39 59.961 -3.071 -8.151
259 1HA GLY 39 HA2 GLY 39 59.283 -5.324 -8.288
260 2HA GLY 39 HA1 GLY 39 60.884 -5.726 -8.904
261 H SER 40 HN SER 40 59.592 -4.404 -5.824
262 HA SER 40 HA SER 40 60.867 -6.666 -4.367
263 1HB SER 40 HB2 SER 40 61.344 -3.853 -3.430
264 2HB SER 40 HB1 SER 40 62.320 -5.294 -3.160
265 HG SER 40 HG SER 40 62.844 -3.516 -4.883
266 H ARG 41 HN ARG 41 60.333 -6.259 -1.866
267 HA ARG 41 HA ARG 41 57.723 -4.894 -1.486
268 1HB ARG 41 HB2 ARG 41 57.184 -7.126 -2.343
269 2HB ARG 41 HB1 ARG 41 58.228 -7.866 -1.129
270 1HG ARG 41 HG2 ARG 41 56.537 -6.244 0.368
271 2HG ARG 41 HG1 ARG 41 55.479 -6.912 -0.875
272 1HD ARG 41 HD2 ARG 41 56.378 -9.203 -0.320
273 2HD ARG 41 HD1 ARG 41 57.230 -8.468 1.053
274 HE ARG 41 HE ARG 41 54.546 -7.576 1.165
275 1HH1 ARG 41 HH2 ARG 41 56.482 -9.484 2.913
276 2HH1 ARG 41 HH2 ARG 41 55.320 -10.707 3.303
277 1HH2 ARG 41 HH1 ARG 41 52.977 -9.597 1.002
278 2HH2 ARG 41 HH1 ARG 41 53.340 -10.775 2.220
279 H PHE 42 HN PHE 42 57.259 -4.543 0.789
280 HA PHE 42 HA PHE 42 59.607 -5.050 2.593
281 1HB PHE 42 HB2 PHE 42 57.498 -2.884 2.793
282 2HB PHE 42 HB1 PHE 42 59.037 -2.958 3.652
283 HD1 PHE 42 HD1 PHE 42 57.852 -0.772 1.699
284 HD2 PHE 42 HD2 PHE 42 60.682 -3.972 1.252
285 HE1 PHE 42 HE1 PHE 42 58.958 0.462 -0.144
286 HE2 PHE 42 HE2 PHE 42 61.788 -2.732 -0.591
287 HZ PHE 42 HZ PHE 42 60.925 -0.512 -1.280
288 H ASP 43 HN ASP 43 58.666 -4.713 5.020
289 HA ASP 43 HA ASP 43 56.011 -5.751 5.534
290 1HB ASP 43 HB2 ASP 43 57.750 -7.636 4.651
291 2HB ASP 43 HB1 ASP 43 58.084 -7.702 6.383
292 H GLY 44 HN GLY 44 57.225 -3.521 6.548
293 1HA GLY 44 HA2 GLY 44 56.907 -2.913 8.965
294 2HA GLY 44 HA1 GLY 44 57.880 -4.330 9.351
295 H VAL 45 HN VAL 45 58.209 -1.429 7.222
296 HA VAL 45 HA VAL 45 60.883 -0.997 8.497
297 HB VAL 45 HB VAL 45 62.015 -1.119 6.453
298 1HG1 VAL 45 HG11 VAL 45 61.127 -3.330 7.022
299 2HG1 VAL 45 HG12 VAL 45 61.229 -3.125 5.273
300 3HG1 VAL 45 HG13 VAL 45 59.670 -2.990 6.089
301 1HG2 VAL 45 HG21 VAL 45 60.606 -1.130 4.254
302 2HG2 VAL 45 HG22 VAL 45 60.910 0.405 5.069
303 3HG2 VAL 45 HG23 VAL 45 59.358 -0.405 5.264
304 H THR 46 HN THR 46 61.756 1.129 7.063
305 HA THR 46 HA THR 46 59.632 3.116 6.658
306 HB THR 46 HB THR 46 61.560 3.240 9.000
307 HG1 THR 46 HG1 THR 46 59.209 3.498 9.894
308 1HG2 THR 46 HG21 THR 46 59.789 5.268 9.373
309 2HG2 THR 46 HG22 THR 46 59.915 5.269 7.613
310 3HG2 THR 46 HG23 THR 46 61.362 5.475 8.600
311 H ILE 47 HN ILE 47 61.455 2.321 4.785
312 HA ILE 47 HA ILE 47 63.929 3.844 4.839
313 HB ILE 47 HB ILE 47 63.479 1.713 3.585
314 1HG1 ILE 47 HG12 ILE 47 64.231 4.022 1.765
315 2HG1 ILE 47 HG11 ILE 47 65.321 3.315 2.958
316 1HG2 ILE 47 HG21 ILE 47 61.525 1.648 2.447
317 2HG2 ILE 47 HG22 ILE 47 62.337 2.619 1.217
318 3HG2 ILE 47 HG23 ILE 47 61.375 3.405 2.467
319 1HD1 ILE 47 HD1 ILE 47 65.628 1.396 1.744
320 2HD1 ILE 47 HD1 ILE 47 65.206 2.456 0.400
321 3HD1 ILE 47 HD1 ILE 47 63.981 1.409 1.115
322 H THR 48 HN THR 48 64.351 5.511 3.033
323 HA THR 48 HA THR 48 61.923 7.156 2.426
324 HB THR 48 HB THR 48 63.208 9.149 3.174
325 HG1 THR 48 HG1 THR 48 65.240 8.972 3.689
326 1HG2 THR 48 HG21 THR 48 63.371 8.452 5.648
327 2HG2 THR 48 HG22 THR 48 62.817 6.869 5.104
328 3HG2 THR 48 HG23 THR 48 61.802 8.290 4.860
329 H THR 49 HN THR 49 64.011 9.243 1.521
330 HA THR 49 HA THR 49 64.101 8.622 -1.247
331 HB THR 49 HB THR 49 65.810 10.387 0.533
332 HG1 THR 49 HG1 THR 49 63.710 11.044 -1.247
333 1HG2 THR 49 HG21 THR 49 67.109 10.138 -1.416
334 2HG2 THR 49 HG22 THR 49 66.177 11.604 -1.719
335 3HG2 THR 49 HG23 THR 49 65.689 10.081 -2.462
336 H SER 50 HN SER 50 64.885 6.303 -1.128
337 HA SER 50 HA SER 50 67.872 6.241 -1.162
338 1HB SER 50 HB2 SER 50 67.203 5.513 1.042
339 2HB SER 50 HB1 SER 50 65.954 4.467 0.375
340 HG SER 50 HG SER 50 67.415 2.996 0.035
341 H THR 51 HN THR 51 68.689 4.899 -2.779
342 HA THR 51 HA THR 51 66.780 3.838 -4.735
343 HB THR 51 HB THR 51 69.529 3.154 -5.219
344 HG1 THR 51 HG1 THR 51 69.601 5.839 -5.025
345 1HG2 THR 51 HG21 THR 51 68.448 3.668 -7.161
346 2HG2 THR 51 HG22 THR 51 69.024 5.297 -6.809
347 3HG2 THR 51 HG23 THR 51 67.380 4.831 -6.374
348 H SER 52 HN SER 52 66.173 1.701 -4.856
349 HA SER 52 HA SER 52 67.896 -0.408 -3.677
350 1HB SER 52 HB2 SER 52 66.649 0.097 -1.752
351 2HB SER 52 HB1 SER 52 65.216 0.528 -2.678
352 HG SER 52 HG SER 52 66.315 -2.080 -2.393
353 H THR 53 HN THR 53 67.821 -2.161 -5.058
354 HA THR 53 HA THR 53 65.349 -2.480 -6.737
355 HB THR 53 HB THR 53 66.967 -3.218 -8.532
356 HG1 THR 53 HG1 THR 53 68.772 -3.711 -7.425
357 1HG2 THR 53 HG21 THR 53 66.438 -1.089 -9.092
358 2HG2 THR 53 HG22 THR 53 68.033 -0.680 -8.459
359 3HG2 THR 53 HG23 THR 53 66.608 -0.519 -7.433
360 H GLY 54 HN GLY 54 64.411 -4.327 -5.945
361 1HA GLY 54 HA2 GLY 54 64.178 -6.613 -5.445
362 2HA GLY 54 HA1 GLY 54 65.773 -6.861 -6.161
363 H SER 55 HN SER 55 64.100 -5.928 -3.186
364 HA SER 55 HA SER 55 66.275 -7.103 -1.589
365 1HB SER 55 HB2 SER 55 66.687 -4.917 -0.427
366 2HB SER 55 HB1 SER 55 67.155 -4.892 -2.125
367 HG SER 55 HG SER 55 64.528 -4.197 -1.493
368 H ARG 56 HN ARG 56 65.295 -8.039 0.154
369 HA ARG 56 HA ARG 56 62.498 -7.379 0.822
370 1HB ARG 56 HB2 ARG 56 64.113 -9.631 0.815
371 2HB ARG 56 HB1 ARG 56 64.014 -9.235 2.530
372 1HG ARG 56 HG2 ARG 56 61.786 -9.722 2.651
373 2HG ARG 56 HG1 ARG 56 61.457 -9.086 1.038
374 1HD ARG 56 HD2 ARG 56 61.266 -11.291 0.445
375 2HD ARG 56 HD1 ARG 56 63.041 -11.288 0.485
376 HE ARG 56 HE ARG 56 62.014 -11.633 3.145
377 1HH1 ARG 56 HH2 ARG 56 63.831 -13.156 0.875
378 2HH1 ARG 56 HH2 ARG 56 63.307 -14.769 1.232
379 1HH2 ARG 56 HH1 ARG 56 60.713 -13.757 3.298
380 2HH2 ARG 56 HH1 ARG 56 61.543 -15.109 2.600
381 H ILE 57 HN ILE 57 62.417 -5.413 1.972
382 HA ILE 57 HA ILE 57 64.441 -4.796 4.015
383 HB ILE 57 HB ILE 57 61.853 -3.329 3.483
384 1HG1 ILE 57 HG12 ILE 57 62.752 -3.715 1.279
385 2HG1 ILE 57 HG11 ILE 57 63.185 -2.066 1.730
386 1HG2 ILE 57 HG21 ILE 57 62.836 -1.665 4.661
387 2HG2 ILE 57 HG22 ILE 57 64.361 -1.848 3.792
388 3HG2 ILE 57 HG23 ILE 57 64.006 -2.879 5.178
389 1HD1 ILE 57 HD1 ILE 57 65.143 -3.141 0.780
390 2HD1 ILE 57 HD1 ILE 57 64.969 -4.512 1.876
391 3HD1 ILE 57 HD1 ILE 57 65.407 -2.926 2.511
392 H SER 58 HN SER 58 62.075 -6.980 4.117
393 HA SER 58 HA SER 58 60.205 -6.628 6.071
394 1HB SER 58 HB2 SER 58 62.012 -8.766 5.214
395 2HB SER 58 HB1 SER 58 61.474 -8.967 6.879
396 HG SER 58 HG SER 58 59.629 -8.258 4.884
397 H GLY 59 HN GLY 59 60.136 -6.311 8.335
398 1HA GLY 59 HA2 GLY 59 62.276 -6.741 10.144
399 2HA GLY 59 HA1 GLY 59 62.375 -5.067 9.608
400 HA PRO 60 HA PRO 60 58.893 -5.785 12.785
401 1HB PRO 60 HB2 PRO 60 60.227 -5.819 15.173
402 2HB PRO 60 HB1 PRO 60 59.844 -7.295 14.266
403 1HG PRO 60 HG2 PRO 60 62.412 -5.829 14.498
404 2HG PRO 60 HG1 PRO 60 62.109 -7.566 14.355
405 1HD PRO 60 HD2 PRO 60 62.945 -5.940 12.291
406 2HD PRO 60 HD1 PRO 60 62.126 -7.503 12.084
407 H GLY 61 HN GLY 61 61.576 -3.773 12.270
408 1HA GLY 61 HA2 GLY 61 60.161 -1.363 12.927
409 2HA GLY 61 HA1 GLY 61 61.337 -1.727 14.193
410 H CYS 62 HN CYS 62 61.642 -2.426 10.740
411 HA CYS 62 HA CYS 62 64.328 -1.615 10.497
412 1HB CYS 62 HB2 CYS 62 62.123 -2.473 8.866
413 2HB CYS 62 HB1 CYS 62 62.985 -1.181 8.032
414 H LYS 63 HN LYS 63 65.237 0.256 9.395
415 HA LYS 63 HA LYS 63 63.624 2.684 9.028
416 1HB LYS 63 HB2 LYS 63 63.873 2.710 11.435
417 2HB LYS 63 HB1 LYS 63 65.586 2.310 11.314
418 1HG LYS 63 HG2 LYS 63 65.735 4.520 9.909
419 2HG LYS 63 HG1 LYS 63 64.209 4.913 10.701
420 1HD LYS 63 HD2 LYS 63 65.255 4.563 12.908
421 2HD LYS 63 HD1 LYS 63 66.784 4.168 12.121
422 1HE LYS 63 HE2 LYS 63 67.210 6.365 11.538
423 2HE LYS 63 HE1 LYS 63 65.487 6.768 11.396
424 1HZ LYS 63 HZ1 LYS 63 66.646 7.648 13.442
425 2HZ LYS 63 HZ2 LYS 63 66.752 6.038 13.978
426 3HZ LYS 63 HZ3 LYS 63 65.232 6.755 13.725
427 H ILE 64 HN ILE 64 64.548 2.837 6.938
428 HA ILE 64 HA ILE 64 67.540 3.091 6.819
429 HB ILE 64 HB ILE 64 65.538 2.320 4.673
430 1HG1 ILE 64 HG12 ILE 64 67.487 0.383 5.850
431 2HG1 ILE 64 HG11 ILE 64 66.049 0.774 6.796
432 1HG2 ILE 64 HG21 ILE 64 67.562 3.264 3.729
433 2HG2 ILE 64 HG22 ILE 64 67.609 1.515 3.508
434 3HG2 ILE 64 HG23 ILE 64 68.567 2.270 4.781
435 1HD1 ILE 64 HD1 ILE 64 66.248 -1.001 4.580
436 2HD1 ILE 64 HD1 ILE 64 65.269 0.373 4.067
437 3HD1 ILE 64 HD1 ILE 64 64.802 -0.561 5.488
438 H SER 65 HN SER 65 68.315 4.644 5.145
439 HA SER 65 HA SER 65 66.351 6.729 4.339
440 1HB SER 65 HB2 SER 65 67.224 8.326 5.714
441 2HB SER 65 HB1 SER 65 67.828 6.956 6.641
442 HG SER 65 HG SER 65 69.629 8.067 6.220
443 H THR 66 HN THR 66 68.192 8.574 3.393
444 HA THR 66 HA THR 66 68.774 8.038 0.822
445 HB THR 66 HB THR 66 70.876 9.264 2.594
446 HG1 THR 66 HG1 THR 66 69.558 10.917 2.969
447 1HG2 THR 66 HG21 THR 66 70.449 10.960 0.529
448 2HG2 THR 66 HG22 THR 66 70.000 9.437 -0.238
449 3HG2 THR 66 HG23 THR 66 71.609 9.635 0.456
450 H CYS 67 HN CYS 67 69.204 5.714 0.594
451 HA CYS 67 HA CYS 67 72.125 5.104 0.818
452 1HB CYS 67 HB2 CYS 67 70.973 4.034 2.720
453 2HB CYS 67 HB1 CYS 67 69.794 3.325 1.623
454 H ILE 68 HN ILE 68 72.879 4.031 -1.040
455 HA ILE 68 HA ILE 68 70.869 3.596 -3.196
456 HB ILE 68 HB ILE 68 73.886 3.864 -3.081
457 1HG1 ILE 68 HG12 ILE 68 73.439 5.837 -4.492
458 2HG1 ILE 68 HG11 ILE 68 71.717 5.460 -4.491
459 1HG2 ILE 68 HG21 ILE 68 73.965 2.568 -4.934
460 2HG2 ILE 68 HG22 ILE 68 73.099 3.864 -5.761
461 3HG2 ILE 68 HG23 ILE 68 72.205 2.518 -5.050
462 1HD1 ILE 68 HD1 ILE 68 71.429 6.118 -2.294
463 2HD1 ILE 68 HD1 ILE 68 72.737 7.206 -2.762
464 3HD1 ILE 68 HD1 ILE 68 73.093 5.738 -1.852
465 H ILE 69 HN ILE 69 70.064 1.629 -2.174
466 HA ILE 69 HA ILE 69 71.912 -0.649 -1.908
467 HB ILE 69 HB ILE 69 68.905 -0.512 -1.543
468 1HG1 ILE 69 HG12 ILE 69 70.930 -0.020 0.654
469 2HG1 ILE 69 HG11 ILE 69 70.307 1.313 -0.315
470 1HG2 ILE 69 HG21 ILE 69 70.303 -2.716 -1.504
471 2HG2 ILE 69 HG22 ILE 69 69.158 -2.417 -0.196
472 3HG2 ILE 69 HG23 ILE 69 70.880 -2.129 0.056
473 1HD1 ILE 69 HD1 ILE 69 68.468 1.367 0.965
474 2HD1 ILE 69 HD1 ILE 69 69.052 -0.016 1.892
475 3HD1 ILE 69 HD1 ILE 69 68.076 -0.273 0.446
476 H THR 70 HN THR 70 71.591 -2.640 -3.117
477 HA THR 70 HA THR 70 69.700 -2.699 -5.370
478 HB THR 70 HB THR 70 72.695 -2.394 -5.731
479 HG1 THR 70 HG1 THR 70 71.237 -0.741 -7.193
480 1HG2 THR 70 HG21 THR 70 71.150 -4.017 -7.241
481 2HG2 THR 70 HG22 THR 70 72.506 -3.095 -7.897
482 3HG2 THR 70 HG23 THR 70 70.860 -2.481 -8.062
483 H GLY 71 HN GLY 71 69.041 -4.777 -4.638
484 1HA GLY 71 HA2 GLY 71 69.274 -7.156 -5.000
485 2HA GLY 71 HA1 GLY 71 71.023 -6.930 -5.119
486 H GLY 72 HN GLY 72 68.869 -5.675 -2.622
487 1HA GLY 72 HA2 GLY 72 68.825 -6.051 -0.309
488 2HA GLY 72 HA1 GLY 72 69.488 -7.654 -0.631
489 H VAL 73 HN VAL 73 71.158 -4.868 -1.848
490 HA VAL 73 HA VAL 73 73.231 -5.169 0.311
491 HB VAL 73 HB VAL 73 74.886 -5.077 -1.458
492 1HG1 VAL 73 HG11 VAL 73 73.074 -6.855 -2.913
493 2HG1 VAL 73 HG12 VAL 73 73.028 -7.131 -1.172
494 3HG1 VAL 73 HG13 VAL 73 74.559 -7.240 -2.042
495 1HG2 VAL 73 HG21 VAL 73 73.868 -5.024 -3.881
496 2HG2 VAL 73 HG22 VAL 73 74.076 -3.509 -3.002
497 3HG2 VAL 73 HG23 VAL 73 72.484 -4.268 -3.087
498 HA PRO 74 HA PRO 74 72.701 -0.729 0.293
499 1HB PRO 74 HB2 PRO 74 74.278 -0.246 2.473
500 2HB PRO 74 HB1 PRO 74 72.624 -0.864 2.606
501 1HG PRO 74 HG2 PRO 74 75.188 -2.256 2.975
502 2HG PRO 74 HG1 PRO 74 73.598 -2.617 3.656
503 1HD PRO 74 HD2 PRO 74 74.852 -3.932 1.496
504 2HD PRO 74 HD1 PRO 74 73.171 -4.130 2.034
505 H ALA 75 HN ALA 75 73.913 0.750 -0.882
506 HA ALA 75 HA ALA 75 76.629 0.058 -1.726
507 1HB ALA 75 HB1 ALA 75 75.090 1.097 -3.277
508 2HB ALA 75 HB2 ALA 75 76.359 2.272 -2.933
509 3HB ALA 75 HB3 ALA 75 74.782 2.425 -2.158
510 HA PRO 76 HA PRO 76 78.803 2.247 1.406
511 1HB PRO 76 HB2 PRO 76 81.061 2.925 0.013
512 2HB PRO 76 HB1 PRO 76 80.726 1.271 0.566
513 1HG PRO 76 HG2 PRO 76 80.341 2.476 -2.135
514 2HG PRO 76 HG1 PRO 76 80.956 0.875 -1.692
515 1HD PRO 76 HD2 PRO 76 78.422 1.286 -2.559
516 2HD PRO 76 HD1 PRO 76 78.852 -0.003 -1.413
517 H SER 77 HN SER 77 76.848 3.913 0.605
518 HA SER 77 HA SER 77 77.980 6.355 -0.621
519 1HB SER 77 HB2 SER 77 75.815 6.101 -1.347
520 2HB SER 77 HB1 SER 77 75.333 5.211 0.095
521 HG SER 77 HG SER 77 74.448 7.380 -0.112
522 H ALA 78 HN ALA 78 78.121 8.363 0.511
523 HA ALA 78 HA ALA 78 78.896 8.224 3.281
524 1HB ALA 78 HB1 ALA 78 79.424 10.477 2.942
525 2HB ALA 78 HB2 ALA 78 78.023 10.749 1.906
526 3HB ALA 78 HB3 ALA 78 79.425 9.879 1.284
527 H ALA 79 HN ALA 79 75.822 8.340 1.791
528 HA ALA 79 HA ALA 79 74.574 9.488 4.261
529 1HB ALA 79 HB1 ALA 79 74.287 9.981 1.482
530 2HB ALA 79 HB2 ALA 79 73.349 10.686 2.797
531 3HB ALA 79 HB3 ALA 79 72.792 9.208 2.013
532 H CYS 80 HN CYS 80 74.548 6.713 2.042
533 HA CYS 80 HA CYS 80 72.245 5.336 2.734
534 1HB CYS 80 HB2 CYS 80 73.823 4.464 1.144
535 2HB CYS 80 HB1 CYS 80 75.094 4.391 2.362
536 H LYS 81 HN LYS 81 71.460 4.308 4.583
537 HA LYS 81 HA LYS 81 73.207 4.461 7.010
538 1HB LYS 81 HB2 LYS 81 71.224 4.854 8.222
539 2HB LYS 81 HB1 LYS 81 70.958 5.720 6.710
540 1HG LYS 81 HG2 LYS 81 68.962 4.547 6.888
541 2HG LYS 81 HG1 LYS 81 69.921 3.413 5.936
542 1HD LYS 81 HD2 LYS 81 70.592 2.773 8.555
543 2HD LYS 81 HD1 LYS 81 68.871 3.135 8.653
544 1HE LYS 81 HE2 LYS 81 68.698 1.627 6.504
545 2HE LYS 81 HE1 LYS 81 70.253 0.991 7.058
546 1HZ LYS 81 HZ1 LYS 81 67.680 0.512 8.123
547 2HZ LYS 81 HZ2 LYS 81 68.647 1.252 9.307
548 3HZ LYS 81 HZ3 LYS 81 69.157 -0.189 8.566
549 H ILE 82 HN ILE 82 72.842 2.743 8.633
550 HA ILE 82 HA ILE 82 71.679 0.183 7.809
551 HB ILE 82 HB ILE 82 74.624 0.790 7.728
552 1HG1 ILE 82 HG12 ILE 82 73.960 -1.235 5.942
553 2HG1 ILE 82 HG11 ILE 82 72.519 -0.219 5.964
554 1HG2 ILE 82 HG21 ILE 82 74.761 -1.867 7.687
555 2HG2 ILE 82 HG22 ILE 82 73.335 -1.729 8.715
556 3HG2 ILE 82 HG23 ILE 82 74.854 -0.982 9.210
557 1HD1 ILE 82 HD1 ILE 82 74.196 1.762 5.729
558 2HD1 ILE 82 HD1 ILE 82 73.840 0.787 4.305
559 3HD1 ILE 82 HD1 ILE 82 75.336 0.524 5.201
560 H SER 83 HN SER 83 70.604 1.011 9.872
561 HA SER 83 HA SER 83 72.282 0.451 12.285
562 1HB SER 83 HB2 SER 83 70.065 2.320 11.593
563 2HB SER 83 HB1 SER 83 70.117 1.721 13.249
564 HG SER 83 HG SER 83 72.401 2.754 11.938
565 H GLY 84 HN GLY 84 68.764 0.545 12.173
566 1HA GLY 84 HA2 GLY 84 68.752 -2.280 13.124
567 2HA GLY 84 HA1 GLY 84 67.482 -1.103 13.456
568 H CYS 85 HN CYS 85 69.067 -2.626 10.620
569 HA CYS 85 HA CYS 85 66.462 -3.461 9.592
570 1HB CYS 85 HB2 CYS 85 66.908 -0.915 9.131
571 2HB CYS 85 HB1 CYS 85 68.014 -1.511 7.899
572 H THR 86 HN THR 86 66.959 -4.148 7.072
573 HA THR 86 HA THR 86 69.602 -5.042 6.402
574 HB THR 86 HB THR 86 69.353 -6.414 8.392
575 HG1 THR 86 HG1 THR 86 68.919 -7.815 5.975
576 1HG2 THR 86 HG21 THR 86 66.849 -6.265 8.447
577 2HG2 THR 86 HG22 THR 86 67.461 -7.894 8.731
578 3HG2 THR 86 HG23 THR 86 66.794 -7.466 7.156
579 H PHE 87 HN PHE 87 69.558 -6.432 4.471
580 HA PHE 87 HA PHE 87 66.859 -6.515 3.151
581 1HB PHE 87 HB2 PHE 87 69.391 -6.318 1.567
582 2HB PHE 87 HB1 PHE 87 67.798 -5.663 1.206
583 HD1 PHE 87 HD1 PHE 87 70.791 -4.446 1.388
584 HD2 PHE 87 HD2 PHE 87 67.229 -4.211 3.776
585 HE1 PHE 87 HE1 PHE 87 71.516 -2.247 2.253
586 HE2 PHE 87 HE2 PHE 87 67.960 -2.007 4.648
587 HZ PHE 87 HZ PHE 87 70.106 -1.022 3.885
588 H SER 88 HN SER 88 66.526 -8.310 1.703
589 HA SER 88 HA SER 88 68.529 -10.527 1.898
590 1HB SER 88 HB2 SER 88 65.540 -10.914 2.097
591 2HB SER 88 HB1 SER 88 66.816 -12.035 2.562
592 HG SER 88 HG SER 88 65.880 -10.946 4.359
593 H ALA 89 HN ALA 89 67.883 -8.594 -0.251
594 HA ALA 89 HA ALA 89 67.193 -8.540 -2.526
595 1HB ALA 89 HB1 ALA 89 68.173 -10.720 -3.606
596 2HB ALA 89 HB2 ALA 89 68.727 -11.072 -1.969
597 3HB ALA 89 HB3 ALA 89 69.269 -9.607 -2.788
598 H ASN 90 HN ASN 90 64.835 -8.777 -1.690
599 HA ASN 90 HA ASN 90 63.526 -11.335 -1.757
600 1HB ASN 90 HB2 ASN 90 61.747 -10.056 -1.092
601 2HB ASN 90 HB1 ASN 90 62.953 -8.792 -0.933
602 1HD2 ASN 90 HD2 ASN 90 59.960 -9.280 -2.155
603 2HD2 ASN 90 HD2 ASN 90 59.970 -8.180 -3.449
Start of MODEL 9
1 1H ASP 1 HT1 ASP 1 45.098 6.762 6.200
2 2H ASP 1 HT2 ASP 1 46.712 6.353 6.529
3 3H ASP 1 HT3 ASP 1 45.790 5.395 5.474
4 HA ASP 1 HA ASP 1 46.350 8.250 4.897
5 1HB ASP 1 HB2 ASP 1 48.333 6.551 5.363
6 2HB ASP 1 HB1 ASP 1 47.927 5.968 3.748
7 H GLY 2 HN GLY 2 46.521 8.266 2.336
8 1HA GLY 2 HA2 GLY 2 43.995 7.598 1.257
9 2HA GLY 2 HA1 GLY 2 45.421 7.967 0.289
10 H SER 3 HN SER 3 44.545 6.295 -1.195
11 HA SER 3 HA SER 3 45.239 3.516 -0.283
12 1HB SER 3 HB2 SER 3 42.818 3.921 -0.557
13 2HB SER 3 HB1 SER 3 43.094 4.490 -2.201
14 HG SER 3 HG SER 3 43.429 2.487 -2.846
15 H CYS 4 HN CYS 4 47.243 5.097 -1.448
16 HA CYS 4 HA CYS 4 47.514 5.153 -4.246
17 1HB CYS 4 HB2 CYS 4 49.148 5.294 -1.859
18 2HB CYS 4 HB1 CYS 4 50.014 4.433 -3.133
19 H THR 5 HN THR 5 49.132 3.676 -5.475
20 HA THR 5 HA THR 5 48.796 0.795 -4.739
21 HB THR 5 HB THR 5 47.949 2.306 -7.196
22 HG1 THR 5 HG1 THR 5 46.370 1.655 -5.792
23 1HG2 THR 5 HG21 THR 5 48.900 -0.575 -7.167
24 2HG2 THR 5 HG22 THR 5 49.497 0.733 -8.185
25 3HG2 THR 5 HG23 THR 5 47.874 0.095 -8.434
26 H ASN 6 HN ASN 6 50.924 3.225 -5.278
27 HA ASN 6 HA ASN 6 53.171 3.308 -6.006
28 1HB ASN 6 HB2 ASN 6 53.671 1.793 -4.304
29 2HB ASN 6 HB1 ASN 6 52.575 0.571 -4.943
30 1HD2 ASN 6 HD2 ASN 6 55.370 2.312 -6.425
31 2HD2 ASN 6 HD2 ASN 6 56.193 0.900 -6.882
32 H THR 7 HN THR 7 51.995 3.655 -8.220
33 HA THR 7 HA THR 7 52.062 3.311 -10.550
34 HB THR 7 HB THR 7 54.024 2.316 -11.337
35 HG1 THR 7 HG1 THR 7 54.127 0.281 -10.897
36 1HG2 THR 7 HG21 THR 7 54.305 3.921 -9.252
37 2HG2 THR 7 HG22 THR 7 55.702 3.100 -9.945
38 3HG2 THR 7 HG23 THR 7 54.937 2.461 -8.491
39 H ASN 8 HN ASN 8 52.344 0.088 -8.968
40 HA ASN 8 HA ASN 8 49.714 -0.778 -9.653
41 1HB ASN 8 HB2 ASN 8 51.556 -0.581 -11.816
42 2HB ASN 8 HB1 ASN 8 51.299 -2.296 -11.503
43 1HD2 ASN 8 HD2 ASN 8 50.276 -0.561 -13.764
44 2HD2 ASN 8 HD2 ASN 8 48.591 -0.772 -13.748
45 H SER 9 HN SER 9 50.799 -1.297 -7.348
46 HA SER 9 HA SER 9 51.770 -4.130 -7.498
47 1HB SER 9 HB2 SER 9 52.672 -1.945 -5.594
48 2HB SER 9 HB1 SER 9 53.317 -3.582 -5.681
49 HG SER 9 HG SER 9 53.987 -3.109 -7.816
50 H GLN 10 HN GLN 10 51.773 -3.266 -4.331
51 HA GLN 10 HA GLN 10 48.861 -3.850 -3.956
52 1HB GLN 10 HB2 GLN 10 49.430 -5.547 -2.386
53 2HB GLN 10 HB1 GLN 10 50.571 -5.787 -3.711
54 1HG GLN 10 HG2 GLN 10 52.263 -4.467 -2.486
55 2HG GLN 10 HG1 GLN 10 51.127 -4.240 -1.160
56 1HE2 GLN 10 HE21 GLN 10 50.257 -7.232 -1.974
57 2HE2 GLN 10 HE22 GLN 10 51.385 -8.158 -1.108
58 H LEU 11 HN LEU 11 51.868 -2.618 -2.491
59 HA LEU 11 HA LEU 11 52.189 -1.107 -0.688
60 1HB LEU 11 HB2 LEU 11 51.408 0.241 -2.664
61 2HB LEU 11 HB1 LEU 11 49.765 0.127 -2.033
62 HG LEU 11 HG LEU 11 50.364 1.308 -0.024
63 1HD1 LEU 11 HD1 LEU 11 52.487 0.466 0.559
64 2HD1 LEU 11 HD1 LEU 11 52.823 2.143 0.127
65 3HD1 LEU 11 HD1 LEU 11 53.171 0.849 -1.022
66 1HD2 LEU 11 HD2 LEU 11 51.531 3.399 -1.090
67 2HD2 LEU 11 HD2 LEU 11 49.938 2.920 -1.675
68 3HD2 LEU 11 HD2 LEU 11 51.380 2.495 -2.597
69 H SER 12 HN SER 12 51.641 -2.303 1.163
70 HA SER 12 HA SER 12 49.284 -3.272 2.149
71 1HB SER 12 HB2 SER 12 50.611 -3.449 3.970
72 2HB SER 12 HB1 SER 12 51.794 -2.449 3.134
73 HG SER 12 HG SER 12 50.919 -1.719 5.272
74 H ALA 13 HN ALA 13 47.467 -2.439 3.292
75 HA ALA 13 HA ALA 13 46.399 0.054 2.407
76 1HB ALA 13 HB1 ALA 13 45.761 -1.730 4.780
77 2HB ALA 13 HB2 ALA 13 45.056 -1.841 3.168
78 3HB ALA 13 HB3 ALA 13 44.705 -0.447 4.189
79 H ASN 14 HN ASN 14 48.459 -0.762 5.123
80 HA ASN 14 HA ASN 14 48.045 1.948 6.305
81 1HB ASN 14 HB2 ASN 14 48.936 0.960 8.303
82 2HB ASN 14 HB1 ASN 14 47.841 -0.235 7.608
83 1HD2 ASN 14 HD2 ASN 14 51.333 0.667 7.573
84 2HD2 ASN 14 HD2 ASN 14 51.890 -0.928 7.410
85 H SER 15 HN SER 15 50.004 0.695 3.987
86 HA SER 15 HA SER 15 52.644 1.468 4.886
87 1HB SER 15 HB2 SER 15 52.277 -0.083 3.038
88 2HB SER 15 HB1 SER 15 51.368 1.135 2.150
89 HG SER 15 HG SER 15 54.111 1.228 2.887
90 H LYS 16 HN LYS 16 53.370 3.159 2.622
91 HA LYS 16 HA LYS 16 51.775 5.637 3.118
92 1HB LYS 16 HB2 LYS 16 54.248 4.973 4.292
93 2HB LYS 16 HB1 LYS 16 54.629 6.148 3.032
94 1HG LYS 16 HG2 LYS 16 53.995 7.726 4.525
95 2HG LYS 16 HG1 LYS 16 52.342 7.202 4.198
96 1HD LYS 16 HD2 LYS 16 53.696 5.442 6.099
97 2HD LYS 16 HD1 LYS 16 53.626 7.110 6.669
98 1HE LYS 16 HE2 LYS 16 51.098 6.907 5.788
99 2HE LYS 16 HE1 LYS 16 51.393 5.196 6.162
100 1HZ LYS 16 HZ1 LYS 16 50.668 6.286 8.152
101 2HZ LYS 16 HZ2 LYS 16 51.827 7.515 7.969
102 3HZ LYS 16 HZ3 LYS 16 52.316 5.926 8.319
103 H CYS 17 HN CYS 17 51.915 7.163 1.383
104 HA CYS 17 HA CYS 17 53.458 6.299 -1.034
105 1HB CYS 17 HB2 CYS 17 51.230 5.499 -1.383
106 2HB CYS 17 HB1 CYS 17 50.521 6.977 -0.731
107 H GLU 18 HN GLU 18 51.086 8.875 -1.037
108 HA GLU 18 HA GLU 18 51.419 11.158 -1.613
109 1HB GLU 18 HB2 GLU 18 53.082 10.641 0.874
110 2HB GLU 18 HB1 GLU 18 52.604 12.250 0.326
111 1HG GLU 18 HG2 GLU 18 50.191 11.106 0.264
112 2HG GLU 18 HG1 GLU 18 50.927 10.063 1.482
113 H LYS 19 HN LYS 19 54.302 12.104 -0.440
114 HA LYS 19 HA LYS 19 55.529 12.420 -3.018
115 1HB LYS 19 HB2 LYS 19 55.864 13.930 -1.107
116 2HB LYS 19 HB1 LYS 19 56.620 12.624 -0.193
117 1HG LYS 19 HG2 LYS 19 58.589 13.297 -1.063
118 2HG LYS 19 HG1 LYS 19 58.021 12.670 -2.610
119 1HD LYS 19 HD2 LYS 19 57.127 14.821 -3.238
120 2HD LYS 19 HD1 LYS 19 57.416 15.471 -1.624
121 1HE LYS 19 HE2 LYS 19 59.765 15.514 -1.930
122 2HE LYS 19 HE1 LYS 19 59.689 14.394 -3.305
123 1HZ LYS 19 HZ1 LYS 19 59.924 16.792 -3.927
124 2HZ LYS 19 HZ2 LYS 19 58.370 17.052 -3.290
125 3HZ LYS 19 HZ3 LYS 19 58.587 16.011 -4.616
126 H SER 20 HN SER 20 56.647 10.895 -4.154
127 HA SER 20 HA SER 20 58.688 9.224 -3.076
128 1HB SER 20 HB2 SER 20 57.313 7.054 -3.235
129 2HB SER 20 HB1 SER 20 56.983 8.089 -1.851
130 HG SER 20 HG SER 20 55.528 7.902 -4.284
131 H THR 21 HN THR 21 59.205 7.378 -4.702
132 HA THR 21 HA THR 21 58.073 7.764 -7.409
133 HB THR 21 HB THR 21 59.727 9.516 -7.345
134 HG1 THR 21 HG1 THR 21 61.379 8.549 -8.748
135 1HG2 THR 21 HG21 THR 21 61.932 9.259 -6.477
136 2HG2 THR 21 HG22 THR 21 61.776 7.503 -6.411
137 3HG2 THR 21 HG23 THR 21 60.866 8.512 -5.286
138 H LEU 22 HN LEU 22 57.533 5.467 -6.693
139 HA LEU 22 HA LEU 22 59.890 3.647 -7.023
140 1HB LEU 22 HB2 LEU 22 58.056 2.049 -5.913
141 2HB LEU 22 HB1 LEU 22 59.055 3.114 -4.933
142 HG LEU 22 HG LEU 22 56.400 4.054 -6.015
143 1HD1 LEU 22 HD1 LEU 22 56.470 3.094 -3.222
144 2HD1 LEU 22 HD1 LEU 22 56.583 1.815 -4.432
145 3HD1 LEU 22 HD1 LEU 22 55.205 2.918 -4.440
146 1HD2 LEU 22 HD2 LEU 22 58.482 5.233 -4.553
147 2HD2 LEU 22 HD2 LEU 22 57.237 4.884 -3.352
148 3HD2 LEU 22 HD2 LEU 22 56.852 5.876 -4.758
149 H THR 23 HN THR 23 58.698 1.306 -7.646
150 HA THR 23 HA THR 23 56.677 1.567 -9.740
151 HB THR 23 HB THR 23 59.627 1.271 -10.324
152 HG1 THR 23 HG1 THR 23 57.739 2.759 -11.770
153 1HG2 THR 23 HG21 THR 23 58.968 0.674 -12.650
154 2HG2 THR 23 HG22 THR 23 57.293 0.532 -12.113
155 3HG2 THR 23 HG23 THR 23 58.520 -0.569 -11.483
156 H ASN 24 HN ASN 24 55.587 -0.348 -9.633
157 HA ASN 24 HA ASN 24 55.145 -2.639 -9.265
158 1HB ASN 24 HB2 ASN 24 58.032 -2.590 -10.175
159 2HB ASN 24 HB1 ASN 24 57.163 -4.095 -9.893
160 1HD2 ASN 24 HD2 ASN 24 56.555 -4.894 -11.904
161 2HD2 ASN 24 HD2 ASN 24 55.865 -3.973 -13.150
162 H CYS 25 HN CYS 25 56.058 -0.976 -6.943
163 HA CYS 25 HA CYS 25 57.949 -2.444 -5.364
164 1HB CYS 25 HB2 CYS 25 56.724 -0.051 -5.143
165 2HB CYS 25 HB1 CYS 25 55.704 -0.971 -4.045
166 H TYR 26 HN TYR 26 56.011 -2.565 -3.020
167 HA TYR 26 HA TYR 26 53.923 -4.409 -3.315
168 1HB TYR 26 HB2 TYR 26 56.613 -5.484 -3.808
169 2HB TYR 26 HB1 TYR 26 55.765 -6.363 -2.539
170 HD1 TYR 26 HD1 TYR 26 52.959 -6.188 -3.387
171 HD2 TYR 26 HD2 TYR 26 56.498 -6.836 -5.729
172 HE1 TYR 26 HE1 TYR 26 51.609 -7.384 -5.087
173 HE2 TYR 26 HE2 TYR 26 55.149 -8.030 -7.433
174 HH TYR 26 HH TYR 26 52.837 -8.169 -8.185
175 H VAL 27 HN VAL 27 54.641 -2.322 -1.639
176 HA VAL 27 HA VAL 27 55.869 -3.069 0.828
177 HB VAL 27 HB VAL 27 53.776 -0.939 0.344
178 1HG1 VAL 27 HG11 VAL 27 54.320 -0.702 2.560
179 2HG1 VAL 27 HG12 VAL 27 55.705 0.159 1.889
180 3HG1 VAL 27 HG13 VAL 27 55.865 -1.529 2.371
181 1HG2 VAL 27 HG21 VAL 27 56.657 -1.153 -0.539
182 2HG2 VAL 27 HG22 VAL 27 55.944 0.422 -0.202
183 3HG2 VAL 27 HG23 VAL 27 55.266 -0.598 -1.472
184 H ASP 28 HN ASP 28 55.031 -3.881 2.705
185 HA ASP 28 HA ASP 28 52.114 -4.603 2.766
186 1HB ASP 28 HB2 ASP 28 54.150 -6.330 2.503
187 2HB ASP 28 HB1 ASP 28 54.199 -6.148 4.257
188 H LYS 29 HN LYS 29 54.729 -3.000 4.278
189 HA LYS 29 HA LYS 29 53.156 -1.834 6.366
190 1HB LYS 29 HB2 LYS 29 54.453 -4.452 6.843
191 2HB LYS 29 HB1 LYS 29 54.807 -3.232 8.064
192 1HG LYS 29 HG2 LYS 29 52.703 -3.265 8.885
193 2HG LYS 29 HG1 LYS 29 51.978 -3.306 7.279
194 1HD LYS 29 HD2 LYS 29 51.450 -5.454 7.782
195 2HD LYS 29 HD1 LYS 29 53.146 -5.791 7.440
196 1HE LYS 29 HE2 LYS 29 52.604 -4.786 10.177
197 2HE LYS 29 HE1 LYS 29 51.973 -6.404 9.818
198 1HZ LYS 29 HZ1 LYS 29 54.230 -6.651 10.497
199 2HZ LYS 29 HZ2 LYS 29 54.755 -5.442 9.431
200 3HZ LYS 29 HZ3 LYS 29 54.176 -6.919 8.824
201 H SER 30 HN SER 30 54.646 -0.353 4.871
202 HA SER 30 HA SER 30 57.107 0.211 6.452
203 1HB SER 30 HB2 SER 30 56.876 -0.524 3.543
204 2HB SER 30 HB1 SER 30 58.239 0.424 4.128
205 HG SER 30 HG SER 30 57.445 -2.196 4.814
206 H GLU 31 HN GLU 31 57.824 2.361 6.267
207 HA GLU 31 HA GLU 31 55.848 4.258 5.048
208 1HB GLU 31 HB2 GLU 31 56.497 4.136 7.575
209 2HB GLU 31 HB1 GLU 31 58.004 4.897 7.066
210 1HG GLU 31 HG2 GLU 31 56.335 6.547 5.809
211 2HG GLU 31 HG1 GLU 31 55.230 6.007 7.074
212 H VAL 32 HN VAL 32 56.677 4.539 2.943
213 HA VAL 32 HA VAL 32 59.595 5.038 2.625
214 HB VAL 32 HB VAL 32 57.397 4.733 0.557
215 1HG1 VAL 32 HG11 VAL 32 59.562 3.798 -0.653
216 2HG1 VAL 32 HG12 VAL 32 60.391 4.824 0.519
217 3HG1 VAL 32 HG13 VAL 32 59.235 5.532 -0.612
218 1HG2 VAL 32 HG21 VAL 32 57.452 2.756 2.019
219 2HG2 VAL 32 HG22 VAL 32 59.200 2.636 1.815
220 3HG2 VAL 32 HG23 VAL 32 58.132 2.356 0.440
221 H TYR 33 HN TYR 33 60.055 6.819 0.868
222 HA TYR 33 HA TYR 33 58.150 9.096 1.039
223 1HB TYR 33 HB2 TYR 33 60.903 8.908 2.243
224 2HB TYR 33 HB1 TYR 33 60.241 10.473 1.772
225 HD1 TYR 33 HD1 TYR 33 59.891 7.604 4.076
226 HD2 TYR 33 HD2 TYR 33 58.297 11.417 2.890
227 HE1 TYR 33 HE1 TYR 33 58.543 7.688 6.149
228 HE2 TYR 33 HE2 TYR 33 56.951 11.498 4.972
229 HH TYR 33 HH TYR 33 57.455 10.007 7.550
230 H GLY 34 HN GLY 34 61.133 7.722 -0.343
231 1HA GLY 34 HA2 GLY 34 60.538 8.949 -2.921
232 2HA GLY 34 HA1 GLY 34 61.941 9.674 -2.132
233 H THR 35 HN THR 35 61.186 6.301 -1.642
234 HA THR 35 HA THR 35 63.807 5.521 -2.636
235 HB THR 35 HB THR 35 61.494 4.394 -1.184
236 HG1 THR 35 HG1 THR 35 63.604 3.253 -0.390
237 1HG2 THR 35 HG21 THR 35 62.007 2.068 -1.599
238 2HG2 THR 35 HG22 THR 35 63.345 2.505 -2.662
239 3HG2 THR 35 HG23 THR 35 61.685 2.836 -3.154
240 H THR 36 HN THR 36 64.267 4.349 -4.527
241 HA THR 36 HA THR 36 62.264 4.543 -6.700
242 HB THR 36 HB THR 36 64.847 3.315 -7.301
243 HG1 THR 36 HG1 THR 36 65.862 5.474 -6.812
244 1HG2 THR 36 HG21 THR 36 63.656 5.989 -8.082
245 2HG2 THR 36 HG22 THR 36 63.321 4.465 -8.909
246 3HG2 THR 36 HG23 THR 36 64.955 5.131 -8.914
247 H CYS 37 HN CYS 37 61.187 2.685 -5.123
248 HA CYS 37 HA CYS 37 62.046 0.040 -5.036
249 1HB CYS 37 HB2 CYS 37 59.825 1.339 -4.360
250 2HB CYS 37 HB1 CYS 37 59.237 0.654 -5.872
251 H THR 38 HN THR 38 63.210 -0.676 -6.892
252 HA THR 38 HA THR 38 61.995 -0.439 -9.568
253 HB THR 38 HB THR 38 64.496 -0.303 -8.799
254 HG1 THR 38 HG1 THR 38 64.615 -0.314 -10.876
255 1HG2 THR 38 HG21 THR 38 65.661 -2.259 -8.431
256 2HG2 THR 38 HG22 THR 38 64.571 -3.217 -9.433
257 3HG2 THR 38 HG23 THR 38 64.090 -2.756 -7.802
258 H GLY 39 HN GLY 39 60.581 -2.068 -7.501
259 1HA GLY 39 HA2 GLY 39 59.176 -3.980 -8.213
260 2HA GLY 39 HA1 GLY 39 60.614 -4.673 -8.963
261 H SER 40 HN SER 40 60.781 -3.107 -5.848
262 HA SER 40 HA SER 40 61.633 -5.675 -4.629
263 1HB SER 40 HB2 SER 40 63.074 -3.784 -4.293
264 2HB SER 40 HB1 SER 40 61.719 -2.751 -3.840
265 HG SER 40 HG SER 40 63.192 -3.940 -2.177
266 H ARG 41 HN ARG 41 60.951 -5.163 -1.979
267 HA ARG 41 HA ARG 41 58.112 -4.544 -1.694
268 1HB ARG 41 HB2 ARG 41 57.656 -6.631 -2.622
269 2HB ARG 41 HB1 ARG 41 59.173 -7.326 -2.051
270 1HG ARG 41 HG2 ARG 41 58.334 -7.729 0.093
271 2HG ARG 41 HG1 ARG 41 57.078 -6.500 -0.061
272 1HD ARG 41 HD2 ARG 41 55.778 -8.401 -0.383
273 2HD ARG 41 HD1 ARG 41 56.295 -8.130 -2.058
274 HE ARG 41 HE ARG 41 58.369 -9.615 -1.065
275 1HH1 ARG 41 HH1 ARG 41 56.124 -10.494 0.904
276 2HH1 ARG 41 HH1 ARG 41 55.630 -11.976 0.156
277 1HH2 ARG 41 HH2 ARG 41 57.220 -11.302 -2.851
278 2HH2 ARG 41 HH2 ARG 41 56.243 -12.430 -1.971
279 H PHE 42 HN PHE 42 57.612 -4.272 0.530
280 HA PHE 42 HA PHE 42 59.862 -4.854 2.432
281 1HB PHE 42 HB2 PHE 42 57.783 -2.687 2.724
282 2HB PHE 42 HB1 PHE 42 59.365 -2.788 3.495
283 HD1 PHE 42 HD1 PHE 42 57.991 -0.594 1.611
284 HD2 PHE 42 HD2 PHE 42 60.965 -3.643 1.052
285 HE1 PHE 42 HE1 PHE 42 58.976 0.712 -0.251
286 HE2 PHE 42 HE2 PHE 42 61.952 -2.337 -0.813
287 HZ PHE 42 HZ PHE 42 60.956 -0.157 -1.456
288 H ASP 43 HN ASP 43 58.689 -4.517 4.815
289 HA ASP 43 HA ASP 43 56.020 -5.591 5.083
290 1HB ASP 43 HB2 ASP 43 57.951 -7.420 4.310
291 2HB ASP 43 HB1 ASP 43 57.892 -7.634 6.058
292 H GLY 44 HN GLY 44 57.032 -3.436 6.358
293 1HA GLY 44 HA2 GLY 44 56.599 -3.017 8.780
294 2HA GLY 44 HA1 GLY 44 57.560 -4.459 9.112
295 H VAL 45 HN VAL 45 58.109 -1.512 7.101
296 HA VAL 45 HA VAL 45 60.642 -1.131 8.660
297 HB VAL 45 HB VAL 45 61.908 -1.038 6.694
298 1HG1 VAL 45 HG11 VAL 45 61.116 -3.319 6.951
299 2HG1 VAL 45 HG12 VAL 45 61.173 -2.925 5.234
300 3HG1 VAL 45 HG13 VAL 45 59.630 -2.932 6.085
301 1HG2 VAL 45 HG21 VAL 45 61.111 0.409 5.155
302 2HG2 VAL 45 HG22 VAL 45 59.435 0.055 5.562
303 3HG2 VAL 45 HG23 VAL 45 60.311 -0.999 4.450
304 H THR 46 HN THR 46 61.616 1.090 7.514
305 HA THR 46 HA THR 46 59.502 3.148 7.258
306 HB THR 46 HB THR 46 61.655 3.217 9.393
307 HG1 THR 46 HG1 THR 46 60.307 1.967 10.403
308 1HG2 THR 46 HG21 THR 46 60.603 5.358 8.304
309 2HG2 THR 46 HG22 THR 46 60.729 5.261 10.063
310 3HG2 THR 46 HG23 THR 46 59.188 4.932 9.270
311 H ILE 47 HN ILE 47 61.009 2.553 5.160
312 HA ILE 47 HA ILE 47 63.610 3.889 5.164
313 HB ILE 47 HB ILE 47 62.907 1.824 3.867
314 1HG1 ILE 47 HG12 ILE 47 63.778 3.990 1.965
315 2HG1 ILE 47 HG11 ILE 47 64.831 3.487 3.288
316 1HG2 ILE 47 HG21 ILE 47 61.718 2.356 1.683
317 2HG2 ILE 47 HG22 ILE 47 61.325 3.930 2.375
318 3HG2 ILE 47 HG23 ILE 47 60.715 2.457 3.130
319 1HD1 ILE 47 HD1 ILE 47 63.827 1.854 0.965
320 2HD1 ILE 47 HD1 ILE 47 64.378 1.074 2.446
321 3HD1 ILE 47 HD1 ILE 47 65.488 2.081 1.515
322 H THR 48 HN THR 48 63.857 5.472 3.089
323 HA THR 48 HA THR 48 61.522 7.328 3.011
324 HB THR 48 HB THR 48 63.619 9.055 3.205
325 HG1 THR 48 HG1 THR 48 65.274 8.052 3.955
326 1HG2 THR 48 HG21 THR 48 62.232 9.649 4.877
327 2HG2 THR 48 HG22 THR 48 62.959 8.389 5.873
328 3HG2 THR 48 HG23 THR 48 61.528 8.031 4.906
329 H THR 49 HN THR 49 64.746 8.106 1.852
330 HA THR 49 HA THR 49 63.710 7.857 -0.952
331 HB THR 49 HB THR 49 65.605 9.756 0.440
332 HG1 THR 49 HG1 THR 49 63.200 9.975 0.246
333 1HG2 THR 49 HG21 THR 49 65.365 9.045 -2.450
334 2HG2 THR 49 HG22 THR 49 66.795 9.505 -1.523
335 3HG2 THR 49 HG23 THR 49 65.631 10.736 -2.023
336 H SER 50 HN SER 50 64.536 5.514 -0.687
337 HA SER 50 HA SER 50 67.513 5.384 -1.041
338 1HB SER 50 HB2 SER 50 66.014 2.920 -0.467
339 2HB SER 50 HB1 SER 50 67.441 3.572 0.328
340 HG SER 50 HG SER 50 66.163 4.852 1.567
341 H THR 51 HN THR 51 68.337 4.026 -2.689
342 HA THR 51 HA THR 51 66.493 3.612 -4.997
343 HB THR 51 HB THR 51 69.467 3.254 -4.982
344 HG1 THR 51 HG1 THR 51 69.681 5.487 -5.151
345 1HG2 THR 51 HG21 THR 51 67.804 4.720 -7.009
346 2HG2 THR 51 HG22 THR 51 67.817 2.956 -6.989
347 3HG2 THR 51 HG23 THR 51 69.319 3.845 -7.239
348 H SER 52 HN SER 52 66.712 1.730 -2.621
349 HA SER 52 HA SER 52 68.131 -0.602 -2.929
350 1HB SER 52 HB2 SER 52 65.774 -1.644 -2.264
351 2HB SER 52 HB1 SER 52 66.643 -0.588 -1.155
352 HG SER 52 HG SER 52 64.880 0.479 -3.073
353 H THR 53 HN THR 53 68.251 -2.278 -4.383
354 HA THR 53 HA THR 53 66.244 -2.314 -6.620
355 HB THR 53 HB THR 53 69.233 -2.851 -6.689
356 HG1 THR 53 HG1 THR 53 69.353 -0.790 -6.963
357 1HG2 THR 53 HG21 THR 53 68.177 -2.368 -9.258
358 2HG2 THR 53 HG22 THR 53 67.071 -3.505 -8.489
359 3HG2 THR 53 HG23 THR 53 68.785 -3.899 -8.628
360 H GLY 54 HN GLY 54 65.094 -4.015 -5.446
361 1HA GLY 54 HA2 GLY 54 64.598 -6.311 -5.226
362 2HA GLY 54 HA1 GLY 54 66.149 -6.676 -5.985
363 H SER 55 HN SER 55 64.913 -5.263 -2.940
364 HA SER 55 HA SER 55 66.749 -7.041 -1.426
365 1HB SER 55 HB2 SER 55 67.250 -4.810 -0.095
366 2HB SER 55 HB1 SER 55 68.148 -5.198 -1.560
367 HG SER 55 HG SER 55 67.080 -3.680 -2.628
368 H ARG 56 HN ARG 56 65.542 -7.957 0.145
369 HA ARG 56 HA ARG 56 62.881 -6.997 0.822
370 1HB ARG 56 HB2 ARG 56 64.273 -9.369 0.813
371 2HB ARG 56 HB1 ARG 56 64.211 -8.995 2.536
372 1HG ARG 56 HG2 ARG 56 61.668 -8.447 1.949
373 2HG ARG 56 HG1 ARG 56 61.982 -9.593 0.643
374 1HD ARG 56 HD2 ARG 56 63.045 -11.052 2.577
375 2HD ARG 56 HD1 ARG 56 61.995 -10.062 3.611
376 HE ARG 56 HE ARG 56 60.990 -11.660 1.283
377 1HH1 ARG 56 HH2 ARG 56 59.755 -9.257 3.064
378 2HH1 ARG 56 HH2 ARG 56 58.534 -10.174 3.883
379 1HH2 ARG 56 HH1 ARG 56 59.807 -13.246 2.900
380 2HH2 ARG 56 HH1 ARG 56 58.570 -12.432 3.796
381 H ILE 57 HN ILE 57 62.930 -5.023 1.981
382 HA ILE 57 HA ILE 57 64.849 -4.634 4.175
383 HB ILE 57 HB ILE 57 62.497 -2.990 3.173
384 1HG1 ILE 57 HG12 ILE 57 64.919 -1.768 2.489
385 2HG1 ILE 57 HG11 ILE 57 65.188 -3.477 2.150
386 1HG2 ILE 57 HG21 ILE 57 64.715 -2.506 5.155
387 2HG2 ILE 57 HG22 ILE 57 62.992 -2.180 5.332
388 3HG2 ILE 57 HG23 ILE 57 63.981 -1.159 4.289
389 1HD1 ILE 57 HD1 ILE 57 64.251 -2.589 0.150
390 2HD1 ILE 57 HD1 ILE 57 63.027 -1.682 1.038
391 3HD1 ILE 57 HD1 ILE 57 62.925 -3.440 0.944
392 H SER 58 HN SER 58 62.407 -6.650 4.096
393 HA SER 58 HA SER 58 60.416 -6.035 5.936
394 1HB SER 58 HB2 SER 58 60.428 -8.469 6.384
395 2HB SER 58 HB1 SER 58 60.667 -8.136 4.672
396 HG SER 58 HG SER 58 62.841 -8.418 6.451
397 H GLY 59 HN GLY 59 60.230 -6.567 8.273
398 1HA GLY 59 HA2 GLY 59 62.093 -7.304 10.116
399 2HA GLY 59 HA1 GLY 59 62.602 -5.654 9.751
400 HA PRO 60 HA PRO 60 58.856 -5.791 12.655
401 1HB PRO 60 HB2 PRO 60 60.067 -5.867 15.108
402 2HB PRO 60 HB1 PRO 60 59.537 -7.325 14.247
403 1HG PRO 60 HG2 PRO 60 62.259 -6.184 14.534
404 2HG PRO 60 HG1 PRO 60 61.743 -7.874 14.459
405 1HD PRO 60 HD2 PRO 60 62.867 -6.495 12.359
406 2HD PRO 60 HD1 PRO 60 61.835 -7.932 12.185
407 H GLY 61 HN GLY 61 61.615 -4.048 11.982
408 1HA GLY 61 HA2 GLY 61 60.460 -1.511 12.604
409 2HA GLY 61 HA1 GLY 61 61.640 -1.916 13.849
410 H CYS 62 HN CYS 62 61.981 -2.992 10.533
411 HA CYS 62 HA CYS 62 64.649 -2.205 10.193
412 1HB CYS 62 HB2 CYS 62 62.821 -3.591 8.802
413 2HB CYS 62 HB1 CYS 62 62.763 -2.088 7.885
414 H LYS 63 HN LYS 63 65.439 -0.141 10.394
415 HA LYS 63 HA LYS 63 63.780 2.128 9.352
416 1HB LYS 63 HB2 LYS 63 64.293 2.196 11.742
417 2HB LYS 63 HB1 LYS 63 66.010 1.962 11.408
418 1HG LYS 63 HG2 LYS 63 66.022 4.098 10.127
419 2HG LYS 63 HG1 LYS 63 64.333 4.342 10.564
420 1HD LYS 63 HD2 LYS 63 65.606 5.598 12.151
421 2HD LYS 63 HD1 LYS 63 65.066 4.152 13.001
422 1HE LYS 63 HE2 LYS 63 67.293 4.005 13.574
423 2HE LYS 63 HE1 LYS 63 67.439 3.265 11.967
424 1HZ LYS 63 HZ1 LYS 63 67.947 5.347 10.999
425 2HZ LYS 63 HZ2 LYS 63 68.935 5.224 12.373
426 3HZ LYS 63 HZ3 LYS 63 67.545 6.197 12.411
427 H ILE 64 HN ILE 64 64.572 3.202 7.568
428 HA ILE 64 HA ILE 64 67.491 3.008 6.974
429 HB ILE 64 HB ILE 64 65.169 2.392 5.123
430 1HG1 ILE 64 HG12 ILE 64 67.376 0.674 6.307
431 2HG1 ILE 64 HG11 ILE 64 65.653 0.564 6.666
432 1HG2 ILE 64 HG21 ILE 64 67.786 1.696 4.117
433 2HG2 ILE 64 HG22 ILE 64 67.731 3.414 4.515
434 3HG2 ILE 64 HG23 ILE 64 66.559 2.732 3.388
435 1HD1 ILE 64 HD1 ILE 64 65.336 0.169 4.138
436 2HD1 ILE 64 HD1 ILE 64 66.021 -1.155 5.080
437 3HD1 ILE 64 HD1 ILE 64 67.073 -0.134 4.096
438 H SER 65 HN SER 65 68.300 4.816 5.817
439 HA SER 65 HA SER 65 66.344 6.940 5.069
440 1HB SER 65 HB2 SER 65 67.138 8.395 6.628
441 2HB SER 65 HB1 SER 65 67.684 6.934 7.451
442 HG SER 65 HG SER 65 69.114 8.800 5.929
443 H THR 66 HN THR 66 66.772 7.106 2.917
444 HA THR 66 HA THR 66 67.964 7.391 0.915
445 HB THR 66 HB THR 66 69.985 8.732 2.702
446 HG1 THR 66 HG1 THR 66 68.348 10.539 2.128
447 1HG2 THR 66 HG21 THR 66 70.601 9.875 0.815
448 2HG2 THR 66 HG22 THR 66 68.957 9.901 0.173
449 3HG2 THR 66 HG23 THR 66 69.942 8.444 0.015
450 H CYS 67 HN CYS 67 68.427 4.937 1.114
451 HA CYS 67 HA CYS 67 71.404 4.570 1.052
452 1HB CYS 67 HB2 CYS 67 70.399 3.677 3.164
453 2HB CYS 67 HB1 CYS 67 69.364 2.628 2.202
454 H ILE 68 HN ILE 68 71.790 4.154 -1.087
455 HA ILE 68 HA ILE 68 70.024 3.400 -3.092
456 HB ILE 68 HB ILE 68 72.956 3.004 -2.584
457 1HG1 ILE 68 HG12 ILE 68 72.972 4.508 -4.663
458 2HG1 ILE 68 HG11 ILE 68 71.227 4.642 -4.445
459 1HG2 ILE 68 HG21 ILE 68 71.351 1.890 -4.890
460 2HG2 ILE 68 HG22 ILE 68 72.559 1.067 -3.903
461 3HG2 ILE 68 HG23 ILE 68 73.056 2.298 -5.064
462 1HD1 ILE 68 HD1 ILE 68 73.047 5.162 -2.113
463 2HD1 ILE 68 HD1 ILE 68 71.426 5.783 -2.420
464 3HD1 ILE 68 HD1 ILE 68 72.800 6.421 -3.322
465 H ILE 69 HN ILE 69 72.294 1.015 -1.690
466 HA ILE 69 HA ILE 69 71.998 -1.289 -1.228
467 HB ILE 69 HB ILE 69 69.045 -0.600 -1.327
468 1HG1 ILE 69 HG12 ILE 69 70.917 -0.327 1.044
469 2HG1 ILE 69 HG11 ILE 69 70.378 1.030 0.059
470 1HG2 ILE 69 HG21 ILE 69 69.972 -3.020 -1.061
471 2HG2 ILE 69 HG22 ILE 69 68.736 -2.463 0.064
472 3HG2 ILE 69 HG23 ILE 69 70.426 -2.495 0.560
473 1HD1 ILE 69 HD1 ILE 69 68.966 0.748 2.076
474 2HD1 ILE 69 HD1 ILE 69 68.547 -0.880 1.538
475 3HD1 ILE 69 HD1 ILE 69 68.039 0.521 0.593
476 H THR 70 HN THR 70 71.413 -3.267 -2.372
477 HA THR 70 HA THR 70 70.034 -2.959 -4.990
478 HB THR 70 HB THR 70 72.819 -4.129 -4.716
479 HG1 THR 70 HG1 THR 70 73.224 -2.064 -4.388
480 1HG2 THR 70 HG21 THR 70 72.833 -3.806 -7.175
481 2HG2 THR 70 HG22 THR 70 71.172 -3.220 -7.093
482 3HG2 THR 70 HG23 THR 70 71.540 -4.892 -6.666
483 H GLY 71 HN GLY 71 71.926 -5.725 -5.040
484 1HA GLY 71 HA2 GLY 71 69.650 -7.449 -4.561
485 2HA GLY 71 HA1 GLY 71 71.293 -7.976 -4.913
486 H GLY 72 HN GLY 72 69.201 -6.801 -2.317
487 1HA GLY 72 HA2 GLY 72 69.372 -7.094 -0.002
488 2HA GLY 72 HA1 GLY 72 70.158 -8.617 -0.388
489 H VAL 73 HN VAL 73 71.593 -5.769 -1.658
490 HA VAL 73 HA VAL 73 73.725 -5.853 0.464
491 HB VAL 73 HB VAL 73 75.193 -5.233 -1.580
492 1HG1 VAL 73 HG11 VAL 73 75.059 -7.501 -0.455
493 2HG1 VAL 73 HG12 VAL 73 75.498 -7.553 -2.162
494 3HG1 VAL 73 HG13 VAL 73 73.854 -7.950 -1.662
495 1HG2 VAL 73 HG21 VAL 73 72.787 -4.931 -2.816
496 2HG2 VAL 73 HG22 VAL 73 73.171 -6.591 -3.274
497 3HG2 VAL 73 HG23 VAL 73 74.284 -5.285 -3.681
498 HA PRO 74 HA PRO 74 72.766 -1.500 0.513
499 1HB PRO 74 HB2 PRO 74 74.513 -0.798 2.490
500 2HB PRO 74 HB1 PRO 74 72.977 -1.624 2.810
501 1HG PRO 74 HG2 PRO 74 75.725 -2.678 2.866
502 2HG PRO 74 HG1 PRO 74 74.285 -3.224 3.734
503 1HD PRO 74 HD2 PRO 74 75.423 -4.403 1.435
504 2HD PRO 74 HD1 PRO 74 73.852 -4.792 2.168
505 H ALA 75 HN ALA 75 73.597 0.061 -0.826
506 HA ALA 75 HA ALA 75 76.399 -0.201 -1.773
507 1HB ALA 75 HB1 ALA 75 74.028 0.220 -3.028
508 2HB ALA 75 HB2 ALA 75 75.574 0.745 -3.696
509 3HB ALA 75 HB3 ALA 75 74.560 1.887 -2.813
510 HA PRO 76 HA PRO 76 77.747 3.230 0.629
511 1HB PRO 76 HB2 PRO 76 79.854 4.051 -0.911
512 2HB PRO 76 HB1 PRO 76 79.899 2.584 0.087
513 1HG PRO 76 HG2 PRO 76 79.474 2.866 -2.841
514 2HG PRO 76 HG1 PRO 76 80.354 1.622 -1.943
515 1HD PRO 76 HD2 PRO 76 77.836 1.281 -2.964
516 2HD PRO 76 HD1 PRO 76 78.476 0.382 -1.572
517 H SER 77 HN SER 77 77.401 5.485 0.676
518 HA SER 77 HA SER 77 77.127 7.063 -1.772
519 1HB SER 77 HB2 SER 77 75.038 5.676 -1.647
520 2HB SER 77 HB1 SER 77 74.676 6.433 -0.099
521 HG SER 77 HG SER 77 74.546 8.410 -1.137
522 H ALA 78 HN ALA 78 78.371 7.055 1.049
523 HA ALA 78 HA ALA 78 78.702 8.604 2.820
524 1HB ALA 78 HB1 ALA 78 79.784 9.978 1.321
525 2HB ALA 78 HB2 ALA 78 78.397 11.023 1.630
526 3HB ALA 78 HB3 ALA 78 78.423 9.989 0.202
527 H ALA 79 HN ALA 79 75.856 7.653 2.312
528 HA ALA 79 HA ALA 79 74.537 9.660 4.027
529 1HB ALA 79 HB1 ALA 79 74.426 10.128 1.402
530 2HB ALA 79 HB2 ALA 79 73.033 10.434 2.441
531 3HB ALA 79 HB3 ALA 79 73.116 8.949 1.492
532 H CYS 80 HN CYS 80 74.326 6.608 2.205
533 HA CYS 80 HA CYS 80 71.917 5.549 3.163
534 1HB CYS 80 HB2 CYS 80 73.106 4.325 1.539
535 2HB CYS 80 HB1 CYS 80 74.599 4.381 2.455
536 H LYS 81 HN LYS 81 71.292 4.458 5.016
537 HA LYS 81 HA LYS 81 72.975 4.884 7.427
538 1HB LYS 81 HB2 LYS 81 70.952 5.129 8.486
539 2HB LYS 81 HB1 LYS 81 70.356 5.386 6.850
540 1HG LYS 81 HG2 LYS 81 70.306 2.791 8.426
541 2HG LYS 81 HG1 LYS 81 68.918 3.759 7.930
542 1HD LYS 81 HD2 LYS 81 68.910 2.866 5.842
543 2HD LYS 81 HD1 LYS 81 70.655 2.995 5.689
544 1HE LYS 81 HE2 LYS 81 70.885 0.991 7.184
545 2HE LYS 81 HE1 LYS 81 69.124 0.799 7.102
546 1HZ LYS 81 HZ1 LYS 81 70.301 1.281 4.536
547 2HZ LYS 81 HZ2 LYS 81 69.241 0.045 5.019
548 3HZ LYS 81 HZ3 LYS 81 70.915 -0.127 5.256
549 H ILE 82 HN ILE 82 72.926 3.004 9.050
550 HA ILE 82 HA ILE 82 72.535 0.318 7.878
551 HB ILE 82 HB ILE 82 75.210 1.483 8.701
552 1HG1 ILE 82 HG12 ILE 82 74.528 1.985 6.383
553 2HG1 ILE 82 HG11 ILE 82 75.869 0.848 6.403
554 1HG2 ILE 82 HG21 ILE 82 74.237 -1.233 8.840
555 2HG2 ILE 82 HG22 ILE 82 75.806 -0.586 9.329
556 3HG2 ILE 82 HG23 ILE 82 75.548 -1.112 7.665
557 1HD1 ILE 82 HD1 ILE 82 73.365 -0.597 6.508
558 2HD1 ILE 82 HD1 ILE 82 74.649 -0.696 5.306
559 3HD1 ILE 82 HD1 ILE 82 73.368 0.505 5.130
560 H SER 83 HN SER 83 71.001 1.075 9.884
561 HA SER 83 HA SER 83 72.324 0.468 12.478
562 1HB SER 83 HB2 SER 83 69.534 1.430 11.776
563 2HB SER 83 HB1 SER 83 70.227 1.367 13.395
564 HG SER 83 HG SER 83 71.944 2.736 12.435
565 H GLY 84 HN GLY 84 69.080 -0.263 12.763
566 1HA GLY 84 HA2 GLY 84 69.677 -3.174 12.692
567 2HA GLY 84 HA1 GLY 84 68.364 -2.421 13.596
568 H CYS 85 HN CYS 85 69.424 -3.324 10.341
569 HA CYS 85 HA CYS 85 66.551 -3.547 9.558
570 1HB CYS 85 HB2 CYS 85 68.344 -1.494 8.781
571 2HB CYS 85 HB1 CYS 85 68.184 -2.553 7.381
572 H THR 86 HN THR 86 66.971 -4.358 6.924
573 HA THR 86 HA THR 86 69.114 -6.254 6.605
574 HB THR 86 HB THR 86 68.046 -7.456 8.377
575 HG1 THR 86 HG1 THR 86 66.835 -9.062 6.715
576 1HG2 THR 86 HG21 THR 86 65.910 -6.403 8.518
577 2HG2 THR 86 HG22 THR 86 65.576 -8.084 8.105
578 3HG2 THR 86 HG23 THR 86 65.509 -6.840 6.858
579 H PHE 87 HN PHE 87 69.078 -7.134 4.538
580 HA PHE 87 HA PHE 87 66.796 -6.241 2.810
581 1HB PHE 87 HB2 PHE 87 69.575 -7.000 1.906
582 2HB PHE 87 HB1 PHE 87 68.401 -5.976 1.084
583 HD1 PHE 87 HD1 PHE 87 71.363 -5.360 1.840
584 HD2 PHE 87 HD2 PHE 87 67.589 -4.453 3.689
585 HE1 PHE 87 HE1 PHE 87 72.366 -3.362 2.913
586 HE2 PHE 87 HE2 PHE 87 68.592 -2.449 4.757
587 HZ PHE 87 HZ PHE 87 70.982 -1.904 4.369
588 H SER 88 HN SER 88 69.347 -8.747 2.560
589 HA SER 88 HA SER 88 69.154 -11.080 2.170
590 1HB SER 88 HB2 SER 88 67.107 -10.415 3.835
591 2HB SER 88 HB1 SER 88 66.197 -10.999 2.445
592 HG SER 88 HG SER 88 66.632 -12.784 3.633
593 H ALA 89 HN ALA 89 68.208 -8.719 0.196
594 HA ALA 89 HA ALA 89 67.391 -8.615 -2.027
595 1HB ALA 89 HB1 ALA 89 69.229 -9.783 -2.756
596 2HB ALA 89 HB2 ALA 89 68.010 -11.008 -3.115
597 3HB ALA 89 HB3 ALA 89 68.948 -11.112 -1.628
598 H ASN 90 HN ASN 90 65.113 -8.524 -1.568
599 HA ASN 90 HA ASN 90 63.449 -10.698 -0.870
600 1HB ASN 90 HB2 ASN 90 61.719 -9.174 -1.342
601 2HB ASN 90 HB1 ASN 90 63.090 -8.100 -1.091
602 1HD2 ASN 90 HD2 ASN 90 60.545 -8.173 -3.008
603 2HD2 ASN 90 HD2 ASN 90 61.207 -7.688 -4.495
Start of MODEL 10
1 1H ASP 1 HT1 ASP 1 47.124 11.950 2.436
2 2H ASP 1 HT2 ASP 1 47.121 10.814 3.700
3 3H ASP 1 HT3 ASP 1 45.737 11.023 2.736
4 HA ASP 1 HA ASP 1 47.617 10.424 0.883
5 1HB ASP 1 HB2 ASP 1 48.062 8.781 3.398
6 2HB ASP 1 HB1 ASP 1 48.915 8.594 1.865
7 H GLY 2 HN GLY 2 47.372 7.407 1.711
8 1HA GLY 2 HA2 GLY 2 45.070 6.247 2.185
9 2HA GLY 2 HA1 GLY 2 44.562 7.157 0.762
10 H SER 3 HN SER 3 44.175 5.287 -0.496
11 HA SER 3 HA SER 3 46.061 3.135 -0.844
12 1HB SER 3 HB2 SER 3 43.439 3.742 -1.494
13 2HB SER 3 HB1 SER 3 44.235 3.745 -3.065
14 HG SER 3 HG SER 3 44.825 1.690 -1.262
15 H CYS 4 HN CYS 4 47.814 3.000 -2.248
16 HA CYS 4 HA CYS 4 48.103 5.146 -4.322
17 1HB CYS 4 HB2 CYS 4 49.608 4.692 -1.936
18 2HB CYS 4 HB1 CYS 4 50.651 4.343 -3.316
19 H THR 5 HN THR 5 48.780 1.825 -3.322
20 HA THR 5 HA THR 5 49.273 -0.078 -4.618
21 HB THR 5 HB THR 5 48.681 1.875 -6.872
22 HG1 THR 5 HG1 THR 5 46.948 1.611 -5.477
23 1HG2 THR 5 HG21 THR 5 48.955 -1.131 -6.793
24 2HG2 THR 5 HG22 THR 5 49.825 0.007 -7.820
25 3HG2 THR 5 HG23 THR 5 48.108 -0.287 -8.087
26 H ASN 6 HN ASN 6 51.175 2.535 -4.289
27 HA ASN 6 HA ASN 6 53.486 2.863 -4.637
28 1HB ASN 6 HB2 ASN 6 54.531 0.859 -4.401
29 2HB ASN 6 HB1 ASN 6 52.967 0.083 -4.621
30 1HD2 ASN 6 HD2 ASN 6 55.909 1.127 -6.365
31 2HD2 ASN 6 HD2 ASN 6 55.680 0.102 -7.700
32 H THR 7 HN THR 7 52.207 0.999 -7.409
33 HA THR 7 HA THR 7 52.383 3.297 -9.201
34 HB THR 7 HB THR 7 54.321 0.965 -9.369
35 HG1 THR 7 HG1 THR 7 55.443 2.427 -8.366
36 1HG2 THR 7 HG21 THR 7 54.044 3.186 -11.394
37 2HG2 THR 7 HG22 THR 7 53.174 1.661 -11.567
38 3HG2 THR 7 HG23 THR 7 54.937 1.672 -11.548
39 H ASN 8 HN ASN 8 52.061 -0.210 -8.778
40 HA ASN 8 HA ASN 8 49.508 -0.392 -10.036
41 1HB ASN 8 HB2 ASN 8 51.611 0.072 -11.807
42 2HB ASN 8 HB1 ASN 8 51.342 -1.666 -11.909
43 1HD2 ASN 8 HD2 ASN 8 48.540 -1.782 -11.487
44 2HD2 ASN 8 HD2 ASN 8 47.753 -0.994 -12.768
45 H SER 9 HN SER 9 50.839 -1.547 -7.752
46 HA SER 9 HA SER 9 50.803 -4.437 -8.543
47 1HB SER 9 HB2 SER 9 52.625 -4.756 -6.942
48 2HB SER 9 HB1 SER 9 53.070 -3.527 -8.119
49 HG SER 9 HG SER 9 52.278 -1.980 -6.531
50 H GLN 10 HN GLN 10 51.069 -2.799 -5.358
51 HA GLN 10 HA GLN 10 48.318 -3.579 -4.654
52 1HB GLN 10 HB2 GLN 10 50.501 -5.380 -4.391
53 2HB GLN 10 HB1 GLN 10 50.061 -4.866 -2.762
54 1HG GLN 10 HG2 GLN 10 47.867 -5.678 -2.960
55 2HG GLN 10 HG1 GLN 10 47.930 -5.691 -4.723
56 1HE2 GLN 10 HE21 GLN 10 49.962 -7.192 -5.500
57 2HE2 GLN 10 HE22 GLN 10 50.002 -8.717 -4.756
58 H LEU 11 HN LEU 11 51.463 -2.973 -3.015
59 HA LEU 11 HA LEU 11 51.968 -1.488 -1.237
60 1HB LEU 11 HB2 LEU 11 51.372 0.043 -3.176
61 2HB LEU 11 HB1 LEU 11 49.734 0.127 -2.520
62 HG LEU 11 HG LEU 11 50.538 1.081 -0.452
63 1HD1 LEU 11 HD1 LEU 11 52.535 0.109 0.110
64 2HD1 LEU 11 HD1 LEU 11 53.153 1.623 -0.543
65 3HD1 LEU 11 HD1 LEU 11 53.159 0.164 -1.536
66 1HD2 LEU 11 HD2 LEU 11 50.344 2.562 -2.533
67 2HD2 LEU 11 HD2 LEU 11 52.103 2.473 -2.634
68 3HD2 LEU 11 HD2 LEU 11 51.336 3.193 -1.219
69 H SER 12 HN SER 12 51.129 -2.895 0.418
70 HA SER 12 HA SER 12 48.560 -3.440 1.226
71 1HB SER 12 HB2 SER 12 51.136 -3.482 2.314
72 2HB SER 12 HB1 SER 12 50.185 -2.564 3.479
73 HG SER 12 HG SER 12 49.549 -5.118 2.397
74 H ALA 13 HN ALA 13 46.871 -2.346 2.226
75 HA ALA 13 HA ALA 13 46.500 0.434 1.910
76 1HB ALA 13 HB1 ALA 13 45.042 -1.740 2.691
77 2HB ALA 13 HB2 ALA 13 44.468 -0.078 2.831
78 3HB ALA 13 HB3 ALA 13 45.198 -0.880 4.224
79 H ASN 14 HN ASN 14 48.338 -1.269 4.298
80 HA ASN 14 HA ASN 14 48.235 0.977 6.223
81 1HB ASN 14 HB2 ASN 14 49.389 -0.597 7.661
82 2HB ASN 14 HB1 ASN 14 48.079 -1.447 6.849
83 1HD2 ASN 14 HD2 ASN 14 48.684 -3.386 5.897
84 2HD2 ASN 14 HD2 ASN 14 50.258 -3.785 5.401
85 H SER 15 HN SER 15 50.117 0.086 3.515
86 HA SER 15 HA SER 15 52.733 0.907 4.405
87 1HB SER 15 HB2 SER 15 52.801 -0.247 2.393
88 2HB SER 15 HB1 SER 15 51.274 0.437 1.841
89 HG SER 15 HG SER 15 52.301 2.236 1.195
90 H LYS 16 HN LYS 16 53.647 2.963 2.941
91 HA LYS 16 HA LYS 16 51.792 5.248 3.545
92 1HB LYS 16 HB2 LYS 16 54.106 4.620 4.808
93 2HB LYS 16 HB1 LYS 16 54.736 5.641 3.513
94 1HG LYS 16 HG2 LYS 16 54.215 7.348 4.933
95 2HG LYS 16 HG1 LYS 16 52.576 7.106 4.321
96 1HD LYS 16 HD2 LYS 16 52.852 5.169 6.315
97 2HD LYS 16 HD1 LYS 16 53.644 6.596 6.986
98 1HE LYS 16 HE2 LYS 16 51.681 7.901 6.852
99 2HE LYS 16 HE1 LYS 16 50.932 6.813 5.667
100 1HZ LYS 16 HZ1 LYS 16 50.005 6.360 7.823
101 2HZ LYS 16 HZ2 LYS 16 51.550 6.184 8.505
102 3HZ LYS 16 HZ3 LYS 16 50.986 5.052 7.370
103 H CYS 17 HN CYS 17 52.103 7.140 2.120
104 HA CYS 17 HA CYS 17 53.636 6.694 -0.375
105 1HB CYS 17 HB2 CYS 17 51.405 5.596 -0.622
106 2HB CYS 17 HB1 CYS 17 50.636 7.157 -0.325
107 H GLU 18 HN GLU 18 54.760 8.602 -0.431
108 HA GLU 18 HA GLU 18 53.419 11.129 -0.827
109 1HB GLU 18 HB2 GLU 18 52.987 10.781 1.580
110 2HB GLU 18 HB1 GLU 18 54.715 10.580 1.865
111 1HG GLU 18 HG2 GLU 18 55.170 12.827 1.566
112 2HG GLU 18 HG1 GLU 18 53.797 13.068 0.483
113 H LYS 19 HN LYS 19 54.865 12.219 -2.117
114 HA LYS 19 HA LYS 19 56.927 12.830 -3.108
115 1HB LYS 19 HB2 LYS 19 57.207 12.786 -0.154
116 2HB LYS 19 HB1 LYS 19 58.724 12.813 -1.053
117 1HG LYS 19 HG2 LYS 19 57.570 14.720 -2.431
118 2HG LYS 19 HG1 LYS 19 56.509 14.845 -1.028
119 1HD LYS 19 HD2 LYS 19 59.389 14.681 -0.387
120 2HD LYS 19 HD1 LYS 19 58.901 16.144 -1.243
121 1HE LYS 19 HE2 LYS 19 56.885 15.817 0.650
122 2HE LYS 19 HE1 LYS 19 58.365 15.376 1.527
123 1HZ LYS 19 HZ1 LYS 19 59.306 17.421 0.228
124 2HZ LYS 19 HZ2 LYS 19 58.456 17.645 1.681
125 3HZ LYS 19 HZ3 LYS 19 57.679 17.901 0.191
126 H SER 20 HN SER 20 56.435 10.229 -3.706
127 HA SER 20 HA SER 20 59.107 8.923 -3.361
128 1HB SER 20 HB2 SER 20 58.171 7.313 -2.089
129 2HB SER 20 HB1 SER 20 56.662 8.221 -2.105
130 HG SER 20 HG SER 20 56.493 6.059 -2.946
131 H THR 21 HN THR 21 59.484 7.220 -5.030
132 HA THR 21 HA THR 21 57.707 7.472 -7.434
133 HB THR 21 HB THR 21 59.581 8.980 -7.757
134 HG1 THR 21 HG1 THR 21 60.396 8.086 -9.594
135 1HG2 THR 21 HG21 THR 21 61.927 7.705 -7.747
136 2HG2 THR 21 HG22 THR 21 61.096 6.711 -6.550
137 3HG2 THR 21 HG23 THR 21 61.272 8.445 -6.286
138 H LEU 22 HN LEU 22 57.249 5.328 -6.007
139 HA LEU 22 HA LEU 22 59.119 3.143 -6.323
140 1HB LEU 22 HB2 LEU 22 56.150 2.967 -5.820
141 2HB LEU 22 HB1 LEU 22 57.414 1.896 -5.228
142 HG LEU 22 HG LEU 22 56.651 4.638 -4.266
143 1HD1 LEU 22 HD1 LEU 22 57.515 2.088 -2.875
144 2HD1 LEU 22 HD1 LEU 22 55.842 2.575 -3.139
145 3HD1 LEU 22 HD1 LEU 22 56.887 3.535 -2.088
146 1HD2 LEU 22 HD2 LEU 22 59.399 3.689 -4.625
147 2HD2 LEU 22 HD2 LEU 22 59.026 4.006 -2.934
148 3HD2 LEU 22 HD2 LEU 22 58.821 5.280 -4.133
149 H THR 23 HN THR 23 58.178 1.032 -7.370
150 HA THR 23 HA THR 23 56.549 1.389 -9.781
151 HB THR 23 HB THR 23 59.563 1.171 -9.807
152 HG1 THR 23 HG1 THR 23 58.322 2.656 -11.703
153 1HG2 THR 23 HG21 THR 23 57.634 -0.101 -11.621
154 2HG2 THR 23 HG22 THR 23 59.363 -0.392 -11.436
155 3HG2 THR 23 HG23 THR 23 58.796 0.937 -12.449
156 H ASN 24 HN ASN 24 55.417 -0.530 -9.767
157 HA ASN 24 HA ASN 24 54.939 -2.831 -9.449
158 1HB ASN 24 HB2 ASN 24 57.860 -2.918 -10.297
159 2HB ASN 24 HB1 ASN 24 56.737 -4.275 -10.377
160 1HD2 ASN 24 HD2 ASN 24 54.428 -3.115 -11.412
161 2HD2 ASN 24 HD2 ASN 24 54.739 -2.463 -12.946
162 H CYS 25 HN CYS 25 54.665 -3.108 -7.171
163 HA CYS 25 HA CYS 25 56.970 -4.272 -5.740
164 1HB CYS 25 HB2 CYS 25 56.310 -1.495 -5.614
165 2HB CYS 25 HB1 CYS 25 55.903 -2.201 -4.052
166 H TYR 26 HN TYR 26 55.911 -4.017 -3.150
167 HA TYR 26 HA TYR 26 53.106 -4.823 -3.053
168 1HB TYR 26 HB2 TYR 26 54.162 -6.884 -3.912
169 2HB TYR 26 HB1 TYR 26 55.336 -6.842 -2.594
170 HD1 TYR 26 HD1 TYR 26 54.799 -8.772 -1.305
171 HD2 TYR 26 HD2 TYR 26 51.695 -6.040 -2.478
172 HE1 TYR 26 HE1 TYR 26 53.191 -9.961 0.165
173 HE2 TYR 26 HE2 TYR 26 50.091 -7.232 -1.009
174 HH TYR 26 HH TYR 26 51.070 -9.492 1.331
175 H VAL 27 HN VAL 27 54.903 -2.881 -1.900
176 HA VAL 27 HA VAL 27 56.069 -3.113 0.522
177 HB VAL 27 HB VAL 27 53.764 -1.202 0.125
178 1HG1 VAL 27 HG11 VAL 27 56.031 0.130 1.054
179 2HG1 VAL 27 HG12 VAL 27 56.063 -1.414 1.907
180 3HG1 VAL 27 HG13 VAL 27 54.647 -0.370 2.028
181 1HG2 VAL 27 HG21 VAL 27 55.832 0.154 -0.936
182 2HG2 VAL 27 HG22 VAL 27 54.757 -0.842 -1.924
183 3HG2 VAL 27 HG23 VAL 27 56.316 -1.480 -1.394
184 H ASP 28 HN ASP 28 55.438 -3.309 2.720
185 HA ASP 28 HA ASP 28 52.636 -3.996 3.387
186 1HB ASP 28 HB2 ASP 28 54.362 -5.961 2.564
187 2HB ASP 28 HB1 ASP 28 54.658 -5.963 4.303
188 H LYS 29 HN LYS 29 52.336 -2.780 5.254
189 HA LYS 29 HA LYS 29 52.907 -1.632 7.262
190 1HB LYS 29 HB2 LYS 29 54.569 -4.172 7.436
191 2HB LYS 29 HB1 LYS 29 54.220 -3.114 8.800
192 1HG LYS 29 HG2 LYS 29 51.962 -3.700 8.846
193 2HG LYS 29 HG1 LYS 29 51.957 -4.206 7.156
194 1HD LYS 29 HD2 LYS 29 52.360 -6.326 7.788
195 2HD LYS 29 HD1 LYS 29 53.871 -5.809 8.534
196 1HE LYS 29 HE2 LYS 29 51.178 -5.582 9.918
197 2HE LYS 29 HE1 LYS 29 52.297 -6.938 10.153
198 1HZ LYS 29 HZ1 LYS 29 53.951 -4.855 10.373
199 2HZ LYS 29 HZ2 LYS 29 53.193 -5.597 11.701
200 3HZ LYS 29 HZ3 LYS 29 52.538 -4.181 11.026
201 H SER 30 HN SER 30 54.134 -0.112 5.659
202 HA SER 30 HA SER 30 56.930 0.135 6.590
203 1HB SER 30 HB2 SER 30 56.183 -0.319 3.686
204 2HB SER 30 HB1 SER 30 57.809 -0.002 4.285
205 HG SER 30 HG SER 30 57.939 -1.997 4.943
206 H GLU 31 HN GLU 31 57.872 2.170 5.987
207 HA GLU 31 HA GLU 31 55.888 4.239 5.097
208 1HB GLU 31 HB2 GLU 31 57.603 3.911 7.429
209 2HB GLU 31 HB1 GLU 31 57.914 5.444 6.615
210 1HG GLU 31 HG2 GLU 31 55.550 6.029 6.727
211 2HG GLU 31 HG1 GLU 31 55.165 4.455 7.424
212 H VAL 32 HN VAL 32 56.503 5.043 3.117
213 HA VAL 32 HA VAL 32 59.438 5.135 2.505
214 HB VAL 32 HB VAL 32 57.065 4.639 0.682
215 1HG1 VAL 32 HG11 VAL 32 60.018 4.944 0.268
216 2HG1 VAL 32 HG12 VAL 32 58.683 5.501 -0.743
217 3HG1 VAL 32 HG13 VAL 32 59.136 3.796 -0.742
218 1HG2 VAL 32 HG21 VAL 32 57.523 2.359 0.840
219 2HG2 VAL 32 HG22 VAL 32 57.895 2.876 2.487
220 3HG2 VAL 32 HG23 VAL 32 59.200 2.623 1.322
221 H TYR 33 HN TYR 33 60.117 6.944 1.143
222 HA TYR 33 HA TYR 33 58.173 9.148 0.709
223 1HB TYR 33 HB2 TYR 33 60.421 9.066 2.711
224 2HB TYR 33 HB1 TYR 33 59.878 10.604 2.050
225 HD1 TYR 33 HD1 TYR 33 57.610 11.449 2.502
226 HD2 TYR 33 HD2 TYR 33 58.993 7.740 4.170
227 HE1 TYR 33 HE1 TYR 33 55.713 11.462 4.095
228 HE2 TYR 33 HE2 TYR 33 57.099 7.746 5.768
229 HH TYR 33 HH TYR 33 55.340 8.881 6.534
230 H GLY 34 HN GLY 34 60.005 7.478 -1.029
231 1HA GLY 34 HA2 GLY 34 60.854 9.308 -2.922
232 2HA GLY 34 HA1 GLY 34 62.210 9.233 -1.798
233 H THR 35 HN THR 35 61.720 6.417 -1.151
234 HA THR 35 HA THR 35 63.512 5.015 -2.658
235 HB THR 35 HB THR 35 60.837 4.193 -1.516
236 HG1 THR 35 HG1 THR 35 62.363 4.958 -0.050
237 1HG2 THR 35 HG21 THR 35 62.166 1.900 -1.449
238 2HG2 THR 35 HG22 THR 35 62.951 2.582 -2.871
239 3HG2 THR 35 HG23 THR 35 61.201 2.359 -2.850
240 H THR 36 HN THR 36 63.265 3.418 -4.440
241 HA THR 36 HA THR 36 61.403 4.402 -6.556
242 HB THR 36 HB THR 36 63.647 2.492 -7.055
243 HG1 THR 36 HG1 THR 36 65.128 3.821 -6.395
244 1HG2 THR 36 HG21 THR 36 63.244 5.067 -8.498
245 2HG2 THR 36 HG22 THR 36 62.006 3.828 -8.694
246 3HG2 THR 36 HG23 THR 36 63.678 3.479 -9.130
247 H CYS 37 HN CYS 37 61.908 1.752 -4.424
248 HA CYS 37 HA CYS 37 61.079 -0.484 -4.409
249 1HB CYS 37 HB2 CYS 37 59.160 1.503 -4.378
250 2HB CYS 37 HB1 CYS 37 58.570 0.431 -5.647
251 H THR 38 HN THR 38 62.274 -1.599 -6.046
252 HA THR 38 HA THR 38 61.119 -1.565 -8.806
253 HB THR 38 HB THR 38 63.753 -2.556 -7.663
254 HG1 THR 38 HG1 THR 38 64.108 -0.631 -9.373
255 1HG2 THR 38 HG21 THR 38 62.445 -2.899 -10.273
256 2HG2 THR 38 HG22 THR 38 63.804 -3.778 -9.573
257 3HG2 THR 38 HG23 THR 38 64.073 -2.233 -10.380
258 H GLY 39 HN GLY 39 59.367 -3.023 -8.484
259 1HA GLY 39 HA2 GLY 39 58.313 -5.096 -8.146
260 2HA GLY 39 HA1 GLY 39 59.777 -5.751 -8.876
261 H SER 40 HN SER 40 59.944 -3.952 -5.884
262 HA SER 40 HA SER 40 60.772 -6.470 -4.492
263 1HB SER 40 HB2 SER 40 61.175 -3.716 -3.394
264 2HB SER 40 HB1 SER 40 62.240 -5.118 -3.311
265 HG SER 40 HG SER 40 62.510 -4.820 -5.630
266 H ARG 41 HN ARG 41 60.438 -5.692 -1.865
267 HA ARG 41 HA ARG 41 57.748 -4.634 -1.381
268 1HB ARG 41 HB2 ARG 41 56.812 -6.770 -0.629
269 2HB ARG 41 HB1 ARG 41 57.372 -6.935 -2.293
270 1HG ARG 41 HG2 ARG 41 59.599 -7.748 -1.254
271 2HG ARG 41 HG1 ARG 41 58.670 -7.959 0.230
272 1HD ARG 41 HD2 ARG 41 57.990 -9.968 -0.571
273 2HD ARG 41 HD1 ARG 41 57.110 -9.101 -1.845
274 HE ARG 41 HE ARG 41 60.003 -9.414 -2.304
275 1HH1 ARG 41 HH2 ARG 41 58.861 -12.166 -2.298
276 2HH1 ARG 41 HH2 ARG 41 58.358 -12.364 -3.945
277 1HH2 ARG 41 HH1 ARG 41 58.461 -8.974 -4.664
278 2HH2 ARG 41 HH1 ARG 41 58.127 -10.558 -5.280
279 H PHE 42 HN PHE 42 57.331 -4.439 0.921
280 HA PHE 42 HA PHE 42 59.743 -4.938 2.637
281 1HB PHE 42 HB2 PHE 42 57.660 -2.764 2.981
282 2HB PHE 42 HB1 PHE 42 59.243 -2.865 3.744
283 HD1 PHE 42 HD1 PHE 42 57.802 -0.730 1.794
284 HD2 PHE 42 HD2 PHE 42 60.900 -3.676 1.364
285 HE1 PHE 42 HE1 PHE 42 58.788 0.580 -0.067
286 HE2 PHE 42 HE2 PHE 42 61.883 -2.361 -0.500
287 HZ PHE 42 HZ PHE 42 60.822 -0.235 -1.206
288 H ASP 43 HN ASP 43 58.779 -4.647 5.102
289 HA ASP 43 HA ASP 43 56.113 -5.770 5.489
290 1HB ASP 43 HB2 ASP 43 58.391 -7.485 5.039
291 2HB ASP 43 HB1 ASP 43 57.795 -7.720 6.683
292 H GLY 44 HN GLY 44 57.305 -3.466 6.515
293 1HA GLY 44 HA2 GLY 44 56.796 -2.847 8.910
294 2HA GLY 44 HA1 GLY 44 57.803 -4.228 9.357
295 H VAL 45 HN VAL 45 58.236 -1.512 7.031
296 HA VAL 45 HA VAL 45 60.787 -0.913 8.488
297 HB VAL 45 HB VAL 45 62.021 -1.059 6.528
298 1HG1 VAL 45 HG11 VAL 45 61.086 -3.284 6.988
299 2HG1 VAL 45 HG12 VAL 45 61.298 -3.043 5.254
300 3HG1 VAL 45 HG13 VAL 45 59.692 -2.912 5.973
301 1HG2 VAL 45 HG21 VAL 45 59.521 -0.079 5.277
302 2HG2 VAL 45 HG22 VAL 45 60.530 -1.113 4.264
303 3HG2 VAL 45 HG23 VAL 45 61.197 0.368 4.953
304 H THR 46 HN THR 46 61.696 1.224 7.267
305 HA THR 46 HA THR 46 59.526 3.175 6.736
306 HB THR 46 HB THR 46 61.536 3.372 9.001
307 HG1 THR 46 HG1 THR 46 59.220 3.515 10.004
308 1HG2 THR 46 HG21 THR 46 61.171 5.592 8.819
309 2HG2 THR 46 HG22 THR 46 59.503 5.281 9.304
310 3HG2 THR 46 HG23 THR 46 59.926 5.345 7.592
311 H ILE 47 HN ILE 47 61.189 2.480 4.766
312 HA ILE 47 HA ILE 47 63.702 3.986 4.804
313 HB ILE 47 HB ILE 47 63.541 1.887 3.619
314 1HG1 ILE 47 HG12 ILE 47 63.446 4.008 1.467
315 2HG1 ILE 47 HG11 ILE 47 64.822 3.836 2.556
316 1HG2 ILE 47 HG21 ILE 47 61.807 2.457 1.452
317 2HG2 ILE 47 HG22 ILE 47 60.944 2.905 2.922
318 3HG2 ILE 47 HG23 ILE 47 61.573 1.268 2.733
319 1HD1 ILE 47 HD1 ILE 47 65.154 1.527 1.827
320 2HD1 ILE 47 HD1 ILE 47 65.138 2.586 0.417
321 3HD1 ILE 47 HD1 ILE 47 63.719 1.614 0.807
322 H THR 48 HN THR 48 64.101 5.627 2.987
323 HA THR 48 HA THR 48 61.639 7.186 2.292
324 HB THR 48 HB THR 48 62.747 9.209 3.128
325 HG1 THR 48 HG1 THR 48 64.770 8.578 4.422
326 1HG2 THR 48 HG21 THR 48 61.474 7.724 4.710
327 2HG2 THR 48 HG22 THR 48 62.693 8.729 5.489
328 3HG2 THR 48 HG23 THR 48 63.015 7.019 5.199
329 H THR 49 HN THR 49 64.032 9.225 1.586
330 HA THR 49 HA THR 49 64.067 8.651 -1.230
331 HB THR 49 HB THR 49 65.941 10.316 0.486
332 HG1 THR 49 HG1 THR 49 64.153 11.386 0.785
333 1HG2 THR 49 HG21 THR 49 66.168 11.604 -1.669
334 2HG2 THR 49 HG22 THR 49 65.287 10.300 -2.469
335 3HG2 THR 49 HG23 THR 49 66.851 9.979 -1.717
336 H SER 50 HN SER 50 64.741 6.268 -0.859
337 HA SER 50 HA SER 50 67.734 6.113 -0.898
338 1HB SER 50 HB2 SER 50 65.701 4.362 0.512
339 2HB SER 50 HB1 SER 50 67.405 3.948 0.363
340 HG SER 50 HG SER 50 66.194 5.613 2.090
341 H THR 51 HN THR 51 68.526 4.902 -2.606
342 HA THR 51 HA THR 51 66.560 3.735 -4.489
343 HB THR 51 HB THR 51 69.553 3.663 -4.751
344 HG1 THR 51 HG1 THR 51 69.547 5.805 -5.312
345 1HG2 THR 51 HG21 THR 51 68.357 2.703 -6.577
346 2HG2 THR 51 HG22 THR 51 68.872 4.300 -7.120
347 3HG2 THR 51 HG23 THR 51 67.203 4.036 -6.611
348 H SER 52 HN SER 52 66.329 1.525 -4.800
349 HA SER 52 HA SER 52 68.270 -0.367 -3.599
350 1HB SER 52 HB2 SER 52 66.643 -1.323 -2.110
351 2HB SER 52 HB1 SER 52 66.548 0.421 -1.874
352 HG SER 52 HG SER 52 64.890 0.158 -3.706
353 H THR 53 HN THR 53 68.434 -2.116 -4.979
354 HA THR 53 HA THR 53 66.184 -2.519 -6.923
355 HB THR 53 HB THR 53 68.732 -3.815 -7.528
356 HG1 THR 53 HG1 THR 53 68.839 -1.023 -7.620
357 1HG2 THR 53 HG21 THR 53 68.123 -1.760 -9.361
358 2HG2 THR 53 HG22 THR 53 66.570 -2.393 -8.808
359 3HG2 THR 53 HG23 THR 53 67.760 -3.479 -9.526
360 H GLY 54 HN GLY 54 64.927 -4.207 -6.230
361 1HA GLY 54 HA2 GLY 54 64.350 -6.276 -5.274
362 2HA GLY 54 HA1 GLY 54 65.819 -6.862 -6.064
363 H SER 55 HN SER 55 64.477 -5.634 -3.076
364 HA SER 55 HA SER 55 66.695 -6.865 -1.567
365 1HB SER 55 HB2 SER 55 67.318 -4.750 -0.505
366 2HB SER 55 HB1 SER 55 67.445 -4.573 -2.251
367 HG SER 55 HG SER 55 65.720 -3.394 -0.451
368 H ARG 56 HN ARG 56 65.682 -7.872 0.118
369 HA ARG 56 HA ARG 56 62.940 -7.114 0.863
370 1HB ARG 56 HB2 ARG 56 64.094 -9.461 0.604
371 2HB ARG 56 HB1 ARG 56 64.631 -9.159 2.259
372 1HG ARG 56 HG2 ARG 56 62.520 -9.310 3.123
373 2HG ARG 56 HG1 ARG 56 61.778 -8.590 1.691
374 1HD ARG 56 HD2 ARG 56 61.879 -10.653 0.484
375 2HD ARG 56 HD1 ARG 56 62.944 -11.392 1.700
376 HE ARG 56 HE ARG 56 60.152 -10.518 2.354
377 1HH1 ARG 56 HH1 ARG 56 61.783 -11.322 4.653
378 2HH1 ARG 56 HH1 ARG 56 61.464 -13.018 4.792
379 1HH2 ARG 56 HH2 ARG 56 60.185 -13.303 1.582
380 2HH2 ARG 56 HH2 ARG 56 60.556 -14.142 3.052
381 H ILE 57 HN ILE 57 62.984 -5.205 2.045
382 HA ILE 57 HA ILE 57 64.928 -4.859 4.236
383 HB ILE 57 HB ILE 57 62.616 -3.127 3.293
384 1HG1 ILE 57 HG12 ILE 57 65.243 -2.250 2.478
385 2HG1 ILE 57 HG11 ILE 57 64.970 -3.900 1.914
386 1HG2 ILE 57 HG21 ILE 57 65.183 -2.222 4.570
387 2HG2 ILE 57 HG22 ILE 57 63.855 -2.783 5.577
388 3HG2 ILE 57 HG23 ILE 57 63.627 -1.397 4.517
389 1HD1 ILE 57 HD1 ILE 57 64.149 -2.351 0.230
390 2HD1 ILE 57 HD1 ILE 57 63.172 -1.508 1.433
391 3HD1 ILE 57 HD1 ILE 57 62.773 -3.164 0.976
392 H SER 58 HN SER 58 62.648 -6.939 4.259
393 HA SER 58 HA SER 58 60.529 -6.401 5.965
394 1HB SER 58 HB2 SER 58 62.242 -8.635 5.244
395 2HB SER 58 HB1 SER 58 61.704 -8.775 6.916
396 HG SER 58 HG SER 58 60.323 -9.137 4.629
397 H GLY 59 HN GLY 59 60.318 -6.423 8.346
398 1HA GLY 59 HA2 GLY 59 62.333 -6.774 10.228
399 2HA GLY 59 HA1 GLY 59 62.536 -5.108 9.690
400 HA PRO 60 HA PRO 60 58.841 -5.715 12.666
401 1HB PRO 60 HB2 PRO 60 60.050 -5.750 15.124
402 2HB PRO 60 HB1 PRO 60 59.661 -7.228 14.218
403 1HG PRO 60 HG2 PRO 60 62.263 -5.815 14.509
404 2HG PRO 60 HG1 PRO 60 61.919 -7.549 14.460
405 1HD PRO 60 HD2 PRO 60 62.900 -6.145 12.335
406 2HD PRO 60 HD1 PRO 60 61.921 -7.621 12.176
407 H GLY 61 HN GLY 61 61.774 -3.849 12.590
408 1HA GLY 61 HA2 GLY 61 60.282 -1.377 13.100
409 2HA GLY 61 HA1 GLY 61 61.496 -1.754 14.326
410 H CYS 62 HN CYS 62 61.749 -2.489 10.882
411 HA CYS 62 HA CYS 62 64.418 -1.604 10.587
412 1HB CYS 62 HB2 CYS 62 62.222 -2.611 9.023
413 2HB CYS 62 HB1 CYS 62 63.047 -1.346 8.114
414 H LYS 63 HN LYS 63 65.236 0.249 9.356
415 HA LYS 63 HA LYS 63 63.509 2.601 8.947
416 1HB LYS 63 HB2 LYS 63 63.856 2.792 11.312
417 2HB LYS 63 HB1 LYS 63 65.559 2.341 11.163
418 1HG LYS 63 HG2 LYS 63 65.846 4.444 9.741
419 2HG LYS 63 HG1 LYS 63 64.240 4.920 10.283
420 1HD LYS 63 HD2 LYS 63 64.967 4.827 12.617
421 2HD LYS 63 HD1 LYS 63 66.561 4.261 12.119
422 1HE LYS 63 HE2 LYS 63 66.931 6.572 12.371
423 2HE LYS 63 HE1 LYS 63 66.547 6.462 10.642
424 1HZ LYS 63 HZ1 LYS 63 64.104 6.545 11.794
425 2HZ LYS 63 HZ2 LYS 63 64.901 7.886 11.122
426 3HZ LYS 63 HZ3 LYS 63 64.991 7.590 12.793
427 H ILE 64 HN ILE 64 64.338 3.219 6.933
428 HA ILE 64 HA ILE 64 67.328 3.339 6.698
429 HB ILE 64 HB ILE 64 65.264 2.498 4.642
430 1HG1 ILE 64 HG12 ILE 64 67.462 0.731 5.580
431 2HG1 ILE 64 HG11 ILE 64 66.140 1.023 6.710
432 1HG2 ILE 64 HG21 ILE 64 67.488 3.733 3.936
433 2HG2 ILE 64 HG22 ILE 64 66.995 2.270 3.089
434 3HG2 ILE 64 HG23 ILE 64 68.237 2.190 4.338
435 1HD1 ILE 64 HD1 ILE 64 66.169 -0.654 4.368
436 2HD1 ILE 64 HD1 ILE 64 64.926 0.590 4.207
437 3HD1 ILE 64 HD1 ILE 64 64.924 -0.483 5.605
438 H SER 65 HN SER 65 68.138 4.979 5.296
439 HA SER 65 HA SER 65 66.296 6.973 4.155
440 1HB SER 65 HB2 SER 65 66.370 8.319 5.973
441 2HB SER 65 HB1 SER 65 67.390 7.146 6.805
442 HG SER 65 HG SER 65 68.058 9.526 5.885
443 H THR 66 HN THR 66 67.257 7.600 2.262
444 HA THR 66 HA THR 66 68.915 7.910 0.614
445 HB THR 66 HB THR 66 70.849 8.515 2.822
446 HG1 THR 66 HG1 THR 66 68.353 9.709 2.389
447 1HG2 THR 66 HG21 THR 66 70.125 10.417 0.663
448 2HG2 THR 66 HG22 THR 66 70.881 8.907 0.151
449 3HG2 THR 66 HG23 THR 66 71.715 9.971 1.287
450 H CYS 67 HN CYS 67 68.928 5.474 0.369
451 HA CYS 67 HA CYS 67 71.654 4.395 1.017
452 1HB CYS 67 HB2 CYS 67 68.965 3.026 1.386
453 2HB CYS 67 HB1 CYS 67 70.523 2.225 1.549
454 H ILE 68 HN ILE 68 72.540 3.914 -0.985
455 HA ILE 68 HA ILE 68 70.715 3.302 -3.238
456 HB ILE 68 HB ILE 68 73.703 3.748 -2.978
457 1HG1 ILE 68 HG12 ILE 68 73.081 5.775 -4.382
458 2HG1 ILE 68 HG11 ILE 68 71.387 5.362 -4.098
459 1HG2 ILE 68 HG21 ILE 68 73.569 2.303 -4.809
460 2HG2 ILE 68 HG22 ILE 68 73.374 3.876 -5.586
461 3HG2 ILE 68 HG23 ILE 68 71.958 2.869 -5.254
462 1HD1 ILE 68 HD1 ILE 68 71.530 5.796 -1.801
463 2HD1 ILE 68 HD1 ILE 68 72.562 7.056 -2.484
464 3HD1 ILE 68 HD1 ILE 68 73.283 5.609 -1.778
465 H ILE 69 HN ILE 69 70.044 1.255 -2.272
466 HA ILE 69 HA ILE 69 72.043 -0.892 -2.006
467 HB ILE 69 HB ILE 69 69.028 -0.778 -1.679
468 1HG1 ILE 69 HG12 ILE 69 70.967 -1.002 0.596
469 2HG1 ILE 69 HG11 ILE 69 70.778 0.570 -0.176
470 1HG2 ILE 69 HG21 ILE 69 69.151 -2.920 -0.657
471 2HG2 ILE 69 HG22 ILE 69 70.911 -2.860 -0.558
472 3HG2 ILE 69 HG23 ILE 69 70.122 -3.065 -2.122
473 1HD1 ILE 69 HD1 ILE 69 68.361 -1.022 0.662
474 2HD1 ILE 69 HD1 ILE 69 68.501 0.716 0.389
475 3HD1 ILE 69 HD1 ILE 69 69.222 -0.013 1.824
476 H THR 70 HN THR 70 71.786 -2.934 -3.212
477 HA THR 70 HA THR 70 70.104 -2.912 -5.642
478 HB THR 70 HB THR 70 73.125 -2.672 -5.609
479 HG1 THR 70 HG1 THR 70 72.012 -1.124 -7.384
480 1HG2 THR 70 HG21 THR 70 72.216 -4.479 -7.180
481 2HG2 THR 70 HG22 THR 70 73.192 -3.212 -7.921
482 3HG2 THR 70 HG23 THR 70 71.436 -3.167 -8.063
483 H GLY 71 HN GLY 71 69.253 -4.947 -4.952
484 1HA GLY 71 HA2 GLY 71 69.383 -7.334 -5.293
485 2HA GLY 71 HA1 GLY 71 71.142 -7.212 -5.237
486 H GLY 72 HN GLY 72 69.509 -5.442 -2.811
487 1HA GLY 72 HA2 GLY 72 68.954 -6.056 -0.558
488 2HA GLY 72 HA1 GLY 72 69.629 -7.659 -0.849
489 H VAL 73 HN VAL 73 71.540 -5.076 -2.000
490 HA VAL 73 HA VAL 73 73.335 -5.277 0.406
491 HB VAL 73 HB VAL 73 75.183 -5.217 -1.189
492 1HG1 VAL 73 HG11 VAL 73 74.936 -7.437 -1.453
493 2HG1 VAL 73 HG12 VAL 73 73.761 -7.170 -2.742
494 3HG1 VAL 73 HG13 VAL 73 73.222 -7.281 -1.065
495 1HG2 VAL 73 HG21 VAL 73 74.495 -5.305 -3.680
496 2HG2 VAL 73 HG22 VAL 73 74.392 -3.742 -2.870
497 3HG2 VAL 73 HG23 VAL 73 72.931 -4.692 -3.138
498 HA PRO 74 HA PRO 74 72.866 -0.846 0.212
499 1HB PRO 74 HB2 PRO 74 74.441 -0.270 2.362
500 2HB PRO 74 HB1 PRO 74 72.798 -0.916 2.526
501 1HG PRO 74 HG2 PRO 74 75.404 -2.272 2.867
502 2HG PRO 74 HG1 PRO 74 73.853 -2.590 3.653
503 1HD PRO 74 HD2 PRO 74 74.963 -4.061 1.552
504 2HD PRO 74 HD1 PRO 74 73.273 -4.127 2.097
505 H ALA 75 HN ALA 75 74.079 0.715 -0.862
506 HA ALA 75 HA ALA 75 76.847 0.017 -1.661
507 1HB ALA 75 HB1 ALA 75 74.875 2.197 -2.414
508 2HB ALA 75 HB2 ALA 75 75.288 0.768 -3.361
509 3HB ALA 75 HB3 ALA 75 76.479 2.047 -3.129
510 HA PRO 76 HA PRO 76 78.755 2.785 1.165
511 1HB PRO 76 HB2 PRO 76 80.850 3.727 -0.328
512 2HB PRO 76 HB1 PRO 76 80.798 2.080 0.330
513 1HG PRO 76 HG2 PRO 76 80.197 3.033 -2.426
514 2HG PRO 76 HG1 PRO 76 81.044 1.571 -1.897
515 1HD PRO 76 HD2 PRO 76 78.456 1.568 -2.734
516 2HD PRO 76 HD1 PRO 76 79.100 0.405 -1.552
517 H SER 77 HN SER 77 76.616 4.122 0.585
518 HA SER 77 HA SER 77 77.028 6.498 -1.077
519 1HB SER 77 HB2 SER 77 74.860 5.254 -0.710
520 2HB SER 77 HB1 SER 77 74.864 5.843 0.950
521 HG SER 77 HG SER 77 75.086 7.554 -1.296
522 H ALA 78 HN ALA 78 78.301 5.701 1.843
523 HA ALA 78 HA ALA 78 78.975 6.938 3.758
524 1HB ALA 78 HB1 ALA 78 79.256 9.343 2.062
525 2HB ALA 78 HB2 ALA 78 79.968 7.877 1.384
526 3HB ALA 78 HB3 ALA 78 80.486 8.458 2.968
527 H ALA 79 HN ALA 79 76.085 7.026 3.109
528 HA ALA 79 HA ALA 79 75.384 9.403 4.738
529 1HB ALA 79 HB1 ALA 79 75.249 10.323 2.542
530 2HB ALA 79 HB2 ALA 79 73.587 9.901 2.950
531 3HB ALA 79 HB3 ALA 79 74.529 8.853 1.889
532 H CYS 80 HN CYS 80 74.347 6.476 3.008
533 HA CYS 80 HA CYS 80 71.797 6.056 4.086
534 1HB CYS 80 HB2 CYS 80 72.867 4.666 2.381
535 2HB CYS 80 HB1 CYS 80 74.074 4.124 3.533
536 H LYS 81 HN LYS 81 71.317 4.401 5.916
537 HA LYS 81 HA LYS 81 73.006 5.132 8.263
538 1HB LYS 81 HB2 LYS 81 70.924 4.596 9.526
539 2HB LYS 81 HB1 LYS 81 70.682 5.849 8.311
540 1HG LYS 81 HG2 LYS 81 68.873 4.518 7.796
541 2HG LYS 81 HG1 LYS 81 70.073 3.702 6.805
542 1HD LYS 81 HD2 LYS 81 70.506 2.431 9.136
543 2HD LYS 81 HD1 LYS 81 68.795 2.813 9.322
544 1HE LYS 81 HE2 LYS 81 68.734 1.919 6.775
545 2HE LYS 81 HE1 LYS 81 70.109 0.971 7.376
546 1HZ LYS 81 HZ1 LYS 81 67.559 0.298 7.794
547 2HZ LYS 81 HZ2 LYS 81 67.862 1.212 9.194
548 3HZ LYS 81 HZ3 LYS 81 68.827 -0.137 8.834
549 H ILE 82 HN ILE 82 71.426 2.303 6.730
550 HA ILE 82 HA ILE 82 71.724 -0.015 7.209
551 HB ILE 82 HB ILE 82 74.533 1.064 7.630
552 1HG1 ILE 82 HG12 ILE 82 73.562 2.001 5.585
553 2HG1 ILE 82 HG11 ILE 82 74.755 0.772 5.162
554 1HG2 ILE 82 HG21 ILE 82 74.200 -1.416 6.127
555 2HG2 ILE 82 HG22 ILE 82 73.556 -1.543 7.765
556 3HG2 ILE 82 HG23 ILE 82 75.238 -1.078 7.510
557 1HD1 ILE 82 HD1 ILE 82 72.739 0.461 3.809
558 2HD1 ILE 82 HD1 ILE 82 71.746 0.386 5.265
559 3HD1 ILE 82 HD1 ILE 82 72.917 -0.891 4.928
560 H SER 83 HN SER 83 70.499 0.622 9.369
561 HA SER 83 HA SER 83 72.298 -0.004 11.686
562 1HB SER 83 HB2 SER 83 71.546 2.334 11.640
563 2HB SER 83 HB1 SER 83 69.870 1.812 11.476
564 HG SER 83 HG SER 83 71.333 2.118 13.690
565 H GLY 84 HN GLY 84 69.131 0.305 12.704
566 1HA GLY 84 HA2 GLY 84 68.843 -2.508 13.227
567 2HA GLY 84 HA1 GLY 84 67.602 -1.284 13.490
568 H CYS 85 HN CYS 85 69.240 -2.737 10.632
569 HA CYS 85 HA CYS 85 66.662 -3.658 9.591
570 1HB CYS 85 HB2 CYS 85 67.034 -1.073 9.253
571 2HB CYS 85 HB1 CYS 85 68.103 -1.594 7.954
572 H THR 86 HN THR 86 67.194 -4.104 6.990
573 HA THR 86 HA THR 86 69.834 -4.857 6.224
574 HB THR 86 HB THR 86 69.760 -6.388 8.091
575 HG1 THR 86 HG1 THR 86 69.885 -8.348 6.978
576 1HG2 THR 86 HG21 THR 86 67.901 -8.004 8.359
577 2HG2 THR 86 HG22 THR 86 67.075 -7.267 6.984
578 3HG2 THR 86 HG23 THR 86 67.328 -6.339 8.462
579 H PHE 87 HN PHE 87 69.712 -6.483 4.311
580 HA PHE 87 HA PHE 87 66.990 -6.473 3.058
581 1HB PHE 87 HB2 PHE 87 69.315 -6.130 1.253
582 2HB PHE 87 HB1 PHE 87 67.736 -5.364 1.194
583 HD1 PHE 87 HD1 PHE 87 71.031 -4.614 1.401
584 HD2 PHE 87 HD2 PHE 87 67.404 -3.864 3.583
585 HE1 PHE 87 HE1 PHE 87 72.026 -2.571 2.368
586 HE2 PHE 87 HE2 PHE 87 68.410 -1.808 4.547
587 HZ PHE 87 HZ PHE 87 70.724 -1.162 3.936
588 H SER 88 HN SER 88 66.600 -8.280 1.672
589 HA SER 88 HA SER 88 68.753 -10.369 1.620
590 1HB SER 88 HB2 SER 88 66.752 -10.565 3.294
591 2HB SER 88 HB1 SER 88 65.813 -10.983 1.862
592 HG SER 88 HG SER 88 67.311 -12.653 1.467
593 H ALA 89 HN ALA 89 67.839 -8.382 -0.455
594 HA ALA 89 HA ALA 89 67.202 -8.369 -2.741
595 1HB ALA 89 HB1 ALA 89 69.259 -9.909 -2.451
596 2HB ALA 89 HB2 ALA 89 68.333 -10.082 -3.943
597 3HB ALA 89 HB3 ALA 89 68.122 -11.245 -2.633
598 H ASN 90 HN ASN 90 64.900 -8.569 -1.485
599 HA ASN 90 HA ASN 90 63.362 -10.906 -1.483
600 1HB ASN 90 HB2 ASN 90 61.609 -9.422 -1.125
601 2HB ASN 90 HB1 ASN 90 62.970 -8.347 -0.826
602 1HD2 ASN 90 HD2 ASN 90 63.841 -7.480 -3.215
603 2HD2 ASN 90 HD2 ASN 90 62.599 -6.799 -4.150
Start of MODEL 11
1 1H ASP 1 HT1 ASP 1 45.117 4.958 -1.917
2 2H ASP 1 HT2 ASP 1 45.323 4.065 -0.486
3 3H ASP 1 HT3 ASP 1 46.665 4.429 -1.463
4 HA ASP 1 HA ASP 1 45.115 6.234 0.297
5 1HB ASP 1 HB2 ASP 1 47.316 6.600 1.213
6 2HB ASP 1 HB1 ASP 1 47.130 4.859 1.000
7 H GLY 2 HN GLY 2 47.486 8.082 -0.121
8 1HA GLY 2 HA2 GLY 2 46.276 9.739 -2.157
9 2HA GLY 2 HA1 GLY 2 47.822 10.054 -1.367
10 H SER 3 HN SER 3 46.274 8.433 -4.080
11 HA SER 3 HA SER 3 47.185 7.542 -6.076
12 1HB SER 3 HB2 SER 3 49.222 9.694 -5.431
13 2HB SER 3 HB1 SER 3 48.854 9.054 -7.030
14 HG SER 3 HG SER 3 47.754 11.099 -6.049
15 H CYS 4 HN CYS 4 50.203 7.823 -6.523
16 HA CYS 4 HA CYS 4 52.172 6.575 -6.099
17 1HB CYS 4 HB2 CYS 4 51.273 7.145 -3.680
18 2HB CYS 4 HB1 CYS 4 50.873 5.427 -3.647
19 H THR 5 HN THR 5 52.823 4.492 -6.697
20 HA THR 5 HA THR 5 51.161 2.139 -6.459
21 HB THR 5 HB THR 5 51.273 3.677 -9.078
22 HG1 THR 5 HG1 THR 5 49.004 3.468 -8.870
23 1HG2 THR 5 HG21 THR 5 50.517 0.810 -8.492
24 2HG2 THR 5 HG22 THR 5 51.674 1.403 -9.681
25 3HG2 THR 5 HG23 THR 5 49.947 1.658 -9.927
26 H ASN 6 HN ASN 6 52.206 0.344 -7.838
27 HA ASN 6 HA ASN 6 55.042 0.953 -8.537
28 1HB ASN 6 HB2 ASN 6 55.628 -1.077 -7.100
29 2HB ASN 6 HB1 ASN 6 55.043 0.333 -6.210
30 1HD2 ASN 6 HD2 ASN 6 53.505 -2.512 -7.879
31 2HD2 ASN 6 HD2 ASN 6 52.411 -2.817 -6.623
32 H THR 7 HN THR 7 53.514 0.573 -10.629
33 HA THR 7 HA THR 7 53.222 -0.839 -12.519
34 HB THR 7 HB THR 7 54.613 -2.997 -10.934
35 HG1 THR 7 HG1 THR 7 56.468 -1.649 -12.106
36 1HG2 THR 7 HG21 THR 7 54.653 -2.101 -13.826
37 2HG2 THR 7 HG22 THR 7 53.944 -3.583 -13.185
38 3HG2 THR 7 HG23 THR 7 55.694 -3.365 -13.172
39 H ASN 8 HN ASN 8 51.628 -0.847 -9.843
40 HA ASN 8 HA ASN 8 49.542 -2.654 -10.612
41 1HB ASN 8 HB2 ASN 8 50.845 -4.512 -10.088
42 2HB ASN 8 HB1 ASN 8 51.777 -3.631 -8.878
43 1HD2 ASN 8 HD2 ASN 8 50.559 -3.063 -6.819
44 2HD2 ASN 8 HD2 ASN 8 49.347 -4.106 -6.277
45 H SER 9 HN SER 9 51.248 -1.241 -7.825
46 HA SER 9 HA SER 9 50.422 0.261 -6.176
47 1HB SER 9 HB2 SER 9 48.670 0.558 -8.219
48 2HB SER 9 HB1 SER 9 47.599 -0.141 -7.009
49 HG SER 9 HG SER 9 48.201 1.513 -5.596
50 H GLN 10 HN GLN 10 50.990 -1.510 -4.671
51 HA GLN 10 HA GLN 10 48.540 -2.859 -3.583
52 1HB GLN 10 HB2 GLN 10 50.829 -4.003 -4.782
53 2HB GLN 10 HB1 GLN 10 50.999 -4.287 -3.048
54 1HG GLN 10 HG2 GLN 10 48.281 -4.742 -3.665
55 2HG GLN 10 HG1 GLN 10 49.217 -5.571 -4.907
56 1HE2 GLN 10 HE21 GLN 10 47.825 -6.173 -1.991
57 2HE2 GLN 10 HE22 GLN 10 48.903 -7.330 -1.375
58 H LEU 11 HN LEU 11 50.319 -0.373 -2.967
59 HA LEU 11 HA LEU 11 51.799 -0.593 -0.616
60 1HB LEU 11 HB2 LEU 11 51.134 1.414 -2.129
61 2HB LEU 11 HB1 LEU 11 49.724 1.556 -1.083
62 HG LEU 11 HG LEU 11 51.037 2.057 0.818
63 1HD1 LEU 11 HD1 LEU 11 53.641 1.918 0.528
64 2HD1 LEU 11 HD1 LEU 11 53.255 0.784 -0.768
65 3HD1 LEU 11 HD1 LEU 11 52.730 0.451 0.886
66 1HD2 LEU 11 HD2 LEU 11 51.168 4.073 -0.274
67 2HD2 LEU 11 HD2 LEU 11 51.879 3.359 -1.722
68 3HD2 LEU 11 HD2 LEU 11 52.884 3.674 -0.308
69 H SER 12 HN SER 12 50.914 -2.273 0.724
70 HA SER 12 HA SER 12 48.376 -2.760 1.643
71 1HB SER 12 HB2 SER 12 50.698 -3.685 2.351
72 2HB SER 12 HB1 SER 12 50.669 -2.430 3.585
73 HG SER 12 HG SER 12 49.675 -4.072 4.567
74 H ALA 13 HN ALA 13 46.838 -1.703 2.866
75 HA ALA 13 HA ALA 13 46.733 1.068 3.158
76 1HB ALA 13 HB1 ALA 13 45.464 -1.294 4.496
77 2HB ALA 13 HB2 ALA 13 44.734 -0.088 3.436
78 3HB ALA 13 HB3 ALA 13 45.105 0.318 5.113
79 H ASN 14 HN ASN 14 48.584 -1.150 5.087
80 HA ASN 14 HA ASN 14 48.793 0.716 7.370
81 1HB ASN 14 HB2 ASN 14 48.646 -1.855 7.421
82 2HB ASN 14 HB1 ASN 14 50.318 -1.847 6.862
83 1HD2 ASN 14 HD2 ASN 14 51.702 -0.112 8.279
84 2HD2 ASN 14 HD2 ASN 14 51.505 -0.300 9.952
85 H SER 15 HN SER 15 50.245 0.448 4.345
86 HA SER 15 HA SER 15 52.971 1.170 5.217
87 1HB SER 15 HB2 SER 15 51.576 0.171 2.865
88 2HB SER 15 HB1 SER 15 52.693 1.462 2.445
89 HG SER 15 HG SER 15 53.542 -0.775 2.567
90 H LYS 16 HN LYS 16 53.516 3.009 3.084
91 HA LYS 16 HA LYS 16 51.673 5.281 3.258
92 1HB LYS 16 HB2 LYS 16 52.963 5.012 5.495
93 2HB LYS 16 HB1 LYS 16 54.371 5.563 4.590
94 1HG LYS 16 HG2 LYS 16 52.472 7.407 3.849
95 2HG LYS 16 HG1 LYS 16 52.031 7.084 5.525
96 1HD LYS 16 HD2 LYS 16 54.248 7.639 6.295
97 2HD LYS 16 HD1 LYS 16 54.855 7.736 4.643
98 1HE LYS 16 HE2 LYS 16 52.563 9.501 5.490
99 2HE LYS 16 HE1 LYS 16 54.234 9.967 5.868
100 1HZ LYS 16 HZ1 LYS 16 53.106 9.326 3.196
101 2HZ LYS 16 HZ2 LYS 16 54.770 9.489 3.496
102 3HZ LYS 16 HZ3 LYS 16 53.731 10.816 3.713
103 H CYS 17 HN CYS 17 52.415 7.053 1.904
104 HA CYS 17 HA CYS 17 54.894 6.558 0.322
105 1HB CYS 17 HB2 CYS 17 53.066 5.447 -0.848
106 2HB CYS 17 HB1 CYS 17 52.068 6.896 -0.733
107 H GLU 18 HN GLU 18 55.620 8.476 -0.801
108 HA GLU 18 HA GLU 18 54.316 10.994 -0.863
109 1HB GLU 18 HB2 GLU 18 55.221 10.115 1.733
110 2HB GLU 18 HB1 GLU 18 56.124 11.552 1.254
111 1HG GLU 18 HG2 GLU 18 53.669 12.343 0.501
112 2HG GLU 18 HG1 GLU 18 53.215 11.241 1.802
113 H LYS 19 HN LYS 19 55.473 11.447 -2.734
114 HA LYS 19 HA LYS 19 57.319 12.301 -3.961
115 1HB LYS 19 HB2 LYS 19 57.918 12.749 -1.269
116 2HB LYS 19 HB1 LYS 19 59.332 11.891 -1.882
117 1HG LYS 19 HG2 LYS 19 59.489 13.506 -3.754
118 2HG LYS 19 HG1 LYS 19 58.107 14.384 -3.095
119 1HD LYS 19 HD2 LYS 19 59.401 15.444 -1.586
120 2HD LYS 19 HD1 LYS 19 60.124 13.927 -1.053
121 1HE LYS 19 HE2 LYS 19 62.033 14.782 -1.989
122 2HE LYS 19 HE1 LYS 19 61.301 14.272 -3.524
123 1HZ LYS 19 HZ1 LYS 19 61.531 16.488 -3.941
124 2HZ LYS 19 HZ2 LYS 19 61.401 16.933 -2.306
125 3HZ LYS 19 HZ3 LYS 19 60.010 16.523 -3.191
126 H SER 20 HN SER 20 56.713 9.289 -3.163
127 HA SER 20 HA SER 20 59.355 8.133 -3.939
128 1HB SER 20 HB2 SER 20 56.975 6.488 -3.214
129 2HB SER 20 HB1 SER 20 58.663 6.263 -2.774
130 HG SER 20 HG SER 20 58.038 7.125 -0.956
131 H THR 21 HN THR 21 59.243 6.289 -5.533
132 HA THR 21 HA THR 21 57.226 6.866 -7.681
133 HB THR 21 HB THR 21 59.667 5.389 -8.385
134 HG1 THR 21 HG1 THR 21 60.510 7.863 -8.134
135 1HG2 THR 21 HG21 THR 21 59.419 7.936 -9.661
136 2HG2 THR 21 HG22 THR 21 57.806 7.234 -9.528
137 3HG2 THR 21 HG23 THR 21 59.092 6.341 -10.340
138 H LEU 22 HN LEU 22 59.094 4.238 -6.110
139 HA LEU 22 HA LEU 22 58.516 1.958 -5.806
140 1HB LEU 22 HB2 LEU 22 56.161 3.569 -5.741
141 2HB LEU 22 HB1 LEU 22 55.768 2.087 -6.612
142 HG LEU 22 HG LEU 22 56.722 0.763 -4.735
143 1HD1 LEU 22 HD1 LEU 22 57.299 1.877 -2.641
144 2HD1 LEU 22 HD1 LEU 22 56.909 3.450 -3.338
145 3HD1 LEU 22 HD1 LEU 22 58.292 2.535 -3.940
146 1HD2 LEU 22 HD2 LEU 22 54.946 1.697 -2.996
147 2HD2 LEU 22 HD2 LEU 22 54.419 0.933 -4.495
148 3HD2 LEU 22 HD2 LEU 22 54.459 2.690 -4.369
149 H THR 23 HN THR 23 57.993 0.031 -7.097
150 HA THR 23 HA THR 23 57.078 0.165 -9.830
151 HB THR 23 HB THR 23 60.024 0.331 -9.208
152 HG1 THR 23 HG1 THR 23 59.665 2.162 -10.129
153 1HG2 THR 23 HG21 THR 23 60.022 -0.236 -11.867
154 2HG2 THR 23 HG22 THR 23 58.727 -1.297 -11.313
155 3HG2 THR 23 HG23 THR 23 60.340 -1.435 -10.613
156 H ASN 24 HN ASN 24 56.135 -1.845 -9.918
157 HA ASN 24 HA ASN 24 55.813 -4.172 -9.579
158 1HB ASN 24 HB2 ASN 24 58.832 -3.874 -9.803
159 2HB ASN 24 HB1 ASN 24 58.033 -5.446 -9.750
160 1HD2 ASN 24 HD2 ASN 24 56.318 -5.812 -11.490
161 2HD2 ASN 24 HD2 ASN 24 56.545 -5.078 -13.004
162 H CYS 25 HN CYS 25 55.280 -3.040 -7.303
163 HA CYS 25 HA CYS 25 56.759 -4.612 -5.249
164 1HB CYS 25 HB2 CYS 25 56.643 -1.672 -5.648
165 2HB CYS 25 HB1 CYS 25 56.464 -2.231 -3.990
166 H TYR 26 HN TYR 26 55.561 -3.637 -3.016
167 HA TYR 26 HA TYR 26 52.641 -3.473 -3.340
168 1HB TYR 26 HB2 TYR 26 53.858 -5.736 -1.728
169 2HB TYR 26 HB1 TYR 26 52.187 -5.563 -2.270
170 HD1 TYR 26 HD1 TYR 26 55.567 -6.597 -3.183
171 HD2 TYR 26 HD2 TYR 26 51.602 -5.871 -4.667
172 HE1 TYR 26 HE1 TYR 26 56.125 -7.821 -5.265
173 HE2 TYR 26 HE2 TYR 26 52.158 -7.098 -6.748
174 HH TYR 26 HH TYR 26 53.729 -8.751 -7.543
175 H VAL 27 HN VAL 27 55.432 -3.877 -1.221
176 HA VAL 27 HA VAL 27 56.005 -2.874 0.827
177 HB VAL 27 HB VAL 27 53.979 -0.824 -0.098
178 1HG1 VAL 27 HG11 VAL 27 56.355 0.326 0.915
179 2HG1 VAL 27 HG12 VAL 27 55.927 -0.966 2.037
180 3HG1 VAL 27 HG13 VAL 27 54.767 0.315 1.681
181 1HG2 VAL 27 HG21 VAL 27 56.814 -1.384 -1.007
182 2HG2 VAL 27 HG22 VAL 27 56.008 0.158 -1.290
183 3HG2 VAL 27 HG23 VAL 27 55.360 -1.320 -2.004
184 H ASP 28 HN ASP 28 55.356 -3.129 2.926
185 HA ASP 28 HA ASP 28 52.485 -3.006 3.656
186 1HB ASP 28 HB2 ASP 28 53.755 -5.390 2.914
187 2HB ASP 28 HB1 ASP 28 53.737 -5.433 4.676
188 H LYS 29 HN LYS 29 52.344 -2.083 5.680
189 HA LYS 29 HA LYS 29 53.053 -1.195 7.749
190 1HB LYS 29 HB2 LYS 29 54.495 -3.835 7.503
191 2HB LYS 29 HB1 LYS 29 54.637 -2.845 8.952
192 1HG LYS 29 HG2 LYS 29 52.225 -2.902 9.278
193 2HG LYS 29 HG1 LYS 29 52.011 -3.783 7.765
194 1HD LYS 29 HD2 LYS 29 52.767 -5.765 8.651
195 2HD LYS 29 HD1 LYS 29 53.886 -4.962 9.753
196 1HE LYS 29 HE2 LYS 29 52.077 -5.948 11.069
197 2HE LYS 29 HE1 LYS 29 51.880 -4.185 11.093
198 1HZ LYS 29 HZ1 LYS 29 50.196 -6.174 9.912
199 2HZ LYS 29 HZ2 LYS 29 50.646 -4.985 8.785
200 3HZ LYS 29 HZ3 LYS 29 49.867 -4.541 10.228
201 H SER 30 HN SER 30 54.375 -0.285 5.355
202 HA SER 30 HA SER 30 57.097 0.340 6.458
203 1HB SER 30 HB2 SER 30 56.284 0.092 3.553
204 2HB SER 30 HB1 SER 30 57.919 0.186 4.196
205 HG SER 30 HG SER 30 57.463 -1.813 5.284
206 H GLU 31 HN GLU 31 57.957 2.433 5.457
207 HA GLU 31 HA GLU 31 55.728 4.431 5.212
208 1HB GLU 31 HB2 GLU 31 57.971 4.196 6.920
209 2HB GLU 31 HB1 GLU 31 58.339 5.523 5.817
210 1HG GLU 31 HG2 GLU 31 56.150 6.557 6.345
211 2HG GLU 31 HG1 GLU 31 55.816 5.246 7.477
212 H VAL 32 HN VAL 32 59.184 4.200 4.273
213 HA VAL 32 HA VAL 32 60.246 4.704 2.224
214 HB VAL 32 HB VAL 32 57.462 4.463 1.063
215 1HG1 VAL 32 HG11 VAL 32 59.314 5.171 -0.433
216 2HG1 VAL 32 HG12 VAL 32 58.691 3.579 -0.868
217 3HG1 VAL 32 HG13 VAL 32 60.212 3.720 0.015
218 1HG2 VAL 32 HG21 VAL 32 57.876 2.583 2.635
219 2HG2 VAL 32 HG22 VAL 32 59.394 2.237 1.807
220 3HG2 VAL 32 HG23 VAL 32 57.862 2.029 0.960
221 H TYR 33 HN TYR 33 60.709 6.626 1.070
222 HA TYR 33 HA TYR 33 58.673 8.786 0.978
223 1HB TYR 33 HB2 TYR 33 61.186 8.752 2.649
224 2HB TYR 33 HB1 TYR 33 60.505 10.277 2.090
225 HD1 TYR 33 HD1 TYR 33 60.237 7.590 4.493
226 HD2 TYR 33 HD2 TYR 33 58.087 10.808 2.635
227 HE1 TYR 33 HE1 TYR 33 58.563 7.526 6.322
228 HE2 TYR 33 HE2 TYR 33 56.412 10.743 4.460
229 HH TYR 33 HH TYR 33 56.883 8.808 7.325
230 H GLY 34 HN GLY 34 60.173 7.218 -1.057
231 1HA GLY 34 HA2 GLY 34 60.699 9.014 -3.036
232 2HA GLY 34 HA1 GLY 34 62.201 9.064 -2.115
233 H THR 35 HN THR 35 62.000 6.220 -1.353
234 HA THR 35 HA THR 35 63.632 4.909 -3.128
235 HB THR 35 HB THR 35 61.285 3.949 -1.484
236 HG1 THR 35 HG1 THR 35 62.984 4.720 -0.298
237 1HG2 THR 35 HG21 THR 35 61.565 2.251 -3.151
238 2HG2 THR 35 HG22 THR 35 62.378 1.672 -1.699
239 3HG2 THR 35 HG23 THR 35 63.323 2.339 -3.031
240 H THR 36 HN THR 36 63.352 3.566 -4.968
241 HA THR 36 HA THR 36 60.945 4.198 -6.606
242 HB THR 36 HB THR 36 63.634 2.916 -7.218
243 HG1 THR 36 HG1 THR 36 64.062 4.993 -7.000
244 1HG2 THR 36 HG21 THR 36 62.780 2.294 -9.197
245 2HG2 THR 36 HG22 THR 36 62.297 3.959 -9.522
246 3HG2 THR 36 HG23 THR 36 61.194 2.865 -8.685
247 H CYS 37 HN CYS 37 62.354 1.689 -4.718
248 HA CYS 37 HA CYS 37 61.763 -0.571 -4.378
249 1HB CYS 37 HB2 CYS 37 59.599 0.989 -4.178
250 2HB CYS 37 HB1 CYS 37 59.094 0.046 -5.581
251 H THR 38 HN THR 38 63.210 -1.255 -6.149
252 HA THR 38 HA THR 38 61.954 -1.731 -8.791
253 HB THR 38 HB THR 38 64.741 -2.443 -7.863
254 HG1 THR 38 HG1 THR 38 64.114 0.027 -9.025
255 1HG2 THR 38 HG21 THR 38 63.886 -3.167 -10.125
256 2HG2 THR 38 HG22 THR 38 65.304 -2.122 -10.188
257 3HG2 THR 38 HG23 THR 38 63.708 -1.460 -10.534
258 H GLY 39 HN GLY 39 60.585 -3.517 -8.616
259 1HA GLY 39 HA2 GLY 39 59.908 -5.728 -8.213
260 2HA GLY 39 HA1 GLY 39 61.553 -6.131 -8.698
261 H SER 40 HN SER 40 59.934 -4.714 -5.831
262 HA SER 40 HA SER 40 61.204 -6.778 -4.104
263 1HB SER 40 HB2 SER 40 62.832 -4.926 -4.325
264 2HB SER 40 HB1 SER 40 61.600 -3.778 -3.810
265 HG SER 40 HG SER 40 62.096 -4.290 -1.842
266 H ARG 41 HN ARG 41 60.561 -5.778 -1.651
267 HA ARG 41 HA ARG 41 57.929 -4.543 -1.539
268 1HB ARG 41 HB2 ARG 41 57.329 -6.757 -2.412
269 2HB ARG 41 HB1 ARG 41 58.219 -7.533 -1.100
270 1HG ARG 41 HG2 ARG 41 56.704 -6.261 0.509
271 2HG ARG 41 HG1 ARG 41 55.715 -5.848 -0.890
272 1HD ARG 41 HD2 ARG 41 54.881 -7.978 -1.083
273 2HD ARG 41 HD1 ARG 41 56.422 -8.723 -0.617
274 HE ARG 41 HE ARG 41 54.654 -7.364 1.385
275 1HH1 ARG 41 HH1 ARG 41 57.559 -8.532 1.738
276 2HH1 ARG 41 HH1 ARG 41 57.177 -9.971 2.624
277 1HH2 ARG 41 HH2 ARG 41 53.785 -9.814 1.929
278 2HH2 ARG 41 HH2 ARG 41 55.041 -10.696 2.732
279 H PHE 42 HN PHE 42 57.239 -4.259 0.693
280 HA PHE 42 HA PHE 42 59.429 -4.800 2.670
281 1HB PHE 42 HB2 PHE 42 57.357 -2.596 2.727
282 2HB PHE 42 HB1 PHE 42 58.849 -2.693 3.661
283 HD1 PHE 42 HD1 PHE 42 60.563 -3.764 1.292
284 HD2 PHE 42 HD2 PHE 42 57.847 -0.467 1.697
285 HE1 PHE 42 HE1 PHE 42 61.771 -2.545 -0.498
286 HE2 PHE 42 HE2 PHE 42 59.050 0.751 -0.091
287 HZ PHE 42 HZ PHE 42 61.015 -0.283 -1.186
288 H ASP 43 HN ASP 43 58.374 -4.578 5.002
289 HA ASP 43 HA ASP 43 55.625 -5.472 5.304
290 1HB ASP 43 HB2 ASP 43 57.369 -7.409 4.494
291 2HB ASP 43 HB1 ASP 43 57.519 -7.550 6.246
292 H GLY 44 HN GLY 44 57.224 -3.378 6.386
293 1HA GLY 44 HA2 GLY 44 56.684 -2.795 8.824
294 2HA GLY 44 HA1 GLY 44 57.582 -4.257 9.217
295 H VAL 45 HN VAL 45 58.171 -1.496 6.994
296 HA VAL 45 HA VAL 45 60.807 -1.153 8.383
297 HB VAL 45 HB VAL 45 61.931 -1.139 6.335
298 1HG1 VAL 45 HG11 VAL 45 59.517 -2.906 5.851
299 2HG1 VAL 45 HG12 VAL 45 61.016 -3.378 6.653
300 3HG1 VAL 45 HG13 VAL 45 61.022 -2.981 4.934
301 1HG2 VAL 45 HG21 VAL 45 61.028 0.415 4.926
302 2HG2 VAL 45 HG22 VAL 45 59.371 -0.035 5.326
303 3HG2 VAL 45 HG23 VAL 45 60.297 -1.006 4.179
304 H THR 46 HN THR 46 61.691 1.053 7.008
305 HA THR 46 HA THR 46 59.637 3.139 6.853
306 HB THR 46 HB THR 46 61.572 2.879 9.181
307 HG1 THR 46 HG1 THR 46 58.882 2.510 8.771
308 1HG2 THR 46 HG21 THR 46 60.600 5.247 7.884
309 2HG2 THR 46 HG22 THR 46 61.625 5.115 9.314
310 3HG2 THR 46 HG23 THR 46 59.870 5.126 9.485
311 H ILE 47 HN ILE 47 61.249 2.489 4.854
312 HA ILE 47 HA ILE 47 63.833 3.872 4.964
313 HB ILE 47 HB ILE 47 63.552 1.756 3.803
314 1HG1 ILE 47 HG12 ILE 47 63.749 3.829 1.617
315 2HG1 ILE 47 HG11 ILE 47 65.019 3.648 2.829
316 1HG2 ILE 47 HG21 ILE 47 61.440 1.435 3.014
317 2HG2 ILE 47 HG22 ILE 47 62.071 2.182 1.546
318 3HG2 ILE 47 HG23 ILE 47 61.185 3.154 2.719
319 1HD1 ILE 47 HD1 ILE 47 64.093 1.647 0.775
320 2HD1 ILE 47 HD1 ILE 47 64.962 1.136 2.223
321 3HD1 ILE 47 HD1 ILE 47 65.726 2.239 1.080
322 H THR 48 HN THR 48 64.363 5.350 3.039
323 HA THR 48 HA THR 48 62.072 7.173 2.414
324 HB THR 48 HB THR 48 63.563 9.043 2.855
325 HG1 THR 48 HG1 THR 48 65.682 8.779 3.116
326 1HG2 THR 48 HG21 THR 48 63.532 6.880 4.952
327 2HG2 THR 48 HG22 THR 48 62.580 8.362 4.883
328 3HG2 THR 48 HG23 THR 48 64.298 8.438 5.267
329 H THR 49 HN THR 49 63.744 8.923 0.857
330 HA THR 49 HA THR 49 63.645 7.870 -1.727
331 HB THR 49 HB THR 49 65.414 9.887 -0.330
332 HG1 THR 49 HG1 THR 49 64.048 11.193 -1.853
333 1HG2 THR 49 HG21 THR 49 65.352 9.183 -3.270
334 2HG2 THR 49 HG22 THR 49 66.749 9.162 -2.195
335 3HG2 THR 49 HG23 THR 49 66.003 10.696 -2.644
336 H SER 50 HN SER 50 64.434 5.606 -1.597
337 HA SER 50 HA SER 50 67.428 5.447 -1.433
338 1HB SER 50 HB2 SER 50 66.839 4.217 0.413
339 2HB SER 50 HB1 SER 50 65.217 3.898 -0.194
340 HG SER 50 HG SER 50 67.626 2.705 -1.119
341 H THR 51 HN THR 51 68.434 4.344 -3.097
342 HA THR 51 HA THR 51 66.795 3.696 -5.461
343 HB THR 51 HB THR 51 69.782 3.443 -5.021
344 HG1 THR 51 HG1 THR 51 69.808 5.517 -4.871
345 1HG2 THR 51 HG21 THR 51 67.932 3.371 -7.329
346 2HG2 THR 51 HG22 THR 51 69.512 2.615 -7.125
347 3HG2 THR 51 HG23 THR 51 69.399 4.321 -7.562
348 H SER 52 HN SER 52 67.028 1.950 -2.854
349 HA SER 52 HA SER 52 68.330 -0.444 -3.098
350 1HB SER 52 HB2 SER 52 66.605 -1.307 -1.744
351 2HB SER 52 HB1 SER 52 66.467 0.430 -1.494
352 HG SER 52 HG SER 52 64.444 -0.405 -1.974
353 H THR 53 HN THR 53 68.677 -1.677 -4.908
354 HA THR 53 HA THR 53 66.375 -2.044 -6.804
355 HB THR 53 HB THR 53 69.365 -2.379 -7.225
356 HG1 THR 53 HG1 THR 53 69.390 -0.328 -7.634
357 1HG2 THR 53 HG21 THR 53 68.168 -3.688 -8.829
358 2HG2 THR 53 HG22 THR 53 68.617 -2.194 -9.652
359 3HG2 THR 53 HG23 THR 53 66.969 -2.417 -9.066
360 H GLY 54 HN GLY 54 65.440 -3.851 -5.703
361 1HA GLY 54 HA2 GLY 54 65.192 -6.215 -5.554
362 2HA GLY 54 HA1 GLY 54 66.856 -6.395 -6.121
363 H SER 55 HN SER 55 64.947 -5.404 -3.285
364 HA SER 55 HA SER 55 66.949 -6.664 -1.515
365 1HB SER 55 HB2 SER 55 66.875 -4.310 -0.286
366 2HB SER 55 HB1 SER 55 67.985 -4.598 -1.623
367 HG SER 55 HG SER 55 65.395 -3.727 -2.211
368 H ARG 56 HN ARG 56 65.744 -7.739 0.000
369 HA ARG 56 HA ARG 56 62.931 -6.981 0.497
370 1HB ARG 56 HB2 ARG 56 64.409 -9.326 0.393
371 2HB ARG 56 HB1 ARG 56 64.171 -9.092 2.126
372 1HG ARG 56 HG2 ARG 56 61.745 -8.549 0.579
373 2HG ARG 56 HG1 ARG 56 62.321 -10.202 0.373
374 1HD ARG 56 HD2 ARG 56 62.613 -9.953 3.062
375 2HD ARG 56 HD1 ARG 56 61.212 -8.894 2.791
376 HE ARG 56 HE ARG 56 60.955 -11.336 1.270
377 1HH1 ARG 56 HH1 ARG 56 61.627 -11.482 4.444
378 2HH1 ARG 56 HH1 ARG 56 60.053 -11.962 4.990
379 1HH2 ARG 56 HH2 ARG 56 58.514 -11.301 1.951
380 2HH2 ARG 56 HH2 ARG 56 58.290 -11.858 3.577
381 H ILE 57 HN ILE 57 62.858 -5.135 1.839
382 HA ILE 57 HA ILE 57 64.687 -4.942 4.145
383 HB ILE 57 HB ILE 57 62.455 -3.156 3.134
384 1HG1 ILE 57 HG12 ILE 57 64.995 -2.008 2.719
385 2HG1 ILE 57 HG11 ILE 57 65.151 -3.686 2.204
386 1HG2 ILE 57 HG21 ILE 57 63.681 -1.421 4.485
387 2HG2 ILE 57 HG22 ILE 57 64.677 -2.717 5.141
388 3HG2 ILE 57 HG23 ILE 57 62.948 -2.687 5.471
389 1HD1 ILE 57 HD1 ILE 57 63.625 -1.491 0.984
390 2HD1 ILE 57 HD1 ILE 57 62.709 -2.990 1.150
391 3HD1 ILE 57 HD1 ILE 57 64.229 -2.980 0.259
392 H SER 58 HN SER 58 62.212 -6.875 3.752
393 HA SER 58 HA SER 58 60.127 -6.422 5.512
394 1HB SER 58 HB2 SER 58 61.752 -8.750 4.653
395 2HB SER 58 HB1 SER 58 60.798 -9.003 6.111
396 HG SER 58 HG SER 58 59.443 -9.477 4.465
397 H GLY 59 HN GLY 59 59.880 -6.334 7.772
398 1HA GLY 59 HA2 GLY 59 61.653 -7.336 9.716
399 2HA GLY 59 HA1 GLY 59 62.192 -5.696 9.364
400 HA PRO 60 HA PRO 60 58.407 -5.886 12.276
401 1HB PRO 60 HB2 PRO 60 59.701 -5.769 14.694
402 2HB PRO 60 HB1 PRO 60 59.224 -7.294 13.920
403 1HG PRO 60 HG2 PRO 60 61.884 -5.956 13.987
404 2HG PRO 60 HG1 PRO 60 61.484 -7.676 14.123
405 1HD PRO 60 HD2 PRO 60 62.426 -6.552 11.839
406 2HD PRO 60 HD1 PRO 60 61.335 -7.956 11.848
407 H GLY 61 HN GLY 61 61.077 -4.019 11.508
408 1HA GLY 61 HA2 GLY 61 59.833 -1.518 11.886
409 2HA GLY 61 HA1 GLY 61 60.828 -1.808 13.314
410 H CYS 62 HN CYS 62 61.665 -3.006 10.111
411 HA CYS 62 HA CYS 62 64.338 -2.196 10.127
412 1HB CYS 62 HB2 CYS 62 62.469 -3.350 8.372
413 2HB CYS 62 HB1 CYS 62 63.148 -1.984 7.485
414 H LYS 63 HN LYS 63 65.318 -0.227 10.028
415 HA LYS 63 HA LYS 63 63.683 2.133 9.152
416 1HB LYS 63 HB2 LYS 63 64.327 2.097 11.518
417 2HB LYS 63 HB1 LYS 63 66.017 1.840 11.069
418 1HG LYS 63 HG2 LYS 63 65.741 4.030 9.690
419 2HG LYS 63 HG1 LYS 63 64.331 4.311 10.720
420 1HD LYS 63 HD2 LYS 63 65.901 5.279 12.083
421 2HD LYS 63 HD1 LYS 63 66.135 3.609 12.605
422 1HE LYS 63 HE2 LYS 63 67.719 3.837 10.303
423 2HE LYS 63 HE1 LYS 63 67.993 5.349 11.194
424 1HZ LYS 63 HZ1 LYS 63 68.221 3.992 13.234
425 2HZ LYS 63 HZ2 LYS 63 69.440 3.681 12.090
426 3HZ LYS 63 HZ3 LYS 63 68.150 2.592 12.283
427 H ILE 64 HN ILE 64 64.410 3.154 7.314
428 HA ILE 64 HA ILE 64 67.315 2.960 6.643
429 HB ILE 64 HB ILE 64 65.030 2.547 4.700
430 1HG1 ILE 64 HG12 ILE 64 66.633 0.572 6.323
431 2HG1 ILE 64 HG11 ILE 64 64.888 0.670 6.144
432 1HG2 ILE 64 HG21 ILE 64 67.633 3.231 4.223
433 2HG2 ILE 64 HG22 ILE 64 66.613 2.339 3.092
434 3HG2 ILE 64 HG23 ILE 64 67.715 1.469 4.159
435 1HD1 ILE 64 HD1 ILE 64 65.127 0.072 3.739
436 2HD1 ILE 64 HD1 ILE 64 65.744 -1.190 4.805
437 3HD1 ILE 64 HD1 ILE 64 66.865 -0.106 3.981
438 H SER 65 HN SER 65 68.074 4.800 5.442
439 HA SER 65 HA SER 65 66.093 6.924 4.801
440 1HB SER 65 HB2 SER 65 67.263 8.532 6.191
441 2HB SER 65 HB1 SER 65 66.860 7.135 7.183
442 HG SER 65 HG SER 65 69.182 8.148 6.978
443 H THR 66 HN THR 66 66.599 7.101 2.653
444 HA THR 66 HA THR 66 67.865 7.500 0.712
445 HB THR 66 HB THR 66 69.748 8.907 2.596
446 HG1 THR 66 HG1 THR 66 68.245 10.335 3.029
447 1HG2 THR 66 HG21 THR 66 69.390 8.774 -0.218
448 2HG2 THR 66 HG22 THR 66 70.495 9.815 0.682
449 3HG2 THR 66 HG23 THR 66 68.870 10.382 0.293
450 H CYS 67 HN CYS 67 68.449 5.080 0.864
451 HA CYS 67 HA CYS 67 71.434 4.836 1.093
452 1HB CYS 67 HB2 CYS 67 70.026 3.766 2.950
453 2HB CYS 67 HB1 CYS 67 69.407 2.669 1.716
454 H ILE 68 HN ILE 68 72.216 4.386 -0.940
455 HA ILE 68 HA ILE 68 70.757 3.834 -3.253
456 HB ILE 68 HB ILE 68 73.537 3.244 -2.284
457 1HG1 ILE 68 HG12 ILE 68 74.107 4.864 -4.033
458 2HG1 ILE 68 HG11 ILE 68 72.432 4.886 -4.582
459 1HG2 ILE 68 HG21 ILE 68 73.649 2.761 -5.008
460 2HG2 ILE 68 HG22 ILE 68 72.183 1.911 -4.522
461 3HG2 ILE 68 HG23 ILE 68 73.723 1.526 -3.752
462 1HD1 ILE 68 HD1 ILE 68 73.288 5.647 -1.779
463 2HD1 ILE 68 HD1 ILE 68 71.687 5.844 -2.493
464 3HD1 ILE 68 HD1 ILE 68 73.040 6.813 -3.078
465 H ILE 69 HN ILE 69 72.729 1.244 -1.804
466 HA ILE 69 HA ILE 69 72.265 -1.052 -1.507
467 HB ILE 69 HB ILE 69 69.377 -0.159 -1.651
468 1HG1 ILE 69 HG12 ILE 69 71.356 0.082 0.639
469 2HG1 ILE 69 HG11 ILE 69 70.558 1.407 -0.205
470 1HG2 ILE 69 HG21 ILE 69 69.614 -2.548 -1.461
471 2HG2 ILE 69 HG22 ILE 69 69.192 -1.944 0.142
472 3HG2 ILE 69 HG23 ILE 69 70.860 -2.380 -0.224
473 1HD1 ILE 69 HD1 ILE 69 69.610 0.419 2.093
474 2HD1 ILE 69 HD1 ILE 69 68.814 -0.695 0.982
475 3HD1 ILE 69 HD1 ILE 69 68.545 1.043 0.835
476 H THR 70 HN THR 70 72.080 -2.777 -2.978
477 HA THR 70 HA THR 70 70.344 -2.599 -5.338
478 HB THR 70 HB THR 70 73.356 -2.303 -5.528
479 HG1 THR 70 HG1 THR 70 71.988 -0.455 -6.839
480 1HG2 THR 70 HG21 THR 70 71.359 -2.339 -7.799
481 2HG2 THR 70 HG22 THR 70 72.249 -3.774 -7.287
482 3HG2 THR 70 HG23 THR 70 73.120 -2.372 -7.906
483 H GLY 71 HN GLY 71 69.647 -4.754 -4.951
484 1HA GLY 71 HA2 GLY 71 69.908 -7.073 -5.550
485 2HA GLY 71 HA1 GLY 71 71.660 -6.848 -5.539
486 H GLY 72 HN GLY 72 69.798 -5.601 -2.893
487 1HA GLY 72 HA2 GLY 72 69.429 -6.486 -0.725
488 2HA GLY 72 HA1 GLY 72 70.200 -7.988 -1.222
489 H VAL 73 HN VAL 73 72.033 -5.339 -2.156
490 HA VAL 73 HA VAL 73 73.893 -5.698 0.171
491 HB VAL 73 HB VAL 73 75.620 -5.111 -1.480
492 1HG1 VAL 73 HG11 VAL 73 74.623 -6.954 -3.297
493 2HG1 VAL 73 HG12 VAL 73 73.746 -7.343 -1.816
494 3HG1 VAL 73 HG13 VAL 73 75.512 -7.346 -1.825
495 1HG2 VAL 73 HG21 VAL 73 73.220 -4.245 -2.995
496 2HG2 VAL 73 HG22 VAL 73 74.429 -5.105 -3.951
497 3HG2 VAL 73 HG23 VAL 73 74.877 -3.647 -3.069
498 HA PRO 74 HA PRO 74 72.790 -1.396 0.809
499 1HB PRO 74 HB2 PRO 74 74.142 -1.085 3.164
500 2HB PRO 74 HB1 PRO 74 72.562 -1.882 3.059
501 1HG PRO 74 HG2 PRO 74 75.256 -3.063 3.368
502 2HG PRO 74 HG1 PRO 74 73.694 -3.629 3.976
503 1HD PRO 74 HD2 PRO 74 75.026 -4.661 1.768
504 2HD PRO 74 HD1 PRO 74 73.300 -4.873 2.118
505 H ALA 75 HN ALA 75 73.876 0.215 -0.249
506 HA ALA 75 HA ALA 75 76.787 0.029 -0.659
507 1HB ALA 75 HB1 ALA 75 76.266 1.242 -2.507
508 2HB ALA 75 HB2 ALA 75 75.382 2.437 -1.558
509 3HB ALA 75 HB3 ALA 75 74.582 0.952 -2.074
510 HA PRO 76 HA PRO 76 77.692 2.692 2.745
511 1HB PRO 76 HB2 PRO 76 80.250 3.344 2.031
512 2HB PRO 76 HB1 PRO 76 79.808 1.761 2.704
513 1HG PRO 76 HG2 PRO 76 80.295 2.542 -0.128
514 2HG PRO 76 HG1 PRO 76 80.744 1.060 0.727
515 1HD PRO 76 HD2 PRO 76 78.616 1.230 -0.967
516 2HD PRO 76 HD1 PRO 76 78.697 0.093 0.397
517 H SER 77 HN SER 77 76.253 4.470 2.185
518 HA SER 77 HA SER 77 77.565 6.639 0.575
519 1HB SER 77 HB2 SER 77 75.309 5.317 -0.052
520 2HB SER 77 HB1 SER 77 74.615 6.547 1.001
521 HG SER 77 HG SER 77 74.831 7.099 -1.294
522 H ALA 78 HN ALA 78 77.464 8.754 1.450
523 HA ALA 78 HA ALA 78 77.420 9.037 4.299
524 1HB ALA 78 HB1 ALA 78 76.914 11.510 2.914
525 2HB ALA 78 HB2 ALA 78 78.028 10.531 1.959
526 3HB ALA 78 HB3 ALA 78 78.425 10.943 3.626
527 H ALA 79 HN ALA 79 74.838 8.852 2.052
528 HA ALA 79 HA ALA 79 72.975 10.342 3.851
529 1HB ALA 79 HB1 ALA 79 72.222 9.178 1.195
530 2HB ALA 79 HB2 ALA 79 73.333 10.546 1.223
531 3HB ALA 79 HB3 ALA 79 71.725 10.705 1.929
532 H CYS 80 HN CYS 80 73.870 7.129 2.888
533 HA CYS 80 HA CYS 80 71.338 5.817 3.427
534 1HB CYS 80 HB2 CYS 80 72.984 4.809 1.993
535 2HB CYS 80 HB1 CYS 80 74.229 4.955 3.217
536 H LYS 81 HN LYS 81 70.905 4.430 5.330
537 HA LYS 81 HA LYS 81 72.022 5.657 7.805
538 1HB LYS 81 HB2 LYS 81 69.925 5.258 8.692
539 2HB LYS 81 HB1 LYS 81 69.512 5.351 6.982
540 1HG LYS 81 HG2 LYS 81 70.073 2.787 8.499
541 2HG LYS 81 HG1 LYS 81 68.473 3.383 8.074
542 1HD LYS 81 HD2 LYS 81 68.920 3.157 5.724
543 2HD LYS 81 HD1 LYS 81 70.620 2.839 6.023
544 1HE LYS 81 HE2 LYS 81 69.419 0.900 7.556
545 2HE LYS 81 HE1 LYS 81 68.362 0.992 6.138
546 1HZ LYS 81 HZ1 LYS 81 70.641 1.161 4.903
547 2HZ LYS 81 HZ2 LYS 81 69.999 -0.354 5.327
548 3HZ LYS 81 HZ3 LYS 81 71.211 0.352 6.277
549 H ILE 82 HN ILE 82 72.347 2.717 6.053
550 HA ILE 82 HA ILE 82 72.945 0.493 6.758
551 HB ILE 82 HB ILE 82 75.062 2.266 7.998
552 1HG1 ILE 82 HG12 ILE 82 74.405 3.030 5.705
553 2HG1 ILE 82 HG11 ILE 82 76.053 2.408 5.773
554 1HG2 ILE 82 HG21 ILE 82 76.326 0.395 8.080
555 2HG2 ILE 82 HG22 ILE 82 75.872 -0.071 6.441
556 3HG2 ILE 82 HG23 ILE 82 74.835 -0.504 7.801
557 1HD1 ILE 82 HD1 ILE 82 74.926 1.497 3.806
558 2HD1 ILE 82 HD1 ILE 82 73.609 0.894 4.813
559 3HD1 ILE 82 HD1 ILE 82 75.223 0.202 4.967
560 H SER 83 HN SER 83 70.962 1.181 8.614
561 HA SER 83 HA SER 83 72.244 0.668 11.268
562 1HB SER 83 HB2 SER 83 69.509 1.723 10.496
563 2HB SER 83 HB1 SER 83 70.103 1.558 12.145
564 HG SER 83 HG SER 83 70.451 3.579 10.500
565 H GLY 84 HN GLY 84 69.863 -0.264 12.511
566 1HA GLY 84 HA2 GLY 84 70.055 -3.063 12.048
567 2HA GLY 84 HA1 GLY 84 68.773 -2.285 12.972
568 H CYS 85 HN CYS 85 69.630 -3.705 9.944
569 HA CYS 85 HA CYS 85 66.857 -3.988 9.192
570 1HB CYS 85 HB2 CYS 85 67.688 -1.529 8.727
571 2HB CYS 85 HB1 CYS 85 68.472 -2.263 7.335
572 H THR 86 HN THR 86 67.085 -4.501 6.488
573 HA THR 86 HA THR 86 69.503 -5.854 5.700
574 HB THR 86 HB THR 86 68.939 -7.364 7.505
575 HG1 THR 86 HG1 THR 86 69.267 -8.116 5.137
576 1HG2 THR 86 HG21 THR 86 66.799 -7.557 8.170
577 2HG2 THR 86 HG22 THR 86 66.430 -8.422 6.678
578 3HG2 THR 86 HG23 THR 86 66.268 -6.667 6.743
579 H PHE 87 HN PHE 87 69.194 -6.953 3.620
580 HA PHE 87 HA PHE 87 66.597 -6.198 2.313
581 1HB PHE 87 HB2 PHE 87 69.359 -6.466 1.101
582 2HB PHE 87 HB1 PHE 87 67.930 -5.784 0.330
583 HD1 PHE 87 HD1 PHE 87 70.713 -4.454 0.878
584 HD2 PHE 87 HD2 PHE 87 66.937 -4.366 2.917
585 HE1 PHE 87 HE1 PHE 87 71.270 -2.229 1.812
586 HE2 PHE 87 HE2 PHE 87 67.498 -2.142 3.862
587 HZ PHE 87 HZ PHE 87 69.664 -1.071 3.308
588 H SER 88 HN SER 88 69.328 -8.516 2.090
589 HA SER 88 HA SER 88 69.337 -10.800 1.484
590 1HB SER 88 HB2 SER 88 66.360 -10.549 2.017
591 2HB SER 88 HB1 SER 88 67.319 -12.024 2.070
592 HG SER 88 HG SER 88 66.841 -10.805 4.121
593 H ALA 89 HN ALA 89 68.263 -8.417 -0.362
594 HA ALA 89 HA ALA 89 67.649 -8.221 -2.630
595 1HB ALA 89 HB1 ALA 89 69.448 -10.288 -2.297
596 2HB ALA 89 HB2 ALA 89 68.933 -9.641 -3.856
597 3HB ALA 89 HB3 ALA 89 68.140 -11.070 -3.188
598 H ASN 90 HN ASN 90 65.517 -8.057 -3.174
599 HA ASN 90 HA ASN 90 63.844 -10.501 -3.305
600 1HB ASN 90 HB2 ASN 90 63.387 -9.915 -1.082
601 2HB ASN 90 HB1 ASN 90 63.499 -8.187 -1.398
602 1HD2 ASN 90 HD2 ASN 90 61.410 -7.426 -0.919
603 2HD2 ASN 90 HD2 ASN 90 59.985 -8.065 -1.584
Start of MODEL 12
1 1H ASP 1 HT1 ASP 1 44.866 6.292 1.413
2 2H ASP 1 HT2 ASP 1 45.009 7.705 0.480
3 3H ASP 1 HT3 ASP 1 44.660 7.811 2.139
4 HA ASP 1 HA ASP 1 46.819 7.853 2.650
5 1HB ASP 1 HB2 ASP 1 46.811 5.345 0.938
6 2HB ASP 1 HB1 ASP 1 48.165 5.839 1.955
7 H GLY 2 HN GLY 2 46.939 6.590 -0.703
8 1HA GLY 2 HA2 GLY 2 47.911 9.137 -1.744
9 2HA GLY 2 HA1 GLY 2 49.170 7.905 -1.642
10 H SER 3 HN SER 3 48.877 8.531 -4.127
11 HA SER 3 HA SER 3 47.040 6.470 -5.299
12 1HB SER 3 HB2 SER 3 47.734 9.223 -6.373
13 2HB SER 3 HB1 SER 3 46.618 8.077 -7.111
14 HG SER 3 HG SER 3 45.163 8.872 -5.838
15 H CYS 4 HN CYS 4 49.742 5.928 -4.665
16 HA CYS 4 HA CYS 4 51.465 6.402 -6.977
17 1HB CYS 4 HB2 CYS 4 51.801 4.326 -4.802
18 2HB CYS 4 HB1 CYS 4 53.060 5.190 -5.682
19 H THR 5 HN THR 5 50.199 3.385 -5.529
20 HA THR 5 HA THR 5 49.279 1.468 -6.573
21 HB THR 5 HB THR 5 49.769 2.823 -9.224
22 HG1 THR 5 HG1 THR 5 47.781 3.862 -8.893
23 1HG2 THR 5 HG21 THR 5 48.713 0.394 -8.582
24 2HG2 THR 5 HG22 THR 5 48.281 1.304 -10.030
25 3HG2 THR 5 HG23 THR 5 47.262 1.396 -8.593
26 H ASN 6 HN ASN 6 52.366 2.806 -7.309
27 HA ASN 6 HA ASN 6 54.312 1.831 -8.285
28 1HB ASN 6 HB2 ASN 6 54.937 -0.067 -6.917
29 2HB ASN 6 HB1 ASN 6 53.984 1.024 -5.911
30 1HD2 ASN 6 HD2 ASN 6 52.073 0.193 -4.988
31 2HD2 ASN 6 HD2 ASN 6 51.433 -1.336 -5.350
32 H THR 7 HN THR 7 52.062 1.502 -10.065
33 HA THR 7 HA THR 7 51.647 0.285 -12.058
34 HB THR 7 HB THR 7 53.686 -1.750 -11.245
35 HG1 THR 7 HG1 THR 7 55.186 0.005 -12.106
36 1HG2 THR 7 HG21 THR 7 53.996 -1.953 -13.500
37 2HG2 THR 7 HG22 THR 7 53.803 -0.224 -13.786
38 3HG2 THR 7 HG23 THR 7 52.382 -1.244 -13.561
39 H ASN 8 HN ASN 8 50.220 -0.315 -9.527
40 HA ASN 8 HA ASN 8 48.682 -2.552 -10.275
41 1HB ASN 8 HB2 ASN 8 50.444 -4.064 -10.102
42 2HB ASN 8 HB1 ASN 8 51.228 -3.159 -8.806
43 1HD2 ASN 8 HD2 ASN 8 50.002 -3.183 -6.646
44 2HD2 ASN 8 HD2 ASN 8 49.139 -4.576 -6.237
45 H SER 9 HN SER 9 50.224 -1.087 -7.416
46 HA SER 9 HA SER 9 49.227 -0.115 -5.507
47 1HB SER 9 HB2 SER 9 47.216 -0.148 -7.521
48 2HB SER 9 HB1 SER 9 46.459 -0.697 -6.033
49 HG SER 9 HG SER 9 47.133 1.169 -5.030
50 H GLN 10 HN GLN 10 50.076 -1.884 -4.219
51 HA GLN 10 HA GLN 10 47.959 -3.842 -3.408
52 1HB GLN 10 HB2 GLN 10 50.392 -4.331 -4.760
53 2HB GLN 10 HB1 GLN 10 50.655 -4.846 -3.093
54 1HG GLN 10 HG2 GLN 10 48.562 -6.171 -3.190
55 2HG GLN 10 HG1 GLN 10 48.369 -5.711 -4.883
56 1HE2 GLN 10 HE21 GLN 10 49.363 -7.069 -6.391
57 2HE2 GLN 10 HE22 GLN 10 50.566 -8.208 -6.023
58 H LEU 11 HN LEU 11 49.260 -1.188 -2.377
59 HA LEU 11 HA LEU 11 50.835 -1.394 -0.153
60 1HB LEU 11 HB2 LEU 11 48.349 0.148 -0.788
61 2HB LEU 11 HB1 LEU 11 49.037 0.297 0.826
62 HG LEU 11 HG LEU 11 50.042 2.036 -0.404
63 1HD1 LEU 11 HD1 LEU 11 51.595 0.062 0.652
64 2HD1 LEU 11 HD1 LEU 11 52.218 1.593 0.035
65 3HD1 LEU 11 HD1 LEU 11 52.228 0.158 -0.992
66 1HD2 LEU 11 HD2 LEU 11 50.527 1.993 -2.653
67 2HD2 LEU 11 HD2 LEU 11 49.319 0.709 -2.623
68 3HD2 LEU 11 HD2 LEU 11 51.036 0.305 -2.613
69 H SER 12 HN SER 12 50.762 -3.249 1.072
70 HA SER 12 HA SER 12 48.186 -4.255 2.119
71 1HB SER 12 HB2 SER 12 50.894 -5.190 1.678
72 2HB SER 12 HB1 SER 12 50.382 -5.561 3.322
73 HG SER 12 HG SER 12 49.157 -6.271 0.869
74 H ALA 13 HN ALA 13 47.949 -4.573 4.520
75 HA ALA 13 HA ALA 13 47.837 -3.587 6.672
76 1HB ALA 13 HB1 ALA 13 49.999 -4.654 6.801
77 2HB ALA 13 HB2 ALA 13 50.178 -3.049 7.510
78 3HB ALA 13 HB3 ALA 13 50.752 -3.359 5.872
79 H ASN 14 HN ASN 14 49.392 -1.382 7.670
80 HA ASN 14 HA ASN 14 47.983 0.833 6.315
81 1HB ASN 14 HB2 ASN 14 48.371 1.979 8.353
82 2HB ASN 14 HB1 ASN 14 48.119 0.304 8.835
83 1HD2 ASN 14 HD2 ASN 14 50.928 -0.369 7.710
84 2HD2 ASN 14 HD2 ASN 14 51.984 0.181 8.916
85 H SER 15 HN SER 15 49.840 0.129 4.489
86 HA SER 15 HA SER 15 52.493 1.111 4.760
87 1HB SER 15 HB2 SER 15 52.536 0.856 2.406
88 2HB SER 15 HB1 SER 15 51.294 -0.280 2.923
89 HG SER 15 HG SER 15 49.785 1.494 2.540
90 H LYS 16 HN LYS 16 52.946 3.043 2.879
91 HA LYS 16 HA LYS 16 51.158 5.353 3.357
92 1HB LYS 16 HB2 LYS 16 53.003 4.881 5.226
93 2HB LYS 16 HB1 LYS 16 54.051 5.691 4.061
94 1HG LYS 16 HG2 LYS 16 52.341 7.561 3.975
95 2HG LYS 16 HG1 LYS 16 51.536 6.787 5.340
96 1HD LYS 16 HD2 LYS 16 53.407 7.109 6.767
97 2HD LYS 16 HD1 LYS 16 54.473 7.486 5.413
98 1HE LYS 16 HE2 LYS 16 52.974 9.518 4.971
99 2HE LYS 16 HE1 LYS 16 52.259 9.203 6.565
100 1HZ LYS 16 HZ1 LYS 16 54.237 9.569 7.638
101 2HZ LYS 16 HZ2 LYS 16 54.379 10.687 6.367
102 3HZ LYS 16 HZ3 LYS 16 55.183 9.192 6.282
103 H CYS 17 HN CYS 17 51.467 6.979 1.754
104 HA CYS 17 HA CYS 17 53.589 6.397 -0.288
105 1HB CYS 17 HB2 CYS 17 50.728 6.326 -0.452
106 2HB CYS 17 HB1 CYS 17 51.311 7.645 -1.468
107 H GLU 18 HN GLU 18 54.030 8.358 -1.684
108 HA GLU 18 HA GLU 18 53.259 11.013 -0.867
109 1HB GLU 18 HB2 GLU 18 55.252 9.628 0.686
110 2HB GLU 18 HB1 GLU 18 56.012 10.993 -0.131
111 1HG GLU 18 HG2 GLU 18 54.089 12.427 0.702
112 2HG GLU 18 HG1 GLU 18 53.604 11.056 1.702
113 H LYS 19 HN LYS 19 55.825 12.248 -1.497
114 HA LYS 19 HA LYS 19 55.728 12.073 -4.403
115 1HB LYS 19 HB2 LYS 19 56.537 13.881 -2.433
116 2HB LYS 19 HB1 LYS 19 58.042 13.409 -3.223
117 1HG LYS 19 HG2 LYS 19 55.574 14.602 -4.504
118 2HG LYS 19 HG1 LYS 19 57.206 15.270 -4.471
119 1HD LYS 19 HD2 LYS 19 57.750 12.917 -5.652
120 2HD LYS 19 HD1 LYS 19 56.079 13.108 -6.182
121 1HE LYS 19 HE2 LYS 19 56.547 15.021 -7.426
122 2HE LYS 19 HE1 LYS 19 57.948 15.451 -6.426
123 1HZ LYS 19 HZ1 LYS 19 57.772 13.595 -8.649
124 2HZ LYS 19 HZ2 LYS 19 58.655 13.030 -7.313
125 3HZ LYS 19 HZ3 LYS 19 59.102 14.479 -8.080
126 H SER 20 HN SER 20 56.304 9.516 -3.678
127 HA SER 20 HA SER 20 59.269 9.216 -4.000
128 1HB SER 20 HB2 SER 20 57.978 8.294 -1.980
129 2HB SER 20 HB1 SER 20 57.247 7.150 -3.101
130 HG SER 20 HG SER 20 59.372 6.474 -3.642
131 H THR 21 HN THR 21 59.861 7.210 -5.325
132 HA THR 21 HA THR 21 58.094 7.069 -7.734
133 HB THR 21 HB THR 21 60.834 5.930 -7.740
134 HG1 THR 21 HG1 THR 21 61.271 8.450 -8.037
135 1HG2 THR 21 HG21 THR 21 59.427 6.209 -9.769
136 2HG2 THR 21 HG22 THR 21 60.930 7.125 -9.875
137 3HG2 THR 21 HG23 THR 21 59.418 7.952 -9.500
138 H LEU 22 HN LEU 22 56.698 5.345 -7.417
139 HA LEU 22 HA LEU 22 57.825 2.796 -6.327
140 1HB LEU 22 HB2 LEU 22 55.127 4.120 -6.439
141 2HB LEU 22 HB1 LEU 22 55.232 2.376 -6.206
142 HG LEU 22 HG LEU 22 55.156 3.494 -4.032
143 1HD1 LEU 22 HD1 LEU 22 56.943 2.339 -3.045
144 2HD1 LEU 22 HD1 LEU 22 58.031 2.679 -4.391
145 3HD1 LEU 22 HD1 LEU 22 56.743 1.490 -4.578
146 1HD2 LEU 22 HD2 LEU 22 57.811 4.767 -4.381
147 2HD2 LEU 22 HD2 LEU 22 56.394 5.341 -3.501
148 3HD2 LEU 22 HD2 LEU 22 56.483 5.534 -5.252
149 H THR 23 HN THR 23 57.587 0.875 -7.511
150 HA THR 23 HA THR 23 56.038 0.793 -10.002
151 HB THR 23 HB THR 23 59.055 0.525 -10.119
152 HG1 THR 23 HG1 THR 23 58.963 2.602 -11.078
153 1HG2 THR 23 HG21 THR 23 58.681 0.701 -12.536
154 2HG2 THR 23 HG22 THR 23 56.947 0.880 -12.265
155 3HG2 THR 23 HG23 THR 23 57.749 -0.640 -11.867
156 H ASN 24 HN ASN 24 55.181 -1.230 -9.878
157 HA ASN 24 HA ASN 24 55.007 -3.554 -9.510
158 1HB ASN 24 HB2 ASN 24 57.877 -3.002 -10.172
159 2HB ASN 24 HB1 ASN 24 57.451 -4.618 -9.613
160 1HD2 ASN 24 HD2 ASN 24 58.257 -4.791 -12.121
161 2HD2 ASN 24 HD2 ASN 24 56.983 -4.822 -13.243
162 H CYS 25 HN CYS 25 54.543 -2.446 -7.194
163 HA CYS 25 HA CYS 25 56.242 -3.942 -5.242
164 1HB CYS 25 HB2 CYS 25 56.022 -1.056 -5.651
165 2HB CYS 25 HB1 CYS 25 55.610 -1.521 -4.003
166 H TYR 26 HN TYR 26 55.137 -3.923 -3.038
167 HA TYR 26 HA TYR 26 52.155 -3.788 -3.279
168 1HB TYR 26 HB2 TYR 26 53.690 -5.845 -1.675
169 2HB TYR 26 HB1 TYR 26 52.008 -5.912 -2.199
170 HD1 TYR 26 HD1 TYR 26 55.120 -7.277 -2.806
171 HD2 TYR 26 HD2 TYR 26 51.820 -5.525 -4.924
172 HE1 TYR 26 HE1 TYR 26 55.810 -8.470 -4.868
173 HE2 TYR 26 HE2 TYR 26 52.509 -6.717 -6.986
174 HH TYR 26 HH TYR 26 54.133 -9.182 -7.224
175 H VAL 27 HN VAL 27 54.993 -3.818 -1.194
176 HA VAL 27 HA VAL 27 55.406 -2.893 0.935
177 HB VAL 27 HB VAL 27 53.432 -0.822 -0.011
178 1HG1 VAL 27 HG11 VAL 27 55.626 0.480 0.920
179 2HG1 VAL 27 HG12 VAL 27 55.694 -0.988 1.897
180 3HG1 VAL 27 HG13 VAL 27 54.256 0.032 1.937
181 1HG2 VAL 27 HG21 VAL 27 56.062 -1.651 -1.172
182 2HG2 VAL 27 HG22 VAL 27 55.701 0.073 -1.097
183 3HG2 VAL 27 HG23 VAL 27 54.630 -1.013 -1.983
184 H ASP 28 HN ASP 28 54.574 -3.897 2.715
185 HA ASP 28 HA ASP 28 51.631 -3.855 3.181
186 1HB ASP 28 HB2 ASP 28 53.972 -5.359 4.387
187 2HB ASP 28 HB1 ASP 28 52.318 -5.529 4.965
188 H LYS 29 HN LYS 29 53.968 -4.036 5.783
189 HA LYS 29 HA LYS 29 52.788 -1.587 6.983
190 1HB LYS 29 HB2 LYS 29 53.934 -4.108 7.850
191 2HB LYS 29 HB1 LYS 29 54.727 -2.760 8.666
192 1HG LYS 29 HG2 LYS 29 52.023 -2.070 8.694
193 2HG LYS 29 HG1 LYS 29 52.030 -3.802 9.033
194 1HD LYS 29 HD2 LYS 29 54.162 -2.703 10.529
195 2HD LYS 29 HD1 LYS 29 52.788 -1.622 10.765
196 1HE LYS 29 HE2 LYS 29 51.392 -3.429 11.541
197 2HE LYS 29 HE1 LYS 29 52.603 -4.638 11.068
198 1HZ LYS 29 HZ1 LYS 29 53.380 -2.435 12.852
199 2HZ LYS 29 HZ2 LYS 29 54.039 -3.994 12.721
200 3HZ LYS 29 HZ3 LYS 29 52.549 -3.762 13.504
201 H SER 30 HN SER 30 54.064 -0.421 5.107
202 HA SER 30 HA SER 30 56.762 0.314 6.187
203 1HB SER 30 HB2 SER 30 56.231 0.197 3.244
204 2HB SER 30 HB1 SER 30 57.739 -0.061 4.111
205 HG SER 30 HG SER 30 57.226 -2.095 4.396
206 H GLU 31 HN GLU 31 57.475 2.316 4.582
207 HA GLU 31 HA GLU 31 55.137 4.176 4.344
208 1HB GLU 31 HB2 GLU 31 57.492 4.259 6.132
209 2HB GLU 31 HB1 GLU 31 57.144 5.777 5.303
210 1HG GLU 31 HG2 GLU 31 54.729 5.497 6.055
211 2HG GLU 31 HG1 GLU 31 55.292 4.184 7.090
212 H VAL 32 HN VAL 32 58.695 4.374 3.964
213 HA VAL 32 HA VAL 32 59.997 4.870 2.049
214 HB VAL 32 HB VAL 32 57.450 4.643 0.445
215 1HG1 VAL 32 HG11 VAL 32 58.859 4.121 -1.307
216 2HG1 VAL 32 HG12 VAL 32 60.069 3.388 -0.253
217 3HG1 VAL 32 HG13 VAL 32 59.943 5.144 -0.364
218 1HG2 VAL 32 HG21 VAL 32 58.562 2.650 2.243
219 2HG2 VAL 32 HG22 VAL 32 58.646 2.095 0.572
220 3HG2 VAL 32 HG23 VAL 32 57.096 2.566 1.267
221 H TYR 33 HN TYR 33 60.474 6.779 0.819
222 HA TYR 33 HA TYR 33 58.424 8.959 0.901
223 1HB TYR 33 HB2 TYR 33 61.223 8.875 2.023
224 2HB TYR 33 HB1 TYR 33 60.478 10.411 1.582
225 HD1 TYR 33 HD1 TYR 33 60.362 7.536 3.871
226 HD2 TYR 33 HD2 TYR 33 58.517 11.257 2.780
227 HE1 TYR 33 HE1 TYR 33 59.110 7.541 6.011
228 HE2 TYR 33 HE2 TYR 33 57.264 11.263 4.920
229 HH TYR 33 HH TYR 33 57.154 10.312 6.986
230 H GLY 34 HN GLY 34 61.674 8.025 -0.301
231 1HA GLY 34 HA2 GLY 34 60.938 9.248 -2.920
232 2HA GLY 34 HA1 GLY 34 62.470 9.691 -2.164
233 H THR 35 HN THR 35 61.419 6.455 -1.635
234 HA THR 35 HA THR 35 63.756 5.326 -2.883
235 HB THR 35 HB THR 35 61.120 4.181 -1.918
236 HG1 THR 35 HG1 THR 35 63.701 4.516 -0.823
237 1HG2 THR 35 HG21 THR 35 61.912 2.503 -3.351
238 2HG2 THR 35 HG22 THR 35 62.603 2.045 -1.794
239 3HG2 THR 35 HG23 THR 35 63.601 2.866 -2.995
240 H THR 36 HN THR 36 63.693 3.761 -4.710
241 HA THR 36 HA THR 36 61.607 4.483 -6.747
242 HB THR 36 HB THR 36 64.462 3.627 -7.272
243 HG1 THR 36 HG1 THR 36 64.440 6.117 -7.644
244 1HG2 THR 36 HG21 THR 36 62.244 4.915 -8.847
245 2HG2 THR 36 HG22 THR 36 63.212 3.499 -9.258
246 3HG2 THR 36 HG23 THR 36 63.927 5.110 -9.338
247 H CYS 37 HN CYS 37 60.683 2.452 -5.418
248 HA CYS 37 HA CYS 37 61.592 -0.147 -5.526
249 1HB CYS 37 HB2 CYS 37 59.468 0.349 -4.563
250 2HB CYS 37 HB1 CYS 37 58.874 1.069 -6.057
251 H THR 38 HN THR 38 62.870 -0.704 -7.369
252 HA THR 38 HA THR 38 61.696 -0.381 -10.070
253 HB THR 38 HB THR 38 64.294 -1.665 -9.166
254 HG1 THR 38 HG1 THR 38 64.956 0.575 -10.000
255 1HG2 THR 38 HG21 THR 38 63.108 -1.725 -11.626
256 2HG2 THR 38 HG22 THR 38 64.852 -1.794 -11.367
257 3HG2 THR 38 HG23 THR 38 64.078 -0.256 -11.751
258 H GLY 39 HN GLY 39 60.733 -2.329 -7.846
259 1HA GLY 39 HA2 GLY 39 59.407 -4.293 -8.792
260 2HA GLY 39 HA1 GLY 39 60.952 -4.845 -9.441
261 H SER 40 HN SER 40 60.118 -3.474 -6.247
262 HA SER 40 HA SER 40 61.155 -6.003 -5.013
263 1HB SER 40 HB2 SER 40 62.309 -4.629 -3.422
264 2HB SER 40 HB1 SER 40 62.643 -3.928 -5.001
265 HG SER 40 HG SER 40 61.992 -2.373 -3.419
266 H ARG 41 HN ARG 41 60.600 -5.090 -2.338
267 HA ARG 41 HA ARG 41 57.814 -4.274 -2.092
268 1HB ARG 41 HB2 ARG 41 57.063 -6.545 -1.292
269 2HB ARG 41 HB1 ARG 41 57.490 -6.507 -3.003
270 1HG ARG 41 HG2 ARG 41 59.537 -7.613 -2.646
271 2HG ARG 41 HG1 ARG 41 59.545 -7.234 -0.924
272 1HD ARG 41 HD2 ARG 41 57.213 -8.666 -1.132
273 2HD ARG 41 HD1 ARG 41 58.235 -9.473 -2.338
274 HE ARG 41 HE ARG 41 59.957 -9.740 -0.549
275 1HH1 ARG 41 HH2 ARG 41 57.862 -7.748 0.962
276 2HH1 ARG 41 HH2 ARG 41 57.511 -8.776 2.313
277 1HH2 ARG 41 HH1 ARG 41 59.028 -11.567 0.922
278 2HH2 ARG 41 HH1 ARG 41 58.171 -10.936 2.290
279 H PHE 42 HN PHE 42 57.212 -4.061 0.167
280 HA PHE 42 HA PHE 42 59.491 -4.470 2.082
281 1HB PHE 42 HB2 PHE 42 57.353 -2.343 2.282
282 2HB PHE 42 HB1 PHE 42 58.939 -2.369 3.051
283 HD1 PHE 42 HD1 PHE 42 57.358 -0.445 0.898
284 HD2 PHE 42 HD2 PHE 42 60.705 -3.135 0.820
285 HE1 PHE 42 HE1 PHE 42 58.308 0.793 -1.026
286 HE2 PHE 42 HE2 PHE 42 61.655 -1.895 -1.106
287 HZ PHE 42 HZ PHE 42 60.454 0.068 -2.030
288 H ASP 43 HN ASP 43 58.364 -4.136 4.453
289 HA ASP 43 HA ASP 43 55.713 -5.107 4.880
290 1HB ASP 43 HB2 ASP 43 57.266 -7.028 3.760
291 2HB ASP 43 HB1 ASP 43 57.608 -7.322 5.465
292 H GLY 44 HN GLY 44 56.816 -3.145 6.227
293 1HA GLY 44 HA2 GLY 44 56.692 -2.844 8.682
294 2HA GLY 44 HA1 GLY 44 57.598 -4.347 8.847
295 H VAL 45 HN VAL 45 58.110 -1.393 6.859
296 HA VAL 45 HA VAL 45 60.789 -1.158 8.187
297 HB VAL 45 HB VAL 45 61.874 -1.129 6.120
298 1HG1 VAL 45 HG11 VAL 45 60.966 -2.946 4.744
299 2HG1 VAL 45 HG12 VAL 45 59.403 -2.787 5.548
300 3HG1 VAL 45 HG13 VAL 45 60.812 -3.338 6.458
301 1HG2 VAL 45 HG21 VAL 45 59.275 -0.028 5.127
302 2HG2 VAL 45 HG22 VAL 45 60.336 -0.832 3.970
303 3HG2 VAL 45 HG23 VAL 45 60.913 0.571 4.872
304 H THR 46 HN THR 46 61.715 1.063 6.907
305 HA THR 46 HA THR 46 59.687 3.186 6.817
306 HB THR 46 HB THR 46 61.784 3.107 9.012
307 HG1 THR 46 HG1 THR 46 60.028 2.677 10.363
308 1HG2 THR 46 HG21 THR 46 59.891 4.902 9.780
309 2HG2 THR 46 HG22 THR 46 59.838 5.108 8.029
310 3HG2 THR 46 HG23 THR 46 61.354 5.343 8.900
311 H ILE 47 HN ILE 47 61.319 2.499 4.776
312 HA ILE 47 HA ILE 47 63.869 3.958 4.865
313 HB ILE 47 HB ILE 47 63.522 1.799 3.688
314 1HG1 ILE 47 HG12 ILE 47 64.047 4.059 1.732
315 2HG1 ILE 47 HG11 ILE 47 65.232 3.476 2.902
316 1HG2 ILE 47 HG21 ILE 47 62.219 2.579 1.334
317 2HG2 ILE 47 HG22 ILE 47 61.252 3.279 2.632
318 3HG2 ILE 47 HG23 ILE 47 61.562 1.544 2.602
319 1HD1 ILE 47 HD1 ILE 47 64.335 2.257 0.376
320 2HD1 ILE 47 HD1 ILE 47 64.400 1.133 1.733
321 3HD1 ILE 47 HD1 ILE 47 65.843 2.030 1.262
322 H THR 48 HN THR 48 64.306 5.541 3.012
323 HA THR 48 HA THR 48 61.881 7.152 2.325
324 HB THR 48 HB THR 48 63.277 9.163 2.930
325 HG1 THR 48 HG1 THR 48 65.256 7.784 2.756
326 1HG2 THR 48 HG21 THR 48 63.406 8.062 5.505
327 2HG2 THR 48 HG22 THR 48 62.108 7.183 4.698
328 3HG2 THR 48 HG23 THR 48 62.049 8.942 4.802
329 H THR 49 HN THR 49 64.343 9.039 1.417
330 HA THR 49 HA THR 49 64.192 8.323 -1.374
331 HB THR 49 HB THR 49 65.998 10.137 0.251
332 HG1 THR 49 HG1 THR 49 64.583 11.706 -0.496
333 1HG2 THR 49 HG21 THR 49 67.221 9.787 -1.724
334 2HG2 THR 49 HG22 THR 49 66.270 11.228 -2.091
335 3HG2 THR 49 HG23 THR 49 65.764 9.656 -2.711
336 H SER 50 HN SER 50 64.909 5.957 -0.907
337 HA SER 50 HA SER 50 67.899 5.809 -1.112
338 1HB SER 50 HB2 SER 50 65.923 4.103 0.427
339 2HB SER 50 HB1 SER 50 67.600 3.633 0.167
340 HG SER 50 HG SER 50 66.553 5.380 1.939
341 H THR 51 HN THR 51 68.616 4.549 -2.831
342 HA THR 51 HA THR 51 66.540 3.319 -4.567
343 HB THR 51 HB THR 51 69.266 3.154 -5.501
344 HG1 THR 51 HG1 THR 51 69.650 5.421 -5.491
345 1HG2 THR 51 HG21 THR 51 66.765 3.627 -6.532
346 2HG2 THR 51 HG22 THR 51 68.275 3.839 -7.418
347 3HG2 THR 51 HG23 THR 51 67.512 5.221 -6.632
348 H SER 52 HN SER 52 66.156 1.172 -4.229
349 HA SER 52 HA SER 52 68.461 -0.574 -3.427
350 1HB SER 52 HB2 SER 52 65.581 -1.085 -2.703
351 2HB SER 52 HB1 SER 52 67.036 -1.667 -1.900
352 HG SER 52 HG SER 52 66.069 1.004 -1.995
353 H THR 53 HN THR 53 68.711 -2.436 -4.689
354 HA THR 53 HA THR 53 66.629 -2.869 -6.811
355 HB THR 53 HB THR 53 69.469 -3.818 -7.000
356 HG1 THR 53 HG1 THR 53 68.717 -1.208 -7.736
357 1HG2 THR 53 HG21 THR 53 68.160 -4.436 -8.858
358 2HG2 THR 53 HG22 THR 53 68.973 -2.968 -9.401
359 3HG2 THR 53 HG23 THR 53 67.292 -2.901 -8.869
360 H GLY 54 HN GLY 54 65.554 -4.791 -6.678
361 1HA GLY 54 HA2 GLY 54 64.956 -6.905 -5.812
362 2HA GLY 54 HA1 GLY 54 66.581 -7.337 -6.348
363 H SER 55 HN SER 55 65.390 -5.249 -3.703
364 HA SER 55 HA SER 55 66.978 -6.944 -1.805
365 1HB SER 55 HB2 SER 55 67.327 -4.660 -0.650
366 2HB SER 55 HB1 SER 55 68.203 -4.936 -2.152
367 HG SER 55 HG SER 55 66.762 -3.678 -3.224
368 H ARG 56 HN ARG 56 65.944 -7.401 0.140
369 HA ARG 56 HA ARG 56 63.083 -6.601 0.352
370 1HB ARG 56 HB2 ARG 56 64.408 -8.993 0.554
371 2HB ARG 56 HB1 ARG 56 64.287 -8.526 2.249
372 1HG ARG 56 HG2 ARG 56 61.925 -8.435 2.179
373 2HG ARG 56 HG1 ARG 56 61.895 -8.396 0.415
374 1HD ARG 56 HD2 ARG 56 61.715 -10.652 0.392
375 2HD ARG 56 HD1 ARG 56 63.285 -10.771 1.212
376 HE ARG 56 HE ARG 56 61.088 -10.040 3.000
377 1HH1 ARG 56 HH1 ARG 56 63.637 -11.711 3.526
378 2HH1 ARG 56 HH1 ARG 56 62.932 -13.260 3.847
379 1HH2 ARG 56 HH2 ARG 56 59.833 -12.416 2.541
380 2HH2 ARG 56 HH2 ARG 56 60.778 -13.659 3.290
381 H ILE 57 HN ILE 57 63.091 -4.573 1.397
382 HA ILE 57 HA ILE 57 64.884 -4.051 3.661
383 HB ILE 57 HB ILE 57 62.546 -2.551 2.434
384 1HG1 ILE 57 HG12 ILE 57 65.096 -1.311 2.059
385 2HG1 ILE 57 HG11 ILE 57 65.240 -3.003 1.582
386 1HG2 ILE 57 HG21 ILE 57 64.241 -0.741 3.699
387 2HG2 ILE 57 HG22 ILE 57 64.149 -2.086 4.836
388 3HG2 ILE 57 HG23 ILE 57 62.674 -1.279 4.303
389 1HD1 ILE 57 HD1 ILE 57 64.482 -1.451 -0.267
390 2HD1 ILE 57 HD1 ILE 57 62.995 -1.198 0.647
391 3HD1 ILE 57 HD1 ILE 57 63.398 -2.806 0.044
392 H SER 58 HN SER 58 62.303 -6.016 3.454
393 HA SER 58 HA SER 58 60.450 -5.231 5.447
394 1HB SER 58 HB2 SER 58 61.472 -7.783 4.272
395 2HB SER 58 HB1 SER 58 60.471 -7.896 5.717
396 HG SER 58 HG SER 58 58.978 -7.818 4.181
397 H GLY 59 HN GLY 59 60.311 -6.092 7.715
398 1HA GLY 59 HA2 GLY 59 62.213 -7.349 9.238
399 2HA GLY 59 HA1 GLY 59 62.865 -5.717 9.098
400 HA PRO 60 HA PRO 60 59.390 -6.067 12.325
401 1HB PRO 60 HB2 PRO 60 60.853 -6.549 14.586
402 2HB PRO 60 HB1 PRO 60 60.160 -7.846 13.591
403 1HG PRO 60 HG2 PRO 60 62.952 -6.824 13.690
404 2HG PRO 60 HG1 PRO 60 62.363 -8.483 13.503
405 1HD PRO 60 HD2 PRO 60 63.284 -6.959 11.430
406 2HD PRO 60 HD1 PRO 60 62.103 -8.274 11.241
407 H GLY 61 HN GLY 61 60.418 -3.807 11.211
408 1HA GLY 61 HA2 GLY 61 60.145 -1.582 12.391
409 2HA GLY 61 HA1 GLY 61 61.342 -2.174 13.543
410 H CYS 62 HN CYS 62 61.871 -3.103 10.276
411 HA CYS 62 HA CYS 62 64.449 -2.120 9.998
412 1HB CYS 62 HB2 CYS 62 62.553 -3.387 8.440
413 2HB CYS 62 HB1 CYS 62 62.799 -1.871 7.572
414 H LYS 63 HN LYS 63 65.373 -0.108 9.613
415 HA LYS 63 HA LYS 63 63.585 2.154 8.804
416 1HB LYS 63 HB2 LYS 63 63.703 2.151 11.240
417 2HB LYS 63 HB1 LYS 63 65.460 2.004 11.187
418 1HG LYS 63 HG2 LYS 63 65.765 4.213 10.699
419 2HG LYS 63 HG1 LYS 63 64.331 4.287 9.675
420 1HD LYS 63 HD2 LYS 63 63.602 3.800 12.444
421 2HD LYS 63 HD1 LYS 63 64.564 5.270 12.292
422 1HE LYS 63 HE2 LYS 63 62.795 5.384 10.121
423 2HE LYS 63 HE1 LYS 63 61.808 4.809 11.479
424 1HZ LYS 63 HZ1 LYS 63 63.243 7.325 11.167
425 2HZ LYS 63 HZ2 LYS 63 63.303 6.617 12.710
426 3HZ LYS 63 HZ3 LYS 63 61.804 6.997 12.004
427 H ILE 64 HN ILE 64 64.567 3.072 7.017
428 HA ILE 64 HA ILE 64 67.556 3.268 7.019
429 HB ILE 64 HB ILE 64 65.850 2.574 4.619
430 1HG1 ILE 64 HG12 ILE 64 67.441 0.647 6.332
431 2HG1 ILE 64 HG11 ILE 64 65.699 0.868 6.496
432 1HG2 ILE 64 HG21 ILE 64 67.971 3.395 3.938
433 2HG2 ILE 64 HG22 ILE 64 68.140 1.640 3.903
434 3HG2 ILE 64 HG23 ILE 64 68.804 2.563 5.251
435 1HD1 ILE 64 HD1 ILE 64 67.246 -0.425 4.308
436 2HD1 ILE 64 HD1 ILE 64 65.829 0.511 3.832
437 3HD1 ILE 64 HD1 ILE 64 65.659 -0.835 4.958
438 H SER 65 HN SER 65 68.345 4.903 5.437
439 HA SER 65 HA SER 65 66.410 6.913 4.470
440 1HB SER 65 HB2 SER 65 68.596 7.862 6.293
441 2HB SER 65 HB1 SER 65 67.035 8.604 5.951
442 HG SER 65 HG SER 65 66.793 7.713 7.924
443 H THR 66 HN THR 66 67.199 7.216 2.411
444 HA THR 66 HA THR 66 68.745 7.523 0.651
445 HB THR 66 HB THR 66 70.578 8.600 2.789
446 HG1 THR 66 HG1 THR 66 68.459 10.094 1.710
447 1HG2 THR 66 HG21 THR 66 70.270 8.807 -0.095
448 2HG2 THR 66 HG22 THR 66 71.620 9.312 0.922
449 3HG2 THR 66 HG23 THR 66 70.252 10.396 0.670
450 H CYS 67 HN CYS 67 69.120 5.200 0.419
451 HA CYS 67 HA CYS 67 71.911 4.421 1.098
452 1HB CYS 67 HB2 CYS 67 69.369 3.050 2.014
453 2HB CYS 67 HB1 CYS 67 70.899 2.187 1.913
454 H ILE 68 HN ILE 68 72.426 4.250 -1.142
455 HA ILE 68 HA ILE 68 70.683 3.049 -3.102
456 HB ILE 68 HB ILE 68 73.627 3.709 -2.905
457 1HG1 ILE 68 HG12 ILE 68 73.006 5.383 -4.614
458 2HG1 ILE 68 HG11 ILE 68 71.350 4.777 -4.608
459 1HG2 ILE 68 HG21 ILE 68 73.709 3.190 -5.372
460 2HG2 ILE 68 HG22 ILE 68 72.134 2.412 -5.201
461 3HG2 ILE 68 HG23 ILE 68 73.535 1.766 -4.345
462 1HD1 ILE 68 HD1 ILE 68 72.716 5.805 -2.113
463 2HD1 ILE 68 HD1 ILE 68 70.997 5.493 -2.354
464 3HD1 ILE 68 HD1 ILE 68 71.772 6.845 -3.178
465 H ILE 69 HN ILE 69 70.009 0.974 -2.393
466 HA ILE 69 HA ILE 69 72.138 -1.013 -1.769
467 HB ILE 69 HB ILE 69 69.124 -1.036 -1.411
468 1HG1 ILE 69 HG12 ILE 69 71.006 -0.915 0.890
469 2HG1 ILE 69 HG11 ILE 69 70.870 0.549 -0.085
470 1HG2 ILE 69 HG21 ILE 69 69.346 -3.056 -0.253
471 2HG2 ILE 69 HG22 ILE 69 71.070 -2.820 0.028
472 3HG2 ILE 69 HG23 ILE 69 70.491 -3.269 -1.575
473 1HD1 ILE 69 HD1 ILE 69 68.622 -0.938 1.298
474 2HD1 ILE 69 HD1 ILE 69 68.362 0.369 0.142
475 3HD1 ILE 69 HD1 ILE 69 69.206 0.687 1.657
476 H THR 70 HN THR 70 71.917 -3.186 -2.763
477 HA THR 70 HA THR 70 70.188 -3.530 -5.107
478 HB THR 70 HB THR 70 73.170 -3.023 -5.323
479 HG1 THR 70 HG1 THR 70 72.548 -1.187 -6.124
480 1HG2 THR 70 HG21 THR 70 73.135 -3.780 -7.547
481 2HG2 THR 70 HG22 THR 70 71.374 -3.726 -7.634
482 3HG2 THR 70 HG23 THR 70 72.172 -4.992 -6.702
483 H GLY 71 HN GLY 71 69.604 -5.631 -4.607
484 1HA GLY 71 HA2 GLY 71 69.984 -7.989 -4.606
485 2HA GLY 71 HA1 GLY 71 71.722 -7.682 -4.561
486 H GLY 72 HN GLY 72 69.758 -5.926 -2.348
487 1HA GLY 72 HA2 GLY 72 69.269 -6.316 -0.056
488 2HA GLY 72 HA1 GLY 72 70.079 -7.873 -0.168
489 H VAL 73 HN VAL 73 71.889 -5.377 -1.553
490 HA VAL 73 HA VAL 73 73.602 -5.194 0.912
491 HB VAL 73 HB VAL 73 75.467 -5.136 -0.642
492 1HG1 VAL 73 HG11 VAL 73 73.477 -7.264 -0.690
493 2HG1 VAL 73 HG12 VAL 73 75.236 -7.385 -0.645
494 3HG1 VAL 73 HG13 VAL 73 74.403 -7.211 -2.190
495 1HG2 VAL 73 HG21 VAL 73 74.517 -5.509 -3.176
496 2HG2 VAL 73 HG22 VAL 73 74.967 -3.934 -2.520
497 3HG2 VAL 73 HG23 VAL 73 73.277 -4.443 -2.509
498 HA PRO 74 HA PRO 74 72.857 -0.834 0.433
499 1HB PRO 74 HB2 PRO 74 74.531 0.022 2.410
500 2HB PRO 74 HB1 PRO 74 72.958 -0.724 2.742
501 1HG PRO 74 HG2 PRO 74 75.675 -1.860 2.990
502 2HG PRO 74 HG1 PRO 74 74.207 -2.224 3.907
503 1HD PRO 74 HD2 PRO 74 75.283 -3.771 1.843
504 2HD PRO 74 HD1 PRO 74 73.645 -3.916 2.514
505 H ALA 75 HN ALA 75 74.043 1.020 -0.399
506 HA ALA 75 HA ALA 75 76.461 0.306 -1.911
507 1HB ALA 75 HB1 ALA 75 74.472 2.515 -1.740
508 2HB ALA 75 HB2 ALA 75 75.106 1.687 -3.161
509 3HB ALA 75 HB3 ALA 75 76.064 2.937 -2.368
510 HA PRO 76 HA PRO 76 79.401 2.068 0.834
511 1HB PRO 76 HB2 PRO 76 81.213 3.132 -0.919
512 2HB PRO 76 HB1 PRO 76 81.034 1.386 -0.658
513 1HG PRO 76 HG2 PRO 76 80.024 3.080 -2.880
514 2HG PRO 76 HG1 PRO 76 80.646 1.424 -2.914
515 1HD PRO 76 HD2 PRO 76 77.981 2.070 -3.001
516 2HD PRO 76 HD1 PRO 76 78.614 0.517 -2.416
517 H SER 77 HN SER 77 77.224 3.748 0.765
518 HA SER 77 HA SER 77 78.257 6.470 0.093
519 1HB SER 77 HB2 SER 77 75.589 5.148 0.415
520 2HB SER 77 HB1 SER 77 75.698 6.881 0.707
521 HG SER 77 HG SER 77 76.586 7.108 -1.367
522 H ALA 78 HN ALA 78 78.611 7.966 1.728
523 HA ALA 78 HA ALA 78 78.671 6.994 4.496
524 1HB ALA 78 HB1 ALA 78 79.539 9.402 4.795
525 2HB ALA 78 HB2 ALA 78 79.398 9.546 3.043
526 3HB ALA 78 HB3 ALA 78 80.486 8.349 3.744
527 H ALA 79 HN ALA 79 76.552 8.942 2.503
528 HA ALA 79 HA ALA 79 75.175 10.207 4.762
529 1HB ALA 79 HB1 ALA 79 73.629 10.351 2.410
530 2HB ALA 79 HB2 ALA 79 75.307 10.358 1.869
531 3HB ALA 79 HB3 ALA 79 74.746 11.573 3.016
532 H CYS 80 HN CYS 80 75.233 7.074 3.828
533 HA CYS 80 HA CYS 80 72.295 6.626 4.083
534 1HB CYS 80 HB2 CYS 80 73.157 5.458 2.239
535 2HB CYS 80 HB1 CYS 80 74.671 5.089 3.055
536 H LYS 81 HN LYS 81 71.515 5.110 5.697
537 HA LYS 81 HA LYS 81 73.243 5.012 8.124
538 1HB LYS 81 HB2 LYS 81 71.116 4.792 9.285
539 2HB LYS 81 HB1 LYS 81 70.975 6.099 8.108
540 1HG LYS 81 HG2 LYS 81 69.181 5.027 7.263
541 2HG LYS 81 HG1 LYS 81 70.287 3.779 6.688
542 1HD LYS 81 HD2 LYS 81 69.861 3.331 9.472
543 2HD LYS 81 HD1 LYS 81 68.283 3.569 8.722
544 1HE LYS 81 HE2 LYS 81 68.685 1.793 7.126
545 2HE LYS 81 HE1 LYS 81 70.379 1.668 7.623
546 1HZ LYS 81 HZ1 LYS 81 69.420 0.055 8.926
547 2HZ LYS 81 HZ2 LYS 81 67.954 0.901 9.089
548 3HZ LYS 81 HZ3 LYS 81 69.320 1.390 9.967
549 H ILE 82 HN ILE 82 72.157 2.970 9.511
550 HA ILE 82 HA ILE 82 71.648 0.518 8.146
551 HB ILE 82 HB ILE 82 74.165 1.430 7.641
552 1HG1 ILE 82 HG12 ILE 82 74.695 -0.994 7.131
553 2HG1 ILE 82 HG11 ILE 82 73.167 -1.413 7.907
554 1HG2 ILE 82 HG21 ILE 82 75.793 0.562 9.052
555 2HG2 ILE 82 HG22 ILE 82 74.713 -0.666 9.713
556 3HG2 ILE 82 HG23 ILE 82 74.550 1.016 10.218
557 1HD1 ILE 82 HD1 ILE 82 72.176 0.419 6.290
558 2HD1 ILE 82 HD1 ILE 82 72.499 -1.204 5.682
559 3HD1 ILE 82 HD1 ILE 82 73.638 0.102 5.356
560 H SER 83 HN SER 83 70.933 2.026 10.557
561 HA SER 83 HA SER 83 72.038 0.943 12.945
562 1HB SER 83 HB2 SER 83 69.505 2.285 12.084
563 2HB SER 83 HB1 SER 83 69.577 1.597 13.704
564 HG SER 83 HG SER 83 71.554 2.813 13.964
565 H GLY 84 HN GLY 84 68.634 0.271 12.490
566 1HA GLY 84 HA2 GLY 84 69.251 -2.643 12.786
567 2HA GLY 84 HA1 GLY 84 67.901 -1.859 13.604
568 H CYS 85 HN CYS 85 69.113 -2.829 10.414
569 HA CYS 85 HA CYS 85 66.282 -3.117 9.560
570 1HB CYS 85 HB2 CYS 85 67.579 -0.877 8.961
571 2HB CYS 85 HB1 CYS 85 68.262 -1.872 7.683
572 H THR 86 HN THR 86 67.113 -3.633 6.801
573 HA THR 86 HA THR 86 69.177 -5.540 6.504
574 HB THR 86 HB THR 86 68.153 -6.902 8.152
575 HG1 THR 86 HG1 THR 86 68.206 -8.541 6.877
576 1HG2 THR 86 HG21 THR 86 65.478 -6.623 6.775
577 2HG2 THR 86 HG22 THR 86 65.977 -5.545 8.077
578 3HG2 THR 86 HG23 THR 86 65.810 -7.273 8.380
579 H PHE 87 HN PHE 87 69.170 -6.399 4.386
580 HA PHE 87 HA PHE 87 66.878 -5.496 2.669
581 1HB PHE 87 HB2 PHE 87 69.701 -5.933 1.722
582 2HB PHE 87 HB1 PHE 87 68.461 -4.897 1.027
583 HD1 PHE 87 HD1 PHE 87 71.434 -4.297 1.966
584 HD2 PHE 87 HD2 PHE 87 67.545 -3.632 3.679
585 HE1 PHE 87 HE1 PHE 87 72.328 -2.389 3.275
586 HE2 PHE 87 HE2 PHE 87 68.446 -1.720 4.984
587 HZ PHE 87 HZ PHE 87 70.837 -1.102 4.780
588 H SER 88 HN SER 88 69.120 -8.107 3.438
589 HA SER 88 HA SER 88 69.166 -10.361 2.712
590 1HB SER 88 HB2 SER 88 66.263 -9.558 2.336
591 2HB SER 88 HB1 SER 88 66.830 -11.222 2.240
592 HG SER 88 HG SER 88 66.292 -9.722 4.404
593 H ALA 89 HN ALA 89 66.572 -9.624 0.481
594 HA ALA 89 HA ALA 89 67.697 -8.699 -1.845
595 1HB ALA 89 HB1 ALA 89 68.223 -11.246 -2.753
596 2HB ALA 89 HB2 ALA 89 68.783 -11.337 -1.083
597 3HB ALA 89 HB3 ALA 89 69.451 -10.118 -2.173
598 H ASN 90 HN ASN 90 65.254 -8.414 -1.557
599 HA ASN 90 HA ASN 90 63.388 -10.526 -1.902
600 1HB ASN 90 HB2 ASN 90 62.025 -8.747 -1.598
601 2HB ASN 90 HB1 ASN 90 63.446 -7.711 -1.632
602 1HD2 ASN 90 HD2 ASN 90 64.120 -6.961 -3.916
603 2HD2 ASN 90 HD2 ASN 90 62.890 -6.691 -5.052
Start of MODEL 13
1 1H ASP 1 HT1 ASP 1 45.594 8.234 4.390
2 2H ASP 1 HT2 ASP 1 46.033 6.639 4.778
3 3H ASP 1 HT3 ASP 1 44.703 6.934 3.762
4 HA ASP 1 HA ASP 1 46.020 7.522 1.958
5 1HB ASP 1 HB2 ASP 1 47.346 8.876 3.948
6 2HB ASP 1 HB1 ASP 1 48.551 7.678 3.472
7 H GLY 2 HN GLY 2 46.039 5.486 1.040
8 1HA GLY 2 HA2 GLY 2 48.273 3.784 1.175
9 2HA GLY 2 HA1 GLY 2 47.105 3.150 2.334
10 H SER 3 HN SER 3 46.666 4.657 -0.875
11 HA SER 3 HA SER 3 45.655 2.088 -1.952
12 1HB SER 3 HB2 SER 3 43.998 4.607 -1.615
13 2HB SER 3 HB1 SER 3 43.485 3.194 -2.534
14 HG SER 3 HG SER 3 44.171 2.139 -0.352
15 H CYS 4 HN CYS 4 47.861 2.990 -3.014
16 HA CYS 4 HA CYS 4 47.156 4.800 -5.293
17 1HB CYS 4 HB2 CYS 4 49.856 3.975 -4.172
18 2HB CYS 4 HB1 CYS 4 49.559 5.247 -5.357
19 H THR 5 HN THR 5 50.021 3.218 -5.961
20 HA THR 5 HA THR 5 48.992 0.682 -6.970
21 HB THR 5 HB THR 5 49.604 2.953 -8.895
22 HG1 THR 5 HG1 THR 5 47.585 3.369 -8.601
23 1HG2 THR 5 HG21 THR 5 49.813 1.385 -10.491
24 2HG2 THR 5 HG22 THR 5 48.270 0.665 -10.033
25 3HG2 THR 5 HG23 THR 5 49.756 0.149 -9.234
26 H ASN 6 HN ASN 6 51.459 3.226 -7.123
27 HA ASN 6 HA ASN 6 53.806 3.084 -7.334
28 1HB ASN 6 HB2 ASN 6 53.970 0.401 -6.167
29 2HB ASN 6 HB1 ASN 6 54.538 1.933 -5.518
30 1HD2 ASN 6 HD2 ASN 6 53.040 3.184 -4.161
31 2HD2 ASN 6 HD2 ASN 6 51.664 2.456 -3.485
32 H THR 7 HN THR 7 53.131 2.680 -9.754
33 HA THR 7 HA THR 7 53.481 1.473 -11.764
34 HB THR 7 HB THR 7 55.640 0.329 -9.956
35 HG1 THR 7 HG1 THR 7 56.874 2.000 -10.897
36 1HG2 THR 7 HG21 THR 7 56.364 -0.848 -11.729
37 2HG2 THR 7 HG22 THR 7 56.359 0.602 -12.735
38 3HG2 THR 7 HG23 THR 7 54.899 -0.379 -12.593
39 H ASN 8 HN ASN 8 51.457 0.405 -10.074
40 HA ASN 8 HA ASN 8 50.132 -1.559 -10.002
41 1HB ASN 8 HB2 ASN 8 51.942 -1.828 -12.175
42 2HB ASN 8 HB1 ASN 8 51.955 -3.364 -11.314
43 1HD2 ASN 8 HD2 ASN 8 50.690 -2.708 -13.977
44 2HD2 ASN 8 HD2 ASN 8 49.054 -3.120 -13.803
45 H SER 9 HN SER 9 50.690 -1.557 -7.666
46 HA SER 9 HA SER 9 52.415 -3.895 -6.954
47 1HB SER 9 HB2 SER 9 52.606 -1.023 -6.132
48 2HB SER 9 HB1 SER 9 53.028 -2.257 -4.949
49 HG SER 9 HG SER 9 54.127 -1.840 -7.532
50 H GLN 10 HN GLN 10 51.172 -1.725 -4.530
51 HA GLN 10 HA GLN 10 48.580 -2.778 -4.109
52 1HB GLN 10 HB2 GLN 10 49.058 -4.924 -3.568
53 2HB GLN 10 HB1 GLN 10 50.784 -4.593 -3.633
54 1HG GLN 10 HG2 GLN 10 50.931 -4.183 -1.356
55 2HG GLN 10 HG1 GLN 10 49.233 -3.723 -1.217
56 1HE2 GLN 10 HE21 GLN 10 50.949 -5.941 0.153
57 2HE2 GLN 10 HE22 GLN 10 50.002 -7.337 -0.039
58 H LEU 11 HN LEU 11 51.599 -1.980 -2.359
59 HA LEU 11 HA LEU 11 51.933 -0.601 -0.460
60 1HB LEU 11 HB2 LEU 11 51.185 0.941 -2.311
61 2HB LEU 11 HB1 LEU 11 49.539 0.797 -1.693
62 HG LEU 11 HG LEU 11 50.200 1.742 0.444
63 1HD1 LEU 11 HD1 LEU 11 52.975 1.566 -0.744
64 2HD1 LEU 11 HD1 LEU 11 52.389 0.858 0.762
65 3HD1 LEU 11 HD1 LEU 11 52.607 2.603 0.635
66 1HD2 LEU 11 HD2 LEU 11 49.840 3.725 -0.572
67 2HD2 LEU 11 HD2 LEU 11 50.512 3.120 -2.086
68 3HD2 LEU 11 HD2 LEU 11 51.576 3.827 -0.871
69 H SER 12 HN SER 12 51.239 -2.186 1.129
70 HA SER 12 HA SER 12 48.702 -2.953 1.921
71 1HB SER 12 HB2 SER 12 51.342 -2.730 3.045
72 2HB SER 12 HB1 SER 12 50.152 -2.339 4.280
73 HG SER 12 HG SER 12 49.081 -4.343 3.228
74 H ALA 13 HN ALA 13 47.187 -2.129 3.511
75 HA ALA 13 HA ALA 13 46.616 0.687 3.293
76 1HB ALA 13 HB1 ALA 13 44.706 -0.516 3.712
77 2HB ALA 13 HB2 ALA 13 45.130 -0.207 5.395
78 3HB ALA 13 HB3 ALA 13 45.568 -1.741 4.643
79 H ASN 14 HN ASN 14 48.850 -1.009 5.202
80 HA ASN 14 HA ASN 14 48.759 0.938 7.452
81 1HB ASN 14 HB2 ASN 14 48.919 -1.421 7.996
82 2HB ASN 14 HB1 ASN 14 50.284 -1.626 6.898
83 1HD2 ASN 14 HD2 ASN 14 52.264 -0.170 7.469
84 2HD2 ASN 14 HD2 ASN 14 52.600 0.045 9.119
85 H SER 15 HN SER 15 50.328 0.495 4.461
86 HA SER 15 HA SER 15 52.928 1.619 5.179
87 1HB SER 15 HB2 SER 15 52.356 0.042 3.266
88 2HB SER 15 HB1 SER 15 51.575 1.408 2.473
89 HG SER 15 HG SER 15 54.166 1.750 3.457
90 H LYS 16 HN LYS 16 53.214 3.500 3.055
91 HA LYS 16 HA LYS 16 51.214 5.627 3.679
92 1HB LYS 16 HB2 LYS 16 53.055 5.869 5.262
93 2HB LYS 16 HB1 LYS 16 54.232 5.781 3.950
94 1HG LYS 16 HG2 LYS 16 53.627 7.890 3.097
95 2HG LYS 16 HG1 LYS 16 52.077 7.886 3.939
96 1HD LYS 16 HD2 LYS 16 53.403 7.922 6.116
97 2HD LYS 16 HD1 LYS 16 54.830 8.260 5.136
98 1HE LYS 16 HE2 LYS 16 54.239 10.451 5.308
99 2HE LYS 16 HE1 LYS 16 52.925 10.068 4.179
100 1HZ LYS 16 HZ1 LYS 16 52.673 9.479 7.060
101 2HZ LYS 16 HZ2 LYS 16 51.445 9.665 5.902
102 3HZ LYS 16 HZ3 LYS 16 52.300 11.021 6.462
103 H CYS 17 HN CYS 17 50.964 7.137 1.976
104 HA CYS 17 HA CYS 17 52.576 6.611 -0.501
105 1HB CYS 17 HB2 CYS 17 50.031 5.840 -0.161
106 2HB CYS 17 HB1 CYS 17 49.727 7.512 -0.629
107 H GLU 18 HN GLU 18 53.894 8.498 0.127
108 HA GLU 18 HA GLU 18 52.474 11.087 -0.400
109 1HB GLU 18 HB2 GLU 18 52.831 10.983 1.954
110 2HB GLU 18 HB1 GLU 18 54.445 10.299 1.754
111 1HG GLU 18 HG2 GLU 18 55.380 12.339 1.129
112 2HG GLU 18 HG1 GLU 18 53.837 12.994 0.580
113 H LYS 19 HN LYS 19 53.336 10.853 -2.620
114 HA LYS 19 HA LYS 19 54.959 11.242 -4.295
115 1HB LYS 19 HB2 LYS 19 56.365 12.727 -2.064
116 2HB LYS 19 HB1 LYS 19 56.352 13.119 -3.785
117 1HG LYS 19 HG2 LYS 19 53.649 13.055 -3.069
118 2HG LYS 19 HG1 LYS 19 54.441 13.860 -1.714
119 1HD LYS 19 HD2 LYS 19 54.902 15.706 -2.940
120 2HD LYS 19 HD1 LYS 19 55.441 14.753 -4.324
121 1HE LYS 19 HE2 LYS 19 53.515 15.663 -5.242
122 2HE LYS 19 HE1 LYS 19 52.792 14.241 -4.465
123 1HZ LYS 19 HZ1 LYS 19 51.881 16.595 -3.910
124 2HZ LYS 19 HZ2 LYS 19 53.238 16.686 -2.893
125 3HZ LYS 19 HZ3 LYS 19 52.084 15.460 -2.667
126 H SER 20 HN SER 20 56.000 9.291 -4.723
127 HA SER 20 HA SER 20 58.652 8.886 -3.503
128 1HB SER 20 HB2 SER 20 57.156 7.839 -1.884
129 2HB SER 20 HB1 SER 20 56.334 6.956 -3.168
130 HG SER 20 HG SER 20 57.799 5.538 -2.427
131 H THR 21 HN THR 21 58.935 6.181 -4.357
132 HA THR 21 HA THR 21 58.184 6.105 -7.223
133 HB THR 21 HB THR 21 61.065 5.699 -6.749
134 HG1 THR 21 HG1 THR 21 60.761 7.404 -5.337
135 1HG2 THR 21 HG21 THR 21 60.260 7.770 -8.624
136 2HG2 THR 21 HG22 THR 21 59.344 6.284 -8.872
137 3HG2 THR 21 HG23 THR 21 61.106 6.256 -8.932
138 H LEU 22 HN LEU 22 57.068 4.143 -6.480
139 HA LEU 22 HA LEU 22 58.892 1.903 -5.691
140 1HB LEU 22 HB2 LEU 22 56.143 2.775 -5.058
141 2HB LEU 22 HB1 LEU 22 56.308 1.041 -5.335
142 HG LEU 22 HG LEU 22 57.974 0.835 -3.627
143 1HD1 LEU 22 HD1 LEU 22 58.734 2.893 -2.370
144 2HD1 LEU 22 HD1 LEU 22 57.947 3.864 -3.614
145 3HD1 LEU 22 HD1 LEU 22 59.295 2.809 -4.040
146 1HD2 LEU 22 HD2 LEU 22 55.872 2.775 -2.612
147 2HD2 LEU 22 HD2 LEU 22 56.757 1.590 -1.652
148 3HD2 LEU 22 HD2 LEU 22 55.596 1.052 -2.867
149 H THR 23 HN THR 23 59.432 0.627 -7.431
150 HA THR 23 HA THR 23 57.492 0.421 -9.700
151 HB THR 23 HB THR 23 60.434 -0.305 -9.486
152 HG1 THR 23 HG1 THR 23 59.311 1.862 -10.890
153 1HG2 THR 23 HG21 THR 23 59.119 0.228 -12.090
154 2HG2 THR 23 HG22 THR 23 58.670 -1.279 -11.293
155 3HG2 THR 23 HG23 THR 23 60.360 -0.954 -11.675
156 H ASN 24 HN ASN 24 56.254 -1.408 -9.698
157 HA ASN 24 HA ASN 24 55.607 -3.653 -9.354
158 1HB ASN 24 HB2 ASN 24 58.572 -3.654 -9.807
159 2HB ASN 24 HB1 ASN 24 57.797 -5.163 -9.328
160 1HD2 ASN 24 HD2 ASN 24 58.485 -5.816 -11.634
161 2HD2 ASN 24 HD2 ASN 24 57.426 -5.431 -12.904
162 H CYS 25 HN CYS 25 56.478 -1.808 -7.015
163 HA CYS 25 HA CYS 25 57.633 -3.521 -4.991
164 1HB CYS 25 HB2 CYS 25 57.203 -0.854 -5.286
165 2HB CYS 25 HB1 CYS 25 55.860 -1.255 -4.229
166 H TYR 26 HN TYR 26 55.619 -2.707 -2.976
167 HA TYR 26 HA TYR 26 53.047 -3.854 -3.458
168 1HB TYR 26 HB2 TYR 26 55.231 -5.682 -3.228
169 2HB TYR 26 HB1 TYR 26 54.303 -5.801 -1.734
170 HD1 TYR 26 HD1 TYR 26 51.823 -6.259 -1.845
171 HD2 TYR 26 HD2 TYR 26 54.377 -6.539 -5.289
172 HE1 TYR 26 HE1 TYR 26 50.092 -7.589 -3.023
173 HE2 TYR 26 HE2 TYR 26 52.644 -7.866 -6.466
174 HH TYR 26 HH TYR 26 49.856 -7.978 -6.108
175 H VAL 27 HN VAL 27 55.677 -3.780 -1.103
176 HA VAL 27 HA VAL 27 55.809 -2.968 1.098
177 HB VAL 27 HB VAL 27 53.668 -1.048 0.181
178 1HG1 VAL 27 HG11 VAL 27 54.410 -0.455 2.319
179 2HG1 VAL 27 HG12 VAL 27 55.477 0.499 1.289
180 3HG1 VAL 27 HG13 VAL 27 56.057 -1.005 2.007
181 1HG2 VAL 27 HG21 VAL 27 56.469 -1.424 -0.884
182 2HG2 VAL 27 HG22 VAL 27 55.761 0.190 -0.824
183 3HG2 VAL 27 HG23 VAL 27 54.988 -1.077 -1.776
184 H ASP 28 HN ASP 28 54.979 -3.986 2.857
185 HA ASP 28 HA ASP 28 52.021 -4.437 2.982
186 1HB ASP 28 HB2 ASP 28 53.896 -6.289 2.929
187 2HB ASP 28 HB1 ASP 28 54.066 -5.883 4.637
188 H LYS 29 HN LYS 29 54.798 -3.067 4.628
189 HA LYS 29 HA LYS 29 53.084 -1.573 6.467
190 1HB LYS 29 HB2 LYS 29 54.537 -4.076 7.242
191 2HB LYS 29 HB1 LYS 29 54.480 -2.761 8.413
192 1HG LYS 29 HG2 LYS 29 52.437 -3.511 8.996
193 2HG LYS 29 HG1 LYS 29 51.867 -2.920 7.433
194 1HD LYS 29 HD2 LYS 29 51.362 -5.059 6.929
195 2HD LYS 29 HD1 LYS 29 53.099 -5.358 6.842
196 1HE LYS 29 HE2 LYS 29 51.446 -5.565 9.385
197 2HE LYS 29 HE1 LYS 29 51.986 -6.945 8.407
198 1HZ LYS 29 HZ1 LYS 29 53.760 -6.760 9.808
199 2HZ LYS 29 HZ2 LYS 29 53.565 -5.087 10.032
200 3HZ LYS 29 HZ3 LYS 29 54.265 -5.679 8.602
201 H SER 30 HN SER 30 54.797 -0.410 4.743
202 HA SER 30 HA SER 30 57.152 0.334 6.447
203 1HB SER 30 HB2 SER 30 56.952 -0.413 3.536
204 2HB SER 30 HB1 SER 30 58.303 0.544 4.137
205 HG SER 30 HG SER 30 57.487 -2.058 4.913
206 H GLU 31 HN GLU 31 57.907 2.502 6.145
207 HA GLU 31 HA GLU 31 55.857 4.349 4.974
208 1HB GLU 31 HB2 GLU 31 56.796 4.222 7.495
209 2HB GLU 31 HB1 GLU 31 58.044 5.256 6.800
210 1HG GLU 31 HG2 GLU 31 56.021 6.589 5.803
211 2HG GLU 31 HG1 GLU 31 55.092 5.775 7.063
212 H VAL 32 HN VAL 32 56.651 4.437 2.819
213 HA VAL 32 HA VAL 32 59.521 4.964 2.354
214 HB VAL 32 HB VAL 32 57.210 4.792 0.404
215 1HG1 VAL 32 HG11 VAL 32 59.372 3.668 -0.793
216 2HG1 VAL 32 HG12 VAL 32 60.170 4.857 0.237
217 3HG1 VAL 32 HG13 VAL 32 58.963 5.377 -0.939
218 1HG2 VAL 32 HG21 VAL 32 57.010 2.598 0.887
219 2HG2 VAL 32 HG22 VAL 32 58.159 2.799 2.210
220 3HG2 VAL 32 HG23 VAL 32 58.734 2.364 0.598
221 H TYR 33 HN TYR 33 60.124 6.790 0.879
222 HA TYR 33 HA TYR 33 58.268 9.126 0.964
223 1HB TYR 33 HB2 TYR 33 60.953 8.772 2.259
224 2HB TYR 33 HB1 TYR 33 60.495 10.373 1.678
225 HD1 TYR 33 HD1 TYR 33 59.294 7.540 3.802
226 HD2 TYR 33 HD2 TYR 33 59.061 11.742 2.946
227 HE1 TYR 33 HE1 TYR 33 57.892 7.873 5.820
228 HE2 TYR 33 HE2 TYR 33 57.660 12.077 4.964
229 HH TYR 33 HH TYR 33 56.025 10.435 6.357
230 H GLY 34 HN GLY 34 61.291 7.699 -0.255
231 1HA GLY 34 HA2 GLY 34 60.798 8.860 -2.899
232 2HA GLY 34 HA1 GLY 34 62.221 9.513 -2.083
233 H THR 35 HN THR 35 61.186 6.194 -1.612
234 HA THR 35 HA THR 35 63.798 5.195 -2.442
235 HB THR 35 HB THR 35 61.178 3.968 -1.553
236 HG1 THR 35 HG1 THR 35 62.563 5.102 -0.059
237 1HG2 THR 35 HG21 THR 35 62.400 2.441 -3.115
238 2HG2 THR 35 HG22 THR 35 62.295 1.812 -1.471
239 3HG2 THR 35 HG23 THR 35 63.799 2.530 -2.045
240 H THR 36 HN THR 36 64.082 3.564 -4.140
241 HA THR 36 HA THR 36 62.205 3.974 -6.443
242 HB THR 36 HB THR 36 64.999 2.923 -6.712
243 HG1 THR 36 HG1 THR 36 65.363 5.406 -6.861
244 1HG2 THR 36 HG21 THR 36 64.298 5.077 -8.461
245 2HG2 THR 36 HG22 THR 36 62.946 3.947 -8.398
246 3HG2 THR 36 HG23 THR 36 64.550 3.379 -8.863
247 H CYS 37 HN CYS 37 61.327 2.082 -4.690
248 HA CYS 37 HA CYS 37 62.189 -0.512 -4.575
249 1HB CYS 37 HB2 CYS 37 59.949 0.661 -3.919
250 2HB CYS 37 HB1 CYS 37 59.384 0.093 -5.486
251 H THR 38 HN THR 38 63.337 -1.436 -6.294
252 HA THR 38 HA THR 38 62.040 -1.444 -8.990
253 HB THR 38 HB THR 38 64.839 -2.021 -7.975
254 HG1 THR 38 HG1 THR 38 63.532 0.067 -9.296
255 1HG2 THR 38 HG21 THR 38 64.536 -3.528 -9.792
256 2HG2 THR 38 HG22 THR 38 65.354 -2.125 -10.482
257 3HG2 THR 38 HG23 THR 38 63.620 -2.340 -10.721
258 H GLY 39 HN GLY 39 60.465 -3.101 -8.153
259 1HA GLY 39 HA2 GLY 39 59.754 -5.345 -8.251
260 2HA GLY 39 HA1 GLY 39 61.376 -5.784 -8.789
261 H SER 40 HN SER 40 59.685 -4.679 -5.835
262 HA SER 40 HA SER 40 60.938 -6.834 -4.276
263 1HB SER 40 HB2 SER 40 61.523 -3.992 -3.464
264 2HB SER 40 HB1 SER 40 62.362 -5.467 -2.997
265 HG SER 40 HG SER 40 62.435 -4.054 -5.438
266 H ARG 41 HN ARG 41 60.597 -5.240 -1.792
267 HA ARG 41 HA ARG 41 58.020 -4.106 -1.492
268 1HB ARG 41 HB2 ARG 41 57.038 -6.111 -2.282
269 2HB ARG 41 HB1 ARG 41 58.198 -7.120 -1.419
270 1HG ARG 41 HG2 ARG 41 57.217 -6.479 0.724
271 2HG ARG 41 HG1 ARG 41 56.115 -5.364 -0.084
272 1HD ARG 41 HD2 ARG 41 54.686 -7.166 -0.004
273 2HD ARG 41 HD1 ARG 41 55.584 -7.676 -1.447
274 HE ARG 41 HE ARG 41 57.164 -8.837 0.238
275 1HH1 ARG 41 HH1 ARG 41 54.082 -9.679 -0.228
276 2HH1 ARG 41 HH1 ARG 41 53.767 -10.322 1.349
277 1HH2 ARG 41 HH2 ARG 41 56.666 -9.027 2.744
278 2HH2 ARG 41 HH2 ARG 41 55.232 -9.955 3.032
279 H PHE 42 HN PHE 42 57.431 -3.895 0.804
280 HA PHE 42 HA PHE 42 59.688 -4.612 2.651
281 1HB PHE 42 HB2 PHE 42 57.860 -2.236 2.985
282 2HB PHE 42 HB1 PHE 42 59.498 -2.460 3.598
283 HD1 PHE 42 HD1 PHE 42 60.992 -3.362 1.261
284 HD2 PHE 42 HD2 PHE 42 57.910 -0.384 1.548
285 HE1 PHE 42 HE1 PHE 42 61.898 -2.231 -0.752
286 HE2 PHE 42 HE2 PHE 42 58.816 0.746 -0.465
287 HZ PHE 42 HZ PHE 42 60.810 -0.175 -1.615
288 H ASP 43 HN ASP 43 58.635 -4.108 5.063
289 HA ASP 43 HA ASP 43 55.878 -4.911 5.432
290 1HB ASP 43 HB2 ASP 43 56.853 -7.008 4.544
291 2HB ASP 43 HB1 ASP 43 58.061 -6.985 5.827
292 H GLY 44 HN GLY 44 57.062 -2.827 6.638
293 1HA GLY 44 HA2 GLY 44 56.741 -2.366 9.085
294 2HA GLY 44 HA1 GLY 44 57.679 -3.831 9.384
295 H VAL 45 HN VAL 45 58.278 -1.098 7.127
296 HA VAL 45 HA VAL 45 60.816 -0.635 8.647
297 HB VAL 45 HB VAL 45 62.101 -0.842 6.701
298 1HG1 VAL 45 HG11 VAL 45 61.173 -2.830 5.404
299 2HG1 VAL 45 HG12 VAL 45 59.750 -2.727 6.433
300 3HG1 VAL 45 HG13 VAL 45 61.331 -3.056 7.146
301 1HG2 VAL 45 HG21 VAL 45 61.307 0.503 5.044
302 2HG2 VAL 45 HG22 VAL 45 59.626 0.111 5.392
303 3HG2 VAL 45 HG23 VAL 45 60.609 -0.999 4.434
304 H THR 46 HN THR 46 61.865 1.376 7.125
305 HA THR 46 HA THR 46 59.832 3.477 6.685
306 HB THR 46 HB THR 46 61.987 3.719 8.806
307 HG1 THR 46 HG1 THR 46 59.939 3.669 10.137
308 1HG2 THR 46 HG21 THR 46 59.603 5.417 8.040
309 2HG2 THR 46 HG22 THR 46 61.304 5.863 7.937
310 3HG2 THR 46 HG23 THR 46 60.543 5.656 9.514
311 H ILE 47 HN ILE 47 61.369 2.568 4.689
312 HA ILE 47 HA ILE 47 63.976 3.917 4.566
313 HB ILE 47 HB ILE 47 63.479 1.673 3.610
314 1HG1 ILE 47 HG12 ILE 47 64.035 3.496 1.286
315 2HG1 ILE 47 HG11 ILE 47 65.170 3.440 2.635
316 1HG2 ILE 47 HG21 ILE 47 62.159 2.570 1.210
317 2HG2 ILE 47 HG22 ILE 47 61.206 3.045 2.616
318 3HG2 ILE 47 HG23 ILE 47 61.629 1.351 2.369
319 1HD1 ILE 47 HD1 ILE 47 64.880 0.810 2.296
320 2HD1 ILE 47 HD1 ILE 47 66.042 1.734 1.344
321 3HD1 ILE 47 HD1 ILE 47 64.474 1.313 0.654
322 H THR 48 HN THR 48 64.516 5.550 3.028
323 HA THR 48 HA THR 48 62.303 6.936 1.611
324 HB THR 48 HB THR 48 62.962 9.071 2.716
325 HG1 THR 48 HG1 THR 48 64.407 8.992 4.412
326 1HG2 THR 48 HG21 THR 48 61.659 8.714 4.583
327 2HG2 THR 48 HG22 THR 48 62.476 7.207 4.995
328 3HG2 THR 48 HG23 THR 48 61.287 7.238 3.693
329 H THR 49 HN THR 49 63.100 8.186 -0.163
330 HA THR 49 HA THR 49 64.626 8.547 -1.946
331 HB THR 49 HB THR 49 65.887 10.287 -1.218
332 HG1 THR 49 HG1 THR 49 67.735 9.423 -0.757
333 1HG2 THR 49 HG21 THR 49 65.420 11.136 0.934
334 2HG2 THR 49 HG22 THR 49 65.278 9.518 1.627
335 3HG2 THR 49 HG23 THR 49 64.017 10.134 0.554
336 H SER 50 HN SER 50 64.667 5.770 -0.879
337 HA SER 50 HA SER 50 67.563 5.077 -1.098
338 1HB SER 50 HB2 SER 50 66.380 4.133 0.786
339 2HB SER 50 HB1 SER 50 65.068 3.577 -0.251
340 HG SER 50 HG SER 50 67.767 2.696 -0.214
341 H THR 51 HN THR 51 68.325 4.259 -2.993
342 HA THR 51 HA THR 51 66.415 3.694 -5.190
343 HB THR 51 HB THR 51 69.427 3.569 -5.258
344 HG1 THR 51 HG1 THR 51 69.538 5.671 -5.093
345 1HG2 THR 51 HG21 THR 51 69.104 4.325 -7.554
346 2HG2 THR 51 HG22 THR 51 67.375 4.521 -7.274
347 3HG2 THR 51 HG23 THR 51 68.093 2.910 -7.262
348 H SER 52 HN SER 52 67.001 1.834 -2.790
349 HA SER 52 HA SER 52 68.477 -0.421 -3.276
350 1HB SER 52 HB2 SER 52 65.735 -1.113 -2.553
351 2HB SER 52 HB1 SER 52 67.199 -1.196 -1.577
352 HG SER 52 HG SER 52 66.138 0.388 -0.600
353 H THR 53 HN THR 53 68.647 -1.834 -4.974
354 HA THR 53 HA THR 53 66.378 -1.977 -6.925
355 HB THR 53 HB THR 53 69.160 -3.031 -7.379
356 HG1 THR 53 HG1 THR 53 69.699 -0.904 -8.078
357 1HG2 THR 53 HG21 THR 53 68.485 -3.099 -9.531
358 2HG2 THR 53 HG22 THR 53 67.835 -1.460 -9.455
359 3HG2 THR 53 HG23 THR 53 66.856 -2.824 -8.916
360 H GLY 54 HN GLY 54 65.120 -3.597 -5.872
361 1HA GLY 54 HA2 GLY 54 64.497 -5.842 -5.515
362 2HA GLY 54 HA1 GLY 54 66.024 -6.329 -6.256
363 H SER 55 HN SER 55 64.660 -5.025 -3.240
364 HA SER 55 HA SER 55 66.667 -6.613 -1.721
365 1HB SER 55 HB2 SER 55 66.812 -4.327 -0.350
366 2HB SER 55 HB1 SER 55 67.826 -4.610 -1.761
367 HG SER 55 HG SER 55 65.252 -3.477 -1.993
368 H ARG 56 HN ARG 56 65.399 -7.782 -0.307
369 HA ARG 56 HA ARG 56 62.692 -7.064 0.396
370 1HB ARG 56 HB2 ARG 56 64.370 -9.277 0.523
371 2HB ARG 56 HB1 ARG 56 64.137 -8.857 2.219
372 1HG ARG 56 HG2 ARG 56 61.820 -9.175 2.119
373 2HG ARG 56 HG1 ARG 56 61.769 -8.965 0.368
374 1HD ARG 56 HD2 ARG 56 63.242 -11.124 0.296
375 2HD ARG 56 HD1 ARG 56 62.643 -11.380 1.946
376 HE ARG 56 HE ARG 56 60.980 -11.346 -0.505
377 1HH1 ARG 56 HH1 ARG 56 60.965 -10.744 2.860
378 2HH1 ARG 56 HH1 ARG 56 59.478 -11.584 3.152
379 1HH2 ARG 56 HH2 ARG 56 59.174 -12.726 -0.108
380 2HH2 ARG 56 HH2 ARG 56 58.469 -12.709 1.474
381 H ILE 57 HN ILE 57 62.405 -5.167 1.579
382 HA ILE 57 HA ILE 57 64.336 -4.434 3.687
383 HB ILE 57 HB ILE 57 61.726 -3.083 2.955
384 1HG1 ILE 57 HG12 ILE 57 62.997 -3.569 0.870
385 2HG1 ILE 57 HG11 ILE 57 62.970 -1.842 1.226
386 1HG2 ILE 57 HG21 ILE 57 63.223 -1.062 3.471
387 2HG2 ILE 57 HG22 ILE 57 64.374 -2.224 4.128
388 3HG2 ILE 57 HG23 ILE 57 62.769 -2.073 4.842
389 1HD1 ILE 57 HD1 ILE 57 65.211 -3.082 2.558
390 2HD1 ILE 57 HD1 ILE 57 65.215 -1.784 1.365
391 3HD1 ILE 57 HD1 ILE 57 65.248 -3.467 0.837
392 H SER 58 HN SER 58 61.769 -6.529 3.515
393 HA SER 58 HA SER 58 59.970 -6.134 5.557
394 1HB SER 58 HB2 SER 58 61.380 -8.389 4.328
395 2HB SER 58 HB1 SER 58 60.851 -8.742 5.969
396 HG SER 58 HG SER 58 59.183 -9.214 4.544
397 H GLY 59 HN GLY 59 60.179 -5.577 7.711
398 1HA GLY 59 HA2 GLY 59 62.171 -6.830 9.410
399 2HA GLY 59 HA1 GLY 59 62.566 -5.147 9.074
400 HA PRO 60 HA PRO 60 59.042 -5.619 12.245
401 1HB PRO 60 HB2 PRO 60 60.354 -6.220 14.570
402 2HB PRO 60 HB1 PRO 60 59.686 -7.463 13.493
403 1HG PRO 60 HG2 PRO 60 62.493 -6.558 13.828
404 2HG PRO 60 HG1 PRO 60 61.859 -8.173 13.482
405 1HD PRO 60 HD2 PRO 60 62.981 -6.493 11.607
406 2HD PRO 60 HD1 PRO 60 61.863 -7.822 11.235
407 H GLY 61 HN GLY 61 59.395 -3.283 11.630
408 1HA GLY 61 HA2 GLY 61 59.461 -1.112 12.662
409 2HA GLY 61 HA1 GLY 61 60.487 -1.776 13.934
410 H CYS 62 HN CYS 62 61.390 -2.700 10.767
411 HA CYS 62 HA CYS 62 64.014 -1.838 10.802
412 1HB CYS 62 HB2 CYS 62 63.132 -3.246 9.061
413 2HB CYS 62 HB1 CYS 62 62.009 -1.994 8.533
414 H LYS 63 HN LYS 63 65.076 -0.017 9.609
415 HA LYS 63 HA LYS 63 63.457 2.456 9.289
416 1HB LYS 63 HB2 LYS 63 64.050 2.504 11.618
417 2HB LYS 63 HB1 LYS 63 65.701 1.981 11.268
418 1HG LYS 63 HG2 LYS 63 66.104 4.091 10.046
419 2HG LYS 63 HG1 LYS 63 64.464 4.618 10.422
420 1HD LYS 63 HD2 LYS 63 65.658 5.629 12.145
421 2HD LYS 63 HD1 LYS 63 65.187 4.108 12.904
422 1HE LYS 63 HE2 LYS 63 67.405 3.794 13.309
423 2HE LYS 63 HE1 LYS 63 67.570 3.489 11.569
424 1HZ LYS 63 HZ1 LYS 63 67.591 6.191 12.802
425 2HZ LYS 63 HZ2 LYS 63 67.886 5.813 11.171
426 3HZ LYS 63 HZ3 LYS 63 68.991 5.335 12.372
427 H ILE 64 HN ILE 64 64.125 3.078 7.220
428 HA ILE 64 HA ILE 64 67.069 3.038 6.709
429 HB ILE 64 HB ILE 64 64.816 2.336 4.815
430 1HG1 ILE 64 HG12 ILE 64 66.888 0.346 5.315
431 2HG1 ILE 64 HG11 ILE 64 66.031 0.792 6.791
432 1HG2 ILE 64 HG21 ILE 64 66.636 1.741 3.259
433 2HG2 ILE 64 HG22 ILE 64 67.825 2.306 4.433
434 3HG2 ILE 64 HG23 ILE 64 66.708 3.450 3.687
435 1HD1 ILE 64 HD1 ILE 64 64.613 0.076 4.217
436 2HD1 ILE 64 HD1 ILE 64 63.905 0.246 5.823
437 3HD1 ILE 64 HD1 ILE 64 64.982 -1.105 5.473
438 H SER 65 HN SER 65 67.827 4.702 5.230
439 HA SER 65 HA SER 65 65.932 6.804 4.385
440 1HB SER 65 HB2 SER 65 66.398 8.248 6.070
441 2HB SER 65 HB1 SER 65 67.099 6.871 6.913
442 HG SER 65 HG SER 65 68.313 9.042 5.964
443 H THR 66 HN THR 66 66.625 7.306 2.369
444 HA THR 66 HA THR 66 68.049 7.510 0.496
445 HB THR 66 HB THR 66 69.877 8.712 2.586
446 HG1 THR 66 HG1 THR 66 67.760 9.447 2.916
447 1HG2 THR 66 HG21 THR 66 69.909 8.566 -0.248
448 2HG2 THR 66 HG22 THR 66 70.982 9.502 0.796
449 3HG2 THR 66 HG23 THR 66 69.500 10.229 0.175
450 H CYS 67 HN CYS 67 68.335 5.044 0.705
451 HA CYS 67 HA CYS 67 71.242 4.417 1.203
452 1HB CYS 67 HB2 CYS 67 68.711 2.794 1.616
453 2HB CYS 67 HB1 CYS 67 70.326 2.096 1.689
454 H ILE 68 HN ILE 68 72.246 3.972 -0.739
455 HA ILE 68 HA ILE 68 70.623 3.276 -3.110
456 HB ILE 68 HB ILE 68 73.563 3.841 -2.622
457 1HG1 ILE 68 HG12 ILE 68 72.977 5.898 -3.971
458 2HG1 ILE 68 HG11 ILE 68 71.284 5.413 -3.862
459 1HG2 ILE 68 HG21 ILE 68 72.132 2.737 -4.954
460 2HG2 ILE 68 HG22 ILE 68 73.852 2.698 -4.568
461 3HG2 ILE 68 HG23 ILE 68 73.150 4.130 -5.318
462 1HD1 ILE 68 HD1 ILE 68 72.944 5.615 -1.368
463 2HD1 ILE 68 HD1 ILE 68 71.196 5.753 -1.552
464 3HD1 ILE 68 HD1 ILE 68 72.246 7.072 -2.077
465 H ILE 69 HN ILE 69 69.973 1.128 -2.414
466 HA ILE 69 HA ILE 69 72.162 -0.884 -2.188
467 HB ILE 69 HB ILE 69 69.177 -1.161 -1.727
468 1HG1 ILE 69 HG12 ILE 69 70.923 -0.992 0.625
469 2HG1 ILE 69 HG11 ILE 69 70.895 0.499 -0.316
470 1HG2 ILE 69 HG21 ILE 69 69.645 -3.217 -0.782
471 2HG2 ILE 69 HG22 ILE 69 71.283 -2.751 -0.322
472 3HG2 ILE 69 HG23 ILE 69 70.920 -3.158 -1.998
473 1HD1 ILE 69 HD1 ILE 69 68.506 -0.985 0.809
474 2HD1 ILE 69 HD1 ILE 69 68.384 0.386 -0.294
475 3HD1 ILE 69 HD1 ILE 69 69.098 0.600 1.306
476 H THR 70 HN THR 70 71.999 -2.860 -3.480
477 HA THR 70 HA THR 70 70.122 -2.874 -5.771
478 HB THR 70 HB THR 70 73.139 -2.636 -6.004
479 HG1 THR 70 HG1 THR 70 72.466 -0.763 -7.237
480 1HG2 THR 70 HG21 THR 70 71.695 -4.191 -7.625
481 2HG2 THR 70 HG22 THR 70 73.006 -3.182 -8.237
482 3HG2 THR 70 HG23 THR 70 71.334 -2.637 -8.378
483 H GLY 71 HN GLY 71 69.377 -4.964 -5.343
484 1HA GLY 71 HA2 GLY 71 69.569 -7.327 -5.660
485 2HA GLY 71 HA1 GLY 71 71.324 -7.151 -5.687
486 H GLY 72 HN GLY 72 69.736 -5.517 -3.126
487 1HA GLY 72 HA2 GLY 72 69.299 -6.243 -0.882
488 2HA GLY 72 HA1 GLY 72 70.045 -7.796 -1.263
489 H VAL 73 HN VAL 73 71.826 -5.135 -2.405
490 HA VAL 73 HA VAL 73 73.691 -5.326 -0.051
491 HB VAL 73 HB VAL 73 75.479 -5.139 -1.706
492 1HG1 VAL 73 HG11 VAL 73 75.030 -7.197 -3.031
493 2HG1 VAL 73 HG12 VAL 73 73.333 -7.109 -2.560
494 3HG1 VAL 73 HG13 VAL 73 74.574 -7.393 -1.338
495 1HG2 VAL 73 HG21 VAL 73 73.188 -4.293 -3.381
496 2HG2 VAL 73 HG22 VAL 73 74.366 -5.326 -4.193
497 3HG2 VAL 73 HG23 VAL 73 74.881 -3.805 -3.463
498 HA PRO 74 HA PRO 74 72.986 -0.917 -0.047
499 1HB PRO 74 HB2 PRO 74 74.481 -0.375 2.175
500 2HB PRO 74 HB1 PRO 74 72.853 -1.072 2.257
501 1HG PRO 74 HG2 PRO 74 75.481 -2.357 2.653
502 2HG PRO 74 HG1 PRO 74 73.906 -2.768 3.341
503 1HD PRO 74 HD2 PRO 74 75.183 -4.084 1.222
504 2HD PRO 74 HD1 PRO 74 73.482 -4.265 1.699
505 H ALA 75 HN ALA 75 74.137 0.654 -1.139
506 HA ALA 75 HA ALA 75 76.890 0.158 -1.974
507 1HB ALA 75 HB1 ALA 75 74.976 2.506 -2.231
508 2HB ALA 75 HB2 ALA 75 75.256 1.244 -3.431
509 3HB ALA 75 HB3 ALA 75 76.531 2.405 -3.059
510 HA PRO 76 HA PRO 76 78.972 2.296 1.244
511 1HB PRO 76 HB2 PRO 76 80.942 3.629 -0.124
512 2HB PRO 76 HB1 PRO 76 80.971 1.877 0.157
513 1HG PRO 76 HG2 PRO 76 80.153 3.386 -2.279
514 2HG PRO 76 HG1 PRO 76 81.083 1.885 -2.141
515 1HD PRO 76 HD2 PRO 76 78.454 1.922 -2.801
516 2HD PRO 76 HD1 PRO 76 79.203 0.582 -1.903
517 H SER 77 HN SER 77 76.745 3.612 1.058
518 HA SER 77 HA SER 77 77.232 6.425 0.209
519 1HB SER 77 HB2 SER 77 75.177 4.856 -0.304
520 2HB SER 77 HB1 SER 77 74.665 5.317 1.318
521 HG SER 77 HG SER 77 75.205 7.555 0.455
522 H ALA 78 HN ALA 78 77.993 7.769 1.781
523 HA ALA 78 HA ALA 78 77.965 7.114 4.598
524 1HB ALA 78 HB1 ALA 78 78.304 9.911 3.597
525 2HB ALA 78 HB2 ALA 78 79.437 8.695 3.007
526 3HB ALA 78 HB3 ALA 78 79.297 9.004 4.738
527 H ALA 79 HN ALA 79 75.515 8.202 2.567
528 HA ALA 79 HA ALA 79 74.190 9.885 4.628
529 1HB ALA 79 HB1 ALA 79 73.927 10.917 2.591
530 2HB ALA 79 HB2 ALA 79 72.521 9.857 2.506
531 3HB ALA 79 HB3 ALA 79 74.020 9.399 1.697
532 H CYS 80 HN CYS 80 74.091 6.648 3.340
533 HA CYS 80 HA CYS 80 71.330 6.060 3.941
534 1HB CYS 80 HB2 CYS 80 72.601 4.716 2.396
535 2HB CYS 80 HB1 CYS 80 73.822 4.373 3.608
536 H LYS 81 HN LYS 81 70.685 4.509 5.716
537 HA LYS 81 HA LYS 81 71.962 5.355 8.273
538 1HB LYS 81 HB2 LYS 81 69.806 5.275 9.109
539 2HB LYS 81 HB1 LYS 81 69.462 5.580 7.408
540 1HG LYS 81 HG2 LYS 81 69.361 2.916 8.857
541 2HG LYS 81 HG1 LYS 81 68.021 3.776 8.105
542 1HD LYS 81 HD2 LYS 81 68.707 3.214 5.934
543 2HD LYS 81 HD1 LYS 81 70.373 2.971 6.413
544 1HE LYS 81 HE2 LYS 81 69.346 1.016 7.880
545 2HE LYS 81 HE1 LYS 81 68.077 1.087 6.647
546 1HZ LYS 81 HZ1 LYS 81 70.159 -0.321 6.166
547 2HZ LYS 81 HZ2 LYS 81 70.918 1.169 5.874
548 3HZ LYS 81 HZ3 LYS 81 69.574 0.702 4.946
549 H ILE 82 HN ILE 82 72.329 2.678 6.371
550 HA ILE 82 HA ILE 82 71.887 0.271 7.231
551 HB ILE 82 HB ILE 82 74.537 1.646 6.964
552 1HG1 ILE 82 HG12 ILE 82 74.291 -0.609 5.303
553 2HG1 ILE 82 HG11 ILE 82 72.679 0.102 5.354
554 1HG2 ILE 82 HG21 ILE 82 75.422 0.079 8.399
555 2HG2 ILE 82 HG22 ILE 82 75.340 -0.930 6.955
556 3HG2 ILE 82 HG23 ILE 82 74.074 -1.037 8.177
557 1HD1 ILE 82 HD1 ILE 82 73.584 1.362 3.647
558 2HD1 ILE 82 HD1 ILE 82 75.223 1.248 4.291
559 3HD1 ILE 82 HD1 ILE 82 74.065 2.359 5.022
560 H SER 83 HN SER 83 70.748 0.504 9.354
561 HA SER 83 HA SER 83 72.679 0.330 11.646
562 1HB SER 83 HB2 SER 83 70.324 2.024 11.110
563 2HB SER 83 HB1 SER 83 70.343 1.294 12.713
564 HG SER 83 HG SER 83 71.481 3.376 12.413
565 H GLY 84 HN GLY 84 69.138 -0.161 11.287
566 1HA GLY 84 HA2 GLY 84 69.571 -2.944 12.293
567 2HA GLY 84 HA1 GLY 84 68.305 -1.917 12.959
568 H CYS 85 HN CYS 85 69.304 -3.724 10.104
569 HA CYS 85 HA CYS 85 66.611 -4.460 9.452
570 1HB CYS 85 HB2 CYS 85 66.890 -1.902 8.872
571 2HB CYS 85 HB1 CYS 85 67.731 -2.515 7.446
572 H THR 86 HN THR 86 67.114 -4.512 6.540
573 HA THR 86 HA THR 86 69.562 -5.708 5.793
574 HB THR 86 HB THR 86 69.090 -7.402 7.450
575 HG1 THR 86 HG1 THR 86 69.457 -8.939 6.086
576 1HG2 THR 86 HG21 THR 86 66.336 -7.602 6.190
577 2HG2 THR 86 HG22 THR 86 66.694 -6.853 7.747
578 3HG2 THR 86 HG23 THR 86 66.933 -8.586 7.527
579 H PHE 87 HN PHE 87 69.308 -6.780 3.630
580 HA PHE 87 HA PHE 87 66.751 -5.926 2.319
581 1HB PHE 87 HB2 PHE 87 69.425 -6.426 1.001
582 2HB PHE 87 HB1 PHE 87 68.076 -5.473 0.389
583 HD1 PHE 87 HD1 PHE 87 71.087 -4.684 0.882
584 HD2 PHE 87 HD2 PHE 87 67.450 -4.087 3.095
585 HE1 PHE 87 HE1 PHE 87 72.053 -2.671 1.932
586 HE2 PHE 87 HE2 PHE 87 68.425 -2.055 4.148
587 HZ PHE 87 HZ PHE 87 70.731 -1.350 3.561
588 H SER 88 HN SER 88 69.344 -8.392 2.043
589 HA SER 88 HA SER 88 69.185 -10.696 1.523
590 1HB SER 88 HB2 SER 88 67.060 -10.054 3.127
591 2HB SER 88 HB1 SER 88 66.231 -10.684 1.706
592 HG SER 88 HG SER 88 67.456 -12.030 3.625
593 H ALA 89 HN ALA 89 68.164 -8.256 -0.365
594 HA ALA 89 HA ALA 89 67.548 -8.087 -2.634
595 1HB ALA 89 HB1 ALA 89 69.084 -9.382 -3.659
596 2HB ALA 89 HB2 ALA 89 68.055 -10.794 -3.416
597 3HB ALA 89 HB3 ALA 89 69.241 -10.345 -2.189
598 H ASN 90 HN ASN 90 65.355 -7.919 -2.983
599 HA ASN 90 HA ASN 90 63.771 -10.456 -3.062
600 1HB ASN 90 HB2 ASN 90 63.214 -9.501 -0.961
601 2HB ASN 90 HB1 ASN 90 63.195 -7.861 -1.610
602 1HD2 ASN 90 HD2 ASN 90 61.142 -7.074 -2.120
603 2HD2 ASN 90 HD2 ASN 90 59.777 -8.039 -2.421
Start of MODEL 14
1 1H ASP 1 HT1 ASP 1 46.379 9.341 5.482
2 2H ASP 1 HT2 ASP 1 47.605 10.074 4.561
3 3H ASP 1 HT3 ASP 1 48.000 8.899 5.724
4 HA ASP 1 HA ASP 1 47.225 8.547 2.990
5 1HB ASP 1 HB2 ASP 1 48.341 6.407 3.459
6 2HB ASP 1 HB1 ASP 1 49.259 7.728 4.181
7 H GLY 2 HN GLY 2 46.452 5.841 3.067
8 1HA GLY 2 HA2 GLY 2 44.441 4.904 4.653
9 2HA GLY 2 HA1 GLY 2 43.599 6.130 3.706
10 H SER 3 HN SER 3 44.135 5.930 1.229
11 HA SER 3 HA SER 3 44.080 3.019 0.492
12 1HB SER 3 HB2 SER 3 42.400 5.390 -0.262
13 2HB SER 3 HB1 SER 3 42.599 4.086 -1.429
14 HG SER 3 HG SER 3 41.004 4.181 0.687
15 H CYS 4 HN CYS 4 45.748 2.493 -0.880
16 HA CYS 4 HA CYS 4 46.565 4.323 -3.028
17 1HB CYS 4 HB2 CYS 4 47.765 4.463 -0.469
18 2HB CYS 4 HB1 CYS 4 48.933 3.661 -1.516
19 H THR 5 HN THR 5 49.137 3.118 -3.435
20 HA THR 5 HA THR 5 48.986 0.229 -3.444
21 HB THR 5 HB THR 5 48.192 1.882 -5.865
22 HG1 THR 5 HG1 THR 5 46.329 0.968 -5.549
23 1HG2 THR 5 HG21 THR 5 49.709 -0.595 -5.793
24 2HG2 THR 5 HG22 THR 5 49.315 0.431 -7.169
25 3HG2 THR 5 HG23 THR 5 48.174 -0.803 -6.630
26 H ASN 6 HN ASN 6 50.829 2.422 -2.778
27 HA ASN 6 HA ASN 6 53.106 3.008 -3.095
28 1HB ASN 6 HB2 ASN 6 53.424 0.595 -2.866
29 2HB ASN 6 HB1 ASN 6 52.871 0.335 -4.517
30 1HD2 ASN 6 HD2 ASN 6 55.651 0.573 -2.661
31 2HD2 ASN 6 HD2 ASN 6 56.754 1.004 -3.876
32 H THR 7 HN THR 7 52.931 1.277 -6.128
33 HA THR 7 HA THR 7 52.478 3.792 -7.655
34 HB THR 7 HB THR 7 54.888 1.969 -7.689
35 HG1 THR 7 HG1 THR 7 54.395 4.740 -7.464
36 1HG2 THR 7 HG21 THR 7 54.512 2.041 -9.984
37 2HG2 THR 7 HG22 THR 7 55.484 3.493 -9.753
38 3HG2 THR 7 HG23 THR 7 53.732 3.622 -9.910
39 H ASN 8 HN ASN 8 51.736 0.583 -7.139
40 HA ASN 8 HA ASN 8 50.014 0.259 -9.379
41 1HB ASN 8 HB2 ASN 8 51.372 -1.165 -10.814
42 2HB ASN 8 HB1 ASN 8 52.281 0.312 -10.523
43 1HD2 ASN 8 HD2 ASN 8 53.722 0.145 -8.403
44 2HD2 ASN 8 HD2 ASN 8 54.567 -1.311 -8.215
45 H SER 9 HN SER 9 51.911 -1.137 -6.781
46 HA SER 9 HA SER 9 50.685 -3.795 -7.017
47 1HB SER 9 HB2 SER 9 52.219 -4.327 -5.245
48 2HB SER 9 HB1 SER 9 53.055 -3.252 -6.357
49 HG SER 9 HG SER 9 52.168 -1.545 -4.863
50 H GLN 10 HN GLN 10 51.020 -3.178 -3.759
51 HA GLN 10 HA GLN 10 48.103 -2.574 -3.461
52 1HB GLN 10 HB2 GLN 10 47.901 -4.462 -2.118
53 2HB GLN 10 HB1 GLN 10 49.174 -4.996 -3.212
54 1HG GLN 10 HG2 GLN 10 50.888 -4.387 -1.588
55 2HG GLN 10 HG1 GLN 10 49.665 -3.729 -0.501
56 1HE2 GLN 10 HE21 GLN 10 51.557 -6.396 -0.836
57 2HE2 GLN 10 HE22 GLN 10 50.545 -7.573 -0.150
58 H LEU 11 HN LEU 11 51.275 -2.575 -1.802
59 HA LEU 11 HA LEU 11 52.097 -1.144 -0.107
60 1HB LEU 11 HB2 LEU 11 51.338 0.500 -1.877
61 2HB LEU 11 HB1 LEU 11 49.802 0.617 -1.015
62 HG LEU 11 HG LEU 11 50.859 1.503 0.940
63 1HD1 LEU 11 HD1 LEU 11 53.457 1.832 0.774
64 2HD1 LEU 11 HD1 LEU 11 53.363 0.522 -0.403
65 3HD1 LEU 11 HD1 LEU 11 52.814 0.260 1.253
66 1HD2 LEU 11 HD2 LEU 11 50.599 3.065 -1.024
67 2HD2 LEU 11 HD2 LEU 11 52.292 2.766 -1.411
68 3HD2 LEU 11 HD2 LEU 11 51.860 3.543 0.112
69 H SER 12 HN SER 12 51.670 -2.123 1.828
70 HA SER 12 HA SER 12 49.419 -3.067 3.015
71 1HB SER 12 HB2 SER 12 50.777 -3.102 4.836
72 2HB SER 12 HB1 SER 12 51.967 -2.320 3.800
73 HG SER 12 HG SER 12 51.808 -0.798 5.254
74 H ALA 13 HN ALA 13 47.590 -2.269 4.084
75 HA ALA 13 HA ALA 13 46.476 0.221 3.301
76 1HB ALA 13 HB1 ALA 13 45.256 -1.774 4.136
77 2HB ALA 13 HB2 ALA 13 44.813 -0.329 5.043
78 3HB ALA 13 HB3 ALA 13 45.929 -1.501 5.744
79 H ASN 14 HN ASN 14 48.886 -0.453 5.657
80 HA ASN 14 HA ASN 14 48.385 2.172 7.005
81 1HB ASN 14 HB2 ASN 14 49.485 1.187 8.904
82 2HB ASN 14 HB1 ASN 14 48.357 -0.022 8.293
83 1HD2 ASN 14 HD2 ASN 14 49.246 -1.914 7.216
84 2HD2 ASN 14 HD2 ASN 14 50.899 -2.287 7.293
85 H SER 15 HN SER 15 50.157 1.074 4.492
86 HA SER 15 HA SER 15 52.808 2.052 5.284
87 1HB SER 15 HB2 SER 15 52.064 0.189 3.574
88 2HB SER 15 HB1 SER 15 51.897 1.542 2.465
89 HG SER 15 HG SER 15 54.197 0.695 3.883
90 H LYS 16 HN LYS 16 53.354 3.393 2.724
91 HA LYS 16 HA LYS 16 51.577 5.786 2.814
92 1HB LYS 16 HB2 LYS 16 53.694 5.714 4.426
93 2HB LYS 16 HB1 LYS 16 54.545 6.171 2.951
94 1HG LYS 16 HG2 LYS 16 53.025 8.091 2.660
95 2HG LYS 16 HG1 LYS 16 52.169 7.636 4.134
96 1HD LYS 16 HD2 LYS 16 54.311 7.877 5.402
97 2HD LYS 16 HD1 LYS 16 55.079 8.462 3.925
98 1HE LYS 16 HE2 LYS 16 52.541 9.790 4.836
99 2HE LYS 16 HE1 LYS 16 54.066 10.202 5.647
100 1HZ LYS 16 HZ1 LYS 16 53.735 11.600 3.701
101 2HZ LYS 16 HZ2 LYS 16 53.595 10.228 2.710
102 3HZ LYS 16 HZ3 LYS 16 55.072 10.582 3.475
103 H CYS 17 HN CYS 17 51.762 7.107 0.906
104 HA CYS 17 HA CYS 17 53.560 6.121 -1.263
105 1HB CYS 17 HB2 CYS 17 51.518 6.193 -2.773
106 2HB CYS 17 HB1 CYS 17 51.479 4.925 -1.554
107 H GLU 18 HN GLU 18 52.214 7.816 -3.236
108 HA GLU 18 HA GLU 18 52.320 10.045 -4.011
109 1HB GLU 18 HB2 GLU 18 51.743 10.452 -1.057
110 2HB GLU 18 HB1 GLU 18 51.579 11.703 -2.290
111 1HG GLU 18 HG2 GLU 18 50.212 9.153 -2.905
112 2HG GLU 18 HG1 GLU 18 49.545 10.050 -1.539
113 H LYS 19 HN LYS 19 53.742 11.959 -3.972
114 HA LYS 19 HA LYS 19 55.950 12.825 -3.868
115 1HB LYS 19 HB2 LYS 19 54.668 12.590 -1.295
116 2HB LYS 19 HB1 LYS 19 56.411 12.403 -1.100
117 1HG LYS 19 HG2 LYS 19 56.498 14.665 -1.166
118 2HG LYS 19 HG1 LYS 19 56.221 14.495 -2.901
119 1HD LYS 19 HD2 LYS 19 54.267 15.579 -2.661
120 2HD LYS 19 HD1 LYS 19 53.689 14.254 -1.650
121 1HE LYS 19 HE2 LYS 19 54.898 15.383 0.303
122 2HE LYS 19 HE1 LYS 19 55.073 16.798 -0.757
123 1HZ LYS 19 HZ1 LYS 19 52.869 17.196 -0.753
124 2HZ LYS 19 HZ2 LYS 19 52.895 16.338 0.713
125 3HZ LYS 19 HZ3 LYS 19 52.450 15.553 -0.727
126 H SER 20 HN SER 20 56.366 10.504 -4.972
127 HA SER 20 HA SER 20 58.844 9.490 -3.831
128 1HB SER 20 HB2 SER 20 57.928 7.209 -3.390
129 2HB SER 20 HB1 SER 20 57.209 8.433 -2.346
130 HG SER 20 HG SER 20 56.130 7.253 -4.689
131 H THR 21 HN THR 21 59.792 7.819 -5.277
132 HA THR 21 HA THR 21 58.465 7.726 -7.972
133 HB THR 21 HB THR 21 60.303 9.239 -8.144
134 HG1 THR 21 HG1 THR 21 61.455 8.196 -9.615
135 1HG2 THR 21 HG21 THR 21 61.729 7.251 -6.371
136 2HG2 THR 21 HG22 THR 21 61.388 8.950 -6.044
137 3HG2 THR 21 HG23 THR 21 62.592 8.509 -7.255
138 H LEU 22 HN LEU 22 57.724 5.600 -7.947
139 HA LEU 22 HA LEU 22 59.802 3.492 -7.589
140 1HB LEU 22 HB2 LEU 22 57.569 2.413 -6.369
141 2HB LEU 22 HB1 LEU 22 58.937 3.125 -5.522
142 HG LEU 22 HG LEU 22 56.717 4.908 -6.475
143 1HD1 LEU 22 HD1 LEU 22 56.072 4.378 -3.854
144 2HD1 LEU 22 HD1 LEU 22 56.526 2.781 -4.450
145 3HD1 LEU 22 HD1 LEU 22 55.242 3.689 -5.249
146 1HD2 LEU 22 HD2 LEU 22 57.772 6.417 -5.153
147 2HD2 LEU 22 HD2 LEU 22 59.105 5.263 -5.092
148 3HD2 LEU 22 HD2 LEU 22 57.887 5.272 -3.816
149 H THR 23 HN THR 23 58.294 1.275 -7.857
150 HA THR 23 HA THR 23 56.236 1.308 -9.858
151 HB THR 23 HB THR 23 59.129 1.210 -10.694
152 HG1 THR 23 HG1 THR 23 58.290 3.055 -11.309
153 1HG2 THR 23 HG21 THR 23 56.838 -0.307 -11.931
154 2HG2 THR 23 HG22 THR 23 58.486 -0.854 -11.619
155 3HG2 THR 23 HG23 THR 23 58.169 0.285 -12.927
156 H ASN 24 HN ASN 24 55.470 -0.848 -10.164
157 HA ASN 24 HA ASN 24 55.137 -3.081 -9.450
158 1HB ASN 24 HB2 ASN 24 58.126 -2.975 -9.985
159 2HB ASN 24 HB1 ASN 24 57.164 -4.453 -9.921
160 1HD2 ASN 24 HD2 ASN 24 57.823 -4.759 -12.255
161 2HD2 ASN 24 HD2 ASN 24 56.980 -3.917 -13.464
162 H CYS 25 HN CYS 25 54.593 -2.865 -7.222
163 HA CYS 25 HA CYS 25 56.831 -3.402 -5.317
164 1HB CYS 25 HB2 CYS 25 54.642 -1.319 -5.018
165 2HB CYS 25 HB1 CYS 25 55.933 -1.618 -3.859
166 H TYR 26 HN TYR 26 55.120 -3.184 -3.015
167 HA TYR 26 HA TYR 26 52.681 -4.532 -2.961
168 1HB TYR 26 HB2 TYR 26 54.916 -6.190 -3.836
169 2HB TYR 26 HB1 TYR 26 54.167 -6.848 -2.383
170 HD1 TYR 26 HD1 TYR 26 54.146 -7.641 -5.541
171 HD2 TYR 26 HD2 TYR 26 51.352 -5.930 -2.763
172 HE1 TYR 26 HE1 TYR 26 52.265 -8.513 -6.898
173 HE2 TYR 26 HE2 TYR 26 49.468 -6.802 -4.122
174 HH TYR 26 HH TYR 26 49.204 -8.821 -5.815
175 H VAL 27 HN VAL 27 54.143 -2.687 -1.428
176 HA VAL 27 HA VAL 27 55.457 -3.712 0.876
177 HB VAL 27 HB VAL 27 53.775 -1.208 0.579
178 1HG1 VAL 27 HG11 VAL 27 56.243 -0.898 2.006
179 2HG1 VAL 27 HG12 VAL 27 55.340 -2.240 2.709
180 3HG1 VAL 27 HG13 VAL 27 54.597 -0.644 2.588
181 1HG2 VAL 27 HG21 VAL 27 56.521 -1.950 -0.422
182 2HG2 VAL 27 HG22 VAL 27 56.112 -0.270 -0.074
183 3HG2 VAL 27 HG23 VAL 27 55.207 -1.163 -1.299
184 H ASP 28 HN ASP 28 54.692 -4.258 2.926
185 HA ASP 28 HA ASP 28 51.717 -4.455 3.265
186 1HB ASP 28 HB2 ASP 28 53.922 -6.448 3.450
187 2HB ASP 28 HB1 ASP 28 52.639 -6.579 4.652
188 H LYS 29 HN LYS 29 54.435 -2.977 4.383
189 HA LYS 29 HA LYS 29 53.291 -2.003 6.799
190 1HB LYS 29 HB2 LYS 29 54.611 -4.637 6.900
191 2HB LYS 29 HB1 LYS 29 55.226 -3.496 8.090
192 1HG LYS 29 HG2 LYS 29 52.457 -3.137 8.171
193 2HG LYS 29 HG1 LYS 29 52.672 -4.884 8.043
194 1HD LYS 29 HD2 LYS 29 54.552 -4.441 9.871
195 2HD LYS 29 HD1 LYS 29 53.564 -3.019 10.207
196 1HE LYS 29 HE2 LYS 29 52.572 -4.611 11.615
197 2HE LYS 29 HE1 LYS 29 51.577 -4.783 10.156
198 1HZ LYS 29 HZ1 LYS 29 53.645 -6.336 9.535
199 2HZ LYS 29 HZ2 LYS 29 52.244 -6.922 10.296
200 3HZ LYS 29 HZ3 LYS 29 53.624 -6.557 11.217
201 H SER 30 HN SER 30 54.376 -0.212 5.534
202 HA SER 30 HA SER 30 57.021 0.356 6.654
203 1HB SER 30 HB2 SER 30 56.598 -0.328 3.737
204 2HB SER 30 HB1 SER 30 58.026 0.522 4.314
205 HG SER 30 HG SER 30 58.500 -1.640 4.331
206 H GLU 31 HN GLU 31 57.795 2.309 4.772
207 HA GLU 31 HA GLU 31 55.431 4.147 4.619
208 1HB GLU 31 HB2 GLU 31 57.686 4.239 6.406
209 2HB GLU 31 HB1 GLU 31 57.727 5.648 5.348
210 1HG GLU 31 HG2 GLU 31 55.607 6.391 6.047
211 2HG GLU 31 HG1 GLU 31 55.162 4.806 6.682
212 H VAL 32 HN VAL 32 58.951 4.221 3.925
213 HA VAL 32 HA VAL 32 60.089 4.720 1.912
214 HB VAL 32 HB VAL 32 57.400 4.324 0.587
215 1HG1 VAL 32 HG11 VAL 32 59.371 5.057 -0.769
216 2HG1 VAL 32 HG12 VAL 32 58.759 3.471 -1.241
217 3HG1 VAL 32 HG13 VAL 32 60.218 3.595 -0.257
218 1HG2 VAL 32 HG21 VAL 32 59.323 2.225 1.640
219 2HG2 VAL 32 HG22 VAL 32 57.982 1.886 0.548
220 3HG2 VAL 32 HG23 VAL 32 57.664 2.487 2.174
221 H TYR 33 HN TYR 33 60.382 6.520 0.493
222 HA TYR 33 HA TYR 33 58.309 8.643 0.432
223 1HB TYR 33 HB2 TYR 33 60.955 8.708 1.857
224 2HB TYR 33 HB1 TYR 33 60.330 10.195 1.152
225 HD1 TYR 33 HD1 TYR 33 59.777 7.585 3.700
226 HD2 TYR 33 HD2 TYR 33 58.301 11.244 1.998
227 HE1 TYR 33 HE1 TYR 33 58.257 7.877 5.638
228 HE2 TYR 33 HE2 TYR 33 56.783 11.534 3.935
229 HH TYR 33 HH TYR 33 56.776 9.198 6.632
230 H GLY 34 HN GLY 34 61.818 8.759 -0.121
231 1HA GLY 34 HA2 GLY 34 61.266 9.333 -3.001
232 2HA GLY 34 HA1 GLY 34 62.688 9.904 -2.124
233 H THR 35 HN THR 35 61.329 6.651 -1.932
234 HA THR 35 HA THR 35 63.948 5.484 -2.550
235 HB THR 35 HB THR 35 61.279 4.674 -1.507
236 HG1 THR 35 HG1 THR 35 63.112 5.126 -0.206
237 1HG2 THR 35 HG21 THR 35 63.193 2.635 -2.676
238 2HG2 THR 35 HG22 THR 35 61.640 3.078 -3.387
239 3HG2 THR 35 HG23 THR 35 61.696 2.289 -1.809
240 H THR 36 HN THR 36 63.940 3.551 -4.142
241 HA THR 36 HA THR 36 62.406 4.297 -6.613
242 HB THR 36 HB THR 36 65.050 2.856 -6.585
243 HG1 THR 36 HG1 THR 36 65.769 4.553 -5.553
244 1HG2 THR 36 HG21 THR 36 64.118 2.987 -8.746
245 2HG2 THR 36 HG22 THR 36 65.234 4.351 -8.695
246 3HG2 THR 36 HG23 THR 36 63.504 4.618 -8.479
247 H CYS 37 HN CYS 37 61.001 2.619 -5.103
248 HA CYS 37 HA CYS 37 61.355 -0.082 -4.832
249 1HB CYS 37 HB2 CYS 37 59.300 1.343 -4.455
250 2HB CYS 37 HB1 CYS 37 58.984 1.221 -6.175
251 H THR 38 HN THR 38 62.625 -1.230 -6.345
252 HA THR 38 HA THR 38 61.798 -1.099 -9.218
253 HB THR 38 HB THR 38 64.304 -2.007 -7.770
254 HG1 THR 38 HG1 THR 38 63.452 0.257 -9.092
255 1HG2 THR 38 HG21 THR 38 64.505 -1.789 -10.663
256 2HG2 THR 38 HG22 THR 38 63.323 -3.009 -10.189
257 3HG2 THR 38 HG23 THR 38 64.984 -3.118 -9.606
258 H GLY 39 HN GLY 39 59.899 -2.528 -8.520
259 1HA GLY 39 HA2 GLY 39 58.894 -4.650 -8.542
260 2HA GLY 39 HA1 GLY 39 60.409 -5.262 -9.209
261 H SER 40 HN SER 40 59.647 -3.731 -6.073
262 HA SER 40 HA SER 40 60.522 -6.244 -4.706
263 1HB SER 40 HB2 SER 40 61.774 -4.579 -3.152
264 2HB SER 40 HB1 SER 40 62.486 -4.923 -4.725
265 HG SER 40 HG SER 40 61.189 -2.632 -3.784
266 H ARG 41 HN ARG 41 59.965 -6.094 -2.299
267 HA ARG 41 HA ARG 41 57.731 -4.231 -1.677
268 1HB ARG 41 HB2 ARG 41 56.322 -6.194 -1.040
269 2HB ARG 41 HB1 ARG 41 56.727 -6.197 -2.757
270 1HG ARG 41 HG2 ARG 41 58.826 -7.600 -1.844
271 2HG ARG 41 HG1 ARG 41 57.658 -8.011 -0.585
272 1HD ARG 41 HD2 ARG 41 56.732 -9.516 -1.999
273 2HD ARG 41 HD1 ARG 41 56.289 -8.183 -3.083
274 HE ARG 41 HE ARG 41 59.106 -9.037 -3.227
275 1HH1 ARG 41 HH2 ARG 41 56.401 -8.113 -4.950
276 2HH1 ARG 41 HH2 ARG 41 56.660 -9.181 -6.287
277 1HH2 ARG 41 HH1 ARG 41 59.236 -10.918 -4.747
278 2HH2 ARG 41 HH1 ARG 41 58.264 -10.770 -6.173
279 H PHE 42 HN PHE 42 57.283 -4.177 0.660
280 HA PHE 42 HA PHE 42 59.539 -5.300 2.295
281 1HB PHE 42 HB2 PHE 42 57.931 -2.843 2.983
282 2HB PHE 42 HB1 PHE 42 59.562 -3.267 3.496
283 HD1 PHE 42 HD1 PHE 42 60.823 -4.047 0.938
284 HD2 PHE 42 HD2 PHE 42 58.162 -0.799 1.843
285 HE1 PHE 42 HE1 PHE 42 61.754 -2.753 -0.965
286 HE2 PHE 42 HE2 PHE 42 59.092 0.494 -0.058
287 HZ PHE 42 HZ PHE 42 60.885 -0.482 -1.460
288 H ASP 43 HN ASP 43 58.762 -5.170 4.763
289 HA ASP 43 HA ASP 43 55.913 -5.844 5.141
290 1HB ASP 43 HB2 ASP 43 57.588 -7.842 4.372
291 2HB ASP 43 HB1 ASP 43 57.821 -7.908 6.118
292 H GLY 44 HN GLY 44 57.365 -3.703 6.176
293 1HA GLY 44 HA2 GLY 44 56.927 -3.052 8.594
294 2HA GLY 44 HA1 GLY 44 57.820 -4.512 9.017
295 H VAL 45 HN VAL 45 58.183 -1.423 7.257
296 HA VAL 45 HA VAL 45 60.938 -1.204 8.342
297 HB VAL 45 HB VAL 45 62.006 -1.308 6.278
298 1HG1 VAL 45 HG11 VAL 45 60.822 -3.476 6.711
299 2HG1 VAL 45 HG12 VAL 45 61.134 -3.171 5.001
300 3HG1 VAL 45 HG13 VAL 45 59.518 -2.917 5.661
301 1HG2 VAL 45 HG21 VAL 45 59.485 -0.078 5.302
302 2HG2 VAL 45 HG22 VAL 45 60.341 -1.093 4.142
303 3HG2 VAL 45 HG23 VAL 45 61.155 0.290 4.874
304 H THR 46 HN THR 46 61.821 0.965 6.984
305 HA THR 46 HA THR 46 59.717 3.023 6.801
306 HB THR 46 HB THR 46 61.944 3.168 8.862
307 HG1 THR 46 HG1 THR 46 60.600 1.918 9.893
308 1HG2 THR 46 HG21 THR 46 61.121 5.327 7.871
309 2HG2 THR 46 HG22 THR 46 60.830 5.182 9.605
310 3HG2 THR 46 HG23 THR 46 59.509 4.924 8.465
311 H ILE 47 HN ILE 47 61.160 2.300 4.677
312 HA ILE 47 HA ILE 47 63.738 3.653 4.469
313 HB ILE 47 HB ILE 47 62.872 1.550 3.272
314 1HG1 ILE 47 HG12 ILE 47 63.864 3.591 1.298
315 2HG1 ILE 47 HG11 ILE 47 64.886 3.113 2.653
316 1HG2 ILE 47 HG21 ILE 47 60.770 3.086 2.575
317 2HG2 ILE 47 HG22 ILE 47 61.301 1.710 1.608
318 3HG2 ILE 47 HG23 ILE 47 61.791 3.344 1.160
319 1HD1 ILE 47 HD1 ILE 47 63.633 0.838 1.286
320 2HD1 ILE 47 HD1 ILE 47 65.316 1.078 1.758
321 3HD1 ILE 47 HD1 ILE 47 64.715 1.769 0.250
322 H THR 48 HN THR 48 64.052 5.333 2.685
323 HA THR 48 HA THR 48 61.660 7.064 2.266
324 HB THR 48 HB THR 48 63.342 8.970 2.939
325 HG1 THR 48 HG1 THR 48 64.398 6.803 4.405
326 1HG2 THR 48 HG21 THR 48 61.605 7.209 4.509
327 2HG2 THR 48 HG22 THR 48 61.720 8.969 4.515
328 3HG2 THR 48 HG23 THR 48 62.840 8.009 5.482
329 H THR 49 HN THR 49 65.090 7.821 1.792
330 HA THR 49 HA THR 49 64.570 7.947 -1.159
331 HB THR 49 HB THR 49 65.758 9.904 -1.154
332 HG1 THR 49 HG1 THR 49 67.765 9.661 -0.731
333 1HG2 THR 49 HG21 THR 49 65.477 9.652 1.846
334 2HG2 THR 49 HG22 THR 49 64.195 10.194 0.760
335 3HG2 THR 49 HG23 THR 49 65.665 11.153 0.938
336 H SER 50 HN SER 50 65.223 5.467 0.120
337 HA SER 50 HA SER 50 68.107 5.029 -0.425
338 1HB SER 50 HB2 SER 50 66.220 2.881 0.430
339 2HB SER 50 HB1 SER 50 67.851 3.223 0.994
340 HG SER 50 HG SER 50 66.742 5.264 1.810
341 H THR 51 HN THR 51 68.738 4.264 -2.381
342 HA THR 51 HA THR 51 66.845 3.431 -4.418
343 HB THR 51 HB THR 51 69.735 2.713 -4.576
344 HG1 THR 51 HG1 THR 51 68.770 5.365 -4.315
345 1HG2 THR 51 HG21 THR 51 68.725 4.582 -6.532
346 2HG2 THR 51 HG22 THR 51 67.596 3.241 -6.336
347 3HG2 THR 51 HG23 THR 51 69.277 2.923 -6.766
348 H SER 52 HN SER 52 66.173 1.322 -4.872
349 HA SER 52 HA SER 52 67.631 -0.923 -3.543
350 1HB SER 52 HB2 SER 52 65.276 -1.779 -2.948
351 2HB SER 52 HB1 SER 52 65.874 -0.407 -2.019
352 HG SER 52 HG SER 52 64.350 -0.111 -4.386
353 H THR 53 HN THR 53 68.126 -2.348 -5.139
354 HA THR 53 HA THR 53 66.193 -2.660 -7.417
355 HB THR 53 HB THR 53 68.907 -3.602 -7.892
356 HG1 THR 53 HG1 THR 53 69.994 -1.758 -7.547
357 1HG2 THR 53 HG21 THR 53 66.792 -2.475 -9.297
358 2HG2 THR 53 HG22 THR 53 68.400 -2.807 -9.943
359 3HG2 THR 53 HG23 THR 53 68.017 -1.207 -9.308
360 H GLY 54 HN GLY 54 65.251 -4.232 -5.682
361 1HA GLY 54 HA2 GLY 54 64.767 -6.601 -5.624
362 2HA GLY 54 HA1 GLY 54 66.404 -6.919 -6.202
363 H SER 55 HN SER 55 64.464 -6.172 -3.373
364 HA SER 55 HA SER 55 66.417 -7.403 -1.605
365 1HB SER 55 HB2 SER 55 67.044 -5.310 -0.445
366 2HB SER 55 HB1 SER 55 67.512 -5.257 -2.140
367 HG SER 55 HG SER 55 65.189 -4.125 -0.960
368 H ARG 56 HN ARG 56 65.217 -8.212 0.069
369 HA ARG 56 HA ARG 56 62.480 -7.191 0.525
370 1HB ARG 56 HB2 ARG 56 62.485 -9.178 2.133
371 2HB ARG 56 HB1 ARG 56 62.774 -9.578 0.440
372 1HG ARG 56 HG2 ARG 56 65.009 -10.066 0.793
373 2HG ARG 56 HG1 ARG 56 65.139 -8.979 2.175
374 1HD ARG 56 HD2 ARG 56 65.135 -11.044 3.266
375 2HD ARG 56 HD1 ARG 56 63.391 -10.713 3.233
376 HE ARG 56 HE ARG 56 63.851 -11.921 0.794
377 1HH1 ARG 56 HH2 ARG 56 62.216 -13.375 2.735
378 2HH1 ARG 56 HH2 ARG 56 63.162 -14.784 3.083
379 1HH2 ARG 56 HH1 ARG 56 66.101 -13.447 1.817
380 2HH2 ARG 56 HH1 ARG 56 65.362 -14.824 2.565
381 H ILE 57 HN ILE 57 62.524 -5.292 1.724
382 HA ILE 57 HA ILE 57 64.496 -4.864 3.846
383 HB ILE 57 HB ILE 57 62.007 -3.249 3.260
384 1HG1 ILE 57 HG12 ILE 57 62.919 -3.570 1.081
385 2HG1 ILE 57 HG11 ILE 57 63.568 -2.021 1.618
386 1HG2 ILE 57 HG21 ILE 57 62.994 -1.973 4.840
387 2HG2 ILE 57 HG22 ILE 57 64.221 -1.603 3.628
388 3HG2 ILE 57 HG23 ILE 57 64.482 -2.916 4.777
389 1HD1 ILE 57 HD1 ILE 57 65.589 -3.358 2.483
390 2HD1 ILE 57 HD1 ILE 57 65.441 -3.184 0.735
391 3HD1 ILE 57 HD1 ILE 57 64.970 -4.695 1.514
392 H SER 58 HN SER 58 62.139 -6.993 3.957
393 HA SER 58 HA SER 58 60.276 -6.395 5.953
394 1HB SER 58 HB2 SER 58 61.737 -8.767 4.951
395 2HB SER 58 HB1 SER 58 61.027 -8.956 6.551
396 HG SER 58 HG SER 58 59.675 -9.436 4.613
397 H GLY 59 HN GLY 59 60.340 -6.705 8.304
398 1HA GLY 59 HA2 GLY 59 62.417 -7.453 9.942
399 2HA GLY 59 HA1 GLY 59 62.859 -5.808 9.489
400 HA PRO 60 HA PRO 60 59.367 -5.996 12.747
401 1HB PRO 60 HB2 PRO 60 60.706 -6.484 15.080
402 2HB PRO 60 HB1 PRO 60 59.993 -7.774 14.091
403 1HG PRO 60 HG2 PRO 60 62.825 -6.904 14.309
404 2HG PRO 60 HG1 PRO 60 62.155 -8.528 14.102
405 1HD PRO 60 HD2 PRO 60 63.263 -7.036 12.077
406 2HD PRO 60 HD1 PRO 60 62.080 -8.339 11.831
407 H GLY 61 HN GLY 61 62.311 -4.493 12.152
408 1HA GLY 61 HA2 GLY 61 61.418 -1.997 13.379
409 2HA GLY 61 HA1 GLY 61 62.856 -2.678 14.144
410 H CYS 62 HN CYS 62 62.238 -3.163 10.740
411 HA CYS 62 HA CYS 62 64.791 -2.266 9.905
412 1HB CYS 62 HB2 CYS 62 62.420 -3.360 8.807
413 2HB CYS 62 HB1 CYS 62 62.780 -1.914 7.865
414 H LYS 63 HN LYS 63 65.553 -0.289 9.223
415 HA LYS 63 HA LYS 63 63.718 2.023 8.921
416 1HB LYS 63 HB2 LYS 63 64.238 1.874 11.325
417 2HB LYS 63 HB1 LYS 63 65.963 1.796 10.960
418 1HG LYS 63 HG2 LYS 63 66.075 4.032 10.344
419 2HG LYS 63 HG1 LYS 63 64.366 4.107 9.913
420 1HD LYS 63 HD2 LYS 63 64.235 5.203 11.928
421 2HD LYS 63 HD1 LYS 63 64.118 3.552 12.538
422 1HE LYS 63 HE2 LYS 63 65.997 3.921 13.749
423 2HE LYS 63 HE1 LYS 63 66.893 4.126 12.231
424 1HZ LYS 63 HZ1 LYS 63 65.170 6.312 13.159
425 2HZ LYS 63 HZ2 LYS 63 66.597 6.380 12.238
426 3HZ LYS 63 HZ3 LYS 63 66.676 6.105 13.913
427 H ILE 64 HN ILE 64 64.450 2.876 6.971
428 HA ILE 64 HA ILE 64 67.413 2.987 6.579
429 HB ILE 64 HB ILE 64 65.407 2.594 4.366
430 1HG1 ILE 64 HG12 ILE 64 66.336 0.103 4.689
431 2HG1 ILE 64 HG11 ILE 64 66.432 0.628 6.370
432 1HG2 ILE 64 HG21 ILE 64 67.995 3.201 4.191
433 2HG2 ILE 64 HG22 ILE 64 67.249 2.062 3.068
434 3HG2 ILE 64 HG23 ILE 64 68.177 1.465 4.444
435 1HD1 ILE 64 HD1 ILE 64 63.938 1.537 5.363
436 2HD1 ILE 64 HD1 ILE 64 64.220 0.289 6.576
437 3HD1 ILE 64 HD1 ILE 64 64.107 -0.147 4.871
438 H SER 65 HN SER 65 68.214 4.856 5.552
439 HA SER 65 HA SER 65 66.259 6.930 4.711
440 1HB SER 65 HB2 SER 65 66.721 8.274 6.467
441 2HB SER 65 HB1 SER 65 67.465 6.862 7.216
442 HG SER 65 HG SER 65 68.994 8.474 7.155
443 H THR 66 HN THR 66 66.898 7.293 2.643
444 HA THR 66 HA THR 66 68.282 7.701 0.786
445 HB THR 66 HB THR 66 70.090 8.859 2.921
446 HG1 THR 66 HG1 THR 66 68.533 10.190 3.309
447 1HG2 THR 66 HG21 THR 66 69.669 10.311 0.418
448 2HG2 THR 66 HG22 THR 66 70.349 8.703 0.162
449 3HG2 THR 66 HG23 THR 66 71.179 9.855 1.210
450 H CYS 67 HN CYS 67 68.561 5.128 1.346
451 HA CYS 67 HA CYS 67 71.507 4.579 1.562
452 1HB CYS 67 HB2 CYS 67 69.555 3.545 3.058
453 2HB CYS 67 HB1 CYS 67 69.393 2.458 1.685
454 H ILE 68 HN ILE 68 72.516 3.892 -0.311
455 HA ILE 68 HA ILE 68 70.884 3.394 -2.727
456 HB ILE 68 HB ILE 68 73.821 3.691 -2.083
457 1HG1 ILE 68 HG12 ILE 68 73.522 5.581 -3.737
458 2HG1 ILE 68 HG11 ILE 68 71.793 5.227 -3.723
459 1HG2 ILE 68 HG21 ILE 68 74.297 2.390 -3.872
460 2HG2 ILE 68 HG22 ILE 68 73.563 3.647 -4.866
461 3HG2 ILE 68 HG23 ILE 68 72.596 2.276 -4.321
462 1HD1 ILE 68 HD1 ILE 68 72.650 7.028 -2.075
463 2HD1 ILE 68 HD1 ILE 68 73.313 5.670 -1.161
464 3HD1 ILE 68 HD1 ILE 68 71.574 5.781 -1.442
465 H ILE 69 HN ILE 69 69.923 1.374 -2.263
466 HA ILE 69 HA ILE 69 71.770 -0.906 -1.724
467 HB ILE 69 HB ILE 69 68.749 -0.858 -1.588
468 1HG1 ILE 69 HG12 ILE 69 70.601 -0.228 0.735
469 2HG1 ILE 69 HG11 ILE 69 69.872 1.039 -0.250
470 1HG2 ILE 69 HG21 ILE 69 68.976 -2.765 -0.252
471 2HG2 ILE 69 HG22 ILE 69 70.639 -2.377 0.189
472 3HG2 ILE 69 HG23 ILE 69 70.274 -2.982 -1.427
473 1HD1 ILE 69 HD1 ILE 69 68.630 0.273 1.902
474 2HD1 ILE 69 HD1 ILE 69 68.157 -1.125 0.936
475 3HD1 ILE 69 HD1 ILE 69 67.698 0.499 0.422
476 H THR 70 HN THR 70 71.670 -2.777 -3.068
477 HA THR 70 HA THR 70 69.891 -2.782 -5.432
478 HB THR 70 HB THR 70 72.885 -2.379 -5.484
479 HG1 THR 70 HG1 THR 70 71.950 -0.467 -5.670
480 1HG2 THR 70 HG21 THR 70 71.157 -3.841 -7.362
481 2HG2 THR 70 HG22 THR 70 72.914 -3.849 -7.208
482 3HG2 THR 70 HG23 THR 70 72.115 -2.564 -8.116
483 H GLY 71 HN GLY 71 69.142 -4.886 -4.985
484 1HA GLY 71 HA2 GLY 71 69.382 -7.242 -5.370
485 2HA GLY 71 HA1 GLY 71 71.133 -7.039 -5.323
486 H GLY 72 HN GLY 72 69.193 -5.607 -2.819
487 1HA GLY 72 HA2 GLY 72 68.789 -6.337 -0.592
488 2HA GLY 72 HA1 GLY 72 69.534 -7.884 -0.996
489 H VAL 73 HN VAL 73 71.307 -5.127 -1.955
490 HA VAL 73 HA VAL 73 73.152 -5.465 0.398
491 HB VAL 73 HB VAL 73 74.963 -5.187 -1.221
492 1HG1 VAL 73 HG11 VAL 73 73.442 -7.045 -2.866
493 2HG1 VAL 73 HG12 VAL 73 73.184 -7.351 -1.148
494 3HG1 VAL 73 HG13 VAL 73 74.819 -7.363 -1.809
495 1HG2 VAL 73 HG21 VAL 73 72.672 -4.342 -2.927
496 2HG2 VAL 73 HG22 VAL 73 73.969 -5.231 -3.729
497 3HG2 VAL 73 HG23 VAL 73 74.324 -3.727 -2.878
498 HA PRO 74 HA PRO 74 72.491 -1.049 0.600
499 1HB PRO 74 HB2 PRO 74 73.882 -0.651 2.914
500 2HB PRO 74 HB1 PRO 74 72.250 -1.337 2.885
501 1HG PRO 74 HG2 PRO 74 74.843 -2.672 3.330
502 2HG PRO 74 HG1 PRO 74 73.233 -3.100 3.920
503 1HD PRO 74 HD2 PRO 74 74.597 -4.306 1.786
504 2HD PRO 74 HD1 PRO 74 72.878 -4.506 2.187
505 H ALA 75 HN ALA 75 73.735 0.510 -0.432
506 HA ALA 75 HA ALA 75 76.622 -0.031 -0.866
507 1HB ALA 75 HB1 ALA 75 74.910 2.234 -1.921
508 2HB ALA 75 HB2 ALA 75 74.907 0.628 -2.653
509 3HB ALA 75 HB3 ALA 75 76.390 1.584 -2.627
510 HA PRO 76 HA PRO 76 77.812 2.938 2.169
511 1HB PRO 76 HB2 PRO 76 80.338 3.478 1.264
512 2HB PRO 76 HB1 PRO 76 79.913 1.965 2.090
513 1HG PRO 76 HG2 PRO 76 80.293 2.497 -0.807
514 2HG PRO 76 HG1 PRO 76 80.709 1.064 0.145
515 1HD PRO 76 HD2 PRO 76 78.509 1.246 -1.487
516 2HD PRO 76 HD1 PRO 76 78.637 0.146 -0.097
517 H SER 77 HN SER 77 76.540 4.782 1.770
518 HA SER 77 HA SER 77 77.412 6.602 -0.446
519 1HB SER 77 HB2 SER 77 75.120 5.758 -0.565
520 2HB SER 77 HB1 SER 77 74.814 6.275 1.091
521 HG SER 77 HG SER 77 74.296 8.124 0.260
522 H ALA 78 HN ALA 78 77.584 6.222 2.907
523 HA ALA 78 HA ALA 78 78.371 7.718 4.575
524 1HB ALA 78 HB1 ALA 78 79.764 9.274 3.685
525 2HB ALA 78 HB2 ALA 78 78.425 10.103 2.889
526 3HB ALA 78 HB3 ALA 78 79.208 8.733 2.101
527 H ALA 79 HN ALA 79 75.501 7.801 2.993
528 HA ALA 79 HA ALA 79 74.397 9.964 4.751
529 1HB ALA 79 HB1 ALA 79 73.570 9.097 1.958
530 2HB ALA 79 HB2 ALA 79 74.475 10.561 2.342
531 3HB ALA 79 HB3 ALA 79 72.809 10.383 2.894
532 H CYS 80 HN CYS 80 73.952 6.808 3.222
533 HA CYS 80 HA CYS 80 71.380 6.067 3.943
534 1HB CYS 80 HB2 CYS 80 72.879 4.641 2.699
535 2HB CYS 80 HB1 CYS 80 74.011 4.569 4.031
536 H LYS 81 HN LYS 81 70.721 4.654 5.884
537 HA LYS 81 HA LYS 81 71.631 6.003 8.367
538 1HB LYS 81 HB2 LYS 81 69.496 5.494 9.143
539 2HB LYS 81 HB1 LYS 81 69.207 5.604 7.409
540 1HG LYS 81 HG2 LYS 81 69.618 3.070 9.029
541 2HG LYS 81 HG1 LYS 81 68.137 3.588 8.228
542 1HD LYS 81 HD2 LYS 81 69.158 3.334 6.041
543 2HD LYS 81 HD1 LYS 81 70.723 2.990 6.764
544 1HE LYS 81 HE2 LYS 81 69.341 1.052 7.983
545 2HE LYS 81 HE1 LYS 81 68.323 1.221 6.537
546 1HZ LYS 81 HZ1 LYS 81 70.417 -0.280 6.437
547 2HZ LYS 81 HZ2 LYS 81 71.252 1.190 6.268
548 3HZ LYS 81 HZ3 LYS 81 70.066 0.750 5.135
549 H ILE 82 HN ILE 82 72.711 3.360 6.811
550 HA ILE 82 HA ILE 82 72.923 1.005 7.750
551 HB ILE 82 HB ILE 82 75.161 2.990 8.206
552 1HG1 ILE 82 HG12 ILE 82 74.469 3.007 5.915
553 2HG1 ILE 82 HG11 ILE 82 75.897 1.975 5.977
554 1HG2 ILE 82 HG21 ILE 82 75.075 0.384 9.129
555 2HG2 ILE 82 HG22 ILE 82 76.546 1.290 8.775
556 3HG2 ILE 82 HG23 ILE 82 75.859 0.213 7.559
557 1HD1 ILE 82 HD1 ILE 82 74.413 0.675 4.717
558 2HD1 ILE 82 HD1 ILE 82 73.012 1.190 5.653
559 3HD1 ILE 82 HD1 ILE 82 74.160 0.044 6.344
560 H SER 83 HN SER 83 71.322 1.171 9.662
561 HA SER 83 HA SER 83 72.864 1.325 12.234
562 1HB SER 83 HB2 SER 83 71.249 3.172 11.902
563 2HB SER 83 HB1 SER 83 69.964 1.999 11.628
564 HG SER 83 HG SER 83 69.763 1.897 13.709
565 H GLY 84 HN GLY 84 69.918 -0.061 10.749
566 1HA GLY 84 HA2 GLY 84 70.603 -2.690 11.922
567 2HA GLY 84 HA1 GLY 84 69.056 -1.983 12.394
568 H CYS 85 HN CYS 85 67.365 -2.557 11.152
569 HA CYS 85 HA CYS 85 66.204 -3.553 9.355
570 1HB CYS 85 HB2 CYS 85 67.084 -1.118 8.778
571 2HB CYS 85 HB1 CYS 85 68.086 -1.977 7.623
572 H THR 86 HN THR 86 66.934 -4.295 6.816
573 HA THR 86 HA THR 86 69.463 -5.534 6.462
574 HB THR 86 HB THR 86 69.050 -6.886 8.349
575 HG1 THR 86 HG1 THR 86 67.896 -8.615 6.515
576 1HG2 THR 86 HG21 THR 86 66.276 -7.500 7.304
577 2HG2 THR 86 HG22 THR 86 66.599 -6.220 8.474
578 3HG2 THR 86 HG23 THR 86 66.937 -7.899 8.890
579 H PHE 87 HN PHE 87 69.565 -6.379 4.409
580 HA PHE 87 HA PHE 87 66.961 -6.664 2.937
581 1HB PHE 87 HB2 PHE 87 69.652 -6.131 1.680
582 2HB PHE 87 HB1 PHE 87 68.057 -5.788 1.030
583 HD1 PHE 87 HD1 PHE 87 67.032 -4.592 3.790
584 HD2 PHE 87 HD2 PHE 87 70.452 -3.875 1.282
585 HE1 PHE 87 HE1 PHE 87 67.200 -2.271 4.675
586 HE2 PHE 87 HE2 PHE 87 70.600 -1.561 2.158
587 HZ PHE 87 HZ PHE 87 68.983 -0.765 3.853
588 H SER 88 HN SER 88 67.213 -8.218 1.010
589 HA SER 88 HA SER 88 69.290 -10.269 1.156
590 1HB SER 88 HB2 SER 88 66.461 -11.043 1.900
591 2HB SER 88 HB1 SER 88 67.904 -12.044 1.996
592 HG SER 88 HG SER 88 66.899 -10.549 3.880
593 H ALA 89 HN ALA 89 67.775 -8.440 -0.752
594 HA ALA 89 HA ALA 89 66.957 -8.548 -2.960
595 1HB ALA 89 HB1 ALA 89 69.062 -9.773 -3.215
596 2HB ALA 89 HB2 ALA 89 67.818 -10.545 -4.200
597 3HB ALA 89 HB3 ALA 89 68.290 -11.258 -2.657
598 H ASN 90 HN ASN 90 64.708 -8.591 -2.108
599 HA ASN 90 HA ASN 90 63.299 -10.982 -1.446
600 1HB ASN 90 HB2 ASN 90 61.451 -9.546 -1.403
601 2HB ASN 90 HB1 ASN 90 62.781 -8.404 -1.229
602 1HD2 ASN 90 HD2 ASN 90 63.725 -8.092 -3.814
603 2HD2 ASN 90 HD2 ASN 90 62.497 -7.505 -4.828
Start of MODEL 15
1 1H ASP 1 HT1 ASP 1 47.394 9.642 0.408
2 2H ASP 1 HT2 ASP 1 48.892 9.490 -0.378
3 3H ASP 1 HT3 ASP 1 48.807 9.417 1.317
4 HA ASP 1 HA ASP 1 49.007 7.226 -0.067
5 1HB ASP 1 HB2 ASP 1 47.963 6.167 1.852
6 2HB ASP 1 HB1 ASP 1 48.756 7.641 2.409
7 H GLY 2 HN GLY 2 47.168 5.409 -0.239
8 1HA GLY 2 HA2 GLY 2 44.760 5.082 -0.835
9 2HA GLY 2 HA1 GLY 2 44.864 6.596 -1.735
10 H SER 3 HN SER 3 44.973 6.248 -3.896
11 HA SER 3 HA SER 3 45.473 3.737 -5.134
12 1HB SER 3 HB2 SER 3 45.123 4.959 -7.075
13 2HB SER 3 HB1 SER 3 44.472 6.095 -5.898
14 HG SER 3 HG SER 3 46.238 7.316 -6.081
15 H CYS 4 HN CYS 4 47.657 6.461 -4.437
16 HA CYS 4 HA CYS 4 49.957 5.813 -5.836
17 1HB CYS 4 HB2 CYS 4 49.868 7.739 -4.429
18 2HB CYS 4 HB1 CYS 4 49.491 6.770 -3.005
19 H THR 5 HN THR 5 51.586 4.248 -5.659
20 HA THR 5 HA THR 5 51.920 2.538 -3.359
21 HB THR 5 HB THR 5 50.383 1.563 -5.783
22 HG1 THR 5 HG1 THR 5 49.135 0.701 -3.905
23 1HG2 THR 5 HG21 THR 5 50.623 -0.657 -4.306
24 2HG2 THR 5 HG22 THR 5 52.155 0.105 -3.883
25 3HG2 THR 5 HG23 THR 5 51.782 -0.251 -5.571
26 H ASN 6 HN ASN 6 52.076 1.431 -6.708
27 HA ASN 6 HA ASN 6 54.604 2.319 -7.529
28 1HB ASN 6 HB2 ASN 6 55.938 0.234 -6.693
29 2HB ASN 6 HB1 ASN 6 55.604 1.541 -5.554
30 1HD2 ASN 6 HD2 ASN 6 54.791 0.813 -3.594
31 2HD2 ASN 6 HD2 ASN 6 53.871 -0.598 -3.377
32 H THR 7 HN THR 7 52.881 1.824 -9.294
33 HA THR 7 HA THR 7 52.366 0.570 -11.230
34 HB THR 7 HB THR 7 54.578 -1.280 -10.326
35 HG1 THR 7 HG1 THR 7 55.817 0.400 -11.623
36 1HG2 THR 7 HG21 THR 7 54.925 -0.742 -12.976
37 2HG2 THR 7 HG22 THR 7 53.171 -0.613 -12.835
38 3HG2 THR 7 HG23 THR 7 53.987 -2.103 -12.362
39 H ASN 8 HN ASN 8 53.492 -2.017 -9.025
40 HA ASN 8 HA ASN 8 51.494 -3.898 -9.621
41 1HB ASN 8 HB2 ASN 8 53.354 -4.599 -8.365
42 2HB ASN 8 HB1 ASN 8 53.206 -3.259 -7.231
43 1HD2 ASN 8 HD2 ASN 8 50.321 -5.055 -8.150
44 2HD2 ASN 8 HD2 ASN 8 50.120 -5.841 -6.661
45 H SER 9 HN SER 9 51.488 -1.432 -7.035
46 HA SER 9 HA SER 9 49.655 -0.300 -6.066
47 1HB SER 9 HB2 SER 9 48.854 -0.881 -8.568
48 2HB SER 9 HB1 SER 9 47.695 -1.855 -7.668
49 HG SER 9 HG SER 9 47.653 0.311 -6.369
50 H GLN 10 HN GLN 10 50.653 -2.447 -4.621
51 HA GLN 10 HA GLN 10 48.175 -3.881 -3.737
52 1HB GLN 10 HB2 GLN 10 49.553 -5.689 -3.775
53 2HB GLN 10 HB1 GLN 10 50.857 -4.658 -4.351
54 1HG GLN 10 HG2 GLN 10 51.717 -5.611 -2.383
55 2HG GLN 10 HG1 GLN 10 51.187 -4.013 -1.883
56 1HE2 GLN 10 HE21 GLN 10 49.951 -7.395 -2.077
57 2HE2 GLN 10 HE22 GLN 10 48.990 -7.282 -0.684
58 H LEU 11 HN LEU 11 50.820 -1.794 -2.847
59 HA LEU 11 HA LEU 11 51.467 -1.106 -0.579
60 1HB LEU 11 HB2 LEU 11 50.474 0.576 -2.185
61 2HB LEU 11 HB1 LEU 11 48.934 0.358 -1.353
62 HG LEU 11 HG LEU 11 49.837 1.161 0.719
63 1HD1 LEU 11 HD1 LEU 11 52.313 1.884 0.736
64 2HD1 LEU 11 HD1 LEU 11 52.486 0.886 -0.708
65 3HD1 LEU 11 HD1 LEU 11 51.984 0.153 0.814
66 1HD2 LEU 11 HD2 LEU 11 49.932 3.360 0.121
67 2HD2 LEU 11 HD2 LEU 11 49.601 2.745 -1.499
68 3HD2 LEU 11 HD2 LEU 11 51.259 3.095 -1.010
69 H SER 12 HN SER 12 51.177 -2.339 1.242
70 HA SER 12 HA SER 12 48.992 -3.666 2.259
71 1HB SER 12 HB2 SER 12 50.448 -3.856 3.979
72 2HB SER 12 HB1 SER 12 51.459 -2.649 3.191
73 HG SER 12 HG SER 12 50.062 -2.444 5.449
74 H ALA 13 HN ALA 13 47.253 -3.104 3.740
75 HA ALA 13 HA ALA 13 45.852 -0.680 3.096
76 1HB ALA 13 HB1 ALA 13 45.576 -3.061 4.812
77 2HB ALA 13 HB2 ALA 13 44.364 -2.248 3.823
78 3HB ALA 13 HB3 ALA 13 44.747 -1.632 5.431
79 H ASN 14 HN ASN 14 48.487 -1.216 5.175
80 HA ASN 14 HA ASN 14 47.851 1.303 6.677
81 1HB ASN 14 HB2 ASN 14 48.779 0.288 8.634
82 2HB ASN 14 HB1 ASN 14 47.731 -0.937 7.919
83 1HD2 ASN 14 HD2 ASN 14 51.174 0.080 8.081
84 2HD2 ASN 14 HD2 ASN 14 51.800 -1.470 7.801
85 H SER 15 HN SER 15 49.988 -0.282 4.552
86 HA SER 15 HA SER 15 52.511 0.833 5.359
87 1HB SER 15 HB2 SER 15 51.315 -0.646 3.154
88 2HB SER 15 HB1 SER 15 52.485 0.532 2.568
89 HG SER 15 HG SER 15 52.868 -1.495 4.519
90 H LYS 16 HN LYS 16 53.393 2.192 3.048
91 HA LYS 16 HA LYS 16 51.599 4.417 2.420
92 1HB LYS 16 HB2 LYS 16 52.715 4.564 4.861
93 2HB LYS 16 HB1 LYS 16 54.047 5.240 3.923
94 1HG LYS 16 HG2 LYS 16 52.276 6.752 2.824
95 2HG LYS 16 HG1 LYS 16 51.213 6.258 4.142
96 1HD LYS 16 HD2 LYS 16 53.058 6.974 5.742
97 2HD LYS 16 HD1 LYS 16 53.861 7.708 4.353
98 1HE LYS 16 HE2 LYS 16 51.567 8.893 3.942
99 2HE LYS 16 HE1 LYS 16 51.245 8.481 5.638
100 1HZ LYS 16 HZ1 LYS 16 53.561 9.376 6.079
101 2HZ LYS 16 HZ2 LYS 16 52.359 10.524 5.731
102 3HZ LYS 16 HZ3 LYS 16 53.482 10.077 4.538
103 H CYS 17 HN CYS 17 52.488 5.728 0.727
104 HA CYS 17 HA CYS 17 55.148 4.817 -0.327
105 1HB CYS 17 HB2 CYS 17 54.058 5.208 -2.587
106 2HB CYS 17 HB1 CYS 17 53.368 3.875 -1.661
107 H GLU 18 HN GLU 18 52.803 7.471 -0.048
108 HA GLU 18 HA GLU 18 53.130 9.812 -0.166
109 1HB GLU 18 HB2 GLU 18 55.583 8.532 0.839
110 2HB GLU 18 HB1 GLU 18 55.867 10.120 0.127
111 1HG GLU 18 HG2 GLU 18 53.708 9.580 2.181
112 2HG GLU 18 HG1 GLU 18 55.321 10.159 2.597
113 H LYS 19 HN LYS 19 55.237 11.286 -1.285
114 HA LYS 19 HA LYS 19 54.878 10.678 -4.154
115 1HB LYS 19 HB2 LYS 19 55.474 12.944 -2.411
116 2HB LYS 19 HB1 LYS 19 56.533 12.909 -3.822
117 1HG LYS 19 HG2 LYS 19 54.456 12.573 -5.241
118 2HG LYS 19 HG1 LYS 19 53.507 12.923 -3.795
119 1HD LYS 19 HD2 LYS 19 54.093 15.146 -3.780
120 2HD LYS 19 HD1 LYS 19 55.683 14.840 -4.479
121 1HE LYS 19 HE2 LYS 19 54.783 15.625 -6.422
122 2HE LYS 19 HE1 LYS 19 53.941 14.065 -6.508
123 1HZ LYS 19 HZ1 LYS 19 52.127 14.958 -5.251
124 2HZ LYS 19 HZ2 LYS 19 52.412 15.996 -6.565
125 3HZ LYS 19 HZ3 LYS 19 52.940 16.426 -5.007
126 H SER 20 HN SER 20 56.323 8.608 -3.446
127 HA SER 20 HA SER 20 59.214 9.279 -3.536
128 1HB SER 20 HB2 SER 20 59.489 6.980 -2.830
129 2HB SER 20 HB1 SER 20 58.180 7.678 -1.880
130 HG SER 20 HG SER 20 57.377 5.791 -2.630
131 H THR 21 HN THR 21 60.345 7.233 -4.841
132 HA THR 21 HA THR 21 59.290 7.501 -7.629
133 HB THR 21 HB THR 21 61.832 6.517 -7.824
134 HG1 THR 21 HG1 THR 21 62.133 8.341 -5.753
135 1HG2 THR 21 HG21 THR 21 61.279 8.451 -9.033
136 2HG2 THR 21 HG22 THR 21 62.478 9.036 -7.880
137 3HG2 THR 21 HG23 THR 21 60.762 9.320 -7.588
138 H LEU 22 HN LEU 22 58.888 5.435 -5.205
139 HA LEU 22 HA LEU 22 59.755 2.892 -5.665
140 1HB LEU 22 HB2 LEU 22 57.619 4.147 -4.394
141 2HB LEU 22 HB1 LEU 22 56.838 2.981 -5.464
142 HG LEU 22 HG LEU 22 58.310 1.196 -4.556
143 1HD1 LEU 22 HD1 LEU 22 60.194 2.672 -3.894
144 2HD1 LEU 22 HD1 LEU 22 59.658 1.661 -2.555
145 3HD1 LEU 22 HD1 LEU 22 59.191 3.360 -2.618
146 1HD2 LEU 22 HD2 LEU 22 57.177 2.374 -2.085
147 2HD2 LEU 22 HD2 LEU 22 56.867 0.805 -2.829
148 3HD2 LEU 22 HD2 LEU 22 56.056 2.247 -3.441
149 H THR 23 HN THR 23 58.917 1.072 -6.934
150 HA THR 23 HA THR 23 57.232 1.592 -9.278
151 HB THR 23 HB THR 23 60.205 1.011 -9.528
152 HG1 THR 23 HG1 THR 23 60.278 3.097 -9.471
153 1HG2 THR 23 HG21 THR 23 59.398 1.619 -12.025
154 2HG2 THR 23 HG22 THR 23 57.915 0.881 -11.419
155 3HG2 THR 23 HG23 THR 23 59.422 -0.035 -11.411
156 H ASN 24 HN ASN 24 56.099 -0.298 -9.497
157 HA ASN 24 HA ASN 24 55.580 -2.603 -9.412
158 1HB ASN 24 HB2 ASN 24 58.549 -2.491 -9.968
159 2HB ASN 24 HB1 ASN 24 57.692 -4.030 -9.893
160 1HD2 ASN 24 HD2 ASN 24 57.471 -4.636 -12.075
161 2HD2 ASN 24 HD2 ASN 24 56.815 -3.640 -13.283
162 H CYS 25 HN CYS 25 55.432 -1.703 -6.917
163 HA CYS 25 HA CYS 25 57.148 -3.541 -5.279
164 1HB CYS 25 HB2 CYS 25 56.693 -0.711 -5.186
165 2HB CYS 25 HB1 CYS 25 56.027 -1.420 -3.724
166 H TYR 26 HN TYR 26 55.653 -3.099 -2.891
167 HA TYR 26 HA TYR 26 52.852 -3.921 -3.388
168 1HB TYR 26 HB2 TYR 26 55.093 -5.635 -2.268
169 2HB TYR 26 HB1 TYR 26 53.417 -5.968 -1.863
170 HD1 TYR 26 HD1 TYR 26 51.985 -7.108 -3.398
171 HD2 TYR 26 HD2 TYR 26 55.818 -5.661 -4.693
172 HE1 TYR 26 HE1 TYR 26 51.744 -8.366 -5.516
173 HE2 TYR 26 HE2 TYR 26 55.572 -6.917 -6.817
174 HH TYR 26 HH TYR 26 54.384 -8.615 -7.820
175 H VAL 27 HN VAL 27 55.434 -3.978 -1.020
176 HA VAL 27 HA VAL 27 55.660 -3.108 1.145
177 HB VAL 27 HB VAL 27 53.527 -1.133 0.336
178 1HG1 VAL 27 HG11 VAL 27 54.342 -0.070 2.147
179 2HG1 VAL 27 HG12 VAL 27 55.936 -0.015 1.394
180 3HG1 VAL 27 HG13 VAL 27 55.486 -1.388 2.406
181 1HG2 VAL 27 HG21 VAL 27 55.827 0.001 -0.597
182 2HG2 VAL 27 HG22 VAL 27 54.704 -0.887 -1.626
183 3HG2 VAL 27 HG23 VAL 27 56.135 -1.691 -0.982
184 H ASP 28 HN ASP 28 54.856 -4.181 2.865
185 HA ASP 28 HA ASP 28 51.896 -4.589 3.065
186 1HB ASP 28 HB2 ASP 28 54.329 -6.200 3.557
187 2HB ASP 28 HB1 ASP 28 53.065 -6.371 4.776
188 H LYS 29 HN LYS 29 54.753 -3.341 4.628
189 HA LYS 29 HA LYS 29 53.165 -1.952 6.660
190 1HB LYS 29 HB2 LYS 29 54.520 -4.524 7.120
191 2HB LYS 29 HB1 LYS 29 54.990 -3.278 8.274
192 1HG LYS 29 HG2 LYS 29 52.789 -2.998 9.059
193 2HG LYS 29 HG1 LYS 29 52.085 -3.754 7.630
194 1HD LYS 29 HD2 LYS 29 51.933 -5.369 9.402
195 2HD LYS 29 HD1 LYS 29 53.233 -5.906 8.337
196 1HE LYS 29 HE2 LYS 29 54.385 -6.059 10.330
197 2HE LYS 29 HE1 LYS 29 54.646 -4.326 10.048
198 1HZ LYS 29 HZ1 LYS 29 52.432 -5.560 11.599
199 2HZ LYS 29 HZ2 LYS 29 52.518 -3.910 11.206
200 3HZ LYS 29 HZ3 LYS 29 53.692 -4.607 12.218
201 H SER 30 HN SER 30 54.640 -0.646 4.845
202 HA SER 30 HA SER 30 57.099 0.160 6.348
203 1HB SER 30 HB2 SER 30 56.800 -0.643 3.455
204 2HB SER 30 HB1 SER 30 58.190 0.263 4.042
205 HG SER 30 HG SER 30 57.288 -2.304 4.845
206 H GLU 31 HN GLU 31 57.775 2.309 5.964
207 HA GLU 31 HA GLU 31 55.727 4.071 4.652
208 1HB GLU 31 HB2 GLU 31 56.688 3.976 7.281
209 2HB GLU 31 HB1 GLU 31 57.569 5.321 6.551
210 1HG GLU 31 HG2 GLU 31 54.760 5.335 5.779
211 2HG GLU 31 HG1 GLU 31 54.953 5.403 7.530
212 H VAL 32 HN VAL 32 56.580 4.674 2.682
213 HA VAL 32 HA VAL 32 59.536 5.069 2.479
214 HB VAL 32 HB VAL 32 57.462 4.827 0.287
215 1HG1 VAL 32 HG11 VAL 32 59.740 3.702 -0.634
216 2HG1 VAL 32 HG12 VAL 32 60.426 4.877 0.487
217 3HG1 VAL 32 HG13 VAL 32 59.378 5.417 -0.825
218 1HG2 VAL 32 HG21 VAL 32 58.124 2.869 2.224
219 2HG2 VAL 32 HG22 VAL 32 59.007 2.425 0.765
220 3HG2 VAL 32 HG23 VAL 32 57.256 2.616 0.709
221 H TYR 33 HN TYR 33 60.299 6.950 1.236
222 HA TYR 33 HA TYR 33 58.343 9.221 1.166
223 1HB TYR 33 HB2 TYR 33 61.098 8.979 2.364
224 2HB TYR 33 HB1 TYR 33 60.458 10.553 1.904
225 HD1 TYR 33 HD1 TYR 33 58.781 11.646 3.199
226 HD2 TYR 33 HD2 TYR 33 59.836 7.565 4.046
227 HE1 TYR 33 HE1 TYR 33 57.459 11.736 5.295
228 HE2 TYR 33 HE2 TYR 33 58.514 7.659 6.138
229 HH TYR 33 HH TYR 33 57.329 8.940 7.504
230 H GLY 34 HN GLY 34 61.384 7.855 -0.133
231 1HA GLY 34 HA2 GLY 34 60.811 9.207 -2.700
232 2HA GLY 34 HA1 GLY 34 62.328 9.637 -1.922
233 H THR 35 HN THR 35 61.403 6.411 -1.303
234 HA THR 35 HA THR 35 63.708 5.294 -2.579
235 HB THR 35 HB THR 35 61.088 3.953 -1.852
236 HG1 THR 35 HG1 THR 35 62.620 3.642 0.120
237 1HG2 THR 35 HG21 THR 35 63.929 3.029 -2.228
238 2HG2 THR 35 HG22 THR 35 62.457 2.384 -2.955
239 3HG2 THR 35 HG23 THR 35 62.790 2.109 -1.245
240 H THR 36 HN THR 36 63.688 3.731 -4.402
241 HA THR 36 HA THR 36 61.750 4.563 -6.525
242 HB THR 36 HB THR 36 64.474 3.265 -6.798
243 HG1 THR 36 HG1 THR 36 65.177 5.134 -6.179
244 1HG2 THR 36 HG21 THR 36 64.167 3.452 -9.036
245 2HG2 THR 36 HG22 THR 36 63.453 5.059 -8.888
246 3HG2 THR 36 HG23 THR 36 62.455 3.625 -8.643
247 H CYS 37 HN CYS 37 62.963 1.866 -4.683
248 HA CYS 37 HA CYS 37 62.513 -0.463 -4.828
249 1HB CYS 37 HB2 CYS 37 60.467 0.291 -3.890
250 2HB CYS 37 HB1 CYS 37 59.953 1.030 -5.404
251 H THR 38 HN THR 38 63.915 -0.730 -6.793
252 HA THR 38 HA THR 38 62.687 -0.658 -9.443
253 HB THR 38 HB THR 38 65.244 -1.915 -8.387
254 HG1 THR 38 HG1 THR 38 64.542 0.644 -9.322
255 1HG2 THR 38 HG21 THR 38 65.442 -2.739 -10.468
256 2HG2 THR 38 HG22 THR 38 65.547 -1.077 -11.046
257 3HG2 THR 38 HG23 THR 38 63.986 -1.896 -10.998
258 H GLY 39 HN GLY 39 60.917 -2.139 -8.086
259 1HA GLY 39 HA2 GLY 39 59.779 -4.194 -8.512
260 2HA GLY 39 HA1 GLY 39 61.262 -4.844 -9.213
261 H SER 40 HN SER 40 59.855 -3.857 -6.085
262 HA SER 40 HA SER 40 61.022 -6.247 -4.799
263 1HB SER 40 HB2 SER 40 61.704 -3.762 -3.372
264 2HB SER 40 HB1 SER 40 62.707 -5.168 -3.708
265 HG SER 40 HG SER 40 62.329 -2.830 -5.159
266 H ARG 41 HN ARG 41 60.663 -5.391 -2.128
267 HA ARG 41 HA ARG 41 58.077 -4.090 -1.789
268 1HB ARG 41 HB2 ARG 41 56.727 -5.977 -1.463
269 2HB ARG 41 HB1 ARG 41 57.761 -6.493 -2.792
270 1HG ARG 41 HG2 ARG 41 59.321 -7.378 -0.874
271 2HG ARG 41 HG1 ARG 41 57.854 -7.299 0.102
272 1HD ARG 41 HD2 ARG 41 56.722 -8.883 -1.246
273 2HD ARG 41 HD1 ARG 41 57.863 -8.680 -2.589
274 HE ARG 41 HE ARG 41 59.090 -9.591 -0.083
275 1HH1 ARG 41 HH1 ARG 41 57.026 -11.628 -1.010
276 2HH1 ARG 41 HH1 ARG 41 57.997 -12.665 -2.002
277 1HH2 ARG 41 HH2 ARG 41 60.614 -10.405 -2.268
278 2HH2 ARG 41 HH2 ARG 41 60.028 -11.973 -2.713
279 H PHE 42 HN PHE 42 57.414 -4.093 0.529
280 HA PHE 42 HA PHE 42 59.733 -4.650 2.349
281 1HB PHE 42 HB2 PHE 42 57.625 -2.530 2.760
282 2HB PHE 42 HB1 PHE 42 59.244 -2.617 3.457
283 HD1 PHE 42 HD1 PHE 42 60.754 -3.404 0.961
284 HD2 PHE 42 HD2 PHE 42 57.747 -0.415 1.645
285 HE1 PHE 42 HE1 PHE 42 61.645 -2.077 -0.931
286 HE2 PHE 42 HE2 PHE 42 58.640 0.914 -0.250
287 HZ PHE 42 HZ PHE 42 60.588 0.078 -1.533
288 H ASP 43 HN ASP 43 58.387 -4.158 4.754
289 HA ASP 43 HA ASP 43 55.848 -5.357 5.103
290 1HB ASP 43 HB2 ASP 43 57.862 -7.157 4.219
291 2HB ASP 43 HB1 ASP 43 57.546 -7.543 5.910
292 H GLY 44 HN GLY 44 57.035 -3.313 6.439
293 1HA GLY 44 HA2 GLY 44 56.730 -3.044 8.913
294 2HA GLY 44 HA1 GLY 44 57.689 -4.514 9.099
295 H VAL 45 HN VAL 45 58.095 -1.445 7.268
296 HA VAL 45 HA VAL 45 60.722 -1.116 8.656
297 HB VAL 45 HB VAL 45 61.893 -0.999 6.620
298 1HG1 VAL 45 HG11 VAL 45 59.633 -2.965 6.183
299 2HG1 VAL 45 HG12 VAL 45 61.173 -3.295 6.977
300 3HG1 VAL 45 HG13 VAL 45 61.128 -2.943 5.249
301 1HG2 VAL 45 HG21 VAL 45 60.208 -1.060 4.461
302 2HG2 VAL 45 HG22 VAL 45 60.934 0.409 5.122
303 3HG2 VAL 45 HG23 VAL 45 59.301 -0.053 5.594
304 H THR 46 HN THR 46 61.581 1.121 7.295
305 HA THR 46 HA THR 46 59.448 3.134 7.119
306 HB THR 46 HB THR 46 61.498 3.134 9.358
307 HG1 THR 46 HG1 THR 46 59.985 1.896 10.157
308 1HG2 THR 46 HG21 THR 46 61.134 5.397 8.787
309 2HG2 THR 46 HG22 THR 46 60.004 5.105 10.108
310 3HG2 THR 46 HG23 THR 46 59.426 5.125 8.441
311 H ILE 47 HN ILE 47 61.107 2.509 5.099
312 HA ILE 47 HA ILE 47 63.610 4.035 5.201
313 HB ILE 47 HB ILE 47 63.329 1.893 3.994
314 1HG1 ILE 47 HG12 ILE 47 63.747 4.172 2.038
315 2HG1 ILE 47 HG11 ILE 47 64.958 3.673 3.220
316 1HG2 ILE 47 HG21 ILE 47 61.938 2.825 1.675
317 2HG2 ILE 47 HG22 ILE 47 60.946 3.190 3.088
318 3HG2 ILE 47 HG23 ILE 47 61.467 1.533 2.781
319 1HD1 ILE 47 HD1 ILE 47 65.001 1.418 2.268
320 2HD1 ILE 47 HD1 ILE 47 65.327 2.607 1.005
321 3HD1 ILE 47 HD1 ILE 47 63.734 1.859 1.122
322 H THR 48 HN THR 48 64.044 5.695 3.502
323 HA THR 48 HA THR 48 61.604 7.273 2.781
324 HB THR 48 HB THR 48 62.958 9.283 3.366
325 HG1 THR 48 HG1 THR 48 64.967 9.008 4.250
326 1HG2 THR 48 HG21 THR 48 63.052 7.325 5.663
327 2HG2 THR 48 HG22 THR 48 61.535 7.993 5.060
328 3HG2 THR 48 HG23 THR 48 62.767 9.065 5.725
329 H THR 49 HN THR 49 63.696 9.254 1.659
330 HA THR 49 HA THR 49 63.666 8.502 -1.047
331 HB THR 49 HB THR 49 65.661 10.118 0.571
332 HG1 THR 49 HG1 THR 49 64.403 11.834 -0.319
333 1HG2 THR 49 HG21 THR 49 66.591 10.932 -1.414
334 2HG2 THR 49 HG22 THR 49 65.209 10.424 -2.384
335 3HG2 THR 49 HG23 THR 49 66.356 9.224 -1.788
336 H SER 50 HN SER 50 64.776 6.896 -2.156
337 HA SER 50 HA SER 50 67.474 6.081 -1.429
338 1HB SER 50 HB2 SER 50 66.214 5.073 0.410
339 2HB SER 50 HB1 SER 50 65.105 4.317 -0.731
340 HG SER 50 HG SER 50 66.512 2.788 -1.015
341 H THR 51 HN THR 51 68.231 4.266 -2.856
342 HA THR 51 HA THR 51 66.543 4.082 -5.329
343 HB THR 51 HB THR 51 69.541 4.079 -4.873
344 HG1 THR 51 HG1 THR 51 69.242 6.127 -5.102
345 1HG2 THR 51 HG21 THR 51 69.621 2.897 -6.800
346 2HG2 THR 51 HG22 THR 51 69.095 4.386 -7.586
347 3HG2 THR 51 HG23 THR 51 67.909 3.162 -7.128
348 H SER 52 HN SER 52 67.063 2.293 -2.743
349 HA SER 52 HA SER 52 68.304 -0.100 -3.119
350 1HB SER 52 HB2 SER 52 66.568 -1.039 -1.749
351 2HB SER 52 HB1 SER 52 66.673 0.665 -1.315
352 HG SER 52 HG SER 52 64.969 0.958 -2.951
353 H THR 53 HN THR 53 68.249 -1.785 -4.587
354 HA THR 53 HA THR 53 65.952 -1.853 -6.527
355 HB THR 53 HB THR 53 68.945 -2.082 -6.910
356 HG1 THR 53 HG1 THR 53 68.569 -0.115 -7.492
357 1HG2 THR 53 HG21 THR 53 67.693 -3.931 -8.102
358 2HG2 THR 53 HG22 THR 53 68.589 -2.842 -9.162
359 3HG2 THR 53 HG23 THR 53 66.840 -2.676 -9.001
360 H GLY 54 HN GLY 54 64.847 -3.688 -5.877
361 1HA GLY 54 HA2 GLY 54 64.445 -5.973 -5.512
362 2HA GLY 54 HA1 GLY 54 66.011 -6.282 -6.262
363 H SER 55 HN SER 55 64.493 -5.333 -3.186
364 HA SER 55 HA SER 55 66.505 -6.922 -1.731
365 1HB SER 55 HB2 SER 55 67.170 -4.897 -0.390
366 2HB SER 55 HB1 SER 55 67.658 -4.812 -2.080
367 HG SER 55 HG SER 55 65.196 -3.769 -1.157
368 H ARG 56 HN ARG 56 65.426 -7.882 -0.060
369 HA ARG 56 HA ARG 56 62.716 -7.052 0.673
370 1HB ARG 56 HB2 ARG 56 63.698 -9.411 0.506
371 2HB ARG 56 HB1 ARG 56 64.561 -9.060 2.002
372 1HG ARG 56 HG2 ARG 56 62.719 -9.452 3.231
373 2HG ARG 56 HG1 ARG 56 61.769 -8.334 2.253
374 1HD ARG 56 HD2 ARG 56 60.841 -10.022 1.031
375 2HD ARG 56 HD1 ARG 56 62.385 -10.889 0.900
376 HE ARG 56 HE ARG 56 60.746 -10.914 3.411
377 1HH1 ARG 56 HH1 ARG 56 60.909 -12.984 0.973
378 2HH1 ARG 56 HH1 ARG 56 61.771 -14.254 1.775
379 1HH2 ARG 56 HH2 ARG 56 62.663 -12.295 4.492
380 2HH2 ARG 56 HH2 ARG 56 62.764 -13.865 3.767
381 H ILE 57 HN ILE 57 62.713 -5.078 1.830
382 HA ILE 57 HA ILE 57 64.775 -4.608 3.886
383 HB ILE 57 HB ILE 57 62.405 -3.002 2.862
384 1HG1 ILE 57 HG12 ILE 57 64.813 -1.766 2.181
385 2HG1 ILE 57 HG11 ILE 57 65.136 -3.480 1.924
386 1HG2 ILE 57 HG21 ILE 57 63.848 -1.122 3.945
387 2HG2 ILE 57 HG22 ILE 57 64.584 -2.433 4.867
388 3HG2 ILE 57 HG23 ILE 57 62.853 -2.123 5.003
389 1HD1 ILE 57 HD1 ILE 57 64.218 -2.527 -0.124
390 2HD1 ILE 57 HD1 ILE 57 62.832 -1.890 0.761
391 3HD1 ILE 57 HD1 ILE 57 63.037 -3.633 0.579
392 H SER 58 HN SER 58 62.350 -6.626 4.043
393 HA SER 58 HA SER 58 60.498 -5.876 6.016
394 1HB SER 58 HB2 SER 58 61.827 -8.358 5.067
395 2HB SER 58 HB1 SER 58 61.035 -8.468 6.635
396 HG SER 58 HG SER 58 59.709 -8.903 4.707
397 H GLY 59 HN GLY 59 60.525 -6.302 8.378
398 1HA GLY 59 HA2 GLY 59 62.568 -7.131 10.009
399 2HA GLY 59 HA1 GLY 59 63.067 -5.493 9.589
400 HA PRO 60 HA PRO 60 59.862 -5.507 13.038
401 1HB PRO 60 HB2 PRO 60 61.515 -5.124 15.183
402 2HB PRO 60 HB1 PRO 60 61.045 -6.737 14.609
403 1HG PRO 60 HG2 PRO 60 63.582 -5.248 14.208
404 2HG PRO 60 HG1 PRO 60 63.312 -6.982 14.429
405 1HD PRO 60 HD2 PRO 60 63.806 -5.772 12.004
406 2HD PRO 60 HD1 PRO 60 62.989 -7.337 12.202
407 H GLY 61 HN GLY 61 60.409 -3.485 11.291
408 1HA GLY 61 HA2 GLY 61 59.861 -1.109 11.642
409 2HA GLY 61 HA1 GLY 61 60.874 -1.147 13.088
410 H CYS 62 HN CYS 62 61.974 -2.835 10.279
411 HA CYS 62 HA CYS 62 64.514 -1.824 10.077
412 1HB CYS 62 HB2 CYS 62 63.152 -3.558 8.676
413 2HB CYS 62 HB1 CYS 62 62.827 -2.197 7.612
414 H LYS 63 HN LYS 63 64.915 0.360 10.383
415 HA LYS 63 HA LYS 63 63.382 2.373 8.815
416 1HB LYS 63 HB2 LYS 63 63.645 2.810 11.165
417 2HB LYS 63 HB1 LYS 63 65.367 2.427 11.104
418 1HG LYS 63 HG2 LYS 63 65.583 4.383 9.456
419 2HG LYS 63 HG1 LYS 63 63.957 4.845 9.964
420 1HD LYS 63 HD2 LYS 63 65.164 4.416 12.381
421 2HD LYS 63 HD1 LYS 63 66.512 5.041 11.430
422 1HE LYS 63 HE2 LYS 63 64.747 6.855 10.665
423 2HE LYS 63 HE1 LYS 63 63.938 6.396 12.176
424 1HZ LYS 63 HZ1 LYS 63 65.749 8.180 12.303
425 2HZ LYS 63 HZ2 LYS 63 66.848 6.902 12.091
426 3HZ LYS 63 HZ3 LYS 63 65.807 6.918 13.434
427 H ILE 64 HN ILE 64 64.448 3.720 7.270
428 HA ILE 64 HA ILE 64 67.355 3.405 6.875
429 HB ILE 64 HB ILE 64 65.240 2.514 4.896
430 1HG1 ILE 64 HG12 ILE 64 67.450 1.093 6.411
431 2HG1 ILE 64 HG11 ILE 64 65.713 0.824 6.556
432 1HG2 ILE 64 HG21 ILE 64 68.092 2.090 4.261
433 2HG2 ILE 64 HG22 ILE 64 67.580 3.777 4.224
434 3HG2 ILE 64 HG23 ILE 64 66.767 2.587 3.208
435 1HD1 ILE 64 HD1 ILE 64 67.029 -0.858 5.126
436 2HD1 ILE 64 HD1 ILE 64 67.163 0.436 3.936
437 3HD1 ILE 64 HD1 ILE 64 65.574 -0.167 4.406
438 H SER 65 HN SER 65 68.255 5.179 5.772
439 HA SER 65 HA SER 65 66.330 7.174 4.632
440 1HB SER 65 HB2 SER 65 68.509 8.481 5.963
441 2HB SER 65 HB1 SER 65 66.789 8.576 6.334
442 HG SER 65 HG SER 65 68.691 7.415 7.738
443 H THR 66 HN THR 66 66.961 7.153 2.501
444 HA THR 66 HA THR 66 68.337 7.448 0.611
445 HB THR 66 HB THR 66 70.275 8.659 2.582
446 HG1 THR 66 HG1 THR 66 68.926 10.249 2.894
447 1HG2 THR 66 HG21 THR 66 71.240 9.539 0.745
448 2HG2 THR 66 HG22 THR 66 69.685 10.077 0.110
449 3HG2 THR 66 HG23 THR 66 70.243 8.432 -0.201
450 H CYS 67 HN CYS 67 68.655 5.037 0.624
451 HA CYS 67 HA CYS 67 71.553 4.435 1.025
452 1HB CYS 67 HB2 CYS 67 69.708 3.507 2.763
453 2HB CYS 67 HB1 CYS 67 69.595 2.252 1.544
454 H ILE 68 HN ILE 68 72.325 3.934 -0.948
455 HA ILE 68 HA ILE 68 70.590 3.072 -3.123
456 HB ILE 68 HB ILE 68 73.579 3.320 -2.717
457 1HG1 ILE 68 HG12 ILE 68 71.616 5.249 -2.998
458 2HG1 ILE 68 HG11 ILE 68 73.326 5.481 -3.339
459 1HG2 ILE 68 HG21 ILE 68 73.196 1.624 -4.407
460 2HG2 ILE 68 HG22 ILE 68 73.693 3.110 -5.218
461 3HG2 ILE 68 HG23 ILE 68 71.992 2.636 -5.204
462 1HD1 ILE 68 HD1 ILE 68 71.955 6.195 -5.246
463 2HD1 ILE 68 HD1 ILE 68 71.238 4.584 -5.331
464 3HD1 ILE 68 HD1 ILE 68 72.955 4.803 -5.668
465 H ILE 69 HN ILE 69 69.735 1.013 -2.693
466 HA ILE 69 HA ILE 69 71.725 -1.108 -1.999
467 HB ILE 69 HB ILE 69 68.725 -1.157 -1.586
468 1HG1 ILE 69 HG12 ILE 69 70.819 -0.291 0.441
469 2HG1 ILE 69 HG11 ILE 69 69.848 0.844 -0.486
470 1HG2 ILE 69 HG21 ILE 69 69.172 -2.928 -0.073
471 2HG2 ILE 69 HG22 ILE 69 70.889 -2.537 0.004
472 3HG2 ILE 69 HG23 ILE 69 70.215 -3.260 -1.455
473 1HD1 ILE 69 HD1 ILE 69 68.496 0.662 1.349
474 2HD1 ILE 69 HD1 ILE 69 69.038 -0.976 1.718
475 3HD1 ILE 69 HD1 ILE 69 67.869 -0.704 0.424
476 H THR 70 HN THR 70 71.448 -3.186 -3.091
477 HA THR 70 HA THR 70 69.584 -3.360 -5.368
478 HB THR 70 HB THR 70 72.592 -3.136 -5.701
479 HG1 THR 70 HG1 THR 70 72.003 -1.287 -6.891
480 1HG2 THR 70 HG21 THR 70 72.248 -3.530 -8.034
481 2HG2 THR 70 HG22 THR 70 70.495 -3.457 -7.854
482 3HG2 THR 70 HG23 THR 70 71.395 -4.818 -7.183
483 H GLY 71 HN GLY 71 68.887 -5.416 -4.694
484 1HA GLY 71 HA2 GLY 71 69.122 -7.797 -4.857
485 2HA GLY 71 HA1 GLY 71 70.870 -7.581 -4.979
486 H GLY 72 HN GLY 72 69.096 -5.918 -2.496
487 1HA GLY 72 HA2 GLY 72 68.893 -6.381 -0.181
488 2HA GLY 72 HA1 GLY 72 69.619 -7.964 -0.464
489 H VAL 73 HN VAL 73 71.293 -5.316 -1.852
490 HA VAL 73 HA VAL 73 73.279 -5.345 0.408
491 HB VAL 73 HB VAL 73 74.993 -5.368 -1.328
492 1HG1 VAL 73 HG11 VAL 73 73.547 -7.495 -0.669
493 2HG1 VAL 73 HG12 VAL 73 74.730 -7.587 -1.973
494 3HG1 VAL 73 HG13 VAL 73 73.018 -7.382 -2.348
495 1HG2 VAL 73 HG21 VAL 73 73.739 -5.781 -3.729
496 2HG2 VAL 73 HG22 VAL 73 74.353 -4.218 -3.191
497 3HG2 VAL 73 HG23 VAL 73 72.648 -4.620 -2.968
498 HA PRO 74 HA PRO 74 72.725 -0.935 -0.024
499 1HB PRO 74 HB2 PRO 74 74.430 -0.214 1.979
500 2HB PRO 74 HB1 PRO 74 72.813 -0.869 2.292
501 1HG PRO 74 HG2 PRO 74 75.457 -2.173 2.523
502 2HG PRO 74 HG1 PRO 74 73.974 -2.449 3.447
503 1HD PRO 74 HD2 PRO 74 74.931 -4.054 1.376
504 2HD PRO 74 HD1 PRO 74 73.282 -4.078 2.037
505 H ALA 75 HN ALA 75 73.946 0.747 -1.013
506 HA ALA 75 HA ALA 75 76.397 -0.005 -2.404
507 1HB ALA 75 HB1 ALA 75 74.426 1.616 -3.013
508 2HB ALA 75 HB2 ALA 75 76.055 2.076 -3.479
509 3HB ALA 75 HB3 ALA 75 75.311 2.794 -2.052
510 HA PRO 76 HA PRO 76 79.326 1.912 0.349
511 1HB PRO 76 HB2 PRO 76 80.196 4.364 -0.495
512 2HB PRO 76 HB1 PRO 76 80.668 2.841 -1.273
513 1HG PRO 76 HG2 PRO 76 78.706 4.876 -2.139
514 2HG PRO 76 HG1 PRO 76 79.747 3.823 -3.105
515 1HD PRO 76 HD2 PRO 76 77.047 3.433 -2.660
516 2HD PRO 76 HD1 PRO 76 78.184 2.178 -3.197
517 H SER 77 HN SER 77 76.355 3.188 0.260
518 HA SER 77 HA SER 77 75.118 4.676 1.609
519 1HB SER 77 HB2 SER 77 76.053 4.511 4.024
520 2HB SER 77 HB1 SER 77 75.564 3.019 3.228
521 HG SER 77 HG SER 77 77.900 3.568 4.246
522 H ALA 78 HN ALA 78 76.791 6.226 0.015
523 HA ALA 78 HA ALA 78 78.673 7.919 1.241
524 1HB ALA 78 HB1 ALA 78 76.991 7.831 -1.098
525 2HB ALA 78 HB2 ALA 78 78.513 8.696 -0.881
526 3HB ALA 78 HB3 ALA 78 76.988 9.473 -0.456
527 H ALA 79 HN ALA 79 75.237 7.700 1.687
528 HA ALA 79 HA ALA 79 75.323 9.596 3.940
529 1HB ALA 79 HB1 ALA 79 74.847 10.589 1.428
530 2HB ALA 79 HB2 ALA 79 74.203 11.313 2.902
531 3HB ALA 79 HB3 ALA 79 73.208 10.209 1.955
532 H CYS 80 HN CYS 80 74.807 6.783 3.714
533 HA CYS 80 HA CYS 80 71.845 6.574 4.067
534 1HB CYS 80 HB2 CYS 80 72.569 5.103 2.389
535 2HB CYS 80 HB1 CYS 80 74.088 4.760 3.209
536 H LYS 81 HN LYS 81 71.144 5.052 5.763
537 HA LYS 81 HA LYS 81 72.739 5.352 8.255
538 1HB LYS 81 HB2 LYS 81 70.595 4.754 9.312
539 2HB LYS 81 HB1 LYS 81 70.327 6.030 8.125
540 1HG LYS 81 HG2 LYS 81 68.663 4.603 7.447
541 2HG LYS 81 HG1 LYS 81 69.986 3.902 6.521
542 1HD LYS 81 HD2 LYS 81 70.034 2.793 9.162
543 2HD LYS 81 HD1 LYS 81 68.397 2.661 8.535
544 1HE LYS 81 HE2 LYS 81 70.930 1.457 7.441
545 2HE LYS 81 HE1 LYS 81 69.366 0.684 7.715
546 1HZ LYS 81 HZ1 LYS 81 68.656 2.573 6.013
547 2HZ LYS 81 HZ2 LYS 81 69.171 1.042 5.504
548 3HZ LYS 81 HZ3 LYS 81 70.250 2.352 5.493
549 H ILE 82 HN ILE 82 72.523 3.302 9.701
550 HA ILE 82 HA ILE 82 72.329 0.727 8.307
551 HB ILE 82 HB ILE 82 74.959 1.914 9.240
552 1HG1 ILE 82 HG12 ILE 82 74.418 2.462 6.925
553 2HG1 ILE 82 HG11 ILE 82 75.690 1.251 6.936
554 1HG2 ILE 82 HG21 ILE 82 74.063 -0.858 9.226
555 2HG2 ILE 82 HG22 ILE 82 75.537 -0.161 9.896
556 3HG2 ILE 82 HG23 ILE 82 75.473 -0.619 8.194
557 1HD1 ILE 82 HD1 ILE 82 74.420 -0.156 5.730
558 2HD1 ILE 82 HD1 ILE 82 73.169 1.081 5.623
559 3HD1 ILE 82 HD1 ILE 82 73.145 -0.095 6.940
560 H SER 83 HN SER 83 70.780 1.536 10.366
561 HA SER 83 HA SER 83 72.000 0.588 12.907
562 1HB SER 83 HB2 SER 83 70.719 2.745 12.678
563 2HB SER 83 HB1 SER 83 69.281 1.796 12.311
564 HG SER 83 HG SER 83 70.861 1.444 14.641
565 H GLY 84 HN GLY 84 68.833 0.073 13.359
566 1HA GLY 84 HA2 GLY 84 69.099 -2.818 13.122
567 2HA GLY 84 HA1 GLY 84 67.688 -1.953 13.731
568 H CYS 85 HN CYS 85 69.238 -3.235 10.869
569 HA CYS 85 HA CYS 85 66.654 -3.375 9.500
570 1HB CYS 85 HB2 CYS 85 68.378 -1.108 9.178
571 2HB CYS 85 HB1 CYS 85 68.385 -2.017 7.670
572 H THR 86 HN THR 86 67.152 -4.210 7.122
573 HA THR 86 HA THR 86 69.644 -5.535 6.584
574 HB THR 86 HB THR 86 69.177 -6.966 8.409
575 HG1 THR 86 HG1 THR 86 67.833 -8.380 6.393
576 1HG2 THR 86 HG21 THR 86 66.312 -7.108 7.421
577 2HG2 THR 86 HG22 THR 86 66.867 -6.150 8.793
578 3HG2 THR 86 HG23 THR 86 66.954 -7.910 8.855
579 H PHE 87 HN PHE 87 69.573 -6.569 4.538
580 HA PHE 87 HA PHE 87 66.949 -6.312 3.095
581 1HB PHE 87 HB2 PHE 87 69.591 -6.367 1.676
582 2HB PHE 87 HB1 PHE 87 68.118 -5.502 1.253
583 HD1 PHE 87 HD1 PHE 87 71.172 -4.593 1.603
584 HD2 PHE 87 HD2 PHE 87 67.590 -4.190 3.948
585 HE1 PHE 87 HE1 PHE 87 72.085 -2.546 2.659
586 HE2 PHE 87 HE2 PHE 87 68.514 -2.143 5.007
587 HZ PHE 87 HZ PHE 87 70.762 -1.322 4.360
588 H SER 88 HN SER 88 66.778 -7.947 1.243
589 HA SER 88 HA SER 88 68.399 -10.406 1.644
590 1HB SER 88 HB2 SER 88 66.059 -10.042 2.997
591 2HB SER 88 HB1 SER 88 65.464 -10.805 1.525
592 HG SER 88 HG SER 88 66.030 -12.405 2.976
593 H ALA 89 HN ALA 89 67.789 -8.304 -0.526
594 HA ALA 89 HA ALA 89 67.330 -8.286 -2.849
595 1HB ALA 89 HB1 ALA 89 68.960 -9.644 -3.624
596 2HB ALA 89 HB2 ALA 89 67.959 -11.060 -3.306
597 3HB ALA 89 HB3 ALA 89 69.020 -10.429 -2.047
598 H ASN 90 HN ASN 90 64.932 -8.377 -1.796
599 HA ASN 90 HA ASN 90 63.399 -10.773 -2.026
600 1HB ASN 90 HB2 ASN 90 61.766 -9.381 -1.252
601 2HB ASN 90 HB1 ASN 90 63.058 -8.203 -1.108
602 1HD2 ASN 90 HD2 ASN 90 60.001 -8.449 -2.218
603 2HD2 ASN 90 HD2 ASN 90 60.039 -7.331 -3.495
Start of MODEL 16
1 1H ASP 1 HT1 ASP 1 49.409 6.813 0.535
2 2H ASP 1 HT2 ASP 1 48.160 5.920 -0.193
3 3H ASP 1 HT3 ASP 1 48.572 5.642 1.432
4 HA ASP 1 HA ASP 1 46.503 6.975 1.155
5 1HB ASP 1 HB2 ASP 1 48.048 6.929 3.134
6 2HB ASP 1 HB1 ASP 1 48.882 8.329 2.462
7 H GLY 2 HN GLY 2 48.416 7.538 -1.259
8 1HA GLY 2 HA2 GLY 2 47.330 10.253 -1.763
9 2HA GLY 2 HA1 GLY 2 49.075 10.036 -1.911
10 H SER 3 HN SER 3 49.601 9.875 -4.031
11 HA SER 3 HA SER 3 47.761 8.335 -5.830
12 1HB SER 3 HB2 SER 3 49.357 10.824 -6.032
13 2HB SER 3 HB1 SER 3 49.390 9.797 -7.463
14 HG SER 3 HG SER 3 47.469 11.428 -6.653
15 H CYS 4 HN CYS 4 49.648 6.959 -4.196
16 HA CYS 4 HA CYS 4 51.996 6.362 -5.907
17 1HB CYS 4 HB2 CYS 4 51.118 5.246 -3.225
18 2HB CYS 4 HB1 CYS 4 52.739 5.166 -3.923
19 H THR 5 HN THR 5 51.778 4.790 -7.446
20 HA THR 5 HA THR 5 49.923 2.498 -6.878
21 HB THR 5 HB THR 5 50.513 4.050 -9.416
22 HG1 THR 5 HG1 THR 5 48.867 4.582 -7.627
23 1HG2 THR 5 HG21 THR 5 50.291 1.500 -9.684
24 2HG2 THR 5 HG22 THR 5 49.219 2.501 -10.654
25 3HG2 THR 5 HG23 THR 5 48.614 1.713 -9.200
26 H ASN 6 HN ASN 6 53.116 3.493 -7.659
27 HA ASN 6 HA ASN 6 55.003 2.302 -8.467
28 1HB ASN 6 HB2 ASN 6 55.444 0.450 -7.030
29 2HB ASN 6 HB1 ASN 6 54.381 1.499 -6.097
30 1HD2 ASN 6 HD2 ASN 6 52.253 0.726 -5.600
31 2HD2 ASN 6 HD2 ASN 6 51.755 -0.858 -5.952
32 H THR 7 HN THR 7 52.933 2.274 -10.384
33 HA THR 7 HA THR 7 52.588 1.187 -12.461
34 HB THR 7 HB THR 7 54.066 -1.199 -11.372
35 HG1 THR 7 HG1 THR 7 55.894 0.187 -12.355
36 1HG2 THR 7 HG21 THR 7 52.983 -0.860 -13.755
37 2HG2 THR 7 HG22 THR 7 54.569 -1.616 -13.598
38 3HG2 THR 7 HG23 THR 7 54.441 0.085 -14.051
39 H ASN 8 HN ASN 8 51.530 0.089 -9.448
40 HA ASN 8 HA ASN 8 49.246 -1.286 -10.695
41 1HB ASN 8 HB2 ASN 8 50.844 -3.088 -10.681
42 2HB ASN 8 HB1 ASN 8 51.329 -2.715 -9.025
43 1HD2 ASN 8 HD2 ASN 8 47.932 -2.450 -9.808
44 2HD2 ASN 8 HD2 ASN 8 47.438 -3.851 -8.997
45 H SER 9 HN SER 9 50.982 -0.924 -7.605
46 HA SER 9 HA SER 9 50.255 0.160 -5.617
47 1HB SER 9 HB2 SER 9 48.431 1.514 -5.772
48 2HB SER 9 HB1 SER 9 48.497 1.094 -7.478
49 HG SER 9 HG SER 9 46.611 0.237 -7.180
50 H GLN 10 HN GLN 10 50.677 -1.785 -4.468
51 HA GLN 10 HA GLN 10 48.205 -3.353 -3.824
52 1HB GLN 10 HB2 GLN 10 50.507 -5.003 -3.488
53 2HB GLN 10 HB1 GLN 10 49.198 -5.213 -4.647
54 1HG GLN 10 HG2 GLN 10 50.464 -3.489 -6.096
55 2HG GLN 10 HG1 GLN 10 51.830 -3.793 -5.024
56 1HE2 GLN 10 HE21 GLN 10 50.332 -6.700 -4.928
57 2HE2 GLN 10 HE22 GLN 10 51.052 -7.463 -6.257
58 H LEU 11 HN LEU 11 49.667 -1.051 -2.581
59 HA LEU 11 HA LEU 11 51.286 -1.556 -0.422
60 1HB LEU 11 HB2 LEU 11 48.907 0.218 -0.866
61 2HB LEU 11 HB1 LEU 11 49.693 0.214 0.713
62 HG LEU 11 HG LEU 11 50.727 1.947 -0.600
63 1HD1 LEU 11 HD1 LEU 11 52.137 -0.190 0.493
64 2HD1 LEU 11 HD1 LEU 11 52.803 1.387 0.069
65 3HD1 LEU 11 HD1 LEU 11 52.885 0.052 -1.085
66 1HD2 LEU 11 HD2 LEU 11 51.595 1.625 -2.808
67 2HD2 LEU 11 HD2 LEU 11 49.985 0.903 -2.810
68 3HD2 LEU 11 HD2 LEU 11 51.410 -0.127 -2.691
69 H SER 12 HN SER 12 51.114 -3.440 0.667
70 HA SER 12 HA SER 12 48.684 -4.775 1.381
71 1HB SER 12 HB2 SER 12 51.526 -4.867 2.406
72 2HB SER 12 HB1 SER 12 50.285 -5.994 2.947
73 HG SER 12 HG SER 12 50.844 -5.537 0.209
74 H ALA 13 HN ALA 13 47.999 -2.278 2.201
75 HA ALA 13 HA ALA 13 47.192 -1.082 4.077
76 1HB ALA 13 HB1 ALA 13 47.728 -3.637 5.595
77 2HB ALA 13 HB2 ALA 13 46.445 -3.552 4.388
78 3HB ALA 13 HB3 ALA 13 46.397 -2.499 5.803
79 H ASN 14 HN ASN 14 47.958 -0.007 6.002
80 HA ASN 14 HA ASN 14 49.565 0.724 7.580
81 1HB ASN 14 HB2 ASN 14 49.696 -1.935 7.597
82 2HB ASN 14 HB1 ASN 14 51.281 -1.628 6.893
83 1HD2 ASN 14 HD2 ASN 14 52.363 0.442 8.201
84 2HD2 ASN 14 HD2 ASN 14 52.370 0.211 9.881
85 H SER 15 HN SER 15 50.203 0.315 4.260
86 HA SER 15 HA SER 15 52.999 1.094 4.236
87 1HB SER 15 HB2 SER 15 52.738 0.696 2.018
88 2HB SER 15 HB1 SER 15 51.163 0.058 2.483
89 HG SER 15 HG SER 15 50.265 2.064 2.045
90 H LYS 16 HN LYS 16 53.532 3.209 2.898
91 HA LYS 16 HA LYS 16 51.699 5.465 3.340
92 1HB LYS 16 HB2 LYS 16 53.943 4.752 5.141
93 2HB LYS 16 HB1 LYS 16 53.876 6.451 4.667
94 1HG LYS 16 HG2 LYS 16 52.233 6.780 6.168
95 2HG LYS 16 HG1 LYS 16 51.215 5.653 5.271
96 1HD LYS 16 HD2 LYS 16 51.958 3.793 6.560
97 2HD LYS 16 HD1 LYS 16 53.297 4.710 7.247
98 1HE LYS 16 HE2 LYS 16 51.937 5.176 9.007
99 2HE LYS 16 HE1 LYS 16 50.975 6.181 7.904
100 1HZ LYS 16 HZ1 LYS 16 49.464 4.587 8.629
101 2HZ LYS 16 HZ2 LYS 16 50.609 3.332 8.600
102 3HZ LYS 16 HZ3 LYS 16 49.992 3.957 7.145
103 H CYS 17 HN CYS 17 52.402 7.347 2.168
104 HA CYS 17 HA CYS 17 55.027 7.464 0.909
105 1HB CYS 17 HB2 CYS 17 54.359 6.940 -1.328
106 2HB CYS 17 HB1 CYS 17 53.691 5.660 -0.319
107 H GLU 18 HN GLU 18 54.634 9.200 -1.124
108 HA GLU 18 HA GLU 18 52.613 11.231 -0.578
109 1HB GLU 18 HB2 GLU 18 54.058 11.540 1.364
110 2HB GLU 18 HB1 GLU 18 55.486 11.598 0.331
111 1HG GLU 18 HG2 GLU 18 54.904 13.695 -0.569
112 2HG GLU 18 HG1 GLU 18 53.221 13.548 -0.062
113 H LYS 19 HN LYS 19 55.837 10.549 -1.949
114 HA LYS 19 HA LYS 19 55.088 11.333 -4.618
115 1HB LYS 19 HB2 LYS 19 55.034 13.526 -3.415
116 2HB LYS 19 HB1 LYS 19 56.737 13.311 -3.010
117 1HG LYS 19 HG2 LYS 19 56.948 14.565 -4.943
118 2HG LYS 19 HG1 LYS 19 56.953 12.941 -5.636
119 1HD LYS 19 HD2 LYS 19 54.278 14.142 -5.214
120 2HD LYS 19 HD1 LYS 19 55.270 14.906 -6.457
121 1HE LYS 19 HE2 LYS 19 55.669 12.593 -7.427
122 2HE LYS 19 HE1 LYS 19 54.427 11.996 -6.310
123 1HZ LYS 19 HZ1 LYS 19 53.397 12.636 -8.384
124 2HZ LYS 19 HZ2 LYS 19 54.101 14.181 -8.300
125 3HZ LYS 19 HZ3 LYS 19 52.925 13.717 -7.164
126 H SER 20 HN SER 20 56.396 9.095 -3.821
127 HA SER 20 HA SER 20 59.322 9.550 -4.212
128 1HB SER 20 HB2 SER 20 59.536 7.399 -3.177
129 2HB SER 20 HB1 SER 20 58.270 8.234 -2.284
130 HG SER 20 HG SER 20 57.700 6.081 -2.897
131 H THR 21 HN THR 21 59.997 7.057 -5.266
132 HA THR 21 HA THR 21 58.574 7.004 -7.909
133 HB THR 21 HB THR 21 61.536 6.809 -7.260
134 HG1 THR 21 HG1 THR 21 61.593 8.830 -7.854
135 1HG2 THR 21 HG21 THR 21 59.964 5.972 -9.584
136 2HG2 THR 21 HG22 THR 21 61.639 5.607 -9.172
137 3HG2 THR 21 HG23 THR 21 61.244 7.113 -10.000
138 H LEU 22 HN LEU 22 57.384 5.185 -6.761
139 HA LEU 22 HA LEU 22 58.979 2.717 -6.328
140 1HB LEU 22 HB2 LEU 22 56.837 3.895 -5.070
141 2HB LEU 22 HB1 LEU 22 56.042 2.670 -6.062
142 HG LEU 22 HG LEU 22 57.657 0.973 -5.150
143 1HD1 LEU 22 HD1 LEU 22 59.477 2.422 -4.486
144 2HD1 LEU 22 HD1 LEU 22 58.842 1.654 -3.030
145 3HD1 LEU 22 HD1 LEU 22 58.421 3.326 -3.399
146 1HD2 LEU 22 HD2 LEU 22 55.342 1.458 -4.189
147 2HD2 LEU 22 HD2 LEU 22 56.154 2.415 -2.950
148 3HD2 LEU 22 HD2 LEU 22 56.475 0.685 -3.082
149 H THR 23 HN THR 23 58.085 0.664 -7.306
150 HA THR 23 HA THR 23 56.369 0.816 -9.660
151 HB THR 23 HB THR 23 59.384 0.589 -9.903
152 HG1 THR 23 HG1 THR 23 59.210 2.493 -10.814
153 1HG2 THR 23 HG21 THR 23 57.419 -0.777 -11.419
154 2HG2 THR 23 HG22 THR 23 59.141 -0.631 -11.775
155 3HG2 THR 23 HG23 THR 23 58.001 0.547 -12.426
156 H ASN 24 HN ASN 24 55.435 -1.189 -9.810
157 HA ASN 24 HA ASN 24 55.088 -3.502 -9.484
158 1HB ASN 24 HB2 ASN 24 58.013 -3.127 -10.040
159 2HB ASN 24 HB1 ASN 24 57.429 -4.735 -9.613
160 1HD2 ASN 24 HD2 ASN 24 57.849 -2.614 -12.234
161 2HD2 ASN 24 HD2 ASN 24 56.809 -3.379 -13.336
162 H CYS 25 HN CYS 25 55.582 -1.691 -7.132
163 HA CYS 25 HA CYS 25 56.873 -3.554 -5.190
164 1HB CYS 25 HB2 CYS 25 56.675 -0.713 -5.626
165 2HB CYS 25 HB1 CYS 25 56.042 -1.084 -4.035
166 H TYR 26 HN TYR 26 55.695 -4.120 -3.209
167 HA TYR 26 HA TYR 26 52.710 -3.867 -3.433
168 1HB TYR 26 HB2 TYR 26 54.206 -5.995 -1.891
169 2HB TYR 26 HB1 TYR 26 52.558 -6.052 -2.507
170 HD1 TYR 26 HD1 TYR 26 53.351 -4.854 -5.295
171 HD2 TYR 26 HD2 TYR 26 54.871 -8.095 -2.920
172 HE1 TYR 26 HE1 TYR 26 54.150 -5.989 -7.349
173 HE2 TYR 26 HE2 TYR 26 55.671 -9.228 -4.976
174 HH TYR 26 HH TYR 26 55.856 -7.658 -7.982
175 H VAL 27 HN VAL 27 55.508 -3.990 -1.353
176 HA VAL 27 HA VAL 27 55.964 -3.121 0.776
177 HB VAL 27 HB VAL 27 53.777 -1.202 0.011
178 1HG1 VAL 27 HG11 VAL 27 55.909 0.197 1.037
179 2HG1 VAL 27 HG12 VAL 27 55.980 -1.304 1.964
180 3HG1 VAL 27 HG13 VAL 27 54.511 -0.327 1.977
181 1HG2 VAL 27 HG21 VAL 27 54.985 -1.099 -1.959
182 2HG2 VAL 27 HG22 VAL 27 56.451 -1.730 -1.206
183 3HG2 VAL 27 HG23 VAL 27 56.001 -0.043 -0.976
184 H ASP 28 HN ASP 28 55.392 -3.539 2.825
185 HA ASP 28 HA ASP 28 52.518 -3.773 3.598
186 1HB ASP 28 HB2 ASP 28 53.839 -5.984 2.878
187 2HB ASP 28 HB1 ASP 28 54.479 -5.852 4.517
188 H LYS 29 HN LYS 29 52.372 -2.390 5.357
189 HA LYS 29 HA LYS 29 53.009 -1.202 7.313
190 1HB LYS 29 HB2 LYS 29 54.494 -3.834 7.551
191 2HB LYS 29 HB1 LYS 29 54.466 -2.639 8.844
192 1HG LYS 29 HG2 LYS 29 52.232 -2.985 9.308
193 2HG LYS 29 HG1 LYS 29 51.854 -3.467 7.654
194 1HD LYS 29 HD2 LYS 29 53.257 -5.551 8.074
195 2HD LYS 29 HD1 LYS 29 53.263 -5.097 9.778
196 1HE LYS 29 HE2 LYS 29 50.753 -5.534 8.121
197 2HE LYS 29 HE1 LYS 29 51.427 -6.698 9.280
198 1HZ LYS 29 HZ1 LYS 29 50.186 -4.094 9.778
199 2HZ LYS 29 HZ2 LYS 29 51.466 -4.564 10.790
200 3HZ LYS 29 HZ3 LYS 29 50.075 -5.530 10.672
201 H SER 30 HN SER 30 54.248 0.068 5.431
202 HA SER 30 HA SER 30 57.025 0.431 6.402
203 1HB SER 30 HB2 SER 30 56.271 -0.342 3.568
204 2HB SER 30 HB1 SER 30 57.882 0.165 4.070
205 HG SER 30 HG SER 30 58.192 -1.773 4.804
206 H GLU 31 HN GLU 31 57.889 2.469 5.806
207 HA GLU 31 HA GLU 31 55.929 4.356 4.539
208 1HB GLU 31 HB2 GLU 31 57.811 4.580 6.890
209 2HB GLU 31 HB1 GLU 31 57.190 6.018 6.080
210 1HG GLU 31 HG2 GLU 31 55.009 5.629 6.757
211 2HG GLU 31 HG1 GLU 31 55.249 3.884 6.872
212 H VAL 32 HN VAL 32 56.729 4.816 2.541
213 HA VAL 32 HA VAL 32 59.697 5.029 2.204
214 HB VAL 32 HB VAL 32 57.508 4.614 0.145
215 1HG1 VAL 32 HG11 VAL 32 59.470 3.628 -1.122
216 2HG1 VAL 32 HG12 VAL 32 60.519 4.301 0.124
217 3HG1 VAL 32 HG13 VAL 32 59.544 5.373 -0.883
218 1HG2 VAL 32 HG21 VAL 32 59.192 2.315 0.814
219 2HG2 VAL 32 HG22 VAL 32 57.438 2.412 0.673
220 3HG2 VAL 32 HG23 VAL 32 58.225 2.856 2.187
221 H TYR 33 HN TYR 33 60.519 6.841 0.988
222 HA TYR 33 HA TYR 33 58.594 9.038 0.380
223 1HB TYR 33 HB2 TYR 33 60.895 9.037 2.337
224 2HB TYR 33 HB1 TYR 33 60.284 10.537 1.640
225 HD1 TYR 33 HD1 TYR 33 59.837 8.096 4.222
226 HD2 TYR 33 HD2 TYR 33 57.727 10.971 1.825
227 HE1 TYR 33 HE1 TYR 33 57.993 8.129 5.882
228 HE2 TYR 33 HE2 TYR 33 55.883 10.999 3.483
229 HH TYR 33 HH TYR 33 55.345 8.738 5.683
230 H GLY 34 HN GLY 34 60.272 7.290 -1.352
231 1HA GLY 34 HA2 GLY 34 61.091 8.702 -3.429
232 2HA GLY 34 HA1 GLY 34 62.352 9.199 -2.302
233 H THR 35 HN THR 35 60.879 5.971 -2.656
234 HA THR 35 HA THR 35 63.620 4.851 -2.972
235 HB THR 35 HB THR 35 60.885 3.801 -2.252
236 HG1 THR 35 HG1 THR 35 62.643 4.807 -0.821
237 1HG2 THR 35 HG21 THR 35 61.837 1.551 -2.128
238 2HG2 THR 35 HG22 THR 35 63.384 2.155 -2.718
239 3HG2 THR 35 HG23 THR 35 61.971 2.170 -3.773
240 H THR 36 HN THR 36 64.317 4.271 -4.993
241 HA THR 36 HA THR 36 62.482 4.309 -7.277
242 HB THR 36 HB THR 36 65.410 3.551 -6.983
243 HG1 THR 36 HG1 THR 36 65.634 5.611 -6.761
244 1HG2 THR 36 HG21 THR 36 65.065 4.529 -9.517
245 2HG2 THR 36 HG22 THR 36 63.548 3.667 -9.269
246 3HG2 THR 36 HG23 THR 36 65.083 2.814 -9.111
247 H CYS 37 HN CYS 37 61.431 2.405 -5.699
248 HA CYS 37 HA CYS 37 62.309 -0.223 -5.618
249 1HB CYS 37 HB2 CYS 37 60.230 0.550 -4.644
250 2HB CYS 37 HB1 CYS 37 59.582 0.956 -6.231
251 H THR 38 HN THR 38 62.409 -1.959 -7.090
252 HA THR 38 HA THR 38 61.782 -1.320 -9.956
253 HB THR 38 HB THR 38 64.248 -1.468 -9.054
254 HG1 THR 38 HG1 THR 38 64.753 -1.877 -11.075
255 1HG2 THR 38 HG21 THR 38 65.174 -3.731 -9.066
256 2HG2 THR 38 HG22 THR 38 63.583 -4.406 -9.416
257 3HG2 THR 38 HG23 THR 38 63.886 -3.629 -7.862
258 H GLY 39 HN GLY 39 60.609 -3.006 -7.485
259 1HA GLY 39 HA2 GLY 39 58.807 -4.642 -8.295
260 2HA GLY 39 HA1 GLY 39 60.151 -5.510 -9.041
261 H SER 40 HN SER 40 60.079 -3.904 -5.876
262 HA SER 40 HA SER 40 60.563 -6.586 -4.620
263 1HB SER 40 HB2 SER 40 61.654 -3.851 -3.888
264 2HB SER 40 HB1 SER 40 62.040 -5.360 -3.067
265 HG SER 40 HG SER 40 62.785 -6.101 -5.175
266 H ARG 41 HN ARG 41 60.358 -5.880 -1.974
267 HA ARG 41 HA ARG 41 57.927 -4.274 -1.536
268 1HB ARG 41 HB2 ARG 41 56.877 -6.276 -2.250
269 2HB ARG 41 HB1 ARG 41 58.055 -7.287 -1.415
270 1HG ARG 41 HG2 ARG 41 57.192 -6.582 0.754
271 2HG ARG 41 HG1 ARG 41 56.077 -5.457 -0.025
272 1HD ARG 41 HD2 ARG 41 54.553 -7.113 -0.243
273 2HD ARG 41 HD1 ARG 41 55.717 -8.075 -1.178
274 HE ARG 41 HE ARG 41 56.435 -8.143 1.598
275 1HH1 ARG 41 HH1 ARG 41 56.363 -10.577 -0.118
276 2HH1 ARG 41 HH1 ARG 41 55.022 -11.455 0.540
277 1HH2 ARG 41 HH2 ARG 41 53.715 -8.734 2.233
278 2HH2 ARG 41 HH2 ARG 41 53.526 -10.414 1.860
279 H PHE 42 HN PHE 42 57.387 -4.238 0.840
280 HA PHE 42 HA PHE 42 59.801 -4.790 2.527
281 1HB PHE 42 HB2 PHE 42 57.776 -2.569 2.894
282 2HB PHE 42 HB1 PHE 42 59.380 -2.697 3.617
283 HD1 PHE 42 HD1 PHE 42 61.007 -3.562 1.302
284 HD2 PHE 42 HD2 PHE 42 57.888 -0.619 1.555
285 HE1 PHE 42 HE1 PHE 42 61.978 -2.367 -0.642
286 HE2 PHE 42 HE2 PHE 42 58.859 0.577 -0.389
287 HZ PHE 42 HZ PHE 42 60.903 -0.298 -1.488
288 H ASP 43 HN ASP 43 58.801 -4.437 5.021
289 HA ASP 43 HA ASP 43 56.156 -5.620 5.387
290 1HB ASP 43 HB2 ASP 43 57.895 -7.418 4.559
291 2HB ASP 43 HB1 ASP 43 58.464 -7.358 6.228
292 H GLY 44 HN GLY 44 57.222 -3.305 6.483
293 1HA GLY 44 HA2 GLY 44 56.717 -2.736 8.877
294 2HA GLY 44 HA1 GLY 44 57.719 -4.125 9.314
295 H VAL 45 HN VAL 45 58.205 -1.430 7.000
296 HA VAL 45 HA VAL 45 60.762 -0.858 8.460
297 HB VAL 45 HB VAL 45 61.909 -0.833 6.416
298 1HG1 VAL 45 HG11 VAL 45 61.205 -3.117 6.848
299 2HG1 VAL 45 HG12 VAL 45 61.133 -2.821 5.110
300 3HG1 VAL 45 HG13 VAL 45 59.652 -2.824 6.065
301 1HG2 VAL 45 HG21 VAL 45 60.845 0.614 4.981
302 2HG2 VAL 45 HG22 VAL 45 59.249 -0.054 5.322
303 3HG2 VAL 45 HG23 VAL 45 60.347 -0.906 4.235
304 H THR 46 HN THR 46 61.576 1.314 7.046
305 HA THR 46 HA THR 46 59.441 3.301 6.736
306 HB THR 46 HB THR 46 61.467 3.539 8.979
307 HG1 THR 46 HG1 THR 46 59.696 3.070 10.326
308 1HG2 THR 46 HG21 THR 46 59.689 5.379 7.693
309 2HG2 THR 46 HG22 THR 46 60.774 5.676 9.051
310 3HG2 THR 46 HG23 THR 46 59.126 5.119 9.343
311 H ILE 47 HN ILE 47 61.150 2.581 4.799
312 HA ILE 47 HA ILE 47 63.696 3.984 4.826
313 HB ILE 47 HB ILE 47 63.272 1.925 3.571
314 1HG1 ILE 47 HG12 ILE 47 63.589 4.218 1.614
315 2HG1 ILE 47 HG11 ILE 47 64.882 3.661 2.675
316 1HG2 ILE 47 HG21 ILE 47 60.993 1.985 3.020
317 2HG2 ILE 47 HG22 ILE 47 61.773 2.255 1.460
318 3HG2 ILE 47 HG23 ILE 47 61.099 3.616 2.356
319 1HD1 ILE 47 HD1 ILE 47 63.488 1.577 1.068
320 2HD1 ILE 47 HD1 ILE 47 65.191 1.709 1.504
321 3HD1 ILE 47 HD1 ILE 47 64.541 2.684 0.188
322 H THR 48 HN THR 48 64.158 5.570 2.960
323 HA THR 48 HA THR 48 61.851 7.393 2.420
324 HB THR 48 HB THR 48 63.392 9.272 3.080
325 HG1 THR 48 HG1 THR 48 65.203 8.454 4.421
326 1HG2 THR 48 HG21 THR 48 62.917 7.145 5.184
327 2HG2 THR 48 HG22 THR 48 61.762 8.380 4.686
328 3HG2 THR 48 HG23 THR 48 63.248 8.847 5.512
329 H THR 49 HN THR 49 64.159 9.252 1.407
330 HA THR 49 HA THR 49 64.052 8.487 -1.363
331 HB THR 49 HB THR 49 65.880 10.306 0.237
332 HG1 THR 49 HG1 THR 49 63.796 11.031 -1.519
333 1HG2 THR 49 HG21 THR 49 67.029 9.809 -1.797
334 2HG2 THR 49 HG22 THR 49 66.256 11.377 -2.041
335 3HG2 THR 49 HG23 THR 49 65.543 9.923 -2.742
336 H SER 50 HN SER 50 64.804 6.165 -1.176
337 HA SER 50 HA SER 50 67.804 6.020 -1.124
338 1HB SER 50 HB2 SER 50 66.685 5.273 0.997
339 2HB SER 50 HB1 SER 50 65.825 4.052 0.065
340 HG SER 50 HG SER 50 67.739 3.228 1.005
341 H THR 51 HN THR 51 68.712 4.468 -2.591
342 HA THR 51 HA THR 51 66.814 3.487 -4.669
343 HB THR 51 HB THR 51 69.702 2.991 -4.964
344 HG1 THR 51 HG1 THR 51 68.755 5.658 -4.872
345 1HG2 THR 51 HG21 THR 51 69.256 4.172 -7.121
346 2HG2 THR 51 HG22 THR 51 67.606 4.473 -6.573
347 3HG2 THR 51 HG23 THR 51 68.159 2.821 -6.838
348 H SER 52 HN SER 52 66.203 1.384 -4.629
349 HA SER 52 HA SER 52 67.965 -0.637 -3.310
350 1HB SER 52 HB2 SER 52 65.782 0.454 -2.114
351 2HB SER 52 HB1 SER 52 65.017 -0.873 -2.982
352 HG SER 52 HG SER 52 66.075 -1.133 -0.727
353 H THR 53 HN THR 53 68.505 -1.818 -5.149
354 HA THR 53 HA THR 53 66.389 -2.456 -7.140
355 HB THR 53 HB THR 53 69.193 -3.465 -7.325
356 HG1 THR 53 HG1 THR 53 68.425 -0.750 -7.298
357 1HG2 THR 53 HG21 THR 53 67.217 -2.144 -9.195
358 2HG2 THR 53 HG22 THR 53 67.714 -3.834 -9.186
359 3HG2 THR 53 HG23 THR 53 68.858 -2.582 -9.667
360 H GLY 54 HN GLY 54 65.129 -4.134 -6.264
361 1HA GLY 54 HA2 GLY 54 64.633 -6.316 -5.546
362 2HA GLY 54 HA1 GLY 54 66.203 -6.783 -6.206
363 H SER 55 HN SER 55 64.503 -5.777 -3.314
364 HA SER 55 HA SER 55 66.586 -6.944 -1.620
365 1HB SER 55 HB2 SER 55 67.261 -4.850 -0.584
366 2HB SER 55 HB1 SER 55 67.460 -4.684 -2.326
367 HG SER 55 HG SER 55 65.616 -3.487 -2.416
368 H ARG 56 HN ARG 56 65.359 -7.901 -0.023
369 HA ARG 56 HA ARG 56 62.651 -6.931 0.561
370 1HB ARG 56 HB2 ARG 56 64.072 -9.343 0.701
371 2HB ARG 56 HB1 ARG 56 63.763 -8.913 2.385
372 1HG ARG 56 HG2 ARG 56 61.420 -8.380 0.780
373 2HG ARG 56 HG1 ARG 56 61.936 -10.054 0.564
374 1HD ARG 56 HD2 ARG 56 62.063 -10.249 3.086
375 2HD ARG 56 HD1 ARG 56 61.273 -8.662 3.176
376 HE ARG 56 HE ARG 56 59.544 -9.843 1.548
377 1HH1 ARG 56 HH1 ARG 56 61.003 -10.867 4.478
378 2HH1 ARG 56 HH1 ARG 56 59.922 -12.197 4.719
379 1HH2 ARG 56 HH2 ARG 56 58.230 -11.709 1.730
380 2HH2 ARG 56 HH2 ARG 56 58.343 -12.669 3.167
381 H ILE 57 HN ILE 57 62.465 -5.149 1.848
382 HA ILE 57 HA ILE 57 64.539 -4.513 3.843
383 HB ILE 57 HB ILE 57 61.945 -3.069 3.263
384 1HG1 ILE 57 HG12 ILE 57 63.058 -3.540 1.114
385 2HG1 ILE 57 HG11 ILE 57 63.213 -1.830 1.518
386 1HG2 ILE 57 HG21 ILE 57 64.665 -2.350 4.353
387 2HG2 ILE 57 HG22 ILE 57 63.093 -2.136 5.121
388 3HG2 ILE 57 HG23 ILE 57 63.552 -1.118 3.755
389 1HD1 ILE 57 HD1 ILE 57 65.302 -3.650 0.957
390 2HD1 ILE 57 HD1 ILE 57 65.399 -3.311 2.685
391 3HD1 ILE 57 HD1 ILE 57 65.459 -1.986 1.522
392 H SER 58 HN SER 58 62.244 -6.728 4.005
393 HA SER 58 HA SER 58 60.404 -6.297 6.021
394 1HB SER 58 HB2 SER 58 62.066 -8.508 5.033
395 2HB SER 58 HB1 SER 58 61.546 -8.726 6.701
396 HG SER 58 HG SER 58 59.737 -9.325 5.819
397 H GLY 59 HN GLY 59 60.467 -5.998 8.269
398 1HA GLY 59 HA2 GLY 59 62.663 -6.641 9.954
399 2HA GLY 59 HA1 GLY 59 62.831 -4.951 9.473
400 HA PRO 60 HA PRO 60 59.429 -5.598 12.724
401 1HB PRO 60 HB2 PRO 60 60.818 -5.787 15.075
402 2HB PRO 60 HB1 PRO 60 60.331 -7.208 14.131
403 1HG PRO 60 HG2 PRO 60 62.983 -5.906 14.352
404 2HG PRO 60 HG1 PRO 60 62.573 -7.615 14.138
405 1HD PRO 60 HD2 PRO 60 63.450 -5.928 12.129
406 2HD PRO 60 HD1 PRO 60 62.564 -7.447 11.873
407 H GLY 61 HN GLY 61 60.248 -3.351 11.487
408 1HA GLY 61 HA2 GLY 61 59.740 -1.061 12.382
409 2HA GLY 61 HA1 GLY 61 60.859 -1.431 13.698
410 H CYS 62 HN CYS 62 61.690 -2.616 10.569
411 HA CYS 62 HA CYS 62 64.248 -1.678 10.328
412 1HB CYS 62 HB2 CYS 62 62.123 -2.582 8.599
413 2HB CYS 62 HB1 CYS 62 63.069 -1.344 7.774
414 H LYS 63 HN LYS 63 65.285 0.228 9.609
415 HA LYS 63 HA LYS 63 63.596 2.586 8.927
416 1HB LYS 63 HB2 LYS 63 63.860 2.534 11.375
417 2HB LYS 63 HB1 LYS 63 65.613 2.416 11.191
418 1HG LYS 63 HG2 LYS 63 65.674 4.603 10.094
419 2HG LYS 63 HG1 LYS 63 63.917 4.721 10.180
420 1HD LYS 63 HD2 LYS 63 64.084 4.548 12.675
421 2HD LYS 63 HD1 LYS 63 65.839 4.611 12.522
422 1HE LYS 63 HE2 LYS 63 65.825 6.862 12.193
423 2HE LYS 63 HE1 LYS 63 64.465 6.765 11.055
424 1HZ LYS 63 HZ1 LYS 63 64.260 6.489 14.008
425 2HZ LYS 63 HZ2 LYS 63 62.966 6.404 12.909
426 3HZ LYS 63 HZ3 LYS 63 63.808 7.865 13.124
427 H ILE 64 HN ILE 64 64.579 2.784 6.851
428 HA ILE 64 HA ILE 64 67.561 3.079 6.852
429 HB ILE 64 HB ILE 64 65.657 2.281 4.636
430 1HG1 ILE 64 HG12 ILE 64 67.620 0.307 5.416
431 2HG1 ILE 64 HG11 ILE 64 66.661 0.791 6.814
432 1HG2 ILE 64 HG21 ILE 64 68.005 3.476 4.222
433 2HG2 ILE 64 HG22 ILE 64 67.483 2.122 3.222
434 3HG2 ILE 64 HG23 ILE 64 68.617 1.855 4.545
435 1HD1 ILE 64 HD1 ILE 64 65.848 -1.084 5.031
436 2HD1 ILE 64 HD1 ILE 64 65.145 0.362 4.309
437 3HD1 ILE 64 HD1 ILE 64 64.733 -0.086 5.962
438 H SER 65 HN SER 65 68.450 4.843 5.681
439 HA SER 65 HA SER 65 66.510 6.833 4.577
440 1HB SER 65 HB2 SER 65 68.730 7.767 6.353
441 2HB SER 65 HB1 SER 65 67.149 8.490 6.067
442 HG SER 65 HG SER 65 66.524 7.469 7.783
443 H THR 66 HN THR 66 67.214 7.261 2.552
444 HA THR 66 HA THR 66 68.643 7.679 0.737
445 HB THR 66 HB THR 66 70.687 8.582 2.730
446 HG1 THR 66 HG1 THR 66 68.069 9.552 2.355
447 1HG2 THR 66 HG21 THR 66 69.686 10.387 0.644
448 2HG2 THR 66 HG22 THR 66 70.337 8.879 0.002
449 3HG2 THR 66 HG23 THR 66 71.343 9.914 1.018
450 H CYS 67 HN CYS 67 68.913 5.319 0.436
451 HA CYS 67 HA CYS 67 71.772 4.531 0.756
452 1HB CYS 67 HB2 CYS 67 69.927 3.539 2.434
453 2HB CYS 67 HB1 CYS 67 69.628 2.458 1.074
454 H ILE 68 HN ILE 68 72.538 3.873 -1.221
455 HA ILE 68 HA ILE 68 70.690 3.701 -3.495
456 HB ILE 68 HB ILE 68 73.647 3.732 -2.983
457 1HG1 ILE 68 HG12 ILE 68 73.453 5.590 -4.682
458 2HG1 ILE 68 HG11 ILE 68 71.709 5.328 -4.689
459 1HG2 ILE 68 HG21 ILE 68 73.955 3.421 -5.466
460 2HG2 ILE 68 HG22 ILE 68 72.269 2.896 -5.533
461 3HG2 ILE 68 HG23 ILE 68 73.442 1.971 -4.596
462 1HD1 ILE 68 HD1 ILE 68 72.703 7.146 -3.094
463 2HD1 ILE 68 HD1 ILE 68 73.154 5.771 -2.089
464 3HD1 ILE 68 HD1 ILE 68 71.458 6.059 -2.477
465 H ILE 69 HN ILE 69 71.261 1.583 -1.220
466 HA ILE 69 HA ILE 69 72.121 -0.846 -1.571
467 HB ILE 69 HB ILE 69 69.147 -0.297 -1.352
468 1HG1 ILE 69 HG12 ILE 69 71.284 -0.391 0.811
469 2HG1 ILE 69 HG11 ILE 69 70.521 1.070 0.200
470 1HG2 ILE 69 HG21 ILE 69 70.522 -2.723 -1.439
471 2HG2 ILE 69 HG22 ILE 69 68.893 -2.469 -0.812
472 3HG2 ILE 69 HG23 ILE 69 70.275 -2.427 0.283
473 1HD1 ILE 69 HD1 ILE 69 69.514 0.159 2.327
474 2HD1 ILE 69 HD1 ILE 69 68.938 -1.206 1.369
475 3HD1 ILE 69 HD1 ILE 69 68.382 0.430 1.004
476 H THR 70 HN THR 70 72.130 -2.552 -3.037
477 HA THR 70 HA THR 70 70.185 -2.520 -5.289
478 HB THR 70 HB THR 70 73.201 -2.366 -5.520
479 HG1 THR 70 HG1 THR 70 72.837 -0.369 -6.082
480 1HG2 THR 70 HG21 THR 70 72.962 -2.677 -7.869
481 2HG2 THR 70 HG22 THR 70 71.205 -2.553 -7.777
482 3HG2 THR 70 HG23 THR 70 72.025 -3.970 -7.117
483 H GLY 71 HN GLY 71 69.359 -4.571 -4.749
484 1HA GLY 71 HA2 GLY 71 69.425 -6.926 -5.193
485 2HA GLY 71 HA1 GLY 71 71.187 -6.835 -5.270
486 H GLY 72 HN GLY 72 69.144 -5.545 -2.690
487 1HA GLY 72 HA2 GLY 72 68.960 -6.195 -0.431
488 2HA GLY 72 HA1 GLY 72 69.634 -7.762 -0.883
489 H VAL 73 HN VAL 73 71.510 -5.154 -1.976
490 HA VAL 73 HA VAL 73 73.428 -5.517 0.307
491 HB VAL 73 HB VAL 73 75.169 -5.360 -1.369
492 1HG1 VAL 73 HG11 VAL 73 74.446 -7.581 -1.405
493 2HG1 VAL 73 HG12 VAL 73 74.252 -7.124 -3.097
494 3HG1 VAL 73 HG13 VAL 73 72.851 -7.160 -2.029
495 1HG2 VAL 73 HG21 VAL 73 74.572 -3.722 -2.888
496 2HG2 VAL 73 HG22 VAL 73 72.903 -4.283 -2.999
497 3HG2 VAL 73 HG23 VAL 73 74.186 -5.152 -3.846
498 HA PRO 74 HA PRO 74 72.943 -1.118 0.636
499 1HB PRO 74 HB2 PRO 74 74.918 -0.670 2.461
500 2HB PRO 74 HB1 PRO 74 73.350 -1.358 2.896
501 1HG PRO 74 HG2 PRO 74 75.967 -2.705 2.540
502 2HG PRO 74 HG1 PRO 74 74.649 -3.075 3.659
503 1HD PRO 74 HD2 PRO 74 75.170 -4.463 1.328
504 2HD PRO 74 HD1 PRO 74 73.603 -4.435 2.166
505 H ALA 75 HN ALA 75 73.917 0.647 -0.369
506 HA ALA 75 HA ALA 75 76.414 0.115 -1.891
507 1HB ALA 75 HB1 ALA 75 75.590 2.504 -2.754
508 2HB ALA 75 HB2 ALA 75 74.083 1.999 -1.990
509 3HB ALA 75 HB3 ALA 75 74.784 1.027 -3.284
510 HA PRO 76 HA PRO 76 78.895 2.742 0.614
511 1HB PRO 76 HB2 PRO 76 80.328 4.191 -1.212
512 2HB PRO 76 HB1 PRO 76 80.623 2.468 -0.903
513 1HG PRO 76 HG2 PRO 76 79.126 3.762 -3.124
514 2HG PRO 76 HG1 PRO 76 80.199 2.355 -3.155
515 1HD PRO 76 HD2 PRO 76 77.477 2.171 -3.184
516 2HD PRO 76 HD1 PRO 76 78.540 0.911 -2.518
517 H SER 77 HN SER 77 76.715 3.875 1.123
518 HA SER 77 HA SER 77 76.702 6.678 0.055
519 1HB SER 77 HB2 SER 77 74.760 4.986 -0.284
520 2HB SER 77 HB1 SER 77 74.434 5.236 1.426
521 HG SER 77 HG SER 77 74.632 7.604 0.668
522 H ALA 78 HN ALA 78 77.822 7.886 1.573
523 HA ALA 78 HA ALA 78 78.068 7.317 4.353
524 1HB ALA 78 HB1 ALA 78 79.594 8.910 3.804
525 2HB ALA 78 HB2 ALA 78 78.293 10.074 4.052
526 3HB ALA 78 HB3 ALA 78 78.631 9.461 2.434
527 H ALA 79 HN ALA 79 75.394 8.492 2.557
528 HA ALA 79 HA ALA 79 74.124 9.824 4.892
529 1HB ALA 79 HB1 ALA 79 74.147 10.716 2.506
530 2HB ALA 79 HB2 ALA 79 72.548 10.591 3.235
531 3HB ALA 79 HB3 ALA 79 73.086 9.374 2.080
532 H CYS 80 HN CYS 80 74.233 6.764 3.334
533 HA CYS 80 HA CYS 80 71.538 5.864 3.914
534 1HB CYS 80 HB2 CYS 80 72.794 4.786 2.203
535 2HB CYS 80 HB1 CYS 80 74.180 4.557 3.256
536 H LYS 81 HN LYS 81 71.026 4.174 5.531
537 HA LYS 81 HA LYS 81 72.773 4.378 7.959
538 1HB LYS 81 HB2 LYS 81 70.850 4.718 9.265
539 2HB LYS 81 HB1 LYS 81 70.473 5.623 7.801
540 1HG LYS 81 HG2 LYS 81 68.521 4.370 8.114
541 2HG LYS 81 HG1 LYS 81 69.427 3.362 6.985
542 1HD LYS 81 HD2 LYS 81 70.385 2.509 9.428
543 2HD LYS 81 HD1 LYS 81 68.694 2.841 9.785
544 1HE LYS 81 HE2 LYS 81 68.461 1.518 7.382
545 2HE LYS 81 HE1 LYS 81 69.864 0.704 8.098
546 1HZ LYS 81 HZ1 LYS 81 67.163 0.476 8.846
547 2HZ LYS 81 HZ2 LYS 81 68.017 1.161 10.144
548 3HZ LYS 81 HZ3 LYS 81 68.507 -0.328 9.493
549 H ILE 82 HN ILE 82 72.776 2.523 9.309
550 HA ILE 82 HA ILE 82 71.584 0.019 8.216
551 HB ILE 82 HB ILE 82 74.461 0.279 9.136
552 1HG1 ILE 82 HG12 ILE 82 74.038 1.756 7.163
553 2HG1 ILE 82 HG11 ILE 82 75.108 0.408 6.777
554 1HG2 ILE 82 HG21 ILE 82 74.602 -1.806 7.636
555 2HG2 ILE 82 HG22 ILE 82 72.838 -1.802 7.662
556 3HG2 ILE 82 HG23 ILE 82 73.741 -1.989 9.164
557 1HD1 ILE 82 HD1 ILE 82 73.554 -0.623 5.435
558 2HD1 ILE 82 HD1 ILE 82 72.970 1.032 5.254
559 3HD1 ILE 82 HD1 ILE 82 72.192 -0.061 6.401
560 H SER 83 HN SER 83 70.225 0.802 10.197
561 HA SER 83 HA SER 83 71.404 -0.371 12.685
562 1HB SER 83 HB2 SER 83 70.007 2.267 12.215
563 2HB SER 83 HB1 SER 83 70.172 1.568 13.825
564 HG SER 83 HG SER 83 72.317 1.829 13.738
565 H GLY 84 HN GLY 84 70.083 -2.188 12.896
566 1HA GLY 84 HA2 GLY 84 68.118 -3.291 13.594
567 2HA GLY 84 HA1 GLY 84 67.295 -1.733 13.601
568 H CYS 85 HN CYS 85 68.982 -2.954 10.759
569 HA CYS 85 HA CYS 85 66.425 -3.840 9.564
570 1HB CYS 85 HB2 CYS 85 66.851 -1.277 9.367
571 2HB CYS 85 HB1 CYS 85 68.074 -1.725 8.182
572 H THR 86 HN THR 86 66.973 -4.411 7.111
573 HA THR 86 HA THR 86 69.663 -5.175 6.430
574 HB THR 86 HB THR 86 69.394 -6.699 8.298
575 HG1 THR 86 HG1 THR 86 69.315 -8.731 7.073
576 1HG2 THR 86 HG21 THR 86 67.081 -8.142 7.158
577 2HG2 THR 86 HG22 THR 86 66.718 -6.537 7.791
578 3HG2 THR 86 HG23 THR 86 67.448 -7.754 8.837
579 H PHE 87 HN PHE 87 69.663 -6.484 4.418
580 HA PHE 87 HA PHE 87 66.999 -6.404 3.033
581 1HB PHE 87 HB2 PHE 87 69.530 -6.270 1.464
582 2HB PHE 87 HB1 PHE 87 68.003 -5.436 1.197
583 HD1 PHE 87 HD1 PHE 87 67.589 -4.086 3.830
584 HD2 PHE 87 HD2 PHE 87 71.146 -4.595 1.466
585 HE1 PHE 87 HE1 PHE 87 68.566 -2.031 4.854
586 HE2 PHE 87 HE2 PHE 87 72.108 -2.562 2.482
587 HZ PHE 87 HZ PHE 87 70.828 -1.278 4.172
588 H SER 88 HN SER 88 66.997 -8.001 1.117
589 HA SER 88 HA SER 88 68.819 -10.310 1.368
590 1HB SER 88 HB2 SER 88 66.584 -10.205 2.965
591 2HB SER 88 HB1 SER 88 65.969 -11.068 1.558
592 HG SER 88 HG SER 88 66.955 -12.427 3.173
593 H ALA 89 HN ALA 89 67.781 -8.262 -0.651
594 HA ALA 89 HA ALA 89 67.053 -8.229 -2.899
595 1HB ALA 89 HB1 ALA 89 68.555 -10.814 -2.481
596 2HB ALA 89 HB2 ALA 89 69.114 -9.336 -3.261
597 3HB ALA 89 HB3 ALA 89 67.944 -10.374 -4.075
598 H ASN 90 HN ASN 90 64.737 -8.365 -2.114
599 HA ASN 90 HA ASN 90 63.414 -10.958 -2.039
600 1HB ASN 90 HB2 ASN 90 61.682 -9.697 -1.219
601 2HB ASN 90 HB1 ASN 90 62.923 -8.463 -1.064
602 1HD2 ASN 90 HD2 ASN 90 59.848 -8.598 -1.923
603 2HD2 ASN 90 HD2 ASN 90 59.803 -7.530 -3.240
Start of MODEL 17
1 1H ASP 1 HT1 ASP 1 48.379 12.030 1.721
2 2H ASP 1 HT2 ASP 1 48.772 11.710 3.342
3 3H ASP 1 HT3 ASP 1 47.385 11.016 2.647
4 HA ASP 1 HA ASP 1 50.120 10.448 1.633
5 1HB ASP 1 HB2 ASP 1 48.516 9.362 3.935
6 2HB ASP 1 HB1 ASP 1 49.613 8.293 3.062
7 H GLY 2 HN GLY 2 50.069 8.614 0.190
8 1HA GLY 2 HA2 GLY 2 48.930 6.811 -0.954
9 2HA GLY 2 HA1 GLY 2 47.389 7.533 -0.501
10 H SER 3 HN SER 3 50.305 8.433 -2.389
11 HA SER 3 HA SER 3 48.456 9.402 -4.536
12 1HB SER 3 HB2 SER 3 50.791 11.012 -4.510
13 2HB SER 3 HB1 SER 3 49.150 11.502 -4.103
14 HG SER 3 HG SER 3 51.166 10.469 -2.397
15 H CYS 4 HN CYS 4 50.201 6.938 -4.103
16 HA CYS 4 HA CYS 4 51.754 7.174 -6.655
17 1HB CYS 4 HB2 CYS 4 53.600 6.029 -5.594
18 2HB CYS 4 HB1 CYS 4 53.133 7.353 -4.528
19 H THR 5 HN THR 5 51.815 5.196 -7.872
20 HA THR 5 HA THR 5 50.018 3.021 -6.844
21 HB THR 5 HB THR 5 50.304 4.105 -9.666
22 HG1 THR 5 HG1 THR 5 48.403 4.479 -7.612
23 1HG2 THR 5 HG21 THR 5 49.532 1.997 -10.100
24 2HG2 THR 5 HG22 THR 5 47.990 2.703 -9.630
25 3HG2 THR 5 HG23 THR 5 48.921 1.768 -8.464
26 H ASN 6 HN ASN 6 53.138 3.713 -7.585
27 HA ASN 6 HA ASN 6 54.901 2.515 -8.666
28 1HB ASN 6 HB2 ASN 6 55.558 1.018 -7.040
29 2HB ASN 6 HB1 ASN 6 54.277 1.839 -6.172
30 1HD2 ASN 6 HD2 ASN 6 52.236 0.241 -7.967
31 2HD2 ASN 6 HD2 ASN 6 52.219 -1.280 -7.246
32 H THR 7 HN THR 7 52.688 2.354 -10.419
33 HA THR 7 HA THR 7 52.228 1.147 -12.406
34 HB THR 7 HB THR 7 53.795 -1.190 -11.397
35 HG1 THR 7 HG1 THR 7 54.774 1.408 -11.914
36 1HG2 THR 7 HG21 THR 7 53.146 -1.446 -13.630
37 2HG2 THR 7 HG22 THR 7 54.758 -0.748 -13.798
38 3HG2 THR 7 HG23 THR 7 53.330 0.271 -13.982
39 H ASN 8 HN ASN 8 50.763 0.705 -9.677
40 HA ASN 8 HA ASN 8 48.691 -0.969 -10.569
41 1HB ASN 8 HB2 ASN 8 50.024 -2.859 -10.773
42 2HB ASN 8 HB1 ASN 8 51.087 -2.377 -9.452
43 1HD2 ASN 8 HD2 ASN 8 49.886 -2.338 -7.205
44 2HD2 ASN 8 HD2 ASN 8 48.804 -3.604 -6.912
45 H SER 9 HN SER 9 50.578 0.157 -7.853
46 HA SER 9 HA SER 9 49.939 0.881 -5.711
47 1HB SER 9 HB2 SER 9 48.205 2.228 -6.351
48 2HB SER 9 HB1 SER 9 47.535 1.006 -7.426
49 HG SER 9 HG SER 9 47.069 1.491 -4.727
50 H GLN 10 HN GLN 10 50.696 -1.068 -4.706
51 HA GLN 10 HA GLN 10 48.453 -2.907 -3.969
52 1HB GLN 10 HB2 GLN 10 50.538 -3.473 -5.645
53 2HB GLN 10 HB1 GLN 10 51.169 -4.042 -4.096
54 1HG GLN 10 HG2 GLN 10 49.566 -5.654 -3.873
55 2HG GLN 10 HG1 GLN 10 48.344 -4.677 -4.687
56 1HE2 GLN 10 HE21 GLN 10 51.341 -4.909 -6.422
57 2HE2 GLN 10 HE22 GLN 10 50.829 -6.052 -7.563
58 H LEU 11 HN LEU 11 49.961 -0.547 -2.656
59 HA LEU 11 HA LEU 11 51.603 -1.218 -0.522
60 1HB LEU 11 HB2 LEU 11 49.214 0.624 -0.802
61 2HB LEU 11 HB1 LEU 11 50.117 0.552 0.708
62 HG LEU 11 HG LEU 11 51.108 2.334 -0.490
63 1HD1 LEU 11 HD1 LEU 11 52.595 0.190 0.216
64 2HD1 LEU 11 HD1 LEU 11 53.290 1.669 -0.448
65 3HD1 LEU 11 HD1 LEU 11 52.995 0.283 -1.499
66 1HD2 LEU 11 HD2 LEU 11 49.988 1.326 -2.700
67 2HD2 LEU 11 HD2 LEU 11 51.629 0.730 -2.957
68 3HD2 LEU 11 HD2 LEU 11 51.335 2.460 -2.785
69 H SER 12 HN SER 12 51.375 -2.924 0.885
70 HA SER 12 HA SER 12 49.030 -4.463 1.306
71 1HB SER 12 HB2 SER 12 51.733 -4.282 2.223
72 2HB SER 12 HB1 SER 12 50.693 -4.512 3.625
73 HG SER 12 HG SER 12 50.232 -6.456 2.949
74 H ALA 13 HN ALA 13 47.558 -2.435 1.564
75 HA ALA 13 HA ALA 13 46.526 -0.748 2.965
76 1HB ALA 13 HB1 ALA 13 46.172 -3.553 4.016
77 2HB ALA 13 HB2 ALA 13 45.105 -2.650 2.940
78 3HB ALA 13 HB3 ALA 13 45.229 -2.201 4.642
79 H ASN 14 HN ASN 14 49.023 -0.200 3.731
80 HA ASN 14 HA ASN 14 48.836 0.401 6.543
81 1HB ASN 14 HB2 ASN 14 49.202 -2.148 6.395
82 2HB ASN 14 HB1 ASN 14 50.828 -1.762 5.836
83 1HD2 ASN 14 HD2 ASN 14 50.344 -3.126 8.328
84 2HD2 ASN 14 HD2 ASN 14 50.840 -2.103 9.588
85 H SER 15 HN SER 15 50.904 -0.143 3.729
86 HA SER 15 HA SER 15 53.235 1.252 4.547
87 1HB SER 15 HB2 SER 15 53.212 -0.066 2.550
88 2HB SER 15 HB1 SER 15 51.860 0.847 1.884
89 HG SER 15 HG SER 15 54.171 1.347 1.216
90 H LYS 16 HN LYS 16 53.826 3.366 3.134
91 HA LYS 16 HA LYS 16 51.625 5.383 3.352
92 1HB LYS 16 HB2 LYS 16 53.443 5.024 5.314
93 2HB LYS 16 HB1 LYS 16 54.375 6.097 4.270
94 1HG LYS 16 HG2 LYS 16 52.623 7.776 4.335
95 2HG LYS 16 HG1 LYS 16 51.558 6.687 5.226
96 1HD LYS 16 HD2 LYS 16 54.264 7.308 6.366
97 2HD LYS 16 HD1 LYS 16 52.984 8.512 6.512
98 1HE LYS 16 HE2 LYS 16 51.587 6.349 7.301
99 2HE LYS 16 HE1 LYS 16 53.209 5.837 7.809
100 1HZ LYS 16 HZ1 LYS 16 53.486 8.067 8.816
101 2HZ LYS 16 HZ2 LYS 16 52.262 7.151 9.555
102 3HZ LYS 16 HZ3 LYS 16 51.859 8.399 8.477
103 H CYS 17 HN CYS 17 51.859 7.105 1.838
104 HA CYS 17 HA CYS 17 54.282 7.139 0.103
105 1HB CYS 17 HB2 CYS 17 51.859 5.833 -0.515
106 2HB CYS 17 HB1 CYS 17 51.845 7.325 -1.456
107 H GLU 18 HN GLU 18 54.851 9.277 -0.210
108 HA GLU 18 HA GLU 18 52.682 11.343 0.044
109 1HB GLU 18 HB2 GLU 18 54.447 11.122 1.877
110 2HB GLU 18 HB1 GLU 18 55.625 11.669 0.684
111 1HG GLU 18 HG2 GLU 18 54.751 13.808 0.593
112 2HG GLU 18 HG1 GLU 18 53.127 13.276 1.023
113 H LYS 19 HN LYS 19 55.723 10.466 -1.587
114 HA LYS 19 HA LYS 19 54.897 11.654 -4.092
115 1HB LYS 19 HB2 LYS 19 55.322 13.670 -2.667
116 2HB LYS 19 HB1 LYS 19 56.983 13.124 -2.443
117 1HG LYS 19 HG2 LYS 19 57.614 13.785 -4.523
118 2HG LYS 19 HG1 LYS 19 56.106 13.237 -5.259
119 1HD LYS 19 HD2 LYS 19 56.349 15.733 -3.558
120 2HD LYS 19 HD1 LYS 19 56.413 15.736 -5.321
121 1HE LYS 19 HE2 LYS 19 54.091 14.473 -3.844
122 2HE LYS 19 HE1 LYS 19 54.106 16.199 -4.258
123 1HZ LYS 19 HZ1 LYS 19 53.134 14.748 -6.014
124 2HZ LYS 19 HZ2 LYS 19 54.661 14.028 -6.208
125 3HZ LYS 19 HZ3 LYS 19 54.447 15.680 -6.543
126 H SER 20 HN SER 20 56.114 9.185 -3.043
127 HA SER 20 HA SER 20 58.930 9.188 -3.888
128 1HB SER 20 HB2 SER 20 58.945 7.127 -2.834
129 2HB SER 20 HB1 SER 20 57.530 7.830 -2.053
130 HG SER 20 HG SER 20 56.282 6.822 -3.749
131 H THR 21 HN THR 21 59.225 6.828 -5.232
132 HA THR 21 HA THR 21 57.418 6.924 -7.608
133 HB THR 21 HB THR 21 59.310 8.426 -8.048
134 HG1 THR 21 HG1 THR 21 58.572 6.557 -9.551
135 1HG2 THR 21 HG21 THR 21 61.615 7.152 -8.172
136 2HG2 THR 21 HG22 THR 21 60.860 6.092 -6.984
137 3HG2 THR 21 HG23 THR 21 61.052 7.811 -6.638
138 H LEU 22 HN LEU 22 56.960 4.839 -6.147
139 HA LEU 22 HA LEU 22 58.913 2.682 -6.364
140 1HB LEU 22 HB2 LEU 22 55.951 2.590 -5.717
141 2HB LEU 22 HB1 LEU 22 57.171 1.407 -5.252
142 HG LEU 22 HG LEU 22 56.686 4.162 -4.152
143 1HD1 LEU 22 HD1 LEU 22 57.240 2.828 -2.035
144 2HD1 LEU 22 HD1 LEU 22 57.219 1.392 -3.061
145 3HD1 LEU 22 HD1 LEU 22 55.760 2.369 -2.878
146 1HD2 LEU 22 HD2 LEU 22 59.085 4.081 -4.913
147 2HD2 LEU 22 HD2 LEU 22 59.313 2.659 -3.898
148 3HD2 LEU 22 HD2 LEU 22 58.914 4.211 -3.164
149 H THR 23 HN THR 23 57.955 0.505 -7.351
150 HA THR 23 HA THR 23 56.242 0.831 -9.706
151 HB THR 23 HB THR 23 59.248 0.453 -9.926
152 HG1 THR 23 HG1 THR 23 57.929 2.388 -11.369
153 1HG2 THR 23 HG21 THR 23 58.512 -0.896 -11.659
154 2HG2 THR 23 HG22 THR 23 58.528 0.673 -12.467
155 3HG2 THR 23 HG23 THR 23 57.010 0.005 -11.863
156 H ASN 24 HN ASN 24 55.162 -1.111 -9.731
157 HA ASN 24 HA ASN 24 54.744 -3.424 -9.493
158 1HB ASN 24 HB2 ASN 24 57.712 -3.347 -10.127
159 2HB ASN 24 HB1 ASN 24 56.746 -4.824 -10.150
160 1HD2 ASN 24 HD2 ASN 24 54.797 -4.774 -11.687
161 2HD2 ASN 24 HD2 ASN 24 54.941 -3.880 -13.122
162 H CYS 25 HN CYS 25 54.979 -2.077 -7.108
163 HA CYS 25 HA CYS 25 56.609 -3.882 -5.354
164 1HB CYS 25 HB2 CYS 25 56.902 -1.223 -5.696
165 2HB CYS 25 HB1 CYS 25 55.655 -1.193 -4.455
166 H TYR 26 HN TYR 26 55.646 -4.191 -3.169
167 HA TYR 26 HA TYR 26 52.674 -3.916 -3.032
168 1HB TYR 26 HB2 TYR 26 53.025 -6.139 -3.843
169 2HB TYR 26 HB1 TYR 26 54.407 -6.386 -2.773
170 HD1 TYR 26 HD1 TYR 26 50.794 -5.391 -2.483
171 HD2 TYR 26 HD2 TYR 26 54.041 -7.718 -0.909
172 HE1 TYR 26 HE1 TYR 26 49.286 -6.320 -0.750
173 HE2 TYR 26 HE2 TYR 26 52.534 -8.647 0.827
174 HH TYR 26 HH TYR 26 50.307 -8.923 1.370
175 H VAL 27 HN VAL 27 55.096 -2.651 -1.863
176 HA VAL 27 HA VAL 27 56.107 -2.943 0.541
177 HB VAL 27 HB VAL 27 54.188 -0.677 0.033
178 1HG1 VAL 27 HG11 VAL 27 56.468 -1.159 1.833
179 2HG1 VAL 27 HG12 VAL 27 55.088 -0.076 2.015
180 3HG1 VAL 27 HG13 VAL 27 56.465 0.410 1.027
181 1HG2 VAL 27 HG21 VAL 27 56.564 -1.537 -1.473
182 2HG2 VAL 27 HG22 VAL 27 56.630 0.146 -0.950
183 3HG2 VAL 27 HG23 VAL 27 55.279 -0.417 -1.942
184 H ASP 28 HN ASP 28 55.576 -3.174 2.722
185 HA ASP 28 HA ASP 28 52.718 -3.101 3.552
186 1HB ASP 28 HB2 ASP 28 53.358 -5.421 2.787
187 2HB ASP 28 HB1 ASP 28 54.570 -5.448 4.068
188 H LYS 29 HN LYS 29 52.494 -2.608 5.789
189 HA LYS 29 HA LYS 29 53.223 -1.390 7.715
190 1HB LYS 29 HB2 LYS 29 54.781 -3.982 7.569
191 2HB LYS 29 HB1 LYS 29 54.796 -2.951 9.000
192 1HG LYS 29 HG2 LYS 29 52.592 -3.397 9.518
193 2HG LYS 29 HG1 LYS 29 52.140 -3.665 7.832
194 1HD LYS 29 HD2 LYS 29 52.113 -5.798 9.025
195 2HD LYS 29 HD1 LYS 29 53.437 -5.791 7.861
196 1HE LYS 29 HE2 LYS 29 55.010 -5.127 9.685
197 2HE LYS 29 HE1 LYS 29 53.669 -5.263 10.842
198 1HZ LYS 29 HZ1 LYS 29 54.857 -7.352 10.718
199 2HZ LYS 29 HZ2 LYS 29 54.645 -7.409 9.033
200 3HZ LYS 29 HZ3 LYS 29 53.301 -7.538 10.065
201 H SER 30 HN SER 30 54.568 -0.399 5.381
202 HA SER 30 HA SER 30 57.238 0.246 6.575
203 1HB SER 30 HB2 SER 30 56.500 -0.459 3.721
204 2HB SER 30 HB1 SER 30 58.075 0.170 4.197
205 HG SER 30 HG SER 30 57.119 -2.333 4.360
206 H GLU 31 HN GLU 31 57.996 2.367 6.127
207 HA GLU 31 HA GLU 31 55.940 4.236 4.990
208 1HB GLU 31 HB2 GLU 31 57.671 4.221 7.413
209 2HB GLU 31 HB1 GLU 31 57.480 5.779 6.605
210 1HG GLU 31 HG2 GLU 31 55.093 5.693 6.809
211 2HG GLU 31 HG1 GLU 31 55.135 4.006 7.320
212 H VAL 32 HN VAL 32 56.766 4.416 2.880
213 HA VAL 32 HA VAL 32 59.668 4.970 2.520
214 HB VAL 32 HB VAL 32 57.443 4.506 0.514
215 1HG1 VAL 32 HG11 VAL 32 59.296 3.887 -0.973
216 2HG1 VAL 32 HG12 VAL 32 60.457 4.241 0.307
217 3HG1 VAL 32 HG13 VAL 32 59.493 5.541 -0.398
218 1HG2 VAL 32 HG21 VAL 32 57.650 2.251 0.811
219 2HG2 VAL 32 HG22 VAL 32 58.255 2.701 2.406
220 3HG2 VAL 32 HG23 VAL 32 59.389 2.353 1.099
221 H TYR 33 HN TYR 33 60.247 6.786 1.004
222 HA TYR 33 HA TYR 33 58.210 8.948 0.789
223 1HB TYR 33 HB2 TYR 33 60.755 8.964 2.398
224 2HB TYR 33 HB1 TYR 33 60.054 10.469 1.807
225 HD1 TYR 33 HD1 TYR 33 59.801 7.795 4.256
226 HD2 TYR 33 HD2 TYR 33 57.701 11.081 2.456
227 HE1 TYR 33 HE1 TYR 33 58.188 7.799 6.143
228 HE2 TYR 33 HE2 TYR 33 56.091 11.084 4.340
229 HH TYR 33 HH TYR 33 55.428 8.845 6.202
230 H GLY 34 HN GLY 34 61.085 7.409 -0.414
231 1HA GLY 34 HA2 GLY 34 60.991 9.030 -2.835
232 2HA GLY 34 HA1 GLY 34 62.426 9.343 -1.859
233 H THR 35 HN THR 35 60.977 6.174 -1.875
234 HA THR 35 HA THR 35 63.468 4.993 -2.872
235 HB THR 35 HB THR 35 60.763 3.915 -2.035
236 HG1 THR 35 HG1 THR 35 62.394 3.137 -0.337
237 1HG2 THR 35 HG21 THR 35 61.949 1.720 -1.920
238 2HG2 THR 35 HG22 THR 35 63.327 2.471 -2.724
239 3HG2 THR 35 HG23 THR 35 61.782 2.337 -3.566
240 H THR 36 HN THR 36 63.297 3.270 -4.626
241 HA THR 36 HA THR 36 61.341 4.041 -6.765
242 HB THR 36 HB THR 36 64.274 3.315 -7.086
243 HG1 THR 36 HG1 THR 36 64.079 5.328 -6.128
244 1HG2 THR 36 HG21 THR 36 62.069 3.466 -8.922
245 2HG2 THR 36 HG22 THR 36 63.756 3.078 -9.261
246 3HG2 THR 36 HG23 THR 36 63.212 4.756 -9.295
247 H CYS 37 HN CYS 37 60.696 1.941 -5.130
248 HA CYS 37 HA CYS 37 61.689 -0.613 -5.473
249 1HB CYS 37 HB2 CYS 37 59.608 0.345 -4.235
250 2HB CYS 37 HB1 CYS 37 58.741 -0.005 -5.728
251 H THR 38 HN THR 38 62.521 -1.235 -7.471
252 HA THR 38 HA THR 38 60.874 -0.857 -9.916
253 HB THR 38 HB THR 38 63.342 -0.298 -9.728
254 HG1 THR 38 HG1 THR 38 63.831 -1.431 -11.725
255 1HG2 THR 38 HG21 THR 38 63.602 -3.317 -9.670
256 2HG2 THR 38 HG22 THR 38 63.950 -2.241 -8.317
257 3HG2 THR 38 HG23 THR 38 64.932 -2.164 -9.780
258 H GLY 39 HN GLY 39 59.998 -2.784 -7.872
259 1HA GLY 39 HA2 GLY 39 58.804 -4.836 -8.721
260 2HA GLY 39 HA1 GLY 39 60.350 -5.321 -9.418
261 H SER 40 HN SER 40 60.289 -3.765 -6.310
262 HA SER 40 HA SER 40 60.978 -6.390 -5.019
263 1HB SER 40 HB2 SER 40 62.848 -5.289 -4.382
264 2HB SER 40 HB1 SER 40 62.279 -3.837 -5.198
265 HG SER 40 HG SER 40 61.456 -3.106 -3.351
266 H ARG 41 HN ARG 41 60.729 -5.637 -2.355
267 HA ARG 41 HA ARG 41 58.210 -4.215 -1.899
268 1HB ARG 41 HB2 ARG 41 57.006 -6.259 -1.125
269 2HB ARG 41 HB1 ARG 41 57.409 -6.327 -2.840
270 1HG ARG 41 HG2 ARG 41 58.643 -8.183 -2.530
271 2HG ARG 41 HG1 ARG 41 59.590 -7.389 -1.269
272 1HD ARG 41 HD2 ARG 41 57.904 -7.948 0.415
273 2HD ARG 41 HD1 ARG 41 56.853 -8.641 -0.834
274 HE ARG 41 HE ARG 41 59.341 -9.852 0.187
275 1HH1 ARG 41 HH2 ARG 41 56.883 -11.452 -0.157
276 2HH1 ARG 41 HH2 ARG 41 57.163 -12.281 -1.651
277 1HH2 ARG 41 HH1 ARG 41 59.728 -10.166 -2.645
278 2HH2 ARG 41 HH1 ARG 41 58.782 -11.556 -3.061
279 H PHE 42 HN PHE 42 57.600 -4.272 0.441
280 HA PHE 42 HA PHE 42 59.949 -4.871 2.227
281 1HB PHE 42 HB2 PHE 42 57.876 -2.680 2.550
282 2HB PHE 42 HB1 PHE 42 59.416 -2.834 3.393
283 HD1 PHE 42 HD1 PHE 42 61.103 -3.684 1.000
284 HD2 PHE 42 HD2 PHE 42 58.198 -0.560 1.506
285 HE1 PHE 42 HE1 PHE 42 62.212 -2.363 -0.782
286 HE2 PHE 42 HE2 PHE 42 59.307 0.758 -0.279
287 HZ PHE 42 HZ PHE 42 61.312 -0.143 -1.417
288 H ASP 43 HN ASP 43 58.946 -4.737 4.667
289 HA ASP 43 HA ASP 43 56.224 -5.761 4.953
290 1HB ASP 43 HB2 ASP 43 58.085 -7.593 4.140
291 2HB ASP 43 HB1 ASP 43 58.215 -7.743 5.894
292 H GLY 44 HN GLY 44 57.277 -3.582 6.206
293 1HA GLY 44 HA2 GLY 44 56.818 -3.153 8.638
294 2HA GLY 44 HA1 GLY 44 57.815 -4.567 8.979
295 H VAL 45 HN VAL 45 58.088 -1.433 7.218
296 HA VAL 45 HA VAL 45 60.753 -1.104 8.527
297 HB VAL 45 HB VAL 45 61.867 -0.889 6.453
298 1HG1 VAL 45 HG11 VAL 45 61.330 -2.908 5.219
299 2HG1 VAL 45 HG12 VAL 45 59.703 -2.932 5.900
300 3HG1 VAL 45 HG13 VAL 45 61.098 -3.225 6.939
301 1HG2 VAL 45 HG21 VAL 45 59.870 -1.103 4.453
302 2HG2 VAL 45 HG22 VAL 45 60.886 0.297 4.807
303 3HG2 VAL 45 HG23 VAL 45 59.312 0.132 5.581
304 H THR 46 HN THR 46 61.535 1.124 7.060
305 HA THR 46 HA THR 46 59.459 3.175 6.956
306 HB THR 46 HB THR 46 61.520 3.154 9.188
307 HG1 THR 46 HG1 THR 46 59.426 3.242 10.392
308 1HG2 THR 46 HG21 THR 46 60.670 5.369 7.966
309 2HG2 THR 46 HG22 THR 46 60.888 5.312 9.714
310 3HG2 THR 46 HG23 THR 46 59.279 5.121 9.019
311 H ILE 47 HN ILE 47 61.032 2.538 4.923
312 HA ILE 47 HA ILE 47 63.621 3.891 4.961
313 HB ILE 47 HB ILE 47 63.259 1.864 3.682
314 1HG1 ILE 47 HG12 ILE 47 63.364 4.156 1.700
315 2HG1 ILE 47 HG11 ILE 47 64.733 3.684 2.708
316 1HG2 ILE 47 HG21 ILE 47 60.939 3.426 2.578
317 2HG2 ILE 47 HG22 ILE 47 60.971 1.780 3.210
318 3HG2 ILE 47 HG23 ILE 47 61.662 2.127 1.625
319 1HD1 ILE 47 HD1 ILE 47 64.895 2.597 0.510
320 2HD1 ILE 47 HD1 ILE 47 63.289 1.900 0.725
321 3HD1 ILE 47 HD1 ILE 47 64.617 1.391 1.765
322 H THR 48 HN THR 48 64.123 5.574 3.316
323 HA THR 48 HA THR 48 61.804 7.363 2.690
324 HB THR 48 HB THR 48 63.434 9.236 3.297
325 HG1 THR 48 HG1 THR 48 65.242 8.648 4.443
326 1HG2 THR 48 HG21 THR 48 62.054 9.108 5.081
327 2HG2 THR 48 HG22 THR 48 63.379 8.254 5.870
328 3HG2 THR 48 HG23 THR 48 62.087 7.345 5.087
329 H THR 49 HN THR 49 63.963 9.246 1.561
330 HA THR 49 HA THR 49 63.936 8.357 -1.135
331 HB THR 49 HB THR 49 65.836 10.141 0.422
332 HG1 THR 49 HG1 THR 49 64.397 11.627 0.036
333 1HG2 THR 49 HG21 THR 49 66.642 10.967 -1.689
334 2HG2 THR 49 HG22 THR 49 65.467 9.996 -2.577
335 3HG2 THR 49 HG23 THR 49 66.792 9.210 -1.718
336 H SER 50 HN SER 50 64.797 6.356 -1.695
337 HA SER 50 HA SER 50 67.652 5.875 -1.169
338 1HB SER 50 HB2 SER 50 67.004 4.999 0.872
339 2HB SER 50 HB1 SER 50 65.392 4.586 0.295
340 HG SER 50 HG SER 50 67.752 3.146 0.219
341 H THR 51 HN THR 51 68.491 4.595 -2.796
342 HA THR 51 HA THR 51 66.578 3.474 -4.779
343 HB THR 51 HB THR 51 69.364 3.271 -5.470
344 HG1 THR 51 HG1 THR 51 69.379 5.786 -5.398
345 1HG2 THR 51 HG21 THR 51 68.688 4.481 -7.371
346 2HG2 THR 51 HG22 THR 51 67.428 5.338 -6.484
347 3HG2 THR 51 HG23 THR 51 67.222 3.631 -6.882
348 H SER 52 HN SER 52 66.173 1.291 -4.653
349 HA SER 52 HA SER 52 68.367 -0.505 -3.683
350 1HB SER 52 HB2 SER 52 67.131 -0.875 -1.828
351 2HB SER 52 HB1 SER 52 65.860 0.180 -2.436
352 HG SER 52 HG SER 52 65.004 -1.582 -3.553
353 H THR 53 HN THR 53 68.683 -2.195 -5.066
354 HA THR 53 HA THR 53 66.563 -2.765 -7.110
355 HB THR 53 HB THR 53 69.252 -3.911 -7.457
356 HG1 THR 53 HG1 THR 53 69.006 -1.102 -7.577
357 1HG2 THR 53 HG21 THR 53 68.227 -3.866 -9.481
358 2HG2 THR 53 HG22 THR 53 68.763 -2.187 -9.535
359 3HG2 THR 53 HG23 THR 53 67.128 -2.577 -9.000
360 H GLY 54 HN GLY 54 65.312 -4.382 -6.101
361 1HA GLY 54 HA2 GLY 54 64.808 -6.544 -5.332
362 2HA GLY 54 HA1 GLY 54 66.397 -7.036 -5.926
363 H SER 55 HN SER 55 64.582 -6.115 -3.123
364 HA SER 55 HA SER 55 66.627 -7.105 -1.321
365 1HB SER 55 HB2 SER 55 67.315 -4.955 -0.403
366 2HB SER 55 HB1 SER 55 67.562 -4.918 -2.148
367 HG SER 55 HG SER 55 65.612 -3.662 -0.567
368 H ARG 56 HN ARG 56 65.141 -8.096 0.048
369 HA ARG 56 HA ARG 56 62.564 -6.857 0.668
370 1HB ARG 56 HB2 ARG 56 62.454 -8.863 2.233
371 2HB ARG 56 HB1 ARG 56 62.728 -9.257 0.537
372 1HG ARG 56 HG2 ARG 56 64.944 -9.860 0.892
373 2HG ARG 56 HG1 ARG 56 65.105 -8.834 2.316
374 1HD ARG 56 HD2 ARG 56 65.011 -11.023 3.233
375 2HD ARG 56 HD1 ARG 56 63.335 -10.458 3.377
376 HE ARG 56 HE ARG 56 63.562 -11.581 0.807
377 1HH1 ARG 56 HH2 ARG 56 65.266 -13.242 2.970
378 2HH1 ARG 56 HH2 ARG 56 64.176 -14.574 3.172
379 1HH2 ARG 56 HH1 ARG 56 61.543 -13.011 1.539
380 2HH2 ARG 56 HH1 ARG 56 62.068 -14.442 2.361
381 H ILE 57 HN ILE 57 62.555 -5.096 2.002
382 HA ILE 57 HA ILE 57 64.660 -4.747 4.029
383 HB ILE 57 HB ILE 57 62.232 -3.058 3.327
384 1HG1 ILE 57 HG12 ILE 57 63.559 -3.429 1.327
385 2HG1 ILE 57 HG11 ILE 57 63.911 -1.806 1.924
386 1HG2 ILE 57 HG21 ILE 57 63.862 -1.254 4.174
387 2HG2 ILE 57 HG22 ILE 57 64.804 -2.584 4.847
388 3HG2 ILE 57 HG23 ILE 57 63.150 -2.307 5.395
389 1HD1 ILE 57 HD1 ILE 57 65.846 -2.934 3.226
390 2HD1 ILE 57 HD1 ILE 57 66.047 -2.708 1.487
391 3HD1 ILE 57 HD1 ILE 57 65.602 -4.289 2.130
392 H SER 58 HN SER 58 62.378 -6.848 4.202
393 HA SER 58 HA SER 58 60.462 -6.327 6.144
394 1HB SER 58 HB2 SER 58 62.258 -8.650 5.510
395 2HB SER 58 HB1 SER 58 61.167 -8.762 6.888
396 HG SER 58 HG SER 58 59.578 -9.004 5.544
397 H GLY 59 HN GLY 59 60.501 -6.654 8.520
398 1HA GLY 59 HA2 GLY 59 62.514 -7.111 10.272
399 2HA GLY 59 HA1 GLY 59 62.935 -5.492 9.712
400 HA PRO 60 HA PRO 60 59.545 -5.327 12.955
401 1HB PRO 60 HB2 PRO 60 61.010 -4.986 15.233
402 2HB PRO 60 HB1 PRO 60 60.535 -6.586 14.630
403 1HG PRO 60 HG2 PRO 60 63.159 -5.229 14.514
404 2HG PRO 60 HG1 PRO 60 62.781 -6.953 14.621
405 1HD PRO 60 HD2 PRO 60 63.553 -5.583 12.315
406 2HD PRO 60 HD1 PRO 60 62.805 -7.193 12.369
407 H GLY 61 HN GLY 61 60.557 -3.367 11.211
408 1HA GLY 61 HA2 GLY 61 59.940 -0.940 11.662
409 2HA GLY 61 HA1 GLY 61 61.061 -1.040 13.021
410 H CYS 62 HN CYS 62 62.001 -2.826 10.261
411 HA CYS 62 HA CYS 62 64.505 -1.876 9.811
412 1HB CYS 62 HB2 CYS 62 62.913 -3.571 8.562
413 2HB CYS 62 HB1 CYS 62 62.680 -2.219 7.455
414 H LYS 63 HN LYS 63 65.259 0.193 9.674
415 HA LYS 63 HA LYS 63 63.577 2.261 8.307
416 1HB LYS 63 HB2 LYS 63 64.154 2.648 10.659
417 2HB LYS 63 HB1 LYS 63 65.866 2.403 10.303
418 1HG LYS 63 HG2 LYS 63 65.812 4.363 8.786
419 2HG LYS 63 HG1 LYS 63 64.117 4.621 9.197
420 1HD LYS 63 HD2 LYS 63 64.761 4.859 11.590
421 2HD LYS 63 HD1 LYS 63 66.454 4.696 11.128
422 1HE LYS 63 HE2 LYS 63 64.935 6.743 9.609
423 2HE LYS 63 HE1 LYS 63 65.201 7.105 11.325
424 1HZ LYS 63 HZ1 LYS 63 67.368 7.391 10.979
425 2HZ LYS 63 HZ2 LYS 63 67.058 7.341 9.310
426 3HZ LYS 63 HZ3 LYS 63 67.508 5.926 10.134
427 H ILE 64 HN ILE 64 64.663 3.672 6.759
428 HA ILE 64 HA ILE 64 67.430 2.979 5.939
429 HB ILE 64 HB ILE 64 64.957 2.617 4.221
430 1HG1 ILE 64 HG12 ILE 64 65.573 0.720 5.731
431 2HG1 ILE 64 HG11 ILE 64 65.716 0.304 4.027
432 1HG2 ILE 64 HG21 ILE 64 66.264 2.488 2.316
433 2HG2 ILE 64 HG22 ILE 64 67.710 2.028 3.214
434 3HG2 ILE 64 HG23 ILE 64 67.170 3.706 3.217
435 1HD1 ILE 64 HD1 ILE 64 67.732 0.174 6.027
436 2HD1 ILE 64 HD1 ILE 64 68.195 1.444 4.895
437 3HD1 ILE 64 HD1 ILE 64 67.887 -0.190 4.306
438 H SER 65 HN SER 65 68.444 4.873 5.313
439 HA SER 65 HA SER 65 66.702 7.099 4.322
440 1HB SER 65 HB2 SER 65 67.868 8.613 5.792
441 2HB SER 65 HB1 SER 65 67.351 7.238 6.763
442 HG SER 65 HG SER 65 69.513 7.684 7.186
443 H THR 66 HN THR 66 67.379 7.610 2.305
444 HA THR 66 HA THR 66 68.814 7.758 0.421
445 HB THR 66 HB THR 66 70.895 8.728 2.346
446 HG1 THR 66 HG1 THR 66 68.269 9.696 2.057
447 1HG2 THR 66 HG21 THR 66 69.907 10.532 0.296
448 2HG2 THR 66 HG22 THR 66 70.362 8.970 -0.389
449 3HG2 THR 66 HG23 THR 66 71.539 9.905 0.539
450 H CYS 67 HN CYS 67 68.840 5.153 1.074
451 HA CYS 67 HA CYS 67 71.728 4.373 1.344
452 1HB CYS 67 HB2 CYS 67 69.155 3.353 2.362
453 2HB CYS 67 HB1 CYS 67 70.178 2.100 1.671
454 H ILE 68 HN ILE 68 72.344 4.386 -0.889
455 HA ILE 68 HA ILE 68 70.640 3.354 -2.988
456 HB ILE 68 HB ILE 68 73.583 3.982 -2.689
457 1HG1 ILE 68 HG12 ILE 68 72.934 5.744 -4.367
458 2HG1 ILE 68 HG11 ILE 68 71.262 5.204 -4.214
459 1HG2 ILE 68 HG21 ILE 68 73.407 3.743 -5.324
460 2HG2 ILE 68 HG22 ILE 68 72.124 2.605 -4.916
461 3HG2 ILE 68 HG23 ILE 68 73.761 2.336 -4.321
462 1HD1 ILE 68 HD1 ILE 68 72.915 6.052 -1.827
463 2HD1 ILE 68 HD1 ILE 68 71.166 5.829 -1.911
464 3HD1 ILE 68 HD1 ILE 68 71.924 7.187 -2.746
465 H ILE 69 HN ILE 69 69.979 1.291 -2.105
466 HA ILE 69 HA ILE 69 72.026 -0.772 -1.615
467 HB ILE 69 HB ILE 69 68.993 -0.843 -1.623
468 1HG1 ILE 69 HG12 ILE 69 70.585 -0.686 0.902
469 2HG1 ILE 69 HG11 ILE 69 70.456 0.788 -0.056
470 1HG2 ILE 69 HG21 ILE 69 69.173 -2.855 -0.378
471 2HG2 ILE 69 HG22 ILE 69 70.895 -2.608 -0.079
472 3HG2 ILE 69 HG23 ILE 69 70.332 -3.033 -1.697
473 1HD1 ILE 69 HD1 ILE 69 68.410 1.113 0.821
474 2HD1 ILE 69 HD1 ILE 69 68.458 -0.462 1.617
475 3HD1 ILE 69 HD1 ILE 69 67.869 -0.327 -0.042
476 H THR 70 HN THR 70 71.935 -2.841 -2.812
477 HA THR 70 HA THR 70 70.491 -2.895 -5.388
478 HB THR 70 HB THR 70 73.479 -2.566 -5.069
479 HG1 THR 70 HG1 THR 70 73.135 -0.790 -6.265
480 1HG2 THR 70 HG21 THR 70 73.318 -4.372 -6.600
481 2HG2 THR 70 HG22 THR 70 73.468 -2.935 -7.614
482 3HG2 THR 70 HG23 THR 70 71.888 -3.687 -7.380
483 H GLY 71 HN GLY 71 69.623 -4.924 -4.691
484 1HA GLY 71 HA2 GLY 71 69.801 -7.307 -4.922
485 2HA GLY 71 HA1 GLY 71 71.560 -7.154 -4.843
486 H GLY 72 HN GLY 72 69.356 -5.593 -2.600
487 1HA GLY 72 HA2 GLY 72 68.932 -6.020 -0.324
488 2HA GLY 72 HA1 GLY 72 69.653 -7.617 -0.535
489 H VAL 73 HN VAL 73 71.563 -4.999 -1.665
490 HA VAL 73 HA VAL 73 73.252 -5.086 0.825
491 HB VAL 73 HB VAL 73 75.171 -5.069 -0.693
492 1HG1 VAL 73 HG11 VAL 73 73.066 -7.065 -1.582
493 2HG1 VAL 73 HG12 VAL 73 74.179 -7.269 -0.227
494 3HG1 VAL 73 HG13 VAL 73 74.797 -7.212 -1.879
495 1HG2 VAL 73 HG21 VAL 73 74.258 -5.414 -3.241
496 2HG2 VAL 73 HG22 VAL 73 74.736 -3.850 -2.578
497 3HG2 VAL 73 HG23 VAL 73 73.034 -4.316 -2.602
498 HA PRO 74 HA PRO 74 72.710 -0.674 0.391
499 1HB PRO 74 HB2 PRO 74 74.143 0.037 2.599
500 2HB PRO 74 HB1 PRO 74 72.501 -0.616 2.692
501 1HG PRO 74 HG2 PRO 74 75.089 -1.937 3.264
502 2HG PRO 74 HG1 PRO 74 73.493 -2.215 3.977
503 1HD PRO 74 HD2 PRO 74 74.715 -3.805 2.040
504 2HD PRO 74 HD1 PRO 74 72.991 -3.823 2.466
505 H ALA 75 HN ALA 75 74.055 1.086 -0.298
506 HA ALA 75 HA ALA 75 76.656 0.291 -1.421
507 1HB ALA 75 HB1 ALA 75 74.884 2.735 -1.427
508 2HB ALA 75 HB2 ALA 75 75.269 1.662 -2.773
509 3HB ALA 75 HB3 ALA 75 76.487 2.774 -2.154
510 HA PRO 76 HA PRO 76 79.130 2.211 1.691
511 1HB PRO 76 HB2 PRO 76 81.153 3.360 0.246
512 2HB PRO 76 HB1 PRO 76 80.990 1.605 0.451
513 1HG PRO 76 HG2 PRO 76 80.436 3.285 -1.900
514 2HG PRO 76 HG1 PRO 76 80.865 1.572 -1.808
515 1HD PRO 76 HD2 PRO 76 78.300 2.657 -2.237
516 2HD PRO 76 HD1 PRO 76 78.696 0.957 -1.924
517 H SER 77 HN SER 77 77.139 3.986 -0.127
518 HA SER 77 HA SER 77 78.020 6.661 -0.154
519 1HB SER 77 HB2 SER 77 75.889 5.529 -1.058
520 2HB SER 77 HB1 SER 77 75.225 5.754 0.556
521 HG SER 77 HG SER 77 75.907 7.633 -1.400
522 H ALA 78 HN ALA 78 78.369 8.151 1.451
523 HA ALA 78 HA ALA 78 78.369 7.392 4.226
524 1HB ALA 78 HB1 ALA 78 79.775 9.128 2.992
525 2HB ALA 78 HB2 ALA 78 79.128 9.643 4.550
526 3HB ALA 78 HB3 ALA 78 78.361 10.182 3.057
527 H ALA 79 HN ALA 79 75.824 8.400 2.173
528 HA ALA 79 HA ALA 79 74.258 9.603 4.393
529 1HB ALA 79 HB1 ALA 79 73.795 10.834 2.515
530 2HB ALA 79 HB2 ALA 79 72.620 9.557 2.220
531 3HB ALA 79 HB3 ALA 79 74.193 9.504 1.425
532 H CYS 80 HN CYS 80 74.756 6.564 2.872
533 HA CYS 80 HA CYS 80 72.091 5.468 3.331
534 1HB CYS 80 HB2 CYS 80 73.574 4.605 1.593
535 2HB CYS 80 HB1 CYS 80 74.826 4.267 2.785
536 H LYS 81 HN LYS 81 71.347 4.869 5.353
537 HA LYS 81 HA LYS 81 73.353 4.530 7.524
538 1HB LYS 81 HB2 LYS 81 71.807 5.616 8.773
539 2HB LYS 81 HB1 LYS 81 70.960 5.930 7.263
540 1HG LYS 81 HG2 LYS 81 70.505 3.540 9.079
541 2HG LYS 81 HG1 LYS 81 69.446 4.944 8.940
542 1HD LYS 81 HD2 LYS 81 68.523 4.196 7.013
543 2HD LYS 81 HD1 LYS 81 70.082 3.689 6.356
544 1HE LYS 81 HE2 LYS 81 68.531 1.752 6.778
545 2HE LYS 81 HE1 LYS 81 70.013 1.658 7.740
546 1HZ LYS 81 HZ1 LYS 81 68.958 2.402 9.636
547 2HZ LYS 81 HZ2 LYS 81 67.752 1.428 8.938
548 3HZ LYS 81 HZ3 LYS 81 67.681 3.119 8.780
549 H ILE 82 HN ILE 82 72.635 2.836 9.204
550 HA ILE 82 HA ILE 82 71.194 0.468 8.261
551 HB ILE 82 HB ILE 82 74.166 0.767 8.113
552 1HG1 ILE 82 HG12 ILE 82 73.161 -1.276 6.444
553 2HG1 ILE 82 HG11 ILE 82 71.930 -0.013 6.449
554 1HG2 ILE 82 HG21 ILE 82 72.852 -1.447 9.510
555 2HG2 ILE 82 HG22 ILE 82 74.568 -1.064 9.386
556 3HG2 ILE 82 HG23 ILE 82 73.777 -1.995 8.116
557 1HD1 ILE 82 HD1 ILE 82 73.237 0.937 4.844
558 2HD1 ILE 82 HD1 ILE 82 74.669 0.035 5.343
559 3HD1 ILE 82 HD1 ILE 82 74.194 1.489 6.221
560 H SER 83 HN SER 83 70.127 1.116 10.284
561 HA SER 83 HA SER 83 71.641 0.244 12.723
562 1HB SER 83 HB2 SER 83 70.748 2.773 12.040
563 2HB SER 83 HB1 SER 83 69.457 2.177 13.076
564 HG SER 83 HG SER 83 72.103 2.773 13.651
565 H GLY 84 HN GLY 84 70.483 -1.900 12.089
566 1HA GLY 84 HA2 GLY 84 68.884 -3.273 13.344
567 2HA GLY 84 HA1 GLY 84 67.805 -1.883 13.401
568 H CYS 85 HN CYS 85 68.721 -1.563 10.381
569 HA CYS 85 HA CYS 85 66.389 -2.998 9.345
570 1HB CYS 85 HB2 CYS 85 67.839 -0.705 8.719
571 2HB CYS 85 HB1 CYS 85 68.249 -1.816 7.418
572 H THR 86 HN THR 86 67.251 -3.777 6.826
573 HA THR 86 HA THR 86 69.617 -5.256 6.541
574 HB THR 86 HB THR 86 69.080 -6.511 8.504
575 HG1 THR 86 HG1 THR 86 69.042 -7.661 6.118
576 1HG2 THR 86 HG21 THR 86 66.410 -7.406 7.541
577 2HG2 THR 86 HG22 THR 86 66.519 -5.756 8.152
578 3HG2 THR 86 HG23 THR 86 66.967 -7.109 9.189
579 H PHE 87 HN PHE 87 69.599 -6.389 4.577
580 HA PHE 87 HA PHE 87 66.955 -6.563 3.175
581 1HB PHE 87 HB2 PHE 87 69.340 -6.003 1.509
582 2HB PHE 87 HB1 PHE 87 67.723 -5.324 1.408
583 HD1 PHE 87 HD1 PHE 87 70.925 -4.335 1.726
584 HD2 PHE 87 HD2 PHE 87 67.230 -4.016 3.900
585 HE1 PHE 87 HE1 PHE 87 71.730 -2.259 2.808
586 HE2 PHE 87 HE2 PHE 87 68.047 -1.929 4.984
587 HZ PHE 87 HZ PHE 87 70.296 -1.056 4.433
588 H SER 88 HN SER 88 66.894 -8.241 1.531
589 HA SER 88 HA SER 88 69.157 -10.176 1.499
590 1HB SER 88 HB2 SER 88 67.194 -10.526 3.286
591 2HB SER 88 HB1 SER 88 66.368 -11.202 1.887
592 HG SER 88 HG SER 88 68.020 -12.459 3.386
593 H ALA 89 HN ALA 89 67.888 -8.269 -0.422
594 HA ALA 89 HA ALA 89 67.119 -8.263 -2.653
595 1HB ALA 89 HB1 ALA 89 68.263 -11.074 -2.511
596 2HB ALA 89 HB2 ALA 89 69.231 -9.617 -2.736
597 3HB ALA 89 HB3 ALA 89 68.063 -10.096 -3.966
598 H ASN 90 HN ASN 90 64.853 -8.283 -1.825
599 HA ASN 90 HA ASN 90 63.350 -10.609 -1.235
600 1HB ASN 90 HB2 ASN 90 61.519 -9.127 -1.323
601 2HB ASN 90 HB1 ASN 90 62.874 -8.038 -1.042
602 1HD2 ASN 90 HD2 ASN 90 63.979 -8.055 -3.702
603 2HD2 ASN 90 HD2 ASN 90 62.877 -7.277 -4.731
Start of MODEL 18
1 1H ASP 1 HT1 ASP 1 47.686 10.116 1.988
2 2H ASP 1 HT2 ASP 1 47.817 10.282 0.302
3 3H ASP 1 HT3 ASP 1 49.206 10.017 1.243
4 HA ASP 1 HA ASP 1 48.581 7.969 0.129
5 1HB ASP 1 HB2 ASP 1 48.642 6.643 2.163
6 2HB ASP 1 HB1 ASP 1 49.575 8.112 2.446
7 H GLY 2 HN GLY 2 46.903 6.029 0.892
8 1HA GLY 2 HA2 GLY 2 44.477 5.755 1.534
9 2HA GLY 2 HA1 GLY 2 44.172 7.209 0.581
10 H SER 3 HN SER 3 45.652 6.741 -1.709
11 HA SER 3 HA SER 3 44.475 4.187 -2.756
12 1HB SER 3 HB2 SER 3 44.838 6.679 -4.405
13 2HB SER 3 HB1 SER 3 43.688 5.367 -4.626
14 HG SER 3 HG SER 3 43.654 7.523 -2.831
15 H CYS 4 HN CYS 4 46.620 6.617 -4.282
16 HA CYS 4 HA CYS 4 48.690 6.302 -5.384
17 1HB CYS 4 HB2 CYS 4 49.004 4.452 -3.001
18 2HB CYS 4 HB1 CYS 4 50.314 5.211 -3.909
19 H THR 5 HN THR 5 50.315 3.901 -5.320
20 HA THR 5 HA THR 5 49.109 1.469 -5.993
21 HB THR 5 HB THR 5 48.928 3.596 -8.101
22 HG1 THR 5 HG1 THR 5 47.429 1.492 -7.065
23 1HG2 THR 5 HG21 THR 5 48.940 1.881 -9.904
24 2HG2 THR 5 HG22 THR 5 49.462 0.672 -8.731
25 3HG2 THR 5 HG23 THR 5 50.517 2.029 -9.129
26 H ASN 6 HN ASN 6 51.512 3.909 -6.707
27 HA ASN 6 HA ASN 6 53.848 3.730 -6.946
28 1HB ASN 6 HB2 ASN 6 53.657 0.810 -6.246
29 2HB ASN 6 HB1 ASN 6 54.787 2.029 -5.678
30 1HD2 ASN 6 HD2 ASN 6 53.541 3.914 -4.383
31 2HD2 ASN 6 HD2 ASN 6 52.431 3.351 -3.231
32 H THR 7 HN THR 7 52.613 3.730 -9.268
33 HA THR 7 HA THR 7 53.020 3.166 -11.534
34 HB THR 7 HB THR 7 54.660 0.828 -10.554
35 HG1 THR 7 HG1 THR 7 55.263 3.586 -10.470
36 1HG2 THR 7 HG21 THR 7 55.075 0.743 -12.766
37 2HG2 THR 7 HG22 THR 7 55.926 2.279 -12.603
38 3HG2 THR 7 HG23 THR 7 54.216 2.260 -13.035
39 H ASN 8 HN ASN 8 52.749 0.264 -9.447
40 HA ASN 8 HA ASN 8 50.129 -0.456 -10.290
41 1HB ASN 8 HB2 ASN 8 52.346 -1.064 -12.106
42 2HB ASN 8 HB1 ASN 8 51.404 -2.491 -11.676
43 1HD2 ASN 8 HD2 ASN 8 48.895 -2.100 -11.820
44 2HD2 ASN 8 HD2 ASN 8 48.360 -1.185 -13.144
45 H SER 9 HN SER 9 51.175 -0.563 -7.821
46 HA SER 9 HA SER 9 51.854 -3.445 -7.331
47 1HB SER 9 HB2 SER 9 52.407 -1.081 -5.530
48 2HB SER 9 HB1 SER 9 53.176 -2.665 -5.507
49 HG SER 9 HG SER 9 53.340 -0.723 -7.576
50 H GLN 10 HN GLN 10 51.430 -2.697 -4.383
51 HA GLN 10 HA GLN 10 48.430 -2.630 -4.402
52 1HB GLN 10 HB2 GLN 10 49.846 -4.275 -2.364
53 2HB GLN 10 HB1 GLN 10 48.318 -4.583 -3.181
54 1HG GLN 10 HG2 GLN 10 49.648 -5.082 -5.276
55 2HG GLN 10 HG1 GLN 10 51.109 -4.988 -4.291
56 1HE2 GLN 10 HE21 GLN 10 50.329 -7.444 -5.568
57 2HE2 GLN 10 HE22 GLN 10 49.902 -8.559 -4.361
58 H LEU 11 HN LEU 11 51.427 -2.116 -2.534
59 HA LEU 11 HA LEU 11 51.786 -0.822 -0.573
60 1HB LEU 11 HB2 LEU 11 51.238 0.849 -2.378
61 2HB LEU 11 HB1 LEU 11 49.550 0.776 -1.869
62 HG LEU 11 HG LEU 11 50.101 1.606 0.328
63 1HD1 LEU 11 HD1 LEU 11 52.970 1.339 -0.610
64 2HD1 LEU 11 HD1 LEU 11 52.200 0.467 0.716
65 3HD1 LEU 11 HD1 LEU 11 52.495 2.200 0.855
66 1HD2 LEU 11 HD2 LEU 11 49.951 3.605 -0.719
67 2HD2 LEU 11 HD2 LEU 11 50.880 3.033 -2.104
68 3HD2 LEU 11 HD2 LEU 11 51.713 3.638 -0.672
69 H SER 12 HN SER 12 50.834 -2.593 0.723
70 HA SER 12 HA SER 12 48.197 -3.101 1.368
71 1HB SER 12 HB2 SER 12 49.374 -4.398 2.789
72 2HB SER 12 HB1 SER 12 50.801 -3.398 2.546
73 HG SER 12 HG SER 12 50.437 -2.491 4.402
74 H ALA 13 HN ALA 13 46.617 -2.178 2.751
75 HA ALA 13 HA ALA 13 46.500 0.662 2.972
76 1HB ALA 13 HB1 ALA 13 45.101 -1.530 4.548
77 2HB ALA 13 HB2 ALA 13 44.566 -0.877 2.998
78 3HB ALA 13 HB3 ALA 13 44.558 0.144 4.436
79 H ASN 14 HN ASN 14 48.238 -1.639 4.815
80 HA ASN 14 HA ASN 14 48.326 -0.007 7.277
81 1HB ASN 14 HB2 ASN 14 48.186 -2.482 7.303
82 2HB ASN 14 HB1 ASN 14 49.712 -2.571 6.424
83 1HD2 ASN 14 HD2 ASN 14 50.029 -3.877 8.678
84 2HD2 ASN 14 HD2 ASN 14 50.749 -2.959 9.911
85 H SER 15 HN SER 15 49.859 0.095 4.299
86 HA SER 15 HA SER 15 52.554 0.778 5.336
87 1HB SER 15 HB2 SER 15 52.323 -0.566 3.295
88 2HB SER 15 HB1 SER 15 51.314 0.675 2.563
89 HG SER 15 HG SER 15 53.963 1.116 3.475
90 H LYS 16 HN LYS 16 53.131 2.801 3.382
91 HA LYS 16 HA LYS 16 51.244 5.013 4.080
92 1HB LYS 16 HB2 LYS 16 53.665 4.539 5.350
93 2HB LYS 16 HB1 LYS 16 54.082 5.752 4.135
94 1HG LYS 16 HG2 LYS 16 51.763 6.804 5.028
95 2HG LYS 16 HG1 LYS 16 52.284 5.974 6.495
96 1HD LYS 16 HD2 LYS 16 54.336 7.193 6.573
97 2HD LYS 16 HD1 LYS 16 54.121 7.797 4.928
98 1HE LYS 16 HE2 LYS 16 52.301 9.220 5.587
99 2HE LYS 16 HE1 LYS 16 52.193 8.446 7.179
100 1HZ LYS 16 HZ1 LYS 16 53.473 10.354 7.544
101 2HZ LYS 16 HZ2 LYS 16 54.368 10.147 6.115
102 3HZ LYS 16 HZ3 LYS 16 54.614 9.106 7.434
103 H CYS 17 HN CYS 17 51.480 6.874 2.618
104 HA CYS 17 HA CYS 17 53.097 6.413 0.164
105 1HB CYS 17 HB2 CYS 17 50.990 5.290 -0.246
106 2HB CYS 17 HB1 CYS 17 50.086 6.691 0.323
107 H GLU 18 HN GLU 18 54.142 8.339 -0.074
108 HA GLU 18 HA GLU 18 52.557 10.852 -0.005
109 1HB GLU 18 HB2 GLU 18 54.440 9.895 2.004
110 2HB GLU 18 HB1 GLU 18 54.948 11.447 1.335
111 1HG GLU 18 HG2 GLU 18 52.836 12.464 1.884
112 2HG GLU 18 HG1 GLU 18 52.137 10.903 2.316
113 H LYS 19 HN LYS 19 53.127 10.267 -2.389
114 HA LYS 19 HA LYS 19 54.389 10.823 -4.317
115 1HB LYS 19 HB2 LYS 19 54.706 12.832 -2.392
116 2HB LYS 19 HB1 LYS 19 56.354 12.460 -2.895
117 1HG LYS 19 HG2 LYS 19 55.062 12.496 -5.307
118 2HG LYS 19 HG1 LYS 19 54.161 13.724 -4.416
119 1HD LYS 19 HD2 LYS 19 56.416 14.714 -3.752
120 2HD LYS 19 HD1 LYS 19 57.139 13.640 -4.949
121 1HE LYS 19 HE2 LYS 19 55.108 14.753 -6.414
122 2HE LYS 19 HE1 LYS 19 55.566 16.105 -5.360
123 1HZ LYS 19 HZ1 LYS 19 57.303 14.527 -7.167
124 2HZ LYS 19 HZ2 LYS 19 57.941 15.452 -5.893
125 3HZ LYS 19 HZ3 LYS 19 57.069 16.204 -7.141
126 H SER 20 HN SER 20 55.699 9.184 -5.081
127 HA SER 20 HA SER 20 58.356 8.754 -3.856
128 1HB SER 20 HB2 SER 20 56.775 6.272 -4.115
129 2HB SER 20 HB1 SER 20 57.853 6.787 -2.821
130 HG SER 20 HG SER 20 55.592 6.698 -2.238
131 H THR 21 HN THR 21 59.500 6.882 -5.119
132 HA THR 21 HA THR 21 58.614 6.982 -7.990
133 HB THR 21 HB THR 21 61.443 6.680 -6.946
134 HG1 THR 21 HG1 THR 21 61.275 9.051 -7.796
135 1HG2 THR 21 HG21 THR 21 62.102 7.105 -9.153
136 2HG2 THR 21 HG22 THR 21 60.568 7.869 -9.566
137 3HG2 THR 21 HG23 THR 21 60.657 6.118 -9.373
138 H LEU 22 HN LEU 22 57.968 4.980 -5.863
139 HA LEU 22 HA LEU 22 59.537 2.614 -6.098
140 1HB LEU 22 HB2 LEU 22 56.533 2.838 -5.746
141 2HB LEU 22 HB1 LEU 22 57.577 1.555 -5.143
142 HG LEU 22 HG LEU 22 57.386 4.414 -4.193
143 1HD1 LEU 22 HD1 LEU 22 55.906 2.683 -3.199
144 2HD1 LEU 22 HD1 LEU 22 57.058 3.317 -2.025
145 3HD1 LEU 22 HD1 LEU 22 57.331 1.739 -2.762
146 1HD2 LEU 22 HD2 LEU 22 59.506 2.449 -3.303
147 2HD2 LEU 22 HD2 LEU 22 59.397 4.172 -2.945
148 3HD2 LEU 22 HD2 LEU 22 59.813 3.637 -4.570
149 H THR 23 HN THR 23 58.312 0.555 -7.099
150 HA THR 23 HA THR 23 56.893 1.023 -9.612
151 HB THR 23 HB THR 23 59.830 0.268 -9.557
152 HG1 THR 23 HG1 THR 23 58.298 2.407 -10.564
153 1HG2 THR 23 HG21 THR 23 59.716 -0.375 -11.803
154 2HG2 THR 23 HG22 THR 23 58.171 0.435 -12.056
155 3HG2 THR 23 HG23 THR 23 58.238 -1.070 -11.139
156 H ASN 24 HN ASN 24 55.563 -0.760 -9.706
157 HA ASN 24 HA ASN 24 54.793 -2.971 -9.278
158 1HB ASN 24 HB2 ASN 24 57.655 -3.134 -10.214
159 2HB ASN 24 HB1 ASN 24 56.766 -4.610 -9.834
160 1HD2 ASN 24 HD2 ASN 24 56.717 -5.254 -12.114
161 2HD2 ASN 24 HD2 ASN 24 55.714 -4.458 -13.228
162 H CYS 25 HN CYS 25 55.424 -1.594 -6.914
163 HA CYS 25 HA CYS 25 57.230 -3.260 -5.302
164 1HB CYS 25 HB2 CYS 25 56.637 -0.641 -5.310
165 2HB CYS 25 HB1 CYS 25 55.447 -1.175 -4.125
166 H TYR 26 HN TYR 26 55.683 -2.893 -2.886
167 HA TYR 26 HA TYR 26 53.094 -4.021 -2.847
168 1HB TYR 26 HB2 TYR 26 54.041 -5.973 -3.917
169 2HB TYR 26 HB1 TYR 26 55.432 -5.963 -2.836
170 HD1 TYR 26 HD1 TYR 26 52.141 -5.185 -1.444
171 HD2 TYR 26 HD2 TYR 26 54.952 -8.338 -2.234
172 HE1 TYR 26 HE1 TYR 26 50.940 -6.658 0.148
173 HE2 TYR 26 HE2 TYR 26 53.749 -9.808 -0.641
174 HH TYR 26 HH TYR 26 51.909 -8.936 1.629
175 H VAL 27 HN VAL 27 54.636 -2.088 -1.571
176 HA VAL 27 HA VAL 27 55.942 -2.642 0.812
177 HB VAL 27 HB VAL 27 53.931 -0.442 0.272
178 1HG1 VAL 27 HG11 VAL 27 55.566 0.851 1.709
179 2HG1 VAL 27 HG12 VAL 27 56.359 -0.686 2.069
180 3HG1 VAL 27 HG13 VAL 27 54.682 -0.421 2.557
181 1HG2 VAL 27 HG21 VAL 27 56.275 0.653 -0.437
182 2HG2 VAL 27 HG22 VAL 27 55.298 -0.253 -1.596
183 3HG2 VAL 27 HG23 VAL 27 56.667 -1.026 -0.804
184 H ASP 28 HN ASP 28 55.300 -2.891 2.971
185 HA ASP 28 HA ASP 28 52.450 -3.095 3.703
186 1HB ASP 28 HB2 ASP 28 54.112 -5.351 2.915
187 2HB ASP 28 HB1 ASP 28 53.568 -5.530 4.584
188 H LYS 29 HN LYS 29 52.300 -2.401 5.828
189 HA LYS 29 HA LYS 29 52.999 -1.737 7.993
190 1HB LYS 29 HB2 LYS 29 54.815 -4.096 7.408
191 2HB LYS 29 HB1 LYS 29 54.636 -3.363 9.001
192 1HG LYS 29 HG2 LYS 29 52.415 -4.070 9.219
193 2HG LYS 29 HG1 LYS 29 52.207 -4.276 7.479
194 1HD LYS 29 HD2 LYS 29 52.511 -6.489 8.007
195 2HD LYS 29 HD1 LYS 29 54.213 -6.039 7.901
196 1HE LYS 29 HE2 LYS 29 53.514 -5.324 10.507
197 2HE LYS 29 HE1 LYS 29 52.683 -6.871 10.246
198 1HZ LYS 29 HZ1 LYS 29 54.786 -7.713 9.268
199 2HZ LYS 29 HZ2 LYS 29 54.919 -7.335 10.920
200 3HZ LYS 29 HZ3 LYS 29 55.554 -6.279 9.750
201 H SER 30 HN SER 30 54.529 -0.846 5.401
202 HA SER 30 HA SER 30 56.976 0.147 6.832
203 1HB SER 30 HB2 SER 30 56.494 -0.609 3.934
204 2HB SER 30 HB1 SER 30 57.988 0.106 4.534
205 HG SER 30 HG SER 30 58.540 -1.805 5.185
206 H GLU 31 HN GLU 31 57.840 2.150 5.396
207 HA GLU 31 HA GLU 31 55.489 3.994 5.047
208 1HB GLU 31 HB2 GLU 31 57.696 4.068 6.770
209 2HB GLU 31 HB1 GLU 31 58.088 5.234 5.504
210 1HG GLU 31 HG2 GLU 31 56.028 6.433 5.866
211 2HG GLU 31 HG1 GLU 31 55.426 5.177 6.948
212 H VAL 32 HN VAL 32 58.930 4.182 4.134
213 HA VAL 32 HA VAL 32 59.947 4.524 2.027
214 HB VAL 32 HB VAL 32 57.249 3.779 0.877
215 1HG1 VAL 32 HG11 VAL 32 58.836 2.601 -0.761
216 2HG1 VAL 32 HG12 VAL 32 60.131 3.529 -0.004
217 3HG1 VAL 32 HG13 VAL 32 58.811 4.363 -0.823
218 1HG2 VAL 32 HG21 VAL 32 59.108 2.192 2.544
219 2HG2 VAL 32 HG22 VAL 32 58.638 1.422 1.028
220 3HG2 VAL 32 HG23 VAL 32 57.403 1.915 2.186
221 H TYR 33 HN TYR 33 60.213 6.384 0.773
222 HA TYR 33 HA TYR 33 57.876 8.215 0.473
223 1HB TYR 33 HB2 TYR 33 60.517 8.700 1.848
224 2HB TYR 33 HB1 TYR 33 59.585 10.044 1.182
225 HD1 TYR 33 HD1 TYR 33 57.654 10.874 2.296
226 HD2 TYR 33 HD2 TYR 33 59.405 7.148 3.519
227 HE1 TYR 33 HE1 TYR 33 56.156 10.819 4.271
228 HE2 TYR 33 HE2 TYR 33 57.909 7.093 5.493
229 HH TYR 33 HH TYR 33 56.650 8.910 6.899
230 H GLY 34 HN GLY 34 61.391 8.510 -0.132
231 1HA GLY 34 HA2 GLY 34 60.715 9.155 -2.967
232 2HA GLY 34 HA1 GLY 34 62.186 9.675 -2.141
233 H THR 35 HN THR 35 61.093 6.439 -1.613
234 HA THR 35 HA THR 35 63.566 5.301 -2.583
235 HB THR 35 HB THR 35 60.890 4.074 -1.853
236 HG1 THR 35 HG1 THR 35 63.263 4.505 -0.366
237 1HG2 THR 35 HG21 THR 35 63.605 2.937 -2.436
238 2HG2 THR 35 HG22 THR 35 62.024 2.368 -2.969
239 3HG2 THR 35 HG23 THR 35 62.533 2.122 -1.298
240 H THR 36 HN THR 36 63.737 3.687 -4.301
241 HA THR 36 HA THR 36 61.853 4.202 -6.578
242 HB THR 36 HB THR 36 64.764 3.343 -6.638
243 HG1 THR 36 HG1 THR 36 64.656 5.374 -5.733
244 1HG2 THR 36 HG21 THR 36 64.679 3.676 -8.933
245 2HG2 THR 36 HG22 THR 36 63.318 4.794 -8.824
246 3HG2 THR 36 HG23 THR 36 63.055 3.059 -8.633
247 H CYS 37 HN CYS 37 61.081 2.258 -4.783
248 HA CYS 37 HA CYS 37 61.918 -0.344 -4.811
249 1HB CYS 37 HB2 CYS 37 59.815 0.674 -3.838
250 2HB CYS 37 HB1 CYS 37 59.087 0.532 -5.430
251 H THR 38 HN THR 38 62.907 -1.274 -6.636
252 HA THR 38 HA THR 38 61.469 -1.113 -9.245
253 HB THR 38 HB THR 38 64.208 -2.203 -8.510
254 HG1 THR 38 HG1 THR 38 64.338 -0.001 -9.945
255 1HG2 THR 38 HG21 THR 38 64.472 -2.752 -10.692
256 2HG2 THR 38 HG22 THR 38 63.699 -1.267 -11.245
257 3HG2 THR 38 HG23 THR 38 62.713 -2.656 -10.788
258 H GLY 39 HN GLY 39 59.767 -2.625 -8.745
259 1HA GLY 39 HA2 GLY 39 58.799 -4.757 -8.707
260 2HA GLY 39 HA1 GLY 39 60.322 -5.354 -9.368
261 H SER 40 HN SER 40 59.871 -3.699 -6.254
262 HA SER 40 HA SER 40 60.582 -6.269 -4.872
263 1HB SER 40 HB2 SER 40 61.570 -3.655 -3.826
264 2HB SER 40 HB1 SER 40 62.350 -5.235 -3.807
265 HG SER 40 HG SER 40 63.274 -4.748 -5.624
266 H ARG 41 HN ARG 41 60.601 -4.842 -2.281
267 HA ARG 41 HA ARG 41 58.169 -3.413 -1.788
268 1HB ARG 41 HB2 ARG 41 56.707 -5.188 -1.064
269 2HB ARG 41 HB1 ARG 41 57.313 -5.659 -2.648
270 1HG ARG 41 HG2 ARG 41 59.104 -6.990 -1.505
271 2HG ARG 41 HG1 ARG 41 58.338 -6.613 0.038
272 1HD ARG 41 HD2 ARG 41 56.402 -7.873 -0.475
273 2HD ARG 41 HD1 ARG 41 56.764 -7.880 -2.212
274 HE ARG 41 HE ARG 41 58.961 -9.132 -1.238
275 1HH1 ARG 41 HH1 ARG 41 56.751 -10.729 -2.487
276 2HH1 ARG 41 HH1 ARG 41 56.360 -11.853 -1.227
277 1HH2 ARG 41 HH2 ARG 41 57.976 -10.042 1.251
278 2HH2 ARG 41 HH2 ARG 41 57.055 -11.464 0.889
279 H PHE 42 HN PHE 42 57.471 -3.952 0.687
280 HA PHE 42 HA PHE 42 59.948 -4.441 2.300
281 1HB PHE 42 HB2 PHE 42 57.874 -2.292 2.826
282 2HB PHE 42 HB1 PHE 42 59.425 -2.495 3.638
283 HD1 PHE 42 HD1 PHE 42 57.858 -1.755 0.356
284 HD2 PHE 42 HD2 PHE 42 61.405 -1.525 2.749
285 HE1 PHE 42 HE1 PHE 42 58.914 -0.308 -1.358
286 HE2 PHE 42 HE2 PHE 42 62.474 -0.086 1.036
287 HZ PHE 42 HZ PHE 42 61.218 0.521 -1.014
288 H ASP 43 HN ASP 43 58.895 -4.237 4.799
289 HA ASP 43 HA ASP 43 56.280 -5.434 5.120
290 1HB ASP 43 HB2 ASP 43 58.240 -7.152 4.212
291 2HB ASP 43 HB1 ASP 43 58.318 -7.394 5.959
292 H GLY 44 HN GLY 44 57.387 -3.248 6.352
293 1HA GLY 44 HA2 GLY 44 56.996 -2.808 8.776
294 2HA GLY 44 HA1 GLY 44 57.932 -4.263 9.110
295 H VAL 45 HN VAL 45 58.425 -1.287 7.145
296 HA VAL 45 HA VAL 45 61.000 -0.912 8.611
297 HB VAL 45 HB VAL 45 62.228 -0.780 6.588
298 1HG1 VAL 45 HG11 VAL 45 61.535 -2.844 5.300
299 2HG1 VAL 45 HG12 VAL 45 60.113 -2.928 6.337
300 3HG1 VAL 45 HG13 VAL 45 61.727 -3.085 7.037
301 1HG2 VAL 45 HG21 VAL 45 60.606 -1.060 4.406
302 2HG2 VAL 45 HG22 VAL 45 61.184 0.493 5.011
303 3HG2 VAL 45 HG23 VAL 45 59.581 -0.089 5.465
304 H THR 46 HN THR 46 61.866 1.270 7.038
305 HA THR 46 HA THR 46 59.729 3.279 6.907
306 HB THR 46 HB THR 46 61.893 3.367 9.030
307 HG1 THR 46 HG1 THR 46 60.365 2.780 10.407
308 1HG2 THR 46 HG21 THR 46 59.888 5.245 9.573
309 2HG2 THR 46 HG22 THR 46 60.195 5.398 7.843
310 3HG2 THR 46 HG23 THR 46 61.518 5.584 8.992
311 H ILE 47 HN ILE 47 61.415 2.482 4.884
312 HA ILE 47 HA ILE 47 63.840 4.119 4.766
313 HB ILE 47 HB ILE 47 63.759 1.973 3.671
314 1HG1 ILE 47 HG12 ILE 47 63.426 3.972 1.433
315 2HG1 ILE 47 HG11 ILE 47 64.846 3.976 2.478
316 1HG2 ILE 47 HG21 ILE 47 61.078 2.815 3.047
317 2HG2 ILE 47 HG22 ILE 47 61.787 1.208 2.904
318 3HG2 ILE 47 HG23 ILE 47 61.902 2.346 1.561
319 1HD1 ILE 47 HD1 ILE 47 63.951 1.427 1.156
320 2HD1 ILE 47 HD1 ILE 47 65.555 1.868 1.739
321 3HD1 ILE 47 HD1 ILE 47 64.924 2.597 0.262
322 H THR 48 HN THR 48 64.145 5.728 2.972
323 HA THR 48 HA THR 48 61.611 7.117 2.182
324 HB THR 48 HB THR 48 62.789 9.245 2.824
325 HG1 THR 48 HG1 THR 48 64.840 7.585 2.984
326 1HG2 THR 48 HG21 THR 48 62.266 7.082 4.856
327 2HG2 THR 48 HG22 THR 48 61.252 8.464 4.435
328 3HG2 THR 48 HG23 THR 48 62.740 8.706 5.352
329 H THR 49 HN THR 49 64.145 9.118 1.445
330 HA THR 49 HA THR 49 64.041 8.540 -1.382
331 HB THR 49 HB THR 49 65.947 10.212 0.290
332 HG1 THR 49 HG1 THR 49 63.587 10.907 -1.118
333 1HG2 THR 49 HG21 THR 49 66.714 9.653 -2.036
334 2HG2 THR 49 HG22 THR 49 66.459 11.377 -1.763
335 3HG2 THR 49 HG23 THR 49 65.257 10.438 -2.648
336 H SER 50 HN SER 50 64.705 6.127 -0.929
337 HA SER 50 HA SER 50 67.699 5.932 -1.006
338 1HB SER 50 HB2 SER 50 67.188 4.866 0.977
339 2HB SER 50 HB1 SER 50 65.549 4.487 0.462
340 HG SER 50 HG SER 50 67.291 2.747 0.597
341 H THR 51 HN THR 51 68.565 4.563 -2.608
342 HA THR 51 HA THR 51 66.612 3.620 -4.670
343 HB THR 51 HB THR 51 69.426 3.526 -5.379
344 HG1 THR 51 HG1 THR 51 69.417 5.988 -5.255
345 1HG2 THR 51 HG21 THR 51 68.694 4.790 -7.246
346 2HG2 THR 51 HG22 THR 51 67.336 5.472 -6.351
347 3HG2 THR 51 HG23 THR 51 67.315 3.774 -6.826
348 H SER 52 HN SER 52 66.278 1.430 -4.795
349 HA SER 52 HA SER 52 68.478 -0.400 -3.913
350 1HB SER 52 HB2 SER 52 67.151 -1.287 -2.282
351 2HB SER 52 HB1 SER 52 66.220 0.200 -2.446
352 HG SER 52 HG SER 52 64.697 -0.866 -3.469
353 H THR 53 HN THR 53 68.756 -2.146 -5.330
354 HA THR 53 HA THR 53 66.686 -2.414 -7.491
355 HB THR 53 HB THR 53 69.308 -3.647 -7.935
356 HG1 THR 53 HG1 THR 53 69.362 -0.857 -7.935
357 1HG2 THR 53 HG21 THR 53 67.234 -2.147 -9.328
358 2HG2 THR 53 HG22 THR 53 68.421 -3.280 -9.977
359 3HG2 THR 53 HG23 THR 53 68.849 -1.584 -9.762
360 H GLY 54 HN GLY 54 65.390 -3.917 -6.275
361 1HA GLY 54 HA2 GLY 54 64.736 -6.144 -5.831
362 2HA GLY 54 HA1 GLY 54 66.295 -6.682 -6.465
363 H SER 55 HN SER 55 64.582 -5.649 -3.598
364 HA SER 55 HA SER 55 66.562 -6.967 -1.889
365 1HB SER 55 HB2 SER 55 67.112 -4.826 -0.697
366 2HB SER 55 HB1 SER 55 67.680 -4.851 -2.365
367 HG SER 55 HG SER 55 65.707 -3.738 -2.901
368 H ARG 56 HN ARG 56 65.432 -7.755 -0.143
369 HA ARG 56 HA ARG 56 62.697 -6.712 0.360
370 1HB ARG 56 HB2 ARG 56 63.314 -9.168 0.098
371 2HB ARG 56 HB1 ARG 56 64.165 -9.036 1.636
372 1HG ARG 56 HG2 ARG 56 62.239 -8.997 2.844
373 2HG ARG 56 HG1 ARG 56 61.425 -7.951 1.682
374 1HD ARG 56 HD2 ARG 56 60.330 -10.155 1.720
375 2HD ARG 56 HD1 ARG 56 61.155 -9.939 0.163
376 HE ARG 56 HE ARG 56 62.895 -11.441 0.913
377 1HH1 ARG 56 HH1 ARG 56 62.976 -10.684 3.798
378 2HH1 ARG 56 HH1 ARG 56 62.294 -12.081 4.565
379 1HH2 ARG 56 HH2 ARG 56 60.879 -13.318 1.650
380 2HH2 ARG 56 HH2 ARG 56 61.105 -13.570 3.349
381 H ILE 57 HN ILE 57 62.799 -4.903 1.665
382 HA ILE 57 HA ILE 57 64.843 -4.610 3.743
383 HB ILE 57 HB ILE 57 62.345 -2.990 3.216
384 1HG1 ILE 57 HG12 ILE 57 63.390 -3.092 1.090
385 2HG1 ILE 57 HG11 ILE 57 63.997 -1.597 1.801
386 1HG2 ILE 57 HG21 ILE 57 64.949 -2.548 4.645
387 2HG2 ILE 57 HG22 ILE 57 63.311 -2.167 5.178
388 3HG2 ILE 57 HG23 ILE 57 64.093 -1.173 3.948
389 1HD1 ILE 57 HD1 ILE 57 65.463 -4.247 1.953
390 2HD1 ILE 57 HD1 ILE 57 66.077 -2.665 2.435
391 3HD1 ILE 57 HD1 ILE 57 65.783 -3.017 0.731
392 H SER 58 HN SER 58 62.412 -6.681 3.739
393 HA SER 58 HA SER 58 60.532 -6.405 5.673
394 1HB SER 58 HB2 SER 58 62.387 -8.524 4.809
395 2HB SER 58 HB1 SER 58 61.695 -8.792 6.406
396 HG SER 58 HG SER 58 60.249 -8.175 4.032
397 H GLY 59 HN GLY 59 60.417 -6.329 7.965
398 1HA GLY 59 HA2 GLY 59 62.515 -6.776 9.793
399 2HA GLY 59 HA1 GLY 59 62.613 -5.080 9.329
400 HA PRO 60 HA PRO 60 59.100 -5.767 12.369
401 1HB PRO 60 HB2 PRO 60 60.346 -5.891 14.797
402 2HB PRO 60 HB1 PRO 60 59.994 -7.333 13.828
403 1HG PRO 60 HG2 PRO 60 62.557 -5.968 14.299
404 2HG PRO 60 HG1 PRO 60 62.233 -7.658 13.897
405 1HD PRO 60 HD2 PRO 60 63.128 -5.634 12.140
406 2HD PRO 60 HD1 PRO 60 62.593 -7.271 11.702
407 H GLY 61 HN GLY 61 60.568 -3.487 11.208
408 1HA GLY 61 HA2 GLY 61 59.700 -1.197 12.002
409 2HA GLY 61 HA1 GLY 61 60.588 -1.562 13.482
410 H CYS 62 HN CYS 62 61.728 -2.441 10.255
411 HA CYS 62 HA CYS 62 64.358 -1.539 10.557
412 1HB CYS 62 HB2 CYS 62 63.831 -2.899 8.692
413 2HB CYS 62 HB1 CYS 62 62.483 -1.883 8.222
414 H LYS 63 HN LYS 63 65.388 0.380 9.424
415 HA LYS 63 HA LYS 63 63.660 2.784 9.144
416 1HB LYS 63 HB2 LYS 63 64.204 2.804 11.484
417 2HB LYS 63 HB1 LYS 63 65.873 2.331 11.165
418 1HG LYS 63 HG2 LYS 63 65.977 4.558 9.790
419 2HG LYS 63 HG1 LYS 63 64.555 5.001 10.737
420 1HD LYS 63 HD2 LYS 63 65.736 4.838 12.786
421 2HD LYS 63 HD1 LYS 63 67.061 3.943 12.044
422 1HE LYS 63 HE2 LYS 63 67.737 6.285 12.441
423 2HE LYS 63 HE1 LYS 63 67.635 5.977 10.697
424 1HZ LYS 63 HZ1 LYS 63 65.075 6.625 11.489
425 2HZ LYS 63 HZ2 LYS 63 66.143 7.608 10.603
426 3HZ LYS 63 HZ3 LYS 63 66.069 7.738 12.294
427 H ILE 64 HN ILE 64 64.332 3.241 6.997
428 HA ILE 64 HA ILE 64 67.292 3.408 6.591
429 HB ILE 64 HB ILE 64 65.281 2.948 4.397
430 1HG1 ILE 64 HG12 ILE 64 66.373 0.948 6.385
431 2HG1 ILE 64 HG11 ILE 64 64.720 1.141 5.815
432 1HG2 ILE 64 HG21 ILE 64 67.534 3.503 3.699
433 2HG2 ILE 64 HG22 ILE 64 67.277 1.786 3.395
434 3HG2 ILE 64 HG23 ILE 64 68.218 2.302 4.793
435 1HD1 ILE 64 HD1 ILE 64 65.343 0.321 3.602
436 2HD1 ILE 64 HD1 ILE 64 65.842 -0.852 4.820
437 3HD1 ILE 64 HD1 ILE 64 67.035 0.221 4.087
438 H SER 65 HN SER 65 68.014 5.071 5.093
439 HA SER 65 HA SER 65 66.163 7.153 4.201
440 1HB SER 65 HB2 SER 65 66.572 8.712 5.855
441 2HB SER 65 HB1 SER 65 66.839 7.260 6.815
442 HG SER 65 HG SER 65 68.894 7.716 6.899
443 H THR 66 HN THR 66 67.099 7.213 2.163
444 HA THR 66 HA THR 66 68.715 7.774 0.529
445 HB THR 66 HB THR 66 70.547 8.551 2.789
446 HG1 THR 66 HG1 THR 66 68.067 9.617 2.093
447 1HG2 THR 66 HG21 THR 66 70.343 10.513 0.780
448 2HG2 THR 66 HG22 THR 66 70.340 8.962 -0.066
449 3HG2 THR 66 HG23 THR 66 71.667 9.374 1.022
450 H CYS 67 HN CYS 67 68.825 5.355 0.337
451 HA CYS 67 HA CYS 67 71.588 4.397 0.979
452 1HB CYS 67 HB2 CYS 67 68.968 2.921 1.447
453 2HB CYS 67 HB1 CYS 67 70.571 2.232 1.670
454 H ILE 68 HN ILE 68 72.470 3.760 -0.987
455 HA ILE 68 HA ILE 68 70.631 3.075 -3.215
456 HB ILE 68 HB ILE 68 73.604 3.627 -2.986
457 1HG1 ILE 68 HG12 ILE 68 72.958 5.567 -4.446
458 2HG1 ILE 68 HG11 ILE 68 71.269 5.083 -4.278
459 1HG2 ILE 68 HG21 ILE 68 73.818 2.402 -4.880
460 2HG2 ILE 68 HG22 ILE 68 72.889 3.669 -5.681
461 3HG2 ILE 68 HG23 ILE 68 72.071 2.238 -5.052
462 1HD1 ILE 68 HD1 ILE 68 72.398 6.876 -2.638
463 2HD1 ILE 68 HD1 ILE 68 72.846 5.407 -1.770
464 3HD1 ILE 68 HD1 ILE 68 71.147 5.761 -2.085
465 H ILE 69 HN ILE 69 69.982 1.017 -2.287
466 HA ILE 69 HA ILE 69 71.992 -1.087 -1.867
467 HB ILE 69 HB ILE 69 68.958 -1.021 -1.849
468 1HG1 ILE 69 HG12 ILE 69 70.726 -1.098 0.578
469 2HG1 ILE 69 HG11 ILE 69 70.451 0.441 -0.237
470 1HG2 ILE 69 HG21 ILE 69 69.186 -3.069 -0.458
471 2HG2 ILE 69 HG22 ILE 69 70.923 -3.056 -0.757
472 3HG2 ILE 69 HG23 ILE 69 69.800 -3.308 -2.094
473 1HD1 ILE 69 HD1 ILE 69 67.925 -0.251 -0.124
474 2HD1 ILE 69 HD1 ILE 69 68.706 0.397 1.317
475 3HD1 ILE 69 HD1 ILE 69 68.468 -1.342 1.151
476 H THR 70 HN THR 70 71.804 -3.184 -3.062
477 HA THR 70 HA THR 70 70.413 -3.167 -5.668
478 HB THR 70 HB THR 70 73.422 -3.029 -5.337
479 HG1 THR 70 HG1 THR 70 71.469 -1.433 -6.619
480 1HG2 THR 70 HG21 THR 70 73.733 -3.927 -7.395
481 2HG2 THR 70 HG22 THR 70 72.311 -3.126 -8.062
482 3HG2 THR 70 HG23 THR 70 72.135 -4.632 -7.162
483 H GLY 71 HN GLY 71 69.452 -5.167 -4.974
484 1HA GLY 71 HA2 GLY 71 69.496 -7.550 -5.218
485 2HA GLY 71 HA1 GLY 71 71.261 -7.490 -5.212
486 H GLY 72 HN GLY 72 69.323 -5.842 -2.802
487 1HA GLY 72 HA2 GLY 72 68.921 -6.397 -0.534
488 2HA GLY 72 HA1 GLY 72 69.637 -7.983 -0.827
489 H VAL 73 HN VAL 73 71.504 -5.375 -1.974
490 HA VAL 73 HA VAL 73 73.266 -5.483 0.464
491 HB VAL 73 HB VAL 73 75.137 -5.585 -1.096
492 1HG1 VAL 73 HG11 VAL 73 74.843 -7.787 -1.758
493 2HG1 VAL 73 HG12 VAL 73 73.215 -7.496 -2.367
494 3HG1 VAL 73 HG13 VAL 73 73.493 -7.641 -0.632
495 1HG2 VAL 73 HG21 VAL 73 73.000 -4.737 -2.975
496 2HG2 VAL 73 HG22 VAL 73 74.154 -5.908 -3.621
497 3HG2 VAL 73 HG23 VAL 73 74.725 -4.365 -2.989
498 HA PRO 74 HA PRO 74 72.684 -1.054 0.017
499 1HB PRO 74 HB2 PRO 74 74.112 -0.352 2.240
500 2HB PRO 74 HB1 PRO 74 72.447 -0.958 2.314
501 1HG PRO 74 HG2 PRO 74 75.005 -2.368 2.859
502 2HG PRO 74 HG1 PRO 74 73.430 -2.542 3.647
503 1HD PRO 74 HD2 PRO 74 74.432 -4.297 1.787
504 2HD PRO 74 HD1 PRO 74 72.702 -4.079 2.126
505 H ALA 75 HN ALA 75 73.958 0.482 -0.992
506 HA ALA 75 HA ALA 75 76.645 -0.212 -1.859
507 1HB ALA 75 HB1 ALA 75 74.688 2.041 -2.124
508 2HB ALA 75 HB2 ALA 75 75.469 1.091 -3.390
509 3HB ALA 75 HB3 ALA 75 76.370 2.354 -2.552
510 HA PRO 76 HA PRO 76 78.978 1.678 1.352
511 1HB PRO 76 HB2 PRO 76 81.002 2.904 -0.032
512 2HB PRO 76 HB1 PRO 76 80.902 1.143 0.177
513 1HG PRO 76 HG2 PRO 76 80.144 2.818 -2.167
514 2HG PRO 76 HG1 PRO 76 80.939 1.235 -2.120
515 1HD PRO 76 HD2 PRO 76 78.296 1.559 -2.685
516 2HD PRO 76 HD1 PRO 76 78.955 0.099 -1.913
517 H SER 77 HN SER 77 76.788 3.188 1.097
518 HA SER 77 HA SER 77 77.488 5.972 0.360
519 1HB SER 77 HB2 SER 77 75.052 4.357 0.980
520 2HB SER 77 HB1 SER 77 74.961 6.095 1.245
521 HG SER 77 HG SER 77 74.722 4.819 -1.024
522 H ALA 78 HN ALA 78 78.407 7.261 1.907
523 HA ALA 78 HA ALA 78 78.414 6.564 4.735
524 1HB ALA 78 HB1 ALA 78 79.427 9.026 4.681
525 2HB ALA 78 HB2 ALA 78 79.462 8.719 2.943
526 3HB ALA 78 HB3 ALA 78 80.339 7.656 4.044
527 H ALA 79 HN ALA 79 75.979 7.871 2.889
528 HA ALA 79 HA ALA 79 75.050 9.715 5.061
529 1HB ALA 79 HB1 ALA 79 75.251 9.956 2.286
530 2HB ALA 79 HB2 ALA 79 74.332 11.020 3.351
531 3HB ALA 79 HB3 ALA 79 73.535 9.660 2.562
532 H CYS 80 HN CYS 80 74.463 6.674 3.553
533 HA CYS 80 HA CYS 80 71.635 6.441 4.042
534 1HB CYS 80 HB2 CYS 80 72.645 5.035 2.428
535 2HB CYS 80 HB1 CYS 80 73.936 4.565 3.522
536 H LYS 81 HN LYS 81 70.714 4.857 5.604
537 HA LYS 81 HA LYS 81 71.329 5.486 8.299
538 1HB LYS 81 HB2 LYS 81 69.867 3.340 8.656
539 2HB LYS 81 HB1 LYS 81 69.153 4.745 7.868
540 1HG LYS 81 HG2 LYS 81 68.926 3.660 5.887
541 2HG LYS 81 HG1 LYS 81 70.515 2.919 6.006
542 1HD LYS 81 HD2 LYS 81 68.905 1.757 8.046
543 2HD LYS 81 HD1 LYS 81 67.965 1.737 6.557
544 1HE LYS 81 HE2 LYS 81 70.686 0.984 5.966
545 2HE LYS 81 HE1 LYS 81 70.034 -0.047 7.257
546 1HZ LYS 81 HZ1 LYS 81 69.189 -1.053 5.374
547 2HZ LYS 81 HZ2 LYS 81 68.981 0.415 4.544
548 3HZ LYS 81 HZ3 LYS 81 67.917 -0.015 5.799
549 H ILE 82 HN ILE 82 71.423 2.068 7.297
550 HA ILE 82 HA ILE 82 73.046 0.405 7.686
551 HB ILE 82 HB ILE 82 74.859 2.680 8.548
552 1HG1 ILE 82 HG12 ILE 82 74.124 3.459 6.438
553 2HG1 ILE 82 HG11 ILE 82 75.582 2.549 6.051
554 1HG2 ILE 82 HG21 ILE 82 75.127 -0.170 7.946
555 2HG2 ILE 82 HG22 ILE 82 76.216 0.902 8.826
556 3HG2 ILE 82 HG23 ILE 82 76.278 0.834 7.065
557 1HD1 ILE 82 HD1 ILE 82 74.009 0.531 5.692
558 2HD1 ILE 82 HD1 ILE 82 73.984 1.798 4.465
559 3HD1 ILE 82 HD1 ILE 82 72.702 1.715 5.673
560 H SER 83 HN SER 83 71.113 1.443 9.634
561 HA SER 83 HA SER 83 72.598 1.055 12.205
562 1HB SER 83 HB2 SER 83 70.039 2.460 11.420
563 2HB SER 83 HB1 SER 83 70.478 2.176 13.102
564 HG SER 83 HG SER 83 72.622 3.152 11.999
565 H GLY 84 HN GLY 84 69.109 0.707 11.706
566 1HA GLY 84 HA2 GLY 84 69.386 -2.142 12.587
567 2HA GLY 84 HA1 GLY 84 68.054 -1.099 13.080
568 H CYS 85 HN CYS 85 69.437 -2.857 10.340
569 HA CYS 85 HA CYS 85 66.867 -3.612 9.316
570 1HB CYS 85 HB2 CYS 85 67.029 -1.070 8.889
571 2HB CYS 85 HB1 CYS 85 68.235 -1.478 7.671
572 H THR 86 HN THR 86 67.152 -4.455 6.957
573 HA THR 86 HA THR 86 69.829 -5.053 6.001
574 HB THR 86 HB THR 86 69.692 -6.507 7.999
575 HG1 THR 86 HG1 THR 86 70.697 -7.301 6.083
576 1HG2 THR 86 HG21 THR 86 67.775 -7.539 8.585
577 2HG2 THR 86 HG22 THR 86 67.642 -8.304 7.003
578 3HG2 THR 86 HG23 THR 86 66.992 -6.685 7.255
579 H PHE 87 HN PHE 87 69.615 -6.668 4.124
580 HA PHE 87 HA PHE 87 66.840 -6.571 2.985
581 1HB PHE 87 HB2 PHE 87 69.316 -6.470 1.282
582 2HB PHE 87 HB1 PHE 87 67.711 -5.831 0.939
583 HD1 PHE 87 HD1 PHE 87 70.824 -4.708 1.271
584 HD2 PHE 87 HD2 PHE 87 67.051 -4.227 3.266
585 HE1 PHE 87 HE1 PHE 87 71.549 -2.506 2.117
586 HE2 PHE 87 HE2 PHE 87 67.781 -2.010 4.114
587 HZ PHE 87 HZ PHE 87 70.035 -1.148 3.535
588 H SER 88 HN SER 88 66.375 -8.358 1.518
589 HA SER 88 HA SER 88 68.230 -10.692 1.832
590 1HB SER 88 HB2 SER 88 65.282 -10.357 2.319
591 2HB SER 88 HB1 SER 88 65.902 -11.934 1.843
592 HG SER 88 HG SER 88 67.158 -10.469 3.890
593 H ALA 89 HN ALA 89 67.507 -8.610 -0.355
594 HA ALA 89 HA ALA 89 67.202 -8.623 -2.693
595 1HB ALA 89 HB1 ALA 89 67.809 -11.495 -2.893
596 2HB ALA 89 HB2 ALA 89 68.949 -10.604 -1.882
597 3HB ALA 89 HB3 ALA 89 68.688 -10.117 -3.556
598 H ASN 90 HN ASN 90 64.781 -8.706 -1.629
599 HA ASN 90 HA ASN 90 63.072 -10.862 -1.707
600 1HB ASN 90 HB2 ASN 90 61.464 -9.212 -1.682
601 2HB ASN 90 HB1 ASN 90 62.868 -8.167 -1.489
602 1HD2 ASN 90 HD2 ASN 90 63.870 -7.446 -3.730
603 2HD2 ASN 90 HD2 ASN 90 62.754 -7.039 -4.942
Start of MODEL 19
1 1H ASP 1 HT1 ASP 1 45.434 6.232 3.556
2 2H ASP 1 HT2 ASP 1 45.075 7.382 2.358
3 3H ASP 1 HT3 ASP 1 45.494 7.887 3.926
4 HA ASP 1 HA ASP 1 47.341 8.146 2.306
5 1HB ASP 1 HB2 ASP 1 47.597 6.185 4.609
6 2HB ASP 1 HB1 ASP 1 48.942 7.075 3.895
7 H GLY 2 HN GLY 2 46.647 4.730 3.148
8 1HA GLY 2 HA2 GLY 2 48.396 3.713 1.063
9 2HA GLY 2 HA1 GLY 2 47.268 2.754 2.023
10 H SER 3 HN SER 3 46.072 1.671 0.500
11 HA SER 3 HA SER 3 44.510 1.365 -1.250
12 1HB SER 3 HB2 SER 3 44.139 4.082 -0.135
13 2HB SER 3 HB1 SER 3 43.436 3.830 -1.729
14 HG SER 3 HG SER 3 42.801 2.690 0.726
15 H CYS 4 HN CYS 4 47.388 2.694 -1.642
16 HA CYS 4 HA CYS 4 47.026 3.986 -4.270
17 1HB CYS 4 HB2 CYS 4 49.617 3.183 -2.926
18 2HB CYS 4 HB1 CYS 4 49.333 4.532 -4.023
19 H THR 5 HN THR 5 48.889 3.081 -5.917
20 HA THR 5 HA THR 5 48.616 0.094 -5.985
21 HB THR 5 HB THR 5 48.269 2.148 -8.189
22 HG1 THR 5 HG1 THR 5 46.520 1.567 -6.683
23 1HG2 THR 5 HG21 THR 5 47.687 -0.062 -9.484
24 2HG2 THR 5 HG22 THR 5 48.707 -0.827 -8.266
25 3HG2 THR 5 HG23 THR 5 49.374 0.421 -9.318
26 H ASN 6 HN ASN 6 50.731 2.624 -5.758
27 HA ASN 6 HA ASN 6 52.991 2.967 -6.450
28 1HB ASN 6 HB2 ASN 6 54.277 0.927 -5.751
29 2HB ASN 6 HB1 ASN 6 53.058 1.410 -4.573
30 1HD2 ASN 6 HD2 ASN 6 51.316 -0.043 -4.164
31 2HD2 ASN 6 HD2 ASN 6 51.176 -1.559 -4.914
32 H THR 7 HN THR 7 51.959 3.048 -8.818
33 HA THR 7 HA THR 7 52.447 2.583 -11.096
34 HB THR 7 HB THR 7 54.294 0.385 -10.224
35 HG1 THR 7 HG1 THR 7 55.342 2.922 -10.111
36 1HG2 THR 7 HG21 THR 7 53.939 1.240 -12.622
37 2HG2 THR 7 HG22 THR 7 55.605 1.128 -12.054
38 3HG2 THR 7 HG23 THR 7 54.793 2.693 -12.103
39 H ASN 8 HN ASN 8 52.617 -0.472 -9.219
40 HA ASN 8 HA ASN 8 50.103 -1.523 -9.916
41 1HB ASN 8 HB2 ASN 8 51.933 -1.310 -12.114
42 2HB ASN 8 HB1 ASN 8 51.666 -3.017 -11.773
43 1HD2 ASN 8 HD2 ASN 8 50.456 -0.591 -13.652
44 2HD2 ASN 8 HD2 ASN 8 48.835 -1.086 -13.758
45 H SER 9 HN SER 9 50.747 -2.235 -7.692
46 HA SER 9 HA SER 9 51.771 -4.970 -7.714
47 1HB SER 9 HB2 SER 9 53.629 -2.917 -7.634
48 2HB SER 9 HB1 SER 9 53.429 -3.324 -5.934
49 HG SER 9 HG SER 9 54.576 -5.029 -6.331
50 H GLN 10 HN GLN 10 52.666 -4.619 -4.846
51 HA GLN 10 HA GLN 10 49.928 -4.511 -3.650
52 1HB GLN 10 HB2 GLN 10 52.346 -6.135 -3.366
53 2HB GLN 10 HB1 GLN 10 51.727 -5.580 -1.810
54 1HG GLN 10 HG2 GLN 10 50.048 -7.070 -1.901
55 2HG GLN 10 HG1 GLN 10 49.526 -6.428 -3.460
56 1HE2 GLN 10 HE21 GLN 10 51.930 -7.057 -4.953
57 2HE2 GLN 10 HE22 GLN 10 52.029 -8.746 -5.084
58 H LEU 11 HN LEU 11 49.964 -3.727 -1.292
59 HA LEU 11 HA LEU 11 52.017 -1.991 -0.304
60 1HB LEU 11 HB2 LEU 11 51.183 -0.803 -2.412
61 2HB LEU 11 HB1 LEU 11 49.656 -0.567 -1.564
62 HG LEU 11 HG LEU 11 50.679 0.775 0.119
63 1HD1 LEU 11 HD1 LEU 11 52.663 -0.352 0.687
64 2HD1 LEU 11 HD1 LEU 11 53.256 1.128 -0.069
65 3HD1 LEU 11 HD1 LEU 11 53.233 -0.381 -0.982
66 1HD2 LEU 11 HD2 LEU 11 51.316 2.630 -1.139
67 2HD2 LEU 11 HD2 LEU 11 50.518 1.654 -2.372
68 3HD2 LEU 11 HD2 LEU 11 52.278 1.666 -2.259
69 H SER 12 HN SER 12 51.393 -3.045 1.653
70 HA SER 12 HA SER 12 48.943 -3.527 2.793
71 1HB SER 12 HB2 SER 12 50.464 -4.040 4.384
72 2HB SER 12 HB1 SER 12 51.652 -2.966 3.649
73 HG SER 12 HG SER 12 50.533 -2.599 5.915
74 H ALA 13 HN ALA 13 47.347 -2.322 3.899
75 HA ALA 13 HA ALA 13 46.802 0.337 3.042
76 1HB ALA 13 HB1 ALA 13 45.614 -1.731 4.554
77 2HB ALA 13 HB2 ALA 13 44.849 -0.232 4.029
78 3HB ALA 13 HB3 ALA 13 45.627 -0.317 5.609
79 H ASN 14 HN ASN 14 48.989 -0.815 5.418
80 HA ASN 14 HA ASN 14 48.968 1.701 6.986
81 1HB ASN 14 HB2 ASN 14 49.224 -0.168 8.356
82 2HB ASN 14 HB1 ASN 14 50.166 -1.045 7.153
83 1HD2 ASN 14 HD2 ASN 14 52.436 -0.056 6.722
84 2HD2 ASN 14 HD2 ASN 14 53.260 0.584 8.060
85 H SER 15 HN SER 15 50.388 0.574 4.141
86 HA SER 15 HA SER 15 53.076 1.583 4.397
87 1HB SER 15 HB2 SER 15 53.177 0.610 2.348
88 2HB SER 15 HB1 SER 15 51.486 0.173 2.577
89 HG SER 15 HG SER 15 50.944 2.207 1.648
90 H LYS 16 HN LYS 16 53.527 3.336 2.385
91 HA LYS 16 HA LYS 16 51.645 5.626 2.672
92 1HB LYS 16 HB2 LYS 16 53.728 5.351 4.377
93 2HB LYS 16 HB1 LYS 16 54.542 6.193 3.058
94 1HG LYS 16 HG2 LYS 16 52.332 7.703 3.185
95 2HG LYS 16 HG1 LYS 16 52.363 7.145 4.858
96 1HD LYS 16 HD2 LYS 16 54.659 7.956 5.118
97 2HD LYS 16 HD1 LYS 16 54.696 8.448 3.425
98 1HE LYS 16 HE2 LYS 16 54.045 10.478 4.288
99 2HE LYS 16 HE1 LYS 16 52.434 9.732 4.278
100 1HZ LYS 16 HZ1 LYS 16 54.352 9.417 6.519
101 2HZ LYS 16 HZ2 LYS 16 52.705 8.998 6.495
102 3HZ LYS 16 HZ3 LYS 16 53.170 10.632 6.488
103 H CYS 17 HN CYS 17 51.281 6.194 0.556
104 HA CYS 17 HA CYS 17 53.557 5.989 -1.382
105 1HB CYS 17 HB2 CYS 17 51.865 5.610 -3.044
106 2HB CYS 17 HB1 CYS 17 51.410 4.631 -1.652
107 H GLU 18 HN GLU 18 52.531 7.650 -3.379
108 HA GLU 18 HA GLU 18 52.259 9.923 -3.999
109 1HB GLU 18 HB2 GLU 18 50.495 9.651 -2.119
110 2HB GLU 18 HB1 GLU 18 51.673 10.462 -1.086
111 1HG GLU 18 HG2 GLU 18 50.154 12.125 -2.021
112 2HG GLU 18 HG1 GLU 18 51.759 12.345 -2.720
113 H LYS 19 HN LYS 19 53.840 11.484 -4.258
114 HA LYS 19 HA LYS 19 55.822 12.714 -3.851
115 1HB LYS 19 HB2 LYS 19 54.477 12.259 -1.309
116 2HB LYS 19 HB1 LYS 19 56.226 12.342 -1.094
117 1HG LYS 19 HG2 LYS 19 55.526 14.389 -2.933
118 2HG LYS 19 HG1 LYS 19 54.382 14.489 -1.594
119 1HD LYS 19 HD2 LYS 19 55.962 15.298 -0.203
120 2HD LYS 19 HD1 LYS 19 57.082 14.002 -0.630
121 1HE LYS 19 HE2 LYS 19 58.290 15.732 -1.550
122 2HE LYS 19 HE1 LYS 19 57.168 15.519 -2.908
123 1HZ LYS 19 HZ1 LYS 19 55.900 17.280 -2.274
124 2HZ LYS 19 HZ2 LYS 19 57.391 17.821 -1.663
125 3HZ LYS 19 HZ3 LYS 19 56.255 17.100 -0.624
126 H SER 20 HN SER 20 55.991 9.950 -4.620
127 HA SER 20 HA SER 20 58.729 9.356 -3.725
128 1HB SER 20 HB2 SER 20 56.990 8.476 -2.016
129 2HB SER 20 HB1 SER 20 56.562 7.301 -3.257
130 HG SER 20 HG SER 20 59.217 7.741 -2.364
131 H THR 21 HN THR 21 59.508 7.308 -4.925
132 HA THR 21 HA THR 21 58.194 7.224 -7.615
133 HB THR 21 HB THR 21 60.999 6.639 -6.617
134 HG1 THR 21 HG1 THR 21 61.315 8.620 -7.174
135 1HG2 THR 21 HG21 THR 21 61.568 6.302 -9.004
136 2HG2 THR 21 HG22 THR 21 59.859 6.440 -9.418
137 3HG2 THR 21 HG23 THR 21 60.421 5.090 -8.432
138 H LEU 22 HN LEU 22 56.741 5.509 -7.520
139 HA LEU 22 HA LEU 22 57.616 2.978 -6.213
140 1HB LEU 22 HB2 LEU 22 54.930 3.893 -7.292
141 2HB LEU 22 HB1 LEU 22 55.214 2.457 -6.310
142 HG LEU 22 HG LEU 22 54.470 4.065 -4.749
143 1HD1 LEU 22 HD1 LEU 22 57.459 4.497 -4.647
144 2HD1 LEU 22 HD1 LEU 22 56.726 2.948 -4.234
145 3HD1 LEU 22 HD1 LEU 22 56.327 4.389 -3.300
146 1HD2 LEU 22 HD2 LEU 22 55.048 5.920 -6.614
147 2HD2 LEU 22 HD2 LEU 22 56.419 6.178 -5.535
148 3HD2 LEU 22 HD2 LEU 22 54.773 6.340 -4.922
149 H THR 23 HN THR 23 57.544 0.997 -7.354
150 HA THR 23 HA THR 23 56.794 0.853 -10.177
151 HB THR 23 HB THR 23 59.706 0.524 -9.393
152 HG1 THR 23 HG1 THR 23 59.963 2.579 -9.726
153 1HG2 THR 23 HG21 THR 23 58.633 -0.595 -11.478
154 2HG2 THR 23 HG22 THR 23 60.124 0.320 -11.697
155 3HG2 THR 23 HG23 THR 23 58.575 1.040 -12.136
156 H ASN 24 HN ASN 24 55.546 -0.969 -9.489
157 HA ASN 24 HA ASN 24 55.216 -3.282 -9.095
158 1HB ASN 24 HB2 ASN 24 57.886 -2.924 -10.151
159 2HB ASN 24 HB1 ASN 24 57.885 -4.228 -8.964
160 1HD2 ASN 24 HD2 ASN 24 55.411 -3.162 -11.376
161 2HD2 ASN 24 HD2 ASN 24 55.242 -4.694 -12.088
162 H CYS 25 HN CYS 25 55.650 -1.307 -6.930
163 HA CYS 25 HA CYS 25 57.328 -2.238 -4.838
164 1HB CYS 25 HB2 CYS 25 54.664 -0.795 -4.848
165 2HB CYS 25 HB1 CYS 25 55.700 -0.917 -3.433
166 H TYR 26 HN TYR 26 55.571 -2.584 -2.670
167 HA TYR 26 HA TYR 26 53.610 -4.640 -2.953
168 1HB TYR 26 HB2 TYR 26 55.858 -5.712 -3.720
169 2HB TYR 26 HB1 TYR 26 56.287 -5.678 -2.010
170 HD1 TYR 26 HD1 TYR 26 54.135 -6.441 -0.460
171 HD2 TYR 26 HD2 TYR 26 55.004 -7.742 -4.460
172 HE1 TYR 26 HE1 TYR 26 52.800 -8.497 -0.082
173 HE2 TYR 26 HE2 TYR 26 53.669 -9.796 -4.083
174 HH TYR 26 HH TYR 26 52.947 -11.042 -1.355
175 H VAL 27 HN VAL 27 56.330 -3.507 -0.997
176 HA VAL 27 HA VAL 27 56.509 -3.182 1.355
177 HB VAL 27 HB VAL 27 53.833 -1.854 0.971
178 1HG1 VAL 27 HG11 VAL 27 55.777 -0.056 1.882
179 2HG1 VAL 27 HG12 VAL 27 56.168 -1.576 2.687
180 3HG1 VAL 27 HG13 VAL 27 54.562 -0.871 2.867
181 1HG2 VAL 27 HG21 VAL 27 56.427 -1.201 -0.452
182 2HG2 VAL 27 HG22 VAL 27 55.168 0.009 -0.190
183 3HG2 VAL 27 HG23 VAL 27 54.825 -1.425 -1.160
184 H ASP 28 HN ASP 28 54.447 -2.799 3.232
185 HA ASP 28 HA ASP 28 52.420 -4.754 3.406
186 1HB ASP 28 HB2 ASP 28 55.134 -5.745 3.559
187 2HB ASP 28 HB1 ASP 28 54.318 -6.024 5.098
188 H LYS 29 HN LYS 29 54.996 -2.983 4.998
189 HA LYS 29 HA LYS 29 53.196 -1.766 6.923
190 1HB LYS 29 HB2 LYS 29 54.563 -4.270 7.536
191 2HB LYS 29 HB1 LYS 29 55.029 -2.992 8.658
192 1HG LYS 29 HG2 LYS 29 52.758 -2.579 9.285
193 2HG LYS 29 HG1 LYS 29 52.144 -3.569 7.961
194 1HD LYS 29 HD2 LYS 29 53.931 -4.743 10.089
195 2HD LYS 29 HD1 LYS 29 52.186 -4.626 10.322
196 1HE LYS 29 HE2 LYS 29 52.076 -5.757 7.939
197 2HE LYS 29 HE1 LYS 29 53.718 -6.297 8.350
198 1HZ LYS 29 HZ1 LYS 29 52.853 -7.068 10.498
199 2HZ LYS 29 HZ2 LYS 29 52.119 -7.875 9.194
200 3HZ LYS 29 HZ3 LYS 29 51.283 -6.646 10.018
201 H SER 30 HN SER 30 54.861 -0.587 5.077
202 HA SER 30 HA SER 30 57.133 0.440 6.748
203 1HB SER 30 HB2 SER 30 56.917 -0.280 3.820
204 2HB SER 30 HB1 SER 30 58.230 0.714 4.443
205 HG SER 30 HG SER 30 57.541 -1.774 5.596
206 H GLU 31 HN GLU 31 57.952 2.495 5.148
207 HA GLU 31 HA GLU 31 55.527 4.240 4.816
208 1HB GLU 31 HB2 GLU 31 57.504 4.348 6.788
209 2HB GLU 31 HB1 GLU 31 57.980 5.598 5.639
210 1HG GLU 31 HG2 GLU 31 55.863 6.702 5.825
211 2HG GLU 31 HG1 GLU 31 55.160 5.345 6.707
212 H VAL 32 HN VAL 32 59.061 4.474 4.260
213 HA VAL 32 HA VAL 32 60.267 4.949 2.283
214 HB VAL 32 HB VAL 32 57.645 4.490 0.840
215 1HG1 VAL 32 HG11 VAL 32 59.336 3.388 -0.760
216 2HG1 VAL 32 HG12 VAL 32 60.578 4.196 0.198
217 3HG1 VAL 32 HG13 VAL 32 59.359 5.149 -0.651
218 1HG2 VAL 32 HG21 VAL 32 58.678 2.698 2.693
219 2HG2 VAL 32 HG22 VAL 32 59.401 2.156 1.182
220 3HG2 VAL 32 HG23 VAL 32 57.648 2.269 1.329
221 H TYR 33 HN TYR 33 60.663 6.846 1.041
222 HA TYR 33 HA TYR 33 58.503 8.922 1.054
223 1HB TYR 33 HB2 TYR 33 61.320 9.002 2.105
224 2HB TYR 33 HB1 TYR 33 60.562 10.484 1.530
225 HD1 TYR 33 HD1 TYR 33 60.279 7.716 3.991
226 HD2 TYR 33 HD2 TYR 33 58.814 11.563 2.759
227 HE1 TYR 33 HE1 TYR 33 59.046 7.934 6.132
228 HE2 TYR 33 HE2 TYR 33 57.582 11.779 4.900
229 HH TYR 33 HH TYR 33 57.308 9.111 7.140
230 H GLY 34 HN GLY 34 61.798 8.202 -0.198
231 1HA GLY 34 HA2 GLY 34 60.860 9.170 -2.862
232 2HA GLY 34 HA1 GLY 34 62.381 9.766 -2.202
233 H THR 35 HN THR 35 61.197 6.455 -1.864
234 HA THR 35 HA THR 35 63.709 5.421 -2.996
235 HB THR 35 HB THR 35 61.202 4.274 -1.754
236 HG1 THR 35 HG1 THR 35 62.421 4.715 -0.111
237 1HG2 THR 35 HG21 THR 35 61.653 2.452 -3.058
238 2HG2 THR 35 HG22 THR 35 62.851 2.151 -1.799
239 3HG2 THR 35 HG23 THR 35 63.335 2.918 -3.312
240 H THR 36 HN THR 36 63.932 4.570 -5.063
241 HA THR 36 HA THR 36 61.939 5.117 -7.075
242 HB THR 36 HB THR 36 64.335 3.261 -7.159
243 HG1 THR 36 HG1 THR 36 65.542 4.987 -7.227
244 1HG2 THR 36 HG21 THR 36 62.403 3.844 -9.083
245 2HG2 THR 36 HG22 THR 36 63.998 3.160 -9.388
246 3HG2 THR 36 HG23 THR 36 63.751 4.902 -9.497
247 H CYS 37 HN CYS 37 62.243 2.580 -4.836
248 HA CYS 37 HA CYS 37 61.279 0.417 -4.702
249 1HB CYS 37 HB2 CYS 37 59.452 2.270 -4.691
250 2HB CYS 37 HB1 CYS 37 59.086 1.709 -6.320
251 H THR 38 HN THR 38 63.100 0.401 -6.804
252 HA THR 38 HA THR 38 61.973 -0.317 -9.356
253 HB THR 38 HB THR 38 64.617 -0.973 -8.013
254 HG1 THR 38 HG1 THR 38 65.005 1.033 -8.412
255 1HG2 THR 38 HG21 THR 38 65.207 -2.090 -9.873
256 2HG2 THR 38 HG22 THR 38 64.678 -0.754 -10.896
257 3HG2 THR 38 HG23 THR 38 63.526 -1.994 -10.397
258 H GLY 39 HN GLY 39 60.259 -1.746 -8.075
259 1HA GLY 39 HA2 GLY 39 59.405 -3.923 -7.851
260 2HA GLY 39 HA1 GLY 39 60.864 -4.506 -8.654
261 H SER 40 HN SER 40 59.697 -3.298 -5.507
262 HA SER 40 HA SER 40 61.454 -5.294 -4.169
263 1HB SER 40 HB2 SER 40 61.488 -2.666 -2.877
264 2HB SER 40 HB1 SER 40 62.835 -3.719 -3.296
265 HG SER 40 HG SER 40 61.957 -1.523 -4.544
266 H ARG 41 HN ARG 41 60.777 -5.672 -1.919
267 HA ARG 41 HA ARG 41 58.042 -4.622 -1.277
268 1HB ARG 41 HB2 ARG 41 57.747 -6.827 -2.152
269 2HB ARG 41 HB1 ARG 41 59.146 -7.439 -1.270
270 1HG ARG 41 HG2 ARG 41 58.005 -7.159 0.853
271 2HG ARG 41 HG1 ARG 41 56.642 -6.368 0.060
272 1HD ARG 41 HD2 ARG 41 55.691 -8.418 -0.149
273 2HD ARG 41 HD1 ARG 41 56.986 -8.829 -1.292
274 HE ARG 41 HE ARG 41 57.754 -9.018 1.536
275 1HH1 ARG 41 HH2 ARG 41 55.693 -10.706 -0.532
276 2HH1 ARG 41 HH2 ARG 41 56.485 -12.235 -0.348
277 1HH2 ARG 41 HH1 ARG 41 59.140 -10.943 1.468
278 2HH2 ARG 41 HH1 ARG 41 58.435 -12.370 0.785
279 H PHE 42 HN PHE 42 57.548 -4.733 1.060
280 HA PHE 42 HA PHE 42 59.978 -4.922 2.806
281 1HB PHE 42 HB2 PHE 42 57.800 -2.837 3.082
282 2HB PHE 42 HB1 PHE 42 59.409 -2.830 3.806
283 HD1 PHE 42 HD1 PHE 42 57.585 -1.186 1.462
284 HD2 PHE 42 HD2 PHE 42 61.279 -3.354 1.750
285 HE1 PHE 42 HE1 PHE 42 58.453 0.042 -0.505
286 HE2 PHE 42 HE2 PHE 42 62.151 -2.124 -0.220
287 HZ PHE 42 HZ PHE 42 60.734 -0.429 -1.346
288 H ASP 43 HN ASP 43 58.826 -4.461 5.235
289 HA ASP 43 HA ASP 43 56.267 -5.735 5.648
290 1HB ASP 43 HB2 ASP 43 58.390 -7.438 4.997
291 2HB ASP 43 HB1 ASP 43 58.256 -7.564 6.752
292 H GLY 44 HN GLY 44 57.316 -3.402 6.682
293 1HA GLY 44 HA2 GLY 44 56.864 -2.746 9.046
294 2HA GLY 44 HA1 GLY 44 57.813 -4.151 9.530
295 H VAL 45 HN VAL 45 58.289 -1.314 7.365
296 HA VAL 45 HA VAL 45 60.898 -0.888 8.770
297 HB VAL 45 HB VAL 45 62.083 -0.938 6.767
298 1HG1 VAL 45 HG11 VAL 45 61.288 -2.824 5.398
299 2HG1 VAL 45 HG12 VAL 45 59.698 -2.701 6.152
300 3HG1 VAL 45 HG13 VAL 45 61.099 -3.170 7.117
301 1HG2 VAL 45 HG21 VAL 45 61.281 0.554 5.250
302 2HG2 VAL 45 HG22 VAL 45 59.602 0.222 5.667
303 3HG2 VAL 45 HG23 VAL 45 60.460 -0.846 4.560
304 H THR 46 HN THR 46 61.773 1.298 7.412
305 HA THR 46 HA THR 46 59.622 3.303 7.175
306 HB THR 46 HB THR 46 61.790 3.462 9.298
307 HG1 THR 46 HG1 THR 46 59.026 2.867 9.418
308 1HG2 THR 46 HG21 THR 46 59.514 5.275 8.486
309 2HG2 THR 46 HG22 THR 46 61.230 5.666 8.593
310 3HG2 THR 46 HG23 THR 46 60.294 5.392 10.063
311 H ILE 47 HN ILE 47 61.178 2.564 5.115
312 HA ILE 47 HA ILE 47 63.714 3.993 4.987
313 HB ILE 47 HB ILE 47 63.353 1.930 3.761
314 1HG1 ILE 47 HG12 ILE 47 63.266 4.158 1.711
315 2HG1 ILE 47 HG11 ILE 47 64.686 3.849 2.709
316 1HG2 ILE 47 HG21 ILE 47 61.297 1.474 2.965
317 2HG2 ILE 47 HG22 ILE 47 61.537 2.699 1.720
318 3HG2 ILE 47 HG23 ILE 47 60.788 3.137 3.255
319 1HD1 ILE 47 HD1 ILE 47 63.375 1.688 1.048
320 2HD1 ILE 47 HD1 ILE 47 64.971 1.659 1.800
321 3HD1 ILE 47 HD1 ILE 47 64.665 2.714 0.420
322 H THR 48 HN THR 48 64.062 5.565 3.135
323 HA THR 48 HA THR 48 61.688 7.283 2.585
324 HB THR 48 HB THR 48 63.156 9.245 3.189
325 HG1 THR 48 HG1 THR 48 65.182 8.689 3.236
326 1HG2 THR 48 HG21 THR 48 63.348 8.142 5.748
327 2HG2 THR 48 HG22 THR 48 62.021 7.262 4.989
328 3HG2 THR 48 HG23 THR 48 61.968 9.021 5.089
329 H THR 49 HN THR 49 64.100 9.143 1.599
330 HA THR 49 HA THR 49 63.955 8.441 -1.168
331 HB THR 49 HB THR 49 65.957 10.013 0.485
332 HG1 THR 49 HG1 THR 49 64.227 11.190 -1.328
333 1HG2 THR 49 HG21 THR 49 65.618 9.890 -2.524
334 2HG2 THR 49 HG22 THR 49 66.989 9.254 -1.614
335 3HG2 THR 49 HG23 THR 49 66.688 10.992 -1.659
336 H SER 50 HN SER 50 64.932 6.691 -2.163
337 HA SER 50 HA SER 50 67.664 5.905 -1.471
338 1HB SER 50 HB2 SER 50 65.275 4.631 -0.302
339 2HB SER 50 HB1 SER 50 66.430 3.497 -0.997
340 HG SER 50 HG SER 50 67.114 3.862 1.057
341 H THR 51 HN THR 51 68.494 4.316 -2.984
342 HA THR 51 HA THR 51 66.763 4.028 -5.410
343 HB THR 51 HB THR 51 69.744 3.595 -5.284
344 HG1 THR 51 HG1 THR 51 69.654 5.973 -5.906
345 1HG2 THR 51 HG21 THR 51 69.229 3.246 -7.467
346 2HG2 THR 51 HG22 THR 51 69.127 5.005 -7.556
347 3HG2 THR 51 HG23 THR 51 67.665 4.048 -7.321
348 H SER 52 HN SER 52 67.128 2.270 -2.834
349 HA SER 52 HA SER 52 68.360 -0.154 -3.165
350 1HB SER 52 HB2 SER 52 65.531 -0.461 -2.463
351 2HB SER 52 HB1 SER 52 66.963 -0.721 -1.471
352 HG SER 52 HG SER 52 66.309 1.064 -0.553
353 H THR 53 HN THR 53 68.404 -1.658 -4.806
354 HA THR 53 HA THR 53 66.071 -1.733 -6.695
355 HB THR 53 HB THR 53 68.953 -2.561 -7.156
356 HG1 THR 53 HG1 THR 53 67.632 -0.166 -7.898
357 1HG2 THR 53 HG21 THR 53 66.587 -2.999 -8.623
358 2HG2 THR 53 HG22 THR 53 68.244 -3.254 -9.171
359 3HG2 THR 53 HG23 THR 53 67.445 -1.710 -9.467
360 H GLY 54 HN GLY 54 64.821 -3.496 -6.163
361 1HA GLY 54 HA2 GLY 54 64.249 -5.716 -5.658
362 2HA GLY 54 HA1 GLY 54 65.781 -6.160 -6.415
363 H SER 55 HN SER 55 64.262 -5.253 -3.359
364 HA SER 55 HA SER 55 66.251 -6.836 -1.886
365 1HB SER 55 HB2 SER 55 66.955 -4.820 -0.544
366 2HB SER 55 HB1 SER 55 67.458 -4.756 -2.230
367 HG SER 55 HG SER 55 66.245 -3.063 -2.479
368 H ARG 56 HN ARG 56 65.204 -7.710 -0.130
369 HA ARG 56 HA ARG 56 62.498 -6.732 0.551
370 1HB ARG 56 HB2 ARG 56 63.626 -9.190 0.305
371 2HB ARG 56 HB1 ARG 56 63.818 -8.944 2.042
372 1HG ARG 56 HG2 ARG 56 61.243 -8.086 1.657
373 2HG ARG 56 HG1 ARG 56 61.362 -9.383 0.467
374 1HD ARG 56 HD2 ARG 56 62.067 -9.648 3.413
375 2HD ARG 56 HD1 ARG 56 60.603 -10.286 2.641
376 HE ARG 56 HE ARG 56 62.711 -11.246 1.082
377 1HH1 ARG 56 HH2 ARG 56 60.832 -12.191 3.649
378 2HH1 ARG 56 HH2 ARG 56 61.930 -13.381 4.265
379 1HH2 ARG 56 HH1 ARG 56 64.541 -12.431 2.191
380 2HH2 ARG 56 HH1 ARG 56 64.029 -13.517 3.439
381 H ILE 57 HN ILE 57 62.551 -4.955 1.907
382 HA ILE 57 HA ILE 57 64.639 -4.694 3.972
383 HB ILE 57 HB ILE 57 62.210 -2.969 3.425
384 1HG1 ILE 57 HG12 ILE 57 63.340 -3.248 1.309
385 2HG1 ILE 57 HG11 ILE 57 63.814 -1.674 1.953
386 1HG2 ILE 57 HG21 ILE 57 64.132 -1.266 4.121
387 2HG2 ILE 57 HG22 ILE 57 64.790 -2.697 4.914
388 3HG2 ILE 57 HG23 ILE 57 63.183 -2.111 5.345
389 1HD1 ILE 57 HD1 ILE 57 65.418 -4.215 1.807
390 2HD1 ILE 57 HD1 ILE 57 65.802 -2.996 3.023
391 3HD1 ILE 57 HD1 ILE 57 65.875 -2.586 1.309
392 H SER 58 HN SER 58 62.344 -6.796 4.036
393 HA SER 58 HA SER 58 60.377 -6.398 5.927
394 1HB SER 58 HB2 SER 58 62.093 -8.571 5.004
395 2HB SER 58 HB1 SER 58 61.578 -8.810 6.671
396 HG SER 58 HG SER 58 60.183 -9.178 4.455
397 H GLY 59 HN GLY 59 60.280 -6.162 8.207
398 1HA GLY 59 HA2 GLY 59 62.367 -6.738 10.028
399 2HA GLY 59 HA1 GLY 59 62.560 -5.056 9.545
400 HA PRO 60 HA PRO 60 59.070 -5.481 12.656
401 1HB PRO 60 HB2 PRO 60 60.342 -5.806 15.051
402 2HB PRO 60 HB1 PRO 60 59.837 -7.173 14.042
403 1HG PRO 60 HG2 PRO 60 62.525 -6.112 14.540
404 2HG PRO 60 HG1 PRO 60 62.024 -7.722 14.010
405 1HD PRO 60 HD2 PRO 60 63.076 -5.613 12.412
406 2HD PRO 60 HD1 PRO 60 62.487 -7.198 11.870
407 H GLY 61 HN GLY 61 59.845 -3.185 11.607
408 1HA GLY 61 HA2 GLY 61 59.507 -0.922 12.555
409 2HA GLY 61 HA1 GLY 61 60.503 -1.416 13.928
410 H CYS 62 HN CYS 62 61.487 -2.521 10.836
411 HA CYS 62 HA CYS 62 64.107 -1.695 10.833
412 1HB CYS 62 HB2 CYS 62 62.077 -2.507 8.937
413 2HB CYS 62 HB1 CYS 62 63.184 -1.355 8.192
414 H LYS 63 HN LYS 63 65.138 0.046 9.419
415 HA LYS 63 HA LYS 63 63.593 2.532 9.047
416 1HB LYS 63 HB2 LYS 63 64.101 2.665 11.399
417 2HB LYS 63 HB1 LYS 63 65.767 2.154 11.125
418 1HG LYS 63 HG2 LYS 63 65.998 4.249 9.657
419 2HG LYS 63 HG1 LYS 63 64.477 4.781 10.374
420 1HD LYS 63 HD2 LYS 63 66.927 3.984 11.973
421 2HD LYS 63 HD1 LYS 63 66.489 5.650 11.588
422 1HE LYS 63 HE2 LYS 63 64.478 3.836 12.915
423 2HE LYS 63 HE1 LYS 63 65.704 4.678 13.883
424 1HZ LYS 63 HZ1 LYS 63 63.378 5.778 12.971
425 2HZ LYS 63 HZ2 LYS 63 64.536 6.354 11.870
426 3HZ LYS 63 HZ3 LYS 63 64.727 6.638 13.534
427 H ILE 64 HN ILE 64 64.300 3.017 6.992
428 HA ILE 64 HA ILE 64 67.244 2.804 6.431
429 HB ILE 64 HB ILE 64 64.918 2.653 4.499
430 1HG1 ILE 64 HG12 ILE 64 65.157 0.807 6.365
431 2HG1 ILE 64 HG11 ILE 64 64.872 0.330 4.696
432 1HG2 ILE 64 HG21 ILE 64 67.834 1.871 4.233
433 2HG2 ILE 64 HG22 ILE 64 67.078 3.292 3.511
434 3HG2 ILE 64 HG23 ILE 64 66.602 1.677 2.986
435 1HD1 ILE 64 HD1 ILE 64 67.718 0.677 5.405
436 2HD1 ILE 64 HD1 ILE 64 66.936 -0.602 4.476
437 3HD1 ILE 64 HD1 ILE 64 66.904 -0.647 6.239
438 H SER 65 HN SER 65 68.000 4.439 4.800
439 HA SER 65 HA SER 65 66.358 6.770 4.210
440 1HB SER 65 HB2 SER 65 66.698 7.823 6.183
441 2HB SER 65 HB1 SER 65 67.792 6.552 6.720
442 HG SER 65 HG SER 65 68.339 8.929 5.309
443 H THR 66 HN THR 66 67.151 7.112 2.166
444 HA THR 66 HA THR 66 68.704 7.358 0.399
445 HB THR 66 HB THR 66 70.637 8.308 2.487
446 HG1 THR 66 HG1 THR 66 69.380 9.980 2.988
447 1HG2 THR 66 HG21 THR 66 69.760 9.899 0.130
448 2HG2 THR 66 HG22 THR 66 70.659 8.420 -0.205
449 3HG2 THR 66 HG23 THR 66 71.377 9.681 0.801
450 H CYS 67 HN CYS 67 68.752 4.806 0.746
451 HA CYS 67 HA CYS 67 71.607 4.021 1.267
452 1HB CYS 67 HB2 CYS 67 68.963 2.649 1.816
453 2HB CYS 67 HB1 CYS 67 70.495 1.778 1.840
454 H ILE 68 HN ILE 68 72.280 4.110 -0.924
455 HA ILE 68 HA ILE 68 70.728 3.167 -3.144
456 HB ILE 68 HB ILE 68 73.677 3.615 -2.628
457 1HG1 ILE 68 HG12 ILE 68 73.253 5.482 -4.262
458 2HG1 ILE 68 HG11 ILE 68 71.544 5.050 -4.242
459 1HG2 ILE 68 HG21 ILE 68 73.407 3.537 -5.361
460 2HG2 ILE 68 HG22 ILE 68 72.340 2.226 -4.855
461 3HG2 ILE 68 HG23 ILE 68 74.040 2.213 -4.382
462 1HD1 ILE 68 HD1 ILE 68 71.321 5.610 -1.941
463 2HD1 ILE 68 HD1 ILE 68 72.257 6.927 -2.650
464 3HD1 ILE 68 HD1 ILE 68 73.069 5.672 -1.712
465 H ILE 69 HN ILE 69 69.914 1.106 -2.253
466 HA ILE 69 HA ILE 69 71.924 -1.070 -1.994
467 HB ILE 69 HB ILE 69 68.924 -0.980 -1.527
468 1HG1 ILE 69 HG12 ILE 69 70.963 -1.104 0.664
469 2HG1 ILE 69 HG11 ILE 69 70.675 0.452 -0.112
470 1HG2 ILE 69 HG21 ILE 69 70.234 -3.224 -1.957
471 2HG2 ILE 69 HG22 ILE 69 69.096 -3.120 -0.613
472 3HG2 ILE 69 HG23 ILE 69 70.828 -2.963 -0.317
473 1HD1 ILE 69 HD1 ILE 69 68.215 0.128 0.313
474 2HD1 ILE 69 HD1 ILE 69 69.179 0.276 1.783
475 3HD1 ILE 69 HD1 ILE 69 68.620 -1.309 1.251
476 H THR 70 HN THR 70 71.664 -3.030 -3.282
477 HA THR 70 HA THR 70 69.777 -2.963 -5.554
478 HB THR 70 HB THR 70 72.783 -2.695 -5.769
479 HG1 THR 70 HG1 THR 70 71.671 -1.140 -7.433
480 1HG2 THR 70 HG21 THR 70 70.871 -3.296 -8.037
481 2HG2 THR 70 HG22 THR 70 71.866 -4.525 -7.256
482 3HG2 THR 70 HG23 THR 70 72.629 -3.190 -8.118
483 H GLY 71 HN GLY 71 68.954 -4.990 -4.992
484 1HA GLY 71 HA2 GLY 71 69.010 -7.363 -5.318
485 2HA GLY 71 HA1 GLY 71 70.772 -7.282 -5.410
486 H GLY 72 HN GLY 72 68.993 -5.686 -2.852
487 1HA GLY 72 HA2 GLY 72 68.752 -6.258 -0.568
488 2HA GLY 72 HA1 GLY 72 69.369 -7.867 -0.940
489 H VAL 73 HN VAL 73 71.263 -5.288 -2.151
490 HA VAL 73 HA VAL 73 73.210 -5.639 0.111
491 HB VAL 73 HB VAL 73 74.939 -5.611 -1.583
492 1HG1 VAL 73 HG11 VAL 73 74.488 -7.781 -1.975
493 2HG1 VAL 73 HG12 VAL 73 73.351 -7.309 -3.237
494 3HG1 VAL 73 HG13 VAL 73 72.791 -7.510 -1.576
495 1HG2 VAL 73 HG21 VAL 73 73.963 -5.509 -4.055
496 2HG2 VAL 73 HG22 VAL 73 74.349 -4.028 -3.177
497 3HG2 VAL 73 HG23 VAL 73 72.680 -4.591 -3.267
498 HA PRO 74 HA PRO 74 72.773 -1.197 0.261
499 1HB PRO 74 HB2 PRO 74 74.541 -0.793 2.305
500 2HB PRO 74 HB1 PRO 74 72.894 -1.387 2.565
501 1HG PRO 74 HG2 PRO 74 75.461 -2.870 2.556
502 2HG PRO 74 HG1 PRO 74 74.005 -3.140 3.522
503 1HD PRO 74 HD2 PRO 74 74.721 -4.627 1.315
504 2HD PRO 74 HD1 PRO 74 73.069 -4.492 1.953
505 H ALA 75 HN ALA 75 74.053 0.575 -0.458
506 HA ALA 75 HA ALA 75 76.612 -0.176 -1.776
507 1HB ALA 75 HB1 ALA 75 76.192 2.201 -2.738
508 2HB ALA 75 HB2 ALA 75 74.612 2.080 -1.962
509 3HB ALA 75 HB3 ALA 75 75.075 0.921 -3.209
510 HA PRO 76 HA PRO 76 79.099 2.054 1.075
511 1HB PRO 76 HB2 PRO 76 80.917 3.285 -0.565
512 2HB PRO 76 HB1 PRO 76 80.935 1.540 -0.242
513 1HG PRO 76 HG2 PRO 76 79.878 3.014 -2.602
514 2HG PRO 76 HG1 PRO 76 80.758 1.479 -2.532
515 1HD PRO 76 HD2 PRO 76 78.060 1.638 -2.865
516 2HD PRO 76 HD1 PRO 76 78.868 0.264 -2.078
517 H SER 77 HN SER 77 76.798 3.413 0.896
518 HA SER 77 HA SER 77 77.266 6.172 -0.072
519 1HB SER 77 HB2 SER 77 74.956 4.623 1.111
520 2HB SER 77 HB1 SER 77 74.852 6.353 0.799
521 HG SER 77 HG SER 77 74.910 4.211 -0.950
522 H ALA 78 HN ALA 78 77.262 7.992 1.337
523 HA ALA 78 HA ALA 78 78.119 7.407 4.118
524 1HB ALA 78 HB1 ALA 78 79.184 8.996 2.303
525 2HB ALA 78 HB2 ALA 78 79.141 9.510 3.989
526 3HB ALA 78 HB3 ALA 78 77.947 10.127 2.847
527 H ALA 79 HN ALA 79 75.336 8.519 2.378
528 HA ALA 79 HA ALA 79 74.169 9.877 4.742
529 1HB ALA 79 HB1 ALA 79 72.371 10.394 3.087
530 2HB ALA 79 HB2 ALA 79 73.214 9.397 1.901
531 3HB ALA 79 HB3 ALA 79 73.968 10.870 2.510
532 H CYS 80 HN CYS 80 74.282 6.732 3.440
533 HA CYS 80 HA CYS 80 71.577 5.889 4.123
534 1HB CYS 80 HB2 CYS 80 72.855 4.776 2.398
535 2HB CYS 80 HB1 CYS 80 74.176 4.452 3.513
536 H LYS 81 HN LYS 81 71.224 4.153 5.848
537 HA LYS 81 HA LYS 81 72.813 4.865 8.281
538 1HB LYS 81 HB2 LYS 81 70.747 4.285 9.500
539 2HB LYS 81 HB1 LYS 81 70.441 5.502 8.263
540 1HG LYS 81 HG2 LYS 81 68.700 4.069 7.792
541 2HG LYS 81 HG1 LYS 81 69.936 3.320 6.788
542 1HD LYS 81 HD2 LYS 81 70.482 2.032 9.065
543 2HD LYS 81 HD1 LYS 81 68.788 2.399 9.386
544 1HE LYS 81 HE2 LYS 81 68.489 1.487 6.883
545 2HE LYS 81 HE1 LYS 81 69.960 0.596 7.304
546 1HZ LYS 81 HZ1 LYS 81 67.414 -0.046 8.081
547 2HZ LYS 81 HZ2 LYS 81 68.093 0.664 9.466
548 3HZ LYS 81 HZ3 LYS 81 68.848 -0.673 8.734
549 H ILE 82 HN ILE 82 71.194 2.000 6.793
550 HA ILE 82 HA ILE 82 71.583 -0.307 7.214
551 HB ILE 82 HB ILE 82 74.307 1.014 7.301
552 1HG1 ILE 82 HG12 ILE 82 72.925 1.010 5.190
553 2HG1 ILE 82 HG11 ILE 82 74.479 0.198 5.032
554 1HG2 ILE 82 HG21 ILE 82 74.507 -1.746 6.626
555 2HG2 ILE 82 HG22 ILE 82 73.604 -1.641 8.137
556 3HG2 ILE 82 HG23 ILE 82 75.209 -0.921 8.018
557 1HD1 ILE 82 HD1 ILE 82 73.518 -1.850 4.757
558 2HD1 ILE 82 HD1 ILE 82 72.107 -0.906 4.272
559 3HD1 ILE 82 HD1 ILE 82 72.238 -1.517 5.922
560 H SER 83 HN SER 83 70.417 0.200 9.406
561 HA SER 83 HA SER 83 72.314 -0.431 11.643
562 1HB SER 83 HB2 SER 83 71.654 1.869 11.837
563 2HB SER 83 HB1 SER 83 69.973 1.483 11.483
564 HG SER 83 HG SER 83 71.497 0.896 13.794
565 H GLY 84 HN GLY 84 69.031 -0.077 12.528
566 1HA GLY 84 HA2 GLY 84 68.814 -2.914 13.133
567 2HA GLY 84 HA1 GLY 84 67.574 -1.693 13.429
568 H CYS 85 HN CYS 85 69.157 -3.231 10.598
569 HA CYS 85 HA CYS 85 66.585 -4.124 9.554
570 1HB CYS 85 HB2 CYS 85 66.959 -1.516 9.214
571 2HB CYS 85 HB1 CYS 85 67.949 -2.061 7.862
572 H THR 86 HN THR 86 67.080 -4.546 6.975
573 HA THR 86 HA THR 86 69.719 -5.246 6.155
574 HB THR 86 HB THR 86 69.638 -6.776 8.049
575 HG1 THR 86 HG1 THR 86 69.419 -8.830 6.673
576 1HG2 THR 86 HG21 THR 86 67.230 -6.876 8.372
577 2HG2 THR 86 HG22 THR 86 67.842 -8.516 8.152
578 3HG2 THR 86 HG23 THR 86 67.024 -7.693 6.823
579 H PHE 87 HN PHE 87 69.626 -6.607 4.147
580 HA PHE 87 HA PHE 87 66.874 -6.568 2.943
581 1HB PHE 87 HB2 PHE 87 69.386 -6.423 1.309
582 2HB PHE 87 HB1 PHE 87 67.797 -5.745 0.967
583 HD1 PHE 87 HD1 PHE 87 67.315 -4.376 3.647
584 HD2 PHE 87 HD2 PHE 87 70.747 -4.510 1.069
585 HE1 PHE 87 HE1 PHE 87 68.081 -2.189 4.550
586 HE2 PHE 87 HE2 PHE 87 71.502 -2.334 1.961
587 HZ PHE 87 HZ PHE 87 70.176 -1.171 3.702
588 H SER 88 HN SER 88 66.647 -8.199 1.138
589 HA SER 88 HA SER 88 68.449 -10.559 1.362
590 1HB SER 88 HB2 SER 88 66.488 -10.604 3.024
591 2HB SER 88 HB1 SER 88 65.438 -10.758 1.618
592 HG SER 88 HG SER 88 66.675 -12.619 1.043
593 H ALA 89 HN ALA 89 67.540 -8.427 -0.681
594 HA ALA 89 HA ALA 89 67.032 -8.373 -2.989
595 1HB ALA 89 HB1 ALA 89 68.087 -10.125 -4.174
596 2HB ALA 89 HB2 ALA 89 67.691 -11.317 -2.936
597 3HB ALA 89 HB3 ALA 89 68.943 -10.113 -2.631
598 H ASN 90 HN ASN 90 64.710 -8.366 -1.800
599 HA ASN 90 HA ASN 90 62.966 -10.548 -1.771
600 1HB ASN 90 HB2 ASN 90 61.343 -8.897 -1.539
601 2HB ASN 90 HB1 ASN 90 62.791 -7.948 -1.220
602 1HD2 ASN 90 HD2 ASN 90 63.826 -7.423 -3.720
603 2HD2 ASN 90 HD2 ASN 90 62.699 -6.591 -4.677
Start of MODEL 20
1 1H ASP 1 HT1 ASP 1 45.708 8.469 5.389
2 2H ASP 1 HT2 ASP 1 47.220 8.789 6.096
3 3H ASP 1 HT3 ASP 1 46.478 7.276 6.316
4 HA ASP 1 HA ASP 1 48.082 8.234 4.109
5 1HB ASP 1 HB2 ASP 1 47.149 5.498 5.040
6 2HB ASP 1 HB1 ASP 1 48.560 5.847 4.039
7 H GLY 2 HN GLY 2 47.517 6.137 2.303
8 1HA GLY 2 HA2 GLY 2 44.674 6.305 1.569
9 2HA GLY 2 HA1 GLY 2 45.778 7.115 0.458
10 H SER 3 HN SER 3 44.210 4.901 -0.343
11 HA SER 3 HA SER 3 45.556 2.382 -0.179
12 1HB SER 3 HB2 SER 3 43.251 2.591 -0.891
13 2HB SER 3 HB1 SER 3 43.707 3.644 -2.228
14 HG SER 3 HG SER 3 44.654 1.939 -3.241
15 H CYS 4 HN CYS 4 45.657 4.907 -2.727
16 HA CYS 4 HA CYS 4 47.331 5.360 -4.341
17 1HB CYS 4 HB2 CYS 4 48.488 4.983 -1.908
18 2HB CYS 4 HB1 CYS 4 49.289 3.710 -2.830
19 H THR 5 HN THR 5 49.263 3.943 -5.529
20 HA THR 5 HA THR 5 48.464 1.117 -5.887
21 HB THR 5 HB THR 5 48.383 3.123 -8.168
22 HG1 THR 5 HG1 THR 5 46.340 1.957 -6.595
23 1HG2 THR 5 HG21 THR 5 47.006 1.053 -9.093
24 2HG2 THR 5 HG22 THR 5 47.974 0.164 -7.917
25 3HG2 THR 5 HG23 THR 5 48.763 1.075 -9.200
26 H ASN 6 HN ASN 6 50.840 3.024 -5.232
27 HA ASN 6 HA ASN 6 53.087 3.406 -6.080
28 1HB ASN 6 HB2 ASN 6 54.167 1.104 -5.580
29 2HB ASN 6 HB1 ASN 6 53.263 1.888 -4.289
30 1HD2 ASN 6 HD2 ASN 6 52.643 -0.118 -3.252
31 2HD2 ASN 6 HD2 ASN 6 51.548 -1.198 -3.970
32 H THR 7 HN THR 7 51.895 3.485 -8.477
33 HA THR 7 HA THR 7 52.192 2.958 -10.763
34 HB THR 7 HB THR 7 54.740 1.836 -9.548
35 HG1 THR 7 HG1 THR 7 54.607 4.254 -10.914
36 1HG2 THR 7 HG21 THR 7 55.036 1.033 -11.649
37 2HG2 THR 7 HG22 THR 7 55.346 2.714 -12.078
38 3HG2 THR 7 HG23 THR 7 53.740 2.026 -12.311
39 H ASN 8 HN ASN 8 50.468 1.264 -9.654
40 HA ASN 8 HA ASN 8 49.474 -0.856 -9.931
41 1HB ASN 8 HB2 ASN 8 51.555 -0.566 -12.033
42 2HB ASN 8 HB1 ASN 8 50.928 -2.186 -11.757
43 1HD2 ASN 8 HD2 ASN 8 50.419 -0.557 -14.151
44 2HD2 ASN 8 HD2 ASN 8 48.743 -0.298 -14.216
45 H SER 9 HN SER 9 50.071 -1.567 -7.769
46 HA SER 9 HA SER 9 51.801 -3.919 -7.761
47 1HB SER 9 HB2 SER 9 52.749 -1.999 -5.745
48 2HB SER 9 HB1 SER 9 53.673 -3.021 -6.839
49 HG SER 9 HG SER 9 53.631 -1.488 -8.337
50 H GLN 10 HN GLN 10 52.256 -3.662 -4.835
51 HA GLN 10 HA GLN 10 49.415 -3.859 -3.883
52 1HB GLN 10 HB2 GLN 10 51.543 -5.802 -4.061
53 2HB GLN 10 HB1 GLN 10 51.091 -5.572 -2.371
54 1HG GLN 10 HG2 GLN 10 49.365 -6.970 -2.785
55 2HG GLN 10 HG1 GLN 10 48.644 -5.637 -3.688
56 1HE2 GLN 10 HE21 GLN 10 51.512 -7.630 -4.555
57 2HE2 GLN 10 HE22 GLN 10 50.856 -8.211 -6.009
58 H LEU 11 HN LEU 11 49.330 -1.903 -2.724
59 HA LEU 11 HA LEU 11 51.514 -1.348 -0.746
60 1HB LEU 11 HB2 LEU 11 50.892 0.383 -2.426
61 2HB LEU 11 HB1 LEU 11 49.243 0.375 -1.800
62 HG LEU 11 HG LEU 11 50.034 1.101 0.395
63 1HD1 LEU 11 HD1 LEU 11 52.709 0.634 -0.893
64 2HD1 LEU 11 HD1 LEU 11 52.138 0.144 0.702
65 3HD1 LEU 11 HD1 LEU 11 52.559 1.830 0.398
66 1HD2 LEU 11 HD2 LEU 11 51.237 3.292 -0.435
67 2HD2 LEU 11 HD2 LEU 11 49.563 2.990 -0.900
68 3HD2 LEU 11 HD2 LEU 11 50.870 2.659 -2.040
69 H SER 12 HN SER 12 50.896 -2.681 0.975
70 HA SER 12 HA SER 12 48.518 -3.474 2.033
71 1HB SER 12 HB2 SER 12 51.153 -2.998 2.917
72 2HB SER 12 HB1 SER 12 50.114 -2.292 4.140
73 HG SER 12 HG SER 12 49.842 -4.267 4.783
74 H ALA 13 HN ALA 13 46.669 -2.540 2.847
75 HA ALA 13 HA ALA 13 45.919 0.130 2.548
76 1HB ALA 13 HB1 ALA 13 45.004 -1.379 4.961
77 2HB ALA 13 HB2 ALA 13 44.738 -2.122 3.381
78 3HB ALA 13 HB3 ALA 13 44.046 -0.538 3.740
79 H ASN 14 HN ASN 14 47.956 -1.264 5.005
80 HA ASN 14 HA ASN 14 47.727 1.143 6.721
81 1HB ASN 14 HB2 ASN 14 49.269 -0.310 8.165
82 2HB ASN 14 HB1 ASN 14 47.645 -0.922 7.884
83 1HD2 ASN 14 HD2 ASN 14 50.923 -1.129 6.371
84 2HD2 ASN 14 HD2 ASN 14 50.770 -2.761 5.932
85 H SER 15 HN SER 15 49.733 -0.019 4.189
86 HA SER 15 HA SER 15 52.270 1.052 5.001
87 1HB SER 15 HB2 SER 15 51.551 -0.526 3.051
88 2HB SER 15 HB1 SER 15 51.233 0.964 2.166
89 HG SER 15 HG SER 15 53.309 1.342 2.055
90 H LYS 16 HN LYS 16 53.156 2.952 3.378
91 HA LYS 16 HA LYS 16 51.160 5.190 3.523
92 1HB LYS 16 HB2 LYS 16 53.294 4.847 5.167
93 2HB LYS 16 HB1 LYS 16 54.052 5.764 3.864
94 1HG LYS 16 HG2 LYS 16 51.891 7.275 4.101
95 2HG LYS 16 HG1 LYS 16 51.848 6.584 5.725
96 1HD LYS 16 HD2 LYS 16 54.026 7.426 6.244
97 2HD LYS 16 HD1 LYS 16 54.343 7.840 4.560
98 1HE LYS 16 HE2 LYS 16 53.761 9.860 5.886
99 2HE LYS 16 HE1 LYS 16 52.524 9.542 4.655
100 1HZ LYS 16 HZ1 LYS 16 52.243 8.195 7.231
101 2HZ LYS 16 HZ2 LYS 16 51.045 8.791 6.185
102 3HZ LYS 16 HZ3 LYS 16 51.902 9.857 7.192
103 H CYS 17 HN CYS 17 51.241 6.680 1.800
104 HA CYS 17 HA CYS 17 53.141 6.021 -0.430
105 1HB CYS 17 HB2 CYS 17 50.492 5.523 -0.430
106 2HB CYS 17 HB1 CYS 17 50.454 7.199 -0.972
107 H GLU 18 HN GLU 18 54.569 7.735 -0.469
108 HA GLU 18 HA GLU 18 53.467 10.493 -0.058
109 1HB GLU 18 HB2 GLU 18 55.463 9.148 1.249
110 2HB GLU 18 HB1 GLU 18 56.382 10.016 0.018
111 1HG GLU 18 HG2 GLU 18 56.288 11.778 1.437
112 2HG GLU 18 HG1 GLU 18 54.614 11.940 0.904
113 H LYS 19 HN LYS 19 56.130 11.477 -1.130
114 HA LYS 19 HA LYS 19 55.338 11.500 -3.988
115 1HB LYS 19 HB2 LYS 19 57.054 13.341 -4.037
116 2HB LYS 19 HB1 LYS 19 55.773 13.610 -2.855
117 1HG LYS 19 HG2 LYS 19 57.269 13.654 -1.176
118 2HG LYS 19 HG1 LYS 19 57.889 12.071 -1.646
119 1HD LYS 19 HD2 LYS 19 58.849 13.875 -3.593
120 2HD LYS 19 HD1 LYS 19 59.084 14.674 -2.037
121 1HE LYS 19 HE2 LYS 19 60.393 12.858 -1.187
122 2HE LYS 19 HE1 LYS 19 59.917 11.801 -2.532
123 1HZ LYS 19 HZ1 LYS 19 62.096 12.779 -2.930
124 2HZ LYS 19 HZ2 LYS 19 61.443 14.341 -2.782
125 3HZ LYS 19 HZ3 LYS 19 60.972 13.338 -4.069
126 H SER 20 HN SER 20 57.021 9.354 -2.290
127 HA SER 20 HA SER 20 59.616 9.195 -3.491
128 1HB SER 20 HB2 SER 20 59.704 7.244 -2.270
129 2HB SER 20 HB1 SER 20 58.245 7.905 -1.537
130 HG SER 20 HG SER 20 57.211 6.288 -2.364
131 H THR 21 HN THR 21 60.204 7.360 -5.076
132 HA THR 21 HA THR 21 58.262 7.411 -7.335
133 HB THR 21 HB THR 21 61.205 6.714 -7.088
134 HG1 THR 21 HG1 THR 21 60.710 8.917 -6.934
135 1HG2 THR 21 HG21 THR 21 60.038 5.412 -8.869
136 2HG2 THR 21 HG22 THR 21 61.217 6.549 -9.518
137 3HG2 THR 21 HG23 THR 21 59.497 6.931 -9.581
138 H LEU 22 HN LEU 22 56.873 5.687 -7.219
139 HA LEU 22 HA LEU 22 57.863 3.070 -6.201
140 1HB LEU 22 HB2 LEU 22 55.110 4.153 -6.877
141 2HB LEU 22 HB1 LEU 22 55.416 2.571 -6.163
142 HG LEU 22 HG LEU 22 54.888 3.988 -4.328
143 1HD1 LEU 22 HD1 LEU 22 56.998 2.587 -4.128
144 2HD1 LEU 22 HD1 LEU 22 56.895 3.955 -3.018
145 3HD1 LEU 22 HD1 LEU 22 57.911 4.060 -4.458
146 1HD2 LEU 22 HD2 LEU 22 55.501 6.216 -4.121
147 2HD2 LEU 22 HD2 LEU 22 55.453 6.070 -5.878
148 3HD2 LEU 22 HD2 LEU 22 56.996 5.998 -5.029
149 H THR 23 HN THR 23 57.853 1.215 -7.494
150 HA THR 23 HA THR 23 56.743 1.331 -10.246
151 HB THR 23 HB THR 23 59.670 1.009 -9.522
152 HG1 THR 23 HG1 THR 23 59.370 2.611 -11.517
153 1HG2 THR 23 HG21 THR 23 58.126 -0.060 -11.794
154 2HG2 THR 23 HG22 THR 23 59.717 -0.530 -11.191
155 3HG2 THR 23 HG23 THR 23 59.555 0.868 -12.256
156 H ASN 24 HN ASN 24 55.463 -0.505 -10.053
157 HA ASN 24 HA ASN 24 54.889 -2.770 -9.660
158 1HB ASN 24 HB2 ASN 24 57.845 -2.781 -10.322
159 2HB ASN 24 HB1 ASN 24 56.988 -4.285 -9.986
160 1HD2 ASN 24 HD2 ASN 24 56.249 -1.302 -11.907
161 2HD2 ASN 24 HD2 ASN 24 55.729 -2.151 -13.282
162 H CYS 25 HN CYS 25 55.253 -1.191 -7.351
163 HA CYS 25 HA CYS 25 57.076 -2.293 -5.428
164 1HB CYS 25 HB2 CYS 25 54.493 -0.719 -5.260
165 2HB CYS 25 HB1 CYS 25 55.514 -1.038 -3.861
166 H TYR 26 HN TYR 26 55.329 -2.750 -3.221
167 HA TYR 26 HA TYR 26 53.281 -4.640 -3.444
168 1HB TYR 26 HB2 TYR 26 54.781 -6.020 -4.773
169 2HB TYR 26 HB1 TYR 26 56.094 -5.795 -3.625
170 HD1 TYR 26 HD1 TYR 26 56.148 -8.368 -3.746
171 HD2 TYR 26 HD2 TYR 26 52.882 -6.155 -2.050
172 HE1 TYR 26 HE1 TYR 26 55.404 -10.397 -2.533
173 HE2 TYR 26 HE2 TYR 26 52.141 -8.183 -0.832
174 HH TYR 26 HH TYR 26 52.367 -10.475 -0.777
175 H VAL 27 HN VAL 27 53.902 -2.635 -1.727
176 HA VAL 27 HA VAL 27 55.420 -3.394 0.590
177 HB VAL 27 HB VAL 27 53.175 -1.376 0.414
178 1HG1 VAL 27 HG11 VAL 27 55.613 -1.808 2.108
179 2HG1 VAL 27 HG12 VAL 27 53.982 -1.347 2.597
180 3HG1 VAL 27 HG13 VAL 27 55.043 -0.162 1.833
181 1HG2 VAL 27 HG21 VAL 27 54.385 -0.778 -1.489
182 2HG2 VAL 27 HG22 VAL 27 55.906 -1.396 -0.841
183 3HG2 VAL 27 HG23 VAL 27 55.247 0.128 -0.245
184 H ASP 28 HN ASP 28 54.427 -3.495 2.761
185 HA ASP 28 HA ASP 28 51.719 -4.715 2.921
186 1HB ASP 28 HB2 ASP 28 53.808 -6.314 2.520
187 2HB ASP 28 HB1 ASP 28 54.004 -6.111 4.260
188 H LYS 29 HN LYS 29 54.633 -3.516 4.538
189 HA LYS 29 HA LYS 29 53.005 -2.242 6.639
190 1HB LYS 29 HB2 LYS 29 54.729 -4.670 6.965
191 2HB LYS 29 HB1 LYS 29 54.700 -3.493 8.278
192 1HG LYS 29 HG2 LYS 29 52.064 -3.660 7.853
193 2HG LYS 29 HG1 LYS 29 52.520 -5.259 7.262
194 1HD LYS 29 HD2 LYS 29 52.257 -5.752 9.504
195 2HD LYS 29 HD1 LYS 29 53.956 -5.275 9.511
196 1HE LYS 29 HE2 LYS 29 53.511 -3.513 10.860
197 2HE LYS 29 HE1 LYS 29 52.233 -2.944 9.765
198 1HZ LYS 29 HZ1 LYS 29 51.788 -5.343 11.411
199 2HZ LYS 29 HZ2 LYS 29 50.651 -4.256 10.771
200 3HZ LYS 29 HZ3 LYS 29 51.595 -3.811 12.112
201 H SER 30 HN SER 30 54.316 -0.649 4.999
202 HA SER 30 HA SER 30 56.792 0.120 6.481
203 1HB SER 30 HB2 SER 30 56.479 -0.509 3.544
204 2HB SER 30 HB1 SER 30 57.808 0.481 4.141
205 HG SER 30 HG SER 30 57.169 -2.205 4.763
206 H GLU 31 HN GLU 31 57.614 2.283 5.247
207 HA GLU 31 HA GLU 31 55.214 4.062 4.914
208 1HB GLU 31 HB2 GLU 31 57.494 4.053 6.726
209 2HB GLU 31 HB1 GLU 31 57.396 5.568 5.832
210 1HG GLU 31 HG2 GLU 31 55.360 6.147 6.751
211 2HG GLU 31 HG1 GLU 31 54.868 4.469 6.980
212 H VAL 32 HN VAL 32 58.751 4.320 4.453
213 HA VAL 32 HA VAL 32 60.019 4.910 2.551
214 HB VAL 32 HB VAL 32 57.424 4.569 1.030
215 1HG1 VAL 32 HG11 VAL 32 60.359 4.490 0.391
216 2HG1 VAL 32 HG12 VAL 32 59.072 5.375 -0.426
217 3HG1 VAL 32 HG13 VAL 32 59.200 3.627 -0.621
218 1HG2 VAL 32 HG21 VAL 32 59.430 2.406 1.727
219 2HG2 VAL 32 HG22 VAL 32 57.878 2.204 0.914
220 3HG2 VAL 32 HG23 VAL 32 57.929 2.646 2.619
221 H TYR 33 HN TYR 33 60.179 6.713 0.923
222 HA TYR 33 HA TYR 33 58.210 8.894 1.103
223 1HB TYR 33 HB2 TYR 33 60.904 8.898 2.470
224 2HB TYR 33 HB1 TYR 33 60.113 10.404 2.015
225 HD1 TYR 33 HD1 TYR 33 57.714 10.804 2.834
226 HD2 TYR 33 HD2 TYR 33 60.283 7.763 4.442
227 HE1 TYR 33 HE1 TYR 33 56.292 10.677 4.864
228 HE2 TYR 33 HE2 TYR 33 58.864 7.632 6.471
229 HH TYR 33 HH TYR 33 57.264 8.868 7.680
230 H GLY 34 HN GLY 34 61.642 8.202 0.279
231 1HA GLY 34 HA2 GLY 34 61.147 9.554 -2.348
232 2HA GLY 34 HA1 GLY 34 62.669 9.728 -1.475
233 H THR 35 HN THR 35 61.775 6.640 -0.881
234 HA THR 35 HA THR 35 63.804 5.358 -2.314
235 HB THR 35 HB THR 35 61.057 4.430 -1.444
236 HG1 THR 35 HG1 THR 35 63.098 5.175 -0.077
237 1HG2 THR 35 HG21 THR 35 63.330 2.966 -2.691
238 2HG2 THR 35 HG22 THR 35 61.595 2.675 -2.821
239 3HG2 THR 35 HG23 THR 35 62.466 2.172 -1.373
240 H THR 36 HN THR 36 63.623 3.918 -4.256
241 HA THR 36 HA THR 36 61.878 5.157 -6.340
242 HB THR 36 HB THR 36 63.795 3.313 -7.390
243 HG1 THR 36 HG1 THR 36 65.297 3.441 -5.943
244 1HG2 THR 36 HG21 THR 36 62.872 5.949 -7.783
245 2HG2 THR 36 HG22 THR 36 63.986 5.044 -8.813
246 3HG2 THR 36 HG23 THR 36 64.614 6.082 -7.531
247 H CYS 37 HN CYS 37 62.284 2.289 -4.479
248 HA CYS 37 HA CYS 37 61.192 0.190 -4.546
249 1HB CYS 37 HB2 CYS 37 59.379 1.995 -4.408
250 2HB CYS 37 HB1 CYS 37 59.156 1.760 -6.137
251 H THR 38 HN THR 38 62.464 -1.106 -5.943
252 HA THR 38 HA THR 38 61.718 -1.032 -8.850
253 HB THR 38 HB THR 38 64.234 -1.854 -7.370
254 HG1 THR 38 HG1 THR 38 63.957 0.361 -7.790
255 1HG2 THR 38 HG21 THR 38 64.696 -3.253 -9.068
256 2HG2 THR 38 HG22 THR 38 64.654 -1.875 -10.167
257 3HG2 THR 38 HG23 THR 38 63.193 -2.818 -9.879
258 H GLY 39 HN GLY 39 59.904 -2.481 -8.545
259 1HA GLY 39 HA2 GLY 39 58.847 -4.555 -8.183
260 2HA GLY 39 HA1 GLY 39 60.303 -5.197 -8.943
261 H SER 40 HN SER 40 59.537 -3.728 -5.757
262 HA SER 40 HA SER 40 60.797 -6.133 -4.482
263 1HB SER 40 HB2 SER 40 62.493 -4.586 -4.196
264 2HB SER 40 HB1 SER 40 61.392 -3.215 -4.277
265 HG SER 40 HG SER 40 60.833 -3.537 -2.189
266 H ARG 41 HN ARG 41 60.319 -5.766 -1.895
267 HA ARG 41 HA ARG 41 57.607 -4.677 -1.436
268 1HB ARG 41 HB2 ARG 41 56.889 -6.993 -0.622
269 2HB ARG 41 HB1 ARG 41 57.090 -6.831 -2.367
270 1HG ARG 41 HG2 ARG 41 59.103 -8.020 -2.383
271 2HG ARG 41 HG1 ARG 41 59.413 -7.713 -0.674
272 1HD ARG 41 HD2 ARG 41 57.550 -9.218 -0.054
273 2HD ARG 41 HD1 ARG 41 57.238 -9.532 -1.774
274 HE ARG 41 HE ARG 41 59.914 -10.077 -1.564
275 1HH1 ARG 41 HH2 ARG 41 57.194 -11.845 -1.236
276 2HH1 ARG 41 HH2 ARG 41 57.817 -13.006 -0.112
277 1HH2 ARG 41 HH1 ARG 41 60.718 -11.219 0.531
278 2HH2 ARG 41 HH1 ARG 41 59.812 -12.651 0.889
279 H PHE 42 HN PHE 42 57.152 -4.445 0.821
280 HA PHE 42 HA PHE 42 59.492 -4.977 2.628
281 1HB PHE 42 HB2 PHE 42 57.357 -2.867 2.997
282 2HB PHE 42 HB1 PHE 42 58.969 -2.924 3.709
283 HD1 PHE 42 HD1 PHE 42 57.314 -0.912 1.690
284 HD2 PHE 42 HD2 PHE 42 60.661 -3.592 1.393
285 HE1 PHE 42 HE1 PHE 42 58.209 0.411 -0.205
286 HE2 PHE 42 HE2 PHE 42 61.553 -2.268 -0.504
287 HZ PHE 42 HZ PHE 42 60.326 -0.267 -1.298
288 H ASP 43 HN ASP 43 58.467 -4.752 5.053
289 HA ASP 43 HA ASP 43 55.823 -5.937 5.393
290 1HB ASP 43 HB2 ASP 43 57.178 -7.847 4.557
291 2HB ASP 43 HB1 ASP 43 58.320 -7.598 5.879
292 H GLY 44 HN GLY 44 57.270 -3.652 6.422
293 1HA GLY 44 HA2 GLY 44 56.640 -3.053 8.844
294 2HA GLY 44 HA1 GLY 44 57.652 -4.432 9.277
295 H VAL 45 HN VAL 45 57.902 -1.423 7.301
296 HA VAL 45 HA VAL 45 60.571 -1.017 8.571
297 HB VAL 45 HB VAL 45 61.700 -0.988 6.528
298 1HG1 VAL 45 HG11 VAL 45 61.011 -2.951 5.255
299 2HG1 VAL 45 HG12 VAL 45 59.397 -2.874 5.958
300 3HG1 VAL 45 HG13 VAL 45 60.783 -3.260 6.976
301 1HG2 VAL 45 HG21 VAL 45 59.156 0.088 5.536
302 2HG2 VAL 45 HG22 VAL 45 59.916 -1.035 4.408
303 3HG2 VAL 45 HG23 VAL 45 60.800 0.386 4.972
304 H THR 46 HN THR 46 61.394 1.171 7.175
305 HA THR 46 HA THR 46 59.307 3.195 6.898
306 HB THR 46 HB THR 46 61.172 3.138 9.294
307 HG1 THR 46 HG1 THR 46 58.417 3.389 9.492
308 1HG2 THR 46 HG21 THR 46 59.477 5.279 8.079
309 2HG2 THR 46 HG22 THR 46 61.044 5.411 8.879
310 3HG2 THR 46 HG23 THR 46 59.580 5.192 9.837
311 H ILE 47 HN ILE 47 61.075 2.514 5.009
312 HA ILE 47 HA ILE 47 63.639 3.884 5.152
313 HB ILE 47 HB ILE 47 63.334 1.901 3.803
314 1HG1 ILE 47 HG12 ILE 47 63.422 4.234 1.872
315 2HG1 ILE 47 HG11 ILE 47 64.784 3.787 2.899
316 1HG2 ILE 47 HG21 ILE 47 61.717 2.564 1.668
317 2HG2 ILE 47 HG22 ILE 47 60.884 3.325 3.023
318 3HG2 ILE 47 HG23 ILE 47 61.215 1.594 3.052
319 1HD1 ILE 47 HD1 ILE 47 63.431 1.982 0.869
320 2HD1 ILE 47 HD1 ILE 47 64.780 1.520 1.908
321 3HD1 ILE 47 HD1 ILE 47 65.005 2.758 0.669
322 H THR 48 HN THR 48 64.188 5.530 3.364
323 HA THR 48 HA THR 48 61.910 7.394 2.824
324 HB THR 48 HB THR 48 63.495 9.235 3.495
325 HG1 THR 48 HG1 THR 48 65.384 8.646 4.515
326 1HG2 THR 48 HG21 THR 48 61.994 8.741 5.197
327 2HG2 THR 48 HG22 THR 48 63.537 8.446 6.000
328 3HG2 THR 48 HG23 THR 48 62.592 7.091 5.383
329 H THR 49 HN THR 49 64.212 9.241 1.839
330 HA THR 49 HA THR 49 64.096 8.563 -0.944
331 HB THR 49 HB THR 49 65.978 10.290 0.695
332 HG1 THR 49 HG1 THR 49 63.907 11.197 -0.966
333 1HG2 THR 49 HG21 THR 49 66.585 11.374 -1.380
334 2HG2 THR 49 HG22 THR 49 65.440 10.384 -2.283
335 3HG2 THR 49 HG23 THR 49 66.870 9.643 -1.560
336 H SER 50 HN SER 50 64.886 6.310 -1.107
337 HA SER 50 HA SER 50 67.863 6.191 -1.074
338 1HB SER 50 HB2 SER 50 65.940 4.390 0.418
339 2HB SER 50 HB1 SER 50 67.609 3.933 0.094
340 HG SER 50 HG SER 50 66.733 5.383 2.072
341 H THR 51 HN THR 51 68.695 4.759 -2.632
342 HA THR 51 HA THR 51 66.698 3.708 -4.581
343 HB THR 51 HB THR 51 69.440 3.446 -5.372
344 HG1 THR 51 HG1 THR 51 69.692 5.886 -5.242
345 1HG2 THR 51 HG21 THR 51 66.959 4.403 -6.353
346 2HG2 THR 51 HG22 THR 51 68.443 4.133 -7.266
347 3HG2 THR 51 HG23 THR 51 68.124 5.711 -6.546
348 H SER 52 HN SER 52 66.201 1.572 -4.346
349 HA SER 52 HA SER 52 68.399 -0.323 -3.624
350 1HB SER 52 HB2 SER 52 65.655 -0.804 -2.565
351 2HB SER 52 HB1 SER 52 67.216 -1.137 -1.821
352 HG SER 52 HG SER 52 66.868 0.643 -0.769
353 H THR 53 HN THR 53 68.503 -1.892 -5.170
354 HA THR 53 HA THR 53 66.059 -2.414 -6.823
355 HB THR 53 HB THR 53 68.747 -3.393 -7.631
356 HG1 THR 53 HG1 THR 53 69.392 -1.448 -6.860
357 1HG2 THR 53 HG21 THR 53 66.440 -1.951 -8.953
358 2HG2 THR 53 HG22 THR 53 66.936 -3.627 -9.183
359 3HG2 THR 53 HG23 THR 53 67.950 -2.318 -9.791
360 H GLY 54 HN GLY 54 65.050 -4.096 -5.660
361 1HA GLY 54 HA2 GLY 54 64.728 -6.380 -5.140
362 2HA GLY 54 HA1 GLY 54 66.341 -6.710 -5.779
363 H SER 55 HN SER 55 64.586 -5.543 -2.937
364 HA SER 55 HA SER 55 66.689 -6.643 -1.191
365 1HB SER 55 HB2 SER 55 66.848 -4.290 -0.114
366 2HB SER 55 HB1 SER 55 67.676 -4.541 -1.648
367 HG SER 55 HG SER 55 65.933 -3.581 -2.694
368 H ARG 56 HN ARG 56 65.432 -7.715 0.296
369 HA ARG 56 HA ARG 56 62.681 -6.955 0.882
370 1HB ARG 56 HB2 ARG 56 64.362 -9.188 1.108
371 2HB ARG 56 HB1 ARG 56 63.992 -8.747 2.775
372 1HG ARG 56 HG2 ARG 56 61.560 -8.499 1.383
373 2HG ARG 56 HG1 ARG 56 62.283 -10.000 0.801
374 1HD ARG 56 HD2 ARG 56 62.153 -9.360 3.758
375 2HD ARG 56 HD1 ARG 56 60.830 -10.194 2.920
376 HE ARG 56 HE ARG 56 62.419 -11.973 2.315
377 1HH1 ARG 56 HH1 ARG 56 62.848 -10.329 5.209
378 2HH1 ARG 56 HH1 ARG 56 64.435 -10.946 5.529
379 1HH2 ARG 56 HH2 ARG 56 64.762 -12.451 2.421
380 2HH2 ARG 56 HH2 ARG 56 65.516 -12.152 3.951
381 H ILE 57 HN ILE 57 62.372 -5.075 2.080
382 HA ILE 57 HA ILE 57 64.339 -4.283 4.128
383 HB ILE 57 HB ILE 57 61.683 -3.014 3.424
384 1HG1 ILE 57 HG12 ILE 57 62.797 -3.280 1.322
385 2HG1 ILE 57 HG11 ILE 57 63.125 -1.625 1.837
386 1HG2 ILE 57 HG21 ILE 57 64.302 -2.021 4.583
387 2HG2 ILE 57 HG22 ILE 57 62.730 -2.076 5.385
388 3HG2 ILE 57 HG23 ILE 57 63.001 -0.952 4.053
389 1HD1 ILE 57 HD1 ILE 57 65.253 -2.361 1.213
390 2HD1 ILE 57 HD1 ILE 57 64.968 -3.997 1.807
391 3HD1 ILE 57 HD1 ILE 57 65.255 -2.683 2.947
392 H SER 58 HN SER 58 61.860 -6.469 4.174
393 HA SER 58 HA SER 58 60.127 -5.979 6.261
394 1HB SER 58 HB2 SER 58 61.806 -8.442 5.697
395 2HB SER 58 HB1 SER 58 60.398 -8.436 6.754
396 HG SER 58 HG SER 58 60.323 -8.868 4.255
397 H GLY 59 HN GLY 59 60.270 -6.561 8.613
398 1HA GLY 59 HA2 GLY 59 62.256 -7.204 10.270
399 2HA GLY 59 HA1 GLY 59 62.850 -5.633 9.740
400 HA PRO 60 HA PRO 60 59.451 -5.377 13.082
401 1HB PRO 60 HB2 PRO 60 60.977 -5.424 15.359
402 2HB PRO 60 HB1 PRO 60 60.245 -6.881 14.658
403 1HG PRO 60 HG2 PRO 60 63.043 -5.876 14.439
404 2HG PRO 60 HG1 PRO 60 62.452 -7.532 14.657
405 1HD PRO 60 HD2 PRO 60 63.284 -6.572 12.261
406 2HD PRO 60 HD1 PRO 60 62.024 -7.817 12.420
407 H GLY 61 HN GLY 61 60.332 -3.396 11.540
408 1HA GLY 61 HA2 GLY 61 60.199 -0.982 12.122
409 2HA GLY 61 HA1 GLY 61 61.316 -1.314 13.447
410 H CYS 62 HN CYS 62 61.732 -2.790 10.291
411 HA CYS 62 HA CYS 62 64.447 -2.123 9.981
412 1HB CYS 62 HB2 CYS 62 62.693 -3.647 8.686
413 2HB CYS 62 HB1 CYS 62 62.606 -2.248 7.614
414 H LYS 63 HN LYS 63 65.478 -0.185 9.529
415 HA LYS 63 HA LYS 63 63.808 2.038 8.385
416 1HB LYS 63 HB2 LYS 63 66.235 2.322 10.167
417 2HB LYS 63 HB1 LYS 63 65.000 3.531 9.815
418 1HG LYS 63 HG2 LYS 63 64.540 0.949 11.323
419 2HG LYS 63 HG1 LYS 63 64.677 2.546 12.057
420 1HD LYS 63 HD2 LYS 63 62.797 2.892 10.034
421 2HD LYS 63 HD1 LYS 63 62.382 1.326 10.731
422 1HE LYS 63 HE2 LYS 63 63.003 3.158 12.870
423 2HE LYS 63 HE1 LYS 63 61.790 3.892 11.802
424 1HZ LYS 63 HZ1 LYS 63 60.457 1.943 11.916
425 2HZ LYS 63 HZ2 LYS 63 60.846 2.367 13.516
426 3HZ LYS 63 HZ3 LYS 63 61.657 1.083 12.753
427 H ILE 64 HN ILE 64 64.816 3.383 6.834
428 HA ILE 64 HA ILE 64 67.592 2.781 5.975
429 HB ILE 64 HB ILE 64 65.067 2.346 4.365
430 1HG1 ILE 64 HG12 ILE 64 66.129 0.480 5.715
431 2HG1 ILE 64 HG11 ILE 64 66.007 0.156 3.985
432 1HG2 ILE 64 HG21 ILE 64 66.639 3.760 3.055
433 2HG2 ILE 64 HG22 ILE 64 66.487 2.142 2.370
434 3HG2 ILE 64 HG23 ILE 64 67.909 2.566 3.322
435 1HD1 ILE 64 HD1 ILE 64 68.274 0.262 3.666
436 2HD1 ILE 64 HD1 ILE 64 68.305 -0.163 5.379
437 3HD1 ILE 64 HD1 ILE 64 68.488 1.520 4.883
438 H SER 65 HN SER 65 68.568 4.687 5.274
439 HA SER 65 HA SER 65 66.794 6.936 4.430
440 1HB SER 65 HB2 SER 65 68.614 8.228 5.958
441 2HB SER 65 HB1 SER 65 67.085 7.626 6.593
442 HG SER 65 HG SER 65 68.471 6.663 7.906
443 H THR 66 HN THR 66 67.524 7.504 2.453
444 HA THR 66 HA THR 66 68.985 7.856 0.638
445 HB THR 66 HB THR 66 70.987 8.793 2.646
446 HG1 THR 66 HG1 THR 66 69.575 9.997 3.601
447 1HG2 THR 66 HG21 THR 66 70.323 10.805 0.869
448 2HG2 THR 66 HG22 THR 66 70.109 9.340 -0.095
449 3HG2 THR 66 HG23 THR 66 71.663 9.673 0.674
450 H CYS 67 HN CYS 67 69.222 5.349 0.625
451 HA CYS 67 HA CYS 67 72.148 4.734 0.871
452 1HB CYS 67 HB2 CYS 67 70.885 3.723 2.755
453 2HB CYS 67 HB1 CYS 67 69.820 2.922 1.606
454 H ILE 68 HN ILE 68 72.905 4.063 -1.110
455 HA ILE 68 HA ILE 68 70.959 3.398 -3.229
456 HB ILE 68 HB ILE 68 73.977 3.716 -3.146
457 1HG1 ILE 68 HG12 ILE 68 73.406 5.791 -4.474
458 2HG1 ILE 68 HG11 ILE 68 71.706 5.477 -4.128
459 1HG2 ILE 68 HG21 ILE 68 73.870 2.502 -5.067
460 2HG2 ILE 68 HG22 ILE 68 73.194 3.974 -5.766
461 3HG2 ILE 68 HG23 ILE 68 72.120 2.694 -5.193
462 1HD1 ILE 68 HD1 ILE 68 73.690 5.597 -1.875
463 2HD1 ILE 68 HD1 ILE 68 71.955 5.901 -1.843
464 3HD1 ILE 68 HD1 ILE 68 73.046 7.090 -2.556
465 H ILE 69 HN ILE 69 70.279 1.383 -2.187
466 HA ILE 69 HA ILE 69 72.240 -0.812 -1.986
467 HB ILE 69 HB ILE 69 69.229 -0.894 -1.661
468 1HG1 ILE 69 HG12 ILE 69 70.975 -0.416 0.721
469 2HG1 ILE 69 HG11 ILE 69 70.683 0.961 -0.333
470 1HG2 ILE 69 HG21 ILE 69 70.694 -3.001 -1.647
471 2HG2 ILE 69 HG22 ILE 69 69.636 -2.765 -0.256
472 3HG2 ILE 69 HG23 ILE 69 71.355 -2.395 -0.129
473 1HD1 ILE 69 HD1 ILE 69 68.952 -0.047 1.639
474 2HD1 ILE 69 HD1 ILE 69 68.225 -0.501 0.098
475 3HD1 ILE 69 HD1 ILE 69 68.584 1.191 0.438
476 H THR 70 HN THR 70 71.839 -2.866 -3.187
477 HA THR 70 HA THR 70 70.061 -2.794 -5.532
478 HB THR 70 HB THR 70 73.082 -2.652 -5.738
479 HG1 THR 70 HG1 THR 70 72.491 -0.627 -5.759
480 1HG2 THR 70 HG21 THR 70 71.691 -4.235 -7.332
481 2HG2 THR 70 HG22 THR 70 72.943 -3.183 -7.994
482 3HG2 THR 70 HG23 THR 70 71.248 -2.713 -8.105
483 H GLY 71 HN GLY 71 69.246 -4.815 -4.790
484 1HA GLY 71 HA2 GLY 71 69.282 -7.189 -5.127
485 2HA GLY 71 HA1 GLY 71 71.034 -7.109 -5.317
486 H GLY 72 HN GLY 72 69.373 -5.553 -2.643
487 1HA GLY 72 HA2 GLY 72 69.242 -6.187 -0.365
488 2HA GLY 72 HA1 GLY 72 69.918 -7.758 -0.790
489 H VAL 73 HN VAL 73 71.640 -5.120 -2.071
490 HA VAL 73 HA VAL 73 73.685 -5.338 0.118
491 HB VAL 73 HB VAL 73 75.338 -5.232 -1.679
492 1HG1 VAL 73 HG11 VAL 73 73.621 -7.349 -1.255
493 2HG1 VAL 73 HG12 VAL 73 75.072 -7.418 -2.253
494 3HG1 VAL 73 HG13 VAL 73 73.503 -7.120 -2.998
495 1HG2 VAL 73 HG21 VAL 73 72.941 -4.349 -3.181
496 2HG2 VAL 73 HG22 VAL 73 74.044 -5.406 -4.067
497 3HG2 VAL 73 HG23 VAL 73 74.633 -3.888 -3.388
498 HA PRO 74 HA PRO 74 73.023 -0.924 0.071
499 1HB PRO 74 HB2 PRO 74 74.651 -0.354 2.187
500 2HB PRO 74 HB1 PRO 74 73.027 -1.030 2.384
501 1HG PRO 74 HG2 PRO 74 75.660 -2.349 2.630
502 2HG PRO 74 HG1 PRO 74 74.133 -2.708 3.447
503 1HD PRO 74 HD2 PRO 74 75.214 -4.120 1.293
504 2HD PRO 74 HD1 PRO 74 73.537 -4.220 1.873
505 H ALA 75 HN ALA 75 74.215 0.783 -0.850
506 HA ALA 75 HA ALA 75 76.851 0.087 -1.979
507 1HB ALA 75 HB1 ALA 75 76.457 2.420 -3.013
508 2HB ALA 75 HB2 ALA 75 74.873 2.358 -2.238
509 3HB ALA 75 HB3 ALA 75 75.311 1.151 -3.449
510 HA PRO 76 HA PRO 76 79.195 2.203 1.070
511 1HB PRO 76 HB2 PRO 76 81.352 2.943 -0.454
512 2HB PRO 76 HB1 PRO 76 81.076 1.279 0.096
513 1HG PRO 76 HG2 PRO 76 80.504 2.509 -2.558
514 2HG PRO 76 HG1 PRO 76 81.169 0.913 -2.174
515 1HD PRO 76 HD2 PRO 76 78.580 1.283 -2.875
516 2HD PRO 76 HD1 PRO 76 79.102 0.001 -1.758
517 H SER 77 HN SER 77 77.163 3.832 0.425
518 HA SER 77 HA SER 77 78.245 6.374 -0.682
519 1HB SER 77 HB2 SER 77 75.756 4.980 -0.664
520 2HB SER 77 HB1 SER 77 75.512 6.493 0.204
521 HG SER 77 HG SER 77 76.041 6.023 -2.458
522 H ALA 78 HN ALA 78 78.201 8.312 0.594
523 HA ALA 78 HA ALA 78 78.716 7.946 3.427
524 1HB ALA 78 HB1 ALA 78 78.605 10.584 3.166
525 2HB ALA 78 HB2 ALA 78 78.553 10.196 1.446
526 3HB ALA 78 HB3 ALA 78 79.924 9.675 2.426
527 H ALA 79 HN ALA 79 75.831 8.194 1.667
528 HA ALA 79 HA ALA 79 74.376 9.466 3.951
529 1HB ALA 79 HB1 ALA 79 73.275 8.847 1.214
530 2HB ALA 79 HB2 ALA 79 74.311 10.249 1.473
531 3HB ALA 79 HB3 ALA 79 72.780 10.113 2.337
532 H CYS 80 HN CYS 80 74.867 6.403 2.377
533 HA CYS 80 HA CYS 80 72.320 5.186 2.996
534 1HB CYS 80 HB2 CYS 80 73.804 4.207 1.362
535 2HB CYS 80 HB1 CYS 80 75.116 4.119 2.527
536 H LYS 81 HN LYS 81 71.581 4.496 4.993
537 HA LYS 81 HA LYS 81 73.546 4.522 7.240
538 1HB LYS 81 HB2 LYS 81 71.922 5.667 8.319
539 2HB LYS 81 HB1 LYS 81 71.021 5.689 6.806
540 1HG LYS 81 HG2 LYS 81 70.865 3.425 8.816
541 2HG LYS 81 HG1 LYS 81 69.731 4.773 8.769
542 1HD LYS 81 HD2 LYS 81 68.654 3.951 6.956
543 2HD LYS 81 HD1 LYS 81 70.159 3.504 6.151
544 1HE LYS 81 HE2 LYS 81 68.743 1.509 6.739
545 2HE LYS 81 HE1 LYS 81 70.321 1.483 7.549
546 1HZ LYS 81 HZ1 LYS 81 69.427 2.162 9.540
547 2HZ LYS 81 HZ2 LYS 81 68.171 1.179 8.948
548 3HZ LYS 81 HZ3 LYS 81 68.064 2.871 8.821
549 H ILE 82 HN ILE 82 72.928 2.889 9.023
550 HA ILE 82 HA ILE 82 71.595 0.415 8.236
551 HB ILE 82 HB ILE 82 74.526 0.863 7.904
552 1HG1 ILE 82 HG12 ILE 82 73.561 -1.374 6.466
553 2HG1 ILE 82 HG11 ILE 82 72.271 -0.172 6.425
554 1HG2 ILE 82 HG21 ILE 82 74.802 -0.730 9.620
555 2HG2 ILE 82 HG22 ILE 82 74.790 -1.714 8.157
556 3HG2 ILE 82 HG23 ILE 82 73.344 -1.611 9.162
557 1HD1 ILE 82 HD1 ILE 82 74.295 1.473 5.902
558 2HD1 ILE 82 HD1 ILE 82 73.529 0.536 4.618
559 3HD1 ILE 82 HD1 ILE 82 75.049 -0.015 5.324
560 H SER 83 HN SER 83 70.538 0.773 10.302
561 HA SER 83 HA SER 83 72.346 0.467 12.675
562 1HB SER 83 HB2 SER 83 70.447 2.423 11.981
563 2HB SER 83 HB1 SER 83 69.674 1.456 13.233
564 HG SER 83 HG SER 83 72.338 2.375 13.461
565 H GLY 84 HN GLY 84 68.924 -0.147 11.775
566 1HA GLY 84 HA2 GLY 84 69.219 -2.902 12.852
567 2HA GLY 84 HA1 GLY 84 67.962 -1.873 13.537
568 H CYS 85 HN CYS 85 69.092 -2.436 10.177
569 HA CYS 85 HA CYS 85 66.246 -3.084 9.489
570 1HB CYS 85 HB2 CYS 85 67.523 -0.839 8.781
571 2HB CYS 85 HB1 CYS 85 68.146 -1.887 7.511
572 H THR 86 HN THR 86 67.088 -3.609 6.700
573 HA THR 86 HA THR 86 69.152 -5.448 6.323
574 HB THR 86 HB THR 86 68.441 -6.846 8.071
575 HG1 THR 86 HG1 THR 86 66.970 -7.790 5.846
576 1HG2 THR 86 HG21 THR 86 65.792 -7.463 7.907
577 2HG2 THR 86 HG22 THR 86 65.773 -5.796 7.332
578 3HG2 THR 86 HG23 THR 86 66.431 -6.172 8.926
579 H PHE 87 HN PHE 87 69.068 -6.289 4.231
580 HA PHE 87 HA PHE 87 66.581 -5.677 2.670
581 1HB PHE 87 HB2 PHE 87 69.319 -6.309 1.568
582 2HB PHE 87 HB1 PHE 87 68.018 -5.406 0.803
583 HD1 PHE 87 HD1 PHE 87 70.934 -4.524 1.137
584 HD2 PHE 87 HD2 PHE 87 67.406 -3.822 3.500
585 HE1 PHE 87 HE1 PHE 87 71.912 -2.413 1.974
586 HE2 PHE 87 HE2 PHE 87 68.396 -1.700 4.337
587 HZ PHE 87 HZ PHE 87 70.650 -0.998 3.572
588 H SER 88 HN SER 88 69.294 -8.000 2.425
589 HA SER 88 HA SER 88 69.274 -10.359 2.195
590 1HB SER 88 HB2 SER 88 67.108 -9.709 3.773
591 2HB SER 88 HB1 SER 88 66.352 -10.599 2.454
592 HG SER 88 HG SER 88 68.002 -11.466 4.461
593 H ALA 89 HN ALA 89 68.045 -8.180 0.125
594 HA ALA 89 HA ALA 89 67.324 -8.290 -2.130
595 1HB ALA 89 HB1 ALA 89 68.049 -11.069 -2.539
596 2HB ALA 89 HB2 ALA 89 69.276 -10.250 -1.571
597 3HB ALA 89 HB3 ALA 89 68.840 -9.619 -3.161
598 H ASN 90 HN ASN 90 65.027 -8.262 -1.456
599 HA ASN 90 HA ASN 90 63.486 -10.502 -0.709
600 1HB ASN 90 HB2 ASN 90 61.648 -9.097 -1.230
601 2HB ASN 90 HB1 ASN 90 62.955 -7.969 -0.880
602 1HD2 ASN 90 HD2 ASN 90 62.942 -6.287 -2.383
603 2HD2 ASN 90 HD2 ASN 90 62.603 -6.458 -4.038
Start of MODEL 21
1 1H ASP 1 HT1 ASP 1 48.250 5.649 0.779
2 2H ASP 1 HT2 ASP 1 48.310 4.026 1.277
3 3H ASP 1 HT3 ASP 1 49.489 5.126 1.811
4 HA ASP 1 HA ASP 1 47.869 4.686 3.571
5 1HB ASP 1 HB2 ASP 1 47.589 7.027 4.072
6 2HB ASP 1 HB1 ASP 1 49.078 6.889 3.135
7 H GLY 2 HN GLY 2 46.545 4.198 0.734
8 1HA GLY 2 HA2 GLY 2 43.889 3.854 1.589
9 2HA GLY 2 HA1 GLY 2 43.960 5.457 0.855
10 H SER 3 HN SER 3 44.953 2.092 0.167
11 HA SER 3 HA SER 3 45.019 0.921 -1.882
12 1HB SER 3 HB2 SER 3 42.876 2.647 -2.981
13 2HB SER 3 HB1 SER 3 42.922 0.897 -2.794
14 HG SER 3 HG SER 3 42.142 2.891 -0.999
15 H CYS 4 HN CYS 4 47.080 2.558 -1.997
16 HA CYS 4 HA CYS 4 46.820 4.395 -4.322
17 1HB CYS 4 HB2 CYS 4 48.116 4.567 -1.932
18 2HB CYS 4 HB1 CYS 4 49.416 3.954 -2.954
19 H THR 5 HN THR 5 47.945 1.224 -3.508
20 HA THR 5 HA THR 5 48.903 -0.477 -4.815
21 HB THR 5 HB THR 5 48.164 1.531 -6.967
22 HG1 THR 5 HG1 THR 5 46.909 -0.914 -6.610
23 1HG2 THR 5 HG21 THR 5 49.366 -1.217 -7.108
24 2HG2 THR 5 HG22 THR 5 49.758 0.215 -8.060
25 3HG2 THR 5 HG23 THR 5 48.267 -0.672 -8.374
26 H ASN 6 HN ASN 6 50.345 2.381 -4.157
27 HA ASN 6 HA ASN 6 52.614 3.035 -4.224
28 1HB ASN 6 HB2 ASN 6 53.753 1.118 -3.824
29 2HB ASN 6 HB1 ASN 6 52.420 0.192 -4.489
30 1HD2 ASN 6 HD2 ASN 6 55.171 2.185 -5.747
31 2HD2 ASN 6 HD2 ASN 6 55.548 1.122 -7.015
32 H THR 7 HN THR 7 51.981 1.121 -7.182
33 HA THR 7 HA THR 7 52.164 3.503 -8.886
34 HB THR 7 HB THR 7 54.285 1.329 -8.880
35 HG1 THR 7 HG1 THR 7 54.098 3.915 -7.894
36 1HG2 THR 7 HG21 THR 7 53.918 3.741 -10.681
37 2HG2 THR 7 HG22 THR 7 53.741 2.053 -11.160
38 3HG2 THR 7 HG23 THR 7 55.322 2.673 -10.686
39 H ASN 8 HN ASN 8 52.107 -0.033 -8.609
40 HA ASN 8 HA ASN 8 49.829 -0.377 -10.299
41 1HB ASN 8 HB2 ASN 8 52.125 0.343 -11.675
42 2HB ASN 8 HB1 ASN 8 52.105 -1.411 -11.827
43 1HD2 ASN 8 HD2 ASN 8 50.353 1.542 -12.650
44 2HD2 ASN 8 HD2 ASN 8 49.280 0.813 -13.743
45 H SER 9 HN SER 9 51.169 -1.428 -7.840
46 HA SER 9 HA SER 9 51.022 -4.334 -8.534
47 1HB SER 9 HB2 SER 9 53.365 -3.790 -8.440
48 2HB SER 9 HB1 SER 9 53.146 -2.829 -6.980
49 HG SER 9 HG SER 9 53.892 -4.791 -6.316
50 H GLN 10 HN GLN 10 51.757 -2.536 -5.528
51 HA GLN 10 HA GLN 10 49.110 -2.943 -4.394
52 1HB GLN 10 HB2 GLN 10 50.990 -5.103 -4.398
53 2HB GLN 10 HB1 GLN 10 50.773 -4.563 -2.732
54 1HG GLN 10 HG2 GLN 10 48.230 -4.572 -3.311
55 2HG GLN 10 HG1 GLN 10 48.708 -5.615 -4.652
56 1HE2 GLN 10 HE21 GLN 10 48.518 -5.402 -1.120
57 2HE2 GLN 10 HE22 GLN 10 48.823 -7.046 -0.828
58 H LEU 11 HN LEU 11 49.350 -2.700 -1.849
59 HA LEU 11 HA LEU 11 51.613 -1.285 -0.750
60 1HB LEU 11 HB2 LEU 11 50.732 0.325 -2.483
61 2HB LEU 11 HB1 LEU 11 49.214 0.377 -1.584
62 HG LEU 11 HG LEU 11 50.298 1.297 0.353
63 1HD1 LEU 11 HD1 LEU 11 52.788 0.487 -1.124
64 2HD1 LEU 11 HD1 LEU 11 52.348 0.202 0.561
65 3HD1 LEU 11 HD1 LEU 11 52.859 1.810 0.044
66 1HD2 LEU 11 HD2 LEU 11 51.778 3.135 -1.141
67 2HD2 LEU 11 HD2 LEU 11 50.062 3.256 -0.753
68 3HD2 LEU 11 HD2 LEU 11 50.573 2.533 -2.278
69 H SER 12 HN SER 12 51.055 -2.756 0.983
70 HA SER 12 HA SER 12 48.725 -3.366 2.250
71 1HB SER 12 HB2 SER 12 50.900 -4.074 3.048
72 2HB SER 12 HB1 SER 12 51.339 -2.419 3.459
73 HG SER 12 HG SER 12 50.178 -2.550 5.225
74 H ALA 13 HN ALA 13 47.126 -2.316 3.400
75 HA ALA 13 HA ALA 13 46.666 0.448 3.190
76 1HB ALA 13 HB1 ALA 13 45.232 -0.159 5.352
77 2HB ALA 13 HB2 ALA 13 45.728 -1.797 4.933
78 3HB ALA 13 HB3 ALA 13 44.819 -0.828 3.775
79 H ASN 14 HN ASN 14 48.845 -1.206 5.313
80 HA ASN 14 HA ASN 14 48.944 1.015 7.268
81 1HB ASN 14 HB2 ASN 14 49.065 -1.410 7.877
82 2HB ASN 14 HB1 ASN 14 50.587 -1.522 6.993
83 1HD2 ASN 14 HD2 ASN 14 52.268 0.250 7.740
84 2HD2 ASN 14 HD2 ASN 14 52.375 0.496 9.414
85 H SER 15 HN SER 15 50.338 0.314 4.256
86 HA SER 15 HA SER 15 53.019 1.343 4.741
87 1HB SER 15 HB2 SER 15 52.410 -0.208 2.902
88 2HB SER 15 HB1 SER 15 51.369 1.027 2.201
89 HG SER 15 HG SER 15 54.119 1.448 2.738
90 H LYS 16 HN LYS 16 53.216 3.199 2.580
91 HA LYS 16 HA LYS 16 51.333 5.406 3.231
92 1HB LYS 16 HB2 LYS 16 53.279 5.361 4.856
93 2HB LYS 16 HB1 LYS 16 54.348 5.650 3.485
94 1HG LYS 16 HG2 LYS 16 52.944 7.706 2.969
95 2HG LYS 16 HG1 LYS 16 52.157 7.461 4.529
96 1HD LYS 16 HD2 LYS 16 54.876 7.255 5.113
97 2HD LYS 16 HD1 LYS 16 54.792 8.574 3.945
98 1HE LYS 16 HE2 LYS 16 54.225 9.877 5.731
99 2HE LYS 16 HE1 LYS 16 52.637 9.089 5.632
100 1HZ LYS 16 HZ1 LYS 16 54.982 8.053 7.139
101 2HZ LYS 16 HZ2 LYS 16 53.456 7.312 7.041
102 3HZ LYS 16 HZ3 LYS 16 53.629 8.806 7.834
103 H CYS 17 HN CYS 17 50.815 6.367 1.300
104 HA CYS 17 HA CYS 17 52.703 6.006 -0.994
105 1HB CYS 17 HB2 CYS 17 50.580 4.966 -1.350
106 2HB CYS 17 HB1 CYS 17 49.711 6.364 -0.722
107 H GLU 18 HN GLU 18 53.808 7.825 -1.557
108 HA GLU 18 HA GLU 18 52.473 10.399 -1.863
109 1HB GLU 18 HB2 GLU 18 53.036 9.911 0.673
110 2HB GLU 18 HB1 GLU 18 54.669 10.366 0.187
111 1HG GLU 18 HG2 GLU 18 54.077 12.558 -0.260
112 2HG GLU 18 HG1 GLU 18 52.411 12.136 -0.658
113 H LYS 19 HN LYS 19 53.434 10.995 -3.767
114 HA LYS 19 HA LYS 19 55.113 11.197 -5.435
115 1HB LYS 19 HB2 LYS 19 56.442 12.061 -2.847
116 2HB LYS 19 HB1 LYS 19 57.054 12.451 -4.455
117 1HG LYS 19 HG2 LYS 19 54.485 13.252 -4.738
118 2HG LYS 19 HG1 LYS 19 54.704 13.545 -3.012
119 1HD LYS 19 HD2 LYS 19 56.388 15.116 -3.351
120 2HD LYS 19 HD1 LYS 19 56.825 14.455 -4.926
121 1HE LYS 19 HE2 LYS 19 55.272 15.725 -6.021
122 2HE LYS 19 HE1 LYS 19 54.054 15.490 -4.750
123 1HZ LYS 19 HZ1 LYS 19 56.246 17.445 -4.881
124 2HZ LYS 19 HZ2 LYS 19 55.742 16.881 -3.359
125 3HZ LYS 19 HZ3 LYS 19 54.639 17.666 -4.386
126 H SER 20 HN SER 20 58.010 10.892 -3.937
127 HA SER 20 HA SER 20 59.636 9.176 -3.865
128 1HB SER 20 HB2 SER 20 57.490 8.369 -2.444
129 2HB SER 20 HB1 SER 20 57.475 7.128 -3.693
130 HG SER 20 HG SER 20 58.801 6.438 -2.041
131 H THR 21 HN THR 21 60.474 7.375 -5.210
132 HA THR 21 HA THR 21 59.241 7.396 -7.927
133 HB THR 21 HB THR 21 61.690 6.084 -8.023
134 HG1 THR 21 HG1 THR 21 62.134 8.314 -6.402
135 1HG2 THR 21 HG21 THR 21 61.879 9.007 -8.216
136 2HG2 THR 21 HG22 THR 21 60.510 8.331 -9.099
137 3HG2 THR 21 HG23 THR 21 62.149 7.778 -9.452
138 H LEU 22 HN LEU 22 58.397 5.739 -5.492
139 HA LEU 22 HA LEU 22 59.100 3.037 -5.659
140 1HB LEU 22 HB2 LEU 22 57.304 4.600 -4.311
141 2HB LEU 22 HB1 LEU 22 56.226 3.636 -5.318
142 HG LEU 22 HG LEU 22 57.568 1.596 -4.522
143 1HD1 LEU 22 HD1 LEU 22 58.980 3.739 -3.202
144 2HD1 LEU 22 HD1 LEU 22 59.378 2.021 -3.253
145 3HD1 LEU 22 HD1 LEU 22 58.305 2.641 -1.999
146 1HD2 LEU 22 HD2 LEU 22 55.918 3.238 -2.579
147 2HD2 LEU 22 HD2 LEU 22 56.330 1.540 -2.338
148 3HD2 LEU 22 HD2 LEU 22 55.323 2.018 -3.703
149 H THR 23 HN THR 23 58.208 1.256 -6.828
150 HA THR 23 HA THR 23 56.254 1.669 -8.966
151 HB THR 23 HB THR 23 59.161 1.102 -9.645
152 HG1 THR 23 HG1 THR 23 58.456 3.305 -10.753
153 1HG2 THR 23 HG21 THR 23 58.339 1.499 -11.975
154 2HG2 THR 23 HG22 THR 23 56.695 1.578 -11.340
155 3HG2 THR 23 HG23 THR 23 57.617 0.079 -11.218
156 H ASN 24 HN ASN 24 55.279 -0.305 -9.360
157 HA ASN 24 HA ASN 24 54.839 -2.619 -9.108
158 1HB ASN 24 HB2 ASN 24 57.801 -2.454 -9.733
159 2HB ASN 24 HB1 ASN 24 56.915 -3.980 -9.707
160 1HD2 ASN 24 HD2 ASN 24 56.527 -4.542 -11.858
161 2HD2 ASN 24 HD2 ASN 24 55.942 -3.482 -13.048
162 H CYS 25 HN CYS 25 54.698 -1.727 -6.655
163 HA CYS 25 HA CYS 25 56.489 -3.498 -5.022
164 1HB CYS 25 HB2 CYS 25 56.390 -0.668 -5.121
165 2HB CYS 25 HB1 CYS 25 55.612 -1.128 -3.612
166 H TYR 26 HN TYR 26 55.492 -3.988 -2.863
167 HA TYR 26 HA TYR 26 52.497 -3.959 -2.967
168 1HB TYR 26 HB2 TYR 26 54.382 -6.054 -1.817
169 2HB TYR 26 HB1 TYR 26 52.623 -6.173 -1.889
170 HD1 TYR 26 HD1 TYR 26 51.530 -6.963 -3.831
171 HD2 TYR 26 HD2 TYR 26 55.678 -5.862 -4.011
172 HE1 TYR 26 HE1 TYR 26 51.680 -7.903 -6.120
173 HE2 TYR 26 HE2 TYR 26 55.826 -6.802 -6.302
174 HH TYR 26 HH TYR 26 54.354 -8.751 -7.585
175 H VAL 27 HN VAL 27 55.423 -3.970 -1.010
176 HA VAL 27 HA VAL 27 55.896 -3.075 1.105
177 HB VAL 27 HB VAL 27 53.473 -1.356 0.556
178 1HG1 VAL 27 HG11 VAL 27 54.352 -0.573 2.532
179 2HG1 VAL 27 HG12 VAL 27 55.415 0.293 1.423
180 3HG1 VAL 27 HG13 VAL 27 55.963 -1.200 2.184
181 1HG2 VAL 27 HG21 VAL 27 54.531 -1.256 -1.540
182 2HG2 VAL 27 HG22 VAL 27 56.140 -1.472 -0.845
183 3HG2 VAL 27 HG23 VAL 27 55.305 0.071 -0.672
184 H ASP 28 HN ASP 28 55.387 -3.488 3.208
185 HA ASP 28 HA ASP 28 52.584 -4.164 3.953
186 1HB ASP 28 HB2 ASP 28 54.744 -6.008 3.437
187 2HB ASP 28 HB1 ASP 28 54.291 -6.100 5.142
188 H LYS 29 HN LYS 29 52.277 -2.754 5.649
189 HA LYS 29 HA LYS 29 52.691 -1.574 7.656
190 1HB LYS 29 HB2 LYS 29 54.334 -4.099 7.903
191 2HB LYS 29 HB1 LYS 29 54.220 -2.937 9.222
192 1HG LYS 29 HG2 LYS 29 52.220 -3.766 9.816
193 2HG LYS 29 HG1 LYS 29 51.585 -3.438 8.203
194 1HD LYS 29 HD2 LYS 29 52.004 -5.584 7.449
195 2HD LYS 29 HD1 LYS 29 53.358 -5.819 8.554
196 1HE LYS 29 HE2 LYS 29 51.994 -6.834 10.049
197 2HE LYS 29 HE1 LYS 29 50.923 -5.419 10.069
198 1HZ LYS 29 HZ1 LYS 29 50.282 -6.325 7.717
199 2HZ LYS 29 HZ2 LYS 29 49.548 -6.959 9.110
200 3HZ LYS 29 HZ3 LYS 29 50.816 -7.802 8.356
201 H SER 30 HN SER 30 53.975 -0.347 5.662
202 HA SER 30 HA SER 30 56.711 0.210 6.755
203 1HB SER 30 HB2 SER 30 55.948 0.109 3.827
204 2HB SER 30 HB1 SER 30 57.567 0.170 4.510
205 HG SER 30 HG SER 30 57.498 -1.915 4.690
206 H GLU 31 HN GLU 31 57.300 2.175 4.787
207 HA GLU 31 HA GLU 31 55.128 4.192 4.894
208 1HB GLU 31 HB2 GLU 31 57.369 4.002 6.737
209 2HB GLU 31 HB1 GLU 31 57.414 5.530 5.854
210 1HG GLU 31 HG2 GLU 31 55.325 6.210 6.659
211 2HG GLU 31 HG1 GLU 31 54.824 4.560 7.034
212 H VAL 32 HN VAL 32 58.677 4.102 4.388
213 HA VAL 32 HA VAL 32 59.967 4.721 2.509
214 HB VAL 32 HB VAL 32 57.339 4.378 1.037
215 1HG1 VAL 32 HG11 VAL 32 60.224 4.505 0.323
216 2HG1 VAL 32 HG12 VAL 32 58.812 5.029 -0.596
217 3HG1 VAL 32 HG13 VAL 32 59.246 3.320 -0.542
218 1HG2 VAL 32 HG21 VAL 32 59.295 2.134 1.407
219 2HG2 VAL 32 HG22 VAL 32 57.556 2.065 1.123
220 3HG2 VAL 32 HG23 VAL 32 58.172 2.487 2.721
221 H TYR 33 HN TYR 33 60.215 6.531 0.924
222 HA TYR 33 HA TYR 33 58.222 8.709 1.051
223 1HB TYR 33 HB2 TYR 33 60.813 8.607 2.538
224 2HB TYR 33 HB1 TYR 33 60.340 10.156 1.844
225 HD1 TYR 33 HD1 TYR 33 58.039 11.099 2.399
226 HD2 TYR 33 HD2 TYR 33 59.771 7.776 4.497
227 HE1 TYR 33 HE1 TYR 33 56.443 11.445 4.267
228 HE2 TYR 33 HE2 TYR 33 58.176 8.121 6.361
229 HH TYR 33 HH TYR 33 56.811 9.955 7.298
230 H GLY 34 HN GLY 34 61.586 7.875 0.120
231 1HA GLY 34 HA2 GLY 34 61.031 9.098 -2.547
232 2HA GLY 34 HA1 GLY 34 62.520 9.503 -1.690
233 H THR 35 HN THR 35 61.281 6.290 -1.334
234 HA THR 35 HA THR 35 63.703 5.136 -2.444
235 HB THR 35 HB THR 35 61.072 4.103 -1.383
236 HG1 THR 35 HG1 THR 35 62.207 3.821 0.394
237 1HG2 THR 35 HG21 THR 35 63.458 2.448 -2.243
238 2HG2 THR 35 HG22 THR 35 61.946 2.564 -3.142
239 3HG2 THR 35 HG23 THR 35 61.961 1.844 -1.532
240 H THR 36 HN THR 36 63.929 3.961 -4.381
241 HA THR 36 HA THR 36 61.765 4.384 -6.408
242 HB THR 36 HB THR 36 64.713 3.721 -6.726
243 HG1 THR 36 HG1 THR 36 65.010 5.750 -6.385
244 1HG2 THR 36 HG21 THR 36 64.272 3.517 -8.918
245 2HG2 THR 36 HG22 THR 36 63.469 5.086 -8.938
246 3HG2 THR 36 HG23 THR 36 62.553 3.632 -8.545
247 H CYS 37 HN CYS 37 60.790 2.423 -5.164
248 HA CYS 37 HA CYS 37 61.934 -0.176 -5.225
249 1HB CYS 37 HB2 CYS 37 60.016 0.350 -3.879
250 2HB CYS 37 HB1 CYS 37 59.098 0.877 -5.281
251 H THR 38 HN THR 38 62.620 -1.192 -7.064
252 HA THR 38 HA THR 38 61.025 -0.876 -9.578
253 HB THR 38 HB THR 38 63.874 -1.691 -8.932
254 HG1 THR 38 HG1 THR 38 62.991 0.280 -10.732
255 1HG2 THR 38 HG21 THR 38 63.987 -2.856 -10.848
256 2HG2 THR 38 HG22 THR 38 63.433 -1.441 -11.746
257 3HG2 THR 38 HG23 THR 38 62.261 -2.594 -11.105
258 H GLY 39 HN GLY 39 59.646 -2.464 -7.988
259 1HA GLY 39 HA2 GLY 39 58.644 -4.631 -8.254
260 2HA GLY 39 HA1 GLY 39 60.117 -5.188 -9.050
261 H SER 40 HN SER 40 58.959 -4.064 -5.862
262 HA SER 40 HA SER 40 60.463 -6.264 -4.573
263 1HB SER 40 HB2 SER 40 60.988 -3.310 -4.127
264 2HB SER 40 HB1 SER 40 61.644 -4.592 -3.114
265 HG SER 40 HG SER 40 63.165 -4.179 -4.653
266 H ARG 41 HN ARG 41 60.023 -6.155 -2.097
267 HA ARG 41 HA ARG 41 57.446 -4.778 -1.475
268 1HB ARG 41 HB2 ARG 41 56.676 -6.977 -0.488
269 2HB ARG 41 HB1 ARG 41 56.845 -6.991 -2.244
270 1HG ARG 41 HG2 ARG 41 59.117 -7.986 -1.984
271 2HG ARG 41 HG1 ARG 41 58.860 -8.052 -0.241
272 1HD ARG 41 HD2 ARG 41 57.374 -9.809 -0.390
273 2HD ARG 41 HD1 ARG 41 56.737 -9.267 -1.956
274 HE ARG 41 HE ARG 41 59.501 -10.394 -1.754
275 1HH1 ARG 41 HH1 ARG 41 56.651 -11.856 -2.160
276 2HH1 ARG 41 HH1 ARG 41 56.835 -12.284 -3.828
277 1HH2 ARG 41 HH2 ARG 41 59.610 -10.269 -4.319
278 2HH2 ARG 41 HH2 ARG 41 58.508 -11.387 -5.048
279 H PHE 42 HN PHE 42 57.103 -4.502 0.831
280 HA PHE 42 HA PHE 42 59.595 -4.853 2.468
281 1HB PHE 42 HB2 PHE 42 57.407 -2.774 2.754
282 2HB PHE 42 HB1 PHE 42 58.991 -2.766 3.529
283 HD1 PHE 42 HD1 PHE 42 60.524 -3.794 1.042
284 HD2 PHE 42 HD2 PHE 42 57.646 -0.657 1.614
285 HE1 PHE 42 HE1 PHE 42 61.466 -2.570 -0.900
286 HE2 PHE 42 HE2 PHE 42 58.585 0.565 -0.324
287 HZ PHE 42 HZ PHE 42 60.493 -0.392 -1.581
288 H ASP 43 HN ASP 43 58.752 -4.467 4.952
289 HA ASP 43 HA ASP 43 56.197 -5.636 5.649
290 1HB ASP 43 HB2 ASP 43 58.200 -7.401 4.766
291 2HB ASP 43 HB1 ASP 43 58.209 -7.552 6.523
292 H GLY 44 HN GLY 44 56.493 -3.646 6.982
293 1HA GLY 44 HA2 GLY 44 56.704 -2.901 9.229
294 2HA GLY 44 HA1 GLY 44 57.678 -4.331 9.583
295 H VAL 45 HN VAL 45 58.034 -1.591 7.269
296 HA VAL 45 HA VAL 45 60.756 -1.188 8.458
297 HB VAL 45 HB VAL 45 61.732 -1.267 6.362
298 1HG1 VAL 45 HG11 VAL 45 59.217 -2.911 6.014
299 2HG1 VAL 45 HG12 VAL 45 60.763 -3.465 6.659
300 3HG1 VAL 45 HG13 VAL 45 60.626 -3.016 4.958
301 1HG2 VAL 45 HG21 VAL 45 59.127 -0.144 5.415
302 2HG2 VAL 45 HG22 VAL 45 60.195 -0.933 4.252
303 3HG2 VAL 45 HG23 VAL 45 60.763 0.466 5.168
304 H THR 46 HN THR 46 61.607 0.988 7.224
305 HA THR 46 HA THR 46 59.558 3.086 7.019
306 HB THR 46 HB THR 46 61.625 3.196 9.229
307 HG1 THR 46 HG1 THR 46 59.676 2.763 10.543
308 1HG2 THR 46 HG21 THR 46 59.665 5.008 8.119
309 2HG2 THR 46 HG22 THR 46 60.892 5.319 9.347
310 3HG2 THR 46 HG23 THR 46 59.313 4.692 9.817
311 H ILE 47 HN ILE 47 61.214 2.400 5.024
312 HA ILE 47 HA ILE 47 63.799 3.765 5.143
313 HB ILE 47 HB ILE 47 63.461 1.725 3.848
314 1HG1 ILE 47 HG12 ILE 47 63.685 4.030 1.890
315 2HG1 ILE 47 HG11 ILE 47 64.996 3.556 2.970
316 1HG2 ILE 47 HG21 ILE 47 61.153 3.296 2.798
317 2HG2 ILE 47 HG22 ILE 47 61.263 1.577 3.176
318 3HG2 ILE 47 HG23 ILE 47 61.958 2.197 1.678
319 1HD1 ILE 47 HD1 ILE 47 63.771 1.990 0.702
320 2HD1 ILE 47 HD1 ILE 47 64.651 1.173 1.994
321 3HD1 ILE 47 HD1 ILE 47 65.471 2.367 0.986
322 H THR 48 HN THR 48 64.320 5.419 3.418
323 HA THR 48 HA THR 48 62.002 7.183 2.740
324 HB THR 48 HB THR 48 63.473 9.098 3.463
325 HG1 THR 48 HG1 THR 48 65.396 7.666 3.274
326 1HG2 THR 48 HG21 THR 48 62.298 8.921 5.363
327 2HG2 THR 48 HG22 THR 48 63.490 7.774 5.981
328 3HG2 THR 48 HG23 THR 48 62.086 7.192 5.083
329 H THR 49 HN THR 49 63.935 9.187 1.665
330 HA THR 49 HA THR 49 64.149 8.430 -1.009
331 HB THR 49 HB THR 49 66.024 10.074 0.720
332 HG1 THR 49 HG1 THR 49 63.658 10.581 0.299
333 1HG2 THR 49 HG21 THR 49 65.741 10.036 -2.291
334 2HG2 THR 49 HG22 THR 49 67.075 9.302 -1.398
335 3HG2 THR 49 HG23 THR 49 66.840 11.050 -1.356
336 H SER 50 HN SER 50 64.991 6.417 -1.611
337 HA SER 50 HA SER 50 67.848 5.938 -1.174
338 1HB SER 50 HB2 SER 50 65.723 4.201 0.122
339 2HB SER 50 HB1 SER 50 67.438 3.804 0.063
340 HG SER 50 HG SER 50 67.252 4.851 1.943
341 H THR 51 HN THR 51 68.630 4.569 -2.777
342 HA THR 51 HA THR 51 66.613 3.530 -4.714
343 HB THR 51 HB THR 51 69.513 3.433 -5.279
344 HG1 THR 51 HG1 THR 51 68.102 5.876 -4.972
345 1HG2 THR 51 HG21 THR 51 68.137 4.956 -7.180
346 2HG2 THR 51 HG22 THR 51 66.981 3.730 -6.661
347 3HG2 THR 51 HG23 THR 51 68.551 3.246 -7.302
348 H SER 52 HN SER 52 66.196 1.382 -4.641
349 HA SER 52 HA SER 52 68.356 -0.494 -3.769
350 1HB SER 52 HB2 SER 52 65.639 -1.245 -2.968
351 2HB SER 52 HB1 SER 52 67.110 -1.181 -2.003
352 HG SER 52 HG SER 52 65.265 0.867 -2.607
353 H THR 53 HN THR 53 68.576 -2.169 -5.208
354 HA THR 53 HA THR 53 66.371 -2.610 -7.193
355 HB THR 53 HB THR 53 69.087 -3.728 -7.613
356 HG1 THR 53 HG1 THR 53 69.630 -1.452 -8.318
357 1HG2 THR 53 HG21 THR 53 68.294 -2.028 -9.704
358 2HG2 THR 53 HG22 THR 53 66.807 -2.783 -9.130
359 3HG2 THR 53 HG23 THR 53 68.159 -3.786 -9.659
360 H GLY 54 HN GLY 54 65.140 -4.215 -6.150
361 1HA GLY 54 HA2 GLY 54 64.614 -6.403 -5.473
362 2HA GLY 54 HA1 GLY 54 66.171 -6.906 -6.136
363 H SER 55 HN SER 55 64.649 -5.433 -3.285
364 HA SER 55 HA SER 55 66.686 -6.741 -1.565
365 1HB SER 55 HB2 SER 55 66.897 -4.387 -0.449
366 2HB SER 55 HB1 SER 55 67.771 -4.688 -1.946
367 HG SER 55 HG SER 55 66.698 -3.019 -2.638
368 H ARG 56 HN ARG 56 65.349 -7.825 -0.150
369 HA ARG 56 HA ARG 56 62.652 -6.955 0.495
370 1HB ARG 56 HB2 ARG 56 64.018 -9.292 0.504
371 2HB ARG 56 HB1 ARG 56 64.133 -8.882 2.216
372 1HG ARG 56 HG2 ARG 56 61.493 -8.323 1.664
373 2HG ARG 56 HG1 ARG 56 61.794 -9.734 0.650
374 1HD ARG 56 HD2 ARG 56 62.979 -10.044 3.307
375 2HD ARG 56 HD1 ARG 56 61.222 -9.805 3.378
376 HE ARG 56 HE ARG 56 61.398 -11.584 1.342
377 1HH1 ARG 56 HH1 ARG 56 60.637 -12.485 4.119
378 2HH1 ARG 56 HH1 ARG 56 61.794 -13.740 4.415
379 1HH2 ARG 56 HH2 ARG 56 63.899 -12.765 1.832
380 2HH2 ARG 56 HH2 ARG 56 63.639 -13.904 3.111
381 H ILE 57 HN ILE 57 62.378 -5.134 1.761
382 HA ILE 57 HA ILE 57 64.362 -4.434 3.831
383 HB ILE 57 HB ILE 57 61.733 -3.084 3.165
384 1HG1 ILE 57 HG12 ILE 57 62.828 -3.399 1.040
385 2HG1 ILE 57 HG11 ILE 57 63.149 -1.736 1.537
386 1HG2 ILE 57 HG21 ILE 57 64.380 -2.222 4.346
387 2HG2 ILE 57 HG22 ILE 57 62.779 -2.113 5.075
388 3HG2 ILE 57 HG23 ILE 57 63.208 -1.060 3.728
389 1HD1 ILE 57 HD1 ILE 57 65.307 -2.652 2.600
390 2HD1 ILE 57 HD1 ILE 57 65.260 -2.568 0.839
391 3HD1 ILE 57 HD1 ILE 57 65.010 -4.111 1.654
392 H SER 58 HN SER 58 61.978 -6.647 3.805
393 HA SER 58 HA SER 58 60.153 -6.251 5.852
394 1HB SER 58 HB2 SER 58 61.892 -8.621 5.129
395 2HB SER 58 HB1 SER 58 60.558 -8.742 6.272
396 HG SER 58 HG SER 58 60.346 -7.741 3.621
397 H GLY 59 HN GLY 59 60.244 -6.158 8.132
398 1HA GLY 59 HA2 GLY 59 62.283 -7.149 9.784
399 2HA GLY 59 HA1 GLY 59 62.776 -5.512 9.359
400 HA PRO 60 HA PRO 60 59.550 -5.456 12.752
401 1HB PRO 60 HB2 PRO 60 61.138 -5.421 14.975
402 2HB PRO 60 HB1 PRO 60 60.525 -6.923 14.257
403 1HG PRO 60 HG2 PRO 60 63.231 -5.749 14.153
404 2HG PRO 60 HG1 PRO 60 62.727 -7.441 14.075
405 1HD PRO 60 HD2 PRO 60 63.498 -5.837 11.908
406 2HD PRO 60 HD1 PRO 60 62.688 -7.415 11.817
407 H GLY 61 HN GLY 61 60.304 -3.358 11.217
408 1HA GLY 61 HA2 GLY 61 59.980 -0.977 11.829
409 2HA GLY 61 HA1 GLY 61 61.058 -1.252 13.201
410 H CYS 62 HN CYS 62 61.920 -2.775 10.221
411 HA CYS 62 HA CYS 62 64.509 -1.957 9.923
412 1HB CYS 62 HB2 CYS 62 62.512 -3.106 8.346
413 2HB CYS 62 HB1 CYS 62 63.065 -1.731 7.398
414 H LYS 63 HN LYS 63 65.355 0.113 10.169
415 HA LYS 63 HA LYS 63 63.826 2.414 9.003
416 1HB LYS 63 HB2 LYS 63 64.297 2.478 11.404
417 2HB LYS 63 HB1 LYS 63 66.010 2.185 11.101
418 1HG LYS 63 HG2 LYS 63 65.945 4.332 9.679
419 2HG LYS 63 HG1 LYS 63 64.394 4.653 10.456
420 1HD LYS 63 HD2 LYS 63 65.342 5.023 12.518
421 2HD LYS 63 HD1 LYS 63 66.659 3.886 12.235
422 1HE LYS 63 HE2 LYS 63 66.665 6.274 10.473
423 2HE LYS 63 HE1 LYS 63 67.004 6.583 12.188
424 1HZ LYS 63 HZ1 LYS 63 68.293 4.447 10.573
425 2HZ LYS 63 HZ2 LYS 63 68.650 4.856 12.184
426 3HZ LYS 63 HZ3 LYS 63 69.009 5.942 10.928
427 H ILE 64 HN ILE 64 64.640 3.188 7.072
428 HA ILE 64 HA ILE 64 67.591 2.914 6.580
429 HB ILE 64 HB ILE 64 65.285 2.507 4.654
430 1HG1 ILE 64 HG12 ILE 64 66.540 0.127 4.760
431 2HG1 ILE 64 HG11 ILE 64 66.883 0.691 6.395
432 1HG2 ILE 64 HG21 ILE 64 67.631 1.392 3.626
433 2HG2 ILE 64 HG22 ILE 64 68.147 2.933 4.310
434 3HG2 ILE 64 HG23 ILE 64 66.871 2.891 3.096
435 1HD1 ILE 64 HD1 ILE 64 64.575 -0.580 5.678
436 2HD1 ILE 64 HD1 ILE 64 64.098 1.108 5.496
437 3HD1 ILE 64 HD1 ILE 64 64.704 0.526 7.045
438 H SER 65 HN SER 65 68.545 4.644 5.397
439 HA SER 65 HA SER 65 66.774 6.844 4.468
440 1HB SER 65 HB2 SER 65 68.629 8.262 5.853
441 2HB SER 65 HB1 SER 65 67.081 7.771 6.533
442 HG SER 65 HG SER 65 68.895 7.181 7.838
443 H THR 66 HN THR 66 67.507 7.354 2.471
444 HA THR 66 HA THR 66 68.968 7.592 0.626
445 HB THR 66 HB THR 66 71.062 8.394 2.598
446 HG1 THR 66 HG1 THR 66 68.509 9.549 2.260
447 1HG2 THR 66 HG21 THR 66 71.803 9.478 0.773
448 2HG2 THR 66 HG22 THR 66 70.288 10.378 0.681
449 3HG2 THR 66 HG23 THR 66 70.444 8.827 -0.146
450 H CYS 67 HN CYS 67 68.942 4.940 1.119
451 HA CYS 67 HA CYS 67 71.838 4.146 1.275
452 1HB CYS 67 HB2 CYS 67 69.296 2.975 2.290
453 2HB CYS 67 HB1 CYS 67 70.492 1.835 1.691
454 H ILE 68 HN ILE 68 72.489 4.013 -0.864
455 HA ILE 68 HA ILE 68 70.685 3.162 -2.996
456 HB ILE 68 HB ILE 68 73.616 3.830 -2.712
457 1HG1 ILE 68 HG12 ILE 68 73.032 5.701 -4.129
458 2HG1 ILE 68 HG11 ILE 68 71.432 5.028 -4.438
459 1HG2 ILE 68 HG21 ILE 68 73.839 2.215 -4.377
460 2HG2 ILE 68 HG22 ILE 68 73.487 3.649 -5.340
461 3HG2 ILE 68 HG23 ILE 68 72.210 2.483 -4.996
462 1HD1 ILE 68 HD1 ILE 68 71.569 6.882 -2.669
463 2HD1 ILE 68 HD1 ILE 68 72.377 5.694 -1.648
464 3HD1 ILE 68 HD1 ILE 68 70.727 5.405 -2.197
465 H ILE 69 HN ILE 69 70.011 1.032 -2.512
466 HA ILE 69 HA ILE 69 72.131 -1.023 -2.134
467 HB ILE 69 HB ILE 69 69.124 -1.257 -1.863
468 1HG1 ILE 69 HG12 ILE 69 70.867 -0.897 0.535
469 2HG1 ILE 69 HG11 ILE 69 70.526 0.541 -0.422
470 1HG2 ILE 69 HG21 ILE 69 70.777 -3.288 -1.963
471 2HG2 ILE 69 HG22 ILE 69 69.546 -3.245 -0.703
472 3HG2 ILE 69 HG23 ILE 69 71.208 -2.789 -0.328
473 1HD1 ILE 69 HD1 ILE 69 68.066 -0.137 -0.319
474 2HD1 ILE 69 HD1 ILE 69 68.781 0.428 1.191
475 3HD1 ILE 69 HD1 ILE 69 68.545 -1.299 0.920
476 H THR 70 HN THR 70 71.944 -3.030 -3.397
477 HA THR 70 HA THR 70 70.181 -3.088 -5.755
478 HB THR 70 HB THR 70 73.184 -2.693 -5.912
479 HG1 THR 70 HG1 THR 70 72.600 -0.735 -6.311
480 1HG2 THR 70 HG21 THR 70 73.123 -3.225 -8.200
481 2HG2 THR 70 HG22 THR 70 71.370 -3.066 -8.284
482 3HG2 THR 70 HG23 THR 70 72.090 -4.461 -7.482
483 H GLY 71 HN GLY 71 69.506 -5.163 -5.068
484 1HA GLY 71 HA2 GLY 71 69.778 -7.538 -5.392
485 2HA GLY 71 HA1 GLY 71 71.529 -7.305 -5.406
486 H GLY 72 HN GLY 72 69.661 -5.710 -2.951
487 1HA GLY 72 HA2 GLY 72 69.314 -6.270 -0.665
488 2HA GLY 72 HA1 GLY 72 70.048 -7.845 -0.971
489 H VAL 73 HN VAL 73 71.815 -5.203 -2.198
490 HA VAL 73 HA VAL 73 73.720 -5.362 0.123
491 HB VAL 73 HB VAL 73 75.471 -5.154 -1.560
492 1HG1 VAL 73 HG11 VAL 73 75.081 -7.215 -2.833
493 2HG1 VAL 73 HG12 VAL 73 73.352 -7.112 -2.503
494 3HG1 VAL 73 HG13 VAL 73 74.485 -7.412 -1.185
495 1HG2 VAL 73 HG21 VAL 73 74.693 -3.694 -3.201
496 2HG2 VAL 73 HG22 VAL 73 73.115 -4.475 -3.295
497 3HG2 VAL 73 HG23 VAL 73 74.522 -5.237 -4.037
498 HA PRO 74 HA PRO 74 72.806 -0.985 0.193
499 1HB PRO 74 HB2 PRO 74 74.325 -0.400 2.382
500 2HB PRO 74 HB1 PRO 74 72.730 -1.155 2.497
501 1HG PRO 74 HG2 PRO 74 75.423 -2.374 2.740
502 2HG PRO 74 HG1 PRO 74 73.920 -2.784 3.577
503 1HD PRO 74 HD2 PRO 74 74.975 -4.202 1.460
504 2HD PRO 74 HD1 PRO 74 73.269 -4.231 1.947
505 H ALA 75 HN ALA 75 73.940 0.879 -0.466
506 HA ALA 75 HA ALA 75 76.684 0.427 -1.506
507 1HB ALA 75 HB1 ALA 75 76.158 2.749 -2.489
508 2HB ALA 75 HB2 ALA 75 74.544 2.543 -1.811
509 3HB ALA 75 HB3 ALA 75 75.133 1.423 -3.036
510 HA PRO 76 HA PRO 76 78.407 2.555 1.927
511 1HB PRO 76 HB2 PRO 76 80.787 3.326 0.811
512 2HB PRO 76 HB1 PRO 76 80.443 1.658 1.312
513 1HG PRO 76 HG2 PRO 76 80.380 2.866 -1.406
514 2HG PRO 76 HG1 PRO 76 80.928 1.263 -0.895
515 1HD PRO 76 HD2 PRO 76 78.510 1.728 -2.074
516 2HD PRO 76 HD1 PRO 76 78.821 0.378 -0.960
517 H SER 77 HN SER 77 76.499 4.149 1.015
518 HA SER 77 HA SER 77 77.507 6.633 -0.182
519 1HB SER 77 HB2 SER 77 74.943 5.401 0.663
520 2HB SER 77 HB1 SER 77 74.992 7.160 0.716
521 HG SER 77 HG SER 77 75.116 7.218 -1.396
522 H ALA 78 HN ALA 78 77.276 8.733 0.983
523 HA ALA 78 HA ALA 78 78.386 8.586 3.674
524 1HB ALA 78 HB1 ALA 78 78.787 10.255 1.718
525 2HB ALA 78 HB2 ALA 78 78.715 10.903 3.358
526 3HB ALA 78 HB3 ALA 78 77.316 11.044 2.291
527 H ALA 79 HN ALA 79 75.170 8.820 2.372
528 HA ALA 79 HA ALA 79 74.138 9.745 5.027
529 1HB ALA 79 HB1 ALA 79 73.425 10.136 2.199
530 2HB ALA 79 HB2 ALA 79 73.093 11.164 3.594
531 3HB ALA 79 HB3 ALA 79 72.041 9.798 3.238
532 H CYS 80 HN CYS 80 74.105 7.086 2.739
533 HA CYS 80 HA CYS 80 71.839 5.608 3.426
534 1HB CYS 80 HB2 CYS 80 73.434 4.931 1.734
535 2HB CYS 80 HB1 CYS 80 74.719 4.800 2.927
536 H LYS 81 HN LYS 81 71.104 4.739 5.374
537 HA LYS 81 HA LYS 81 72.902 4.876 7.714
538 1HB LYS 81 HB2 LYS 81 70.860 4.564 8.942
539 2HB LYS 81 HB1 LYS 81 70.478 5.650 7.607
540 1HG LYS 81 HG2 LYS 81 68.744 4.133 7.386
541 2HG LYS 81 HG1 LYS 81 69.948 3.364 6.354
542 1HD LYS 81 HD2 LYS 81 70.675 2.250 8.675
543 2HD LYS 81 HD1 LYS 81 68.992 2.567 9.071
544 1HE LYS 81 HE2 LYS 81 68.520 0.615 7.991
545 2HE LYS 81 HE1 LYS 81 68.878 1.503 6.486
546 1HZ LYS 81 HZ1 LYS 81 70.816 0.023 8.177
547 2HZ LYS 81 HZ2 LYS 81 71.223 0.937 6.809
548 3HZ LYS 81 HZ3 LYS 81 70.262 -0.448 6.649
549 H ILE 82 HN ILE 82 73.045 3.019 9.143
550 HA ILE 82 HA ILE 82 72.569 0.337 7.936
551 HB ILE 82 HB ILE 82 75.216 1.187 9.146
552 1HG1 ILE 82 HG12 ILE 82 74.699 2.554 7.115
553 2HG1 ILE 82 HG11 ILE 82 76.071 1.472 6.874
554 1HG2 ILE 82 HG21 ILE 82 75.258 -1.121 9.120
555 2HG2 ILE 82 HG22 ILE 82 75.809 -0.813 7.474
556 3HG2 ILE 82 HG23 ILE 82 74.123 -1.231 7.774
557 1HD1 ILE 82 HD1 ILE 82 73.814 1.637 5.239
558 2HD1 ILE 82 HD1 ILE 82 73.534 0.186 6.204
559 3HD1 ILE 82 HD1 ILE 82 75.003 0.333 5.240
560 H SER 83 HN SER 83 70.872 0.886 9.810
561 HA SER 83 HA SER 83 71.986 -0.221 12.340
562 1HB SER 83 HB2 SER 83 70.144 2.145 12.363
563 2HB SER 83 HB1 SER 83 71.317 1.642 13.580
564 HG SER 83 HG SER 83 72.323 3.273 12.564
565 H GLY 84 HN GLY 84 70.735 -2.046 12.483
566 1HA GLY 84 HA2 GLY 84 68.839 -3.339 12.914
567 2HA GLY 84 HA1 GLY 84 68.010 -1.830 13.277
568 H CYS 85 HN CYS 85 69.074 -3.808 10.491
569 HA CYS 85 HA CYS 85 66.482 -3.726 9.313
570 1HB CYS 85 HB2 CYS 85 67.486 -1.322 9.144
571 2HB CYS 85 HB1 CYS 85 68.473 -2.000 7.854
572 H THR 86 HN THR 86 66.890 -4.230 6.704
573 HA THR 86 HA THR 86 69.282 -5.667 6.018
574 HB THR 86 HB THR 86 68.705 -7.212 7.728
575 HG1 THR 86 HG1 THR 86 68.985 -8.648 6.230
576 1HG2 THR 86 HG21 THR 86 65.851 -7.124 6.702
577 2HG2 THR 86 HG22 THR 86 66.433 -6.268 8.129
578 3HG2 THR 86 HG23 THR 86 66.429 -8.031 8.099
579 H PHE 87 HN PHE 87 69.112 -6.583 3.904
580 HA PHE 87 HA PHE 87 66.594 -5.862 2.444
581 1HB PHE 87 HB2 PHE 87 69.333 -6.432 1.293
582 2HB PHE 87 HB1 PHE 87 68.006 -5.548 0.543
583 HD1 PHE 87 HD1 PHE 87 67.356 -4.095 3.325
584 HD2 PHE 87 HD2 PHE 87 70.859 -4.553 0.883
585 HE1 PHE 87 HE1 PHE 87 68.271 -1.969 4.240
586 HE2 PHE 87 HE2 PHE 87 71.762 -2.447 1.787
587 HZ PHE 87 HZ PHE 87 70.480 -1.147 3.465
588 H SER 88 HN SER 88 69.272 -8.206 2.073
589 HA SER 88 HA SER 88 69.221 -10.550 1.751
590 1HB SER 88 HB2 SER 88 67.203 -10.033 3.458
591 2HB SER 88 HB1 SER 88 66.261 -10.611 2.086
592 HG SER 88 HG SER 88 66.921 -12.549 2.531
593 H ALA 89 HN ALA 89 67.858 -8.274 -0.194
594 HA ALA 89 HA ALA 89 67.152 -8.308 -2.452
595 1HB ALA 89 HB1 ALA 89 68.307 -9.901 -3.741
596 2HB ALA 89 HB2 ALA 89 68.143 -11.150 -2.507
597 3HB ALA 89 HB3 ALA 89 69.283 -9.826 -2.274
598 H ASN 90 HN ASN 90 64.859 -8.307 -2.124
599 HA ASN 90 HA ASN 90 63.401 -10.725 -1.435
600 1HB ASN 90 HB2 ASN 90 61.575 -9.278 -1.420
601 2HB ASN 90 HB1 ASN 90 62.896 -8.136 -1.190
602 1HD2 ASN 90 HD2 ASN 90 63.919 -7.781 -3.738
603 2HD2 ASN 90 HD2 ASN 90 62.722 -7.182 -4.781
Start of MODEL 22
1 1H ASP 1 HT1 ASP 1 46.594 7.964 -2.112
2 2H ASP 1 HT2 ASP 1 47.453 9.269 -1.443
3 3H ASP 1 HT3 ASP 1 45.903 8.883 -0.866
4 HA ASP 1 HA ASP 1 48.302 7.139 -0.611
5 1HB ASP 1 HB2 ASP 1 48.061 7.860 1.794
6 2HB ASP 1 HB1 ASP 1 48.483 9.179 0.701
7 H GLY 2 HN GLY 2 47.786 5.456 1.139
8 1HA GLY 2 HA2 GLY 2 46.191 4.038 2.269
9 2HA GLY 2 HA1 GLY 2 44.904 4.761 1.301
10 H SER 3 HN SER 3 45.148 4.314 -1.144
11 HA SER 3 HA SER 3 46.137 1.510 -1.561
12 1HB SER 3 HB2 SER 3 43.658 1.753 -1.351
13 2HB SER 3 HB1 SER 3 43.679 2.880 -2.707
14 HG SER 3 HG SER 3 44.449 1.226 -4.014
15 H CYS 4 HN CYS 4 48.119 2.613 -2.399
16 HA CYS 4 HA CYS 4 47.757 4.118 -4.944
17 1HB CYS 4 HB2 CYS 4 50.342 3.532 -3.488
18 2HB CYS 4 HB1 CYS 4 49.963 4.903 -4.528
19 H THR 5 HN THR 5 48.808 1.026 -3.713
20 HA THR 5 HA THR 5 49.404 -0.956 -4.842
21 HB THR 5 HB THR 5 48.736 0.669 -7.318
22 HG1 THR 5 HG1 THR 5 47.060 0.603 -5.720
23 1HG2 THR 5 HG21 THR 5 47.972 -1.901 -7.793
24 2HG2 THR 5 HG22 THR 5 49.381 -2.163 -6.768
25 3HG2 THR 5 HG23 THR 5 49.539 -1.243 -8.265
26 H ASN 6 HN ASN 6 51.103 1.886 -4.984
27 HA ASN 6 HA ASN 6 53.352 2.352 -5.457
28 1HB ASN 6 HB2 ASN 6 54.716 0.567 -5.007
29 2HB ASN 6 HB1 ASN 6 53.202 -0.247 -4.629
30 1HD2 ASN 6 HD2 ASN 6 55.257 0.432 -7.529
31 2HD2 ASN 6 HD2 ASN 6 55.014 -1.093 -8.226
32 H THR 7 HN THR 7 52.179 -0.118 -7.792
33 HA THR 7 HA THR 7 52.389 1.780 -10.006
34 HB THR 7 HB THR 7 54.269 -0.597 -9.834
35 HG1 THR 7 HG1 THR 7 54.969 2.132 -9.836
36 1HG2 THR 7 HG21 THR 7 53.838 1.584 -11.883
37 2HG2 THR 7 HG22 THR 7 53.719 -0.160 -12.121
38 3HG2 THR 7 HG23 THR 7 55.292 0.585 -11.839
39 H ASN 8 HN ASN 8 52.008 -1.575 -8.902
40 HA ASN 8 HA ASN 8 49.570 -1.957 -10.396
41 1HB ASN 8 HB2 ASN 8 51.854 -2.014 -11.927
42 2HB ASN 8 HB1 ASN 8 51.631 -3.712 -11.536
43 1HD2 ASN 8 HD2 ASN 8 49.586 -0.941 -12.545
44 2HD2 ASN 8 HD2 ASN 8 48.646 -1.837 -13.633
45 H SER 9 HN SER 9 50.937 -2.554 -7.735
46 HA SER 9 HA SER 9 50.262 -5.474 -7.656
47 1HB SER 9 HB2 SER 9 52.719 -3.990 -6.917
48 2HB SER 9 HB1 SER 9 52.194 -5.205 -5.757
49 HG SER 9 HG SER 9 52.938 -5.491 -8.457
50 H GLN 10 HN GLN 10 51.428 -3.466 -4.983
51 HA GLN 10 HA GLN 10 48.750 -2.936 -3.930
52 1HB GLN 10 HB2 GLN 10 49.626 -5.490 -3.659
53 2HB GLN 10 HB1 GLN 10 50.288 -4.779 -2.188
54 1HG GLN 10 HG2 GLN 10 47.915 -3.760 -1.880
55 2HG GLN 10 HG1 GLN 10 47.409 -4.981 -3.048
56 1HE2 GLN 10 HE21 GLN 10 48.617 -7.273 -2.416
57 2HE2 GLN 10 HE22 GLN 10 48.405 -7.709 -0.789
58 H LEU 11 HN LEU 11 49.344 -2.757 -1.237
59 HA LEU 11 HA LEU 11 51.859 -1.473 -0.625
60 1HB LEU 11 HB2 LEU 11 50.043 0.034 -2.124
61 2HB LEU 11 HB1 LEU 11 49.771 0.581 -0.474
62 HG LEU 11 HG LEU 11 51.482 2.012 -1.008
63 1HD1 LEU 11 HD1 LEU 11 53.560 -0.052 -0.744
64 2HD1 LEU 11 HD1 LEU 11 52.364 -0.058 0.549
65 3HD1 LEU 11 HD1 LEU 11 53.291 1.403 0.211
66 1HD2 LEU 11 HD2 LEU 11 53.130 1.620 -2.738
67 2HD2 LEU 11 HD2 LEU 11 51.543 1.153 -3.347
68 3HD2 LEU 11 HD2 LEU 11 52.684 -0.085 -2.827
69 H SER 12 HN SER 12 51.983 -2.084 1.498
70 HA SER 12 HA SER 12 50.161 -3.098 3.239
71 1HB SER 12 HB2 SER 12 51.608 -2.335 4.982
72 2HB SER 12 HB1 SER 12 52.630 -2.478 3.556
73 HG SER 12 HG SER 12 52.721 -0.450 4.855
74 H ALA 13 HN ALA 13 48.493 -2.360 4.593
75 HA ALA 13 HA ALA 13 46.861 -0.204 3.804
76 1HB ALA 13 HB1 ALA 13 46.849 -0.901 6.674
77 2HB ALA 13 HB2 ALA 13 46.788 -2.288 5.587
78 3HB ALA 13 HB3 ALA 13 45.555 -1.033 5.481
79 H ASN 14 HN ASN 14 49.692 -0.207 5.876
80 HA ASN 14 HA ASN 14 49.142 2.623 6.674
81 1HB ASN 14 HB2 ASN 14 50.828 2.150 8.410
82 2HB ASN 14 HB1 ASN 14 49.573 0.911 8.422
83 1HD2 ASN 14 HD2 ASN 14 52.972 1.512 7.817
84 2HD2 ASN 14 HD2 ASN 14 53.397 -0.099 7.490
85 H SER 15 HN SER 15 50.653 1.034 4.220
86 HA SER 15 HA SER 15 53.294 2.018 4.079
87 1HB SER 15 HB2 SER 15 53.151 1.037 2.036
88 2HB SER 15 HB1 SER 15 51.511 0.599 2.495
89 HG SER 15 HG SER 15 50.733 2.190 1.297
90 H LYS 16 HN LYS 16 53.709 3.667 2.026
91 HA LYS 16 HA LYS 16 51.989 6.077 2.264
92 1HB LYS 16 HB2 LYS 16 54.404 5.602 3.731
93 2HB LYS 16 HB1 LYS 16 54.723 6.882 2.562
94 1HG LYS 16 HG2 LYS 16 53.607 8.341 3.858
95 2HG LYS 16 HG1 LYS 16 52.148 7.361 3.700
96 1HD LYS 16 HD2 LYS 16 53.578 5.886 5.505
97 2HD LYS 16 HD1 LYS 16 54.075 7.523 5.933
98 1HE LYS 16 HE2 LYS 16 51.561 8.116 5.891
99 2HE LYS 16 HE1 LYS 16 51.280 6.364 5.918
100 1HZ LYS 16 HZ1 LYS 16 52.749 8.012 7.891
101 2HZ LYS 16 HZ2 LYS 16 52.957 6.329 7.800
102 3HZ LYS 16 HZ3 LYS 16 51.430 6.980 8.164
103 H CYS 17 HN CYS 17 51.710 6.702 0.132
104 HA CYS 17 HA CYS 17 53.995 6.243 -1.759
105 1HB CYS 17 HB2 CYS 17 52.252 5.999 -3.473
106 2HB CYS 17 HB1 CYS 17 51.926 4.905 -2.130
107 H GLU 18 HN GLU 18 54.664 8.472 -0.813
108 HA GLU 18 HA GLU 18 53.450 10.603 -2.527
109 1HB GLU 18 HB2 GLU 18 53.456 12.097 -0.577
110 2HB GLU 18 HB1 GLU 18 52.513 10.650 -0.217
111 1HG GLU 18 HG2 GLU 18 54.598 9.663 0.823
112 2HG GLU 18 HG1 GLU 18 55.354 11.247 0.647
113 H LYS 19 HN LYS 19 55.015 11.900 -3.472
114 HA LYS 19 HA LYS 19 57.181 12.644 -4.068
115 1HB LYS 19 HB2 LYS 19 56.916 12.598 -1.126
116 2HB LYS 19 HB1 LYS 19 58.582 12.627 -1.704
117 1HG LYS 19 HG2 LYS 19 57.602 14.502 -3.328
118 2HG LYS 19 HG1 LYS 19 56.431 14.676 -2.020
119 1HD LYS 19 HD2 LYS 19 58.221 15.034 -0.406
120 2HD LYS 19 HD1 LYS 19 59.440 14.740 -1.648
121 1HE LYS 19 HE2 LYS 19 58.285 16.694 -2.934
122 2HE LYS 19 HE1 LYS 19 57.590 17.106 -1.354
123 1HZ LYS 19 HZ1 LYS 19 59.844 16.983 -0.413
124 2HZ LYS 19 HZ2 LYS 19 59.713 18.196 -1.596
125 3HZ LYS 19 HZ3 LYS 19 60.474 16.723 -1.967
126 H SER 20 HN SER 20 56.639 9.769 -4.255
127 HA SER 20 HA SER 20 59.448 8.792 -4.044
128 1HB SER 20 HB2 SER 20 57.034 7.222 -3.112
129 2HB SER 20 HB1 SER 20 58.731 6.821 -2.865
130 HG SER 20 HG SER 20 57.335 9.066 -1.821
131 H THR 21 HN THR 21 59.777 6.814 -5.367
132 HA THR 21 HA THR 21 57.876 6.704 -7.685
133 HB THR 21 HB THR 21 60.275 5.617 -8.506
134 HG1 THR 21 HG1 THR 21 61.884 6.645 -7.525
135 1HG2 THR 21 HG21 THR 21 60.694 8.016 -9.376
136 2HG2 THR 21 HG22 THR 21 59.180 8.425 -8.569
137 3HG2 THR 21 HG23 THR 21 59.195 7.221 -9.859
138 H LEU 22 HN LEU 22 56.579 4.914 -7.249
139 HA LEU 22 HA LEU 22 57.783 2.492 -6.039
140 1HB LEU 22 HB2 LEU 22 55.040 3.559 -6.641
141 2HB LEU 22 HB1 LEU 22 55.246 1.838 -6.323
142 HG LEU 22 HG LEU 22 54.722 3.104 -4.253
143 1HD1 LEU 22 HD1 LEU 22 55.939 1.516 -3.223
144 2HD1 LEU 22 HD1 LEU 22 57.408 2.453 -3.495
145 3HD1 LEU 22 HD1 LEU 22 56.872 1.284 -4.701
146 1HD2 LEU 22 HD2 LEU 22 56.166 4.790 -3.412
147 2HD2 LEU 22 HD2 LEU 22 55.992 5.178 -5.124
148 3HD2 LEU 22 HD2 LEU 22 57.450 4.371 -4.546
149 H THR 23 HN THR 23 57.541 0.397 -7.078
150 HA THR 23 HA THR 23 56.672 0.182 -9.859
151 HB THR 23 HB THR 23 59.592 0.326 -9.078
152 HG1 THR 23 HG1 THR 23 59.366 2.178 -9.998
153 1HG2 THR 23 HG21 THR 23 59.601 -1.583 -10.441
154 2HG2 THR 23 HG22 THR 23 59.882 -0.280 -11.596
155 3HG2 THR 23 HG23 THR 23 58.275 -0.990 -11.441
156 H ASN 24 HN ASN 24 55.826 -1.867 -9.882
157 HA ASN 24 HA ASN 24 55.442 -4.110 -9.201
158 1HB ASN 24 HB2 ASN 24 58.359 -3.732 -9.824
159 2HB ASN 24 HB1 ASN 24 57.796 -5.311 -9.276
160 1HD2 ASN 24 HD2 ASN 24 57.943 -6.419 -11.304
161 2HD2 ASN 24 HD2 ASN 24 57.004 -5.997 -12.653
162 H CYS 25 HN CYS 25 55.006 -2.930 -6.938
163 HA CYS 25 HA CYS 25 56.757 -4.290 -4.922
164 1HB CYS 25 HB2 CYS 25 55.952 -1.406 -5.199
165 2HB CYS 25 HB1 CYS 25 56.279 -2.062 -3.601
166 H TYR 26 HN TYR 26 55.631 -4.423 -2.752
167 HA TYR 26 HA TYR 26 52.647 -4.460 -3.022
168 1HB TYR 26 HB2 TYR 26 54.636 -6.554 -2.276
169 2HB TYR 26 HB1 TYR 26 53.126 -6.533 -1.365
170 HD1 TYR 26 HD1 TYR 26 50.945 -6.785 -2.534
171 HD2 TYR 26 HD2 TYR 26 54.690 -7.184 -4.600
172 HE1 TYR 26 HE1 TYR 26 49.782 -7.878 -4.433
173 HE2 TYR 26 HE2 TYR 26 53.528 -8.277 -6.497
174 HH TYR 26 HH TYR 26 51.355 -9.606 -6.800
175 H VAL 27 HN VAL 27 55.394 -4.583 -0.765
176 HA VAL 27 HA VAL 27 55.691 -3.602 1.360
177 HB VAL 27 HB VAL 27 53.474 -1.735 0.493
178 1HG1 VAL 27 HG11 VAL 27 55.637 -1.756 2.461
179 2HG1 VAL 27 HG12 VAL 27 54.224 -0.705 2.361
180 3HG1 VAL 27 HG13 VAL 27 55.676 -0.321 1.436
181 1HG2 VAL 27 HG21 VAL 27 55.738 -0.595 -0.517
182 2HG2 VAL 27 HG22 VAL 27 54.612 -1.556 -1.477
183 3HG2 VAL 27 HG23 VAL 27 56.068 -2.302 -0.819
184 H ASP 28 HN ASP 28 54.966 -4.514 3.224
185 HA ASP 28 HA ASP 28 52.021 -5.002 3.532
186 1HB ASP 28 HB2 ASP 28 54.526 -6.501 4.196
187 2HB ASP 28 HB1 ASP 28 53.128 -6.725 5.248
188 H LYS 29 HN LYS 29 54.752 -3.336 4.798
189 HA LYS 29 HA LYS 29 53.201 -1.967 6.809
190 1HB LYS 29 HB2 LYS 29 54.565 -4.499 7.469
191 2HB LYS 29 HB1 LYS 29 54.942 -3.175 8.569
192 1HG LYS 29 HG2 LYS 29 52.894 -3.258 9.507
193 2HG LYS 29 HG1 LYS 29 52.105 -3.236 7.929
194 1HD LYS 29 HD2 LYS 29 52.368 -5.626 7.688
195 2HD LYS 29 HD1 LYS 29 53.372 -5.708 9.136
196 1HE LYS 29 HE2 LYS 29 50.956 -4.412 9.897
197 2HE LYS 29 HE1 LYS 29 50.508 -5.856 8.966
198 1HZ LYS 29 HZ1 LYS 29 52.395 -6.952 10.311
199 2HZ LYS 29 HZ2 LYS 29 50.888 -6.719 11.063
200 3HZ LYS 29 HZ3 LYS 29 52.176 -5.662 11.391
201 H SER 30 HN SER 30 54.587 -0.605 5.117
202 HA SER 30 HA SER 30 57.107 0.168 6.528
203 1HB SER 30 HB2 SER 30 56.670 -0.403 3.584
204 2HB SER 30 HB1 SER 30 58.112 0.385 4.215
205 HG SER 30 HG SER 30 57.174 -2.086 5.221
206 H GLU 31 HN GLU 31 57.889 2.264 5.016
207 HA GLU 31 HA GLU 31 55.479 4.043 4.803
208 1HB GLU 31 HB2 GLU 31 57.377 4.095 6.775
209 2HB GLU 31 HB1 GLU 31 58.069 5.225 5.613
210 1HG GLU 31 HG2 GLU 31 56.208 6.663 5.713
211 2HG GLU 31 HG1 GLU 31 55.166 5.414 6.393
212 H VAL 32 HN VAL 32 58.991 4.179 4.122
213 HA VAL 32 HA VAL 32 60.131 4.665 2.106
214 HB VAL 32 HB VAL 32 57.462 4.432 0.719
215 1HG1 VAL 32 HG11 VAL 32 60.304 3.609 0.059
216 2HG1 VAL 32 HG12 VAL 32 59.401 4.942 -0.660
217 3HG1 VAL 32 HG13 VAL 32 58.907 3.278 -0.967
218 1HG2 VAL 32 HG21 VAL 32 58.284 1.874 0.696
219 2HG2 VAL 32 HG22 VAL 32 57.218 2.496 1.956
220 3HG2 VAL 32 HG23 VAL 32 58.949 2.347 2.259
221 H TYR 33 HN TYR 33 60.688 6.670 1.295
222 HA TYR 33 HA TYR 33 58.573 8.731 0.921
223 1HB TYR 33 HB2 TYR 33 60.800 8.691 2.937
224 2HB TYR 33 HB1 TYR 33 60.274 10.238 2.274
225 HD1 TYR 33 HD1 TYR 33 59.877 8.353 5.053
226 HD2 TYR 33 HD2 TYR 33 57.449 10.072 1.954
227 HE1 TYR 33 HE1 TYR 33 57.923 8.348 6.580
228 HE2 TYR 33 HE2 TYR 33 55.496 10.068 3.481
229 HH TYR 33 HH TYR 33 54.799 9.724 5.572
230 H GLY 34 HN GLY 34 60.045 7.451 -1.123
231 1HA GLY 34 HA2 GLY 34 60.862 9.223 -2.919
232 2HA GLY 34 HA1 GLY 34 62.235 9.337 -1.818
233 H THR 35 HN THR 35 61.473 6.263 -1.379
234 HA THR 35 HA THR 35 63.635 5.196 -2.896
235 HB THR 35 HB THR 35 61.169 3.955 -1.646
236 HG1 THR 35 HG1 THR 35 63.397 3.401 -0.369
237 1HG2 THR 35 HG21 THR 35 63.115 2.019 -1.642
238 2HG2 THR 35 HG22 THR 35 63.368 2.783 -3.211
239 3HG2 THR 35 HG23 THR 35 61.791 2.107 -2.803
240 H THR 36 HN THR 36 63.623 3.899 -4.813
241 HA THR 36 HA THR 36 61.504 4.614 -6.745
242 HB THR 36 HB THR 36 64.115 3.072 -6.920
243 HG1 THR 36 HG1 THR 36 64.925 4.954 -7.648
244 1HG2 THR 36 HG21 THR 36 63.866 3.111 -9.305
245 2HG2 THR 36 HG22 THR 36 62.434 4.136 -9.199
246 3HG2 THR 36 HG23 THR 36 62.363 2.462 -8.651
247 H CYS 37 HN CYS 37 62.259 2.038 -4.619
248 HA CYS 37 HA CYS 37 61.409 -0.162 -4.408
249 1HB CYS 37 HB2 CYS 37 59.446 1.717 -4.565
250 2HB CYS 37 HB1 CYS 37 58.984 0.669 -5.904
251 H THR 38 HN THR 38 63.103 -0.669 -6.231
252 HA THR 38 HA THR 38 61.924 -1.207 -8.885
253 HB THR 38 HB THR 38 64.651 -1.724 -7.651
254 HG1 THR 38 HG1 THR 38 64.020 0.478 -7.868
255 1HG2 THR 38 HG21 THR 38 65.030 -2.971 -9.484
256 2HG2 THR 38 HG22 THR 38 64.851 -1.497 -10.438
257 3HG2 THR 38 HG23 THR 38 63.459 -2.547 -10.167
258 H GLY 39 HN GLY 39 60.474 -2.947 -8.691
259 1HA GLY 39 HA2 GLY 39 59.731 -5.130 -8.204
260 2HA GLY 39 HA1 GLY 39 61.334 -5.580 -8.787
261 H SER 40 HN SER 40 59.800 -4.256 -5.838
262 HA SER 40 HA SER 40 61.237 -6.279 -4.215
263 1HB SER 40 HB2 SER 40 62.772 -4.341 -4.527
264 2HB SER 40 HB1 SER 40 61.547 -3.284 -3.832
265 HG SER 40 HG SER 40 62.644 -5.562 -2.536
266 H ARG 41 HN ARG 41 60.579 -5.936 -1.822
267 HA ARG 41 HA ARG 41 57.946 -4.605 -1.483
268 1HB ARG 41 HB2 ARG 41 58.503 -7.574 -1.197
269 2HB ARG 41 HB1 ARG 41 57.034 -6.795 -0.608
270 1HG ARG 41 HG2 ARG 41 56.282 -7.391 -2.696
271 2HG ARG 41 HG1 ARG 41 57.017 -5.845 -3.119
272 1HD ARG 41 HD2 ARG 41 59.179 -7.559 -3.256
273 2HD ARG 41 HD1 ARG 41 57.852 -8.565 -3.870
274 HE ARG 41 HE ARG 41 57.868 -5.831 -4.930
275 1HH1 ARG 41 HH2 ARG 41 60.219 -8.079 -5.316
276 2HH1 ARG 41 HH2 ARG 41 59.925 -8.416 -6.989
277 1HH2 ARG 41 HH1 ARG 41 56.919 -6.689 -7.082
278 2HH2 ARG 41 HH1 ARG 41 58.057 -7.628 -7.988
279 H PHE 42 HN PHE 42 57.346 -4.490 0.826
280 HA PHE 42 HA PHE 42 59.676 -4.942 2.665
281 1HB PHE 42 HB2 PHE 42 57.657 -2.723 2.979
282 2HB PHE 42 HB1 PHE 42 59.308 -2.804 3.590
283 HD1 PHE 42 HD1 PHE 42 61.043 -3.356 1.469
284 HD2 PHE 42 HD2 PHE 42 57.374 -1.130 1.316
285 HE1 PHE 42 HE1 PHE 42 61.846 -2.173 -0.558
286 HE2 PHE 42 HE2 PHE 42 58.176 0.054 -0.710
287 HZ PHE 42 HZ PHE 42 60.412 -0.467 -1.647
288 H ASP 43 HN ASP 43 58.678 -4.628 5.065
289 HA ASP 43 HA ASP 43 55.962 -5.577 5.465
290 1HB ASP 43 HB2 ASP 43 57.455 -7.527 4.532
291 2HB ASP 43 HB1 ASP 43 58.112 -7.563 6.169
292 H GLY 44 HN GLY 44 57.338 -3.422 6.567
293 1HA GLY 44 HA2 GLY 44 56.931 -2.916 9.024
294 2HA GLY 44 HA1 GLY 44 57.892 -4.359 9.350
295 H VAL 45 HN VAL 45 58.307 -1.470 7.240
296 HA VAL 45 HA VAL 45 60.975 -1.100 8.549
297 HB VAL 45 HB VAL 45 62.055 -1.042 6.475
298 1HG1 VAL 45 HG11 VAL 45 61.223 -3.311 6.840
299 2HG1 VAL 45 HG12 VAL 45 61.188 -2.934 5.116
300 3HG1 VAL 45 HG13 VAL 45 59.698 -2.899 6.057
301 1HG2 VAL 45 HG21 VAL 45 59.393 -0.114 5.487
302 2HG2 VAL 45 HG22 VAL 45 60.451 -0.932 4.337
303 3HG2 VAL 45 HG23 VAL 45 61.001 0.531 5.154
304 H THR 46 HN THR 46 61.778 1.109 7.088
305 HA THR 46 HA THR 46 59.707 3.166 6.975
306 HB THR 46 HB THR 46 61.784 3.303 9.176
307 HG1 THR 46 HG1 THR 46 60.532 2.085 10.304
308 1HG2 THR 46 HG21 THR 46 61.060 5.475 8.837
309 2HG2 THR 46 HG22 THR 46 59.854 4.919 9.997
310 3HG2 THR 46 HG23 THR 46 59.467 4.967 8.277
311 H ILE 47 HN ILE 47 61.390 2.498 4.972
312 HA ILE 47 HA ILE 47 63.911 3.994 5.082
313 HB ILE 47 HB ILE 47 63.501 1.818 3.886
314 1HG1 ILE 47 HG12 ILE 47 64.258 4.028 1.960
315 2HG1 ILE 47 HG11 ILE 47 65.320 3.506 3.269
316 1HG2 ILE 47 HG21 ILE 47 61.686 1.656 2.564
317 2HG2 ILE 47 HG22 ILE 47 62.399 2.847 1.475
318 3HG2 ILE 47 HG23 ILE 47 61.344 3.370 2.789
319 1HD1 ILE 47 HD1 ILE 47 66.013 1.760 2.037
320 2HD1 ILE 47 HD1 ILE 47 64.993 2.309 0.707
321 3HD1 ILE 47 HD1 ILE 47 64.352 1.181 1.902
322 H THR 48 HN THR 48 64.360 5.562 3.225
323 HA THR 48 HA THR 48 61.958 7.255 2.629
324 HB THR 48 HB THR 48 63.388 9.197 3.082
325 HG1 THR 48 HG1 THR 48 65.510 8.527 4.090
326 1HG2 THR 48 HG21 THR 48 62.987 7.059 5.093
327 2HG2 THR 48 HG22 THR 48 62.470 8.744 5.123
328 3HG2 THR 48 HG23 THR 48 64.131 8.323 5.541
329 H THR 49 HN THR 49 64.038 9.081 1.290
330 HA THR 49 HA THR 49 63.757 8.154 -1.386
331 HB THR 49 HB THR 49 65.601 10.092 0.021
332 HG1 THR 49 HG1 THR 49 63.623 10.651 -1.896
333 1HG2 THR 49 HG21 THR 49 65.991 10.939 -2.387
334 2HG2 THR 49 HG22 THR 49 65.450 9.339 -2.894
335 3HG2 THR 49 HG23 THR 49 66.883 9.505 -1.878
336 H SER 50 HN SER 50 64.475 5.861 -1.203
337 HA SER 50 HA SER 50 67.464 5.596 -1.089
338 1HB SER 50 HB2 SER 50 66.958 4.058 0.491
339 2HB SER 50 HB1 SER 50 65.238 4.221 0.158
340 HG SER 50 HG SER 50 65.401 2.677 -1.403
341 H THR 51 HN THR 51 68.469 4.607 -2.839
342 HA THR 51 HA THR 51 66.814 4.152 -5.252
343 HB THR 51 HB THR 51 69.817 4.021 -4.832
344 HG1 THR 51 HG1 THR 51 68.050 6.122 -4.923
345 1HG2 THR 51 HG21 THR 51 69.706 4.752 -7.300
346 2HG2 THR 51 HG22 THR 51 68.021 4.239 -7.241
347 3HG2 THR 51 HG23 THR 51 69.306 3.073 -6.934
348 H SER 52 HN SER 52 67.108 2.246 -2.793
349 HA SER 52 HA SER 52 68.516 -0.082 -3.281
350 1HB SER 52 HB2 SER 52 66.464 -1.185 -2.217
351 2HB SER 52 HB1 SER 52 67.155 0.172 -1.332
352 HG SER 52 HG SER 52 64.919 0.203 -3.086
353 H THR 53 HN THR 53 68.609 -1.473 -4.986
354 HA THR 53 HA THR 53 66.373 -1.437 -6.977
355 HB THR 53 HB THR 53 69.283 -2.293 -7.072
356 HG1 THR 53 HG1 THR 53 67.768 -0.139 -8.078
357 1HG2 THR 53 HG21 THR 53 67.009 -2.930 -8.819
358 2HG2 THR 53 HG22 THR 53 68.603 -3.680 -8.729
359 3HG2 THR 53 HG23 THR 53 68.374 -2.205 -9.671
360 H GLY 54 HN GLY 54 64.933 -2.966 -6.042
361 1HA GLY 54 HA2 GLY 54 64.125 -5.118 -5.559
362 2HA GLY 54 HA1 GLY 54 65.507 -5.740 -6.465
363 H SER 55 HN SER 55 64.361 -4.816 -3.273
364 HA SER 55 HA SER 55 66.441 -6.518 -2.051
365 1HB SER 55 HB2 SER 55 67.067 -4.485 -0.583
366 2HB SER 55 HB1 SER 55 67.670 -4.499 -2.238
367 HG SER 55 HG SER 55 65.206 -3.306 -1.518
368 H ARG 56 HN ARG 56 65.353 -7.639 -0.480
369 HA ARG 56 HA ARG 56 62.736 -6.798 0.484
370 1HB ARG 56 HB2 ARG 56 64.215 -9.142 0.253
371 2HB ARG 56 HB1 ARG 56 64.160 -8.870 1.994
372 1HG ARG 56 HG2 ARG 56 61.568 -8.287 1.128
373 2HG ARG 56 HG1 ARG 56 62.025 -9.716 0.201
374 1HD ARG 56 HD2 ARG 56 62.375 -9.496 3.210
375 2HD ARG 56 HD1 ARG 56 60.983 -10.274 2.429
376 HE ARG 56 HE ARG 56 63.592 -11.197 1.450
377 1HH1 ARG 56 HH1 ARG 56 61.167 -12.903 1.346
378 2HH1 ARG 56 HH1 ARG 56 61.418 -13.999 2.664
379 1HH2 ARG 56 HH2 ARG 56 63.858 -12.048 4.171
380 2HH2 ARG 56 HH2 ARG 56 62.942 -13.515 4.263
381 H ILE 57 HN ILE 57 62.860 -4.911 1.745
382 HA ILE 57 HA ILE 57 64.939 -4.674 3.834
383 HB ILE 57 HB ILE 57 62.686 -2.932 2.803
384 1HG1 ILE 57 HG12 ILE 57 65.420 -1.921 2.703
385 2HG1 ILE 57 HG11 ILE 57 65.264 -3.459 1.854
386 1HG2 ILE 57 HG21 ILE 57 64.349 -2.721 5.242
387 2HG2 ILE 57 HG22 ILE 57 62.787 -1.988 4.876
388 3HG2 ILE 57 HG23 ILE 57 64.269 -1.260 4.257
389 1HD1 ILE 57 HD1 ILE 57 64.143 -2.486 0.158
390 2HD1 ILE 57 HD1 ILE 57 64.516 -0.926 0.890
391 3HD1 ILE 57 HD1 ILE 57 63.001 -1.740 1.277
392 H SER 58 HN SER 58 62.413 -6.582 3.803
393 HA SER 58 HA SER 58 60.521 -5.950 5.739
394 1HB SER 58 HB2 SER 58 61.878 -8.341 4.709
395 2HB SER 58 HB1 SER 58 61.236 -8.558 6.334
396 HG SER 58 HG SER 58 59.711 -7.360 4.278
397 H GLY 59 HN GLY 59 60.433 -6.310 8.089
398 1HA GLY 59 HA2 GLY 59 62.498 -7.138 9.769
399 2HA GLY 59 HA1 GLY 59 62.831 -5.433 9.466
400 HA PRO 60 HA PRO 60 59.279 -6.086 12.568
401 1HB PRO 60 HB2 PRO 60 60.592 -6.551 14.921
402 2HB PRO 60 HB1 PRO 60 60.040 -7.856 13.853
403 1HG PRO 60 HG2 PRO 60 62.764 -6.741 14.228
404 2HG PRO 60 HG1 PRO 60 62.258 -8.401 13.883
405 1HD PRO 60 HD2 PRO 60 63.285 -6.643 12.014
406 2HD PRO 60 HD1 PRO 60 62.298 -8.070 11.634
407 H GLY 61 HN GLY 61 60.023 -3.748 11.634
408 1HA GLY 61 HA2 GLY 61 59.671 -1.564 12.789
409 2HA GLY 61 HA1 GLY 61 60.817 -2.116 14.013
410 H CYS 62 HN CYS 62 61.569 -3.005 10.796
411 HA CYS 62 HA CYS 62 64.125 -2.041 10.605
412 1HB CYS 62 HB2 CYS 62 62.030 -2.906 8.857
413 2HB CYS 62 HB1 CYS 62 62.850 -1.542 8.098
414 H LYS 63 HN LYS 63 65.073 -0.134 9.587
415 HA LYS 63 HA LYS 63 63.420 2.280 9.237
416 1HB LYS 63 HB2 LYS 63 63.675 2.195 11.656
417 2HB LYS 63 HB1 LYS 63 65.410 1.914 11.499
418 1HG LYS 63 HG2 LYS 63 65.656 4.125 10.404
419 2HG LYS 63 HG1 LYS 63 63.929 4.411 10.623
420 1HD LYS 63 HD2 LYS 63 64.452 3.859 13.144
421 2HD LYS 63 HD1 LYS 63 66.101 4.289 12.689
422 1HE LYS 63 HE2 LYS 63 65.590 6.494 12.699
423 2HE LYS 63 HE1 LYS 63 64.192 6.223 11.638
424 1HZ LYS 63 HZ1 LYS 63 63.878 6.943 14.141
425 2HZ LYS 63 HZ2 LYS 63 64.026 5.270 14.399
426 3HZ LYS 63 HZ3 LYS 63 62.803 5.871 13.387
427 H ILE 64 HN ILE 64 64.338 3.097 7.385
428 HA ILE 64 HA ILE 64 67.328 3.190 7.239
429 HB ILE 64 HB ILE 64 65.507 2.573 4.906
430 1HG1 ILE 64 HG12 ILE 64 66.527 0.165 5.422
431 2HG1 ILE 64 HG11 ILE 64 66.552 0.786 7.073
432 1HG2 ILE 64 HG21 ILE 64 67.809 1.396 4.312
433 2HG2 ILE 64 HG22 ILE 64 68.447 2.559 5.475
434 3HG2 ILE 64 HG23 ILE 64 67.587 3.125 4.043
435 1HD1 ILE 64 HD1 ILE 64 64.050 1.329 5.612
436 2HD1 ILE 64 HD1 ILE 64 64.288 0.742 7.257
437 3HD1 ILE 64 HD1 ILE 64 64.369 -0.382 5.900
438 H SER 65 HN SER 65 68.105 4.870 5.710
439 HA SER 65 HA SER 65 66.117 6.912 4.881
440 1HB SER 65 HB2 SER 65 66.714 8.429 6.478
441 2HB SER 65 HB1 SER 65 67.303 7.018 7.353
442 HG SER 65 HG SER 65 68.696 9.065 6.490
443 H THR 66 HN THR 66 66.713 7.448 2.829
444 HA THR 66 HA THR 66 68.069 7.712 0.909
445 HB THR 66 HB THR 66 70.069 8.778 2.896
446 HG1 THR 66 HG1 THR 66 67.571 9.856 2.112
447 1HG2 THR 66 HG21 THR 66 69.597 8.952 0.047
448 2HG2 THR 66 HG22 THR 66 70.973 9.538 0.983
449 3HG2 THR 66 HG23 THR 66 69.549 10.557 0.779
450 H CYS 67 HN CYS 67 68.302 5.202 1.090
451 HA CYS 67 HA CYS 67 71.217 4.529 1.405
452 1HB CYS 67 HB2 CYS 67 68.760 3.369 2.494
453 2HB CYS 67 HB1 CYS 67 69.725 2.181 1.630
454 H ILE 68 HN ILE 68 71.866 4.553 -0.768
455 HA ILE 68 HA ILE 68 70.368 4.030 -3.061
456 HB ILE 68 HB ILE 68 73.240 3.638 -2.258
457 1HG1 ILE 68 HG12 ILE 68 73.489 5.420 -4.045
458 2HG1 ILE 68 HG11 ILE 68 71.729 5.460 -4.152
459 1HG2 ILE 68 HG21 ILE 68 73.065 1.890 -3.856
460 2HG2 ILE 68 HG22 ILE 68 73.659 3.272 -4.775
461 3HG2 ILE 68 HG23 ILE 68 71.958 2.817 -4.869
462 1HD1 ILE 68 HD1 ILE 68 73.126 5.780 -1.500
463 2HD1 ILE 68 HD1 ILE 68 71.492 6.269 -1.949
464 3HD1 ILE 68 HD1 ILE 68 72.880 7.161 -2.569
465 H ILE 69 HN ILE 69 72.500 1.584 -1.549
466 HA ILE 69 HA ILE 69 72.312 -0.767 -1.479
467 HB ILE 69 HB ILE 69 69.353 -0.131 -1.627
468 1HG1 ILE 69 HG12 ILE 69 71.230 -0.006 0.760
469 2HG1 ILE 69 HG11 ILE 69 70.403 1.363 0.012
470 1HG2 ILE 69 HG21 ILE 69 70.880 -2.290 -0.145
471 2HG2 ILE 69 HG22 ILE 69 70.053 -2.528 -1.684
472 3HG2 ILE 69 HG23 ILE 69 69.129 -2.121 -0.238
473 1HD1 ILE 69 HD1 ILE 69 68.886 -1.019 1.085
474 2HD1 ILE 69 HD1 ILE 69 68.262 0.582 0.689
475 3HD1 ILE 69 HD1 ILE 69 69.294 0.364 2.102
476 H THR 70 HN THR 70 71.551 -2.670 -2.790
477 HA THR 70 HA THR 70 70.502 -1.988 -5.489
478 HB THR 70 HB THR 70 73.095 -3.476 -4.954
479 HG1 THR 70 HG1 THR 70 73.881 -1.522 -6.098
480 1HG2 THR 70 HG21 THR 70 72.427 -4.330 -6.991
481 2HG2 THR 70 HG22 THR 70 73.203 -2.847 -7.548
482 3HG2 THR 70 HG23 THR 70 71.449 -2.915 -7.380
483 H GLY 71 HN GLY 71 72.097 -5.016 -5.259
484 1HA GLY 71 HA2 GLY 71 69.511 -6.407 -5.249
485 2HA GLY 71 HA1 GLY 71 71.091 -7.151 -5.494
486 H GLY 72 HN GLY 72 69.058 -5.687 -2.961
487 1HA GLY 72 HA2 GLY 72 68.874 -6.238 -0.686
488 2HA GLY 72 HA1 GLY 72 69.572 -7.806 -1.104
489 H VAL 73 HN VAL 73 71.501 -5.212 -2.133
490 HA VAL 73 HA VAL 73 73.322 -5.593 0.226
491 HB VAL 73 HB VAL 73 75.111 -5.263 -1.405
492 1HG1 VAL 73 HG11 VAL 73 73.458 -7.030 -3.067
493 2HG1 VAL 73 HG12 VAL 73 73.386 -7.427 -1.350
494 3HG1 VAL 73 HG13 VAL 73 74.941 -7.387 -2.182
495 1HG2 VAL 73 HG21 VAL 73 73.967 -5.214 -3.900
496 2HG2 VAL 73 HG22 VAL 73 74.553 -3.785 -3.050
497 3HG2 VAL 73 HG23 VAL 73 72.842 -4.212 -2.981
498 HA PRO 74 HA PRO 74 72.747 -1.217 0.733
499 1HB PRO 74 HB2 PRO 74 74.582 -0.859 2.720
500 2HB PRO 74 HB1 PRO 74 72.997 -1.599 3.001
501 1HG PRO 74 HG2 PRO 74 75.659 -2.873 2.782
502 2HG PRO 74 HG1 PRO 74 74.253 -3.344 3.746
503 1HD PRO 74 HD2 PRO 74 75.036 -4.528 1.359
504 2HD PRO 74 HD1 PRO 74 73.423 -4.655 2.093
505 H ALA 75 HN ALA 75 73.756 0.550 -0.241
506 HA ALA 75 HA ALA 75 76.296 0.083 -1.651
507 1HB ALA 75 HB1 ALA 75 74.173 1.262 -2.490
508 2HB ALA 75 HB2 ALA 75 75.698 2.094 -2.797
509 3HB ALA 75 HB3 ALA 75 74.656 2.620 -1.474
510 HA PRO 76 HA PRO 76 78.829 2.203 1.248
511 1HB PRO 76 HB2 PRO 76 80.790 3.146 -0.405
512 2HB PRO 76 HB1 PRO 76 80.625 1.432 0.017
513 1HG PRO 76 HG2 PRO 76 79.918 2.835 -2.484
514 2HG PRO 76 HG1 PRO 76 80.443 1.166 -2.231
515 1HD PRO 76 HD2 PRO 76 77.823 2.008 -2.683
516 2HD PRO 76 HD1 PRO 76 78.314 0.422 -2.053
517 H SER 77 HN SER 77 76.636 3.799 0.776
518 HA SER 77 HA SER 77 77.524 6.432 -0.236
519 1HB SER 77 HB2 SER 77 75.215 5.139 -0.435
520 2HB SER 77 HB1 SER 77 74.908 5.894 1.127
521 HG SER 77 HG SER 77 74.364 7.066 -0.949
522 H ALA 78 HN ALA 78 77.355 8.360 1.125
523 HA ALA 78 HA ALA 78 78.314 7.900 3.868
524 1HB ALA 78 HB1 ALA 78 79.231 9.597 2.264
525 2HB ALA 78 HB2 ALA 78 78.696 10.313 3.785
526 3HB ALA 78 HB3 ALA 78 77.689 10.449 2.344
527 H ALA 79 HN ALA 79 75.289 8.445 2.338
528 HA ALA 79 HA ALA 79 74.077 9.485 4.868
529 1HB ALA 79 HB1 ALA 79 72.231 9.432 2.716
530 2HB ALA 79 HB2 ALA 79 73.770 9.966 2.040
531 3HB ALA 79 HB3 ALA 79 73.047 10.845 3.388
532 H CYS 80 HN CYS 80 74.189 6.732 2.725
533 HA CYS 80 HA CYS 80 71.711 5.477 3.413
534 1HB CYS 80 HB2 CYS 80 73.064 4.815 1.509
535 2HB CYS 80 HB1 CYS 80 74.422 4.420 2.559
536 H LYS 81 HN LYS 81 71.102 4.692 5.391
537 HA LYS 81 HA LYS 81 73.146 4.295 7.497
538 1HB LYS 81 HB2 LYS 81 71.211 4.311 8.956
539 2HB LYS 81 HB1 LYS 81 71.000 5.600 7.771
540 1HG LYS 81 HG2 LYS 81 68.982 4.662 7.349
541 2HG LYS 81 HG1 LYS 81 69.886 3.412 6.495
542 1HD LYS 81 HD2 LYS 81 70.041 2.757 9.238
543 2HD LYS 81 HD1 LYS 81 68.360 3.188 8.931
544 1HE LYS 81 HE2 LYS 81 68.238 1.567 7.090
545 2HE LYS 81 HE1 LYS 81 69.957 1.196 7.280
546 1HZ LYS 81 HZ1 LYS 81 68.948 0.993 9.807
547 2HZ LYS 81 HZ2 LYS 81 69.314 -0.307 8.777
548 3HZ LYS 81 HZ3 LYS 81 67.732 0.305 8.847
549 H ILE 82 HN ILE 82 72.103 2.338 9.043
550 HA ILE 82 HA ILE 82 71.164 -0.033 7.745
551 HB ILE 82 HB ILE 82 73.619 0.635 6.855
552 1HG1 ILE 82 HG12 ILE 82 73.920 -1.809 6.353
553 2HG1 ILE 82 HG11 ILE 82 72.562 -2.143 7.429
554 1HG2 ILE 82 HG21 ILE 82 74.405 0.344 9.334
555 2HG2 ILE 82 HG22 ILE 82 75.396 -0.310 8.031
556 3HG2 ILE 82 HG23 ILE 82 74.346 -1.379 8.960
557 1HD1 ILE 82 HD1 ILE 82 71.017 -1.066 6.026
558 2HD1 ILE 82 HD1 ILE 82 72.094 -1.852 4.872
559 3HD1 ILE 82 HD1 ILE 82 72.269 -0.130 5.208
560 H SER 83 HN SER 83 70.741 1.346 10.215
561 HA SER 83 HA SER 83 72.144 0.087 12.401
562 1HB SER 83 HB2 SER 83 69.726 1.814 12.005
563 2HB SER 83 HB1 SER 83 70.004 1.085 13.583
564 HG SER 83 HG SER 83 71.064 3.261 12.724
565 H GLY 84 HN GLY 84 68.680 -0.040 12.629
566 1HA GLY 84 HA2 GLY 84 68.864 -2.967 13.061
567 2HA GLY 84 HA1 GLY 84 67.538 -1.930 13.583
568 H CYS 85 HN CYS 85 69.081 -2.976 10.518
569 HA CYS 85 HA CYS 85 66.471 -3.829 9.504
570 1HB CYS 85 HB2 CYS 85 66.789 -1.242 9.305
571 2HB CYS 85 HB1 CYS 85 67.894 -1.643 7.995
572 H THR 86 HN THR 86 66.919 -4.234 6.907
573 HA THR 86 HA THR 86 69.601 -4.969 6.152
574 HB THR 86 HB THR 86 69.344 -6.581 7.948
575 HG1 THR 86 HG1 THR 86 70.017 -8.179 6.757
576 1HG2 THR 86 HG21 THR 86 66.627 -6.815 6.776
577 2HG2 THR 86 HG22 THR 86 67.143 -6.945 8.458
578 3HG2 THR 86 HG23 THR 86 67.341 -8.316 7.366
579 H PHE 87 HN PHE 87 69.618 -6.116 4.080
580 HA PHE 87 HA PHE 87 66.974 -6.001 2.661
581 1HB PHE 87 HB2 PHE 87 69.692 -5.717 1.372
582 2HB PHE 87 HB1 PHE 87 68.135 -5.143 0.783
583 HD1 PHE 87 HD1 PHE 87 67.182 -3.983 3.486
584 HD2 PHE 87 HD2 PHE 87 70.854 -3.608 1.287
585 HE1 PHE 87 HE1 PHE 87 67.606 -1.788 4.572
586 HE2 PHE 87 HE2 PHE 87 71.270 -1.413 2.367
587 HZ PHE 87 HZ PHE 87 69.648 -0.508 4.007
588 H SER 88 HN SER 88 66.681 -7.664 0.991
589 HA SER 88 HA SER 88 68.573 -9.977 1.148
590 1HB SER 88 HB2 SER 88 65.670 -10.573 1.084
591 2HB SER 88 HB1 SER 88 66.956 -11.361 1.993
592 HG SER 88 HG SER 88 66.845 -9.787 3.515
593 H ALA 89 HN ALA 89 67.635 -7.808 -0.894
594 HA ALA 89 HA ALA 89 67.258 -7.742 -3.226
595 1HB ALA 89 HB1 ALA 89 68.886 -9.974 -2.522
596 2HB ALA 89 HB2 ALA 89 68.849 -9.109 -4.059
597 3HB ALA 89 HB3 ALA 89 67.798 -10.503 -3.804
598 H ASN 90 HN ASN 90 64.903 -7.541 -2.802
599 HA ASN 90 HA ASN 90 63.412 -10.004 -3.633
600 1HB ASN 90 HB2 ASN 90 63.193 -9.552 -1.224
601 2HB ASN 90 HB1 ASN 90 62.659 -7.907 -1.556
602 1HD2 ASN 90 HD2 ASN 90 60.499 -8.195 -0.704
603 2HD2 ASN 90 HD2 ASN 90 59.363 -9.219 -1.440
Start of MODEL 23
1 1H ASP 1 HT1 ASP 1 46.129 6.247 3.955
2 2H ASP 1 HT2 ASP 1 47.641 6.964 4.248
3 3H ASP 1 HT3 ASP 1 47.409 5.310 4.556
4 HA ASP 1 HA ASP 1 48.618 6.039 2.384
5 1HB ASP 1 HB2 ASP 1 47.679 3.962 1.400
6 2HB ASP 1 HB1 ASP 1 48.007 3.763 3.122
7 H GLY 2 HN GLY 2 48.059 6.382 0.096
8 1HA GLY 2 HA2 GLY 2 45.327 7.500 -0.348
9 2HA GLY 2 HA1 GLY 2 46.747 8.426 -0.834
10 H SER 3 HN SER 3 46.881 8.310 -3.026
11 HA SER 3 HA SER 3 46.106 5.808 -4.426
12 1HB SER 3 HB2 SER 3 46.245 7.260 -6.404
13 2HB SER 3 HB1 SER 3 45.315 8.063 -5.141
14 HG SER 3 HG SER 3 47.114 9.247 -6.281
15 H CYS 4 HN CYS 4 48.867 6.978 -2.997
16 HA CYS 4 HA CYS 4 50.828 6.353 -5.070
17 1HB CYS 4 HB2 CYS 4 51.365 7.995 -3.418
18 2HB CYS 4 HB1 CYS 4 50.893 6.921 -2.099
19 H THR 5 HN THR 5 52.261 4.521 -5.048
20 HA THR 5 HA THR 5 52.010 2.363 -3.136
21 HB THR 5 HB THR 5 50.592 2.295 -5.809
22 HG1 THR 5 HG1 THR 5 48.929 2.262 -4.555
23 1HG2 THR 5 HG21 THR 5 51.529 0.231 -6.064
24 2HG2 THR 5 HG22 THR 5 50.324 -0.241 -4.870
25 3HG2 THR 5 HG23 THR 5 51.973 0.113 -4.362
26 H ASN 6 HN ASN 6 52.366 2.011 -6.617
27 HA ASN 6 HA ASN 6 55.049 2.530 -7.090
28 1HB ASN 6 HB2 ASN 6 55.975 0.146 -6.650
29 2HB ASN 6 HB1 ASN 6 55.744 1.213 -5.265
30 1HD2 ASN 6 HD2 ASN 6 55.122 -0.234 -3.618
31 2HD2 ASN 6 HD2 ASN 6 53.809 -1.304 -3.740
32 H THR 7 HN THR 7 52.810 2.446 -8.673
33 HA THR 7 HA THR 7 52.145 1.728 -10.821
34 HB THR 7 HB THR 7 54.488 -0.136 -10.883
35 HG1 THR 7 HG1 THR 7 55.150 2.445 -11.420
36 1HG2 THR 7 HG21 THR 7 54.568 0.463 -13.142
37 2HG2 THR 7 HG22 THR 7 53.779 2.015 -12.859
38 3HG2 THR 7 HG23 THR 7 52.838 0.525 -12.803
39 H ASN 8 HN ASN 8 53.707 -1.178 -9.380
40 HA ASN 8 HA ASN 8 51.940 -3.113 -10.353
41 1HB ASN 8 HB2 ASN 8 53.969 -3.653 -9.138
42 2HB ASN 8 HB1 ASN 8 53.347 -2.886 -7.675
43 1HD2 ASN 8 HD2 ASN 8 51.157 -3.889 -6.887
44 2HD2 ASN 8 HD2 ASN 8 51.008 -5.572 -7.017
45 H SER 9 HN SER 9 51.518 -0.931 -7.602
46 HA SER 9 HA SER 9 49.522 -0.275 -6.528
47 1HB SER 9 HB2 SER 9 47.970 -2.224 -8.184
48 2HB SER 9 HB1 SER 9 47.555 -0.578 -7.719
49 HG SER 9 HG SER 9 48.277 -0.088 -9.629
50 H GLN 10 HN GLN 10 50.987 -2.087 -5.079
51 HA GLN 10 HA GLN 10 48.886 -4.000 -4.108
52 1HB GLN 10 HB2 GLN 10 51.534 -4.472 -5.139
53 2HB GLN 10 HB1 GLN 10 51.473 -4.961 -3.446
54 1HG GLN 10 HG2 GLN 10 49.534 -6.360 -3.859
55 2HG GLN 10 HG1 GLN 10 49.433 -5.795 -5.526
56 1HE2 GLN 10 HE21 GLN 10 50.260 -7.333 -6.942
57 2HE2 GLN 10 HE22 GLN 10 51.581 -8.349 -6.622
58 H LEU 11 HN LEU 11 49.995 -1.191 -3.334
59 HA LEU 11 HA LEU 11 51.408 -1.196 -0.924
60 1HB LEU 11 HB2 LEU 11 50.395 0.696 -2.385
61 2HB LEU 11 HB1 LEU 11 48.946 0.484 -1.401
62 HG LEU 11 HG LEU 11 50.190 0.950 0.631
63 1HD1 LEU 11 HD1 LEU 11 52.328 0.109 0.455
64 2HD1 LEU 11 HD1 LEU 11 52.675 1.798 0.077
65 3HD1 LEU 11 HD1 LEU 11 52.503 0.620 -1.224
66 1HD2 LEU 11 HD2 LEU 11 49.394 2.862 -0.840
67 2HD2 LEU 11 HD2 LEU 11 51.045 2.984 -1.446
68 3HD2 LEU 11 HD2 LEU 11 50.709 3.271 0.261
69 H SER 12 HN SER 12 50.881 -2.987 0.428
70 HA SER 12 HA SER 12 48.467 -4.101 1.137
71 1HB SER 12 HB2 SER 12 49.846 -5.076 2.646
72 2HB SER 12 HB1 SER 12 51.095 -3.939 2.150
73 HG SER 12 HG SER 12 50.705 -3.786 4.378
74 H ALA 13 HN ALA 13 46.752 -3.572 2.563
75 HA ALA 13 HA ALA 13 46.044 -0.809 2.834
76 1HB ALA 13 HB1 ALA 13 44.585 -2.897 2.762
77 2HB ALA 13 HB2 ALA 13 44.140 -1.713 3.990
78 3HB ALA 13 HB3 ALA 13 45.034 -3.163 4.446
79 H ASN 14 HN ASN 14 48.344 -0.367 3.862
80 HA ASN 14 HA ASN 14 47.983 0.397 6.603
81 1HB ASN 14 HB2 ASN 14 48.101 -2.102 6.808
82 2HB ASN 14 HB1 ASN 14 49.712 -2.049 6.098
83 1HD2 ASN 14 HD2 ASN 14 51.216 -0.344 7.330
84 2HD2 ASN 14 HD2 ASN 14 51.140 -0.420 9.022
85 H SER 15 HN SER 15 50.193 -0.449 3.979
86 HA SER 15 HA SER 15 52.606 0.704 4.820
87 1HB SER 15 HB2 SER 15 52.446 -0.478 2.744
88 2HB SER 15 HB1 SER 15 51.182 0.594 2.154
89 HG SER 15 HG SER 15 52.660 2.201 1.904
90 H LYS 16 HN LYS 16 53.401 2.875 3.546
91 HA LYS 16 HA LYS 16 51.360 5.029 3.826
92 1HB LYS 16 HB2 LYS 16 52.900 4.375 5.932
93 2HB LYS 16 HB1 LYS 16 54.028 5.446 5.098
94 1HG LYS 16 HG2 LYS 16 51.730 6.903 4.928
95 2HG LYS 16 HG1 LYS 16 51.491 6.088 6.475
96 1HD LYS 16 HD2 LYS 16 53.384 7.061 7.434
97 2HD LYS 16 HD1 LYS 16 54.142 7.366 5.871
98 1HE LYS 16 HE2 LYS 16 53.414 9.518 6.508
99 2HE LYS 16 HE1 LYS 16 52.068 8.956 5.495
100 1HZ LYS 16 HZ1 LYS 16 52.249 9.102 8.426
101 2HZ LYS 16 HZ2 LYS 16 51.284 7.893 7.722
102 3HZ LYS 16 HZ3 LYS 16 50.963 9.532 7.408
103 H CYS 17 HN CYS 17 52.134 7.083 2.845
104 HA CYS 17 HA CYS 17 54.646 7.324 1.475
105 1HB CYS 17 HB2 CYS 17 53.869 5.517 0.100
106 2HB CYS 17 HB1 CYS 17 52.265 6.236 -0.050
107 H GLU 18 HN GLU 18 54.823 9.393 0.491
108 HA GLU 18 HA GLU 18 52.343 11.071 0.441
109 1HB GLU 18 HB2 GLU 18 53.556 11.413 2.552
110 2HB GLU 18 HB1 GLU 18 55.042 11.742 1.658
111 1HG GLU 18 HG2 GLU 18 53.866 13.656 0.533
112 2HG GLU 18 HG1 GLU 18 52.493 13.380 1.606
113 H LYS 19 HN LYS 19 55.617 10.469 -0.774
114 HA LYS 19 HA LYS 19 54.968 11.677 -3.340
115 1HB LYS 19 HB2 LYS 19 55.448 13.524 -1.509
116 2HB LYS 19 HB1 LYS 19 57.131 13.101 -1.821
117 1HG LYS 19 HG2 LYS 19 56.085 13.300 -4.370
118 2HG LYS 19 HG1 LYS 19 55.240 14.585 -3.504
119 1HD LYS 19 HD2 LYS 19 57.193 15.743 -3.029
120 2HD LYS 19 HD1 LYS 19 58.190 14.290 -3.093
121 1HE LYS 19 HE2 LYS 19 56.831 15.313 -5.588
122 2HE LYS 19 HE1 LYS 19 58.397 15.967 -5.069
123 1HZ LYS 19 HZ1 LYS 19 59.079 14.150 -6.264
124 2HZ LYS 19 HZ2 LYS 19 57.706 13.228 -5.877
125 3HZ LYS 19 HZ3 LYS 19 58.934 13.451 -4.726
126 H SER 20 HN SER 20 56.008 9.130 -2.574
127 HA SER 20 HA SER 20 58.918 9.215 -3.140
128 1HB SER 20 HB2 SER 20 57.476 6.643 -2.912
129 2HB SER 20 HB1 SER 20 58.915 7.199 -2.065
130 HG SER 20 HG SER 20 56.832 6.954 -0.851
131 H THR 21 HN THR 21 59.570 7.266 -4.713
132 HA THR 21 HA THR 21 57.738 7.241 -7.084
133 HB THR 21 HB THR 21 59.310 8.949 -7.593
134 HG1 THR 21 HG1 THR 21 59.220 6.974 -9.035
135 1HG2 THR 21 HG21 THR 21 61.835 8.376 -7.284
136 2HG2 THR 21 HG22 THR 21 61.249 7.148 -6.164
137 3HG2 THR 21 HG23 THR 21 60.897 8.850 -5.868
138 H LEU 22 HN LEU 22 57.303 5.013 -6.288
139 HA LEU 22 HA LEU 22 59.575 3.108 -6.395
140 1HB LEU 22 HB2 LEU 22 56.623 2.776 -5.769
141 2HB LEU 22 HB1 LEU 22 57.870 1.560 -5.500
142 HG LEU 22 HG LEU 22 57.648 4.266 -4.155
143 1HD1 LEU 22 HD1 LEU 22 57.614 1.438 -3.054
144 2HD1 LEU 22 HD1 LEU 22 56.184 2.442 -3.292
145 3HD1 LEU 22 HD1 LEU 22 57.413 2.920 -2.120
146 1HD2 LEU 22 HD2 LEU 22 59.800 2.141 -3.890
147 2HD2 LEU 22 HD2 LEU 22 59.700 3.631 -2.953
148 3HD2 LEU 22 HD2 LEU 22 60.006 3.700 -4.687
149 H THR 23 HN THR 23 58.733 0.889 -7.448
150 HA THR 23 HA THR 23 57.128 1.206 -9.877
151 HB THR 23 HB THR 23 60.141 1.127 -9.842
152 HG1 THR 23 HG1 THR 23 59.345 2.494 -11.819
153 1HG2 THR 23 HG21 THR 23 60.076 0.474 -12.248
154 2HG2 THR 23 HG22 THR 23 58.350 0.153 -12.087
155 3HG2 THR 23 HG23 THR 23 59.515 -0.816 -11.184
156 H ASN 24 HN ASN 24 56.035 -0.711 -9.872
157 HA ASN 24 HA ASN 24 55.602 -3.022 -9.680
158 1HB ASN 24 HB2 ASN 24 58.498 -2.767 -10.417
159 2HB ASN 24 HB1 ASN 24 57.879 -4.359 -9.986
160 1HD2 ASN 24 HD2 ASN 24 58.737 -3.600 -12.680
161 2HD2 ASN 24 HD2 ASN 24 57.372 -3.706 -13.684
162 H CYS 25 HN CYS 25 55.156 -2.425 -7.303
163 HA CYS 25 HA CYS 25 56.948 -4.073 -5.578
164 1HB CYS 25 HB2 CYS 25 56.722 -1.170 -5.617
165 2HB CYS 25 HB1 CYS 25 56.285 -1.815 -4.043
166 H TYR 26 HN TYR 26 55.655 -3.283 -3.162
167 HA TYR 26 HA TYR 26 52.759 -3.628 -3.469
168 1HB TYR 26 HB2 TYR 26 53.091 -5.899 -3.685
169 2HB TYR 26 HB1 TYR 26 54.696 -5.828 -2.966
170 HD1 TYR 26 HD1 TYR 26 54.867 -5.497 -0.430
171 HD2 TYR 26 HD2 TYR 26 51.228 -6.613 -2.419
172 HE1 TYR 26 HE1 TYR 26 53.953 -6.339 1.714
173 HE2 TYR 26 HE2 TYR 26 50.312 -7.451 -0.273
174 HH TYR 26 HH TYR 26 52.205 -8.029 2.429
175 H VAL 27 HN VAL 27 55.612 -3.729 -1.416
176 HA VAL 27 HA VAL 27 56.039 -2.870 0.727
177 HB VAL 27 HB VAL 27 53.768 -1.021 -0.030
178 1HG1 VAL 27 HG11 VAL 27 55.729 0.505 1.046
179 2HG1 VAL 27 HG12 VAL 27 56.030 -1.012 1.897
180 3HG1 VAL 27 HG13 VAL 27 54.449 -0.233 2.011
181 1HG2 VAL 27 HG21 VAL 27 55.505 0.288 -1.241
182 2HG2 VAL 27 HG22 VAL 27 55.269 -1.304 -1.966
183 3HG2 VAL 27 HG23 VAL 27 56.669 -1.001 -0.935
184 H ASP 28 HN ASP 28 55.174 -2.640 2.884
185 HA ASP 28 HA ASP 28 52.414 -3.231 3.550
186 1HB ASP 28 HB2 ASP 28 52.826 -5.444 2.879
187 2HB ASP 28 HB1 ASP 28 54.503 -5.398 3.421
188 H LYS 29 HN LYS 29 52.157 -2.282 5.548
189 HA LYS 29 HA LYS 29 52.786 -1.241 7.586
190 1HB LYS 29 HB2 LYS 29 54.325 -3.857 7.567
191 2HB LYS 29 HB1 LYS 29 54.104 -2.858 9.006
192 1HG LYS 29 HG2 LYS 29 51.580 -2.995 8.489
193 2HG LYS 29 HG1 LYS 29 52.003 -4.316 7.402
194 1HD LYS 29 HD2 LYS 29 53.088 -5.511 9.274
195 2HD LYS 29 HD1 LYS 29 52.653 -4.193 10.364
196 1HE LYS 29 HE2 LYS 29 50.207 -4.647 9.468
197 2HE LYS 29 HE1 LYS 29 50.873 -6.245 9.080
198 1HZ LYS 29 HZ1 LYS 29 49.973 -5.962 11.409
199 2HZ LYS 29 HZ2 LYS 29 51.297 -4.937 11.704
200 3HZ LYS 29 HZ3 LYS 29 51.555 -6.567 11.292
201 H SER 30 HN SER 30 54.259 -0.279 5.350
202 HA SER 30 HA SER 30 56.944 0.198 6.605
203 1HB SER 30 HB2 SER 30 56.148 -0.334 3.735
204 2HB SER 30 HB1 SER 30 57.734 0.280 4.189
205 HG SER 30 HG SER 30 56.762 -2.233 4.300
206 H GLU 31 HN GLU 31 57.874 2.292 6.075
207 HA GLU 31 HA GLU 31 55.849 4.329 5.196
208 1HB GLU 31 HB2 GLU 31 57.429 3.996 7.598
209 2HB GLU 31 HB1 GLU 31 57.865 5.508 6.804
210 1HG GLU 31 HG2 GLU 31 55.307 5.893 6.596
211 2HG GLU 31 HG1 GLU 31 55.166 4.633 7.822
212 H VAL 32 HN VAL 32 56.571 4.499 3.030
213 HA VAL 32 HA VAL 32 59.474 4.955 2.551
214 HB VAL 32 HB VAL 32 57.131 4.546 0.666
215 1HG1 VAL 32 HG11 VAL 32 60.132 4.368 0.246
216 2HG1 VAL 32 HG12 VAL 32 59.071 5.621 -0.398
217 3HG1 VAL 32 HG13 VAL 32 58.911 3.956 -0.959
218 1HG2 VAL 32 HG21 VAL 32 59.219 2.505 1.440
219 2HG2 VAL 32 HG22 VAL 32 57.662 2.235 0.656
220 3HG2 VAL 32 HG23 VAL 32 57.725 2.681 2.362
221 H TYR 33 HN TYR 33 60.100 6.796 1.149
222 HA TYR 33 HA TYR 33 58.120 9.039 1.089
223 1HB TYR 33 HB2 TYR 33 60.842 8.884 2.371
224 2HB TYR 33 HB1 TYR 33 60.189 10.437 1.849
225 HD1 TYR 33 HD1 TYR 33 58.543 11.565 3.125
226 HD2 TYR 33 HD2 TYR 33 59.459 7.451 3.969
227 HE1 TYR 33 HE1 TYR 33 57.153 11.675 5.174
228 HE2 TYR 33 HE2 TYR 33 58.069 7.562 6.018
229 HH TYR 33 HH TYR 33 56.140 10.425 6.777
230 H GLY 34 HN GLY 34 61.389 7.970 0.051
231 1HA GLY 34 HA2 GLY 34 60.791 9.049 -2.647
232 2HA GLY 34 HA1 GLY 34 62.225 9.668 -1.828
233 H THR 35 HN THR 35 61.181 6.349 -1.414
234 HA THR 35 HA THR 35 63.765 5.324 -2.265
235 HB THR 35 HB THR 35 61.098 4.203 -1.405
236 HG1 THR 35 HG1 THR 35 62.651 5.049 0.099
237 1HG2 THR 35 HG21 THR 35 62.015 1.946 -1.544
238 2HG2 THR 35 HG22 THR 35 63.524 2.574 -2.206
239 3HG2 THR 35 HG23 THR 35 62.035 2.689 -3.144
240 H THR 36 HN THR 36 64.143 3.934 -4.102
241 HA THR 36 HA THR 36 62.215 4.358 -6.362
242 HB THR 36 HB THR 36 65.224 3.946 -6.309
243 HG1 THR 36 HG1 THR 36 63.806 6.205 -7.209
244 1HG2 THR 36 HG21 THR 36 65.125 3.510 -8.513
245 2HG2 THR 36 HG22 THR 36 64.141 4.948 -8.790
246 3HG2 THR 36 HG23 THR 36 63.369 3.419 -8.372
247 H CYS 37 HN CYS 37 61.089 2.373 -5.569
248 HA CYS 37 HA CYS 37 62.344 -0.184 -5.341
249 1HB CYS 37 HB2 CYS 37 60.211 0.049 -4.408
250 2HB CYS 37 HB1 CYS 37 59.584 0.911 -5.808
251 H THR 38 HN THR 38 62.444 -1.925 -6.875
252 HA THR 38 HA THR 38 61.963 -1.221 -9.746
253 HB THR 38 HB THR 38 64.456 -2.492 -8.561
254 HG1 THR 38 HG1 THR 38 63.816 0.113 -9.422
255 1HG2 THR 38 HG21 THR 38 64.454 -3.323 -10.706
256 2HG2 THR 38 HG22 THR 38 65.183 -1.749 -11.023
257 3HG2 THR 38 HG23 THR 38 63.465 -2.002 -11.330
258 H GLY 39 HN GLY 39 60.343 -2.879 -8.042
259 1HA GLY 39 HA2 GLY 39 59.208 -4.910 -8.801
260 2HA GLY 39 HA1 GLY 39 60.763 -5.511 -9.375
261 H SER 40 HN SER 40 60.284 -3.962 -6.241
262 HA SER 40 HA SER 40 60.839 -6.609 -4.932
263 1HB SER 40 HB2 SER 40 61.696 -3.839 -4.039
264 2HB SER 40 HB1 SER 40 62.228 -5.378 -3.369
265 HG SER 40 HG SER 40 62.839 -4.174 -5.838
266 H ARG 41 HN ARG 41 60.559 -5.393 -2.277
267 HA ARG 41 HA ARG 41 58.024 -4.071 -1.970
268 1HB ARG 41 HB2 ARG 41 56.766 -6.128 -1.200
269 2HB ARG 41 HB1 ARG 41 57.137 -6.110 -2.923
270 1HG ARG 41 HG2 ARG 41 58.063 -8.145 -2.602
271 2HG ARG 41 HG1 ARG 41 59.382 -7.293 -1.799
272 1HD ARG 41 HD2 ARG 41 58.125 -7.470 0.366
273 2HD ARG 41 HD1 ARG 41 56.913 -8.462 -0.469
274 HE ARG 41 HE ARG 41 59.683 -9.276 0.137
275 1HH1 ARG 41 HH2 ARG 41 56.944 -10.777 0.316
276 2HH1 ARG 41 HH2 ARG 41 57.196 -11.992 -0.893
277 1HH2 ARG 41 HH1 ARG 41 59.954 -10.414 -2.283
278 2HH2 ARG 41 HH1 ARG 41 58.900 -11.786 -2.363
279 H PHE 42 HN PHE 42 57.268 -4.215 0.371
280 HA PHE 42 HA PHE 42 59.582 -4.791 2.195
281 1HB PHE 42 HB2 PHE 42 57.453 -2.659 2.499
282 2HB PHE 42 HB1 PHE 42 58.960 -2.802 3.403
283 HD1 PHE 42 HD1 PHE 42 60.746 -3.591 1.058
284 HD2 PHE 42 HD2 PHE 42 57.795 -0.504 1.518
285 HE1 PHE 42 HE1 PHE 42 61.904 -2.229 -0.663
286 HE2 PHE 42 HE2 PHE 42 58.952 0.860 -0.199
287 HZ PHE 42 HZ PHE 42 61.006 -0.001 -1.289
288 H ASP 43 HN ASP 43 58.403 -4.524 4.616
289 HA ASP 43 HA ASP 43 55.785 -5.702 4.888
290 1HB ASP 43 HB2 ASP 43 57.725 -7.456 4.017
291 2HB ASP 43 HB1 ASP 43 57.771 -7.700 5.764
292 H GLY 44 HN GLY 44 56.990 -3.537 6.141
293 1HA GLY 44 HA2 GLY 44 56.512 -3.121 8.579
294 2HA GLY 44 HA1 GLY 44 57.456 -4.571 8.910
295 H VAL 45 HN VAL 45 57.908 -1.522 7.045
296 HA VAL 45 HA VAL 45 60.547 -1.249 8.430
297 HB VAL 45 HB VAL 45 61.661 -0.954 6.357
298 1HG1 VAL 45 HG11 VAL 45 61.104 -3.297 6.741
299 2HG1 VAL 45 HG12 VAL 45 61.005 -2.945 5.016
300 3HG1 VAL 45 HG13 VAL 45 59.531 -3.074 5.975
301 1HG2 VAL 45 HG21 VAL 45 60.607 0.305 4.809
302 2HG2 VAL 45 HG22 VAL 45 59.027 -0.056 5.501
303 3HG2 VAL 45 HG23 VAL 45 59.746 -1.157 4.324
304 H THR 46 HN THR 46 61.363 0.991 6.967
305 HA THR 46 HA THR 46 59.339 3.089 6.952
306 HB THR 46 HB THR 46 61.402 2.928 9.177
307 HG1 THR 46 HG1 THR 46 58.693 2.334 8.965
308 1HG2 THR 46 HG21 THR 46 60.682 5.226 8.124
309 2HG2 THR 46 HG22 THR 46 60.713 5.046 9.878
310 3HG2 THR 46 HG23 THR 46 59.183 4.945 9.009
311 H ILE 47 HN ILE 47 60.900 2.498 4.884
312 HA ILE 47 HA ILE 47 63.502 3.862 4.980
313 HB ILE 47 HB ILE 47 63.139 1.784 3.736
314 1HG1 ILE 47 HG12 ILE 47 63.454 4.055 1.752
315 2HG1 ILE 47 HG11 ILE 47 64.732 3.557 2.862
316 1HG2 ILE 47 HG21 ILE 47 60.789 3.268 2.818
317 2HG2 ILE 47 HG22 ILE 47 61.077 1.529 2.844
318 3HG2 ILE 47 HG23 ILE 47 61.667 2.500 1.496
319 1HD1 ILE 47 HD1 ILE 47 64.767 1.325 1.913
320 2HD1 ILE 47 HD1 ILE 47 64.906 2.488 0.594
321 3HD1 ILE 47 HD1 ILE 47 63.366 1.689 0.907
322 H THR 48 HN THR 48 63.997 5.467 3.189
323 HA THR 48 HA THR 48 61.676 7.192 2.438
324 HB THR 48 HB THR 48 62.925 9.147 3.298
325 HG1 THR 48 HG1 THR 48 64.944 8.941 3.810
326 1HG2 THR 48 HG21 THR 48 62.643 8.720 5.656
327 2HG2 THR 48 HG22 THR 48 62.796 6.982 5.407
328 3HG2 THR 48 HG23 THR 48 61.381 7.838 4.796
329 H THR 49 HN THR 49 63.620 9.268 1.546
330 HA THR 49 HA THR 49 64.043 8.614 -1.131
331 HB THR 49 HB THR 49 65.899 10.181 0.693
332 HG1 THR 49 HG1 THR 49 64.190 11.366 0.940
333 1HG2 THR 49 HG21 THR 49 66.095 11.543 -1.503
334 2HG2 THR 49 HG22 THR 49 65.443 10.103 -2.283
335 3HG2 THR 49 HG23 THR 49 66.966 10.014 -1.397
336 H SER 50 HN SER 50 65.029 6.716 -1.818
337 HA SER 50 HA SER 50 67.826 6.225 -1.228
338 1HB SER 50 HB2 SER 50 67.119 5.455 0.886
339 2HB SER 50 HB1 SER 50 65.628 4.774 0.240
340 HG SER 50 HG SER 50 66.842 3.157 -0.739
341 H THR 51 HN THR 51 68.610 4.318 -2.427
342 HA THR 51 HA THR 51 66.643 3.409 -4.504
343 HB THR 51 HB THR 51 69.574 3.257 -4.967
344 HG1 THR 51 HG1 THR 51 68.182 5.725 -4.947
345 1HG2 THR 51 HG21 THR 51 67.188 4.228 -6.558
346 2HG2 THR 51 HG22 THR 51 68.032 2.691 -6.749
347 3HG2 THR 51 HG23 THR 51 68.843 4.200 -7.169
348 H SER 52 HN SER 52 66.320 1.212 -4.590
349 HA SER 52 HA SER 52 68.406 -0.620 -3.510
350 1HB SER 52 HB2 SER 52 65.973 -1.607 -2.535
351 2HB SER 52 HB1 SER 52 67.217 -0.795 -1.592
352 HG SER 52 HG SER 52 65.713 0.651 -1.302
353 H THR 53 HN THR 53 68.649 -2.268 -4.976
354 HA THR 53 HA THR 53 66.409 -2.786 -6.890
355 HB THR 53 HB THR 53 69.257 -3.759 -7.112
356 HG1 THR 53 HG1 THR 53 69.500 -1.716 -8.328
357 1HG2 THR 53 HG21 THR 53 68.492 -4.456 -9.105
358 2HG2 THR 53 HG22 THR 53 68.135 -2.783 -9.536
359 3HG2 THR 53 HG23 THR 53 66.904 -3.773 -8.752
360 H GLY 54 HN GLY 54 65.247 -4.637 -6.540
361 1HA GLY 54 HA2 GLY 54 64.647 -6.696 -5.557
362 2HA GLY 54 HA1 GLY 54 66.214 -7.213 -6.184
363 H SER 55 HN SER 55 64.601 -5.814 -3.355
364 HA SER 55 HA SER 55 66.557 -7.154 -1.596
365 1HB SER 55 HB2 SER 55 67.206 -4.999 -0.538
366 2HB SER 55 HB1 SER 55 67.664 -5.055 -2.237
367 HG SER 55 HG SER 55 65.470 -3.734 -1.028
368 H ARG 56 HN ARG 56 65.431 -7.862 0.175
369 HA ARG 56 HA ARG 56 62.715 -6.776 0.683
370 1HB ARG 56 HB2 ARG 56 63.887 -9.292 0.651
371 2HB ARG 56 HB1 ARG 56 63.748 -8.944 2.374
372 1HG ARG 56 HG2 ARG 56 61.383 -8.554 2.187
373 2HG ARG 56 HG1 ARG 56 61.457 -8.605 0.424
374 1HD ARG 56 HD2 ARG 56 60.665 -10.764 1.023
375 2HD ARG 56 HD1 ARG 56 62.403 -11.016 0.764
376 HE ARG 56 HE ARG 56 61.462 -10.325 3.504
377 1HH1 ARG 56 HH2 ARG 56 60.949 -13.202 2.565
378 2HH1 ARG 56 HH2 ARG 56 62.358 -14.000 3.180
379 1HH2 ARG 56 HH1 ARG 56 64.107 -11.058 3.737
380 2HH2 ARG 56 HH1 ARG 56 64.145 -12.786 3.842
381 H ILE 57 HN ILE 57 62.813 -4.944 1.987
382 HA ILE 57 HA ILE 57 64.850 -4.696 4.097
383 HB ILE 57 HB ILE 57 62.501 -3.008 3.173
384 1HG1 ILE 57 HG12 ILE 57 64.988 -1.730 2.794
385 2HG1 ILE 57 HG11 ILE 57 65.224 -3.397 2.268
386 1HG2 ILE 57 HG21 ILE 57 63.706 -1.205 4.510
387 2HG2 ILE 57 HG22 ILE 57 64.633 -2.503 5.261
388 3HG2 ILE 57 HG23 ILE 57 62.883 -2.432 5.471
389 1HD1 ILE 57 HD1 ILE 57 63.112 -1.453 1.303
390 2HD1 ILE 57 HD1 ILE 57 63.095 -3.174 0.918
391 3HD1 ILE 57 HD1 ILE 57 64.425 -2.158 0.361
392 H SER 58 HN SER 58 62.309 -6.626 3.998
393 HA SER 58 HA SER 58 60.451 -6.144 5.974
394 1HB SER 58 HB2 SER 58 61.968 -8.497 4.976
395 2HB SER 58 HB1 SER 58 61.081 -8.727 6.480
396 HG SER 58 HG SER 58 60.032 -8.975 4.219
397 H GLY 59 HN GLY 59 60.452 -6.007 8.227
398 1HA GLY 59 HA2 GLY 59 62.355 -7.070 10.005
399 2HA GLY 59 HA1 GLY 59 62.927 -5.456 9.585
400 HA PRO 60 HA PRO 60 59.659 -5.243 12.925
401 1HB PRO 60 HB2 PRO 60 61.282 -4.496 14.993
402 2HB PRO 60 HB1 PRO 60 60.931 -6.193 14.610
403 1HG PRO 60 HG2 PRO 60 63.350 -4.578 14.011
404 2HG PRO 60 HG1 PRO 60 63.210 -6.289 14.439
405 1HD PRO 60 HD2 PRO 60 63.610 -5.346 11.884
406 2HD PRO 60 HD1 PRO 60 62.900 -6.929 12.275
407 H GLY 61 HN GLY 61 59.751 -3.378 11.070
408 1HA GLY 61 HA2 GLY 61 59.157 -1.038 11.078
409 2HA GLY 61 HA1 GLY 61 60.083 -0.837 12.566
410 H CYS 62 HN CYS 62 61.902 -2.733 10.559
411 HA CYS 62 HA CYS 62 64.218 -1.703 10.119
412 1HB CYS 62 HB2 CYS 62 62.755 -3.335 8.647
413 2HB CYS 62 HB1 CYS 62 62.667 -1.948 7.565
414 H LYS 63 HN LYS 63 65.090 0.330 10.003
415 HA LYS 63 HA LYS 63 63.524 2.483 8.621
416 1HB LYS 63 HB2 LYS 63 65.963 3.059 10.247
417 2HB LYS 63 HB1 LYS 63 64.448 3.949 10.157
418 1HG LYS 63 HG2 LYS 63 64.828 1.292 11.565
419 2HG LYS 63 HG1 LYS 63 64.754 2.862 12.364
420 1HD LYS 63 HD2 LYS 63 62.526 2.138 10.509
421 2HD LYS 63 HD1 LYS 63 62.572 1.356 12.088
422 1HE LYS 63 HE2 LYS 63 63.085 4.244 12.248
423 2HE LYS 63 HE1 LYS 63 61.480 3.853 11.599
424 1HZ LYS 63 HZ1 LYS 63 61.459 3.870 14.025
425 2HZ LYS 63 HZ2 LYS 63 62.678 2.687 14.057
426 3HZ LYS 63 HZ3 LYS 63 61.145 2.314 13.428
427 H ILE 64 HN ILE 64 64.513 3.652 6.926
428 HA ILE 64 HA ILE 64 67.352 3.136 6.272
429 HB ILE 64 HB ILE 64 65.035 2.403 4.453
430 1HG1 ILE 64 HG12 ILE 64 67.036 0.832 6.079
431 2HG1 ILE 64 HG11 ILE 64 65.286 0.635 5.996
432 1HG2 ILE 64 HG21 ILE 64 67.522 3.369 3.718
433 2HG2 ILE 64 HG22 ILE 64 66.492 2.350 2.713
434 3HG2 ILE 64 HG23 ILE 64 67.765 1.622 3.692
435 1HD1 ILE 64 HD1 ILE 64 67.384 -0.478 4.256
436 2HD1 ILE 64 HD1 ILE 64 66.027 0.228 3.378
437 3HD1 ILE 64 HD1 ILE 64 65.744 -1.057 4.552
438 H SER 65 HN SER 65 68.195 5.058 5.589
439 HA SER 65 HA SER 65 66.364 7.001 4.225
440 1HB SER 65 HB2 SER 65 66.760 8.503 5.878
441 2HB SER 65 HB1 SER 65 67.411 7.153 6.803
442 HG SER 65 HG SER 65 69.418 7.739 6.270
443 H THR 66 HN THR 66 67.167 7.312 2.196
444 HA THR 66 HA THR 66 68.726 7.599 0.435
445 HB THR 66 HB THR 66 70.597 8.516 2.613
446 HG1 THR 66 HG1 THR 66 68.551 9.337 3.104
447 1HG2 THR 66 HG21 THR 66 69.953 9.888 0.018
448 2HG2 THR 66 HG22 THR 66 71.061 8.516 0.042
449 3HG2 THR 66 HG23 THR 66 71.432 9.967 0.975
450 H CYS 67 HN CYS 67 68.990 5.258 0.135
451 HA CYS 67 HA CYS 67 71.755 4.355 0.805
452 1HB CYS 67 HB2 CYS 67 69.637 3.579 2.339
453 2HB CYS 67 HB1 CYS 67 69.588 2.341 1.091
454 H ILE 68 HN ILE 68 72.584 3.847 -1.218
455 HA ILE 68 HA ILE 68 70.740 3.020 -3.374
456 HB ILE 68 HB ILE 68 73.753 3.390 -3.272
457 1HG1 ILE 68 HG12 ILE 68 73.098 5.443 -4.667
458 2HG1 ILE 68 HG11 ILE 68 71.443 5.151 -4.132
459 1HG2 ILE 68 HG21 ILE 68 72.748 3.646 -5.888
460 2HG2 ILE 68 HG22 ILE 68 71.949 2.222 -5.214
461 3HG2 ILE 68 HG23 ILE 68 73.712 2.310 -5.253
462 1HD1 ILE 68 HD1 ILE 68 71.921 5.651 -1.918
463 2HD1 ILE 68 HD1 ILE 68 73.024 6.752 -2.746
464 3HD1 ILE 68 HD1 ILE 68 73.625 5.229 -2.087
465 H ILE 69 HN ILE 69 70.178 1.101 -2.054
466 HA ILE 69 HA ILE 69 72.142 -1.033 -1.708
467 HB ILE 69 HB ILE 69 69.112 -1.074 -1.543
468 1HG1 ILE 69 HG12 ILE 69 70.910 -0.550 0.819
469 2HG1 ILE 69 HG11 ILE 69 70.449 0.785 -0.232
470 1HG2 ILE 69 HG21 ILE 69 71.057 -2.617 0.161
471 2HG2 ILE 69 HG22 ILE 69 70.582 -3.221 -1.426
472 3HG2 ILE 69 HG23 ILE 69 69.362 -2.970 -0.177
473 1HD1 ILE 69 HD1 ILE 69 68.218 -0.981 0.531
474 2HD1 ILE 69 HD1 ILE 69 68.300 0.780 0.487
475 3HD1 ILE 69 HD1 ILE 69 68.947 -0.098 1.874
476 H THR 70 HN THR 70 71.876 -3.170 -2.794
477 HA THR 70 HA THR 70 70.256 -3.254 -5.258
478 HB THR 70 HB THR 70 73.289 -3.232 -5.270
479 HG1 THR 70 HG1 THR 70 71.664 -1.469 -6.698
480 1HG2 THR 70 HG21 THR 70 71.563 -3.210 -7.720
481 2HG2 THR 70 HG22 THR 70 71.892 -4.746 -6.914
482 3HG2 THR 70 HG23 THR 70 73.226 -3.767 -7.531
483 H GLY 71 HN GLY 71 69.357 -5.237 -4.534
484 1HA GLY 71 HA2 GLY 71 69.406 -7.623 -4.707
485 2HA GLY 71 HA1 GLY 71 71.168 -7.549 -4.768
486 H GLY 72 HN GLY 72 69.316 -5.866 -2.307
487 1HA GLY 72 HA2 GLY 72 68.996 -6.404 -0.016
488 2HA GLY 72 HA1 GLY 72 69.728 -7.980 -0.317
489 H VAL 73 HN VAL 73 71.524 -5.383 -1.583
490 HA VAL 73 HA VAL 73 73.375 -5.457 0.784
491 HB VAL 73 HB VAL 73 75.180 -5.447 -0.854
492 1HG1 VAL 73 HG11 VAL 73 73.272 -7.518 -0.588
493 2HG1 VAL 73 HG12 VAL 73 74.946 -7.674 -1.118
494 3HG1 VAL 73 HG13 VAL 73 73.664 -7.435 -2.305
495 1HG2 VAL 73 HG21 VAL 73 74.587 -4.160 -2.665
496 2HG2 VAL 73 HG22 VAL 73 72.913 -4.719 -2.641
497 3HG2 VAL 73 HG23 VAL 73 74.174 -5.737 -3.341
498 HA PRO 74 HA PRO 74 72.903 -1.049 0.419
499 1HB PRO 74 HB2 PRO 74 74.461 -0.399 2.561
500 2HB PRO 74 HB1 PRO 74 72.822 -1.047 2.728
501 1HG PRO 74 HG2 PRO 74 75.408 -2.350 3.221
502 2HG PRO 74 HG1 PRO 74 73.810 -2.724 3.876
503 1HD PRO 74 HD2 PRO 74 75.176 -4.076 1.786
504 2HD PRO 74 HD1 PRO 74 73.516 -4.357 2.353
505 H ALA 75 HN ALA 75 74.038 0.067 -1.133
506 HA ALA 75 HA ALA 75 76.856 -0.467 -1.697
507 1HB ALA 75 HB1 ALA 75 76.454 1.073 -3.512
508 2HB ALA 75 HB2 ALA 75 75.068 1.779 -2.681
509 3HB ALA 75 HB3 ALA 75 74.977 0.134 -3.312
510 HA PRO 76 HA PRO 76 78.702 2.686 0.745
511 1HB PRO 76 HB2 PRO 76 80.484 3.871 -0.972
512 2HB PRO 76 HB1 PRO 76 80.737 2.258 -0.277
513 1HG PRO 76 HG2 PRO 76 79.723 3.014 -2.975
514 2HG PRO 76 HG1 PRO 76 80.840 1.719 -2.512
515 1HD PRO 76 HD2 PRO 76 78.227 1.266 -3.068
516 2HD PRO 76 HD1 PRO 76 79.143 0.289 -1.900
517 H SER 77 HN SER 77 76.659 3.890 0.852
518 HA SER 77 HA SER 77 76.131 6.015 -1.107
519 1HB SER 77 HB2 SER 77 74.872 5.200 1.530
520 2HB SER 77 HB1 SER 77 74.185 6.377 0.417
521 HG SER 77 HG SER 77 74.592 3.605 0.072
522 H ALA 78 HN ALA 78 78.136 5.757 1.624
523 HA ALA 78 HA ALA 78 79.075 7.389 3.082
524 1HB ALA 78 HB1 ALA 78 79.630 9.478 1.709
525 2HB ALA 78 HB2 ALA 78 78.713 8.742 0.394
526 3HB ALA 78 HB3 ALA 78 80.163 7.948 1.011
527 H ALA 79 HN ALA 79 76.039 7.220 2.858
528 HA ALA 79 HA ALA 79 75.435 9.690 4.345
529 1HB ALA 79 HB1 ALA 79 73.460 9.968 2.602
530 2HB ALA 79 HB2 ALA 79 74.542 9.064 1.543
531 3HB ALA 79 HB3 ALA 79 75.059 10.607 2.222
532 H CYS 80 HN CYS 80 74.231 6.742 2.767
533 HA CYS 80 HA CYS 80 71.767 6.339 3.997
534 1HB CYS 80 HB2 CYS 80 72.704 4.886 2.307
535 2HB CYS 80 HB1 CYS 80 74.045 4.446 3.350
536 H LYS 81 HN LYS 81 71.316 4.778 5.896
537 HA LYS 81 HA LYS 81 73.138 5.519 8.139
538 1HB LYS 81 HB2 LYS 81 71.243 5.948 9.316
539 2HB LYS 81 HB1 LYS 81 70.489 5.997 7.729
540 1HG LYS 81 HG2 LYS 81 70.692 3.426 9.317
541 2HG LYS 81 HG1 LYS 81 69.350 4.544 9.519
542 1HD LYS 81 HD2 LYS 81 68.470 4.096 7.441
543 2HD LYS 81 HD1 LYS 81 70.041 3.745 6.727
544 1HE LYS 81 HE2 LYS 81 68.487 1.711 7.079
545 2HE LYS 81 HE1 LYS 81 70.115 1.562 7.772
546 1HZ LYS 81 HZ1 LYS 81 69.351 2.203 9.888
547 2HZ LYS 81 HZ2 LYS 81 68.204 1.079 9.342
548 3HZ LYS 81 HZ3 LYS 81 67.859 2.739 9.289
549 H ILE 82 HN ILE 82 71.536 2.721 6.643
550 HA ILE 82 HA ILE 82 71.588 0.419 7.298
551 HB ILE 82 HB ILE 82 74.395 1.523 7.129
552 1HG1 ILE 82 HG12 ILE 82 73.442 -0.530 5.249
553 2HG1 ILE 82 HG11 ILE 82 72.476 0.946 5.230
554 1HG2 ILE 82 HG21 ILE 82 74.651 -1.198 6.744
555 2HG2 ILE 82 HG22 ILE 82 73.522 -1.116 8.096
556 3HG2 ILE 82 HG23 ILE 82 75.102 -0.342 8.219
557 1HD1 ILE 82 HD1 ILE 82 75.175 1.778 5.356
558 2HD1 ILE 82 HD1 ILE 82 74.077 1.920 3.983
559 3HD1 ILE 82 HD1 ILE 82 75.112 0.501 4.142
560 H SER 83 HN SER 83 70.544 0.834 9.500
561 HA SER 83 HA SER 83 72.567 0.495 11.692
562 1HB SER 83 HB2 SER 83 69.890 1.921 11.664
563 2HB SER 83 HB1 SER 83 70.922 1.751 13.081
564 HG SER 83 HG SER 83 71.591 3.626 12.270
565 H GLY 84 HN GLY 84 69.174 0.353 12.399
566 1HA GLY 84 HA2 GLY 84 69.483 -2.483 13.162
567 2HA GLY 84 HA1 GLY 84 68.135 -1.432 13.601
568 H CYS 85 HN CYS 85 69.113 -1.449 10.272
569 HA CYS 85 HA CYS 85 66.529 -2.751 9.598
570 1HB CYS 85 HB2 CYS 85 68.051 -0.576 8.639
571 2HB CYS 85 HB1 CYS 85 68.094 -1.789 7.364
572 H THR 86 HN THR 86 67.136 -3.685 7.057
573 HA THR 86 HA THR 86 69.454 -5.308 6.789
574 HB THR 86 HB THR 86 68.786 -6.465 8.756
575 HG1 THR 86 HG1 THR 86 67.623 -7.919 6.626
576 1HG2 THR 86 HG21 THR 86 66.073 -5.934 7.683
577 2HG2 THR 86 HG22 THR 86 66.643 -5.927 9.352
578 3HG2 THR 86 HG23 THR 86 66.273 -7.455 8.553
579 H PHE 87 HN PHE 87 69.352 -6.516 4.846
580 HA PHE 87 HA PHE 87 66.762 -6.282 3.346
581 1HB PHE 87 HB2 PHE 87 69.398 -6.476 1.944
582 2HB PHE 87 HB1 PHE 87 67.947 -5.602 1.470
583 HD1 PHE 87 HD1 PHE 87 67.447 -4.032 4.027
584 HD2 PHE 87 HD2 PHE 87 71.056 -4.805 1.809
585 HE1 PHE 87 HE1 PHE 87 68.455 -1.931 4.930
586 HE2 PHE 87 HE2 PHE 87 72.047 -2.725 2.708
587 HZ PHE 87 HZ PHE 87 70.753 -1.291 4.260
588 H SER 88 HN SER 88 66.768 -8.000 1.467
589 HA SER 88 HA SER 88 68.244 -10.483 2.127
590 1HB SER 88 HB2 SER 88 65.764 -9.932 3.264
591 2HB SER 88 HB1 SER 88 65.358 -10.948 1.883
592 HG SER 88 HG SER 88 66.505 -12.568 2.721
593 H ALA 89 HN ALA 89 67.789 -8.506 -0.180
594 HA ALA 89 HA ALA 89 67.416 -8.608 -2.517
595 1HB ALA 89 HB1 ALA 89 68.851 -10.187 -3.328
596 2HB ALA 89 HB2 ALA 89 67.985 -11.503 -2.537
597 3HB ALA 89 HB3 ALA 89 69.154 -10.545 -1.628
598 H ASN 90 HN ASN 90 64.971 -8.584 -1.538
599 HA ASN 90 HA ASN 90 63.331 -10.871 -1.618
600 1HB ASN 90 HB2 ASN 90 61.675 -9.309 -1.341
601 2HB ASN 90 HB1 ASN 90 63.035 -8.214 -1.134
602 1HD2 ASN 90 HD2 ASN 90 63.903 -7.924 -3.821
603 2HD2 ASN 90 HD2 ASN 90 62.671 -7.182 -4.723
Start of MODEL 24
1 1H ASP 1 HT1 ASP 1 48.962 9.033 3.277
2 2H ASP 1 HT2 ASP 1 48.538 7.974 2.019
3 3H ASP 1 HT3 ASP 1 50.106 7.940 2.668
4 HA ASP 1 HA ASP 1 49.481 6.402 4.138
5 1HB ASP 1 HB2 ASP 1 48.013 7.176 5.933
6 2HB ASP 1 HB1 ASP 1 49.049 8.511 5.425
7 H GLY 2 HN GLY 2 48.336 6.060 1.564
8 1HA GLY 2 HA2 GLY 2 45.855 4.600 2.313
9 2HA GLY 2 HA1 GLY 2 45.785 5.719 0.950
10 H SER 3 HN SER 3 45.534 4.246 -0.729
11 HA SER 3 HA SER 3 47.688 2.176 -1.022
12 1HB SER 3 HB2 SER 3 45.573 1.116 -0.770
13 2HB SER 3 HB1 SER 3 44.767 2.304 -1.792
14 HG SER 3 HG SER 3 45.896 -0.002 -2.490
15 H CYS 4 HN CYS 4 49.180 3.129 -2.403
16 HA CYS 4 HA CYS 4 48.232 4.780 -4.677
17 1HB CYS 4 HB2 CYS 4 50.798 4.211 -3.240
18 2HB CYS 4 HB1 CYS 4 50.885 4.824 -4.891
19 H THR 5 HN THR 5 49.017 1.530 -4.038
20 HA THR 5 HA THR 5 49.069 -0.327 -5.500
21 HB THR 5 HB THR 5 48.871 1.657 -7.770
22 HG1 THR 5 HG1 THR 5 47.005 0.966 -5.805
23 1HG2 THR 5 HG21 THR 5 47.273 -0.303 -8.489
24 2HG2 THR 5 HG22 THR 5 48.180 -1.219 -7.286
25 3HG2 THR 5 HG23 THR 5 49.019 -0.491 -8.656
26 H ASN 6 HN ASN 6 51.398 1.849 -5.044
27 HA ASN 6 HA ASN 6 53.627 2.150 -5.863
28 1HB ASN 6 HB2 ASN 6 54.770 0.016 -5.636
29 2HB ASN 6 HB1 ASN 6 53.438 0.033 -4.479
30 1HD2 ASN 6 HD2 ASN 6 54.618 -1.435 -7.447
31 2HD2 ASN 6 HD2 ASN 6 53.384 -2.589 -7.587
32 H THR 7 HN THR 7 51.840 2.539 -7.990
33 HA THR 7 HA THR 7 52.129 2.832 -10.338
34 HB THR 7 HB THR 7 54.088 0.547 -10.352
35 HG1 THR 7 HG1 THR 7 54.350 3.084 -9.207
36 1HG2 THR 7 HG21 THR 7 53.229 1.883 -12.407
37 2HG2 THR 7 HG22 THR 7 54.967 1.635 -12.243
38 3HG2 THR 7 HG23 THR 7 54.251 3.184 -11.797
39 H ASN 8 HN ASN 8 51.886 -0.442 -8.928
40 HA ASN 8 HA ASN 8 49.476 -1.012 -10.385
41 1HB ASN 8 HB2 ASN 8 51.590 -0.974 -12.039
42 2HB ASN 8 HB1 ASN 8 51.697 -2.646 -11.494
43 1HD2 ASN 8 HD2 ASN 8 49.738 -0.369 -13.335
44 2HD2 ASN 8 HD2 ASN 8 48.657 -1.519 -13.956
45 H SER 9 HN SER 9 50.308 -1.502 -7.678
46 HA SER 9 HA SER 9 49.686 -4.361 -7.530
47 1HB SER 9 HB2 SER 9 52.227 -3.644 -6.138
48 2HB SER 9 HB1 SER 9 51.736 -5.169 -6.860
49 HG SER 9 HG SER 9 52.584 -4.553 -8.680
50 H GLN 10 HN GLN 10 51.185 -4.083 -4.713
51 HA GLN 10 HA GLN 10 48.838 -2.730 -3.427
52 1HB GLN 10 HB2 GLN 10 50.561 -5.109 -2.785
53 2HB GLN 10 HB1 GLN 10 49.691 -4.286 -1.490
54 1HG GLN 10 HG2 GLN 10 47.705 -5.143 -2.145
55 2HG GLN 10 HG1 GLN 10 48.009 -4.745 -3.837
56 1HE2 GLN 10 HE21 GLN 10 49.474 -6.307 -5.049
57 2HE2 GLN 10 HE22 GLN 10 49.468 -7.940 -4.588
58 H LEU 11 HN LEU 11 49.744 -2.420 -0.888
59 HA LEU 11 HA LEU 11 52.396 -1.203 -0.751
60 1HB LEU 11 HB2 LEU 11 50.491 0.300 -1.960
61 2HB LEU 11 HB1 LEU 11 50.172 0.732 -0.286
62 HG LEU 11 HG LEU 11 51.838 2.237 -0.433
63 1HD1 LEU 11 HD1 LEU 11 53.147 0.137 0.419
64 2HD1 LEU 11 HD1 LEU 11 54.049 1.559 -0.107
65 3HD1 LEU 11 HD1 LEU 11 53.885 0.170 -1.183
66 1HD2 LEU 11 HD2 LEU 11 53.043 2.613 -2.478
67 2HD2 LEU 11 HD2 LEU 11 51.420 2.075 -2.913
68 3HD2 LEU 11 HD2 LEU 11 52.774 0.951 -3.003
69 H SER 12 HN SER 12 51.943 -3.020 0.945
70 HA SER 12 HA SER 12 51.418 -3.678 3.161
71 1HB SER 12 HB2 SER 12 52.048 -1.657 4.696
72 2HB SER 12 HB1 SER 12 53.281 -2.325 3.633
73 HG SER 12 HG SER 12 52.161 0.129 3.660
74 H ALA 13 HN ALA 13 49.144 -2.346 1.537
75 HA ALA 13 HA ALA 13 46.996 -1.420 1.946
76 1HB ALA 13 HB1 ALA 13 47.601 -3.743 3.452
77 2HB ALA 13 HB2 ALA 13 46.006 -3.176 2.956
78 3HB ALA 13 HB3 ALA 13 46.671 -2.688 4.515
79 H ASN 14 HN ASN 14 49.406 0.010 3.231
80 HA ASN 14 HA ASN 14 48.047 2.135 4.530
81 1HB ASN 14 HB2 ASN 14 48.630 1.630 6.889
82 2HB ASN 14 HB1 ASN 14 47.570 0.389 6.229
83 1HD2 ASN 14 HD2 ASN 14 48.308 -1.476 7.329
84 2HD2 ASN 14 HD2 ASN 14 49.914 -2.026 7.283
85 H SER 15 HN SER 15 50.388 1.443 2.767
86 HA SER 15 HA SER 15 52.840 2.043 4.159
87 1HB SER 15 HB2 SER 15 53.491 1.229 2.152
88 2HB SER 15 HB1 SER 15 51.859 1.412 1.526
89 HG SER 15 HG SER 15 52.336 3.482 0.909
90 H LYS 16 HN LYS 16 54.039 4.114 2.812
91 HA LYS 16 HA LYS 16 52.298 6.472 3.470
92 1HB LYS 16 HB2 LYS 16 54.948 5.593 4.305
93 2HB LYS 16 HB1 LYS 16 54.997 7.218 3.619
94 1HG LYS 16 HG2 LYS 16 54.469 7.700 5.832
95 2HG LYS 16 HG1 LYS 16 52.856 7.578 5.128
96 1HD LYS 16 HD2 LYS 16 52.376 5.638 6.229
97 2HD LYS 16 HD1 LYS 16 54.020 5.022 6.062
98 1HE LYS 16 HE2 LYS 16 53.905 5.439 8.372
99 2HE LYS 16 HE1 LYS 16 54.589 6.965 7.779
100 1HZ LYS 16 HZ1 LYS 16 52.564 7.184 9.238
101 2HZ LYS 16 HZ2 LYS 16 51.670 6.482 7.976
102 3HZ LYS 16 HZ3 LYS 16 52.468 7.962 7.734
103 H CYS 17 HN CYS 17 51.649 7.234 1.469
104 HA CYS 17 HA CYS 17 53.512 7.163 -0.828
105 1HB CYS 17 HB2 CYS 17 50.849 6.766 -0.545
106 2HB CYS 17 HB1 CYS 17 50.850 8.478 -0.969
107 H GLU 18 HN GLU 18 52.026 9.649 -1.836
108 HA GLU 18 HA GLU 18 52.355 11.994 -1.847
109 1HB GLU 18 HB2 GLU 18 52.373 11.104 0.877
110 2HB GLU 18 HB1 GLU 18 53.617 12.342 0.696
111 1HG GLU 18 HG2 GLU 18 51.675 13.589 1.170
112 2HG GLU 18 HG1 GLU 18 51.797 13.677 -0.587
113 H LYS 19 HN LYS 19 54.016 12.348 -3.313
114 HA LYS 19 HA LYS 19 56.220 12.845 -4.031
115 1HB LYS 19 HB2 LYS 19 56.016 13.676 -1.451
116 2HB LYS 19 HB1 LYS 19 57.298 12.476 -1.285
117 1HG LYS 19 HG2 LYS 19 58.798 13.829 -2.284
118 2HG LYS 19 HG1 LYS 19 57.710 14.126 -3.640
119 1HD LYS 19 HD2 LYS 19 56.544 15.860 -2.391
120 2HD LYS 19 HD1 LYS 19 57.496 15.504 -0.949
121 1HE LYS 19 HE2 LYS 19 59.549 16.225 -2.075
122 2HE LYS 19 HE1 LYS 19 58.648 16.503 -3.580
123 1HZ LYS 19 HZ1 LYS 19 57.527 17.714 -1.190
124 2HZ LYS 19 HZ2 LYS 19 57.661 18.340 -2.763
125 3HZ LYS 19 HZ3 LYS 19 58.996 18.382 -1.713
126 H SER 20 HN SER 20 55.478 10.275 -4.486
127 HA SER 20 HA SER 20 57.777 8.619 -3.504
128 1HB SER 20 HB2 SER 20 55.044 7.710 -4.436
129 2HB SER 20 HB1 SER 20 56.262 6.739 -3.614
130 HG SER 20 HG SER 20 54.912 9.016 -2.577
131 H THR 21 HN THR 21 58.689 7.128 -5.042
132 HA THR 21 HA THR 21 57.899 7.391 -7.891
133 HB THR 21 HB THR 21 60.710 7.973 -6.908
134 HG1 THR 21 HG1 THR 21 58.603 9.734 -7.615
135 1HG2 THR 21 HG21 THR 21 60.959 7.443 -9.137
136 2HG2 THR 21 HG22 THR 21 60.544 9.150 -9.298
137 3HG2 THR 21 HG23 THR 21 59.308 7.915 -9.543
138 H LEU 22 HN LEU 22 57.383 5.086 -7.412
139 HA LEU 22 HA LEU 22 59.844 3.367 -7.352
140 1HB LEU 22 HB2 LEU 22 58.059 1.735 -6.292
141 2HB LEU 22 HB1 LEU 22 58.808 2.979 -5.295
142 HG LEU 22 HG LEU 22 56.310 3.676 -6.789
143 1HD1 LEU 22 HD1 LEU 22 55.522 1.668 -5.857
144 2HD1 LEU 22 HD1 LEU 22 55.093 2.870 -4.641
145 3HD1 LEU 22 HD1 LEU 22 56.509 1.842 -4.408
146 1HD2 LEU 22 HD2 LEU 22 57.875 4.586 -4.442
147 2HD2 LEU 22 HD2 LEU 22 56.123 4.681 -4.263
148 3HD2 LEU 22 HD2 LEU 22 56.920 5.526 -5.589
149 H THR 23 HN THR 23 58.589 0.936 -7.886
150 HA THR 23 HA THR 23 56.841 1.121 -10.218
151 HB THR 23 HB THR 23 59.819 0.621 -10.446
152 HG1 THR 23 HG1 THR 23 59.534 2.651 -10.955
153 1HG2 THR 23 HG21 THR 23 58.683 -1.176 -11.654
154 2HG2 THR 23 HG22 THR 23 59.370 -0.029 -12.804
155 3HG2 THR 23 HG23 THR 23 57.640 -0.003 -12.459
156 H ASN 24 HN ASN 24 55.579 -0.640 -9.730
157 HA ASN 24 HA ASN 24 54.986 -2.870 -9.227
158 1HB ASN 24 HB2 ASN 24 57.707 -2.965 -10.476
159 2HB ASN 24 HB1 ASN 24 57.070 -4.446 -9.765
160 1HD2 ASN 24 HD2 ASN 24 55.074 -1.916 -11.303
161 2HD2 ASN 24 HD2 ASN 24 54.550 -2.886 -12.594
162 H CYS 25 HN CYS 25 54.795 -3.715 -7.191
163 HA CYS 25 HA CYS 25 56.901 -4.591 -5.516
164 1HB CYS 25 HB2 CYS 25 56.452 -1.708 -5.606
165 2HB CYS 25 HB1 CYS 25 56.263 -2.336 -3.971
166 H TYR 26 HN TYR 26 55.972 -4.193 -2.997
167 HA TYR 26 HA TYR 26 53.032 -4.689 -3.016
168 1HB TYR 26 HB2 TYR 26 53.835 -6.898 -3.137
169 2HB TYR 26 HB1 TYR 26 55.284 -6.520 -2.210
170 HD1 TYR 26 HD1 TYR 26 55.376 -7.144 0.028
171 HD2 TYR 26 HD2 TYR 26 51.546 -6.548 -1.825
172 HE1 TYR 26 HE1 TYR 26 54.253 -7.901 2.105
173 HE2 TYR 26 HE2 TYR 26 50.424 -7.304 0.253
174 HH TYR 26 HH TYR 26 50.770 -7.674 2.499
175 H VAL 27 HN VAL 27 55.981 -4.404 -1.070
176 HA VAL 27 HA VAL 27 56.411 -3.268 0.945
177 HB VAL 27 HB VAL 27 53.948 -1.670 0.221
178 1HG1 VAL 27 HG11 VAL 27 54.735 -0.446 1.945
179 2HG1 VAL 27 HG12 VAL 27 56.121 -0.043 0.930
180 3HG1 VAL 27 HG13 VAL 27 56.206 -1.416 2.038
181 1HG2 VAL 27 HG21 VAL 27 55.053 -1.785 -1.872
182 2HG2 VAL 27 HG22 VAL 27 56.652 -1.790 -1.124
183 3HG2 VAL 27 HG23 VAL 27 55.695 -0.309 -1.147
184 H ASP 28 HN ASP 28 55.940 -3.751 3.036
185 HA ASP 28 HA ASP 28 53.110 -4.354 3.797
186 1HB ASP 28 HB2 ASP 28 55.262 -6.190 3.413
187 2HB ASP 28 HB1 ASP 28 54.947 -6.107 5.146
188 H LYS 29 HN LYS 29 52.625 -3.139 5.586
189 HA LYS 29 HA LYS 29 52.997 -1.661 7.412
190 1HB LYS 29 HB2 LYS 29 54.406 -4.264 7.825
191 2HB LYS 29 HB1 LYS 29 54.731 -2.981 8.991
192 1HG LYS 29 HG2 LYS 29 52.207 -2.694 9.193
193 2HG LYS 29 HG1 LYS 29 52.054 -4.199 8.286
194 1HD LYS 29 HD2 LYS 29 53.910 -4.193 10.621
195 2HD LYS 29 HD1 LYS 29 52.180 -4.175 10.963
196 1HE LYS 29 HE2 LYS 29 52.439 -6.462 10.765
197 2HE LYS 29 HE1 LYS 29 52.253 -6.096 9.038
198 1HZ LYS 29 HZ1 LYS 29 54.693 -5.704 8.979
199 2HZ LYS 29 HZ2 LYS 29 54.270 -7.316 9.301
200 3HZ LYS 29 HZ3 LYS 29 54.794 -6.306 10.562
201 H SER 30 HN SER 30 54.412 -0.587 5.340
202 HA SER 30 HA SER 30 57.043 0.093 6.613
203 1HB SER 30 HB2 SER 30 56.373 -0.727 3.784
204 2HB SER 30 HB1 SER 30 57.859 0.135 4.169
205 HG SER 30 HG SER 30 57.131 -2.118 5.675
206 H GLU 31 HN GLU 31 57.909 2.191 5.808
207 HA GLU 31 HA GLU 31 55.705 4.141 5.349
208 1HB GLU 31 HB2 GLU 31 57.971 4.028 6.972
209 2HB GLU 31 HB1 GLU 31 58.425 5.159 5.697
210 1HG GLU 31 HG2 GLU 31 56.551 6.573 6.154
211 2HG GLU 31 HG1 GLU 31 55.801 5.357 7.189
212 H VAL 32 HN VAL 32 59.105 4.069 4.258
213 HA VAL 32 HA VAL 32 60.036 4.469 2.124
214 HB VAL 32 HB VAL 32 57.290 3.595 1.187
215 1HG1 VAL 32 HG11 VAL 32 58.999 4.460 -0.482
216 2HG1 VAL 32 HG12 VAL 32 58.452 2.807 -0.764
217 3HG1 VAL 32 HG13 VAL 32 60.024 3.100 -0.019
218 1HG2 VAL 32 HG21 VAL 32 59.018 2.212 2.928
219 2HG2 VAL 32 HG22 VAL 32 59.288 1.498 1.340
220 3HG2 VAL 32 HG23 VAL 32 57.664 1.533 2.025
221 H TYR 33 HN TYR 33 60.248 6.305 0.874
222 HA TYR 33 HA TYR 33 57.876 8.081 0.510
223 1HB TYR 33 HB2 TYR 33 60.533 8.679 1.820
224 2HB TYR 33 HB1 TYR 33 59.541 9.966 1.138
225 HD1 TYR 33 HD1 TYR 33 57.388 10.562 2.120
226 HD2 TYR 33 HD2 TYR 33 59.765 7.380 3.759
227 HE1 TYR 33 HE1 TYR 33 55.975 10.557 4.158
228 HE2 TYR 33 HE2 TYR 33 58.351 7.376 5.797
229 HH TYR 33 HH TYR 33 56.841 9.206 6.990
230 H GLY 34 HN GLY 34 61.318 8.729 -0.088
231 1HA GLY 34 HA2 GLY 34 60.677 9.072 -2.968
232 2HA GLY 34 HA1 GLY 34 62.147 9.637 -2.169
233 H THR 35 HN THR 35 60.884 6.409 -1.673
234 HA THR 35 HA THR 35 63.404 5.190 -2.437
235 HB THR 35 HB THR 35 60.700 4.379 -1.443
236 HG1 THR 35 HG1 THR 35 63.029 4.814 -0.421
237 1HG2 THR 35 HG21 THR 35 62.721 2.416 -2.565
238 2HG2 THR 35 HG22 THR 35 61.114 2.730 -3.220
239 3HG2 THR 35 HG23 THR 35 61.288 1.983 -1.632
240 H THR 36 HN THR 36 63.576 3.507 -4.134
241 HA THR 36 HA THR 36 61.867 4.132 -6.522
242 HB THR 36 HB THR 36 64.732 3.141 -6.332
243 HG1 THR 36 HG1 THR 36 64.952 5.182 -5.815
244 1HG2 THR 36 HG21 THR 36 63.014 4.039 -8.659
245 2HG2 THR 36 HG22 THR 36 63.705 2.437 -8.404
246 3HG2 THR 36 HG23 THR 36 64.759 3.806 -8.757
247 H CYS 37 HN CYS 37 60.711 2.288 -4.965
248 HA CYS 37 HA CYS 37 61.397 -0.367 -4.816
249 1HB CYS 37 HB2 CYS 37 59.095 1.203 -4.711
250 2HB CYS 37 HB1 CYS 37 58.723 -0.002 -5.940
251 H THR 38 HN THR 38 62.723 -1.168 -6.513
252 HA THR 38 HA THR 38 61.791 -0.973 -9.312
253 HB THR 38 HB THR 38 64.193 -2.316 -8.028
254 HG1 THR 38 HG1 THR 38 63.785 0.250 -9.155
255 1HG2 THR 38 HG21 THR 38 64.894 -1.600 -10.578
256 2HG2 THR 38 HG22 THR 38 63.207 -2.068 -10.793
257 3HG2 THR 38 HG23 THR 38 64.359 -3.214 -10.106
258 H GLY 39 HN GLY 39 59.934 -2.425 -7.831
259 1HA GLY 39 HA2 GLY 39 58.724 -4.425 -8.289
260 2HA GLY 39 HA1 GLY 39 60.146 -5.069 -9.112
261 H SER 40 HN SER 40 60.484 -3.655 -5.953
262 HA SER 40 HA SER 40 61.217 -6.336 -4.875
263 1HB SER 40 HB2 SER 40 62.345 -4.959 -3.155
264 2HB SER 40 HB1 SER 40 62.821 -4.456 -4.774
265 HG SER 40 HG SER 40 62.248 -2.581 -3.916
266 H ARG 41 HN ARG 41 60.866 -5.516 -2.119
267 HA ARG 41 HA ARG 41 58.092 -4.753 -1.662
268 1HB ARG 41 HB2 ARG 41 57.306 -6.960 -0.984
269 2HB ARG 41 HB1 ARG 41 57.946 -7.068 -2.624
270 1HG ARG 41 HG2 ARG 41 59.645 -8.433 -1.997
271 2HG ARG 41 HG1 ARG 41 59.966 -7.511 -0.529
272 1HD ARG 41 HD2 ARG 41 58.642 -8.866 0.751
273 2HD ARG 41 HD1 ARG 41 57.408 -9.007 -0.517
274 HE ARG 41 HE ARG 41 59.966 -10.560 -0.486
275 1HH1 ARG 41 HH2 ARG 41 58.847 -10.295 -3.203
276 2HH1 ARG 41 HH2 ARG 41 57.778 -11.652 -3.316
277 1HH2 ARG 41 HH1 ARG 41 57.667 -12.184 0.110
278 2HH2 ARG 41 HH1 ARG 41 57.109 -12.724 -1.439
279 H PHE 42 HN PHE 42 57.628 -4.654 0.656
280 HA PHE 42 HA PHE 42 60.090 -4.878 2.356
281 1HB PHE 42 HB2 PHE 42 57.754 -2.968 2.634
282 2HB PHE 42 HB1 PHE 42 59.295 -2.893 3.490
283 HD1 PHE 42 HD1 PHE 42 57.895 -0.817 1.546
284 HD2 PHE 42 HD2 PHE 42 61.033 -3.711 1.090
285 HE1 PHE 42 HE1 PHE 42 58.857 0.520 -0.305
286 HE2 PHE 42 HE2 PHE 42 61.999 -2.371 -0.759
287 HZ PHE 42 HZ PHE 42 60.909 -0.257 -1.456
288 H ASP 43 HN ASP 43 59.358 -4.913 4.793
289 HA ASP 43 HA ASP 43 56.816 -6.315 5.303
290 1HB ASP 43 HB2 ASP 43 59.284 -7.677 4.739
291 2HB ASP 43 HB1 ASP 43 58.861 -7.956 6.429
292 H GLY 44 HN GLY 44 57.212 -3.972 6.390
293 1HA GLY 44 HA2 GLY 44 56.963 -3.213 8.667
294 2HA GLY 44 HA1 GLY 44 57.947 -4.577 9.200
295 H VAL 45 HN VAL 45 58.268 -1.655 7.120
296 HA VAL 45 HA VAL 45 60.956 -1.254 8.383
297 HB VAL 45 HB VAL 45 61.979 -1.054 6.274
298 1HG1 VAL 45 HG11 VAL 45 61.414 -3.061 5.073
299 2HG1 VAL 45 HG12 VAL 45 59.773 -3.049 5.717
300 3HG1 VAL 45 HG13 VAL 45 61.137 -3.384 6.784
301 1HG2 VAL 45 HG21 VAL 45 60.843 0.344 4.877
302 2HG2 VAL 45 HG22 VAL 45 59.269 -0.214 5.444
303 3HG2 VAL 45 HG23 VAL 45 60.154 -1.147 4.236
304 H THR 46 HN THR 46 61.645 1.004 6.878
305 HA THR 46 HA THR 46 59.522 3.006 6.913
306 HB THR 46 HB THR 46 61.646 2.920 9.083
307 HG1 THR 46 HG1 THR 46 60.110 2.119 10.248
308 1HG2 THR 46 HG21 THR 46 60.532 5.170 7.887
309 2HG2 THR 46 HG22 THR 46 61.287 5.112 9.480
310 3HG2 THR 46 HG23 THR 46 59.540 4.926 9.326
311 H ILE 47 HN ILE 47 61.137 2.386 4.823
312 HA ILE 47 HA ILE 47 63.610 3.948 4.791
313 HB ILE 47 HB ILE 47 63.286 1.842 3.551
314 1HG1 ILE 47 HG12 ILE 47 63.424 4.023 1.473
315 2HG1 ILE 47 HG11 ILE 47 64.708 3.844 2.669
316 1HG2 ILE 47 HG21 ILE 47 61.441 1.434 2.314
317 2HG2 ILE 47 HG22 ILE 47 61.601 2.961 1.446
318 3HG2 ILE 47 HG23 ILE 47 60.773 2.915 3.002
319 1HD1 ILE 47 HD1 ILE 47 64.206 1.241 1.732
320 2HD1 ILE 47 HD1 ILE 47 65.605 2.247 1.358
321 3HD1 ILE 47 HD1 ILE 47 64.198 2.261 0.294
322 H THR 48 HN THR 48 63.880 5.566 2.902
323 HA THR 48 HA THR 48 61.399 7.156 2.420
324 HB THR 48 HB THR 48 62.893 9.180 2.990
325 HG1 THR 48 HG1 THR 48 64.706 8.749 4.142
326 1HG2 THR 48 HG21 THR 48 62.738 8.457 5.563
327 2HG2 THR 48 HG22 THR 48 61.750 7.170 4.870
328 3HG2 THR 48 HG23 THR 48 61.302 8.858 4.620
329 H THR 49 HN THR 49 64.179 8.899 1.647
330 HA THR 49 HA THR 49 63.815 8.396 -1.225
331 HB THR 49 HB THR 49 65.637 10.180 0.425
332 HG1 THR 49 HG1 THR 49 63.730 11.087 0.584
333 1HG2 THR 49 HG21 THR 49 65.174 10.062 -2.566
334 2HG2 THR 49 HG22 THR 49 66.693 9.762 -1.723
335 3HG2 THR 49 HG23 THR 49 66.000 11.382 -1.739
336 H SER 50 HN SER 50 64.582 6.017 -0.808
337 HA SER 50 HA SER 50 67.576 5.940 -1.031
338 1HB SER 50 HB2 SER 50 65.602 4.324 0.564
339 2HB SER 50 HB1 SER 50 67.142 3.610 0.097
340 HG SER 50 HG SER 50 67.537 4.597 2.006
341 H THR 51 HN THR 51 68.378 4.603 -2.669
342 HA THR 51 HA THR 51 66.403 3.576 -4.619
343 HB THR 51 HB THR 51 69.315 3.181 -5.004
344 HG1 THR 51 HG1 THR 51 69.192 5.628 -5.504
345 1HG2 THR 51 HG21 THR 51 68.381 3.034 -7.057
346 2HG2 THR 51 HG22 THR 51 68.298 4.794 -7.007
347 3HG2 THR 51 HG23 THR 51 66.900 3.831 -6.528
348 H SER 52 HN SER 52 65.940 1.404 -4.831
349 HA SER 52 HA SER 52 67.780 -0.585 -3.575
350 1HB SER 52 HB2 SER 52 65.196 -1.457 -2.974
351 2HB SER 52 HB1 SER 52 66.323 -0.712 -1.845
352 HG SER 52 HG SER 52 64.055 0.289 -3.001
353 H THR 53 HN THR 53 68.193 -2.100 -5.134
354 HA THR 53 HA THR 53 66.174 -2.511 -7.299
355 HB THR 53 HB THR 53 68.881 -3.750 -7.356
356 HG1 THR 53 HG1 THR 53 69.645 -1.586 -8.030
357 1HG2 THR 53 HG21 THR 53 66.999 -2.351 -9.234
358 2HG2 THR 53 HG22 THR 53 67.696 -3.965 -9.362
359 3HG2 THR 53 HG23 THR 53 68.697 -2.546 -9.669
360 H GLY 54 HN GLY 54 64.744 -3.971 -6.205
361 1HA GLY 54 HA2 GLY 54 64.016 -6.088 -5.499
362 2HA GLY 54 HA1 GLY 54 65.464 -6.738 -6.272
363 H SER 55 HN SER 55 64.102 -5.595 -3.257
364 HA SER 55 HA SER 55 66.176 -7.040 -1.755
365 1HB SER 55 HB2 SER 55 67.032 -5.048 -0.641
366 2HB SER 55 HB1 SER 55 67.173 -4.825 -2.383
367 HG SER 55 HG SER 55 64.912 -3.874 -2.037
368 H ARG 56 HN ARG 56 65.031 -7.995 -0.133
369 HA ARG 56 HA ARG 56 62.379 -7.049 0.643
370 1HB ARG 56 HB2 ARG 56 62.958 -9.426 0.515
371 2HB ARG 56 HB1 ARG 56 64.246 -9.198 1.699
372 1HG ARG 56 HG2 ARG 56 62.802 -9.181 3.455
373 2HG ARG 56 HG1 ARG 56 61.599 -8.235 2.577
374 1HD ARG 56 HD2 ARG 56 60.883 -10.619 3.129
375 2HD ARG 56 HD1 ARG 56 60.810 -10.212 1.402
376 HE ARG 56 HE ARG 56 63.427 -11.169 1.949
377 1HH1 ARG 56 HH2 ARG 56 60.491 -12.538 2.894
378 2HH1 ARG 56 HH2 ARG 56 60.735 -14.042 2.071
379 1HH2 ARG 56 HH1 ARG 56 63.614 -12.993 0.449
380 2HH2 ARG 56 HH1 ARG 56 62.502 -14.300 0.687
381 H ILE 57 HN ILE 57 62.449 -5.103 1.778
382 HA ILE 57 HA ILE 57 64.536 -4.508 3.729
383 HB ILE 57 HB ILE 57 61.868 -3.153 3.240
384 1HG1 ILE 57 HG12 ILE 57 63.019 -3.464 1.099
385 2HG1 ILE 57 HG11 ILE 57 63.126 -1.773 1.586
386 1HG2 ILE 57 HG21 ILE 57 63.962 -2.643 5.044
387 2HG2 ILE 57 HG22 ILE 57 62.649 -1.548 4.612
388 3HG2 ILE 57 HG23 ILE 57 64.180 -1.473 3.741
389 1HD1 ILE 57 HD1 ILE 57 65.267 -3.885 1.622
390 2HD1 ILE 57 HD1 ILE 57 65.374 -2.497 2.706
391 3HD1 ILE 57 HD1 ILE 57 65.332 -2.252 0.959
392 H SER 58 HN SER 58 62.174 -6.722 3.971
393 HA SER 58 HA SER 58 60.520 -6.342 6.134
394 1HB SER 58 HB2 SER 58 60.711 -8.709 6.453
395 2HB SER 58 HB1 SER 58 61.044 -8.426 4.747
396 HG SER 58 HG SER 58 63.286 -8.430 5.313
397 H GLY 59 HN GLY 59 60.742 -6.437 8.441
398 1HA GLY 59 HA2 GLY 59 63.015 -7.049 9.936
399 2HA GLY 59 HA1 GLY 59 63.217 -5.355 9.488
400 HA PRO 60 HA PRO 60 59.951 -6.051 12.920
401 1HB PRO 60 HB2 PRO 60 61.464 -6.426 15.170
402 2HB PRO 60 HB1 PRO 60 60.842 -7.769 14.190
403 1HG PRO 60 HG2 PRO 60 63.567 -6.575 14.253
404 2HG PRO 60 HG1 PRO 60 63.079 -8.268 14.082
405 1HD PRO 60 HD2 PRO 60 63.883 -6.702 11.991
406 2HD PRO 60 HD1 PRO 60 62.786 -8.090 11.823
407 H GLY 61 HN GLY 61 60.736 -3.765 11.787
408 1HA GLY 61 HA2 GLY 61 60.367 -1.541 12.938
409 2HA GLY 61 HA1 GLY 61 61.664 -2.021 14.034
410 H CYS 62 HN CYS 62 61.986 -2.937 10.716
411 HA CYS 62 HA CYS 62 64.500 -1.927 10.212
412 1HB CYS 62 HB2 CYS 62 62.339 -3.013 8.779
413 2HB CYS 62 HB1 CYS 62 62.748 -1.525 7.925
414 H LYS 63 HN LYS 63 65.353 0.036 9.411
415 HA LYS 63 HA LYS 63 63.561 2.368 9.038
416 1HB LYS 63 HB2 LYS 63 63.983 2.238 11.466
417 2HB LYS 63 HB1 LYS 63 65.722 2.171 11.168
418 1HG LYS 63 HG2 LYS 63 65.608 4.397 10.082
419 2HG LYS 63 HG1 LYS 63 63.883 4.469 10.441
420 1HD LYS 63 HD2 LYS 63 64.783 5.634 12.252
421 2HD LYS 63 HD1 LYS 63 64.659 4.000 12.907
422 1HE LYS 63 HE2 LYS 63 67.181 4.522 11.457
423 2HE LYS 63 HE1 LYS 63 66.969 5.478 12.938
424 1HZ LYS 63 HZ1 LYS 63 66.903 3.643 14.235
425 2HZ LYS 63 HZ2 LYS 63 67.822 2.969 12.975
426 3HZ LYS 63 HZ3 LYS 63 66.149 2.687 13.055
427 H ILE 64 HN ILE 64 64.347 3.067 7.067
428 HA ILE 64 HA ILE 64 67.323 3.261 6.777
429 HB ILE 64 HB ILE 64 65.410 2.705 4.512
430 1HG1 ILE 64 HG12 ILE 64 66.385 0.245 5.030
431 2HG1 ILE 64 HG11 ILE 64 66.328 0.874 6.677
432 1HG2 ILE 64 HG21 ILE 64 68.018 1.417 4.498
433 2HG2 ILE 64 HG22 ILE 64 68.165 3.163 4.699
434 3HG2 ILE 64 HG23 ILE 64 67.306 2.506 3.307
435 1HD1 ILE 64 HD1 ILE 64 63.909 1.705 5.740
436 2HD1 ILE 64 HD1 ILE 64 64.155 0.186 6.602
437 3HD1 ILE 64 HD1 ILE 64 64.110 0.202 4.839
438 H SER 65 HN SER 65 68.042 4.997 5.339
439 HA SER 65 HA SER 65 66.070 6.982 4.414
440 1HB SER 65 HB2 SER 65 66.170 8.093 6.393
441 2HB SER 65 HB1 SER 65 67.536 7.128 6.946
442 HG SER 65 HG SER 65 68.892 8.574 6.154
443 H THR 66 HN THR 66 66.918 7.096 2.343
444 HA THR 66 HA THR 66 68.455 7.653 0.638
445 HB THR 66 HB THR 66 70.325 8.658 2.755
446 HG1 THR 66 HG1 THR 66 67.955 9.991 1.975
447 1HG2 THR 66 HG21 THR 66 70.111 8.892 -0.016
448 2HG2 THR 66 HG22 THR 66 71.117 9.889 1.037
449 3HG2 THR 66 HG23 THR 66 69.499 10.431 0.593
450 H CYS 67 HN CYS 67 68.807 5.303 0.409
451 HA CYS 67 HA CYS 67 71.640 4.576 0.996
452 1HB CYS 67 HB2 CYS 67 69.125 3.196 1.942
453 2HB CYS 67 HB1 CYS 67 70.592 2.260 1.664
454 H ILE 68 HN ILE 68 72.305 4.272 -1.139
455 HA ILE 68 HA ILE 68 70.514 3.294 -3.209
456 HB ILE 68 HB ILE 68 73.499 3.763 -2.980
457 1HG1 ILE 68 HG12 ILE 68 72.941 5.613 -4.569
458 2HG1 ILE 68 HG11 ILE 68 71.239 5.171 -4.443
459 1HG2 ILE 68 HG21 ILE 68 71.845 2.705 -5.277
460 2HG2 ILE 68 HG22 ILE 68 73.336 2.038 -4.611
461 3HG2 ILE 68 HG23 ILE 68 73.378 3.536 -5.542
462 1HD1 ILE 68 HD1 ILE 68 71.143 5.769 -2.144
463 2HD1 ILE 68 HD1 ILE 68 72.043 7.074 -2.920
464 3HD1 ILE 68 HD1 ILE 68 72.900 5.830 -2.008
465 H ILE 69 HN ILE 69 69.759 1.253 -2.400
466 HA ILE 69 HA ILE 69 71.783 -0.877 -1.939
467 HB ILE 69 HB ILE 69 68.762 -0.812 -1.632
468 1HG1 ILE 69 HG12 ILE 69 70.600 -0.813 0.711
469 2HG1 ILE 69 HG11 ILE 69 70.487 0.695 -0.200
470 1HG2 ILE 69 HG21 ILE 69 68.909 -2.896 -0.617
471 2HG2 ILE 69 HG22 ILE 69 70.604 -2.681 -0.184
472 3HG2 ILE 69 HG23 ILE 69 70.159 -3.046 -1.851
473 1HD1 ILE 69 HD1 ILE 69 68.699 1.032 1.202
474 2HD1 ILE 69 HD1 ILE 69 68.419 -0.694 1.431
475 3HD1 ILE 69 HD1 ILE 69 67.865 0.101 -0.042
476 H THR 70 HN THR 70 71.572 -2.927 -3.112
477 HA THR 70 HA THR 70 69.827 -2.986 -5.503
478 HB THR 70 HB THR 70 72.839 -2.728 -5.516
479 HG1 THR 70 HG1 THR 70 71.506 -0.861 -5.705
480 1HG2 THR 70 HG21 THR 70 71.148 -4.336 -7.263
481 2HG2 THR 70 HG22 THR 70 72.908 -4.249 -7.179
482 3HG2 THR 70 HG23 THR 70 72.013 -3.084 -8.155
483 H GLY 71 HN GLY 71 68.952 -4.987 -4.838
484 1HA GLY 71 HA2 GLY 71 69.005 -7.371 -5.017
485 2HA GLY 71 HA1 GLY 71 70.766 -7.297 -5.093
486 H GLY 72 HN GLY 72 68.795 -5.714 -2.630
487 1HA GLY 72 HA2 GLY 72 68.552 -6.210 -0.338
488 2HA GLY 72 HA1 GLY 72 69.260 -7.794 -0.646
489 H VAL 73 HN VAL 73 71.082 -5.171 -1.870
490 HA VAL 73 HA VAL 73 72.939 -5.320 0.496
491 HB VAL 73 HB VAL 73 74.747 -5.347 -1.129
492 1HG1 VAL 73 HG11 VAL 73 72.742 -7.349 -0.951
493 2HG1 VAL 73 HG12 VAL 73 74.428 -7.560 -1.426
494 3HG1 VAL 73 HG13 VAL 73 73.200 -7.243 -2.651
495 1HG2 VAL 73 HG21 VAL 73 72.512 -4.527 -2.925
496 2HG2 VAL 73 HG22 VAL 73 73.782 -5.532 -3.630
497 3HG2 VAL 73 HG23 VAL 73 74.188 -3.977 -2.899
498 HA PRO 74 HA PRO 74 72.499 -0.885 0.233
499 1HB PRO 74 HB2 PRO 74 74.141 -0.282 2.328
500 2HB PRO 74 HB1 PRO 74 72.493 -0.896 2.547
501 1HG PRO 74 HG2 PRO 74 75.083 -2.287 2.854
502 2HG PRO 74 HG1 PRO 74 73.547 -2.560 3.684
503 1HD PRO 74 HD2 PRO 74 74.579 -4.101 1.595
504 2HD PRO 74 HD1 PRO 74 72.901 -4.119 2.177
505 H ALA 75 HN ALA 75 73.855 0.895 -0.435
506 HA ALA 75 HA ALA 75 76.441 0.057 -1.643
507 1HB ALA 75 HB1 ALA 75 74.504 2.352 -1.955
508 2HB ALA 75 HB2 ALA 75 74.984 1.154 -3.158
509 3HB ALA 75 HB3 ALA 75 76.113 2.419 -2.674
510 HA PRO 76 HA PRO 76 78.850 2.281 1.278
511 1HB PRO 76 HB2 PRO 76 80.843 3.302 -0.295
512 2HB PRO 76 HB1 PRO 76 80.725 1.579 0.117
513 1HG PRO 76 HG2 PRO 76 79.951 2.983 -2.387
514 2HG PRO 76 HG1 PRO 76 80.684 1.387 -2.167
515 1HD PRO 76 HD2 PRO 76 78.030 1.784 -2.700
516 2HD PRO 76 HD1 PRO 76 78.668 0.363 -1.842
517 H SER 77 HN SER 77 76.943 3.879 1.423
518 HA SER 77 HA SER 77 77.619 6.519 0.177
519 1HB SER 77 HB2 SER 77 75.222 4.967 0.532
520 2HB SER 77 HB1 SER 77 75.046 6.496 1.390
521 HG SER 77 HG SER 77 74.578 7.165 -0.568
522 H ALA 78 HN ALA 78 77.998 8.274 1.535
523 HA ALA 78 HA ALA 78 78.575 7.747 4.345
524 1HB ALA 78 HB1 ALA 78 78.905 9.864 2.318
525 2HB ALA 78 HB2 ALA 78 80.006 9.358 3.599
526 3HB ALA 78 HB3 ALA 78 78.686 10.470 3.960
527 H ALA 79 HN ALA 79 75.913 9.165 2.531
528 HA ALA 79 HA ALA 79 74.642 10.246 4.977
529 1HB ALA 79 HB1 ALA 79 72.861 10.586 2.949
530 2HB ALA 79 HB2 ALA 79 74.356 10.426 2.027
531 3HB ALA 79 HB3 ALA 79 74.203 11.690 3.247
532 H CYS 80 HN CYS 80 74.835 7.249 3.498
533 HA CYS 80 HA CYS 80 72.023 6.468 3.971
534 1HB CYS 80 HB2 CYS 80 72.980 5.556 2.013
535 2HB CYS 80 HB1 CYS 80 74.506 5.202 2.814
536 H LYS 81 HN LYS 81 71.391 4.996 5.600
537 HA LYS 81 HA LYS 81 73.312 4.746 7.860
538 1HB LYS 81 HB2 LYS 81 71.459 5.021 9.190
539 2HB LYS 81 HB1 LYS 81 70.829 5.773 7.732
540 1HG LYS 81 HG2 LYS 81 70.300 2.969 8.746
541 2HG LYS 81 HG1 LYS 81 69.137 4.261 8.485
542 1HD LYS 81 HD2 LYS 81 68.957 3.813 6.267
543 2HD LYS 81 HD1 LYS 81 70.670 3.520 6.076
544 1HE LYS 81 HE2 LYS 81 70.013 1.366 7.568
545 2HE LYS 81 HE1 LYS 81 68.506 1.598 6.666
546 1HZ LYS 81 HZ1 LYS 81 69.840 1.806 4.632
547 2HZ LYS 81 HZ2 LYS 81 70.021 0.281 5.355
548 3HZ LYS 81 HZ3 LYS 81 71.241 1.451 5.518
549 H ILE 82 HN ILE 82 72.122 2.686 9.224
550 HA ILE 82 HA ILE 82 71.505 0.299 7.830
551 HB ILE 82 HB ILE 82 74.041 1.114 7.219
552 1HG1 ILE 82 HG12 ILE 82 74.440 -1.289 6.591
553 2HG1 ILE 82 HG11 ILE 82 72.973 -1.706 7.477
554 1HG2 ILE 82 HG21 ILE 82 74.647 -1.072 9.157
555 2HG2 ILE 82 HG22 ILE 82 74.493 0.568 9.785
556 3HG2 ILE 82 HG23 ILE 82 75.692 0.209 8.542
557 1HD1 ILE 82 HD1 ILE 82 72.750 -1.295 4.931
558 2HD1 ILE 82 HD1 ILE 82 72.946 0.411 5.324
559 3HD1 ILE 82 HD1 ILE 82 71.588 -0.495 5.989
560 H SER 83 HN SER 83 70.952 1.747 10.304
561 HA SER 83 HA SER 83 72.165 0.464 12.579
562 1HB SER 83 HB2 SER 83 69.542 1.938 12.204
563 2HB SER 83 HB1 SER 83 70.297 1.598 13.760
564 HG SER 83 HG SER 83 70.786 3.700 12.891
565 H GLY 84 HN GLY 84 68.715 0.332 12.686
566 1HA GLY 84 HA2 GLY 84 68.893 -2.619 12.956
567 2HA GLY 84 HA1 GLY 84 67.593 -1.609 13.585
568 H CYS 85 HN CYS 85 68.971 -2.871 10.561
569 HA CYS 85 HA CYS 85 66.260 -3.253 9.529
570 1HB CYS 85 HB2 CYS 85 67.179 -0.811 9.149
571 2HB CYS 85 HB1 CYS 85 68.133 -1.569 7.881
572 H THR 86 HN THR 86 66.726 -3.939 6.950
573 HA THR 86 HA THR 86 69.227 -5.242 6.404
574 HB THR 86 HB THR 86 68.533 -6.575 8.355
575 HG1 THR 86 HG1 THR 86 69.092 -8.372 7.395
576 1HG2 THR 86 HG21 THR 86 66.068 -6.151 8.012
577 2HG2 THR 86 HG22 THR 86 66.467 -7.833 8.359
578 3HG2 THR 86 HG23 THR 86 66.107 -7.336 6.705
579 H PHE 87 HN PHE 87 69.135 -6.531 4.464
580 HA PHE 87 HA PHE 87 66.551 -6.357 2.954
581 1HB PHE 87 HB2 PHE 87 69.130 -6.224 1.470
582 2HB PHE 87 HB1 PHE 87 67.614 -5.397 1.143
583 HD1 PHE 87 HD1 PHE 87 67.060 -3.969 3.644
584 HD2 PHE 87 HD2 PHE 87 70.791 -4.597 1.600
585 HE1 PHE 87 HE1 PHE 87 67.977 -1.910 4.685
586 HE2 PHE 87 HE2 PHE 87 71.700 -2.548 2.647
587 HZ PHE 87 HZ PHE 87 70.300 -1.202 4.185
588 H SER 88 HN SER 88 66.428 -8.067 1.231
589 HA SER 88 HA SER 88 68.336 -10.329 1.584
590 1HB SER 88 HB2 SER 88 66.271 -10.400 3.142
591 2HB SER 88 HB1 SER 88 65.339 -10.710 1.680
592 HG SER 88 HG SER 88 66.916 -12.375 3.113
593 H ALA 89 HN ALA 89 67.074 -8.264 -0.510
594 HA ALA 89 HA ALA 89 66.870 -8.324 -2.868
595 1HB ALA 89 HB1 ALA 89 68.722 -10.094 -2.346
596 2HB ALA 89 HB2 ALA 89 67.959 -10.111 -3.937
597 3HB ALA 89 HB3 ALA 89 67.456 -11.270 -2.706
598 H ASN 90 HN ASN 90 64.904 -9.757 -0.697
599 HA ASN 90 HA ASN 90 62.929 -11.083 -0.810
600 1HB ASN 90 HB2 ASN 90 61.291 -9.505 -1.328
601 2HB ASN 90 HB1 ASN 90 62.712 -8.491 -1.115
602 1HD2 ASN 90 HD2 ASN 90 63.853 -7.796 -3.155
603 2HD2 ASN 90 HD2 ASN 90 62.958 -7.658 -4.590
Start of MODEL 25
1 1H ASP 1 HT1 ASP 1 47.929 4.682 4.863
2 2H ASP 1 HT2 ASP 1 49.150 5.634 5.565
3 3H ASP 1 HT3 ASP 1 49.025 5.517 3.874
4 HA ASP 1 HA ASP 1 47.044 6.807 5.687
5 1HB ASP 1 HB2 ASP 1 49.314 7.876 5.276
6 2HB ASP 1 HB1 ASP 1 48.884 7.958 3.569
7 H GLY 2 HN GLY 2 46.033 4.802 4.120
8 1HA GLY 2 HA2 GLY 2 43.958 5.139 2.758
9 2HA GLY 2 HA1 GLY 2 44.890 6.272 1.776
10 H SER 3 HN SER 3 43.578 4.037 0.643
11 HA SER 3 HA SER 3 45.404 1.808 0.290
12 1HB SER 3 HB2 SER 3 42.736 2.603 -0.395
13 2HB SER 3 HB1 SER 3 43.547 2.067 -1.864
14 HG SER 3 HG SER 3 42.517 0.383 -0.581
15 H CYS 4 HN CYS 4 47.418 2.716 -0.425
16 HA CYS 4 HA CYS 4 47.543 4.475 -2.759
17 1HB CYS 4 HB2 CYS 4 49.662 2.875 -1.283
18 2HB CYS 4 HB1 CYS 4 49.967 4.217 -2.388
19 H THR 5 HN THR 5 49.726 3.290 -4.146
20 HA THR 5 HA THR 5 48.913 0.583 -4.988
21 HB THR 5 HB THR 5 48.692 2.998 -6.813
22 HG1 THR 5 HG1 THR 5 46.415 2.140 -6.733
23 1HG2 THR 5 HG21 THR 5 47.541 1.226 -8.280
24 2HG2 THR 5 HG22 THR 5 48.291 0.034 -7.218
25 3HG2 THR 5 HG23 THR 5 49.299 1.138 -8.155
26 H ASN 6 HN ASN 6 51.361 2.617 -4.300
27 HA ASN 6 HA ASN 6 53.602 2.853 -5.046
28 1HB ASN 6 HB2 ASN 6 53.672 0.684 -4.033
29 2HB ASN 6 HB1 ASN 6 52.809 -0.050 -5.374
30 1HD2 ASN 6 HD2 ASN 6 54.042 -0.743 -7.195
31 2HD2 ASN 6 HD2 ASN 6 55.732 -0.600 -7.273
32 H THR 7 HN THR 7 51.680 3.643 -7.019
33 HA THR 7 HA THR 7 51.855 4.368 -9.281
34 HB THR 7 HB THR 7 54.020 2.322 -9.718
35 HG1 THR 7 HG1 THR 7 55.027 3.192 -8.106
36 1HG2 THR 7 HG21 THR 7 54.925 4.146 -11.140
37 2HG2 THR 7 HG22 THR 7 53.549 5.154 -10.691
38 3HG2 THR 7 HG23 THR 7 53.294 3.678 -11.622
39 H ASN 8 HN ASN 8 51.753 0.964 -8.379
40 HA ASN 8 HA ASN 8 49.475 0.305 -9.880
41 1HB ASN 8 HB2 ASN 8 51.882 0.692 -11.452
42 2HB ASN 8 HB1 ASN 8 51.296 -0.962 -11.625
43 1HD2 ASN 8 HD2 ASN 8 50.930 2.124 -12.900
44 2HD2 ASN 8 HD2 ASN 8 49.384 1.947 -13.579
45 H SER 9 HN SER 9 49.966 -0.726 -7.527
46 HA SER 9 HA SER 9 50.494 -3.566 -8.048
47 1HB SER 9 HB2 SER 9 52.495 -3.728 -6.842
48 2HB SER 9 HB1 SER 9 52.691 -2.215 -7.718
49 HG SER 9 HG SER 9 53.148 -2.218 -5.371
50 H GLN 10 HN GLN 10 51.268 -3.159 -4.862
51 HA GLN 10 HA GLN 10 48.384 -3.305 -4.035
52 1HB GLN 10 HB2 GLN 10 50.490 -4.666 -2.431
53 2HB GLN 10 HB1 GLN 10 48.870 -5.216 -2.851
54 1HG GLN 10 HG2 GLN 10 49.991 -5.274 -5.307
55 2HG GLN 10 HG1 GLN 10 51.432 -5.556 -4.328
56 1HE2 GLN 10 HE21 GLN 10 51.264 -7.789 -5.438
57 2HE2 GLN 10 HE22 GLN 10 50.282 -8.957 -4.694
58 H LEU 11 HN LEU 11 51.657 -2.753 -2.645
59 HA LEU 11 HA LEU 11 52.296 -1.355 -0.842
60 1HB LEU 11 HB2 LEU 11 51.636 0.157 -2.821
61 2HB LEU 11 HB1 LEU 11 50.115 0.420 -1.972
62 HG LEU 11 HG LEU 11 51.169 1.524 -0.171
63 1HD1 LEU 11 HD1 LEU 11 53.784 1.553 -0.137
64 2HD1 LEU 11 HD1 LEU 11 53.645 0.114 -1.145
65 3HD1 LEU 11 HD1 LEU 11 52.943 0.128 0.471
66 1HD2 LEU 11 HD2 LEU 11 52.927 2.265 -2.523
67 2HD2 LEU 11 HD2 LEU 11 52.415 3.304 -1.195
68 3HD2 LEU 11 HD2 LEU 11 51.240 2.760 -2.390
69 H SER 12 HN SER 12 51.333 -2.872 0.703
70 HA SER 12 HA SER 12 48.789 -3.166 1.652
71 1HB SER 12 HB2 SER 12 49.866 -3.500 3.867
72 2HB SER 12 HB1 SER 12 50.810 -4.225 2.570
73 HG SER 12 HG SER 12 51.441 -2.205 4.278
74 H ALA 13 HN ALA 13 47.264 -1.927 2.719
75 HA ALA 13 HA ALA 13 47.283 0.885 2.694
76 1HB ALA 13 HB1 ALA 13 45.309 0.659 3.975
77 2HB ALA 13 HB2 ALA 13 45.934 -0.739 4.850
78 3HB ALA 13 HB3 ALA 13 45.434 -0.903 3.166
79 H ASN 14 HN ASN 14 48.877 -1.324 4.840
80 HA ASN 14 HA ASN 14 49.238 0.526 7.062
81 1HB ASN 14 HB2 ASN 14 49.214 -2.001 7.129
82 2HB ASN 14 HB1 ASN 14 50.771 -1.981 6.298
83 1HD2 ASN 14 HD2 ASN 14 50.507 -3.075 8.933
84 2HD2 ASN 14 HD2 ASN 14 51.365 -2.083 10.010
85 H SER 15 HN SER 15 50.600 0.337 3.952
86 HA SER 15 HA SER 15 53.303 1.227 4.712
87 1HB SER 15 HB2 SER 15 52.864 -0.261 2.786
88 2HB SER 15 HB1 SER 15 51.868 0.986 2.041
89 HG SER 15 HG SER 15 54.588 1.334 2.779
90 H LYS 16 HN LYS 16 53.756 3.205 2.754
91 HA LYS 16 HA LYS 16 51.763 5.360 3.287
92 1HB LYS 16 HB2 LYS 16 53.908 5.035 4.907
93 2HB LYS 16 HB1 LYS 16 54.638 6.037 3.653
94 1HG LYS 16 HG2 LYS 16 52.277 7.345 4.022
95 2HG LYS 16 HG1 LYS 16 52.562 6.725 5.647
96 1HD LYS 16 HD2 LYS 16 54.438 8.017 5.961
97 2HD LYS 16 HD1 LYS 16 54.888 7.964 4.256
98 1HE LYS 16 HE2 LYS 16 53.701 9.856 3.770
99 2HE LYS 16 HE1 LYS 16 52.343 9.376 4.807
100 1HZ LYS 16 HZ1 LYS 16 53.279 10.295 6.631
101 2HZ LYS 16 HZ2 LYS 16 54.050 11.287 5.487
102 3HZ LYS 16 HZ3 LYS 16 54.866 9.948 6.142
103 H CYS 17 HN CYS 17 51.511 6.629 1.476
104 HA CYS 17 HA CYS 17 53.683 6.598 -0.590
105 1HB CYS 17 HB2 CYS 17 51.952 6.295 -2.280
106 2HB CYS 17 HB1 CYS 17 51.771 5.034 -1.061
107 H GLU 18 HN GLU 18 54.182 8.646 -1.319
108 HA GLU 18 HA GLU 18 52.173 10.796 -1.320
109 1HB GLU 18 HB2 GLU 18 54.155 10.365 0.821
110 2HB GLU 18 HB1 GLU 18 54.154 12.003 0.168
111 1HG GLU 18 HG2 GLU 18 51.482 11.578 0.385
112 2HG GLU 18 HG1 GLU 18 52.065 10.590 1.725
113 H LYS 19 HN LYS 19 55.652 11.232 -0.892
114 HA LYS 19 HA LYS 19 55.798 12.246 -3.709
115 1HB LYS 19 HB2 LYS 19 56.670 13.156 -1.085
116 2HB LYS 19 HB1 LYS 19 58.015 13.114 -2.226
117 1HG LYS 19 HG2 LYS 19 55.344 14.411 -2.830
118 2HG LYS 19 HG1 LYS 19 56.743 15.292 -2.214
119 1HD LYS 19 HD2 LYS 19 57.354 13.580 -4.528
120 2HD LYS 19 HD1 LYS 19 56.204 14.870 -4.883
121 1HE LYS 19 HE2 LYS 19 58.800 15.398 -3.403
122 2HE LYS 19 HE1 LYS 19 58.674 15.493 -5.170
123 1HZ LYS 19 HZ1 LYS 19 57.724 17.475 -4.963
124 2HZ LYS 19 HZ2 LYS 19 57.815 17.381 -3.271
125 3HZ LYS 19 HZ3 LYS 19 56.447 16.787 -4.084
126 H SER 20 HN SER 20 56.093 9.409 -3.148
127 HA SER 20 HA SER 20 59.041 8.987 -3.408
128 1HB SER 20 HB2 SER 20 56.691 7.222 -2.688
129 2HB SER 20 HB1 SER 20 58.310 6.586 -2.954
130 HG SER 20 HG SER 20 57.593 7.271 -0.718
131 H THR 21 HN THR 21 59.825 7.651 -5.146
132 HA THR 21 HA THR 21 57.978 7.519 -7.506
133 HB THR 21 HB THR 21 60.999 7.726 -7.242
134 HG1 THR 21 HG1 THR 21 58.983 9.505 -8.137
135 1HG2 THR 21 HG21 THR 21 60.796 8.120 -9.776
136 2HG2 THR 21 HG22 THR 21 59.196 7.391 -9.640
137 3HG2 THR 21 HG23 THR 21 60.629 6.458 -9.211
138 H LEU 22 HN LEU 22 57.172 5.394 -6.748
139 HA LEU 22 HA LEU 22 59.196 3.205 -6.704
140 1HB LEU 22 HB2 LEU 22 56.247 2.951 -6.139
141 2HB LEU 22 HB1 LEU 22 57.581 2.011 -5.481
142 HG LEU 22 HG LEU 22 56.869 4.878 -4.830
143 1HD1 LEU 22 HD1 LEU 22 55.548 3.400 -3.529
144 2HD1 LEU 22 HD1 LEU 22 56.907 3.805 -2.481
145 3HD1 LEU 22 HD1 LEU 22 56.876 2.258 -3.328
146 1HD2 LEU 22 HD2 LEU 22 59.448 3.753 -4.959
147 2HD2 LEU 22 HD2 LEU 22 59.015 3.723 -3.252
148 3HD2 LEU 22 HD2 LEU 22 58.988 5.245 -4.141
149 H THR 23 HN THR 23 58.265 1.079 -7.677
150 HA THR 23 HA THR 23 56.586 1.430 -10.074
151 HB THR 23 HB THR 23 59.560 0.836 -10.128
152 HG1 THR 23 HG1 THR 23 59.643 2.822 -10.750
153 1HG2 THR 23 HG21 THR 23 58.747 0.899 -12.745
154 2HG2 THR 23 HG22 THR 23 57.398 0.063 -11.974
155 3HG2 THR 23 HG23 THR 23 59.035 -0.578 -11.826
156 H ASN 24 HN ASN 24 55.242 -0.289 -9.587
157 HA ASN 24 HA ASN 24 54.565 -2.517 -9.208
158 1HB ASN 24 HB2 ASN 24 57.337 -2.863 -10.385
159 2HB ASN 24 HB1 ASN 24 56.204 -4.194 -10.151
160 1HD2 ASN 24 HD2 ASN 24 55.966 -4.535 -12.482
161 2HD2 ASN 24 HD2 ASN 24 55.109 -3.433 -13.449
162 H CYS 25 HN CYS 25 54.434 -2.654 -6.949
163 HA CYS 25 HA CYS 25 56.617 -4.091 -5.590
164 1HB CYS 25 HB2 CYS 25 56.476 -1.273 -5.567
165 2HB CYS 25 HB1 CYS 25 55.865 -1.782 -3.994
166 H TYR 26 HN TYR 26 55.836 -4.042 -3.035
167 HA TYR 26 HA TYR 26 52.874 -4.472 -2.991
168 1HB TYR 26 HB2 TYR 26 54.479 -6.542 -3.275
169 2HB TYR 26 HB1 TYR 26 54.822 -6.276 -1.565
170 HD1 TYR 26 HD1 TYR 26 52.219 -5.344 -0.541
171 HD2 TYR 26 HD2 TYR 26 53.128 -8.464 -3.350
172 HE1 TYR 26 HE1 TYR 26 50.111 -6.500 0.061
173 HE2 TYR 26 HE2 TYR 26 51.017 -9.622 -2.746
174 HH TYR 26 HH TYR 26 49.039 -8.549 -0.060
175 H VAL 27 HN VAL 27 55.861 -4.305 -1.123
176 HA VAL 27 HA VAL 27 56.383 -3.260 0.916
177 HB VAL 27 HB VAL 27 54.015 -1.542 0.140
178 1HG1 VAL 27 HG11 VAL 27 55.903 0.133 1.069
179 2HG1 VAL 27 HG12 VAL 27 56.354 -1.317 1.967
180 3HG1 VAL 27 HG13 VAL 27 54.731 -0.647 2.131
181 1HG2 VAL 27 HG21 VAL 27 56.852 -1.637 -0.928
182 2HG2 VAL 27 HG22 VAL 27 55.822 -0.217 -1.100
183 3HG2 VAL 27 HG23 VAL 27 55.350 -1.742 -1.847
184 H ASP 28 HN ASP 28 55.842 -3.415 3.065
185 HA ASP 28 HA ASP 28 53.039 -3.885 3.898
186 1HB ASP 28 HB2 ASP 28 54.869 -5.973 3.299
187 2HB ASP 28 HB1 ASP 28 54.727 -5.920 5.057
188 H LYS 29 HN LYS 29 52.820 -2.637 5.724
189 HA LYS 29 HA LYS 29 53.388 -1.491 7.716
190 1HB LYS 29 HB2 LYS 29 55.271 -3.872 7.789
191 2HB LYS 29 HB1 LYS 29 54.931 -2.830 9.170
192 1HG LYS 29 HG2 LYS 29 53.173 -4.161 9.629
193 2HG LYS 29 HG1 LYS 29 52.407 -3.531 8.171
194 1HD LYS 29 HD2 LYS 29 53.157 -5.342 6.851
195 2HD LYS 29 HD1 LYS 29 54.381 -5.806 8.035
196 1HE LYS 29 HE2 LYS 29 51.952 -5.921 9.447
197 2HE LYS 29 HE1 LYS 29 51.608 -6.658 7.868
198 1HZ LYS 29 HZ1 LYS 29 53.878 -7.780 8.191
199 2HZ LYS 29 HZ2 LYS 29 52.555 -8.395 9.062
200 3HZ LYS 29 HZ3 LYS 29 53.690 -7.391 9.831
201 H SER 30 HN SER 30 54.698 -0.616 5.282
202 HA SER 30 HA SER 30 57.356 0.264 6.372
203 1HB SER 30 HB2 SER 30 56.468 -0.289 3.526
204 2HB SER 30 HB1 SER 30 58.073 0.263 3.994
205 HG SER 30 HG SER 30 56.942 -2.230 4.128
206 H GLU 31 HN GLU 31 57.905 2.180 4.422
207 HA GLU 31 HA GLU 31 55.589 4.065 4.397
208 1HB GLU 31 HB2 GLU 31 58.040 4.186 6.046
209 2HB GLU 31 HB1 GLU 31 57.644 5.687 5.210
210 1HG GLU 31 HG2 GLU 31 55.722 6.012 6.416
211 2HG GLU 31 HG1 GLU 31 55.388 4.283 6.548
212 H VAL 32 HN VAL 32 59.098 4.455 3.876
213 HA VAL 32 HA VAL 32 60.316 4.903 1.893
214 HB VAL 32 HB VAL 32 57.732 4.507 0.382
215 1HG1 VAL 32 HG11 VAL 32 60.490 3.500 -0.284
216 2HG1 VAL 32 HG12 VAL 32 60.021 5.161 -0.651
217 3HG1 VAL 32 HG13 VAL 32 59.140 3.814 -1.373
218 1HG2 VAL 32 HG21 VAL 32 57.525 2.451 1.301
219 2HG2 VAL 32 HG22 VAL 32 59.036 2.641 2.192
220 3HG2 VAL 32 HG23 VAL 32 59.059 2.035 0.536
221 H TYR 33 HN TYR 33 60.805 6.835 0.873
222 HA TYR 33 HA TYR 33 58.669 8.884 0.521
223 1HB TYR 33 HB2 TYR 33 61.098 8.995 2.306
224 2HB TYR 33 HB1 TYR 33 60.411 10.475 1.648
225 HD1 TYR 33 HD1 TYR 33 60.109 7.914 4.166
226 HD2 TYR 33 HD2 TYR 33 57.937 10.960 2.052
227 HE1 TYR 33 HE1 TYR 33 58.365 7.895 5.930
228 HE2 TYR 33 HE2 TYR 33 56.194 10.939 3.815
229 HH TYR 33 HH TYR 33 56.428 8.722 6.604
230 H GLY 34 HN GLY 34 60.282 7.313 -1.397
231 1HA GLY 34 HA2 GLY 34 60.866 8.911 -3.458
232 2HA GLY 34 HA1 GLY 34 62.238 9.295 -2.423
233 H THR 35 HN THR 35 61.716 6.212 -1.620
234 HA THR 35 HA THR 35 63.974 5.162 -2.964
235 HB THR 35 HB THR 35 61.897 4.352 -1.133
236 HG1 THR 35 HG1 THR 35 64.044 4.366 -0.597
237 1HG2 THR 35 HG21 THR 35 61.127 2.897 -3.002
238 2HG2 THR 35 HG22 THR 35 61.767 1.962 -1.650
239 3HG2 THR 35 HG23 THR 35 62.745 2.202 -3.099
240 H THR 36 HN THR 36 63.895 3.279 -4.543
241 HA THR 36 HA THR 36 61.900 3.862 -6.697
242 HB THR 36 HB THR 36 64.326 4.230 -7.136
243 HG1 THR 36 HG1 THR 36 62.657 3.128 -8.646
244 1HG2 THR 36 HG21 THR 36 65.052 1.426 -7.309
245 2HG2 THR 36 HG22 THR 36 64.595 1.859 -5.662
246 3HG2 THR 36 HG23 THR 36 65.883 2.742 -6.480
247 H CYS 37 HN CYS 37 60.637 2.314 -4.988
248 HA CYS 37 HA CYS 37 61.059 -0.419 -4.700
249 1HB CYS 37 HB2 CYS 37 59.016 1.424 -4.338
250 2HB CYS 37 HB1 CYS 37 58.319 0.282 -5.485
251 H THR 38 HN THR 38 62.092 -1.321 -6.592
252 HA THR 38 HA THR 38 60.501 -1.325 -9.114
253 HB THR 38 HB THR 38 63.355 -1.889 -8.316
254 HG1 THR 38 HG1 THR 38 63.421 -0.441 -10.328
255 1HG2 THR 38 HG21 THR 38 61.848 -3.162 -10.461
256 2HG2 THR 38 HG22 THR 38 63.479 -3.503 -9.887
257 3HG2 THR 38 HG23 THR 38 63.212 -2.233 -11.081
258 H GLY 39 HN GLY 39 58.940 -2.940 -8.822
259 1HA GLY 39 HA2 GLY 39 58.062 -5.080 -8.359
260 2HA GLY 39 HA1 GLY 39 59.487 -5.624 -9.247
261 H SER 40 HN SER 40 59.032 -4.108 -6.040
262 HA SER 40 HA SER 40 60.525 -6.428 -4.853
263 1HB SER 40 HB2 SER 40 60.693 -3.549 -3.944
264 2HB SER 40 HB1 SER 40 61.793 -4.872 -3.567
265 HG SER 40 HG SER 40 62.611 -4.779 -5.580
266 H ARG 41 HN ARG 41 60.227 -6.194 -2.293
267 HA ARG 41 HA ARG 41 57.492 -5.271 -1.587
268 1HB ARG 41 HB2 ARG 41 58.517 -8.121 -1.397
269 2HB ARG 41 HB1 ARG 41 56.987 -7.561 -0.719
270 1HG ARG 41 HG2 ARG 41 56.331 -6.796 -3.028
271 2HG ARG 41 HG1 ARG 41 57.783 -7.587 -3.642
272 1HD ARG 41 HD2 ARG 41 56.843 -9.672 -2.306
273 2HD ARG 41 HD1 ARG 41 55.297 -8.823 -2.501
274 HE ARG 41 HE ARG 41 56.067 -8.652 -5.003
275 1HH1 ARG 41 HH1 ARG 41 54.705 -11.222 -4.008
276 2HH1 ARG 41 HH1 ARG 41 55.737 -12.422 -4.710
277 1HH2 ARG 41 HH2 ARG 41 58.304 -10.194 -5.398
278 2HH2 ARG 41 HH2 ARG 41 57.775 -11.841 -5.499
279 H PHE 42 HN PHE 42 57.270 -4.894 0.661
280 HA PHE 42 HA PHE 42 59.778 -5.214 2.275
281 1HB PHE 42 HB2 PHE 42 57.555 -3.156 2.443
282 2HB PHE 42 HB1 PHE 42 59.018 -3.170 3.428
283 HD1 PHE 42 HD1 PHE 42 58.124 -0.901 1.589
284 HD2 PHE 42 HD2 PHE 42 60.703 -4.275 0.946
285 HE1 PHE 42 HE1 PHE 42 59.322 0.352 -0.182
286 HE2 PHE 42 HE2 PHE 42 61.901 -3.018 -0.826
287 HZ PHE 42 HZ PHE 42 61.209 -0.701 -1.386
288 H ASP 43 HN ASP 43 59.121 -5.169 4.757
289 HA ASP 43 HA ASP 43 56.505 -6.396 5.340
290 1HB ASP 43 HB2 ASP 43 58.598 -8.007 4.532
291 2HB ASP 43 HB1 ASP 43 58.734 -8.067 6.291
292 H GLY 44 HN GLY 44 57.462 -3.999 6.306
293 1HA GLY 44 HA2 GLY 44 57.110 -3.331 8.674
294 2HA GLY 44 HA1 GLY 44 58.140 -4.686 9.135
295 H VAL 45 HN VAL 45 58.341 -1.819 6.978
296 HA VAL 45 HA VAL 45 61.057 -1.327 8.147
297 HB VAL 45 HB VAL 45 62.001 -1.170 6.017
298 1HG1 VAL 45 HG11 VAL 45 61.046 -3.479 6.435
299 2HG1 VAL 45 HG12 VAL 45 61.322 -3.081 4.739
300 3HG1 VAL 45 HG13 VAL 45 59.690 -3.019 5.405
301 1HG2 VAL 45 HG21 VAL 45 59.318 -0.167 5.296
302 2HG2 VAL 45 HG22 VAL 45 60.131 -1.082 4.027
303 3HG2 VAL 45 HG23 VAL 45 60.903 0.345 4.719
304 H THR 46 HN THR 46 61.677 0.969 6.829
305 HA THR 46 HA THR 46 59.503 2.913 6.780
306 HB THR 46 HB THR 46 61.473 2.785 9.090
307 HG1 THR 46 HG1 THR 46 59.844 1.988 10.124
308 1HG2 THR 46 HG21 THR 46 59.410 4.819 9.276
309 2HG2 THR 46 HG22 THR 46 60.428 5.073 7.858
310 3HG2 THR 46 HG23 THR 46 61.156 4.981 9.462
311 H ILE 47 HN ILE 47 61.198 2.409 4.769
312 HA ILE 47 HA ILE 47 63.680 3.948 4.929
313 HB ILE 47 HB ILE 47 63.413 1.858 3.640
314 1HG1 ILE 47 HG12 ILE 47 63.772 4.169 1.713
315 2HG1 ILE 47 HG11 ILE 47 64.995 3.719 2.903
316 1HG2 ILE 47 HG21 ILE 47 62.054 2.519 1.349
317 2HG2 ILE 47 HG22 ILE 47 61.111 3.361 2.577
318 3HG2 ILE 47 HG23 ILE 47 61.360 1.621 2.699
319 1HD1 ILE 47 HD1 ILE 47 64.890 1.364 1.954
320 2HD1 ILE 47 HD1 ILE 47 65.577 2.576 0.873
321 3HD1 ILE 47 HD1 ILE 47 63.919 2.024 0.638
322 H THR 48 HN THR 48 64.105 5.592 3.142
323 HA THR 48 HA THR 48 61.693 7.269 2.584
324 HB THR 48 HB THR 48 63.177 9.220 3.194
325 HG1 THR 48 HG1 THR 48 65.177 8.866 3.706
326 1HG2 THR 48 HG21 THR 48 62.064 7.200 4.963
327 2HG2 THR 48 HG22 THR 48 62.026 8.956 5.111
328 3HG2 THR 48 HG23 THR 48 63.412 8.050 5.719
329 H THR 49 HN THR 49 64.190 9.096 1.627
330 HA THR 49 HA THR 49 63.947 8.355 -1.183
331 HB THR 49 HB THR 49 65.621 10.325 0.402
332 HG1 THR 49 HG1 THR 49 63.436 10.807 0.309
333 1HG2 THR 49 HG21 THR 49 65.503 9.761 -2.554
334 2HG2 THR 49 HG22 THR 49 66.922 9.986 -1.529
335 3HG2 THR 49 HG23 THR 49 65.910 11.368 -1.950
336 H SER 50 HN SER 50 64.833 6.049 -0.729
337 HA SER 50 HA SER 50 67.833 6.098 -0.869
338 1HB SER 50 HB2 SER 50 65.879 4.404 0.677
339 2HB SER 50 HB1 SER 50 67.488 3.789 0.304
340 HG SER 50 HG SER 50 66.924 5.229 2.318
341 H THR 51 HN THR 51 68.737 4.726 -2.464
342 HA THR 51 HA THR 51 66.841 3.668 -4.467
343 HB THR 51 HB THR 51 69.775 3.218 -4.666
344 HG1 THR 51 HG1 THR 51 68.720 5.826 -4.883
345 1HG2 THR 51 HG21 THR 51 68.733 2.851 -6.689
346 2HG2 THR 51 HG22 THR 51 69.103 4.566 -6.862
347 3HG2 THR 51 HG23 THR 51 67.483 4.057 -6.384
348 H SER 52 HN SER 52 66.362 1.501 -4.713
349 HA SER 52 HA SER 52 68.117 -0.567 -3.537
350 1HB SER 52 HB2 SER 52 66.650 -1.221 -1.862
351 2HB SER 52 HB1 SER 52 66.312 0.507 -1.895
352 HG SER 52 HG SER 52 64.632 -1.466 -2.311
353 H THR 53 HN THR 53 68.154 -2.218 -5.006
354 HA THR 53 HA THR 53 65.824 -2.508 -6.876
355 HB THR 53 HB THR 53 68.413 -3.801 -7.485
356 HG1 THR 53 HG1 THR 53 69.576 -2.024 -7.572
357 1HG2 THR 53 HG21 THR 53 67.586 -1.914 -9.435
358 2HG2 THR 53 HG22 THR 53 66.127 -2.692 -8.824
359 3HG2 THR 53 HG23 THR 53 67.430 -3.669 -9.500
360 H GLY 54 HN GLY 54 64.583 -4.300 -6.452
361 1HA GLY 54 HA2 GLY 54 63.973 -6.371 -5.495
362 2HA GLY 54 HA1 GLY 54 65.447 -6.937 -6.290
363 H SER 55 HN SER 55 64.154 -5.623 -3.278
364 HA SER 55 HA SER 55 66.326 -6.985 -1.790
365 1HB SER 55 HB2 SER 55 66.890 -4.842 -0.645
366 2HB SER 55 HB1 SER 55 67.223 -4.779 -2.373
367 HG SER 55 HG SER 55 65.187 -3.745 -2.625
368 H ARG 56 HN ARG 56 65.325 -7.986 -0.093
369 HA ARG 56 HA ARG 56 62.634 -7.122 0.756
370 1HB ARG 56 HB2 ARG 56 63.030 -9.478 0.512
371 2HB ARG 56 HB1 ARG 56 64.522 -9.389 1.448
372 1HG ARG 56 HG2 ARG 56 63.385 -9.134 3.482
373 2HG ARG 56 HG1 ARG 56 61.911 -8.569 2.695
374 1HD ARG 56 HD2 ARG 56 61.113 -10.686 2.556
375 2HD ARG 56 HD1 ARG 56 62.605 -11.245 1.777
376 HE ARG 56 HE ARG 56 62.722 -10.746 4.697
377 1HH1 ARG 56 HH2 ARG 56 61.614 -13.091 2.529
378 2HH1 ARG 56 HH2 ARG 56 62.528 -14.394 3.212
379 1HH2 ARG 56 HH1 ARG 56 64.309 -12.362 5.383
380 2HH2 ARG 56 HH1 ARG 56 64.052 -13.981 4.827
381 H ILE 57 HN ILE 57 62.866 -5.196 1.955
382 HA ILE 57 HA ILE 57 64.988 -4.927 3.964
383 HB ILE 57 HB ILE 57 62.572 -3.241 3.229
384 1HG1 ILE 57 HG12 ILE 57 65.044 -2.033 2.531
385 2HG1 ILE 57 HG11 ILE 57 65.132 -3.706 1.978
386 1HG2 ILE 57 HG21 ILE 57 63.153 -2.501 5.381
387 2HG2 ILE 57 HG22 ILE 57 64.131 -1.457 4.349
388 3HG2 ILE 57 HG23 ILE 57 64.864 -2.851 5.143
389 1HD1 ILE 57 HD1 ILE 57 62.595 -2.225 1.459
390 2HD1 ILE 57 HD1 ILE 57 63.402 -3.449 0.479
391 3HD1 ILE 57 HD1 ILE 57 64.002 -1.790 0.488
392 H SER 58 HN SER 58 62.615 -6.980 4.130
393 HA SER 58 HA SER 58 60.781 -6.519 6.128
394 1HB SER 58 HB2 SER 58 62.500 -8.776 5.263
395 2HB SER 58 HB1 SER 58 61.754 -8.961 6.848
396 HG SER 58 HG SER 58 60.562 -9.612 4.804
397 H GLY 59 HN GLY 59 60.844 -6.686 8.483
398 1HA GLY 59 HA2 GLY 59 62.908 -7.173 10.205
399 2HA GLY 59 HA1 GLY 59 63.289 -5.550 9.632
400 HA PRO 60 HA PRO 60 59.841 -5.620 12.905
401 1HB PRO 60 HB2 PRO 60 61.289 -5.465 15.222
402 2HB PRO 60 HB1 PRO 60 60.753 -7.004 14.519
403 1HG PRO 60 HG2 PRO 60 63.427 -5.708 14.423
404 2HG PRO 60 HG1 PRO 60 63.007 -7.422 14.562
405 1HD PRO 60 HD2 PRO 60 63.827 -6.230 12.236
406 2HD PRO 60 HD1 PRO 60 62.815 -7.688 12.303
407 H GLY 61 HN GLY 61 60.718 -3.550 11.336
408 1HA GLY 61 HA2 GLY 61 60.182 -1.169 11.971
409 2HA GLY 61 HA1 GLY 61 61.324 -1.379 13.300
410 H CYS 62 HN CYS 62 62.091 -2.851 10.248
411 HA CYS 62 HA CYS 62 64.643 -1.914 9.882
412 1HB CYS 62 HB2 CYS 62 62.632 -3.140 8.357
413 2HB CYS 62 HB1 CYS 62 63.152 -1.763 7.385
414 H LYS 63 HN LYS 63 65.278 0.227 10.253
415 HA LYS 63 HA LYS 63 63.632 2.411 9.048
416 1HB LYS 63 HB2 LYS 63 64.236 2.456 11.467
417 2HB LYS 63 HB1 LYS 63 65.943 2.460 11.018
418 1HG LYS 63 HG2 LYS 63 65.523 4.558 9.697
419 2HG LYS 63 HG1 LYS 63 63.887 4.586 10.356
420 1HD LYS 63 HD2 LYS 63 64.827 4.645 12.649
421 2HD LYS 63 HD1 LYS 63 66.454 4.667 11.969
422 1HE LYS 63 HE2 LYS 63 66.270 6.934 11.953
423 2HE LYS 63 HE1 LYS 63 65.114 6.731 10.621
424 1HZ LYS 63 HZ1 LYS 63 64.267 6.349 13.423
425 2HZ LYS 63 HZ2 LYS 63 63.317 6.714 12.065
426 3HZ LYS 63 HZ3 LYS 63 64.315 7.906 12.753
427 H ILE 64 HN ILE 64 64.344 3.208 7.099
428 HA ILE 64 HA ILE 64 67.278 3.048 6.516
429 HB ILE 64 HB ILE 64 64.955 2.676 4.604
430 1HG1 ILE 64 HG12 ILE 64 66.006 0.250 4.680
431 2HG1 ILE 64 HG11 ILE 64 66.542 0.763 6.280
432 1HG2 ILE 64 HG21 ILE 64 67.568 3.348 4.055
433 2HG2 ILE 64 HG22 ILE 64 66.481 2.521 2.940
434 3HG2 ILE 64 HG23 ILE 64 67.600 1.589 3.935
435 1HD1 ILE 64 HD1 ILE 64 64.126 -0.353 5.863
436 2HD1 ILE 64 HD1 ILE 64 63.705 1.334 5.575
437 3HD1 ILE 64 HD1 ILE 64 64.403 0.851 7.120
438 H SER 65 HN SER 65 68.173 4.942 5.633
439 HA SER 65 HA SER 65 66.308 7.075 4.722
440 1HB SER 65 HB2 SER 65 66.765 8.405 6.495
441 2HB SER 65 HB1 SER 65 67.388 6.949 7.268
442 HG SER 65 HG SER 65 69.437 7.470 6.354
443 H THR 66 HN THR 66 67.027 7.465 2.695
444 HA THR 66 HA THR 66 68.486 7.855 0.891
445 HB THR 66 HB THR 66 70.300 9.059 2.959
446 HG1 THR 66 HG1 THR 66 68.000 10.378 2.048
447 1HG2 THR 66 HG21 THR 66 71.156 9.830 1.014
448 2HG2 THR 66 HG22 THR 66 69.740 10.880 0.952
449 3HG2 THR 66 HG23 THR 66 69.731 9.334 0.099
450 H CYS 67 HN CYS 67 69.022 5.506 0.732
451 HA CYS 67 HA CYS 67 71.943 5.081 1.170
452 1HB CYS 67 HB2 CYS 67 70.795 3.914 3.013
453 2HB CYS 67 HB1 CYS 67 69.710 3.131 1.877
454 H ILE 68 HN ILE 68 72.879 4.123 -0.638
455 HA ILE 68 HA ILE 68 71.088 3.610 -2.936
456 HB ILE 68 HB ILE 68 74.094 3.802 -2.562
457 1HG1 ILE 68 HG12 ILE 68 73.753 5.839 -3.996
458 2HG1 ILE 68 HG11 ILE 68 72.012 5.567 -3.904
459 1HG2 ILE 68 HG21 ILE 68 74.302 2.713 -4.524
460 2HG2 ILE 68 HG22 ILE 68 73.344 3.979 -5.292
461 3HG2 ILE 68 HG23 ILE 68 72.550 2.545 -4.641
462 1HD1 ILE 68 HD1 ILE 68 73.098 7.220 -2.207
463 2HD1 ILE 68 HD1 ILE 68 73.658 5.760 -1.390
464 3HD1 ILE 68 HD1 ILE 68 71.930 6.042 -1.605
465 H ILE 69 HN ILE 69 70.161 1.646 -2.198
466 HA ILE 69 HA ILE 69 71.931 -0.687 -1.727
467 HB ILE 69 HB ILE 69 68.909 -0.459 -1.660
468 1HG1 ILE 69 HG12 ILE 69 70.695 -0.061 0.752
469 2HG1 ILE 69 HG11 ILE 69 70.236 1.306 -0.257
470 1HG2 ILE 69 HG21 ILE 69 70.086 -2.718 -1.551
471 2HG2 ILE 69 HG22 ILE 69 69.009 -2.346 -0.206
472 3HG2 ILE 69 HG23 ILE 69 70.755 -2.190 -0.007
473 1HD1 ILE 69 HD1 ILE 69 68.733 0.213 1.821
474 2HD1 ILE 69 HD1 ILE 69 67.941 -0.367 0.355
475 3HD1 ILE 69 HD1 ILE 69 68.169 1.364 0.610
476 H THR 70 HN THR 70 71.540 -2.692 -2.966
477 HA THR 70 HA THR 70 69.897 -2.635 -5.386
478 HB THR 70 HB THR 70 72.883 -2.195 -5.413
479 HG1 THR 70 HG1 THR 70 72.322 -0.418 -6.455
480 1HG2 THR 70 HG21 THR 70 71.977 -2.527 -8.065
481 2HG2 THR 70 HG22 THR 70 71.364 -3.915 -7.167
482 3HG2 THR 70 HG23 THR 70 73.093 -3.566 -7.181
483 H GLY 71 HN GLY 71 69.120 -4.723 -5.021
484 1HA GLY 71 HA2 GLY 71 69.304 -7.095 -5.293
485 2HA GLY 71 HA1 GLY 71 71.061 -6.924 -5.273
486 H GLY 72 HN GLY 72 68.906 -5.547 -2.855
487 1HA GLY 72 HA2 GLY 72 68.638 -6.077 -0.585
488 2HA GLY 72 HA1 GLY 72 69.276 -7.682 -0.941
489 H VAL 73 HN VAL 73 71.165 -4.962 -1.936
490 HA VAL 73 HA VAL 73 72.998 -5.405 0.401
491 HB VAL 73 HB VAL 73 74.830 -5.362 -1.146
492 1HG1 VAL 73 HG11 VAL 73 74.442 -7.410 -2.057
493 2HG1 VAL 73 HG12 VAL 73 73.008 -6.856 -2.922
494 3HG1 VAL 73 HG13 VAL 73 72.894 -7.300 -1.219
495 1HG2 VAL 73 HG21 VAL 73 74.010 -5.094 -3.694
496 2HG2 VAL 73 HG22 VAL 73 74.492 -3.708 -2.717
497 3HG2 VAL 73 HG23 VAL 73 72.782 -4.098 -2.913
498 HA PRO 74 HA PRO 74 72.393 -0.969 0.597
499 1HB PRO 74 HB2 PRO 74 73.665 -0.633 2.994
500 2HB PRO 74 HB1 PRO 74 72.008 -1.248 2.866
501 1HG PRO 74 HG2 PRO 74 74.531 -2.707 3.388
502 2HG PRO 74 HG1 PRO 74 72.896 -3.027 3.981
503 1HD PRO 74 HD2 PRO 74 74.144 -4.403 1.930
504 2HD PRO 74 HD1 PRO 74 72.390 -4.350 2.211
505 H ALA 75 HN ALA 75 73.773 0.720 -0.039
506 HA ALA 75 HA ALA 75 76.613 0.002 -0.556
507 1HB ALA 75 HB1 ALA 75 74.759 2.246 -1.415
508 2HB ALA 75 HB2 ALA 75 75.355 0.914 -2.406
509 3HB ALA 75 HB3 ALA 75 76.461 2.179 -1.872
510 HA PRO 76 HA PRO 76 77.843 2.380 2.960
511 1HB PRO 76 HB2 PRO 76 80.505 2.585 2.360
512 2HB PRO 76 HB1 PRO 76 79.765 1.093 2.977
513 1HG PRO 76 HG2 PRO 76 80.521 1.818 0.194
514 2HG PRO 76 HG1 PRO 76 80.632 0.259 1.025
515 1HD PRO 76 HD2 PRO 76 78.660 0.899 -0.763
516 2HD PRO 76 HD1 PRO 76 78.470 -0.300 0.536
517 H SER 77 HN SER 77 76.524 4.166 1.728
518 HA SER 77 HA SER 77 78.284 6.176 0.418
519 1HB SER 77 HB2 SER 77 75.960 5.308 -0.386
520 2HB SER 77 HB1 SER 77 75.305 6.365 0.862
521 HG SER 77 HG SER 77 75.455 7.686 -0.838
522 H ALA 78 HN ALA 78 77.928 8.495 1.116
523 HA ALA 78 HA ALA 78 78.424 8.831 3.918
524 1HB ALA 78 HB1 ALA 78 78.555 10.291 1.525
525 2HB ALA 78 HB2 ALA 78 79.064 10.847 3.120
526 3HB ALA 78 HB3 ALA 78 77.433 11.193 2.545
527 H ALA 79 HN ALA 79 75.480 8.495 2.152
528 HA ALA 79 HA ALA 79 73.923 9.698 4.413
529 1HB ALA 79 HB1 ALA 79 72.366 10.341 2.813
530 2HB ALA 79 HB2 ALA 79 72.746 8.984 1.753
531 3HB ALA 79 HB3 ALA 79 73.835 10.368 1.837
532 H CYS 80 HN CYS 80 74.206 6.833 2.312
533 HA CYS 80 HA CYS 80 72.010 5.305 3.017
534 1HB CYS 80 HB2 CYS 80 73.677 4.521 1.473
535 2HB CYS 80 HB1 CYS 80 74.923 4.554 2.719
536 H LYS 81 HN LYS 81 71.178 4.588 4.921
537 HA LYS 81 HA LYS 81 72.818 4.793 7.385
538 1HB LYS 81 HB2 LYS 81 70.779 5.150 8.396
539 2HB LYS 81 HB1 LYS 81 70.304 5.563 6.753
540 1HG LYS 81 HG2 LYS 81 69.873 2.930 8.190
541 2HG LYS 81 HG1 LYS 81 68.642 4.047 7.608
542 1HD LYS 81 HD2 LYS 81 68.746 3.228 5.482
543 2HD LYS 81 HD1 LYS 81 70.495 3.110 5.514
544 1HE LYS 81 HE2 LYS 81 70.022 1.148 7.214
545 2HE LYS 81 HE1 LYS 81 68.470 1.096 6.356
546 1HZ LYS 81 HZ1 LYS 81 69.600 0.971 4.270
547 2HZ LYS 81 HZ2 LYS 81 70.232 -0.248 5.271
548 3HZ LYS 81 HZ3 LYS 81 71.113 1.181 5.007
549 H ILE 82 HN ILE 82 71.859 2.866 8.996
550 HA ILE 82 HA ILE 82 71.453 0.263 7.904
551 HB ILE 82 HB ILE 82 73.911 1.206 7.243
552 1HG1 ILE 82 HG12 ILE 82 74.559 -1.218 7.012
553 2HG1 ILE 82 HG11 ILE 82 73.103 -1.630 7.918
554 1HG2 ILE 82 HG21 ILE 82 75.582 0.761 8.736
555 2HG2 ILE 82 HG22 ILE 82 74.717 -0.593 9.462
556 3HG2 ILE 82 HG23 ILE 82 74.291 1.061 9.901
557 1HD1 ILE 82 HD1 ILE 82 71.949 -0.051 6.111
558 2HD1 ILE 82 HD1 ILE 82 72.268 -1.749 5.758
559 3HD1 ILE 82 HD1 ILE 82 73.360 -0.502 5.155
560 H SER 83 HN SER 83 70.563 1.849 10.141
561 HA SER 83 HA SER 83 71.742 0.459 12.503
562 1HB SER 83 HB2 SER 83 70.149 2.961 12.014
563 2HB SER 83 HB1 SER 83 70.245 2.273 13.632
564 HG SER 83 HG SER 83 72.219 3.443 12.046
565 H GLY 84 HN GLY 84 70.571 -1.583 12.149
566 1HA GLY 84 HA2 GLY 84 68.813 -2.919 13.060
567 2HA GLY 84 HA1 GLY 84 67.859 -1.456 13.296
568 H CYS 85 HN CYS 85 69.363 -2.970 10.419
569 HA CYS 85 HA CYS 85 66.765 -3.581 9.272
570 1HB CYS 85 HB2 CYS 85 67.116 -1.037 9.119
571 2HB CYS 85 HB1 CYS 85 68.387 -1.393 7.955
572 H THR 86 HN THR 86 67.093 -4.329 6.912
573 HA THR 86 HA THR 86 69.742 -4.929 5.940
574 HB THR 86 HB THR 86 69.699 -6.342 7.967
575 HG1 THR 86 HG1 THR 86 70.514 -7.051 5.784
576 1HG2 THR 86 HG21 THR 86 67.730 -7.229 8.607
577 2HG2 THR 86 HG22 THR 86 67.846 -8.349 7.251
578 3HG2 THR 86 HG23 THR 86 67.000 -6.814 7.056
579 H PHE 87 HN PHE 87 69.628 -6.288 4.012
580 HA PHE 87 HA PHE 87 66.838 -6.617 2.954
581 1HB PHE 87 HB2 PHE 87 69.226 -5.990 1.238
582 2HB PHE 87 HB1 PHE 87 67.528 -5.680 0.908
583 HD1 PHE 87 HD1 PHE 87 70.201 -3.855 1.047
584 HD2 PHE 87 HD2 PHE 87 66.716 -4.397 3.499
585 HE1 PHE 87 HE1 PHE 87 70.453 -1.550 1.917
586 HE2 PHE 87 HE2 PHE 87 66.975 -2.091 4.378
587 HZ PHE 87 HZ PHE 87 68.843 -0.667 3.584
588 H SER 88 HN SER 88 66.544 -8.437 1.551
589 HA SER 88 HA SER 88 68.835 -10.364 1.410
590 1HB SER 88 HB2 SER 88 66.851 -10.641 3.184
591 2HB SER 88 HB1 SER 88 66.018 -11.317 1.788
592 HG SER 88 HG SER 88 68.600 -12.105 2.672
593 H ALA 89 HN ALA 89 67.605 -8.440 -0.544
594 HA ALA 89 HA ALA 89 66.861 -8.429 -2.784
595 1HB ALA 89 HB1 ALA 89 68.222 -11.110 -2.450
596 2HB ALA 89 HB2 ALA 89 68.911 -9.623 -3.108
597 3HB ALA 89 HB3 ALA 89 67.684 -10.506 -4.018
598 H ASN 90 HN ASN 90 64.594 -8.421 -2.070
599 HA ASN 90 HA ASN 90 63.091 -10.838 -1.639
600 1HB ASN 90 HB2 ASN 90 61.343 -9.330 -1.330
601 2HB ASN 90 HB1 ASN 90 62.719 -8.251 -1.129
602 1HD2 ASN 90 HD2 ASN 90 63.557 -7.597 -3.611
603 2HD2 ASN 90 HD2 ASN 90 62.310 -6.932 -4.550
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