Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
22047 | 2j4m RC | 7285 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 HT1 ALA 1 5.969 5.716 -7.478
2 H2 ALA 1 HT3 ALA 1 6.306 4.267 -6.626
3 H3 ALA 1 HT2 ALA 1 4.693 4.639 -7.079
4 HA ALA 1 HA ALA 1 5.025 5.033 -4.777
5 1HB ALA 1 HB2 ALA 1 6.805 6.089 -3.909
6 2HB ALA 1 HB3 ALA 1 6.824 7.316 -5.176
7 3HB ALA 1 HB1 ALA 1 7.554 5.738 -5.466
8 H MET 2 HN MET 2 3.079 5.643 -6.468
9 HA MET 2 HA MET 2 2.057 8.090 -5.464
10 1HB MET 2 HB2 MET 2 3.644 8.928 -7.223
11 2HB MET 2 HB1 MET 2 2.663 8.101 -8.423
12 1HG MET 2 HG2 MET 2 1.010 9.631 -8.333
13 2HG MET 2 HG1 MET 2 1.231 9.930 -6.610
14 1HE MET 2 HE2 MET 2 3.210 11.114 -5.631
15 2HE MET 2 HE1 MET 2 4.587 10.767 -6.678
16 3HE MET 2 HE3 MET 2 4.084 12.436 -6.407
17 H ALA 3 HN ALA 3 0.350 6.709 -4.908
18 HA ALA 3 HA ALA 3 -1.637 6.389 -6.978
19 1HB ALA 3 HB1 ALA 3 -1.664 4.148 -7.215
20 2HB ALA 3 HB2 ALA 3 -1.210 3.858 -5.535
21 3HB ALA 3 HB3 ALA 3 0.024 4.282 -6.722
22 H CYS 4 HN CYS 4 -1.346 7.844 -4.478
23 HA CYS 4 HA CYS 4 -2.843 6.601 -2.422
24 1HB CYS 4 HB2 CYS 4 -3.009 8.892 -1.473
25 2HB CYS 4 HB1 CYS 4 -1.362 8.441 -1.904
26 H TRP 5 HN TRP 5 -4.986 6.865 -1.802
27 HA TRP 5 HA TRP 5 -6.834 7.290 -3.967
28 1HB TRP 5 HB2 TRP 5 -8.557 6.777 -2.166
29 2HB TRP 5 HB1 TRP 5 -7.388 5.504 -2.504
30 HD1 TRP 5 HD1 TRP 5 -6.078 4.589 -0.490
31 HE1 TRP 5 HE1 TRP 5 -5.814 5.249 1.985
32 HE3 TRP 5 HE3 TRP 5 -8.561 9.018 -0.606
33 HZ2 TRP 5 HZ2 TRP 5 -6.586 7.391 3.666
34 HZ3 TRP 5 HZ3 TRP 5 -8.771 10.325 1.469
35 HH2 TRP 5 HH2 TRP 5 -7.802 9.526 3.563
36 H ALA 6 HN ALA 6 -5.409 9.270 -1.617
37 HA ALA 6 HA ALA 6 -7.579 11.081 -1.196
38 1HB ALA 6 HB3 ALA 6 -4.653 11.673 -0.814
39 2HB ALA 6 HB2 ALA 6 -6.030 12.430 -0.012
40 3HB ALA 6 HB1 ALA 6 -5.614 10.754 0.345
41 H GLN 7 HN GLN 7 -4.948 10.835 -3.504
42 HA GLN 7 HA GLN 7 -5.084 13.456 -4.531
43 1HB GLN 7 HB2 GLN 7 -3.891 12.561 -6.480
44 2HB GLN 7 HB1 GLN 7 -3.177 12.002 -4.974
45 1HG GLN 7 HG2 GLN 7 -3.356 9.919 -5.680
46 2HG GLN 7 HG1 GLN 7 -5.110 10.095 -5.724
47 1HE2 GLN 7 1HE2 GLN 7 -2.160 10.405 -7.590
48 2HE2 GLN 7 2HE2 GLN 7 -2.902 10.265 -9.144
49 H SER 8 HN SER 8 -6.990 10.600 -5.107
50 HA SER 8 HA SER 8 -8.154 11.208 -7.555
51 1HB SER 8 HB2 SER 8 -8.444 9.182 -5.788
52 2HB SER 8 HB1 SER 8 -9.952 10.049 -5.503
53 HG SER 8 HG SER 8 -9.675 8.348 -7.322
54 H GLN 9 HN GLN 9 -8.627 12.647 -4.445
55 HA GLN 9 HA GLN 9 -11.025 14.062 -5.339
56 1HB GLN 9 HB2 GLN 9 -9.716 14.274 -2.633
57 2HB GLN 9 HB1 GLN 9 -11.368 14.685 -3.072
58 1HG GLN 9 HG2 GLN 9 -11.585 12.175 -3.649
59 2HG GLN 9 HG1 GLN 9 -10.138 11.995 -2.657
60 1HE2 GLN 9 1HE2 GLN 9 -10.343 11.941 -0.510
61 2HE2 GLN 9 2HE2 GLN 9 -11.813 12.217 0.355
62 H GLY 10 HN GLY 10 -7.641 14.554 -4.644
63 1HA GLY 10 HA1 GLY 10 -7.944 17.459 -4.907
64 2HA GLY 10 HA2 GLY 10 -6.982 16.619 -6.113
65 H TYR 11 HN TYR 11 -6.946 15.460 -2.846
66 HA TYR 11 HA TYR 11 -4.826 17.031 -1.849
67 1HB TYR 11 HB2 TYR 11 -6.143 14.479 -1.071
68 2HB TYR 11 HB1 TYR 11 -4.553 14.800 -0.391
69 HD1 TYR 11 HD1 TYR 11 -8.068 15.706 -0.363
70 HD2 TYR 11 HD2 TYR 11 -4.206 16.772 1.076
71 HE1 TYR 11 HE1 TYR 11 -9.104 17.131 1.349
72 HE2 TYR 11 HE2 TYR 11 -5.234 18.199 2.791
73 HH TYR 11 HH TYR 11 -8.568 19.005 2.759
74 H ASN 12 HN ASN 12 -2.849 15.438 -0.950
75 HA ASN 12 HA ASN 12 -1.648 14.299 -3.388
76 1HB ASN 12 HB2 ASN 12 -0.638 16.476 -2.839
77 2HB ASN 12 HB1 ASN 12 -0.251 15.892 -1.224
78 1HD2 ASN 12 1HD2 ASN 12 1.932 16.089 -1.392
79 2HD2 ASN 12 2HD2 ASN 12 2.899 15.129 -2.454
80 H CYS 13 HN CYS 13 0.106 12.721 -2.946
81 HA CYS 13 HA CYS 13 -0.748 10.859 -0.927
82 1HB CYS 13 HB2 CYS 13 1.700 10.592 -2.661
83 2HB CYS 13 HB1 CYS 13 0.727 9.315 -1.940
84 H CYS 14 HN CYS 14 0.405 10.143 0.845
85 HA CYS 14 HA CYS 14 2.480 11.988 1.793
86 1HB CYS 14 HB2 CYS 14 0.270 10.682 3.041
87 2HB CYS 14 HB1 CYS 14 1.752 10.102 3.790
88 H ASN 15 HN ASN 15 4.457 11.321 1.234
89 HA ASN 15 HA ASN 15 5.273 8.784 0.557
90 1HB ASN 15 HB2 ASN 15 7.385 9.668 0.459
91 2HB ASN 15 HB1 ASN 15 6.443 11.150 0.507
92 1HD2 ASN 15 1HD2 ASN 15 5.796 11.038 3.280
93 2HD2 ASN 15 2HD2 ASN 15 7.246 11.368 4.159
94 H ASN 16 HN ASN 16 6.429 7.131 1.682
95 HA ASN 16 HA ASN 16 6.574 5.610 3.379
96 1HB ASN 16 HB2 ASN 16 7.070 8.034 5.113
97 2HB ASN 16 HB1 ASN 16 7.625 6.388 5.400
98 1HD2 ASN 16 1HD2 ASN 16 8.417 9.373 4.167
99 2HD2 ASN 16 2HD2 ASN 16 9.833 8.932 3.281
100 HA PRO 17 HA PRO 17 2.234 6.975 4.849
101 1HB PRO 17 HB2 PRO 17 0.954 4.861 3.619
102 2HB PRO 17 HB1 PRO 17 1.091 6.486 2.941
103 1HG PRO 17 HG2 PRO 17 2.721 4.048 2.367
104 2HG PRO 17 HG1 PRO 17 2.124 5.288 1.249
105 1HD PRO 17 HD2 PRO 17 4.677 5.249 2.076
106 2HD PRO 17 HD1 PRO 17 3.811 6.775 1.798
107 H SER 18 HN SER 18 4.222 4.155 4.862
108 HA SER 18 HA SER 18 2.608 2.673 6.728
109 1HB SER 18 HB2 SER 18 4.477 1.898 4.955
110 2HB SER 18 HB1 SER 18 5.479 1.999 6.402
111 HG SER 18 HG SER 18 3.387 0.269 5.796
112 H SER 19 HN SER 19 4.331 5.418 7.130
113 HA SER 19 HA SER 19 4.686 4.896 9.972
114 1HB SER 19 HB2 SER 19 6.887 4.466 8.742
115 2HB SER 19 HB1 SER 19 6.917 6.197 8.410
116 HG SER 19 HG SER 19 7.187 4.839 10.844
117 H THR 20 HN THR 20 2.854 6.474 8.291
118 HA THR 20 HA THR 20 3.582 9.217 8.954
119 HB THR 20 HB THR 20 1.575 7.927 7.137
120 HG1 THR 20 HG1 THR 20 3.393 8.435 6.087
121 1HG2 THR 20 2HG2 THR 20 1.506 10.812 7.964
122 2HG2 THR 20 1HG2 THR 20 0.613 10.100 6.621
123 3HG2 THR 20 3HG2 THR 20 0.267 9.597 8.274
124 H LYS 21 HN LYS 21 2.286 10.536 10.249
125 HA LYS 21 HA LYS 21 0.699 9.093 12.217
126 1HB LYS 21 HB2 LYS 21 2.358 10.675 13.041
127 2HB LYS 21 HB1 LYS 21 1.617 11.973 12.114
128 1HG LYS 21 HG2 LYS 21 0.852 12.313 14.284
129 2HG LYS 21 HG1 LYS 21 -0.492 11.497 13.482
130 1HD LYS 21 HD2 LYS 21 0.201 9.373 14.451
131 2HD LYS 21 HD1 LYS 21 1.581 10.160 15.220
132 1HE LYS 21 HE2 LYS 21 -1.280 10.945 15.735
133 2HE LYS 21 HE1 LYS 21 -0.409 9.761 16.709
134 1HZ LYS 21 HZ3 LYS 21 0.924 12.312 16.313
135 2HZ LYS 21 HZ2 LYS 21 -0.470 12.354 17.269
136 3HZ LYS 21 HZ1 LYS 21 0.819 11.347 17.699
137 H VAL 22 HN VAL 22 -1.401 8.821 11.822
138 HA VAL 22 HA VAL 22 -2.836 10.681 10.135
139 HB VAL 22 HB VAL 22 -3.715 8.073 11.389
140 1HG1 VAL 22 2HG1 VAL 22 -5.539 9.726 10.883
141 2HG1 VAL 22 1HG1 VAL 22 -5.075 9.607 9.186
142 3HG1 VAL 22 3HG1 VAL 22 -5.668 8.183 10.041
143 1HG2 VAL 22 1HG2 VAL 22 -1.876 8.211 9.511
144 2HG2 VAL 22 3HG2 VAL 22 -3.135 6.977 9.470
145 3HG2 VAL 22 2HG2 VAL 22 -3.283 8.421 8.469
146 H GLU 23 HN GLU 23 -3.179 12.477 11.356
147 HA GLU 23 HA GLU 23 -4.324 12.220 14.019
148 1HB GLU 23 HB2 GLU 23 -4.392 14.881 13.567
149 2HB GLU 23 HB1 GLU 23 -2.982 14.044 14.197
150 1HG GLU 23 HG2 GLU 23 -1.883 14.102 12.137
151 2HG GLU 23 HG1 GLU 23 -3.367 14.461 11.256
152 H TYR 24 HN TYR 24 -5.461 11.968 10.995
153 HA TYR 24 HA TYR 24 -8.120 12.924 11.817
154 1HB TYR 24 HB2 TYR 24 -6.928 14.572 10.268
155 2HB TYR 24 HB1 TYR 24 -7.122 13.355 9.011
156 HD1 TYR 24 HD1 TYR 24 -8.633 16.100 10.678
157 HD2 TYR 24 HD2 TYR 24 -9.529 12.514 8.571
158 HE1 TYR 24 HE1 TYR 24 -10.903 16.937 10.229
159 HE2 TYR 24 HE2 TYR 24 -11.802 13.339 8.116
160 HH TYR 24 HH TYR 24 -12.912 15.670 7.946
161 H THR 25 HN THR 25 -9.852 11.748 11.076
162 HA THR 25 HA THR 25 -9.593 9.764 9.040
163 HB THR 25 HB THR 25 -10.067 8.710 11.827
164 HG1 THR 25 HG1 THR 25 -7.694 8.574 10.279
165 1HG2 THR 25 3HG2 THR 25 -10.434 7.581 9.264
166 2HG2 THR 25 2HG2 THR 25 -9.044 6.789 10.010
167 3HG2 THR 25 1HG2 THR 25 -10.599 6.809 10.842
168 H ASP 26 HN ASP 26 -11.504 9.422 8.133
169 HA ASP 26 HA ASP 26 -13.959 9.573 9.657
170 1HB ASP 26 HB2 ASP 26 -13.111 11.936 8.672
171 2HB ASP 26 HB1 ASP 26 -13.975 11.330 7.262
172 H ALA 27 HN ALA 27 -15.482 10.038 7.112
173 HA ALA 27 HA ALA 27 -15.409 7.288 6.208
174 1HB ALA 27 HB3 ALA 27 -17.598 7.921 6.422
175 2HB ALA 27 HB2 ALA 27 -17.289 9.573 5.890
176 3HB ALA 27 HB1 ALA 27 -17.346 8.263 4.711
177 H SER 28 HN SER 28 -13.494 9.724 5.452
178 HA SER 28 HA SER 28 -13.546 9.271 2.552
179 1HB SER 28 HB2 SER 28 -11.898 11.354 3.983
180 2HB SER 28 HB1 SER 28 -12.369 11.311 2.284
181 HG SER 28 HG SER 28 -13.766 12.714 3.172
182 H GLY 29 HN GLY 29 -11.760 8.710 5.451
183 1HA GLY 29 HA1 GLY 29 -9.489 7.672 3.884
184 2HA GLY 29 HA2 GLY 29 -10.268 6.689 5.116
185 H GLN 30 HN GLN 30 -7.599 7.111 5.297
186 HA GLN 30 HA GLN 30 -7.426 8.668 7.755
187 1HB GLN 30 HB2 GLN 30 -5.372 6.839 6.501
188 2HB GLN 30 HB1 GLN 30 -5.325 7.505 8.126
189 1HG GLN 30 HG2 GLN 30 -7.001 6.111 8.890
190 2HG GLN 30 HG1 GLN 30 -7.626 5.809 7.270
191 1HE2 GLN 30 1HE2 GLN 30 -4.291 5.639 8.398
192 2HE2 GLN 30 2HE2 GLN 30 -4.078 3.954 8.080
193 H TRP 31 HN TRP 31 -6.309 10.521 7.967
194 HA TRP 31 HA TRP 31 -4.578 11.366 5.742
195 1HB TRP 31 HB2 TRP 31 -6.296 13.323 7.250
196 2HB TRP 31 HB1 TRP 31 -5.480 13.542 5.707
197 HD1 TRP 31 HD1 TRP 31 -8.409 11.439 7.148
198 HE1 TRP 31 HE1 TRP 31 -10.171 11.171 5.292
199 HE3 TRP 31 HE3 TRP 31 -5.940 13.796 3.343
200 HZ2 TRP 31 HZ2 TRP 31 -10.472 11.871 2.570
201 HZ3 TRP 31 HZ3 TRP 31 -7.034 13.952 1.145
202 HH2 TRP 31 HH2 TRP 31 -9.254 13.010 0.769
203 H GLY 32 HN GLY 32 -2.882 12.817 6.303
204 1HA GLY 32 HA1 GLY 32 -1.418 12.211 8.532
205 2HA GLY 32 HA2 GLY 32 -2.425 13.559 9.038
206 H VAL 33 HN VAL 33 -0.480 14.776 9.352
207 HA VAL 33 HA VAL 33 0.397 16.058 6.879
208 HB VAL 33 HB VAL 33 0.801 16.868 9.762
209 1HG1 VAL 33 3HG1 VAL 33 2.235 17.660 7.419
210 2HG1 VAL 33 2HG1 VAL 33 1.284 19.027 8.004
211 3HG1 VAL 33 1HG1 VAL 33 2.425 18.222 9.080
212 1HG2 VAL 33 2HG2 VAL 33 -1.085 17.751 7.604
213 2HG2 VAL 33 1HG2 VAL 33 -1.446 17.249 9.256
214 3HG2 VAL 33 3HG2 VAL 33 -0.673 18.806 8.956
215 H GLN 34 HN GLN 34 2.124 15.207 5.935
216 HA GLN 34 HA GLN 34 4.348 14.321 7.652
217 1HB GLN 34 HB2 GLN 34 3.160 12.569 6.207
218 2HB GLN 34 HB1 GLN 34 3.895 13.377 4.827
219 1HG GLN 34 HG2 GLN 34 5.728 12.189 5.131
220 2HG GLN 34 HG1 GLN 34 5.945 12.949 6.706
221 1HE2 GLN 34 1HE2 GLN 34 5.932 10.083 5.280
222 2HE2 GLN 34 2HE2 GLN 34 5.319 9.081 6.548
223 H ASN 35 HN ASN 35 6.317 15.184 7.320
224 HA ASN 35 HA ASN 35 7.831 16.757 6.699
225 1HB ASN 35 HB2 ASN 35 8.552 16.651 4.448
226 2HB ASN 35 HB1 ASN 35 7.892 15.059 4.804
227 1HD2 ASN 35 1HD2 ASN 35 6.196 14.316 3.658
228 2HD2 ASN 35 2HD2 ASN 35 5.438 15.182 2.369
229 H GLY 36 HN GLY 36 5.103 17.691 7.228
230 1HA GLY 36 HA1 GLY 36 5.456 20.391 6.367
231 2HA GLY 36 HA2 GLY 36 4.103 19.765 7.296
232 H GLN 37 HN GLN 37 3.115 17.852 5.528
233 HA GLN 37 HA GLN 37 1.762 19.579 3.651
234 1HB GLN 37 HB2 GLN 37 3.298 17.200 2.596
235 2HB GLN 37 HB1 GLN 37 2.307 18.310 1.659
236 1HG GLN 37 HG2 GLN 37 3.875 20.138 2.321
237 2HG GLN 37 HG1 GLN 37 4.911 18.904 3.039
238 1HE2 GLN 37 1HE2 GLN 37 3.078 19.178 0.009
239 2HE2 GLN 37 2HE2 GLN 37 4.407 18.797 -1.028
240 H TRP 38 HN TRP 38 -0.294 18.941 3.354
241 HA TRP 38 HA TRP 38 -1.333 16.754 4.837
242 1HB TRP 38 HB2 TRP 38 -2.444 18.782 2.955
243 2HB TRP 38 HB1 TRP 38 -3.399 17.335 3.251
244 HD1 TRP 38 HD1 TRP 38 -3.562 20.624 4.313
245 HE1 TRP 38 HE1 TRP 38 -4.325 20.910 6.756
246 HE3 TRP 38 HE3 TRP 38 -2.696 15.874 5.996
247 HZ2 TRP 38 HZ2 TRP 38 -4.533 19.331 9.085
248 HZ3 TRP 38 HZ3 TRP 38 -3.207 15.345 8.347
249 HH2 TRP 38 HH2 TRP 38 -4.106 17.039 9.856
250 H CYS 39 HN CYS 39 -1.957 14.732 4.199
251 HA CYS 39 HA CYS 39 -2.314 13.928 1.530
252 1HB CYS 39 HB2 CYS 39 -0.184 12.286 1.793
253 2HB CYS 39 HB1 CYS 39 -0.144 13.800 0.905
254 H GLY 40 HN GLY 40 -3.229 11.932 1.385
255 1HA GLY 40 HA1 GLY 40 -4.431 10.135 2.177
256 2HA GLY 40 HA2 GLY 40 -4.181 10.758 3.802
257 H ILE 41 HN ILE 41 -3.947 8.487 4.384
258 HA ILE 41 HA ILE 41 -1.159 7.653 4.100
259 HB ILE 41 HB ILE 41 -3.280 7.143 6.141
260 1HG1 ILE 41 2HG1 ILE 41 -1.289 7.597 7.637
261 2HG1 ILE 41 1HG1 ILE 41 -0.378 7.962 6.175
262 1HG2 ILE 41 2HG2 ILE 41 -0.998 5.302 5.520
263 2HG2 ILE 41 1HG2 ILE 41 -1.657 5.440 7.151
264 3HG2 ILE 41 3HG2 ILE 41 -2.691 4.910 5.825
265 1HD1 ILE 41 3HD1 ILE 41 -2.945 9.367 6.508
266 2HD1 ILE 41 2HD1 ILE 41 -1.643 9.812 7.610
267 3HD1 ILE 41 1HD1 ILE 41 -1.406 9.940 5.867
268 H ASP 42 HN ASP 42 -0.975 6.536 2.245
269 HA ASP 42 HA ASP 42 -2.762 4.226 1.846
270 1HB ASP 42 HB2 ASP 42 -1.385 6.051 -0.106
271 2HB ASP 42 HB1 ASP 42 -1.873 4.427 -0.582
272 H TYR 43 HN TYR 43 -1.607 2.648 2.908
273 HA TYR 43 HA TYR 43 1.195 2.371 2.827
274 1HB TYR 43 HB2 TYR 43 -0.707 0.067 3.209
275 2HB TYR 43 HB1 TYR 43 0.904 0.275 3.886
276 HD1 TYR 43 HD1 TYR 43 0.802 2.960 5.021
277 HD2 TYR 43 HD2 TYR 43 -2.166 -0.089 5.000
278 HE1 TYR 43 HE1 TYR 43 -0.179 3.907 7.070
279 HE2 TYR 43 HE2 TYR 43 -3.153 0.848 7.047
280 HH TYR 43 HH TYR 43 -1.754 2.684 9.089
281 H SER 44 HN SER 44 -1.185 1.668 0.476
282 HA SER 44 HA SER 44 0.817 0.206 -1.110
283 1HB SER 44 HB2 SER 44 -2.035 -0.477 -0.566
284 2HB SER 44 HB1 SER 44 -1.392 -0.825 -2.171
285 HG SER 44 HG SER 44 -1.040 -2.191 0.091
286 H TYR 45 HN TYR 45 0.746 2.878 -1.364
287 HA TYR 45 HA TYR 45 -1.073 3.598 -3.505
288 1HB TYR 45 HB2 TYR 45 -0.588 5.792 -3.042
289 2HB TYR 45 HB1 TYR 45 -0.223 5.070 -1.484
290 HD1 TYR 45 HD1 TYR 45 2.435 3.811 -2.381
291 HD2 TYR 45 HD2 TYR 45 0.804 7.713 -2.798
292 HE1 TYR 45 HE1 TYR 45 4.701 4.735 -2.491
293 HE2 TYR 45 HE2 TYR 45 3.070 8.658 -2.900
294 HH TYR 45 HH TYR 45 5.343 8.077 -2.227
295 H GLY 46 HN GLY 46 0.975 1.555 -4.012
296 1HA GLY 46 HA1 GLY 46 2.022 2.726 -6.456
297 2HA GLY 46 HA2 GLY 46 2.029 1.022 -6.031
298 H GLN 47 HN GLN 47 3.458 0.586 -3.996
299 HA GLN 47 HA GLN 47 5.904 2.199 -4.138
300 1HB GLN 47 HB2 GLN 47 5.002 0.178 -2.078
301 2HB GLN 47 HB1 GLN 47 6.523 1.057 -2.022
302 1HG GLN 47 HG2 GLN 47 4.246 2.824 -2.322
303 2HG GLN 47 HG1 GLN 47 4.135 1.822 -0.876
304 1HE2 GLN 47 1HE2 GLN 47 4.703 3.076 0.760
305 2HE2 GLN 47 2HE2 GLN 47 6.133 4.042 0.843
306 H ASN 48 HN ASN 48 7.859 0.570 -3.403
307 HA ASN 48 HA ASN 48 8.148 -1.166 -5.697
308 1HB ASN 48 HB2 ASN 48 10.112 -0.646 -3.457
309 2HB ASN 48 HB1 ASN 48 10.467 -1.366 -5.024
310 1HD2 ASN 48 1HD2 ASN 48 12.004 0.642 -4.438
311 2HD2 ASN 48 2HD2 ASN 48 11.556 2.089 -5.269
312 H GLN 49 HN GLN 49 8.824 -3.378 -5.561
313 HA GLN 49 HA GLN 49 7.487 -4.789 -3.401
314 1HB GLN 49 HB2 GLN 49 6.820 -5.851 -5.294
315 2HB GLN 49 HB1 GLN 49 8.260 -5.394 -6.193
316 1HG GLN 49 HG2 GLN 49 8.327 -7.533 -4.091
317 2HG GLN 49 HG1 GLN 49 7.826 -7.870 -5.744
318 1HE2 GLN 49 1HE2 GLN 49 9.437 -6.694 -7.359
319 2HE2 GLN 49 2HE2 GLN 49 11.097 -7.085 -7.081
320 H GLY 50 HN GLY 50 10.359 -3.449 -3.539
321 1HA GLY 50 HA1 GLY 50 12.338 -3.777 -2.437
322 2HA GLY 50 HA2 GLY 50 12.290 -5.404 -3.100
323 H ASN 51 HN ASN 51 9.617 -4.567 -1.141
324 HA ASN 51 HA ASN 51 8.844 -5.688 0.714
325 1HB ASN 51 HB2 ASN 51 10.760 -7.402 0.092
326 2HB ASN 51 HB1 ASN 51 11.552 -6.679 1.489
327 1HD2 ASN 51 1HD2 ASN 51 11.419 -8.675 2.567
328 2HD2 ASN 51 2HD2 ASN 51 9.936 -9.219 3.269
329 H GLU 52 HN GLU 52 9.375 -3.065 0.724
330 HA GLU 52 HA GLU 52 11.096 -2.325 2.908
331 1HB GLU 52 HB2 GLU 52 8.998 -0.619 1.567
332 2HB GLU 52 HB1 GLU 52 10.396 -0.071 2.482
333 1HG GLU 52 HG2 GLU 52 11.856 -1.059 0.739
334 2HG GLU 52 HG1 GLU 52 10.412 -1.442 -0.196
335 H SER 53 HN SER 53 7.757 -3.131 2.463
336 HA SER 53 HA SER 53 7.335 -3.112 5.321
337 1HB SER 53 HB2 SER 53 6.752 -0.770 4.342
338 2HB SER 53 HB1 SER 53 5.331 -1.580 3.684
339 HG SER 53 HG SER 53 5.354 -0.562 5.956
340 H CYS 54 HN CYS 54 4.603 -3.430 5.380
341 HA CYS 54 HA CYS 54 3.861 -5.439 3.428
342 1HB CYS 54 HB2 CYS 54 4.020 -7.290 4.721
343 2HB CYS 54 HB1 CYS 54 5.169 -6.339 5.650
344 H THR 55 HN THR 55 1.591 -6.297 3.950
345 HA THR 55 HA THR 55 -0.047 -3.996 4.654
346 HB THR 55 HB THR 55 -0.770 -6.678 3.453
347 HG1 THR 55 HG1 THR 55 -0.805 -5.632 1.576
348 1HG2 THR 55 2HG2 THR 55 -2.509 -4.315 4.091
349 2HG2 THR 55 1HG2 THR 55 -2.942 -5.533 2.886
350 3HG2 THR 55 3HG2 THR 55 -2.726 -5.996 4.576
351 H GLY 56 HN GLY 56 -1.996 -4.358 6.012
352 1HA GLY 56 HA1 GLY 56 -2.048 -6.589 7.798
353 2HA GLY 56 HA2 GLY 56 -3.039 -5.142 7.911
354 H ASN 57 HN ASN 57 -0.300 -3.661 7.765
355 HA ASN 57 HA ASN 57 0.875 -4.276 10.318
356 1HB ASN 57 HB2 ASN 57 1.426 -2.384 8.096
357 2HB ASN 57 HB1 ASN 57 1.991 -1.911 9.695
358 1HD2 ASN 57 1HD2 ASN 57 3.015 -3.221 6.977
359 2HD2 ASN 57 2HD2 ASN 57 4.212 -4.319 7.564
360 H GLY 58 HN GLY 58 -1.964 -2.853 9.578
361 1HA GLY 58 HA1 GLY 58 -3.074 -0.941 10.439
362 2HA GLY 58 HA2 GLY 58 -1.742 -0.703 11.559
363 H SER 59 HN SER 59 -2.363 -3.926 11.699
364 HA SER 59 HA SER 59 -3.705 -3.657 14.222
365 1HB SER 59 HB2 SER 59 -5.146 -5.145 12.019
366 2HB SER 59 HB1 SER 59 -5.690 -4.940 13.684
367 HG SER 59 HG SER 59 -6.382 -3.429 11.787
368 H TYR 60 HN TYR 60 -3.396 -6.208 11.742
369 HA TYR 60 HA TYR 60 -2.387 -8.021 13.796
370 1HB TYR 60 HB2 TYR 60 -2.609 -9.129 11.102
371 2HB TYR 60 HB1 TYR 60 -3.320 -9.689 12.609
372 HD1 TYR 60 HD1 TYR 60 -3.808 -7.568 9.658
373 HD2 TYR 60 HD2 TYR 60 -5.569 -9.058 13.232
374 HE1 TYR 60 HE1 TYR 60 -6.014 -6.822 8.874
375 HE2 TYR 60 HE2 TYR 60 -7.781 -8.312 12.459
376 HH TYR 60 HH TYR 60 -8.431 -7.446 9.302
377 HA PRO 61 HA PRO 61 1.736 -8.170 12.157
378 1HB PRO 61 HB2 PRO 61 2.458 -10.725 12.199
379 2HB PRO 61 HB1 PRO 61 1.955 -9.918 13.690
380 1HG PRO 61 HG2 PRO 61 0.398 -11.769 11.920
381 2HG PRO 61 HG1 PRO 61 0.481 -11.721 13.692
382 1HD PRO 61 HD2 PRO 61 -1.533 -10.592 12.168
383 2HD PRO 61 HD1 PRO 61 -1.135 -10.116 13.830
384 H CYS 62 HN CYS 62 3.279 -9.206 10.520
385 HA CYS 62 HA CYS 62 2.040 -9.123 7.926
386 1HB CYS 62 HB2 CYS 62 4.907 -9.616 8.763
387 2HB CYS 62 HB1 CYS 62 4.374 -9.463 7.093
388 H CYS 63 HN CYS 63 2.152 -10.806 6.339
389 HA CYS 63 HA CYS 63 1.903 -13.448 7.537
390 1HB CYS 63 HB2 CYS 63 0.577 -12.088 5.440
391 2HB CYS 63 HB1 CYS 63 1.407 -13.458 4.712
392 H ASN 64 HN ASN 64 3.419 -12.093 4.639
393 HA ASN 64 HA ASN 64 5.651 -12.361 3.977
394 1HB ASN 64 HB2 ASN 64 6.351 -13.381 6.098
395 2HB ASN 64 HB1 ASN 64 5.622 -14.908 5.613
396 1HD2 ASN 64 1HD2 ASN 64 6.627 -16.199 4.146
397 2HD2 ASN 64 2HD2 ASN 64 8.250 -15.936 3.612
398 H THR 65 HN THR 65 2.887 -13.992 3.419
399 HA THR 65 HA THR 65 4.059 -15.620 1.269
400 HB THR 65 HB THR 65 2.661 -16.785 2.997
401 HG1 THR 65 HG1 THR 65 1.664 -16.798 0.342
402 1HG2 THR 65 2HG2 THR 65 0.972 -15.079 3.385
403 2HG2 THR 65 1HG2 THR 65 0.390 -15.274 1.732
404 3HG2 THR 65 3HG2 THR 65 0.246 -16.605 2.880
405 H CYS 66 HN CYS 66 3.392 -15.338 -0.834
406 HA CYS 66 HA CYS 66 1.967 -12.849 -1.362
407 1HB CYS 66 HB2 CYS 66 3.199 -14.651 -3.443
408 2HB CYS 66 HB1 CYS 66 2.861 -12.926 -3.554
409 H GLN 67 HN GLN 67 0.366 -14.812 -0.314
410 HA GLN 67 HA GLN 67 -1.367 -15.462 -2.597
411 1HB GLN 67 HB2 GLN 67 -0.754 -17.603 -2.021
412 2HB GLN 67 HB1 GLN 67 -0.416 -17.175 -0.354
413 1HG GLN 67 HG2 GLN 67 -3.239 -16.958 -0.921
414 2HG GLN 67 HG1 GLN 67 -2.622 -18.553 -1.337
415 1HE2 GLN 67 1HE2 GLN 67 -1.410 -16.442 1.206
416 2HE2 GLN 67 2HE2 GLN 67 -1.840 -17.477 2.521
417 H ALA 68 HN ALA 68 -2.569 -13.603 -2.301
418 HA ALA 68 HA ALA 68 -3.698 -13.004 0.283
419 1HB ALA 68 HB3 ALA 68 -3.364 -11.599 -2.248
420 2HB ALA 68 HB2 ALA 68 -4.897 -11.275 -1.437
421 3HB ALA 68 HB1 ALA 68 -3.374 -10.991 -0.593
422 H THR 69 HN THR 69 -5.033 -14.680 0.702
423 HA THR 69 HA THR 69 -6.974 -15.742 -1.022
424 HB THR 69 HB THR 69 -6.651 -17.162 0.735
425 HG1 THR 69 HG1 THR 69 -8.733 -17.161 1.075
426 1HG2 THR 69 1HG2 THR 69 -6.363 -14.740 2.471
427 2HG2 THR 69 3HG2 THR 69 -6.541 -16.364 3.142
428 3HG2 THR 69 2HG2 THR 69 -5.169 -15.984 2.096
429 H TYR 70 HN TYR 70 -6.900 -12.794 0.783
430 HA TYR 70 HA TYR 70 -9.497 -12.102 -0.277
431 1HB TYR 70 HB2 TYR 70 -10.705 -12.003 1.646
432 2HB TYR 70 HB1 TYR 70 -9.583 -13.265 2.132
433 HD1 TYR 70 HD1 TYR 70 -8.519 -13.060 4.165
434 HD2 TYR 70 HD2 TYR 70 -9.895 -9.533 2.220
435 HE1 TYR 70 HE1 TYR 70 -7.865 -11.729 6.126
436 HE2 TYR 70 HE2 TYR 70 -9.245 -8.195 4.175
437 HH TYR 70 HH TYR 70 -7.205 -9.212 6.506
438 H THR 71 HN THR 71 -9.761 -9.949 -0.596
439 HA THR 71 HA THR 71 -7.590 -8.191 0.344
440 HB THR 71 HB THR 71 -9.121 -8.055 -2.260
441 HG1 THR 71 HG1 THR 71 -7.281 -8.722 -3.181
442 1HG2 THR 71 3HG2 THR 71 -8.396 -5.837 -1.138
443 2HG2 THR 71 2HG2 THR 71 -6.770 -6.337 -1.613
444 3HG2 THR 71 1HG2 THR 71 -8.019 -6.119 -2.840
445 H ASP 72 HN ASP 72 -8.148 -6.289 1.282
446 HA ASP 72 HA ASP 72 -11.023 -5.691 1.438
447 1HB ASP 72 HB2 ASP 72 -9.213 -6.310 3.545
448 2HB ASP 72 HB1 ASP 72 -9.660 -4.615 3.708
449 H GLY 73 HN GLY 73 -10.877 -3.297 2.799
450 1HA GLY 73 HA1 GLY 73 -10.793 -1.060 2.281
451 2HA GLY 73 HA2 GLY 73 -10.248 -1.511 0.674
452 H ASP 74 HN ASP 74 -8.138 -2.987 2.753
453 HA ASP 74 HA ASP 74 -6.353 -0.640 2.743
454 1HB ASP 74 HB2 ASP 74 -7.092 -2.419 4.872
455 2HB ASP 74 HB1 ASP 74 -5.364 -2.568 4.566
456 H GLY 75 HN GLY 75 -6.916 -3.247 0.982
457 1HA GLY 75 HA1 GLY 75 -4.055 -3.893 0.644
458 2HA GLY 75 HA2 GLY 75 -5.134 -3.632 -0.720
459 H ASP 76 HN ASP 76 -3.551 -5.976 -0.144
460 HA ASP 76 HA ASP 76 -5.702 -7.933 -0.277
461 1HB ASP 76 HB2 ASP 76 -2.900 -8.865 -0.466
462 2HB ASP 76 HB1 ASP 76 -4.286 -9.237 -1.484
463 H TRP 77 HN TRP 77 -5.278 -10.089 0.845
464 HA TRP 77 HA TRP 77 -3.840 -9.902 3.350
465 1HB TRP 77 HB2 TRP 77 -6.826 -10.349 3.366
466 2HB TRP 77 HB1 TRP 77 -5.761 -10.316 4.768
467 HD1 TRP 77 HD1 TRP 77 -7.358 -7.965 2.176
468 HE1 TRP 77 HE1 TRP 77 -7.294 -5.573 3.105
469 HE3 TRP 77 HE3 TRP 77 -4.546 -8.801 6.356
470 HZ2 TRP 77 HZ2 TRP 77 -6.202 -4.219 5.314
471 HZ3 TRP 77 HZ3 TRP 77 -4.038 -6.900 7.827
472 HH2 TRP 77 HH2 TRP 77 -4.847 -4.653 7.315
473 H ALA 78 HN ALA 78 -3.556 -11.865 4.416
474 HA ALA 78 HA ALA 78 -4.569 -14.272 3.118
475 1HB ALA 78 HB1 ALA 78 -1.645 -13.674 3.530
476 2HB ALA 78 HB3 ALA 78 -2.287 -15.269 3.137
477 3HB ALA 78 HB2 ALA 78 -2.484 -13.937 2.002
478 H PHE 79 HN PHE 79 -3.874 -16.263 4.418
479 HA PHE 79 HA PHE 79 -3.761 -15.616 7.287
480 1HB PHE 79 HB2 PHE 79 -6.070 -16.221 6.618
481 2HB PHE 79 HB1 PHE 79 -5.474 -17.768 6.026
482 HD1 PHE 79 HD1 PHE 79 -5.457 -15.691 9.123
483 HD2 PHE 79 HD2 PHE 79 -5.585 -19.589 7.420
484 HE1 PHE 79 HE1 PHE 79 -5.757 -16.657 11.366
485 HE2 PHE 79 HE2 PHE 79 -5.886 -20.562 9.659
486 HZ PHE 79 HZ PHE 79 -5.972 -19.095 11.636
487 H GLU 80 HN GLU 80 -1.796 -16.288 7.886
488 HA GLU 80 HA GLU 80 -1.082 -19.071 7.307
489 1HB GLU 80 HB2 GLU 80 1.041 -18.597 6.545
490 2HB GLU 80 HB1 GLU 80 0.128 -17.262 5.862
491 1HG GLU 80 HG2 GLU 80 1.923 -16.137 6.687
492 2HG GLU 80 HG1 GLU 80 0.849 -16.060 8.085
493 H ASN 81 HN ASN 81 0.437 -20.002 8.829
494 HA ASN 81 HA ASN 81 1.062 -20.505 10.959
495 1HB ASN 81 HB2 ASN 81 1.659 -17.628 10.640
496 2HB ASN 81 HB1 ASN 81 1.581 -18.202 12.303
497 1HD2 ASN 81 1HD2 ASN 81 3.859 -17.255 10.748
498 2HD2 ASN 81 2HD2 ASN 81 5.016 -18.538 10.766
499 H GLY 82 HN GLY 82 -1.799 -19.795 10.300
500 1HA GLY 82 HA1 GLY 82 -2.855 -20.130 12.908
501 2HA GLY 82 HA2 GLY 82 -3.784 -19.826 11.448
502 H ASN 83 HN ASN 83 -2.600 -17.313 10.769
503 HA ASN 83 HA ASN 83 -4.038 -15.658 12.672
504 1HB ASN 83 HB2 ASN 83 -2.039 -14.052 12.768
505 2HB ASN 83 HB1 ASN 83 -1.954 -15.509 13.754
506 1HD2 ASN 83 1HD2 ASN 83 -0.838 -13.978 10.814
507 2HD2 ASN 83 2HD2 ASN 83 0.572 -14.956 10.612
508 H TRP 84 HN TRP 84 -4.921 -13.871 11.767
509 HA TRP 84 HA TRP 84 -4.908 -13.674 8.909
510 1HB TRP 84 HB2 TRP 84 -6.232 -12.087 11.103
511 2HB TRP 84 HB1 TRP 84 -6.355 -11.609 9.413
512 HD1 TRP 84 HD1 TRP 84 -8.128 -13.592 11.913
513 HE1 TRP 84 HE1 TRP 84 -9.827 -15.179 10.809
514 HE3 TRP 84 HE3 TRP 84 -6.492 -13.300 7.077
515 HZ2 TRP 84 HZ2 TRP 84 -10.399 -16.175 8.231
516 HZ3 TRP 84 HZ3 TRP 84 -7.670 -14.601 5.353
517 HH2 TRP 84 HH2 TRP 84 -9.583 -16.009 5.920
518 H CYS 85 HN CYS 85 -2.956 -13.059 8.141
519 HA CYS 85 HA CYS 85 -1.832 -10.525 9.117
520 1HB CYS 85 HB2 CYS 85 0.070 -11.599 7.425
521 2HB CYS 85 HB1 CYS 85 0.078 -11.706 9.179
522 H GLY 86 HN GLY 86 -0.556 -9.351 7.291
523 1HA GLY 86 HA1 GLY 86 -1.441 -7.799 5.649
524 2HA GLY 86 HA2 GLY 86 -2.413 -9.114 5.009
525 H ILE 87 HN ILE 87 -1.672 -9.103 2.928
526 HA ILE 87 HA ILE 87 0.629 -10.541 2.304
527 HB ILE 87 HB ILE 87 -1.456 -9.150 0.826
528 1HG1 ILE 87 2HG1 ILE 87 -1.395 -11.081 -0.545
529 2HG1 ILE 87 1HG1 ILE 87 0.263 -11.447 -0.090
530 1HG2 ILE 87 1HG2 ILE 87 0.392 -7.814 -0.040
531 2HG2 ILE 87 3HG2 ILE 87 1.256 -9.290 -0.477
532 3HG2 ILE 87 2HG2 ILE 87 -0.262 -8.886 -1.277
533 1HD1 ILE 87 3HD1 ILE 87 -0.967 -11.587 2.311
534 2HD1 ILE 87 2HD1 ILE 87 -2.256 -12.110 1.232
535 3HD1 ILE 87 1HD1 ILE 87 -0.707 -12.955 1.230
536 H LYS 88 HN LYS 88 2.688 -10.053 1.895
537 HA LYS 88 HA LYS 88 3.829 -7.693 2.866
538 1HB LYS 88 HB2 LYS 88 4.999 -9.711 0.949
539 2HB LYS 88 HB1 LYS 88 5.916 -8.501 1.838
540 1HG LYS 88 HG2 LYS 88 4.287 -10.697 3.099
541 2HG LYS 88 HG1 LYS 88 6.034 -10.740 2.852
542 1HD LYS 88 HD2 LYS 88 5.810 -8.388 4.135
543 2HD LYS 88 HD1 LYS 88 4.427 -9.239 4.826
544 1HE LYS 88 HE2 LYS 88 6.434 -9.554 6.183
545 2HE LYS 88 HE1 LYS 88 5.879 -11.079 5.494
546 1HZ LYS 88 HZ1 LYS 88 7.940 -9.490 4.112
547 2HZ LYS 88 HZ3 LYS 88 8.368 -10.499 5.401
548 3HZ LYS 88 HZ2 LYS 88 7.638 -11.151 4.023
549 H ASN 89 HN ASN 89 4.909 -5.999 1.834
550 HA ASN 89 HA ASN 89 3.546 -4.839 -0.347
551 1HB ASN 89 HB2 ASN 89 4.753 -3.574 1.431
552 2HB ASN 89 HB1 ASN 89 6.277 -4.128 0.748
553 1HD2 ASN 89 1HD2 ASN 89 6.339 -1.639 0.843
554 2HD2 ASN 89 2HD2 ASN 89 5.916 -0.839 -0.630
555 H SER 90 HN SER 90 6.001 -7.171 -0.198
556 HA SER 90 HA SER 90 7.139 -6.595 -2.801
557 1HB SER 90 HB2 SER 90 8.728 -7.405 -1.255
558 2HB SER 90 HB1 SER 90 7.639 -8.663 -0.670
559 HG SER 90 HG SER 90 9.240 -9.519 -2.052
560 H CYS 91 HN CYS 91 4.707 -8.576 -1.375
561 HA CYS 91 HA CYS 91 4.509 -10.354 -3.660
562 1HB CYS 91 HB2 CYS 91 2.929 -10.187 -1.090
563 2HB CYS 91 HB1 CYS 91 2.682 -11.405 -2.334
564 H LYS 92 HN LYS 92 4.083 -8.047 -4.753
565 HA LYS 92 HA LYS 92 1.188 -7.973 -5.191
566 1HB LYS 92 HB2 LYS 92 1.515 -5.403 -5.454
567 2HB LYS 92 HB1 LYS 92 1.303 -6.095 -3.852
568 1HG LYS 92 HG2 LYS 92 3.247 -5.280 -3.188
569 2HG LYS 92 HG1 LYS 92 4.086 -6.066 -4.526
570 1HD LYS 92 HD2 LYS 92 4.541 -3.943 -5.139
571 2HD LYS 92 HD1 LYS 92 2.917 -4.010 -5.827
572 1HE LYS 92 HE2 LYS 92 2.514 -3.335 -3.164
573 2HE LYS 92 HE1 LYS 92 3.941 -2.412 -3.638
574 1HZ LYS 92 HZ2 LYS 92 2.464 -1.874 -5.707
575 2HZ LYS 92 HZ1 LYS 92 1.195 -2.238 -4.649
576 3HZ LYS 92 HZ3 LYS 92 2.284 -1.000 -4.270
577 H GLN 93 HN GLN 93 4.349 -6.858 -6.321
578 HA GLN 93 HA GLN 93 3.713 -7.679 -9.012
579 1HB GLN 93 HB2 GLN 93 4.249 -4.768 -8.395
580 2HB GLN 93 HB1 GLN 93 4.198 -5.462 -10.009
581 1HG GLN 93 HG2 GLN 93 1.824 -6.206 -9.403
582 2HG GLN 93 HG1 GLN 93 1.956 -5.064 -8.066
583 1HE2 GLN 93 1HE2 GLN 93 0.182 -3.956 -9.068
584 2HE2 GLN 93 2HE2 GLN 93 0.472 -2.874 -10.384
585 H GLN 94 HN GLN 94 5.490 -8.507 -9.904
586 HA GLN 94 HA GLN 94 7.974 -8.413 -8.551
587 1HB GLN 94 HB2 GLN 94 7.891 -9.287 -11.391
588 2HB GLN 94 HB1 GLN 94 8.726 -10.003 -10.025
589 1HG GLN 94 HG2 GLN 94 6.451 -10.708 -9.174
590 2HG GLN 94 HG1 GLN 94 5.826 -10.243 -10.756
591 1HE2 GLN 94 1HE2 GLN 94 6.654 -11.345 -12.618
592 2HE2 GLN 94 2HE2 GLN 94 7.240 -12.964 -12.475
593 HA PRO 95 HA PRO 95 9.474 -5.676 -12.239
594 1HB PRO 95 HB2 PRO 95 7.580 -4.593 -13.836
595 2HB PRO 95 HB1 PRO 95 8.267 -6.196 -14.139
596 1HG PRO 95 HG2 PRO 95 5.714 -5.483 -12.722
597 2HG PRO 95 HG1 PRO 95 5.966 -6.672 -14.015
598 1HD PRO 95 HD2 PRO 95 5.830 -7.410 -11.463
599 2HD PRO 95 HD1 PRO 95 6.969 -8.189 -12.580
600 H GLN 96 HN GLN 96 8.958 -4.847 -9.700
601 HA GLN 96 HA GLN 96 7.289 -2.584 -9.471
602 1HB GLN 96 HB2 GLN 96 8.776 -2.078 -7.459
603 2HB GLN 96 HB1 GLN 96 7.918 -3.613 -7.451
604 1HG GLN 96 HG2 GLN 96 9.810 -4.751 -7.303
605 2HG GLN 96 HG1 GLN 96 10.497 -3.905 -8.688
606 1HE2 GLN 96 1HE2 GLN 96 11.410 -1.752 -8.251
607 2HE2 GLN 96 2HE2 GLN 96 12.210 -1.492 -6.741
608 H ASN 97 HN ASN 97 7.631 -1.153 -11.144
609 HA ASN 97 HA ASN 97 8.481 0.710 -12.110
610 1HB ASN 97 HB2 ASN 97 9.680 2.138 -10.822
611 2HB ASN 97 HB1 ASN 97 9.338 0.962 -9.562
612 1HD2 ASN 97 1HD2 ASN 97 11.729 1.771 -12.042
613 2HD2 ASN 97 2HD2 ASN 97 13.104 1.248 -11.135
614 H ASN 98 HN ASN 98 11.198 -1.414 -11.143
615 HA ASN 98 HA ASN 98 12.874 -0.842 -13.283
616 1HB ASN 98 HB2 ASN 98 12.555 -3.248 -11.515
617 2HB ASN 98 HB1 ASN 98 13.705 -3.271 -12.848
618 1HD2 ASN 98 1HD2 ASN 98 14.676 -3.611 -10.391
619 2HD2 ASN 98 2HD2 ASN 98 15.525 -2.205 -9.855
620 H ASN 99 HN ASN 99 12.154 -0.835 -15.329
621 HA ASN 99 HA ASN 99 10.585 -3.125 -16.283
622 1HB ASN 99 HB2 ASN 99 11.074 -0.518 -17.729
623 2HB ASN 99 HB1 ASN 99 9.863 -1.742 -18.102
624 1HD2 ASN 99 1HD2 ASN 99 10.461 1.144 -16.546
625 2HD2 ASN 99 2HD2 ASN 99 9.031 1.226 -15.579
626 H GLN 100 HN GLN 100 11.903 -4.703 -16.960
627 HA GLN 100 HA GLN 100 14.504 -4.375 -17.943
628 1HB GLN 100 HB2 GLN 100 12.508 -6.586 -17.940
629 2HB GLN 100 HB1 GLN 100 13.890 -6.734 -19.017
630 1HG GLN 100 HG2 GLN 100 14.536 -7.826 -17.063
631 2HG GLN 100 HG1 GLN 100 15.328 -6.254 -16.976
632 1HE2 GLN 100 1HE2 GLN 100 12.082 -7.461 -16.193
633 2HE2 GLN 100 2HE2 GLN 100 12.052 -6.836 -14.583
No H/Q in entry = 633
Start of MODEL 2
1 H1 ALA 1 HT1 ALA 1 6.180 5.194 -7.013
2 H2 ALA 1 HT3 ALA 1 7.006 3.958 -6.160
3 H3 ALA 1 HT2 ALA 1 5.295 3.917 -6.284
4 HA ALA 1 HA ALA 1 5.656 4.669 -4.185
5 1HB ALA 1 HB1 ALA 1 7.914 6.223 -5.406
6 2HB ALA 1 HB3 ALA 1 7.280 6.605 -3.805
7 3HB ALA 1 HB2 ALA 1 7.970 5.013 -4.124
8 H MET 2 HN MET 2 3.784 5.322 -6.156
9 HA MET 2 HA MET 2 2.715 7.719 -5.084
10 1HB MET 2 HB2 MET 2 4.569 8.296 -6.956
11 2HB MET 2 HB1 MET 2 3.148 8.133 -7.980
12 1HG MET 2 HG2 MET 2 2.234 9.679 -5.907
13 2HG MET 2 HG1 MET 2 3.888 10.246 -6.126
14 1HE MET 2 HE3 MET 2 1.243 11.563 -6.214
15 2HE MET 2 HE2 MET 2 1.633 12.825 -7.383
16 3HE MET 2 HE1 MET 2 0.364 11.654 -7.741
17 H ALA 3 HN ALA 3 0.912 6.424 -4.775
18 HA ALA 3 HA ALA 3 -0.885 6.292 -7.025
19 1HB ALA 3 HB3 ALA 3 -0.747 3.683 -5.670
20 2HB ALA 3 HB1 ALA 3 0.623 4.073 -6.712
21 3HB ALA 3 HB2 ALA 3 -1.014 4.072 -7.371
22 H CYS 4 HN CYS 4 -0.720 7.629 -4.466
23 HA CYS 4 HA CYS 4 -2.369 6.464 -2.523
24 1HB CYS 4 HB2 CYS 4 -2.668 8.838 -1.724
25 2HB CYS 4 HB1 CYS 4 -0.997 8.314 -1.898
26 H TRP 5 HN TRP 5 -4.538 6.925 -1.951
27 HA TRP 5 HA TRP 5 -6.270 7.205 -4.264
28 1HB TRP 5 HB2 TRP 5 -8.078 6.692 -2.543
29 2HB TRP 5 HB1 TRP 5 -6.887 5.425 -2.822
30 HD1 TRP 5 HD1 TRP 5 -5.428 4.680 -0.792
31 HE1 TRP 5 HE1 TRP 5 -5.387 5.293 1.707
32 HE3 TRP 5 HE3 TRP 5 -8.473 8.743 -0.939
33 HZ2 TRP 5 HZ2 TRP 5 -6.513 7.265 3.395
34 HZ3 TRP 5 HZ3 TRP 5 -8.955 9.952 1.151
35 HH2 TRP 5 HH2 TRP 5 -7.993 9.225 3.275
36 H ALA 6 HN ALA 6 -5.155 9.088 -1.605
37 HA ALA 6 HA ALA 6 -7.282 10.924 -1.379
38 1HB ALA 6 HB3 ALA 6 -4.487 11.817 -0.895
39 2HB ALA 6 HB2 ALA 6 -5.941 12.076 0.070
40 3HB ALA 6 HB1 ALA 6 -5.133 10.508 0.096
41 H GLN 7 HN GLN 7 -4.589 10.671 -3.595
42 HA GLN 7 HA GLN 7 -4.609 13.291 -4.605
43 1HB GLN 7 HB2 GLN 7 -3.472 12.339 -6.578
44 2HB GLN 7 HB1 GLN 7 -2.766 11.785 -5.067
45 1HG GLN 7 HG2 GLN 7 -2.961 9.715 -5.820
46 2HG GLN 7 HG1 GLN 7 -4.710 9.894 -5.684
47 1HE2 GLN 7 1HE2 GLN 7 -1.971 10.032 -7.835
48 2HE2 GLN 7 2HE2 GLN 7 -2.869 9.940 -9.307
49 H SER 8 HN SER 8 -6.617 10.515 -5.265
50 HA SER 8 HA SER 8 -7.752 11.255 -7.695
51 1HB SER 8 HB2 SER 8 -9.035 9.813 -5.361
52 2HB SER 8 HB1 SER 8 -9.705 9.885 -6.991
53 HG SER 8 HG SER 8 -7.497 8.479 -6.026
54 H GLN 9 HN GLN 9 -8.211 12.546 -4.515
55 HA GLN 9 HA GLN 9 -10.559 14.074 -5.339
56 1HB GLN 9 HB2 GLN 9 -9.203 13.632 -2.687
57 2HB GLN 9 HB1 GLN 9 -10.433 14.870 -2.903
58 1HG GLN 9 HG2 GLN 9 -11.827 12.879 -3.875
59 2HG GLN 9 HG1 GLN 9 -10.696 11.908 -2.934
60 1HE2 GLN 9 1HE2 GLN 9 -10.782 11.958 -0.718
61 2HE2 GLN 9 2HE2 GLN 9 -12.071 12.703 0.159
62 H GLY 10 HN GLY 10 -7.152 14.435 -4.704
63 1HA GLY 10 HA1 GLY 10 -7.387 17.360 -4.876
64 2HA GLY 10 HA2 GLY 10 -6.425 16.518 -6.080
65 H TYR 11 HN TYR 11 -6.472 15.315 -2.826
66 HA TYR 11 HA TYR 11 -4.320 16.821 -1.789
67 1HB TYR 11 HB2 TYR 11 -5.713 14.296 -1.038
68 2HB TYR 11 HB1 TYR 11 -4.138 14.602 -0.316
69 HD1 TYR 11 HD1 TYR 11 -7.644 15.500 -0.347
70 HD2 TYR 11 HD2 TYR 11 -3.804 16.631 1.098
71 HE1 TYR 11 HE1 TYR 11 -8.707 16.955 1.325
72 HE2 TYR 11 HE2 TYR 11 -4.858 18.088 2.774
73 HH TYR 11 HH TYR 11 -7.090 19.316 3.004
74 H ASN 12 HN ASN 12 -2.402 15.170 -0.867
75 HA ASN 12 HA ASN 12 -1.223 13.969 -3.286
76 1HB ASN 12 HB2 ASN 12 0.254 15.535 -1.158
77 2HB ASN 12 HB1 ASN 12 0.966 14.803 -2.592
78 1HD2 ASN 12 1HD2 ASN 12 1.176 17.515 -1.918
79 2HD2 ASN 12 2HD2 ASN 12 0.361 18.438 -3.130
80 H CYS 13 HN CYS 13 0.456 12.342 -2.840
81 HA CYS 13 HA CYS 13 -0.435 10.478 -0.885
82 1HB CYS 13 HB2 CYS 13 2.202 10.317 -2.327
83 2HB CYS 13 HB1 CYS 13 1.177 9.001 -1.768
84 H CYS 14 HN CYS 14 0.537 9.795 1.005
85 HA CYS 14 HA CYS 14 2.440 11.696 2.168
86 1HB CYS 14 HB2 CYS 14 0.113 10.487 3.170
87 2HB CYS 14 HB1 CYS 14 1.441 9.709 4.022
88 H ASN 15 HN ASN 15 4.432 11.038 1.540
89 HA ASN 15 HA ASN 15 5.484 8.629 0.982
90 1HB ASN 15 HB2 ASN 15 6.769 10.715 0.909
91 2HB ASN 15 HB1 ASN 15 6.822 10.756 2.668
92 1HD2 ASN 15 1HD2 ASN 15 8.899 10.498 3.109
93 2HD2 ASN 15 2HD2 ASN 15 9.878 9.176 2.578
94 H ASN 16 HN ASN 16 6.435 6.894 2.067
95 HA ASN 16 HA ASN 16 6.321 5.213 3.608
96 1HB ASN 16 HB2 ASN 16 7.449 5.692 5.683
97 2HB ASN 16 HB1 ASN 16 8.237 6.591 4.392
98 1HD2 ASN 16 1HD2 ASN 16 7.785 8.855 4.222
99 2HD2 ASN 16 2HD2 ASN 16 7.352 9.756 5.629
100 HA PRO 17 HA PRO 17 2.143 6.744 5.248
101 1HB PRO 17 HB2 PRO 17 0.710 4.777 3.971
102 2HB PRO 17 HB1 PRO 17 0.972 6.397 3.318
103 1HG PRO 17 HG2 PRO 17 2.415 3.850 2.706
104 2HG PRO 17 HG1 PRO 17 1.889 5.134 1.601
105 1HD PRO 17 HD2 PRO 17 4.444 4.923 2.405
106 2HD PRO 17 HD1 PRO 17 3.678 6.504 2.141
107 H SER 18 HN SER 18 4.008 3.857 5.145
108 HA SER 18 HA SER 18 2.365 2.277 6.863
109 1HB SER 18 HB2 SER 18 5.285 1.751 6.748
110 2HB SER 18 HB1 SER 18 3.929 0.636 6.581
111 HG SER 18 HG SER 18 3.593 1.754 4.482
112 H SER 19 HN SER 19 4.204 5.007 7.446
113 HA SER 19 HA SER 19 4.234 4.419 10.314
114 1HB SER 19 HB2 SER 19 6.537 4.073 9.264
115 2HB SER 19 HB1 SER 19 6.555 5.814 8.981
116 HG SER 19 HG SER 19 6.775 6.171 11.071
117 H THR 20 HN THR 20 2.858 6.208 8.123
118 HA THR 20 HA THR 20 3.375 8.871 8.995
119 HB THR 20 HB THR 20 1.343 7.555 7.211
120 HG1 THR 20 HG1 THR 20 2.411 8.763 5.650
121 1HG2 THR 20 2HG2 THR 20 1.451 10.477 7.875
122 2HG2 THR 20 1HG2 THR 20 0.499 9.739 6.587
123 3HG2 THR 20 3HG2 THR 20 0.148 9.358 8.271
124 H LYS 21 HN LYS 21 2.112 10.169 10.309
125 HA LYS 21 HA LYS 21 0.451 8.744 12.225
126 1HB LYS 21 HB2 LYS 21 2.107 10.299 13.101
127 2HB LYS 21 HB1 LYS 21 1.416 11.610 12.154
128 1HG LYS 21 HG2 LYS 21 0.588 11.967 14.294
129 2HG LYS 21 HG1 LYS 21 -0.742 11.161 13.461
130 1HD LYS 21 HD2 LYS 21 -0.600 9.317 14.750
131 2HD LYS 21 HD1 LYS 21 1.164 9.368 14.804
132 1HE LYS 21 HE2 LYS 21 0.841 11.403 16.347
133 2HE LYS 21 HE1 LYS 21 -0.819 10.831 16.513
134 1HZ LYS 21 HZ2 LYS 21 0.504 8.585 16.987
135 2HZ LYS 21 HZ1 LYS 21 1.649 9.695 17.551
136 3HZ LYS 21 HZ3 LYS 21 0.089 9.681 18.207
137 H VAL 22 HN VAL 22 -1.640 8.495 11.754
138 HA VAL 22 HA VAL 22 -2.995 10.384 10.039
139 HB VAL 22 HB VAL 22 -3.970 7.799 11.265
140 1HG1 VAL 22 3HG1 VAL 22 -5.700 9.559 10.629
141 2HG1 VAL 22 2HG1 VAL 22 -5.212 9.266 8.960
142 3HG1 VAL 22 1HG1 VAL 22 -5.890 7.954 9.925
143 1HG2 VAL 22 1HG2 VAL 22 -2.071 8.010 9.365
144 2HG2 VAL 22 3HG2 VAL 22 -3.209 6.667 9.474
145 3HG2 VAL 22 2HG2 VAL 22 -3.524 8.001 8.364
146 H GLU 23 HN GLU 23 -3.363 12.177 11.227
147 HA GLU 23 HA GLU 23 -4.582 11.954 13.863
148 1HB GLU 23 HB2 GLU 23 -4.559 14.589 13.494
149 2HB GLU 23 HB1 GLU 23 -3.122 13.715 14.002
150 1HG GLU 23 HG2 GLU 23 -2.153 13.839 11.880
151 2HG GLU 23 HG1 GLU 23 -3.685 14.246 11.107
152 H TYR 24 HN TYR 24 -5.614 11.720 10.800
153 HA TYR 24 HA TYR 24 -8.282 12.740 11.514
154 1HB TYR 24 HB2 TYR 24 -6.933 14.295 9.947
155 2HB TYR 24 HB1 TYR 24 -7.238 13.071 8.719
156 HD1 TYR 24 HD1 TYR 24 -8.481 15.991 10.267
157 HD2 TYR 24 HD2 TYR 24 -9.739 12.377 8.407
158 HE1 TYR 24 HE1 TYR 24 -10.685 16.991 9.829
159 HE2 TYR 24 HE2 TYR 24 -11.947 13.367 7.963
160 HH TYR 24 HH TYR 24 -12.864 15.770 7.680
161 H THR 25 HN THR 25 -9.982 11.504 10.863
162 HA THR 25 HA THR 25 -9.760 9.541 8.805
163 HB THR 25 HB THR 25 -10.156 8.423 11.574
164 HG1 THR 25 HG1 THR 25 -7.776 8.625 10.053
165 1HG2 THR 25 2HG2 THR 25 -10.446 7.341 8.978
166 2HG2 THR 25 1HG2 THR 25 -9.034 6.593 9.728
167 3HG2 THR 25 3HG2 THR 25 -10.600 6.528 10.537
168 H ASP 26 HN ASP 26 -11.655 9.696 7.866
169 HA ASP 26 HA ASP 26 -14.077 9.678 9.521
170 1HB ASP 26 HB2 ASP 26 -15.100 11.418 8.196
171 2HB ASP 26 HB1 ASP 26 -13.548 12.012 8.777
172 H ALA 27 HN ALA 27 -15.606 10.072 6.904
173 HA ALA 27 HA ALA 27 -15.685 7.264 6.221
174 1HB ALA 27 HB3 ALA 27 -17.646 9.055 6.460
175 2HB ALA 27 HB2 ALA 27 -17.343 9.211 4.730
176 3HB ALA 27 HB1 ALA 27 -17.771 7.642 5.412
177 H SER 28 HN SER 28 -13.623 9.539 5.298
178 HA SER 28 HA SER 28 -13.663 8.872 2.444
179 1HB SER 28 HB2 SER 28 -11.818 10.867 3.748
180 2HB SER 28 HB1 SER 28 -12.324 10.780 2.061
181 HG SER 28 HG SER 28 -14.388 11.432 2.693
182 H GLY 29 HN GLY 29 -11.913 8.397 5.397
183 1HA GLY 29 HA1 GLY 29 -9.723 7.078 3.940
184 2HA GLY 29 HA2 GLY 29 -10.627 6.189 5.158
185 H GLN 30 HN GLN 30 -7.750 7.093 4.930
186 HA GLN 30 HA GLN 30 -7.601 8.413 7.560
187 1HB GLN 30 HB2 GLN 30 -5.444 6.662 6.401
188 2HB GLN 30 HB1 GLN 30 -5.676 7.147 8.074
189 1HG GLN 30 HG2 GLN 30 -7.519 5.691 8.340
190 2HG GLN 30 HG1 GLN 30 -7.617 5.391 6.605
191 1HE2 GLN 30 1HE2 GLN 30 -5.727 4.318 5.625
192 2HE2 GLN 30 2HE2 GLN 30 -4.907 3.109 6.546
193 H TRP 31 HN TRP 31 -6.417 10.233 7.760
194 HA TRP 31 HA TRP 31 -4.681 11.009 5.518
195 1HB TRP 31 HB2 TRP 31 -6.385 13.015 6.980
196 2HB TRP 31 HB1 TRP 31 -5.534 13.209 5.452
197 HD1 TRP 31 HD1 TRP 31 -8.507 11.134 6.844
198 HE1 TRP 31 HE1 TRP 31 -10.239 10.879 4.958
199 HE3 TRP 31 HE3 TRP 31 -5.960 13.480 3.085
200 HZ2 TRP 31 HZ2 TRP 31 -10.491 11.583 2.232
201 HZ3 TRP 31 HZ3 TRP 31 -7.015 13.646 0.869
202 HH2 TRP 31 HH2 TRP 31 -9.233 12.717 0.451
203 H GLY 32 HN GLY 32 -3.024 12.557 6.062
204 1HA GLY 32 HA1 GLY 32 -1.492 11.947 8.237
205 2HA GLY 32 HA2 GLY 32 -2.526 13.256 8.794
206 H VAL 33 HN VAL 33 -0.287 14.218 9.037
207 HA VAL 33 HA VAL 33 0.476 15.530 6.510
208 HB VAL 33 HB VAL 33 -0.495 17.202 7.879
209 1HG1 VAL 33 1HG1 VAL 33 -0.476 15.947 9.978
210 2HG1 VAL 33 3HG1 VAL 33 1.255 16.248 10.140
211 3HG1 VAL 33 2HG1 VAL 33 0.116 17.594 10.197
212 1HG2 VAL 33 1HG2 VAL 33 1.590 17.885 6.804
213 2HG2 VAL 33 3HG2 VAL 33 1.368 18.719 8.341
214 3HG2 VAL 33 2HG2 VAL 33 2.501 17.372 8.224
215 H GLN 34 HN GLN 34 2.331 14.708 5.818
216 HA GLN 34 HA GLN 34 4.451 14.183 7.797
217 1HB GLN 34 HB2 GLN 34 3.445 12.223 6.396
218 2HB GLN 34 HB1 GLN 34 4.409 12.900 5.087
219 1HG GLN 34 HG2 GLN 34 6.222 11.914 5.850
220 2HG GLN 34 HG1 GLN 34 6.031 12.692 7.420
221 1HE2 GLN 34 1HE2 GLN 34 5.379 9.860 5.524
222 2HE2 GLN 34 2HE2 GLN 34 4.975 8.816 6.841
223 H ASN 35 HN ASN 35 6.351 15.192 7.541
224 HA ASN 35 HA ASN 35 7.929 16.601 6.720
225 1HB ASN 35 HB2 ASN 35 8.251 14.909 5.042
226 2HB ASN 35 HB1 ASN 35 6.856 15.470 4.132
227 1HD2 ASN 35 1HD2 ASN 35 7.929 15.835 2.274
228 2HD2 ASN 35 2HD2 ASN 35 9.099 17.092 2.070
229 H GLY 36 HN GLY 36 5.753 17.913 7.561
230 1HA GLY 36 HA1 GLY 36 5.930 20.415 6.423
231 2HA GLY 36 HA2 GLY 36 4.578 19.876 7.400
232 H GLN 37 HN GLN 37 3.390 17.989 5.784
233 HA GLN 37 HA GLN 37 2.055 19.684 3.909
234 1HB GLN 37 HB2 GLN 37 2.594 18.598 1.871
235 2HB GLN 37 HB1 GLN 37 4.123 18.954 2.660
236 1HG GLN 37 HG2 GLN 37 4.705 16.828 2.554
237 2HG GLN 37 HG1 GLN 37 3.270 16.362 3.466
238 1HE2 GLN 37 1HE2 GLN 37 3.375 14.432 2.144
239 2HE2 GLN 37 2HE2 GLN 37 2.663 14.446 0.570
240 H TRP 38 HN TRP 38 0.097 18.824 3.160
241 HA TRP 38 HA TRP 38 -0.986 16.751 4.847
242 1HB TRP 38 HB2 TRP 38 -2.098 18.694 2.870
243 2HB TRP 38 HB1 TRP 38 -3.051 17.271 3.274
244 HD1 TRP 38 HD1 TRP 38 -3.178 20.628 4.141
245 HE1 TRP 38 HE1 TRP 38 -3.893 21.060 6.576
246 HE3 TRP 38 HE3 TRP 38 -2.310 15.977 6.079
247 HZ2 TRP 38 HZ2 TRP 38 -4.066 19.619 8.997
248 HZ3 TRP 38 HZ3 TRP 38 -2.777 15.587 8.463
249 HH2 TRP 38 HH2 TRP 38 -3.636 17.372 9.891
250 H CYS 39 HN CYS 39 -1.894 14.796 4.163
251 HA CYS 39 HA CYS 39 -1.992 13.920 1.499
252 1HB CYS 39 HB2 CYS 39 -0.076 12.111 2.027
253 2HB CYS 39 HB1 CYS 39 0.236 13.618 1.179
254 H GLY 40 HN GLY 40 -2.476 11.595 1.312
255 1HA GLY 40 HA1 GLY 40 -4.210 10.151 2.058
256 2HA GLY 40 HA2 GLY 40 -3.925 10.705 3.702
257 H ILE 41 HN ILE 41 -3.911 8.458 4.312
258 HA ILE 41 HA ILE 41 -1.241 7.311 4.036
259 HB ILE 41 HB ILE 41 -3.477 6.921 5.992
260 1HG1 ILE 41 2HG1 ILE 41 -1.483 7.209 7.562
261 2HG1 ILE 41 1HG1 ILE 41 -0.553 7.634 6.129
262 1HG2 ILE 41 2HG2 ILE 41 -1.202 5.011 5.513
263 2HG2 ILE 41 1HG2 ILE 41 -2.105 5.085 7.027
264 3HG2 ILE 41 3HG2 ILE 41 -2.931 4.660 5.527
265 1HD1 ILE 41 1HD1 ILE 41 -3.090 9.079 6.530
266 2HD1 ILE 41 3HD1 ILE 41 -1.780 9.431 7.657
267 3HD1 ILE 41 2HD1 ILE 41 -1.535 9.649 5.923
268 H ASP 42 HN ASP 42 -0.919 5.918 2.461
269 HA ASP 42 HA ASP 42 -2.890 3.807 1.989
270 1HB ASP 42 HB2 ASP 42 -2.038 4.217 -0.558
271 2HB ASP 42 HB1 ASP 42 -3.526 4.888 0.099
272 H TYR 43 HN TYR 43 -1.577 2.286 2.926
273 HA TYR 43 HA TYR 43 1.179 2.018 2.567
274 1HB TYR 43 HB2 TYR 43 -0.612 -0.362 2.976
275 2HB TYR 43 HB1 TYR 43 1.001 -0.074 3.617
276 HD1 TYR 43 HD1 TYR 43 0.494 2.762 4.627
277 HD2 TYR 43 HD2 TYR 43 -1.738 -0.841 5.004
278 HE1 TYR 43 HE1 TYR 43 -0.492 3.598 6.720
279 HE2 TYR 43 HE2 TYR 43 -2.729 -0.014 7.096
280 HH TYR 43 HH TYR 43 -1.544 2.731 8.735
281 H SER 44 HN SER 44 -1.453 1.161 0.490
282 HA SER 44 HA SER 44 0.391 -0.301 -1.277
283 1HB SER 44 HB2 SER 44 -2.538 -0.528 -0.760
284 2HB SER 44 HB1 SER 44 -1.947 -0.905 -2.379
285 HG SER 44 HG SER 44 -0.818 -2.578 -1.598
286 H TYR 45 HN TYR 45 0.731 2.373 -1.377
287 HA TYR 45 HA TYR 45 -0.890 3.358 -3.591
288 1HB TYR 45 HB2 TYR 45 -0.401 5.481 -2.922
289 2HB TYR 45 HB1 TYR 45 -0.146 4.661 -1.390
290 HD1 TYR 45 HD1 TYR 45 2.513 3.393 -2.071
291 HD2 TYR 45 HD2 TYR 45 1.029 7.333 -2.629
292 HE1 TYR 45 HE1 TYR 45 4.805 4.256 -1.998
293 HE2 TYR 45 HE2 TYR 45 3.322 8.219 -2.554
294 HH TYR 45 HH TYR 45 5.513 7.590 -1.714
295 H GLY 46 HN GLY 46 1.112 1.225 -3.917
296 1HA GLY 46 HA1 GLY 46 2.332 2.254 -6.303
297 2HA GLY 46 HA2 GLY 46 2.448 0.610 -5.697
298 H GLN 47 HN GLN 47 4.187 0.003 -4.467
299 HA GLN 47 HA GLN 47 6.275 2.051 -4.121
300 1HB GLN 47 HB2 GLN 47 5.230 0.011 -2.274
301 2HB GLN 47 HB1 GLN 47 6.985 0.105 -2.346
302 1HG GLN 47 HG2 GLN 47 6.986 1.916 -1.082
303 2HG GLN 47 HG1 GLN 47 5.905 2.743 -2.202
304 1HE2 GLN 47 1HE2 GLN 47 3.576 1.585 -2.019
305 2HE2 GLN 47 2HE2 GLN 47 2.956 1.593 -0.406
306 H ASN 48 HN ASN 48 8.463 0.655 -3.630
307 HA ASN 48 HA ASN 48 9.127 -0.457 -6.163
308 1HB ASN 48 HB2 ASN 48 10.572 0.023 -3.596
309 2HB ASN 48 HB1 ASN 48 11.283 -1.095 -4.756
310 1HD2 ASN 48 1HD2 ASN 48 12.666 1.108 -4.130
311 2HD2 ASN 48 2HD2 ASN 48 12.656 2.236 -5.439
312 H GLN 49 HN GLN 49 10.288 -2.592 -6.341
313 HA GLN 49 HA GLN 49 8.582 -4.651 -5.205
314 1HB GLN 49 HB2 GLN 49 10.508 -4.520 -7.475
315 2HB GLN 49 HB1 GLN 49 10.147 -6.090 -6.764
316 1HG GLN 49 HG2 GLN 49 8.301 -6.203 -7.891
317 2HG GLN 49 HG1 GLN 49 7.725 -4.731 -7.117
318 1HE2 GLN 49 1HE2 GLN 49 8.242 -2.699 -8.129
319 2HE2 GLN 49 2HE2 GLN 49 8.473 -2.619 -9.839
320 H GLY 50 HN GLY 50 10.425 -3.411 -3.364
321 1HA GLY 50 HA1 GLY 50 12.502 -3.944 -2.297
322 2HA GLY 50 HA2 GLY 50 12.415 -5.532 -3.038
323 H ASN 51 HN ASN 51 9.508 -5.693 -2.224
324 HA ASN 51 HA ASN 51 8.281 -6.553 -0.511
325 1HB ASN 51 HB2 ASN 51 10.396 -8.113 -0.662
326 2HB ASN 51 HB1 ASN 51 10.775 -7.401 0.904
327 1HD2 ASN 51 1HD2 ASN 51 10.537 -9.764 1.421
328 2HD2 ASN 51 2HD2 ASN 51 8.967 -10.302 1.899
329 H GLU 52 HN GLU 52 9.581 -3.799 -0.256
330 HA GLU 52 HA GLU 52 9.965 -3.432 2.565
331 1HB GLU 52 HB2 GLU 52 10.139 -1.063 2.040
332 2HB GLU 52 HB1 GLU 52 11.096 -2.005 0.906
333 1HG GLU 52 HG2 GLU 52 9.669 -1.589 -0.855
334 2HG GLU 52 HG1 GLU 52 8.304 -1.229 0.201
335 H SER 53 HN SER 53 7.258 -3.911 0.698
336 HA SER 53 HA SER 53 5.496 -3.160 2.830
337 1HB SER 53 HB2 SER 53 5.979 -1.222 0.851
338 2HB SER 53 HB1 SER 53 4.408 -1.918 0.453
339 HG SER 53 HG SER 53 3.628 -1.296 2.398
340 H CYS 54 HN CYS 54 3.886 -4.595 2.896
341 HA CYS 54 HA CYS 54 3.344 -6.161 0.466
342 1HB CYS 54 HB2 CYS 54 3.771 -7.975 1.689
343 2HB CYS 54 HB1 CYS 54 4.013 -6.996 3.126
344 H THR 55 HN THR 55 1.148 -7.104 0.379
345 HA THR 55 HA THR 55 -0.813 -5.040 0.909
346 HB THR 55 HB THR 55 -1.010 -7.650 -0.609
347 HG1 THR 55 HG1 THR 55 0.051 -6.456 -1.984
348 1HG2 THR 55 2HG2 THR 55 -3.062 -5.775 0.204
349 2HG2 THR 55 1HG2 THR 55 -2.977 -5.963 -1.549
350 3HG2 THR 55 3HG2 THR 55 -3.210 -7.377 -0.520
351 H GLY 56 HN GLY 56 -2.384 -5.204 2.405
352 1HA GLY 56 HA1 GLY 56 -2.532 -7.738 3.915
353 2HA GLY 56 HA2 GLY 56 -3.899 -6.652 3.695
354 H ASN 57 HN ASN 57 -1.410 -4.615 4.043
355 HA ASN 57 HA ASN 57 -1.013 -4.784 6.890
356 1HB ASN 57 HB2 ASN 57 -0.191 -2.835 4.756
357 2HB ASN 57 HB1 ASN 57 0.021 -2.437 6.458
358 1HD2 ASN 57 1HD2 ASN 57 1.998 -2.881 4.348
359 2HD2 ASN 57 2HD2 ASN 57 3.026 -4.145 4.923
360 H GLY 58 HN GLY 58 -3.671 -4.022 5.231
361 1HA GLY 58 HA1 GLY 58 -4.824 -1.725 5.687
362 2HA GLY 58 HA2 GLY 58 -4.628 -2.251 7.354
363 H SER 59 HN SER 59 -5.014 -5.113 6.334
364 HA SER 59 HA SER 59 -7.858 -5.164 6.753
365 1HB SER 59 HB2 SER 59 -6.766 -6.111 4.095
366 2HB SER 59 HB1 SER 59 -8.429 -6.296 4.650
367 HG SER 59 HG SER 59 -8.782 -4.197 4.361
368 H TYR 60 HN TYR 60 -5.481 -7.331 5.183
369 HA TYR 60 HA TYR 60 -5.915 -9.242 7.379
370 1HB TYR 60 HB2 TYR 60 -5.375 -10.590 4.863
371 2HB TYR 60 HB1 TYR 60 -6.659 -10.871 6.030
372 HD1 TYR 60 HD1 TYR 60 -5.765 -8.274 3.491
373 HD2 TYR 60 HD2 TYR 60 -8.801 -10.704 5.207
374 HE1 TYR 60 HE1 TYR 60 -7.387 -7.363 1.885
375 HE2 TYR 60 HE2 TYR 60 -10.437 -9.797 3.611
376 HH TYR 60 HH TYR 60 -10.091 -8.660 1.066
377 HA PRO 61 HA PRO 61 -1.580 -9.853 7.756
378 1HB PRO 61 HB2 PRO 61 -1.294 -12.589 7.529
379 2HB PRO 61 HB1 PRO 61 -1.807 -11.750 8.996
380 1HG PRO 61 HG2 PRO 61 -3.477 -13.086 6.896
381 2HG PRO 61 HG1 PRO 61 -3.639 -13.148 8.664
382 1HD PRO 61 HD2 PRO 61 -5.229 -11.582 7.211
383 2HD PRO 61 HD1 PRO 61 -4.590 -11.019 8.770
384 H CYS 62 HN CYS 62 0.384 -10.520 6.694
385 HA CYS 62 HA CYS 62 0.312 -10.186 3.868
386 1HB CYS 62 HB2 CYS 62 2.470 -10.807 5.867
387 2HB CYS 62 HB1 CYS 62 2.809 -10.865 4.145
388 H CYS 63 HN CYS 63 1.277 -11.747 2.310
389 HA CYS 63 HA CYS 63 0.494 -14.488 3.022
390 1HB CYS 63 HB2 CYS 63 -0.251 -12.892 0.854
391 2HB CYS 63 HB1 CYS 63 0.892 -14.049 0.184
392 H ASN 64 HN ASN 64 2.631 -13.102 0.575
393 HA ASN 64 HA ASN 64 5.057 -13.269 0.781
394 1HB ASN 64 HB2 ASN 64 6.141 -15.246 1.495
395 2HB ASN 64 HB1 ASN 64 4.860 -14.981 2.664
396 1HD2 ASN 64 1HD2 ASN 64 4.251 -16.923 3.322
397 2HD2 ASN 64 2HD2 ASN 64 3.841 -18.255 2.302
398 H THR 65 HN THR 65 2.646 -15.369 -0.546
399 HA THR 65 HA THR 65 4.182 -16.393 -2.696
400 HB THR 65 HB THR 65 2.076 -17.378 -1.756
401 HG1 THR 65 HG1 THR 65 2.858 -18.025 -3.798
402 1HG2 THR 65 2HG2 THR 65 0.790 -15.220 -1.733
403 2HG2 THR 65 1HG2 THR 65 0.632 -15.389 -3.484
404 3HG2 THR 65 3HG2 THR 65 -0.057 -16.611 -2.413
405 H CYS 66 HN CYS 66 4.392 -15.712 -4.783
406 HA CYS 66 HA CYS 66 3.562 -12.953 -5.318
407 1HB CYS 66 HB2 CYS 66 5.508 -14.653 -6.893
408 2HB CYS 66 HB1 CYS 66 5.257 -12.914 -7.042
409 H GLN 67 HN GLN 67 1.688 -15.076 -5.383
410 HA GLN 67 HA GLN 67 0.939 -15.039 -8.225
411 1HB GLN 67 HB2 GLN 67 1.263 -17.287 -8.049
412 2HB GLN 67 HB1 GLN 67 1.111 -17.279 -6.302
413 1HG GLN 67 HG2 GLN 67 -1.422 -16.774 -7.640
414 2HG GLN 67 HG1 GLN 67 -0.694 -18.307 -8.106
415 1HE2 GLN 67 1HE2 GLN 67 -0.341 -16.709 -4.992
416 2HE2 GLN 67 2HE2 GLN 67 -1.163 -17.918 -4.072
417 H ALA 68 HN ALA 68 -0.346 -13.239 -8.014
418 HA ALA 68 HA ALA 68 -2.338 -13.064 -5.948
419 1HB ALA 68 HB1 ALA 68 -1.650 -10.960 -6.424
420 2HB ALA 68 HB2 ALA 68 -3.010 -11.053 -7.544
421 3HB ALA 68 HB3 ALA 68 -1.366 -11.314 -8.128
422 H THR 69 HN THR 69 -4.227 -13.989 -6.029
423 HA THR 69 HA THR 69 -5.263 -14.928 -8.596
424 HB THR 69 HB THR 69 -5.565 -16.750 -7.303
425 HG1 THR 69 HG1 THR 69 -7.607 -16.897 -6.644
426 1HG2 THR 69 3HG2 THR 69 -4.341 -15.815 -5.396
427 2HG2 THR 69 2HG2 THR 69 -5.835 -15.061 -4.832
428 3HG2 THR 69 1HG2 THR 69 -5.708 -16.820 -4.904
429 H TYR 70 HN TYR 70 -5.840 -12.506 -6.201
430 HA TYR 70 HA TYR 70 -8.018 -11.483 -7.817
431 1HB TYR 70 HB2 TYR 70 -9.720 -11.710 -6.332
432 2HB TYR 70 HB1 TYR 70 -8.755 -13.064 -5.763
433 HD1 TYR 70 HD1 TYR 70 -8.277 -13.209 -3.505
434 HD2 TYR 70 HD2 TYR 70 -9.198 -9.400 -5.161
435 HE1 TYR 70 HE1 TYR 70 -8.229 -12.224 -1.253
436 HE2 TYR 70 HE2 TYR 70 -9.153 -8.407 -2.917
437 HH TYR 70 HH TYR 70 -7.822 -9.897 -0.269
438 H THR 71 HN THR 71 -8.083 -9.304 -7.851
439 HA THR 71 HA THR 71 -6.369 -7.870 -5.931
440 HB THR 71 HB THR 71 -6.706 -7.366 -8.893
441 HG1 THR 71 HG1 THR 71 -5.162 -8.982 -8.086
442 1HG2 THR 71 3HG2 THR 71 -6.598 -5.253 -7.519
443 2HG2 THR 71 2HG2 THR 71 -4.978 -5.761 -7.038
444 3HG2 THR 71 1HG2 THR 71 -5.338 -5.459 -8.738
445 H ASP 72 HN ASP 72 -7.228 -6.161 -4.944
446 HA ASP 72 HA ASP 72 -9.859 -5.221 -5.869
447 1HB ASP 72 HB2 ASP 72 -9.413 -6.545 -3.523
448 2HB ASP 72 HB1 ASP 72 -9.248 -4.870 -3.007
449 H GLY 73 HN GLY 73 -10.162 -3.096 -4.137
450 1HA GLY 73 HA1 GLY 73 -9.711 -0.843 -4.113
451 2HA GLY 73 HA2 GLY 73 -8.575 -1.117 -5.423
452 H ASP 74 HN ASP 74 -7.614 -3.191 -3.044
453 HA ASP 74 HA ASP 74 -5.839 -1.161 -1.859
454 1HB ASP 74 HB2 ASP 74 -5.693 -3.200 -0.075
455 2HB ASP 74 HB1 ASP 74 -6.806 -1.846 0.069
456 H GLY 75 HN GLY 75 -5.702 -3.182 -4.248
457 1HA GLY 75 HA1 GLY 75 -3.007 -4.156 -3.540
458 2HA GLY 75 HA2 GLY 75 -3.489 -3.659 -5.155
459 H ASP 76 HN ASP 76 -2.325 -5.984 -5.137
460 HA ASP 76 HA ASP 76 -4.369 -7.796 -5.972
461 1HB ASP 76 HB2 ASP 76 -1.515 -8.625 -5.527
462 2HB ASP 76 HB1 ASP 76 -2.647 -9.160 -6.764
463 H TRP 77 HN TRP 77 -4.229 -10.166 -5.207
464 HA TRP 77 HA TRP 77 -3.569 -10.523 -2.421
465 1HB TRP 77 HB2 TRP 77 -6.459 -10.666 -3.294
466 2HB TRP 77 HB1 TRP 77 -5.840 -11.057 -1.692
467 HD1 TRP 77 HD1 TRP 77 -6.762 -8.101 -3.905
468 HE1 TRP 77 HE1 TRP 77 -6.710 -5.954 -2.493
469 HE3 TRP 77 HE3 TRP 77 -4.664 -9.985 0.357
470 HZ2 TRP 77 HZ2 TRP 77 -5.886 -5.164 0.080
471 HZ3 TRP 77 HZ3 TRP 77 -4.273 -8.462 2.248
472 HH2 TRP 77 HH2 TRP 77 -4.874 -6.099 2.111
473 H ALA 78 HN ALA 78 -3.572 -12.653 -1.735
474 HA ALA 78 HA ALA 78 -4.310 -14.703 -3.672
475 1HB ALA 78 HB3 ALA 78 -1.567 -14.515 -2.441
476 2HB ALA 78 HB2 ALA 78 -2.159 -15.843 -3.440
477 3HB ALA 78 HB1 ALA 78 -1.971 -14.234 -4.136
478 H PHE 79 HN PHE 79 -4.810 -16.702 -2.775
479 HA PHE 79 HA PHE 79 -5.163 -16.662 0.138
480 1HB PHE 79 HB2 PHE 79 -7.193 -16.962 -1.243
481 2HB PHE 79 HB1 PHE 79 -6.493 -18.423 -1.932
482 HD1 PHE 79 HD1 PHE 79 -6.679 -20.485 -0.835
483 HD2 PHE 79 HD2 PHE 79 -7.685 -16.897 1.221
484 HE1 PHE 79 HE1 PHE 79 -7.639 -21.811 1.002
485 HE2 PHE 79 HE2 PHE 79 -8.646 -18.217 3.062
486 HZ PHE 79 HZ PHE 79 -8.623 -20.677 2.954
487 H GLU 80 HN GLU 80 -3.673 -17.709 1.265
488 HA GLU 80 HA GLU 80 -2.853 -20.372 0.403
489 1HB GLU 80 HB2 GLU 80 -0.554 -19.984 0.460
490 2HB GLU 80 HB1 GLU 80 -1.181 -18.568 -0.370
491 1HG GLU 80 HG2 GLU 80 0.129 -17.453 1.060
492 2HG GLU 80 HG1 GLU 80 -1.210 -17.692 2.183
493 H ASN 81 HN ASN 81 -1.847 -21.624 2.126
494 HA ASN 81 HA ASN 81 -1.919 -22.490 4.230
495 1HB ASN 81 HB2 ASN 81 -0.380 -20.361 4.402
496 2HB ASN 81 HB1 ASN 81 -1.703 -19.737 5.383
497 1HD2 ASN 81 1HD2 ASN 81 0.966 -21.869 5.225
498 2HD2 ASN 81 2HD2 ASN 81 0.868 -22.474 6.841
499 H GLY 82 HN GLY 82 -4.440 -21.456 2.984
500 1HA GLY 82 HA1 GLY 82 -6.166 -21.971 5.174
501 2HA GLY 82 HA2 GLY 82 -6.659 -21.439 3.574
502 H ASN 83 HN ASN 83 -5.190 -18.988 3.540
503 HA ASN 83 HA ASN 83 -6.979 -17.410 5.198
504 1HB ASN 83 HB2 ASN 83 -3.998 -16.944 5.361
505 2HB ASN 83 HB1 ASN 83 -5.260 -16.125 6.276
506 1HD2 ASN 83 1HD2 ASN 83 -3.003 -18.556 6.322
507 2HD2 ASN 83 2HD2 ASN 83 -3.589 -19.447 7.681
508 H TRP 84 HN TRP 84 -7.253 -15.279 4.483
509 HA TRP 84 HA TRP 84 -6.476 -14.866 1.704
510 1HB TRP 84 HB2 TRP 84 -8.460 -13.494 3.517
511 2HB TRP 84 HB1 TRP 84 -8.070 -12.889 1.910
512 HD1 TRP 84 HD1 TRP 84 -10.293 -15.301 3.665
513 HE1 TRP 84 HE1 TRP 84 -11.615 -16.696 1.954
514 HE3 TRP 84 HE3 TRP 84 -7.716 -14.049 -0.570
515 HZ2 TRP 84 HZ2 TRP 84 -11.572 -17.200 -0.823
516 HZ3 TRP 84 HZ3 TRP 84 -8.420 -15.032 -2.713
517 HH2 TRP 84 HH2 TRP 84 -10.308 -16.575 -2.835
518 H CYS 85 HN CYS 85 -4.299 -14.331 1.938
519 HA CYS 85 HA CYS 85 -3.716 -11.838 3.377
520 1HB CYS 85 HB2 CYS 85 -1.263 -12.759 2.642
521 2HB CYS 85 HB1 CYS 85 -2.035 -13.116 4.179
522 H GLY 86 HN GLY 86 -2.089 -10.383 2.339
523 1HA GLY 86 HA1 GLY 86 -2.084 -8.815 0.571
524 2HA GLY 86 HA2 GLY 86 -2.844 -10.014 -0.463
525 H ILE 87 HN ILE 87 -1.219 -9.311 -2.028
526 HA ILE 87 HA ILE 87 1.079 -11.057 -1.922
527 HB ILE 87 HB ILE 87 -0.472 -9.780 -3.987
528 1HG1 ILE 87 2HG1 ILE 87 0.337 -11.584 -5.334
529 2HG1 ILE 87 1HG1 ILE 87 1.722 -11.833 -4.276
530 1HG2 ILE 87 1HG2 ILE 87 1.356 -8.183 -4.159
531 2HG2 ILE 87 3HG2 ILE 87 2.510 -9.508 -4.315
532 3HG2 ILE 87 2HG2 ILE 87 1.302 -9.239 -5.571
533 1HD1 ILE 87 1HD1 ILE 87 -1.145 -12.284 -3.491
534 2HD1 ILE 87 3HD1 ILE 87 -0.025 -13.538 -4.027
535 3HD1 ILE 87 2HD1 ILE 87 0.289 -12.659 -2.533
536 H LYS 88 HN LYS 88 3.233 -10.446 -2.107
537 HA LYS 88 HA LYS 88 3.923 -8.049 -0.686
538 1HB LYS 88 HB2 LYS 88 5.863 -9.881 -2.080
539 2HB LYS 88 HB1 LYS 88 6.136 -8.880 -0.660
540 1HG LYS 88 HG2 LYS 88 4.171 -11.142 -0.607
541 2HG LYS 88 HG1 LYS 88 5.893 -11.410 -0.344
542 1HD LYS 88 HD2 LYS 88 5.652 -10.802 1.778
543 2HD LYS 88 HD1 LYS 88 5.125 -9.205 1.254
544 1HE LYS 88 HE2 LYS 88 3.430 -11.621 1.826
545 2HE LYS 88 HE1 LYS 88 3.434 -10.072 2.666
546 1HZ LYS 88 HZ2 LYS 88 2.736 -9.116 0.427
547 2HZ LYS 88 HZ1 LYS 88 2.361 -10.706 -0.008
548 3HZ LYS 88 HZ3 LYS 88 1.577 -9.979 1.303
549 H ASN 89 HN ASN 89 4.928 -6.216 -1.447
550 HA ASN 89 HA ASN 89 4.412 -5.446 -4.090
551 1HB ASN 89 HB2 ASN 89 5.611 -3.422 -3.607
552 2HB ASN 89 HB1 ASN 89 4.721 -3.881 -2.161
553 1HD2 ASN 89 1HD2 ASN 89 6.420 -2.236 -1.447
554 2HD2 ASN 89 2HD2 ASN 89 7.894 -2.900 -0.839
555 H SER 90 HN SER 90 7.031 -7.209 -2.719
556 HA SER 90 HA SER 90 8.890 -6.695 -4.851
557 1HB SER 90 HB2 SER 90 10.122 -7.356 -3.044
558 2HB SER 90 HB1 SER 90 8.822 -8.358 -2.398
559 HG SER 90 HG SER 90 9.540 -10.027 -3.510
560 H CYS 91 HN CYS 91 6.126 -8.567 -4.489
561 HA CYS 91 HA CYS 91 6.919 -10.628 -6.368
562 1HB CYS 91 HB2 CYS 91 4.419 -10.155 -4.756
563 2HB CYS 91 HB1 CYS 91 4.540 -11.429 -5.962
564 H LYS 92 HN LYS 92 6.875 -7.988 -7.430
565 HA LYS 92 HA LYS 92 4.486 -7.962 -9.123
566 1HB LYS 92 HB2 LYS 92 6.712 -5.944 -8.931
567 2HB LYS 92 HB1 LYS 92 5.259 -5.768 -9.890
568 1HG LYS 92 HG2 LYS 92 3.904 -5.565 -7.956
569 2HG LYS 92 HG1 LYS 92 5.234 -6.045 -6.899
570 1HD LYS 92 HD2 LYS 92 6.392 -3.953 -8.077
571 2HD LYS 92 HD1 LYS 92 4.711 -3.448 -8.245
572 1HE LYS 92 HE2 LYS 92 4.916 -4.336 -5.627
573 2HE LYS 92 HE1 LYS 92 6.433 -3.483 -5.918
574 1HZ LYS 92 HZ2 LYS 92 4.695 -1.770 -6.971
575 2HZ LYS 92 HZ1 LYS 92 3.720 -2.449 -5.767
576 3HZ LYS 92 HZ3 LYS 92 5.186 -1.712 -5.353
577 H GLN 93 HN GLN 93 7.947 -7.337 -9.616
578 HA GLN 93 HA GLN 93 8.023 -9.282 -11.773
579 1HB GLN 93 HB2 GLN 93 8.230 -6.326 -12.235
580 2HB GLN 93 HB1 GLN 93 9.075 -7.453 -13.288
581 1HG GLN 93 HG2 GLN 93 6.973 -8.525 -13.860
582 2HG GLN 93 HG1 GLN 93 6.111 -7.442 -12.768
583 1HE2 GLN 93 1HE2 GLN 93 5.963 -5.228 -13.305
584 2HE2 GLN 93 2HE2 GLN 93 6.142 -4.693 -14.938
585 H GLN 94 HN GLN 94 10.192 -6.528 -11.505
586 HA GLN 94 HA GLN 94 12.376 -8.371 -10.919
587 1HB GLN 94 HB2 GLN 94 12.094 -5.830 -12.316
588 2HB GLN 94 HB1 GLN 94 13.464 -5.833 -11.214
589 1HG GLN 94 HG2 GLN 94 14.550 -7.517 -12.355
590 2HG GLN 94 HG1 GLN 94 13.064 -8.113 -13.096
591 1HE2 GLN 94 1HE2 GLN 94 12.002 -6.526 -14.607
592 2HE2 GLN 94 2HE2 GLN 94 13.042 -5.645 -15.668
593 HA PRO 95 HA PRO 95 13.038 -6.937 -6.797
594 1HB PRO 95 HB2 PRO 95 15.701 -6.775 -6.539
595 2HB PRO 95 HB1 PRO 95 14.891 -8.321 -6.818
596 1HG PRO 95 HG2 PRO 95 16.334 -6.561 -8.760
597 2HG PRO 95 HG1 PRO 95 16.379 -8.326 -8.602
598 1HD PRO 95 HD2 PRO 95 14.860 -6.985 -10.456
599 2HD PRO 95 HD1 PRO 95 14.474 -8.602 -9.838
600 H GLN 96 HN GLN 96 12.253 -4.761 -8.302
601 HA GLN 96 HA GLN 96 12.328 -2.498 -8.500
602 1HB GLN 96 HB2 GLN 96 12.180 -1.466 -6.476
603 2HB GLN 96 HB1 GLN 96 12.112 -3.131 -5.923
604 1HG GLN 96 HG2 GLN 96 14.783 -2.704 -5.881
605 2HG GLN 96 HG1 GLN 96 14.185 -1.085 -5.532
606 1HE2 GLN 96 1HE2 GLN 96 15.266 -3.770 -4.121
607 2HE2 GLN 96 2HE2 GLN 96 14.416 -3.707 -2.619
608 H ASN 97 HN ASN 97 14.743 -3.960 -9.410
609 HA ASN 97 HA ASN 97 17.047 -2.443 -8.762
610 1HB ASN 97 HB2 ASN 97 18.110 -3.584 -10.630
611 2HB ASN 97 HB1 ASN 97 17.146 -4.729 -9.702
612 1HD2 ASN 97 1HD2 ASN 97 17.280 -2.825 -12.638
613 2HD2 ASN 97 2HD2 ASN 97 16.157 -3.783 -13.536
614 H ASN 98 HN ASN 98 14.781 -2.322 -11.492
615 HA ASN 98 HA ASN 98 15.327 0.487 -11.854
616 1HB ASN 98 HB2 ASN 98 16.169 -1.555 -13.905
617 2HB ASN 98 HB1 ASN 98 15.821 0.115 -14.342
618 1HD2 ASN 98 1HD2 ASN 98 18.307 -1.642 -14.203
619 2HD2 ASN 98 2HD2 ASN 98 19.458 -0.653 -13.377
620 H ASN 99 HN ASN 99 13.938 1.434 -13.576
621 HA ASN 99 HA ASN 99 11.329 0.134 -13.519
622 1HB ASN 99 HB2 ASN 99 12.266 2.925 -14.127
623 2HB ASN 99 HB1 ASN 99 10.648 2.401 -14.582
624 1HD2 ASN 99 1HD2 ASN 99 10.309 4.302 -13.052
625 2HD2 ASN 99 2HD2 ASN 99 10.072 3.900 -11.388
626 H GLN 100 HN GLN 100 9.963 0.485 -15.566
627 HA GLN 100 HA GLN 100 11.541 0.162 -18.009
628 1HB GLN 100 HB2 GLN 100 10.242 -1.803 -18.684
629 2HB GLN 100 HB1 GLN 100 11.130 -2.107 -17.198
630 1HG GLN 100 HG2 GLN 100 9.249 -2.258 -15.935
631 2HG GLN 100 HG1 GLN 100 8.340 -1.143 -16.953
632 1HE2 GLN 100 1HE2 GLN 100 8.038 -2.047 -19.265
633 2HE2 GLN 100 2HE2 GLN 100 7.480 -3.680 -19.346
No H/Q in entry = 633
Start of MODEL 3
1 H1 ALA 1 HT2 ALA 1 5.097 4.909 -8.206
2 H2 ALA 1 HT1 ALA 1 6.063 3.700 -7.462
3 H3 ALA 1 HT3 ALA 1 4.357 3.642 -7.316
4 HA ALA 1 HA ALA 1 4.995 4.460 -5.323
5 1HB ALA 1 HB1 ALA 1 7.148 5.781 -6.901
6 2HB ALA 1 HB3 ALA 1 6.669 6.478 -5.353
7 3HB ALA 1 HB2 ALA 1 7.256 4.817 -5.428
8 H MET 2 HN MET 2 3.078 5.236 -7.430
9 HA MET 2 HA MET 2 2.127 7.650 -6.160
10 1HB MET 2 HB2 MET 2 1.794 8.758 -8.456
11 2HB MET 2 HB1 MET 2 3.396 8.816 -7.736
12 1HG MET 2 HG2 MET 2 3.307 6.467 -9.269
13 2HG MET 2 HG1 MET 2 2.568 7.730 -10.249
14 1HE MET 2 HE3 MET 2 5.238 8.285 -7.483
15 2HE MET 2 HE2 MET 2 5.802 6.758 -8.159
16 3HE MET 2 HE1 MET 2 6.755 8.225 -8.380
17 H ALA 3 HN ALA 3 0.381 6.345 -5.557
18 HA ALA 3 HA ALA 3 -1.715 6.205 -7.529
19 1HB ALA 3 HB3 ALA 3 -1.807 4.013 -7.917
20 2HB ALA 3 HB1 ALA 3 -1.508 3.609 -6.226
21 3HB ALA 3 HB2 ALA 3 -0.157 3.971 -7.300
22 H CYS 4 HN CYS 4 -1.248 7.555 -4.976
23 HA CYS 4 HA CYS 4 -2.777 6.305 -2.936
24 1HB CYS 4 HB2 CYS 4 -2.862 8.671 -1.981
25 2HB CYS 4 HB1 CYS 4 -1.266 7.963 -2.203
26 H TRP 5 HN TRP 5 -4.869 6.823 -2.189
27 HA TRP 5 HA TRP 5 -6.728 7.407 -4.325
28 1HB TRP 5 HB2 TRP 5 -8.444 6.975 -2.483
29 2HB TRP 5 HB1 TRP 5 -7.403 5.624 -2.921
30 HD1 TRP 5 HD1 TRP 5 -5.876 4.635 -1.061
31 HE1 TRP 5 HE1 TRP 5 -5.562 5.107 1.453
32 HE3 TRP 5 HE3 TRP 5 -8.508 8.964 -0.762
33 HZ2 TRP 5 HZ2 TRP 5 -6.353 7.088 3.318
34 HZ3 TRP 5 HZ3 TRP 5 -8.698 10.100 1.410
35 HH2 TRP 5 HH2 TRP 5 -7.640 9.182 3.408
36 H ALA 6 HN ALA 6 -5.265 9.083 -1.692
37 HA ALA 6 HA ALA 6 -7.213 11.068 -1.231
38 1HB ALA 6 HB2 ALA 6 -4.262 11.545 -0.957
39 2HB ALA 6 HB1 ALA 6 -5.587 12.196 0.014
40 3HB ALA 6 HB3 ALA 6 -5.137 10.495 0.157
41 H GLN 7 HN GLN 7 -4.847 10.640 -3.746
42 HA GLN 7 HA GLN 7 -4.774 13.333 -4.651
43 1HB GLN 7 HB2 GLN 7 -3.705 12.447 -6.648
44 2HB GLN 7 HB1 GLN 7 -3.021 11.701 -5.209
45 1HG GLN 7 HG2 GLN 7 -3.381 9.734 -6.151
46 2HG GLN 7 HG1 GLN 7 -5.110 10.025 -5.959
47 1HE2 GLN 7 1HE2 GLN 7 -2.419 10.057 -8.148
48 2HE2 GLN 7 2HE2 GLN 7 -3.339 10.214 -9.602
49 H SER 8 HN SER 8 -7.069 10.803 -4.988
50 HA SER 8 HA SER 8 -8.257 11.419 -7.432
51 1HB SER 8 HB2 SER 8 -9.870 10.582 -5.031
52 2HB SER 8 HB1 SER 8 -10.097 10.137 -6.722
53 HG SER 8 HG SER 8 -8.707 8.858 -4.850
54 H GLN 9 HN GLN 9 -8.347 13.085 -4.393
55 HA GLN 9 HA GLN 9 -10.418 14.898 -5.426
56 1HB GLN 9 HB2 GLN 9 -10.503 15.673 -2.985
57 2HB GLN 9 HB1 GLN 9 -11.171 14.091 -3.357
58 1HG GLN 9 HG2 GLN 9 -8.336 14.310 -2.479
59 2HG GLN 9 HG1 GLN 9 -9.629 14.432 -1.288
60 1HE2 GLN 9 1HE2 GLN 9 -10.845 12.644 -0.794
61 2HE2 GLN 9 2HE2 GLN 9 -10.430 11.050 -1.313
62 H GLY 10 HN GLY 10 -7.094 14.657 -4.490
63 1HA GLY 10 HA1 GLY 10 -6.806 17.576 -4.455
64 2HA GLY 10 HA2 GLY 10 -5.966 16.680 -5.710
65 H TYR 11 HN TYR 11 -6.344 15.301 -2.535
66 HA TYR 11 HA TYR 11 -3.921 16.290 -1.432
67 1HB TYR 11 HB2 TYR 11 -5.770 14.034 -0.727
68 2HB TYR 11 HB1 TYR 11 -4.234 14.224 0.111
69 HD1 TYR 11 HD1 TYR 11 -3.785 16.557 1.178
70 HD2 TYR 11 HD2 TYR 11 -7.641 15.178 0.020
71 HE1 TYR 11 HE1 TYR 11 -4.819 18.192 2.692
72 HE2 TYR 11 HE2 TYR 11 -8.685 16.809 1.528
73 HH TYR 11 HH TYR 11 -8.157 18.118 3.481
74 H ASN 12 HN ASN 12 -1.879 15.635 -1.684
75 HA ASN 12 HA ASN 12 -1.295 13.582 -3.616
76 1HB ASN 12 HB2 ASN 12 1.095 14.197 -3.098
77 2HB ASN 12 HB1 ASN 12 0.094 15.527 -3.671
78 1HD2 ASN 12 1HD2 ASN 12 2.430 14.827 -1.584
79 2HD2 ASN 12 2HD2 ASN 12 2.091 15.960 -0.324
80 H CYS 13 HN CYS 13 0.345 11.889 -3.163
81 HA CYS 13 HA CYS 13 -0.491 10.257 -1.015
82 1HB CYS 13 HB2 CYS 13 2.113 9.832 -2.445
83 2HB CYS 13 HB1 CYS 13 0.962 8.639 -1.856
84 H CYS 14 HN CYS 14 0.691 9.529 0.809
85 HA CYS 14 HA CYS 14 2.514 11.566 1.860
86 1HB CYS 14 HB2 CYS 14 0.327 10.249 2.980
87 2HB CYS 14 HB1 CYS 14 1.722 9.499 3.746
88 H ASN 15 HN ASN 15 4.604 11.169 1.623
89 HA ASN 15 HA ASN 15 5.844 8.853 0.857
90 1HB ASN 15 HB2 ASN 15 6.986 10.998 0.872
91 2HB ASN 15 HB1 ASN 15 6.907 11.067 2.628
92 1HD2 ASN 15 1HD2 ASN 15 8.417 10.049 3.818
93 2HD2 ASN 15 2HD2 ASN 15 9.760 9.188 3.153
94 H ASN 16 HN ASN 16 5.856 6.908 1.771
95 HA ASN 16 HA ASN 16 6.025 5.235 3.301
96 1HB ASN 16 HB2 ASN 16 7.118 7.477 5.005
97 2HB ASN 16 HB1 ASN 16 6.984 5.822 5.586
98 1HD2 ASN 16 1HD2 ASN 16 8.110 7.471 2.656
99 2HD2 ASN 16 2HD2 ASN 16 9.596 6.602 2.533
100 HA PRO 17 HA PRO 17 1.885 6.772 4.904
101 1HB PRO 17 HB2 PRO 17 0.509 4.645 3.841
102 2HB PRO 17 HB1 PRO 17 0.731 6.194 3.021
103 1HG PRO 17 HG2 PRO 17 2.234 3.632 2.677
104 2HG PRO 17 HG1 PRO 17 1.690 4.788 1.447
105 1HD PRO 17 HD2 PRO 17 4.243 4.703 2.286
106 2HD PRO 17 HD1 PRO 17 3.453 6.228 1.839
107 H SER 18 HN SER 18 3.779 3.890 5.053
108 HA SER 18 HA SER 18 2.174 2.625 7.096
109 1HB SER 18 HB2 SER 18 3.882 1.613 5.268
110 2HB SER 18 HB1 SER 18 4.967 1.734 6.653
111 HG SER 18 HG SER 18 3.789 0.288 7.729
112 H SER 19 HN SER 19 4.113 5.250 7.148
113 HA SER 19 HA SER 19 4.717 4.883 9.984
114 1HB SER 19 HB2 SER 19 6.753 4.416 8.474
115 2HB SER 19 HB1 SER 19 6.740 6.148 8.139
116 HG SER 19 HG SER 19 6.825 5.043 10.751
117 H THR 20 HN THR 20 2.697 6.366 8.420
118 HA THR 20 HA THR 20 3.448 9.137 8.974
119 HB THR 20 HB THR 20 1.429 7.817 7.188
120 HG1 THR 20 HG1 THR 20 3.109 10.023 6.657
121 1HG2 THR 20 3HG2 THR 20 1.343 10.695 8.036
122 2HG2 THR 20 2HG2 THR 20 0.478 10.010 6.662
123 3HG2 THR 20 1HG2 THR 20 0.106 9.467 8.299
124 H LYS 21 HN LYS 21 2.126 10.476 10.224
125 HA LYS 21 HA LYS 21 0.555 9.070 12.235
126 1HB LYS 21 HB2 LYS 21 2.254 10.772 12.897
127 2HB LYS 21 HB1 LYS 21 1.296 11.999 12.079
128 1HG LYS 21 HG2 LYS 21 -0.073 10.352 14.124
129 2HG LYS 21 HG1 LYS 21 1.108 11.537 14.686
130 1HD LYS 21 HD2 LYS 21 -0.153 13.171 13.117
131 2HD LYS 21 HD1 LYS 21 -1.450 11.976 13.191
132 1HE LYS 21 HE2 LYS 21 -2.097 13.119 15.013
133 2HE LYS 21 HE1 LYS 21 -0.811 12.221 15.818
134 1HZ LYS 21 HZ3 LYS 21 0.627 14.211 14.980
135 2HZ LYS 21 HZ2 LYS 21 -0.856 15.022 14.946
136 3HZ LYS 21 HZ1 LYS 21 -0.291 14.355 16.394
137 H VAL 22 HN VAL 22 -1.568 8.815 11.913
138 HA VAL 22 HA VAL 22 -2.965 10.518 10.057
139 HB VAL 22 HB VAL 22 -3.878 8.051 11.547
140 1HG1 VAL 22 3HG1 VAL 22 -5.709 9.629 10.939
141 2HG1 VAL 22 2HG1 VAL 22 -5.238 9.446 9.250
142 3HG1 VAL 22 1HG1 VAL 22 -5.825 8.053 10.157
143 1HG2 VAL 22 2HG2 VAL 22 -2.061 7.795 9.807
144 2HG2 VAL 22 1HG2 VAL 22 -3.519 6.835 9.559
145 3HG2 VAL 22 3HG2 VAL 22 -3.260 8.303 8.617
146 H GLU 23 HN GLU 23 -3.334 12.424 11.042
147 HA GLU 23 HA GLU 23 -4.506 12.472 13.710
148 1HB GLU 23 HB2 GLU 23 -4.494 15.071 13.025
149 2HB GLU 23 HB1 GLU 23 -3.101 14.263 13.723
150 1HG GLU 23 HG2 GLU 23 -2.284 15.522 11.923
151 2HG GLU 23 HG1 GLU 23 -2.310 13.857 11.353
152 H TYR 24 HN TYR 24 -5.579 11.945 10.698
153 HA TYR 24 HA TYR 24 -8.233 13.049 11.355
154 1HB TYR 24 HB2 TYR 24 -6.946 14.469 9.648
155 2HB TYR 24 HB1 TYR 24 -7.193 13.127 8.535
156 HD1 TYR 24 HD1 TYR 24 -8.578 16.114 9.864
157 HD2 TYR 24 HD2 TYR 24 -9.642 12.355 8.176
158 HE1 TYR 24 HE1 TYR 24 -10.801 17.001 9.299
159 HE2 TYR 24 HE2 TYR 24 -11.869 13.231 7.606
160 HH TYR 24 HH TYR 24 -12.625 16.553 7.751
161 H THR 25 HN THR 25 -10.010 11.927 10.508
162 HA THR 25 HA THR 25 -9.709 9.665 8.807
163 HB THR 25 HB THR 25 -10.547 8.965 11.611
164 HG1 THR 25 HG1 THR 25 -8.472 9.453 11.957
165 1HG2 THR 25 3HG2 THR 25 -10.581 7.564 9.189
166 2HG2 THR 25 2HG2 THR 25 -9.248 6.893 10.132
167 3HG2 THR 25 1HG2 THR 25 -10.875 6.934 10.811
168 H ASP 26 HN ASP 26 -11.619 9.071 7.921
169 HA ASP 26 HA ASP 26 -14.139 9.652 9.168
170 1HB ASP 26 HB2 ASP 26 -13.102 11.798 7.927
171 2HB ASP 26 HB1 ASP 26 -13.880 11.031 6.547
172 H ALA 27 HN ALA 27 -15.430 9.817 6.447
173 HA ALA 27 HA ALA 27 -15.507 6.957 5.991
174 1HB ALA 27 HB1 ALA 27 -17.499 7.297 4.865
175 2HB ALA 27 HB3 ALA 27 -17.512 8.604 6.049
176 3HB ALA 27 HB2 ALA 27 -17.063 8.935 4.376
177 H SER 28 HN SER 28 -13.416 9.191 4.981
178 HA SER 28 HA SER 28 -13.301 8.291 2.196
179 1HB SER 28 HB2 SER 28 -13.103 10.773 2.945
180 2HB SER 28 HB1 SER 28 -11.461 10.334 3.414
181 HG SER 28 HG SER 28 -12.576 9.961 0.829
182 H GLY 29 HN GLY 29 -11.674 8.075 5.260
183 1HA GLY 29 HA1 GLY 29 -9.413 6.658 4.040
184 2HA GLY 29 HA2 GLY 29 -10.416 5.805 5.204
185 H GLN 30 HN GLN 30 -7.578 7.351 4.906
186 HA GLN 30 HA GLN 30 -7.651 8.579 7.568
187 1HB GLN 30 HB2 GLN 30 -5.527 6.617 6.693
188 2HB GLN 30 HB1 GLN 30 -5.642 7.413 8.255
189 1HG GLN 30 HG2 GLN 30 -7.818 6.242 8.601
190 2HG GLN 30 HG1 GLN 30 -7.493 5.336 7.124
191 1HE2 GLN 30 1HE2 GLN 30 -6.169 6.093 10.306
192 2HE2 GLN 30 2HE2 GLN 30 -5.346 4.589 10.522
193 H TRP 31 HN TRP 31 -6.425 10.373 7.782
194 HA TRP 31 HA TRP 31 -4.540 11.018 5.615
195 1HB TRP 31 HB2 TRP 31 -6.128 13.177 6.957
196 2HB TRP 31 HB1 TRP 31 -5.327 13.199 5.392
197 HD1 TRP 31 HD1 TRP 31 -8.377 11.440 7.031
198 HE1 TRP 31 HE1 TRP 31 -10.199 11.192 5.232
199 HE3 TRP 31 HE3 TRP 31 -5.817 13.335 3.038
200 HZ2 TRP 31 HZ2 TRP 31 -10.503 11.737 2.468
201 HZ3 TRP 31 HZ3 TRP 31 -6.941 13.430 0.852
202 HH2 TRP 31 HH2 TRP 31 -9.235 12.649 0.576
203 H GLY 32 HN GLY 32 -2.961 12.715 6.239
204 1HA GLY 32 HA1 GLY 32 -1.530 12.020 8.504
205 2HA GLY 32 HA2 GLY 32 -2.527 13.399 8.950
206 H VAL 33 HN VAL 33 -0.596 14.623 9.271
207 HA VAL 33 HA VAL 33 0.470 15.661 6.742
208 HB VAL 33 HB VAL 33 -0.511 17.416 7.985
209 1HG1 VAL 33 2HG1 VAL 33 0.993 16.357 10.368
210 2HG1 VAL 33 1HG1 VAL 33 0.140 17.900 10.341
211 3HG1 VAL 33 3HG1 VAL 33 -0.753 16.394 10.127
212 1HG2 VAL 33 3HG2 VAL 33 1.673 17.967 7.012
213 2HG2 VAL 33 2HG2 VAL 33 1.354 18.903 8.473
214 3HG2 VAL 33 1HG2 VAL 33 2.456 17.526 8.531
215 H GLN 34 HN GLN 34 2.204 14.452 6.234
216 HA GLN 34 HA GLN 34 4.274 14.066 8.291
217 1HB GLN 34 HB2 GLN 34 3.385 11.999 7.221
218 2HB GLN 34 HB1 GLN 34 3.942 12.599 5.665
219 1HG GLN 34 HG2 GLN 34 6.054 11.996 6.051
220 2HG GLN 34 HG1 GLN 34 6.014 12.560 7.720
221 1HE2 GLN 34 1HE2 GLN 34 5.456 9.891 5.577
222 2HE2 GLN 34 2HE2 GLN 34 5.335 8.667 6.793
223 H ASN 35 HN ASN 35 6.204 15.038 8.057
224 HA ASN 35 HA ASN 35 7.848 16.370 7.219
225 1HB ASN 35 HB2 ASN 35 6.826 15.038 4.731
226 2HB ASN 35 HB1 ASN 35 8.029 16.320 4.607
227 1HD2 ASN 35 1HD2 ASN 35 7.927 13.268 4.264
228 2HD2 ASN 35 2HD2 ASN 35 9.352 12.732 5.082
229 H GLY 36 HN GLY 36 5.176 17.414 7.721
230 1HA GLY 36 HA1 GLY 36 5.510 20.029 6.737
231 2HA GLY 36 HA2 GLY 36 4.060 19.408 7.513
232 H GLN 37 HN GLN 37 3.281 17.450 5.737
233 HA GLN 37 HA GLN 37 2.248 19.079 3.573
234 1HB GLN 37 HB2 GLN 37 3.919 16.613 3.055
235 2HB GLN 37 HB1 GLN 37 2.917 17.402 1.844
236 1HG GLN 37 HG2 GLN 37 5.228 18.678 3.291
237 2HG GLN 37 HG1 GLN 37 5.283 18.012 1.660
238 1HE2 GLN 37 1HE2 GLN 37 3.006 18.887 0.535
239 2HE2 GLN 37 2HE2 GLN 37 2.978 20.612 0.466
240 H TRP 38 HN TRP 38 0.174 18.566 3.191
241 HA TRP 38 HA TRP 38 -1.116 16.509 4.660
242 1HB TRP 38 HB2 TRP 38 -1.999 18.365 2.462
243 2HB TRP 38 HB1 TRP 38 -3.067 17.101 3.063
244 HD1 TRP 38 HD1 TRP 38 -2.082 20.593 3.707
245 HE1 TRP 38 HE1 TRP 38 -3.055 21.413 5.946
246 HE3 TRP 38 HE3 TRP 38 -3.555 16.099 5.646
247 HZ2 TRP 38 HZ2 TRP 38 -4.286 20.300 8.230
248 HZ3 TRP 38 HZ3 TRP 38 -4.625 16.063 7.863
249 HH2 TRP 38 HH2 TRP 38 -4.982 18.121 9.126
250 H CYS 39 HN CYS 39 -1.784 14.490 4.060
251 HA CYS 39 HA CYS 39 -1.945 13.567 1.407
252 1HB CYS 39 HB2 CYS 39 0.075 11.878 1.847
253 2HB CYS 39 HB1 CYS 39 0.294 13.415 1.027
254 H GLY 40 HN GLY 40 -3.009 11.655 1.305
255 1HA GLY 40 HA1 GLY 40 -4.343 9.951 2.093
256 2HA GLY 40 HA2 GLY 40 -4.127 10.609 3.708
257 H ILE 41 HN ILE 41 -4.045 8.343 4.370
258 HA ILE 41 HA ILE 41 -1.299 7.340 4.181
259 HB ILE 41 HB ILE 41 -3.460 7.039 6.225
260 1HG1 ILE 41 2HG1 ILE 41 -1.530 7.556 7.728
261 2HG1 ILE 41 1HG1 ILE 41 -0.521 7.715 6.293
262 1HG2 ILE 41 2HG2 ILE 41 -1.269 5.076 5.692
263 2HG2 ILE 41 1HG2 ILE 41 -1.861 5.345 7.332
264 3HG2 ILE 41 3HG2 ILE 41 -2.965 4.780 6.077
265 1HD1 ILE 41 2HD1 ILE 41 -3.005 9.298 6.350
266 2HD1 ILE 41 1HD1 ILE 41 -1.720 9.779 7.456
267 3HD1 ILE 41 3HD1 ILE 41 -1.408 9.704 5.721
268 H ASP 42 HN ASP 42 -1.225 6.159 2.343
269 HA ASP 42 HA ASP 42 -3.049 3.850 2.178
270 1HB ASP 42 HB2 ASP 42 -2.867 5.827 0.299
271 2HB ASP 42 HB1 ASP 42 -1.691 4.664 -0.310
272 H TYR 43 HN TYR 43 -1.720 2.427 3.277
273 HA TYR 43 HA TYR 43 1.004 2.142 3.111
274 1HB TYR 43 HB2 TYR 43 -0.975 -0.135 3.323
275 2HB TYR 43 HB1 TYR 43 0.710 -0.165 3.833
276 HD1 TYR 43 HD1 TYR 43 -1.325 -0.955 5.725
277 HD2 TYR 43 HD2 TYR 43 0.084 2.953 4.796
278 HE1 TYR 43 HE1 TYR 43 -1.990 -0.186 7.964
279 HE2 TYR 43 HE2 TYR 43 -0.578 3.733 7.034
280 HH TYR 43 HH TYR 43 -0.915 2.505 9.382
281 H SER 44 HN SER 44 -1.359 1.352 0.714
282 HA SER 44 HA SER 44 0.734 0.129 -0.957
283 1HB SER 44 HB2 SER 44 -2.256 -0.258 -0.948
284 2HB SER 44 HB1 SER 44 -1.246 -0.743 -2.310
285 HG SER 44 HG SER 44 -0.004 -1.919 -0.579
286 H TYR 45 HN TYR 45 0.829 2.832 -0.846
287 HA TYR 45 HA TYR 45 -0.760 3.849 -3.059
288 1HB TYR 45 HB2 TYR 45 -0.604 5.830 -2.015
289 2HB TYR 45 HB1 TYR 45 0.214 5.001 -0.696
290 HD1 TYR 45 HD1 TYR 45 2.496 5.391 -0.252
291 HD2 TYR 45 HD2 TYR 45 0.772 6.801 -3.864
292 HE1 TYR 45 HE1 TYR 45 4.560 6.608 -0.755
293 HE2 TYR 45 HE2 TYR 45 2.821 8.010 -4.393
294 HH TYR 45 HH TYR 45 5.565 7.524 -3.412
295 H GLY 46 HN GLY 46 -0.013 3.746 -5.051
296 1HA GLY 46 HA1 GLY 46 2.723 4.436 -5.610
297 2HA GLY 46 HA2 GLY 46 1.478 4.120 -6.800
298 H GLN 47 HN GLN 47 3.338 2.390 -4.327
299 HA GLN 47 HA GLN 47 4.746 0.723 -5.948
300 1HB GLN 47 HB2 GLN 47 3.583 -0.187 -3.319
301 2HB GLN 47 HB1 GLN 47 5.092 -0.702 -4.064
302 1HG GLN 47 HG2 GLN 47 5.228 2.099 -3.804
303 2HG GLN 47 HG1 GLN 47 4.612 1.468 -2.276
304 1HE2 GLN 47 1HE2 GLN 47 7.335 2.316 -3.824
305 2HE2 GLN 47 2HE2 GLN 47 8.480 1.309 -3.013
306 H ASN 48 HN ASN 48 4.264 -0.737 -7.393
307 HA ASN 48 HA ASN 48 1.632 -1.681 -7.845
308 1HB ASN 48 HB2 ASN 48 2.719 -3.124 -9.574
309 2HB ASN 48 HB1 ASN 48 3.132 -1.417 -9.709
310 1HD2 ASN 48 1HD2 ASN 48 5.211 -0.767 -9.401
311 2HD2 ASN 48 2HD2 ASN 48 6.531 -1.860 -9.188
312 H GLN 49 HN GLN 49 1.431 -4.189 -8.326
313 HA GLN 49 HA GLN 49 1.439 -5.454 -5.796
314 1HB GLN 49 HB2 GLN 49 -0.146 -6.658 -6.794
315 2HB GLN 49 HB1 GLN 49 0.227 -5.872 -8.319
316 1HG GLN 49 HG2 GLN 49 2.002 -7.638 -8.650
317 2HG GLN 49 HG1 GLN 49 1.305 -8.472 -7.264
318 1HE2 GLN 49 1HE2 GLN 49 -0.835 -9.263 -7.421
319 2HE2 GLN 49 2HE2 GLN 49 -1.544 -9.600 -8.959
320 H GLY 50 HN GLY 50 4.066 -4.882 -7.605
321 1HA GLY 50 HA1 GLY 50 6.208 -5.693 -7.453
322 2HA GLY 50 HA2 GLY 50 5.471 -7.161 -8.074
323 H ASN 51 HN ASN 51 4.487 -5.976 -4.970
324 HA ASN 51 HA ASN 51 4.420 -7.144 -2.989
325 1HB ASN 51 HB2 ASN 51 5.062 -9.183 -4.573
326 2HB ASN 51 HB1 ASN 51 6.607 -9.017 -3.744
327 1HD2 ASN 51 1HD2 ASN 51 6.807 -10.257 -2.038
328 2HD2 ASN 51 2HD2 ASN 51 5.533 -10.782 -0.996
329 H GLU 52 HN GLU 52 5.729 -4.848 -3.210
330 HA GLU 52 HA GLU 52 8.428 -5.152 -2.164
331 1HB GLU 52 HB2 GLU 52 6.827 -2.651 -2.745
332 2HB GLU 52 HB1 GLU 52 8.530 -2.702 -2.308
333 1HG GLU 52 HG2 GLU 52 7.886 -4.369 -4.606
334 2HG GLU 52 HG1 GLU 52 7.519 -2.663 -4.853
335 H SER 53 HN SER 53 5.210 -4.525 -1.063
336 HA SER 53 HA SER 53 6.124 -4.561 1.689
337 1HB SER 53 HB2 SER 53 4.963 -2.161 0.371
338 2HB SER 53 HB1 SER 53 4.405 -2.532 2.001
339 HG SER 53 HG SER 53 6.965 -1.824 1.108
340 H CYS 54 HN CYS 54 4.876 -5.979 2.703
341 HA CYS 54 HA CYS 54 2.170 -6.464 1.682
342 1HB CYS 54 HB2 CYS 54 2.333 -8.556 3.124
343 2HB CYS 54 HB1 CYS 54 3.391 -8.483 1.720
344 H THR 55 HN THR 55 0.708 -7.376 3.587
345 HA THR 55 HA THR 55 0.491 -5.189 5.482
346 HB THR 55 HB THR 55 -1.410 -7.486 4.962
347 HG1 THR 55 HG1 THR 55 -2.518 -6.047 3.674
348 1HG2 THR 55 3HG2 THR 55 -1.424 -5.446 6.957
349 2HG2 THR 55 2HG2 THR 55 -2.771 -5.199 5.844
350 3HG2 THR 55 1HG2 THR 55 -2.584 -6.742 6.675
351 H GLY 56 HN GLY 56 0.434 -5.486 7.715
352 1HA GLY 56 HA1 GLY 56 1.161 -8.160 8.690
353 2HA GLY 56 HA2 GLY 56 0.510 -6.856 9.674
354 H ASN 57 HN ASN 57 2.611 -5.265 7.841
355 HA ASN 57 HA ASN 57 5.095 -6.071 9.056
356 1HB ASN 57 HB2 ASN 57 4.467 -3.541 7.527
357 2HB ASN 57 HB1 ASN 57 6.068 -4.184 7.875
358 1HD2 ASN 57 1HD2 ASN 57 5.100 -3.580 5.312
359 2HD2 ASN 57 2HD2 ASN 57 5.010 -5.049 4.410
360 H GLY 58 HN GLY 58 2.541 -4.719 10.457
361 1HA GLY 58 HA1 GLY 58 2.807 -2.447 11.697
362 2HA GLY 58 HA2 GLY 58 4.213 -3.260 12.370
363 H SER 59 HN SER 59 2.554 -5.849 12.162
364 HA SER 59 HA SER 59 1.532 -5.707 14.845
365 1HB SER 59 HB2 SER 59 -0.430 -6.305 12.621
366 2HB SER 59 HB1 SER 59 -0.772 -6.272 14.350
367 HG SER 59 HG SER 59 -0.257 -4.142 12.592
368 H TYR 60 HN TYR 60 0.886 -7.740 11.973
369 HA TYR 60 HA TYR 60 2.161 -9.986 13.378
370 1HB TYR 60 HB2 TYR 60 -0.012 -10.984 11.793
371 2HB TYR 60 HB1 TYR 60 0.264 -11.160 13.521
372 HD1 TYR 60 HD1 TYR 60 -0.832 -8.418 11.210
373 HD2 TYR 60 HD2 TYR 60 -1.515 -10.540 14.835
374 HE1 TYR 60 HE1 TYR 60 -2.800 -7.013 11.655
375 HE2 TYR 60 HE2 TYR 60 -3.483 -9.137 15.290
376 HH TYR 60 HH TYR 60 -4.851 -7.067 12.938
377 HA PRO 61 HA PRO 61 4.374 -11.083 9.742
378 1HB PRO 61 HB2 PRO 61 3.495 -13.712 9.336
379 2HB PRO 61 HB1 PRO 61 4.860 -13.215 10.340
380 1HG PRO 61 HG2 PRO 61 2.055 -13.856 11.135
381 2HG PRO 61 HG1 PRO 61 3.574 -14.213 11.980
382 1HD PRO 61 HD2 PRO 61 1.992 -12.229 12.800
383 2HD PRO 61 HD1 PRO 61 3.760 -12.041 12.811
384 H CYS 62 HN CYS 62 4.167 -11.553 7.475
385 HA CYS 62 HA CYS 62 1.599 -10.739 6.422
386 1HB CYS 62 HB2 CYS 62 4.239 -11.331 5.069
387 2HB CYS 62 HB1 CYS 62 2.798 -10.774 4.224
388 H CYS 63 HN CYS 63 0.392 -11.919 4.854
389 HA CYS 63 HA CYS 63 0.269 -14.711 5.427
390 1HB CYS 63 HB2 CYS 63 -1.256 -12.957 3.506
391 2HB CYS 63 HB1 CYS 63 -1.565 -14.680 3.675
392 H ASN 64 HN ASN 64 0.172 -13.302 2.209
393 HA ASN 64 HA ASN 64 1.957 -13.636 0.581
394 1HB ASN 64 HB2 ASN 64 3.041 -15.725 0.296
395 2HB ASN 64 HB1 ASN 64 3.070 -15.418 2.025
396 1HD2 ASN 64 1HD2 ASN 64 3.044 -17.382 2.898
397 2HD2 ASN 64 2HD2 ASN 64 1.872 -18.609 2.576
398 H THR 65 HN THR 65 -1.074 -14.633 1.373
399 HA THR 65 HA THR 65 -1.655 -15.685 -1.312
400 HB THR 65 HB THR 65 -2.252 -17.130 0.634
401 HG1 THR 65 HG1 THR 65 -4.502 -16.123 -0.767
402 1HG2 THR 65 2HG2 THR 65 -2.924 -15.077 2.074
403 2HG2 THR 65 1HG2 THR 65 -4.492 -15.260 1.283
404 3HG2 THR 65 3HG2 THR 65 -3.821 -16.588 2.231
405 H CYS 66 HN CYS 66 -3.219 -14.691 -2.585
406 HA CYS 66 HA CYS 66 -3.959 -12.005 -1.748
407 1HB CYS 66 HB2 CYS 66 -3.185 -12.120 -4.016
408 2HB CYS 66 HB1 CYS 66 -4.276 -13.455 -4.388
409 H GLN 67 HN GLN 67 -5.152 -13.387 -0.039
410 HA GLN 67 HA GLN 67 -7.969 -13.340 -0.778
411 1HB GLN 67 HB2 GLN 67 -7.655 -15.643 -1.052
412 2HB GLN 67 HB1 GLN 67 -6.464 -15.736 0.234
413 1HG GLN 67 HG2 GLN 67 -8.966 -14.908 1.338
414 2HG GLN 67 HG1 GLN 67 -9.212 -16.339 0.341
415 1HE2 GLN 67 1HE2 GLN 67 -6.314 -15.487 2.156
416 2HE2 GLN 67 2HE2 GLN 67 -6.379 -16.830 3.240
417 H ALA 68 HN ALA 68 -8.158 -11.502 0.468
418 HA ALA 68 HA ALA 68 -7.350 -11.606 3.256
419 1HB ALA 68 HB3 ALA 68 -7.390 -9.574 1.360
420 2HB ALA 68 HB2 ALA 68 -8.676 -9.171 2.499
421 3HB ALA 68 HB1 ALA 68 -7.031 -9.430 3.080
422 H THR 69 HN THR 69 -8.817 -12.999 4.090
423 HA THR 69 HA THR 69 -11.589 -12.955 3.720
424 HB THR 69 HB THR 69 -10.932 -14.897 4.738
425 HG1 THR 69 HG1 THR 69 -11.614 -14.862 6.916
426 1HG2 THR 69 1HG2 THR 69 -9.042 -13.237 6.357
427 2HG2 THR 69 3HG2 THR 69 -9.417 -14.910 6.782
428 3HG2 THR 69 2HG2 THR 69 -8.686 -14.537 5.217
429 H TYR 70 HN TYR 70 -9.567 -10.794 5.507
430 HA TYR 70 HA TYR 70 -11.910 -9.286 6.281
431 1HB TYR 70 HB2 TYR 70 -11.749 -9.427 8.557
432 2HB TYR 70 HB1 TYR 70 -11.154 -11.028 8.139
433 HD1 TYR 70 HD1 TYR 70 -9.934 -7.572 8.839
434 HD2 TYR 70 HD2 TYR 70 -9.120 -11.744 9.008
435 HE1 TYR 70 HE1 TYR 70 -7.875 -7.112 10.100
436 HE2 TYR 70 HE2 TYR 70 -7.056 -11.297 10.266
437 HH TYR 70 HH TYR 70 -5.752 -8.147 10.601
438 H THR 71 HN THR 71 -11.535 -7.122 6.528
439 HA THR 71 HA THR 71 -8.755 -6.222 6.160
440 HB THR 71 HB THR 71 -11.254 -5.058 4.916
441 HG1 THR 71 HG1 THR 71 -10.508 -6.830 3.779
442 1HG2 THR 71 1HG2 THR 71 -9.412 -3.412 5.638
443 2HG2 THR 71 3HG2 THR 71 -8.481 -4.124 4.319
444 3HG2 THR 71 2HG2 THR 71 -10.025 -3.338 3.985
445 H ASP 72 HN ASP 72 -8.073 -4.578 7.424
446 HA ASP 72 HA ASP 72 -10.052 -3.396 9.251
447 1HB ASP 72 HB2 ASP 72 -8.071 -5.094 10.028
448 2HB ASP 72 HB1 ASP 72 -7.260 -3.541 10.201
449 H GLY 73 HN GLY 73 -8.414 -1.559 10.499
450 1HA GLY 73 HA1 GLY 73 -7.840 0.650 10.221
451 2HA GLY 73 HA2 GLY 73 -8.366 0.520 8.550
452 H ASP 74 HN ASP 74 -6.202 -1.923 8.833
453 HA ASP 74 HA ASP 74 -3.965 -0.158 8.083
454 1HB ASP 74 HB2 ASP 74 -4.057 -2.559 9.838
455 2HB ASP 74 HB1 ASP 74 -2.632 -2.347 8.825
456 H GLY 75 HN GLY 75 -6.190 -1.938 6.675
457 1HA GLY 75 HA1 GLY 75 -4.302 -3.164 4.762
458 2HA GLY 75 HA2 GLY 75 -5.742 -2.295 4.255
459 H ASP 76 HN ASP 76 -5.145 -4.930 3.492
460 HA ASP 76 HA ASP 76 -7.527 -6.259 4.511
461 1HB ASP 76 HB2 ASP 76 -5.915 -7.675 2.492
462 2HB ASP 76 HB1 ASP 76 -7.638 -7.322 2.517
463 H TRP 77 HN TRP 77 -7.365 -8.691 4.888
464 HA TRP 77 HA TRP 77 -4.811 -9.637 5.857
465 1HB TRP 77 HB2 TRP 77 -7.082 -9.332 7.817
466 2HB TRP 77 HB1 TRP 77 -5.462 -9.933 8.158
467 HD1 TRP 77 HD1 TRP 77 -7.370 -6.674 7.493
468 HE1 TRP 77 HE1 TRP 77 -5.905 -4.701 8.245
469 HE3 TRP 77 HE3 TRP 77 -3.055 -9.213 8.527
470 HZ2 TRP 77 HZ2 TRP 77 -3.275 -4.277 9.153
471 HZ3 TRP 77 HZ3 TRP 77 -1.109 -7.946 9.332
472 HH2 TRP 77 HH2 TRP 77 -1.217 -5.526 9.640
473 H ALA 78 HN ALA 78 -4.745 -11.830 6.370
474 HA ALA 78 HA ALA 78 -7.160 -13.386 5.858
475 1HB ALA 78 HB2 ALA 78 -6.298 -14.658 4.166
476 2HB ALA 78 HB1 ALA 78 -5.556 -13.099 3.817
477 3HB ALA 78 HB3 ALA 78 -4.629 -14.350 4.639
478 H PHE 79 HN PHE 79 -6.794 -15.750 6.399
479 HA PHE 79 HA PHE 79 -5.066 -15.921 8.780
480 1HB PHE 79 HB2 PHE 79 -7.561 -16.050 9.147
481 2HB PHE 79 HB1 PHE 79 -7.547 -17.559 8.239
482 HD1 PHE 79 HD1 PHE 79 -5.646 -16.004 11.053
483 HD2 PHE 79 HD2 PHE 79 -7.540 -19.477 9.484
484 HE1 PHE 79 HE1 PHE 79 -5.096 -17.230 13.114
485 HE2 PHE 79 HE2 PHE 79 -6.994 -20.710 11.543
486 HZ PHE 79 HZ PHE 79 -5.770 -19.586 13.361
487 H GLU 80 HN GLU 80 -3.261 -16.964 8.225
488 HA GLU 80 HA GLU 80 -3.542 -19.585 6.942
489 1HB GLU 80 HB2 GLU 80 -1.848 -19.214 5.371
490 2HB GLU 80 HB1 GLU 80 -2.788 -17.731 5.327
491 1HG GLU 80 HG2 GLU 80 -0.874 -16.646 5.580
492 2HG GLU 80 HG1 GLU 80 -0.860 -17.233 7.243
493 H ASN 81 HN ASN 81 -1.895 -21.094 7.465
494 HA ASN 81 HA ASN 81 -0.530 -22.170 8.932
495 1HB ASN 81 HB2 ASN 81 0.676 -19.471 8.626
496 2HB ASN 81 HB1 ASN 81 1.275 -20.469 9.949
497 1HD2 ASN 81 1HD2 ASN 81 2.226 -19.545 7.150
498 2HD2 ASN 81 2HD2 ASN 81 2.908 -20.986 6.484
499 H GLY 82 HN GLY 82 -2.989 -20.738 9.918
500 1HA GLY 82 HA1 GLY 82 -2.702 -21.369 12.661
501 2HA GLY 82 HA2 GLY 82 -4.075 -20.552 11.930
502 H ASN 83 HN ASN 83 -2.668 -18.291 10.911
503 HA ASN 83 HA ASN 83 -2.371 -16.823 13.409
504 1HB ASN 83 HB2 ASN 83 -0.267 -15.722 12.538
505 2HB ASN 83 HB1 ASN 83 -0.087 -17.399 13.043
506 1HD2 ASN 83 1HD2 ASN 83 -0.661 -15.380 10.201
507 2HD2 ASN 83 2HD2 ASN 83 0.174 -16.404 9.087
508 H TRP 84 HN TRP 84 -2.813 -14.631 13.247
509 HA TRP 84 HA TRP 84 -4.388 -13.867 10.960
510 1HB TRP 84 HB2 TRP 84 -3.686 -12.510 13.558
511 2HB TRP 84 HB1 TRP 84 -4.574 -11.675 12.287
512 HD1 TRP 84 HD1 TRP 84 -5.316 -13.277 15.362
513 HE1 TRP 84 HE1 TRP 84 -7.677 -14.302 15.411
514 HE3 TRP 84 HE3 TRP 84 -6.301 -13.292 10.345
515 HZ2 TRP 84 HZ2 TRP 84 -9.689 -15.022 13.568
516 HZ3 TRP 84 HZ3 TRP 84 -8.467 -14.166 9.572
517 HH2 TRP 84 HH2 TRP 84 -10.124 -15.013 11.151
518 H CYS 85 HN CYS 85 -2.777 -13.895 9.337
519 HA CYS 85 HA CYS 85 -0.677 -11.878 9.483
520 1HB CYS 85 HB2 CYS 85 0.020 -12.886 7.284
521 2HB CYS 85 HB1 CYS 85 0.056 -13.995 8.651
522 H GLY 86 HN GLY 86 -0.308 -10.717 7.237
523 1HA GLY 86 HA1 GLY 86 -1.421 -8.671 6.511
524 2HA GLY 86 HA2 GLY 86 -2.923 -9.579 6.475
525 H ILE 87 HN ILE 87 -3.114 -8.728 4.297
526 HA ILE 87 HA ILE 87 -2.097 -10.610 2.367
527 HB ILE 87 HB ILE 87 -4.279 -8.701 2.508
528 1HG1 ILE 87 2HG1 ILE 87 -5.422 -10.280 1.230
529 2HG1 ILE 87 1HG1 ILE 87 -3.965 -10.822 0.409
530 1HG2 ILE 87 1HG2 ILE 87 -2.966 -7.385 0.934
531 2HG2 ILE 87 3HG2 ILE 87 -2.791 -8.795 -0.114
532 3HG2 ILE 87 2HG2 ILE 87 -4.382 -8.082 0.147
533 1HD1 ILE 87 2HD1 ILE 87 -4.417 -11.299 3.331
534 2HD1 ILE 87 1HD1 ILE 87 -5.025 -12.390 2.084
535 3HD1 ILE 87 3HD1 ILE 87 -3.293 -12.111 2.238
536 H LYS 88 HN LYS 88 -0.605 -10.286 0.810
537 HA LYS 88 HA LYS 88 1.236 -8.120 1.178
538 1HB LYS 88 HB2 LYS 88 1.307 -10.042 -1.127
539 2HB LYS 88 HB1 LYS 88 2.649 -9.236 -0.330
540 1HG LYS 88 HG2 LYS 88 1.152 -10.966 1.466
541 2HG LYS 88 HG1 LYS 88 1.829 -11.823 0.082
542 1HD LYS 88 HD2 LYS 88 3.944 -10.314 0.768
543 2HD LYS 88 HD1 LYS 88 3.181 -10.499 2.347
544 1HE LYS 88 HE2 LYS 88 4.780 -12.267 2.045
545 2HE LYS 88 HE1 LYS 88 3.155 -12.950 1.997
546 1HZ LYS 88 HZ3 LYS 88 3.592 -12.441 -0.591
547 2HZ LYS 88 HZ2 LYS 88 5.164 -12.807 -0.085
548 3HZ LYS 88 HZ1 LYS 88 3.919 -13.930 0.144
549 H ASN 89 HN ASN 89 2.058 -6.875 -0.719
550 HA ASN 89 HA ASN 89 0.030 -5.294 -1.835
551 1HB ASN 89 HB2 ASN 89 2.959 -5.518 -2.071
552 2HB ASN 89 HB1 ASN 89 2.159 -4.837 -3.486
553 1HD2 ASN 89 1HD2 ASN 89 3.905 -3.348 -2.006
554 2HD2 ASN 89 2HD2 ASN 89 3.049 -2.105 -1.168
555 H SER 90 HN SER 90 1.080 -8.379 -2.747
556 HA SER 90 HA SER 90 0.749 -8.224 -5.541
557 1HB SER 90 HB2 SER 90 1.249 -10.281 -3.548
558 2HB SER 90 HB1 SER 90 0.166 -10.852 -4.818
559 HG SER 90 HG SER 90 1.909 -11.074 -5.959
560 H CYS 91 HN CYS 91 -1.490 -8.596 -2.898
561 HA CYS 91 HA CYS 91 -3.639 -9.404 -4.678
562 1HB CYS 91 HB2 CYS 91 -3.309 -10.268 -2.278
563 2HB CYS 91 HB1 CYS 91 -3.994 -8.724 -1.778
564 H LYS 92 HN LYS 92 -2.891 -7.069 -5.598
565 HA LYS 92 HA LYS 92 -5.099 -5.320 -4.772
566 1HB LYS 92 HB2 LYS 92 -3.727 -3.325 -4.897
567 2HB LYS 92 HB1 LYS 92 -3.063 -4.444 -3.715
568 1HG LYS 92 HG2 LYS 92 -1.321 -5.085 -5.186
569 2HG LYS 92 HG1 LYS 92 -2.053 -4.222 -6.535
570 1HD LYS 92 HD2 LYS 92 -0.695 -2.536 -5.979
571 2HD LYS 92 HD1 LYS 92 -1.796 -2.264 -4.627
572 1HE LYS 92 HE2 LYS 92 -0.397 -3.892 -3.310
573 2HE LYS 92 HE1 LYS 92 0.768 -3.842 -4.636
574 1HZ LYS 92 HZ3 LYS 92 0.257 -1.213 -4.048
575 2HZ LYS 92 HZ2 LYS 92 0.346 -1.963 -2.535
576 3HZ LYS 92 HZ1 LYS 92 1.639 -2.089 -3.617
577 H GLN 93 HN GLN 93 -2.684 -6.019 -7.265
578 HA GLN 93 HA GLN 93 -4.673 -5.673 -9.312
579 1HB GLN 93 HB2 GLN 93 -2.441 -3.683 -8.984
580 2HB GLN 93 HB1 GLN 93 -3.189 -3.975 -10.548
581 1HG GLN 93 HG2 GLN 93 -5.402 -3.466 -9.403
582 2HG GLN 93 HG1 GLN 93 -4.434 -2.846 -8.066
583 1HE2 GLN 93 1HE2 GLN 93 -5.242 -0.764 -8.369
584 2HE2 GLN 93 2HE2 GLN 93 -4.732 0.234 -9.683
585 H GLN 94 HN GLN 94 -4.320 -7.279 -10.667
586 HA GLN 94 HA GLN 94 -1.990 -8.819 -10.718
587 1HB GLN 94 HB2 GLN 94 -3.069 -9.432 -13.133
588 2HB GLN 94 HB1 GLN 94 -3.570 -10.144 -11.610
589 1HG GLN 94 HG2 GLN 94 -4.940 -7.645 -12.319
590 2HG GLN 94 HG1 GLN 94 -5.232 -9.000 -13.404
591 1HE2 GLN 94 1HE2 GLN 94 -4.601 -9.130 -9.942
592 2HE2 GLN 94 2HE2 GLN 94 -6.138 -9.784 -9.503
593 HA PRO 95 HA PRO 95 -0.934 -6.422 -14.870
594 1HB PRO 95 HB2 PRO 95 -1.574 -3.750 -14.674
595 2HB PRO 95 HB1 PRO 95 -2.544 -4.948 -15.539
596 1HG PRO 95 HG2 PRO 95 -2.889 -3.883 -12.759
597 2HG PRO 95 HG1 PRO 95 -4.118 -4.161 -14.009
598 1HD PRO 95 HD2 PRO 95 -3.797 -5.880 -12.016
599 2HD PRO 95 HD1 PRO 95 -4.117 -6.463 -13.661
600 H GLN 96 HN GLN 96 -0.917 -5.098 -11.628
601 HA GLN 96 HA GLN 96 0.607 -3.736 -10.536
602 1HB GLN 96 HB2 GLN 96 2.780 -4.986 -10.275
603 2HB GLN 96 HB1 GLN 96 1.327 -5.905 -9.910
604 1HG GLN 96 HG2 GLN 96 1.701 -7.378 -11.545
605 2HG GLN 96 HG1 GLN 96 2.209 -6.136 -12.686
606 1HE2 GLN 96 1HE2 GLN 96 3.577 -6.819 -9.514
607 2HE2 GLN 96 2HE2 GLN 96 5.138 -7.286 -10.087
608 H ASN 97 HN ASN 97 0.829 -1.825 -11.649
609 HA ASN 97 HA ASN 97 2.078 -1.283 -14.010
610 1HB ASN 97 HB2 ASN 97 2.118 0.390 -11.492
611 2HB ASN 97 HB1 ASN 97 2.554 0.985 -13.092
612 1HD2 ASN 97 1HD2 ASN 97 0.531 2.106 -11.562
613 2HD2 ASN 97 2HD2 ASN 97 -0.982 1.826 -12.345
614 H ASN 98 HN ASN 98 3.976 -2.045 -14.677
615 HA ASN 98 HA ASN 98 6.241 -2.092 -12.818
616 1HB ASN 98 HB2 ASN 98 5.463 -3.657 -15.200
617 2HB ASN 98 HB1 ASN 98 7.183 -3.302 -15.059
618 1HD2 ASN 98 1HD2 ASN 98 4.841 -3.846 -12.481
619 2HD2 ASN 98 2HD2 ASN 98 5.599 -5.262 -11.847
620 H ASN 99 HN ASN 99 8.391 -1.501 -13.730
621 HA ASN 99 HA ASN 99 8.132 0.888 -15.430
622 1HB ASN 99 HB2 ASN 99 10.388 0.278 -13.517
623 2HB ASN 99 HB1 ASN 99 10.043 1.808 -14.316
624 1HD2 ASN 99 1HD2 ASN 99 9.221 -0.323 -11.727
625 2HD2 ASN 99 2HD2 ASN 99 8.168 0.759 -10.889
626 H GLN 100 HN GLN 100 8.383 -0.085 -17.428
627 HA GLN 100 HA GLN 100 11.093 -1.078 -17.979
628 1HB GLN 100 HB2 GLN 100 9.094 -2.829 -17.863
629 2HB GLN 100 HB1 GLN 100 8.818 -2.256 -19.502
630 1HG GLN 100 HG2 GLN 100 11.527 -2.722 -19.452
631 2HG GLN 100 HG1 GLN 100 10.872 -4.024 -18.459
632 1HE2 GLN 100 1HE2 GLN 100 10.516 -5.793 -19.570
633 2HE2 GLN 100 2HE2 GLN 100 9.984 -5.885 -21.212
No H/Q in entry = 633
Start of MODEL 4
1 H1 ALA 1 HT1 ALA 1 5.404 5.231 -7.197
2 H2 ALA 1 HT3 ALA 1 7.014 5.800 -7.048
3 H3 ALA 1 HT2 ALA 1 6.601 4.235 -6.474
4 HA ALA 1 HA ALA 1 5.517 5.002 -4.680
5 1HB ALA 1 HB3 ALA 1 7.212 5.957 -3.574
6 2HB ALA 1 HB1 ALA 1 7.254 7.354 -4.650
7 3HB ALA 1 HB2 ALA 1 8.075 5.862 -5.110
8 H MET 2 HN MET 2 3.667 5.718 -6.395
9 HA MET 2 HA MET 2 2.533 8.059 -5.271
10 1HB MET 2 HB2 MET 2 4.279 8.842 -7.080
11 2HB MET 2 HB1 MET 2 2.988 8.422 -8.198
12 1HG MET 2 HG2 MET 2 1.701 10.165 -7.586
13 2HG MET 2 HG1 MET 2 2.218 10.098 -5.902
14 1HE MET 2 HE1 MET 2 3.952 10.933 -4.914
15 2HE MET 2 HE3 MET 2 5.426 11.594 -5.621
16 3HE MET 2 HE2 MET 2 4.086 12.666 -5.215
17 H ALA 3 HN ALA 3 0.852 6.628 -4.907
18 HA ALA 3 HA ALA 3 -1.045 6.407 -7.070
19 1HB ALA 3 HB1 ALA 3 -0.763 3.795 -5.803
20 2HB ALA 3 HB2 ALA 3 0.655 4.272 -6.736
21 3HB ALA 3 HB3 ALA 3 -0.931 4.215 -7.509
22 H CYS 4 HN CYS 4 -0.821 7.730 -4.520
23 HA CYS 4 HA CYS 4 -2.440 6.382 -2.598
24 1HB CYS 4 HB2 CYS 4 -2.389 8.536 -1.395
25 2HB CYS 4 HB1 CYS 4 -0.783 8.038 -1.910
26 H TRP 5 HN TRP 5 -4.594 6.322 -2.427
27 HA TRP 5 HA TRP 5 -6.282 7.249 -4.454
28 1HB TRP 5 HB2 TRP 5 -8.139 6.727 -2.864
29 2HB TRP 5 HB1 TRP 5 -6.979 5.417 -3.052
30 HD1 TRP 5 HD1 TRP 5 -5.634 4.675 -0.923
31 HE1 TRP 5 HE1 TRP 5 -5.794 5.266 1.582
32 HE3 TRP 5 HE3 TRP 5 -8.701 8.708 -1.278
33 HZ2 TRP 5 HZ2 TRP 5 -7.084 7.206 3.188
34 HZ3 TRP 5 HZ3 TRP 5 -9.369 9.887 0.777
35 HH2 TRP 5 HH2 TRP 5 -8.574 9.148 2.966
36 H ALA 6 HN ALA 6 -4.902 8.902 -1.795
37 HA ALA 6 HA ALA 6 -6.859 10.887 -1.359
38 1HB ALA 6 HB3 ALA 6 -3.877 10.985 -0.927
39 2HB ALA 6 HB2 ALA 6 -5.035 12.160 -0.305
40 3HB ALA 6 HB1 ALA 6 -5.094 10.486 0.249
41 H GLN 7 HN GLN 7 -4.130 10.670 -3.602
42 HA GLN 7 HA GLN 7 -4.377 13.347 -4.538
43 1HB GLN 7 HB2 GLN 7 -2.793 12.741 -6.246
44 2HB GLN 7 HB1 GLN 7 -2.287 12.031 -4.719
45 1HG GLN 7 HG2 GLN 7 -2.578 9.921 -5.447
46 2HG GLN 7 HG1 GLN 7 -3.966 10.337 -6.449
47 1HE2 GLN 7 1HE2 GLN 7 -3.551 9.834 -8.464
48 2HE2 GLN 7 2HE2 GLN 7 -2.071 10.116 -9.307
49 H SER 8 HN SER 8 -6.329 10.670 -4.986
50 HA SER 8 HA SER 8 -7.073 10.985 -7.699
51 1HB SER 8 HB2 SER 8 -7.546 8.927 -6.435
52 2HB SER 8 HB1 SER 8 -8.658 9.818 -5.396
53 HG SER 8 HG SER 8 -10.130 9.676 -6.888
54 H GLN 9 HN GLN 9 -8.064 12.536 -4.725
55 HA GLN 9 HA GLN 9 -10.210 13.953 -6.120
56 1HB GLN 9 HB2 GLN 9 -10.847 14.790 -3.884
57 2HB GLN 9 HB1 GLN 9 -10.825 13.034 -3.966
58 1HG GLN 9 HG2 GLN 9 -8.293 13.632 -3.106
59 2HG GLN 9 HG1 GLN 9 -9.277 14.855 -2.310
60 1HE2 GLN 9 1HE2 GLN 9 -8.388 11.557 -2.434
61 2HE2 GLN 9 2HE2 GLN 9 -9.351 11.012 -1.107
62 H GLY 10 HN GLY 10 -6.977 14.415 -4.986
63 1HA GLY 10 HA1 GLY 10 -7.249 17.333 -5.161
64 2HA GLY 10 HA2 GLY 10 -6.181 16.535 -6.303
65 H TYR 11 HN TYR 11 -6.389 15.190 -3.132
66 HA TYR 11 HA TYR 11 -4.426 16.748 -1.845
67 1HB TYR 11 HB2 TYR 11 -5.658 14.075 -1.378
68 2HB TYR 11 HB1 TYR 11 -4.172 14.453 -0.516
69 HD1 TYR 11 HD1 TYR 11 -7.725 14.970 -0.693
70 HD2 TYR 11 HD2 TYR 11 -4.118 16.491 0.977
71 HE1 TYR 11 HE1 TYR 11 -9.030 16.209 0.979
72 HE2 TYR 11 HE2 TYR 11 -5.411 17.734 2.656
73 HH TYR 11 HH TYR 11 -7.578 17.706 3.705
74 H ASN 12 HN ASN 12 -2.465 15.159 -0.896
75 HA ASN 12 HA ASN 12 -1.013 14.270 -3.301
76 1HB ASN 12 HB2 ASN 12 1.026 15.204 -2.399
77 2HB ASN 12 HB1 ASN 12 -0.205 16.461 -2.442
78 1HD2 ASN 12 1HD2 ASN 12 -0.103 17.721 -0.745
79 2HD2 ASN 12 2HD2 ASN 12 0.270 17.234 0.870
80 H CYS 13 HN CYS 13 0.846 12.798 -2.776
81 HA CYS 13 HA CYS 13 -0.085 10.733 -0.986
82 1HB CYS 13 HB2 CYS 13 2.321 10.827 -2.807
83 2HB CYS 13 HB1 CYS 13 1.754 9.410 -1.937
84 H CYS 14 HN CYS 14 0.949 9.937 0.777
85 HA CYS 14 HA CYS 14 2.926 11.712 2.007
86 1HB CYS 14 HB2 CYS 14 2.200 9.875 3.951
87 2HB CYS 14 HB1 CYS 14 1.579 11.509 3.787
88 H ASN 15 HN ASN 15 4.927 11.127 1.561
89 HA ASN 15 HA ASN 15 6.008 8.816 0.697
90 1HB ASN 15 HB2 ASN 15 8.090 9.483 1.972
91 2HB ASN 15 HB1 ASN 15 7.391 10.740 0.957
92 1HD2 ASN 15 1HD2 ASN 15 7.728 9.591 4.248
93 2HD2 ASN 15 2HD2 ASN 15 7.421 11.110 5.009
94 H ASN 16 HN ASN 16 6.339 6.782 1.447
95 HA ASN 16 HA ASN 16 5.981 4.957 2.783
96 1HB ASN 16 HB2 ASN 16 7.080 5.389 5.175
97 2HB ASN 16 HB1 ASN 16 8.055 5.149 3.730
98 1HD2 ASN 16 1HD2 ASN 16 8.912 7.025 2.677
99 2HD2 ASN 16 2HD2 ASN 16 9.226 8.458 3.588
100 HA PRO 17 HA PRO 17 2.265 6.910 4.858
101 1HB PRO 17 HB2 PRO 17 0.515 5.071 3.809
102 2HB PRO 17 HB1 PRO 17 0.896 6.622 3.054
103 1HG PRO 17 HG2 PRO 17 1.982 3.902 2.450
104 2HG PRO 17 HG1 PRO 17 1.512 5.197 1.333
105 1HD PRO 17 HD2 PRO 17 4.087 4.707 1.938
106 2HD PRO 17 HD1 PRO 17 3.490 6.353 1.643
107 H SER 18 HN SER 18 3.872 3.902 4.829
108 HA SER 18 HA SER 18 2.195 2.567 6.738
109 1HB SER 18 HB2 SER 18 3.993 1.655 4.958
110 2HB SER 18 HB1 SER 18 5.016 1.712 6.394
111 HG SER 18 HG SER 18 3.398 0.442 7.455
112 H SER 19 HN SER 19 4.160 5.175 7.081
113 HA SER 19 HA SER 19 4.621 4.556 9.909
114 1HB SER 19 HB2 SER 19 6.709 4.362 8.340
115 2HB SER 19 HB1 SER 19 6.675 6.126 8.390
116 HG SER 19 HG SER 19 6.708 4.458 10.687
117 H THR 20 HN THR 20 2.858 6.336 8.016
118 HA THR 20 HA THR 20 3.443 8.973 9.042
119 HB THR 20 HB THR 20 1.520 7.808 7.061
120 HG1 THR 20 HG1 THR 20 2.775 8.813 5.718
121 1HG2 THR 20 2HG2 THR 20 1.333 10.590 8.172
122 2HG2 THR 20 1HG2 THR 20 0.526 10.010 6.716
123 3HG2 THR 20 3HG2 THR 20 0.117 9.318 8.285
124 H LYS 21 HN LYS 21 2.165 10.125 10.465
125 HA LYS 21 HA LYS 21 0.471 8.515 12.202
126 1HB LYS 21 HB2 LYS 21 2.197 10.001 13.178
127 2HB LYS 21 HB1 LYS 21 1.365 11.389 12.490
128 1HG LYS 21 HG2 LYS 21 -0.156 9.553 14.268
129 2HG LYS 21 HG1 LYS 21 0.998 10.679 14.987
130 1HD LYS 21 HD2 LYS 21 -0.323 12.310 13.264
131 2HD LYS 21 HD1 LYS 21 -1.606 11.187 13.719
132 1HE LYS 21 HE2 LYS 21 -1.883 12.535 15.489
133 2HE LYS 21 HE1 LYS 21 -0.456 11.723 16.132
134 1HZ LYS 21 HZ3 LYS 21 -0.387 14.224 14.531
135 2HZ LYS 21 HZ2 LYS 21 -0.311 14.165 16.220
136 3HZ LYS 21 HZ1 LYS 21 0.925 13.477 15.294
137 H VAL 22 HN VAL 22 -1.651 8.408 11.820
138 HA VAL 22 HA VAL 22 -2.941 10.415 10.192
139 HB VAL 22 HB VAL 22 -4.010 7.828 11.335
140 1HG1 VAL 22 1HG1 VAL 22 -5.389 10.029 10.254
141 2HG1 VAL 22 3HG1 VAL 22 -5.420 8.761 9.030
142 3HG1 VAL 22 2HG1 VAL 22 -6.030 8.436 10.653
143 1HG2 VAL 22 3HG2 VAL 22 -2.127 7.738 9.608
144 2HG2 VAL 22 2HG2 VAL 22 -3.588 6.808 9.274
145 3HG2 VAL 22 1HG2 VAL 22 -3.320 8.352 8.463
146 H GLU 23 HN GLU 23 -3.237 12.184 11.449
147 HA GLU 23 HA GLU 23 -4.445 11.913 14.082
148 1HB GLU 23 HB2 GLU 23 -4.376 14.518 13.883
149 2HB GLU 23 HB1 GLU 23 -2.882 13.631 14.149
150 1HG GLU 23 HG2 GLU 23 -2.247 13.858 11.870
151 2HG GLU 23 HG1 GLU 23 -3.836 14.484 11.429
152 H TYR 24 HN TYR 24 -5.480 11.840 10.983
153 HA TYR 24 HA TYR 24 -8.148 12.807 11.767
154 1HB TYR 24 HB2 TYR 24 -6.840 14.492 10.340
155 2HB TYR 24 HB1 TYR 24 -7.061 13.352 9.017
156 HD1 TYR 24 HD1 TYR 24 -9.384 12.792 8.260
157 HD2 TYR 24 HD2 TYR 24 -8.594 15.919 11.035
158 HE1 TYR 24 HE1 TYR 24 -11.610 13.739 7.811
159 HE2 TYR 24 HE2 TYR 24 -10.817 16.877 10.595
160 HH TYR 24 HH TYR 24 -12.757 15.901 7.983
161 H THR 25 HN THR 25 -9.792 11.515 11.192
162 HA THR 25 HA THR 25 -9.546 9.695 8.964
163 HB THR 25 HB THR 25 -10.191 8.453 11.623
164 HG1 THR 25 HG1 THR 25 -8.169 8.411 12.126
165 1HG2 THR 25 1HG2 THR 25 -10.129 7.519 8.955
166 2HG2 THR 25 3HG2 THR 25 -8.809 6.747 9.835
167 3HG2 THR 25 2HG2 THR 25 -10.463 6.616 10.435
168 H ASP 26 HN ASP 26 -11.365 10.085 7.933
169 HA ASP 26 HA ASP 26 -13.869 10.176 9.482
170 1HB ASP 26 HB2 ASP 26 -12.869 12.328 8.229
171 2HB ASP 26 HB1 ASP 26 -13.731 11.605 6.875
172 H ALA 27 HN ALA 27 -15.306 10.424 6.826
173 HA ALA 27 HA ALA 27 -15.491 7.576 6.343
174 1HB ALA 27 HB3 ALA 27 -17.615 8.368 6.325
175 2HB ALA 27 HB1 ALA 27 -17.260 8.580 4.610
176 3HB ALA 27 HB2 ALA 27 -17.139 9.952 5.713
177 H SER 28 HN SER 28 -13.338 9.698 5.280
178 HA SER 28 HA SER 28 -13.390 8.809 2.484
179 1HB SER 28 HB2 SER 28 -11.284 10.706 3.196
180 2HB SER 28 HB1 SER 28 -12.501 10.805 1.925
181 HG SER 28 HG SER 28 -12.666 12.436 3.600
182 H GLY 29 HN GLY 29 -11.721 8.471 5.482
183 1HA GLY 29 HA1 GLY 29 -9.516 7.040 4.157
184 2HA GLY 29 HA2 GLY 29 -10.464 6.243 5.404
185 H GLN 30 HN GLN 30 -7.591 6.873 5.328
186 HA GLN 30 HA GLN 30 -7.469 8.332 7.872
187 1HB GLN 30 HB2 GLN 30 -5.962 6.083 6.683
188 2HB GLN 30 HB1 GLN 30 -5.007 7.230 7.612
189 1HG GLN 30 HG2 GLN 30 -6.566 6.908 9.510
190 2HG GLN 30 HG1 GLN 30 -7.383 5.657 8.574
191 1HE2 GLN 30 1HE2 GLN 30 -5.592 4.119 7.538
192 2HE2 GLN 30 2HE2 GLN 30 -4.502 3.459 8.704
193 H TRP 31 HN TRP 31 -6.361 10.202 8.068
194 HA TRP 31 HA TRP 31 -4.633 11.031 5.840
195 1HB TRP 31 HB2 TRP 31 -6.551 12.896 7.240
196 2HB TRP 31 HB1 TRP 31 -5.553 13.248 5.835
197 HD1 TRP 31 HD1 TRP 31 -8.609 11.090 6.810
198 HE1 TRP 31 HE1 TRP 31 -10.050 10.758 4.705
199 HE3 TRP 31 HE3 TRP 31 -5.565 13.354 3.386
200 HZ2 TRP 31 HZ2 TRP 31 -9.912 11.384 1.946
201 HZ3 TRP 31 HZ3 TRP 31 -6.291 13.443 1.038
202 HH2 TRP 31 HH2 TRP 31 -8.418 12.478 0.335
203 H GLY 32 HN GLY 32 -3.028 12.611 6.390
204 1HA GLY 32 HA1 GLY 32 -1.565 12.106 8.647
205 2HA GLY 32 HA2 GLY 32 -2.643 13.412 9.115
206 H VAL 33 HN VAL 33 -0.443 14.414 9.436
207 HA VAL 33 HA VAL 33 0.286 15.842 6.973
208 HB VAL 33 HB VAL 33 0.772 16.629 9.851
209 1HG1 VAL 33 1HG1 VAL 33 2.513 17.436 8.305
210 2HG1 VAL 33 3HG1 VAL 33 1.262 18.199 7.322
211 3HG1 VAL 33 2HG1 VAL 33 1.544 18.752 8.973
212 1HG2 VAL 33 1HG2 VAL 33 -1.271 17.484 7.821
213 2HG2 VAL 33 3HG2 VAL 33 -1.532 16.881 9.457
214 3HG2 VAL 33 2HG2 VAL 33 -0.847 18.487 9.208
215 H GLN 34 HN GLN 34 1.954 14.849 6.014
216 HA GLN 34 HA GLN 34 4.196 13.962 7.700
217 1HB GLN 34 HB2 GLN 34 2.954 12.369 6.038
218 2HB GLN 34 HB1 GLN 34 3.912 13.196 4.815
219 1HG GLN 34 HG2 GLN 34 5.945 12.503 5.827
220 2HG GLN 34 HG1 GLN 34 5.096 11.880 7.241
221 1HE2 GLN 34 1HE2 GLN 34 6.149 9.877 6.859
222 2HE2 GLN 34 2HE2 GLN 34 5.557 8.786 5.654
223 H ASN 35 HN ASN 35 6.190 14.806 7.424
224 HA ASN 35 HA ASN 35 7.699 16.441 6.916
225 1HB ASN 35 HB2 ASN 35 8.462 16.386 4.649
226 2HB ASN 35 HB1 ASN 35 7.903 14.764 5.053
227 1HD2 ASN 35 1HD2 ASN 35 7.230 17.665 3.246
228 2HD2 ASN 35 2HD2 ASN 35 6.057 16.969 2.187
229 H GLY 36 HN GLY 36 4.908 17.355 7.290
230 1HA GLY 36 HA1 GLY 36 5.301 20.047 6.351
231 2HA GLY 36 HA2 GLY 36 3.976 19.473 7.349
232 H GLN 37 HN GLN 37 3.000 17.441 5.641
233 HA GLN 37 HA GLN 37 1.598 19.109 3.724
234 1HB GLN 37 HB2 GLN 37 2.060 17.700 1.807
235 2HB GLN 37 HB1 GLN 37 3.572 18.302 2.475
236 1HG GLN 37 HG2 GLN 37 4.322 16.257 2.910
237 2HG GLN 37 HG1 GLN 37 2.785 15.742 3.600
238 1HE2 GLN 37 1HE2 GLN 37 2.463 13.844 2.635
239 2HE2 GLN 37 2HE2 GLN 37 2.372 13.601 0.927
240 H TRP 38 HN TRP 38 -0.435 18.356 3.196
241 HA TRP 38 HA TRP 38 -1.530 16.350 4.950
242 1HB TRP 38 HB2 TRP 38 -2.624 18.312 2.987
243 2HB TRP 38 HB1 TRP 38 -3.618 16.919 3.398
244 HD1 TRP 38 HD1 TRP 38 -3.598 20.280 4.286
245 HE1 TRP 38 HE1 TRP 38 -4.277 20.721 6.730
246 HE3 TRP 38 HE3 TRP 38 -2.919 15.580 6.177
247 HZ2 TRP 38 HZ2 TRP 38 -4.498 19.266 9.139
248 HZ3 TRP 38 HZ3 TRP 38 -3.387 15.188 8.561
249 HH2 TRP 38 HH2 TRP 38 -4.160 16.995 10.010
250 H CYS 39 HN CYS 39 -2.542 14.407 4.318
251 HA CYS 39 HA CYS 39 -2.681 13.495 1.640
252 1HB CYS 39 HB2 CYS 39 -0.337 13.341 1.593
253 2HB CYS 39 HB1 CYS 39 -0.266 12.679 3.225
254 H GLY 40 HN GLY 40 -3.476 11.368 1.442
255 1HA GLY 40 HA1 GLY 40 -5.121 9.857 2.209
256 2HA GLY 40 HA2 GLY 40 -4.771 10.361 3.863
257 H ILE 41 HN ILE 41 -4.007 8.587 4.926
258 HA ILE 41 HA ILE 41 -1.513 7.490 4.118
259 HB ILE 41 HB ILE 41 -3.378 6.908 6.386
260 1HG1 ILE 41 2HG1 ILE 41 -1.458 7.632 7.708
261 2HG1 ILE 41 1HG1 ILE 41 -0.474 7.733 6.253
262 1HG2 ILE 41 2HG2 ILE 41 -0.948 5.306 5.621
263 2HG2 ILE 41 1HG2 ILE 41 -1.711 5.256 7.211
264 3HG2 ILE 41 3HG2 ILE 41 -2.606 4.721 5.788
265 1HD1 ILE 41 1HD1 ILE 41 -2.972 9.324 6.388
266 2HD1 ILE 41 3HD1 ILE 41 -1.567 9.860 7.308
267 3HD1 ILE 41 2HD1 ILE 41 -1.453 9.664 5.557
268 H ASP 42 HN ASP 42 -1.369 6.257 2.404
269 HA ASP 42 HA ASP 42 -3.202 3.964 2.161
270 1HB ASP 42 HB2 ASP 42 -1.862 5.099 -0.260
271 2HB ASP 42 HB1 ASP 42 -3.386 4.228 -0.132
272 H TYR 43 HN TYR 43 -1.893 2.449 3.099
273 HA TYR 43 HA TYR 43 0.873 2.239 2.836
274 1HB TYR 43 HB2 TYR 43 -1.049 -0.063 3.219
275 2HB TYR 43 HB1 TYR 43 0.656 -0.033 3.650
276 HD1 TYR 43 HD1 TYR 43 0.254 3.002 4.679
277 HD2 TYR 43 HD2 TYR 43 -1.537 -0.761 5.541
278 HE1 TYR 43 HE1 TYR 43 -0.332 3.802 6.932
279 HE2 TYR 43 HE2 TYR 43 -2.128 0.030 7.792
280 HH TYR 43 HH TYR 43 -2.469 2.090 8.991
281 H SER 44 HN SER 44 -1.582 1.515 0.548
282 HA SER 44 HA SER 44 0.376 0.092 -1.129
283 1HB SER 44 HB2 SER 44 -2.475 -0.096 -1.873
284 2HB SER 44 HB1 SER 44 -1.230 -1.344 -1.842
285 HG SER 44 HG SER 44 -2.826 -0.382 0.277
286 H TYR 45 HN TYR 45 0.633 2.781 -1.172
287 HA TYR 45 HA TYR 45 -0.973 3.845 -3.337
288 1HB TYR 45 HB2 TYR 45 -0.383 5.911 -2.623
289 2HB TYR 45 HB1 TYR 45 0.025 5.048 -1.150
290 HD1 TYR 45 HD1 TYR 45 2.572 3.754 -2.143
291 HD2 TYR 45 HD2 TYR 45 1.116 7.734 -2.468
292 HE1 TYR 45 HE1 TYR 45 4.876 4.578 -2.303
293 HE2 TYR 45 HE2 TYR 45 3.423 8.573 -2.615
294 HH TYR 45 HH TYR 45 6.145 6.594 -1.953
295 H GLY 46 HN GLY 46 0.971 1.620 -3.792
296 1HA GLY 46 HA1 GLY 46 2.117 2.729 -6.207
297 2HA GLY 46 HA2 GLY 46 2.103 1.037 -5.739
298 H GLN 47 HN GLN 47 3.590 0.448 -3.922
299 HA GLN 47 HA GLN 47 6.072 2.026 -4.106
300 1HB GLN 47 HB2 GLN 47 4.629 0.980 -1.795
301 2HB GLN 47 HB1 GLN 47 6.314 0.480 -1.815
302 1HG GLN 47 HG2 GLN 47 6.307 3.206 -2.464
303 2HG GLN 47 HG1 GLN 47 5.172 3.014 -1.129
304 1HE2 GLN 47 1HE2 GLN 47 8.148 1.253 -1.875
305 2HE2 GLN 47 2HE2 GLN 47 8.961 1.652 -0.404
306 H ASN 48 HN ASN 48 8.072 0.714 -3.774
307 HA ASN 48 HA ASN 48 8.142 -1.444 -5.585
308 1HB ASN 48 HB2 ASN 48 10.094 -0.277 -3.632
309 2HB ASN 48 HB1 ASN 48 10.464 -1.812 -4.411
310 1HD2 ASN 48 1HD2 ASN 48 9.026 1.269 -5.440
311 2HD2 ASN 48 2HD2 ASN 48 10.050 1.481 -6.815
312 H GLN 49 HN GLN 49 8.682 -3.676 -5.154
313 HA GLN 49 HA GLN 49 7.256 -4.662 -2.830
314 1HB GLN 49 HB2 GLN 49 7.106 -6.718 -3.921
315 2HB GLN 49 HB1 GLN 49 7.044 -5.559 -5.235
316 1HG GLN 49 HG2 GLN 49 9.751 -6.377 -4.670
317 2HG GLN 49 HG1 GLN 49 8.704 -7.755 -5.005
318 1HE2 GLN 49 1HE2 GLN 49 6.964 -6.622 -6.825
319 2HE2 GLN 49 2HE2 GLN 49 7.827 -6.224 -8.267
320 H GLY 50 HN GLY 50 10.006 -3.386 -2.701
321 1HA GLY 50 HA1 GLY 50 11.792 -3.612 -1.283
322 2HA GLY 50 HA2 GLY 50 12.060 -5.102 -2.169
323 H ASN 51 HN ASN 51 9.123 -4.806 -0.384
324 HA ASN 51 HA ASN 51 8.293 -6.242 1.204
325 1HB ASN 51 HB2 ASN 51 10.474 -7.664 0.449
326 2HB ASN 51 HB1 ASN 51 10.897 -7.295 2.119
327 1HD2 ASN 51 1HD2 ASN 51 8.551 -7.390 3.415
328 2HD2 ASN 51 2HD2 ASN 51 7.857 -8.969 3.315
329 H GLU 52 HN GLU 52 9.259 -3.539 1.525
330 HA GLU 52 HA GLU 52 10.668 -3.100 3.888
331 1HB GLU 52 HB2 GLU 52 8.364 -1.373 2.996
332 2HB GLU 52 HB1 GLU 52 9.827 -0.884 3.840
333 1HG GLU 52 HG2 GLU 52 10.605 -2.076 1.393
334 2HG GLU 52 HG1 GLU 52 9.308 -0.933 1.049
335 H SER 53 HN SER 53 7.371 -4.049 3.331
336 HA SER 53 HA SER 53 7.032 -4.758 6.091
337 1HB SER 53 HB2 SER 53 6.338 -2.186 5.563
338 2HB SER 53 HB1 SER 53 4.818 -3.007 5.208
339 HG SER 53 HG SER 53 4.664 -2.701 7.329
340 H CYS 54 HN CYS 54 4.373 -5.170 6.232
341 HA CYS 54 HA CYS 54 3.531 -6.584 3.832
342 1HB CYS 54 HB2 CYS 54 4.269 -8.524 4.696
343 2HB CYS 54 HB1 CYS 54 4.458 -7.857 6.305
344 H THR 55 HN THR 55 1.252 -7.388 4.092
345 HA THR 55 HA THR 55 -0.309 -5.278 5.341
346 HB THR 55 HB THR 55 -0.975 -7.496 3.413
347 HG1 THR 55 HG1 THR 55 -1.368 -5.725 2.034
348 1HG2 THR 55 3HG2 THR 55 -2.793 -6.099 5.141
349 2HG2 THR 55 2HG2 THR 55 -3.090 -5.655 3.457
350 3HG2 THR 55 1HG2 THR 55 -3.127 -7.350 3.941
351 H GLY 56 HN GLY 56 -1.826 -5.625 6.939
352 1HA GLY 56 HA1 GLY 56 -2.079 -8.353 7.990
353 2HA GLY 56 HA2 GLY 56 -3.152 -7.011 8.351
354 H ASN 57 HN ASN 57 -0.285 -5.582 8.562
355 HA ASN 57 HA ASN 57 0.611 -6.613 11.097
356 1HB ASN 57 HB2 ASN 57 1.377 -4.076 9.638
357 2HB ASN 57 HB1 ASN 57 2.198 -4.728 11.052
358 1HD2 ASN 57 1HD2 ASN 57 2.105 -7.456 10.316
359 2HD2 ASN 57 2HD2 ASN 57 3.174 -7.677 8.980
360 H GLY 58 HN GLY 58 -2.093 -4.985 10.371
361 1HA GLY 58 HA1 GLY 58 -3.419 -3.437 11.459
362 2HA GLY 58 HA2 GLY 58 -1.998 -2.888 12.337
363 H SER 59 HN SER 59 -3.149 -6.211 12.225
364 HA SER 59 HA SER 59 -3.179 -6.327 15.092
365 1HB SER 59 HB2 SER 59 -5.780 -6.477 13.565
366 2HB SER 59 HB1 SER 59 -5.589 -7.072 15.214
367 HG SER 59 HG SER 59 -6.259 -4.702 14.626
368 H TYR 60 HN TYR 60 -4.113 -7.916 12.070
369 HA TYR 60 HA TYR 60 -3.826 -10.549 13.260
370 1HB TYR 60 HB2 TYR 60 -4.074 -10.641 10.391
371 2HB TYR 60 HB1 TYR 60 -5.193 -11.213 11.619
372 HD1 TYR 60 HD1 TYR 60 -4.880 -9.138 8.880
373 HD2 TYR 60 HD2 TYR 60 -6.544 -9.172 12.791
374 HE1 TYR 60 HE1 TYR 60 -6.469 -7.390 8.207
375 HE2 TYR 60 HE2 TYR 60 -8.139 -7.418 12.134
376 HH TYR 60 HH TYR 60 -7.815 -5.584 9.359
377 HA PRO 61 HA PRO 61 0.197 -11.393 11.556
378 1HB PRO 61 HB2 PRO 61 0.115 -13.922 10.776
379 2HB PRO 61 HB1 PRO 61 -0.273 -13.503 12.450
380 1HG PRO 61 HG2 PRO 61 -2.112 -14.180 10.191
381 2HG PRO 61 HG1 PRO 61 -2.219 -14.639 11.900
382 1HD PRO 61 HD2 PRO 61 -3.582 -12.521 10.676
383 2HD PRO 61 HD1 PRO 61 -3.369 -12.748 12.423
384 H CYS 62 HN CYS 62 1.477 -12.323 9.631
385 HA CYS 62 HA CYS 62 0.448 -11.107 7.211
386 1HB CYS 62 HB2 CYS 62 3.098 -12.309 7.987
387 2HB CYS 62 HB1 CYS 62 2.736 -11.909 6.312
388 H CYS 63 HN CYS 63 0.789 -12.348 5.104
389 HA CYS 63 HA CYS 63 -0.307 -15.049 5.461
390 1HB CYS 63 HB2 CYS 63 -1.145 -12.889 3.878
391 2HB CYS 63 HB1 CYS 63 -0.465 -14.055 2.752
392 H ASN 64 HN ASN 64 1.969 -13.222 3.477
393 HA ASN 64 HA ASN 64 4.029 -13.798 2.666
394 1HB ASN 64 HB2 ASN 64 3.615 -16.639 3.583
395 2HB ASN 64 HB1 ASN 64 5.131 -15.793 3.295
396 1HD2 ASN 64 1HD2 ASN 64 2.655 -16.511 5.533
397 2HD2 ASN 64 2HD2 ASN 64 3.312 -15.653 6.883
398 H THR 65 HN THR 65 1.221 -14.411 1.525
399 HA THR 65 HA THR 65 2.172 -16.065 -0.705
400 HB THR 65 HB THR 65 0.342 -17.071 0.662
401 HG1 THR 65 HG1 THR 65 -0.447 -17.918 -1.098
402 1HG2 THR 65 3HG2 THR 65 -1.169 -14.656 -0.269
403 2HG2 THR 65 2HG2 THR 65 -1.968 -16.158 0.196
404 3HG2 THR 65 1HG2 THR 65 -0.987 -15.282 1.370
405 H CYS 66 HN CYS 66 1.875 -15.306 -2.774
406 HA CYS 66 HA CYS 66 1.113 -12.496 -2.957
407 1HB CYS 66 HB2 CYS 66 2.261 -14.153 -5.196
408 2HB CYS 66 HB1 CYS 66 2.299 -12.401 -5.000
409 H GLN 67 HN GLN 67 -0.913 -14.362 -2.513
410 HA GLN 67 HA GLN 67 -2.461 -14.089 -4.994
411 1HB GLN 67 HB2 GLN 67 -2.331 -16.377 -4.979
412 2HB GLN 67 HB1 GLN 67 -2.025 -16.456 -3.253
413 1HG GLN 67 HG2 GLN 67 -4.728 -15.578 -3.823
414 2HG GLN 67 HG1 GLN 67 -4.364 -17.130 -4.570
415 1HE2 GLN 67 1HE2 GLN 67 -2.963 -15.909 -1.584
416 2HE2 GLN 67 2HE2 GLN 67 -3.672 -17.099 -0.551
417 H ALA 68 HN ALA 68 -3.366 -12.174 -4.314
418 HA ALA 68 HA ALA 68 -4.626 -11.996 -1.727
419 1HB ALA 68 HB2 ALA 68 -3.965 -10.115 -3.902
420 2HB ALA 68 HB1 ALA 68 -5.351 -9.713 -2.888
421 3HB ALA 68 HB3 ALA 68 -3.766 -9.960 -2.156
422 H THR 69 HN THR 69 -6.544 -12.747 -1.373
423 HA THR 69 HA THR 69 -8.404 -13.173 -3.572
424 HB THR 69 HB THR 69 -8.641 -15.059 -2.355
425 HG1 THR 69 HG1 THR 69 -10.624 -13.864 -1.974
426 1HG2 THR 69 2HG2 THR 69 -7.843 -13.575 0.137
427 2HG2 THR 69 1HG2 THR 69 -8.177 -15.306 0.029
428 3HG2 THR 69 3HG2 THR 69 -6.808 -14.614 -0.846
429 H TYR 70 HN TYR 70 -7.855 -10.926 -1.024
430 HA TYR 70 HA TYR 70 -10.189 -9.435 -1.856
431 1HB TYR 70 HB2 TYR 70 -11.506 -9.730 -0.055
432 2HB TYR 70 HB1 TYR 70 -10.528 -11.160 0.242
433 HD1 TYR 70 HD1 TYR 70 -9.630 -11.435 2.343
434 HD2 TYR 70 HD2 TYR 70 -10.508 -7.491 1.008
435 HE1 TYR 70 HE1 TYR 70 -9.000 -10.553 4.550
436 HE2 TYR 70 HE2 TYR 70 -9.878 -6.599 3.210
437 HH TYR 70 HH TYR 70 -9.770 -7.500 5.600
438 H THR 71 HN THR 71 -9.801 -7.311 -1.843
439 HA THR 71 HA THR 71 -7.522 -6.334 -0.249
440 HB THR 71 HB THR 71 -8.451 -5.366 -2.961
441 HG1 THR 71 HG1 THR 71 -6.388 -6.138 -3.602
442 1HG2 THR 71 1HG2 THR 71 -7.273 -3.773 -1.133
443 2HG2 THR 71 3HG2 THR 71 -5.857 -4.479 -1.913
444 3HG2 THR 71 2HG2 THR 71 -7.055 -3.615 -2.876
445 H ASP 72 HN ASP 72 -8.267 -5.183 1.403
446 HA ASP 72 HA ASP 72 -9.986 -2.934 0.930
447 1HB ASP 72 HB2 ASP 72 -11.529 -4.974 1.156
448 2HB ASP 72 HB1 ASP 72 -11.064 -4.981 2.855
449 H GLY 73 HN GLY 73 -10.200 -1.539 2.756
450 1HA GLY 73 HA1 GLY 73 -8.780 -2.206 5.190
451 2HA GLY 73 HA2 GLY 73 -9.664 -0.723 4.869
452 H ASP 74 HN ASP 74 -6.661 -2.442 4.086
453 HA ASP 74 HA ASP 74 -5.383 0.195 3.745
454 1HB ASP 74 HB2 ASP 74 -3.321 -0.824 4.710
455 2HB ASP 74 HB1 ASP 74 -4.660 -0.731 5.849
456 H GLY 75 HN GLY 75 -5.820 -3.001 2.513
457 1HA GLY 75 HA1 GLY 75 -3.561 -3.137 0.826
458 2HA GLY 75 HA2 GLY 75 -4.890 -2.376 -0.036
459 H ASP 76 HN ASP 76 -3.436 -5.032 -0.204
460 HA ASP 76 HA ASP 76 -5.775 -6.597 -0.817
461 1HB ASP 76 HB2 ASP 76 -2.920 -7.520 -1.069
462 2HB ASP 76 HB1 ASP 76 -4.326 -8.050 -1.984
463 H TRP 77 HN TRP 77 -5.681 -8.996 -0.277
464 HA TRP 77 HA TRP 77 -4.438 -9.712 2.214
465 1HB TRP 77 HB2 TRP 77 -7.451 -9.507 2.096
466 2HB TRP 77 HB1 TRP 77 -6.512 -10.144 3.439
467 HD1 TRP 77 HD1 TRP 77 -7.448 -6.837 1.748
468 HE1 TRP 77 HE1 TRP 77 -6.913 -4.913 3.360
469 HE3 TRP 77 HE3 TRP 77 -5.019 -9.483 5.381
470 HZ2 TRP 77 HZ2 TRP 77 -5.636 -4.560 5.840
471 HZ3 TRP 77 HZ3 TRP 77 -4.171 -8.273 7.339
472 HH2 TRP 77 HH2 TRP 77 -4.472 -5.857 7.567
473 H ALA 78 HN ALA 78 -4.633 -11.916 2.719
474 HA ALA 78 HA ALA 78 -5.964 -13.607 0.749
475 1HB ALA 78 HB3 ALA 78 -3.035 -13.755 1.441
476 2HB ALA 78 HB2 ALA 78 -3.915 -15.035 0.603
477 3HB ALA 78 HB1 ALA 78 -3.760 -13.441 -0.137
478 H PHE 79 HN PHE 79 -6.186 -15.847 1.452
479 HA PHE 79 HA PHE 79 -6.223 -16.052 4.390
480 1HB PHE 79 HB2 PHE 79 -8.439 -16.063 3.140
481 2HB PHE 79 HB1 PHE 79 -7.958 -17.627 2.490
482 HD1 PHE 79 HD1 PHE 79 -9.041 -19.364 3.504
483 HD2 PHE 79 HD2 PHE 79 -7.852 -16.029 5.864
484 HE1 PHE 79 HE1 PHE 79 -9.931 -20.473 5.512
485 HE2 PHE 79 HE2 PHE 79 -8.738 -17.132 7.877
486 HZ PHE 79 HZ PHE 79 -9.779 -19.357 7.703
487 H GLU 80 HN GLU 80 -4.501 -17.190 5.019
488 HA GLU 80 HA GLU 80 -4.021 -19.778 3.704
489 1HB GLU 80 HB2 GLU 80 -1.692 -19.498 3.722
490 2HB GLU 80 HB1 GLU 80 -2.307 -17.951 3.162
491 1HG GLU 80 HG2 GLU 80 -1.096 -16.976 4.733
492 2HG GLU 80 HG1 GLU 80 -2.148 -17.716 5.938
493 H ASN 81 HN ASN 81 -3.219 -21.447 5.056
494 HA ASN 81 HA ASN 81 -3.279 -22.702 6.955
495 1HB ASN 81 HB2 ASN 81 -1.996 -20.140 7.803
496 2HB ASN 81 HB1 ASN 81 -2.391 -21.334 9.036
497 1HD2 ASN 81 1HD2 ASN 81 0.176 -20.303 7.843
498 2HD2 ASN 81 2HD2 ASN 81 1.051 -21.730 7.420
499 H GLY 82 HN GLY 82 -5.668 -21.041 6.246
500 1HA GLY 82 HA1 GLY 82 -7.258 -21.702 8.495
501 2HA GLY 82 HA2 GLY 82 -7.780 -20.766 7.102
502 H ASN 83 HN ASN 83 -6.003 -18.601 7.300
503 HA ASN 83 HA ASN 83 -7.241 -17.188 9.516
504 1HB ASN 83 HB2 ASN 83 -5.078 -16.277 10.320
505 2HB ASN 83 HB1 ASN 83 -5.214 -18.015 10.564
506 1HD2 ASN 83 1HD2 ASN 83 -3.329 -18.938 10.274
507 2HD2 ASN 83 2HD2 ASN 83 -2.193 -18.572 9.026
508 H TRP 84 HN TRP 84 -7.541 -15.042 9.123
509 HA TRP 84 HA TRP 84 -7.188 -14.149 6.421
510 1HB TRP 84 HB2 TRP 84 -8.479 -13.076 8.884
511 2HB TRP 84 HB1 TRP 84 -8.055 -11.931 7.617
512 HD1 TRP 84 HD1 TRP 84 -11.000 -13.467 8.672
513 HE1 TRP 84 HE1 TRP 84 -12.617 -14.046 6.755
514 HE3 TRP 84 HE3 TRP 84 -7.735 -13.201 4.747
515 HZ2 TRP 84 HZ2 TRP 84 -12.521 -14.351 3.950
516 HZ3 TRP 84 HZ3 TRP 84 -8.578 -13.651 2.479
517 HH2 TRP 84 HH2 TRP 84 -10.921 -14.214 2.090
518 H CYS 85 HN CYS 85 -5.073 -13.875 5.924
519 HA CYS 85 HA CYS 85 -3.523 -11.989 7.566
520 1HB CYS 85 HB2 CYS 85 -1.665 -13.053 5.907
521 2HB CYS 85 HB1 CYS 85 -2.032 -13.690 7.503
522 H GLY 86 HN GLY 86 -1.835 -10.753 6.204
523 1HA GLY 86 HA1 GLY 86 -2.129 -8.742 4.897
524 2HA GLY 86 HA2 GLY 86 -3.274 -9.619 3.894
525 H ILE 87 HN ILE 87 -2.040 -8.921 2.050
526 HA ILE 87 HA ILE 87 -0.021 -10.837 1.334
527 HB ILE 87 HB ILE 87 -1.781 -9.008 -0.067
528 1HG1 ILE 87 2HG1 ILE 87 -1.792 -10.681 -1.718
529 2HG1 ILE 87 1HG1 ILE 87 -0.184 -11.245 -1.287
530 1HG2 ILE 87 1HG2 ILE 87 0.242 -7.731 -0.517
531 2HG2 ILE 87 3HG2 ILE 87 1.035 -9.188 -1.122
532 3HG2 ILE 87 2HG2 ILE 87 -0.352 -8.518 -1.980
533 1HD1 ILE 87 2HD1 ILE 87 -2.645 -11.570 0.408
534 2HD1 ILE 87 1HD1 ILE 87 -1.955 -12.802 -0.650
535 3HD1 ILE 87 3HD1 ILE 87 -1.043 -12.226 0.741
536 H LYS 88 HN LYS 88 2.107 -10.586 1.174
537 HA LYS 88 HA LYS 88 3.415 -8.476 2.540
538 1HB LYS 88 HB2 LYS 88 4.785 -10.317 0.595
539 2HB LYS 88 HB1 LYS 88 5.421 -9.611 2.074
540 1HG LYS 88 HG2 LYS 88 3.339 -11.778 1.889
541 2HG LYS 88 HG1 LYS 88 5.026 -11.980 2.357
542 1HD LYS 88 HD2 LYS 88 3.551 -9.964 3.887
543 2HD LYS 88 HD1 LYS 88 2.971 -11.615 4.093
544 1HE LYS 88 HE2 LYS 88 4.577 -11.490 5.740
545 2HE LYS 88 HE1 LYS 88 5.499 -12.169 4.400
546 1HZ LYS 88 HZ2 LYS 88 5.830 -9.546 3.999
547 2HZ LYS 88 HZ1 LYS 88 5.736 -9.588 5.687
548 3HZ LYS 88 HZ3 LYS 88 6.904 -10.509 4.880
549 H ASN 89 HN ASN 89 4.907 -6.940 1.713
550 HA ASN 89 HA ASN 89 3.998 -5.506 -0.529
551 1HB ASN 89 HB2 ASN 89 6.200 -5.291 1.407
552 2HB ASN 89 HB1 ASN 89 6.574 -4.618 -0.177
553 1HD2 ASN 89 1HD2 ASN 89 6.587 -2.855 1.731
554 2HD2 ASN 89 2HD2 ASN 89 5.162 -1.877 1.744
555 H SER 90 HN SER 90 6.333 -8.047 -0.140
556 HA SER 90 HA SER 90 7.743 -7.726 -2.575
557 1HB SER 90 HB2 SER 90 7.517 -9.735 -0.450
558 2HB SER 90 HB1 SER 90 7.826 -10.432 -2.041
559 HG SER 90 HG SER 90 9.334 -8.253 -1.063
560 H CYS 91 HN CYS 91 4.697 -9.114 -1.758
561 HA CYS 91 HA CYS 91 4.399 -10.423 -4.329
562 1HB CYS 91 HB2 CYS 91 2.568 -10.230 -1.934
563 2HB CYS 91 HB1 CYS 91 2.188 -11.115 -3.406
564 H LYS 92 HN LYS 92 4.756 -7.830 -4.799
565 HA LYS 92 HA LYS 92 2.106 -6.629 -5.169
566 1HB LYS 92 HB2 LYS 92 4.891 -5.547 -5.066
567 2HB LYS 92 HB1 LYS 92 3.673 -4.665 -5.977
568 1HG LYS 92 HG2 LYS 92 2.269 -4.581 -3.946
569 2HG LYS 92 HG1 LYS 92 3.574 -5.363 -3.051
570 1HD LYS 92 HD2 LYS 92 4.442 -3.031 -4.582
571 2HD LYS 92 HD1 LYS 92 3.237 -2.653 -3.351
572 1HE LYS 92 HE2 LYS 92 4.821 -4.215 -1.896
573 2HE LYS 92 HE1 LYS 92 6.011 -3.655 -3.067
574 1HZ LYS 92 HZ1 LYS 92 5.009 -1.344 -2.481
575 2HZ LYS 92 HZ3 LYS 92 4.512 -2.120 -1.062
576 3HZ LYS 92 HZ2 LYS 92 6.155 -2.050 -1.458
577 H GLN 93 HN GLN 93 5.093 -7.356 -6.899
578 HA GLN 93 HA GLN 93 3.522 -7.629 -9.374
579 1HB GLN 93 HB2 GLN 93 6.293 -6.472 -9.436
580 2HB GLN 93 HB1 GLN 93 5.047 -6.407 -10.672
581 1HG GLN 93 HG2 GLN 93 5.045 -4.919 -8.057
582 2HG GLN 93 HG1 GLN 93 5.350 -4.237 -9.654
583 1HE2 GLN 93 1HE2 GLN 93 3.299 -3.577 -7.676
584 2HE2 GLN 93 2HE2 GLN 93 1.783 -3.775 -8.480
585 H GLN 94 HN GLN 94 6.503 -8.334 -7.651
586 HA GLN 94 HA GLN 94 6.486 -11.051 -8.587
587 1HB GLN 94 HB2 GLN 94 8.876 -10.885 -9.421
588 2HB GLN 94 HB1 GLN 94 7.651 -10.177 -10.463
589 1HG GLN 94 HG2 GLN 94 8.450 -8.103 -8.790
590 2HG GLN 94 HG1 GLN 94 9.937 -8.952 -9.210
591 1HE2 GLN 94 1HE2 GLN 94 6.932 -8.124 -10.915
592 2HE2 GLN 94 2HE2 GLN 94 7.706 -7.411 -12.285
593 HA PRO 95 HA PRO 95 8.058 -11.748 -4.528
594 1HB PRO 95 HB2 PRO 95 9.865 -13.797 -5.161
595 2HB PRO 95 HB1 PRO 95 8.166 -14.004 -4.731
596 1HG PRO 95 HG2 PRO 95 9.448 -13.941 -7.421
597 2HG PRO 95 HG1 PRO 95 8.076 -14.908 -6.849
598 1HD PRO 95 HD2 PRO 95 7.712 -12.774 -8.424
599 2HD PRO 95 HD1 PRO 95 6.573 -13.154 -7.114
600 H GLN 96 HN GLN 96 9.170 -9.725 -4.384
601 HA GLN 96 HA GLN 96 11.549 -8.971 -5.465
602 1HB GLN 96 HB2 GLN 96 11.325 -7.246 -4.057
603 2HB GLN 96 HB1 GLN 96 9.921 -8.071 -3.400
604 1HG GLN 96 HG2 GLN 96 11.219 -7.511 -1.543
605 2HG GLN 96 HG1 GLN 96 11.533 -9.224 -1.808
606 1HE2 GLN 96 1HE2 GLN 96 12.845 -6.350 -3.422
607 2HE2 GLN 96 2HE2 GLN 96 14.497 -6.682 -3.043
608 H ASN 97 HN ASN 97 13.706 -9.304 -5.130
609 HA ASN 97 HA ASN 97 14.459 -11.355 -3.159
610 1HB ASN 97 HB2 ASN 97 14.394 -11.863 -5.825
611 2HB ASN 97 HB1 ASN 97 16.043 -11.272 -5.652
612 1HD2 ASN 97 1HD2 ASN 97 13.762 -13.727 -4.691
613 2HD2 ASN 97 2HD2 ASN 97 14.927 -14.862 -4.111
614 H ASN 98 HN ASN 98 17.166 -11.389 -3.558
615 HA ASN 98 HA ASN 98 18.042 -9.170 -2.102
616 1HB ASN 98 HB2 ASN 98 19.120 -11.566 -2.645
617 2HB ASN 98 HB1 ASN 98 20.024 -10.591 -3.800
618 1HD2 ASN 98 1HD2 ASN 98 21.903 -9.973 -3.047
619 2HD2 ASN 98 2HD2 ASN 98 22.265 -9.556 -1.410
620 H ASN 99 HN ASN 99 17.817 -7.157 -2.884
621 HA ASN 99 HA ASN 99 18.230 -6.531 -5.658
622 1HB ASN 99 HB2 ASN 99 16.551 -5.343 -4.283
623 2HB ASN 99 HB1 ASN 99 17.848 -4.676 -3.297
624 1HD2 ASN 99 1HD2 ASN 99 16.242 -2.895 -4.349
625 2HD2 ASN 99 2HD2 ASN 99 16.960 -2.082 -5.694
626 H GLN 100 HN GLN 100 20.222 -6.496 -6.468
627 HA GLN 100 HA GLN 100 22.573 -6.139 -4.954
628 1HB GLN 100 HB2 GLN 100 23.722 -6.017 -7.118
629 2HB GLN 100 HB1 GLN 100 22.565 -7.341 -7.080
630 1HG GLN 100 HG2 GLN 100 20.966 -5.584 -8.164
631 2HG GLN 100 HG1 GLN 100 22.475 -4.787 -8.606
632 1HE2 GLN 100 1HE2 GLN 100 21.161 -8.088 -8.560
633 2HE2 GLN 100 2HE2 GLN 100 21.708 -8.509 -10.144
No H/Q in entry = 633
Start of MODEL 5
1 H1 ALA 1 HT1 ALA 1 6.738 7.234 -4.294
2 H2 ALA 1 HT3 ALA 1 7.710 5.968 -4.916
3 H3 ALA 1 HT2 ALA 1 7.521 7.421 -5.809
4 HA ALA 1 HA ALA 1 6.160 5.944 -6.855
5 1HB ALA 1 HB1 ALA 1 4.382 4.844 -5.097
6 2HB ALA 1 HB2 ALA 1 5.879 4.850 -4.162
7 3HB ALA 1 HB3 ALA 1 5.823 4.045 -5.729
8 H MET 2 HN MET 2 3.565 5.878 -6.846
9 HA MET 2 HA MET 2 2.238 8.030 -5.553
10 1HB MET 2 HB2 MET 2 1.822 9.146 -7.960
11 2HB MET 2 HB1 MET 2 3.075 9.683 -6.854
12 1HG MET 2 HG2 MET 2 4.136 9.538 -8.918
13 2HG MET 2 HG1 MET 2 4.619 8.068 -8.079
14 1HE MET 2 HE3 MET 2 4.406 6.009 -8.644
15 2HE MET 2 HE2 MET 2 2.732 5.505 -8.874
16 3HE MET 2 HE1 MET 2 3.887 5.354 -10.198
17 H ALA 3 HN ALA 3 0.582 6.611 -5.174
18 HA ALA 3 HA ALA 3 -1.275 6.224 -7.345
19 1HB ALA 3 HB2 ALA 3 -0.877 3.654 -6.033
20 2HB ALA 3 HB3 ALA 3 0.530 4.193 -6.954
21 3HB ALA 3 HB1 ALA 3 -1.039 4.042 -7.746
22 H CYS 4 HN CYS 4 -1.196 7.613 -4.807
23 HA CYS 4 HA CYS 4 -2.699 6.223 -2.845
24 1HB CYS 4 HB2 CYS 4 -1.416 8.715 -3.071
25 2HB CYS 4 HB1 CYS 4 -3.100 9.075 -2.719
26 H TRP 5 HN TRP 5 -4.847 6.904 -2.091
27 HA TRP 5 HA TRP 5 -6.684 7.122 -4.353
28 1HB TRP 5 HB2 TRP 5 -8.415 6.613 -2.523
29 2HB TRP 5 HB1 TRP 5 -7.294 5.323 -2.950
30 HD1 TRP 5 HD1 TRP 5 -5.882 4.327 -1.037
31 HE1 TRP 5 HE1 TRP 5 -5.566 4.850 1.465
32 HE3 TRP 5 HE3 TRP 5 -8.399 8.731 -0.850
33 HZ2 TRP 5 HZ2 TRP 5 -6.311 6.892 3.281
34 HZ3 TRP 5 HZ3 TRP 5 -8.568 9.923 1.297
35 HH2 TRP 5 HH2 TRP 5 -7.542 9.020 3.320
36 H ALA 6 HN ALA 6 -5.374 8.944 -1.763
37 HA ALA 6 HA ALA 6 -7.449 10.816 -1.360
38 1HB ALA 6 HB3 ALA 6 -4.469 11.085 -0.949
39 2HB ALA 6 HB2 ALA 6 -5.681 12.228 -0.365
40 3HB ALA 6 HB1 ALA 6 -5.659 10.575 0.250
41 H GLN 7 HN GLN 7 -4.899 10.521 -3.729
42 HA GLN 7 HA GLN 7 -4.869 13.128 -4.742
43 1HB GLN 7 HB2 GLN 7 -4.013 12.066 -6.842
44 2HB GLN 7 HB1 GLN 7 -3.148 11.589 -5.388
45 1HG GLN 7 HG2 GLN 7 -3.426 9.497 -6.068
46 2HG GLN 7 HG1 GLN 7 -5.117 9.680 -5.601
47 1HE2 GLN 7 1HE2 GLN 7 -2.855 9.647 -8.240
48 2HE2 GLN 7 2HE2 GLN 7 -4.022 9.509 -9.506
49 H SER 8 HN SER 8 -7.124 10.516 -5.188
50 HA SER 8 HA SER 8 -8.392 11.268 -7.541
51 1HB SER 8 HB2 SER 8 -9.753 10.133 -5.086
52 2HB SER 8 HB1 SER 8 -10.305 10.006 -6.757
53 HG SER 8 HG SER 8 -8.059 8.786 -5.549
54 H GLN 9 HN GLN 9 -8.449 12.749 -4.419
55 HA GLN 9 HA GLN 9 -10.669 14.495 -5.222
56 1HB GLN 9 HB2 GLN 9 -9.443 14.309 -2.475
57 2HB GLN 9 HB1 GLN 9 -10.996 15.003 -2.921
58 1HG GLN 9 HG2 GLN 9 -12.037 13.028 -2.843
59 2HG GLN 9 HG1 GLN 9 -10.709 12.185 -3.637
60 1HE2 GLN 9 1HE2 GLN 9 -12.214 12.964 -0.672
61 2HE2 GLN 9 2HE2 GLN 9 -11.144 12.089 0.364
62 H GLY 10 HN GLY 10 -7.276 14.414 -4.861
63 1HA GLY 10 HA1 GLY 10 -7.199 17.369 -4.962
64 2HA GLY 10 HA2 GLY 10 -6.147 16.345 -5.926
65 H TYR 11 HN TYR 11 -6.036 14.564 -3.376
66 HA TYR 11 HA TYR 11 -4.144 16.230 -1.856
67 1HB TYR 11 HB2 TYR 11 -5.971 13.997 -1.126
68 2HB TYR 11 HB1 TYR 11 -4.445 14.105 -0.259
69 HD1 TYR 11 HD1 TYR 11 -7.735 15.548 -0.741
70 HD2 TYR 11 HD2 TYR 11 -3.963 16.093 1.154
71 HE1 TYR 11 HE1 TYR 11 -8.736 17.207 0.767
72 HE2 TYR 11 HE2 TYR 11 -4.955 17.750 2.666
73 HH TYR 11 HH TYR 11 -8.351 18.236 2.896
74 H ASN 12 HN ASN 12 -2.030 15.678 -1.758
75 HA ASN 12 HA ASN 12 -1.092 13.548 -3.465
76 1HB ASN 12 HB2 ASN 12 1.180 14.325 -2.662
77 2HB ASN 12 HB1 ASN 12 0.217 15.554 -3.478
78 1HD2 ASN 12 1HD2 ASN 12 2.038 14.845 -0.786
79 2HD2 ASN 12 2HD2 ASN 12 1.553 16.161 0.222
80 H CYS 13 HN CYS 13 0.063 11.691 -2.778
81 HA CYS 13 HA CYS 13 -0.905 10.529 -0.402
82 1HB CYS 13 HB2 CYS 13 0.125 9.447 -2.591
83 2HB CYS 13 HB1 CYS 13 1.593 9.468 -1.623
84 H CYS 14 HN CYS 14 0.425 9.625 1.327
85 HA CYS 14 HA CYS 14 2.307 11.654 2.289
86 1HB CYS 14 HB2 CYS 14 0.174 10.300 3.498
87 2HB CYS 14 HB1 CYS 14 1.619 9.604 4.218
88 H ASN 15 HN ASN 15 4.187 11.023 1.218
89 HA ASN 15 HA ASN 15 5.355 8.692 0.694
90 1HB ASN 15 HB2 ASN 15 6.436 10.871 0.347
91 2HB ASN 15 HB1 ASN 15 6.726 11.011 2.078
92 1HD2 ASN 15 1HD2 ASN 15 8.642 10.436 2.754
93 2HD2 ASN 15 2HD2 ASN 15 9.735 9.370 1.943
94 H ASN 16 HN ASN 16 5.685 6.857 1.755
95 HA ASN 16 HA ASN 16 6.200 5.359 3.391
96 1HB ASN 16 HB2 ASN 16 7.118 7.845 4.841
97 2HB ASN 16 HB1 ASN 16 7.172 6.249 5.580
98 1HD2 ASN 16 1HD2 ASN 16 8.007 7.703 2.464
99 2HD2 ASN 16 2HD2 ASN 16 9.569 6.977 2.347
100 HA PRO 17 HA PRO 17 1.994 6.827 5.104
101 1HB PRO 17 HB2 PRO 17 0.696 4.614 4.037
102 2HB PRO 17 HB1 PRO 17 0.708 6.231 3.329
103 1HG PRO 17 HG2 PRO 17 2.364 3.848 2.641
104 2HG PRO 17 HG1 PRO 17 1.671 5.082 1.575
105 1HD PRO 17 HD2 PRO 17 4.275 5.082 2.225
106 2HD PRO 17 HD1 PRO 17 3.367 6.594 2.012
107 H SER 18 HN SER 18 3.960 3.979 5.056
108 HA SER 18 HA SER 18 2.529 2.598 7.137
109 1HB SER 18 HB2 SER 18 5.381 1.978 6.480
110 2HB SER 18 HB1 SER 18 4.051 0.879 6.848
111 HG SER 18 HG SER 18 4.953 1.506 4.483
112 H SER 19 HN SER 19 4.412 5.307 7.136
113 HA SER 19 HA SER 19 5.086 4.951 9.966
114 1HB SER 19 HB2 SER 19 7.101 4.641 8.420
115 2HB SER 19 HB1 SER 19 6.937 6.354 8.032
116 HG SER 19 HG SER 19 7.688 5.130 10.439
117 H THR 20 HN THR 20 2.921 6.323 8.459
118 HA THR 20 HA THR 20 3.487 9.116 9.119
119 HB THR 20 HB THR 20 1.612 7.751 7.215
120 HG1 THR 20 HG1 THR 20 3.238 8.450 6.066
121 1HG2 THR 20 2HG2 THR 20 1.319 10.581 8.166
122 2HG2 THR 20 1HG2 THR 20 0.526 9.885 6.753
123 3HG2 THR 20 3HG2 THR 20 0.159 9.268 8.363
124 H LYS 21 HN LYS 21 2.187 10.260 10.505
125 HA LYS 21 HA LYS 21 0.539 8.668 12.302
126 1HB LYS 21 HB2 LYS 21 2.122 10.155 13.358
127 2HB LYS 21 HB1 LYS 21 1.518 11.525 12.438
128 1HG LYS 21 HG2 LYS 21 0.623 11.760 14.596
129 2HG LYS 21 HG1 LYS 21 -0.702 11.157 13.596
130 1HD LYS 21 HD2 LYS 21 -0.824 9.210 14.716
131 2HD LYS 21 HD1 LYS 21 0.929 9.071 14.866
132 1HE LYS 21 HE2 LYS 21 0.992 10.367 16.794
133 2HE LYS 21 HE1 LYS 21 -0.575 11.104 16.465
134 1HZ LYS 21 HZ2 LYS 21 -1.592 8.909 16.890
135 2HZ LYS 21 HZ1 LYS 21 -0.075 8.311 17.342
136 3HZ LYS 21 HZ3 LYS 21 -0.804 9.545 18.245
137 H VAL 22 HN VAL 22 -1.568 8.469 11.878
138 HA VAL 22 HA VAL 22 -2.903 10.391 10.186
139 HB VAL 22 HB VAL 22 -4.021 7.869 11.408
140 1HG1 VAL 22 3HG1 VAL 22 -5.278 9.946 10.097
141 2HG1 VAL 22 2HG1 VAL 22 -5.064 8.727 8.842
142 3HG1 VAL 22 1HG1 VAL 22 -5.918 8.319 10.332
143 1HG2 VAL 22 2HG2 VAL 22 -1.942 7.979 9.595
144 2HG2 VAL 22 1HG2 VAL 22 -3.004 6.601 9.882
145 3HG2 VAL 22 3HG2 VAL 22 -3.365 7.736 8.583
146 H GLU 23 HN GLU 23 -3.267 12.170 11.401
147 HA GLU 23 HA GLU 23 -4.501 11.911 14.026
148 1HB GLU 23 HB2 GLU 23 -4.426 14.527 13.784
149 2HB GLU 23 HB1 GLU 23 -2.960 13.628 14.143
150 1HG GLU 23 HG2 GLU 23 -2.043 14.031 12.103
151 2HG GLU 23 HG1 GLU 23 -3.607 14.125 11.292
152 H TYR 24 HN TYR 24 -5.532 11.748 10.952
153 HA TYR 24 HA TYR 24 -8.183 12.806 11.691
154 1HB TYR 24 HB2 TYR 24 -6.768 14.344 10.135
155 2HB TYR 24 HB1 TYR 24 -7.180 13.170 8.891
156 HD1 TYR 24 HD1 TYR 24 -8.305 16.003 10.785
157 HD2 TYR 24 HD2 TYR 24 -9.630 12.732 8.409
158 HE1 TYR 24 HE1 TYR 24 -10.463 17.132 10.446
159 HE2 TYR 24 HE2 TYR 24 -11.792 13.851 8.062
160 HH TYR 24 HH TYR 24 -12.509 16.536 8.148
161 H THR 25 HN THR 25 -9.966 11.880 10.548
162 HA THR 25 HA THR 25 -9.583 9.733 8.708
163 HB THR 25 HB THR 25 -10.632 8.959 11.433
164 HG1 THR 25 HG1 THR 25 -8.645 8.658 11.973
165 1HG2 THR 25 2HG2 THR 25 -10.940 7.713 8.974
166 2HG2 THR 25 1HG2 THR 25 -9.626 6.839 9.764
167 3HG2 THR 25 3HG2 THR 25 -11.188 7.000 10.569
168 H ASP 26 HN ASP 26 -11.123 10.429 7.373
169 HA ASP 26 HA ASP 26 -13.793 10.987 8.476
170 1HB ASP 26 HB2 ASP 26 -12.214 12.469 6.709
171 2HB ASP 26 HB1 ASP 26 -13.433 11.718 5.683
172 H ALA 27 HN ALA 27 -15.140 10.742 5.951
173 HA ALA 27 HA ALA 27 -15.434 7.865 5.909
174 1HB ALA 27 HB3 ALA 27 -17.227 9.870 5.668
175 2HB ALA 27 HB2 ALA 27 -16.966 9.467 3.972
176 3HB ALA 27 HB1 ALA 27 -17.507 8.224 5.100
177 H SER 28 HN SER 28 -13.196 9.684 4.547
178 HA SER 28 HA SER 28 -13.294 8.398 1.912
179 1HB SER 28 HB2 SER 28 -11.744 10.770 2.960
180 2HB SER 28 HB1 SER 28 -11.385 10.011 1.408
181 HG SER 28 HG SER 28 -13.660 11.452 2.206
182 H GLY 29 HN GLY 29 -11.623 8.491 4.935
183 1HA GLY 29 HA1 GLY 29 -9.431 6.848 3.899
184 2HA GLY 29 HA2 GLY 29 -10.486 6.159 5.124
185 H GLN 30 HN GLN 30 -7.566 6.909 5.089
186 HA GLN 30 HA GLN 30 -7.613 8.434 7.598
187 1HB GLN 30 HB2 GLN 30 -6.082 6.131 6.621
188 2HB GLN 30 HB1 GLN 30 -5.095 7.350 7.413
189 1HG GLN 30 HG2 GLN 30 -5.635 6.273 9.287
190 2HG GLN 30 HG1 GLN 30 -7.171 7.129 9.150
191 1HE2 GLN 30 1HE2 GLN 30 -5.516 4.123 8.375
192 2HE2 GLN 30 2HE2 GLN 30 -6.933 3.135 8.346
193 H TRP 31 HN TRP 31 -6.280 10.193 7.917
194 HA TRP 31 HA TRP 31 -4.627 11.067 5.653
195 1HB TRP 31 HB2 TRP 31 -6.392 12.980 7.178
196 2HB TRP 31 HB1 TRP 31 -5.477 13.295 5.710
197 HD1 TRP 31 HD1 TRP 31 -8.585 11.318 6.884
198 HE1 TRP 31 HE1 TRP 31 -10.176 11.076 4.875
199 HE3 TRP 31 HE3 TRP 31 -5.630 13.379 3.259
200 HZ2 TRP 31 HZ2 TRP 31 -10.175 11.681 2.115
201 HZ3 TRP 31 HZ3 TRP 31 -6.498 13.508 0.962
202 HH2 TRP 31 HH2 TRP 31 -8.723 12.677 0.403
203 H GLY 32 HN GLY 32 -2.980 12.611 6.221
204 1HA GLY 32 HA1 GLY 32 -1.404 11.975 8.343
205 2HA GLY 32 HA2 GLY 32 -2.468 13.224 8.980
206 H VAL 33 HN VAL 33 -0.084 14.070 9.157
207 HA VAL 33 HA VAL 33 0.527 15.564 6.695
208 HB VAL 33 HB VAL 33 -0.486 17.148 8.151
209 1HG1 VAL 33 3HG1 VAL 33 -0.216 15.741 10.203
210 2HG1 VAL 33 2HG1 VAL 33 1.430 16.360 10.333
211 3HG1 VAL 33 1HG1 VAL 33 0.062 17.467 10.442
212 1HG2 VAL 33 3HG2 VAL 33 1.520 17.944 7.009
213 2HG2 VAL 33 2HG2 VAL 33 1.331 18.731 8.575
214 3HG2 VAL 33 1HG2 VAL 33 2.512 17.435 8.377
215 H GLN 34 HN GLN 34 2.295 14.499 6.000
216 HA GLN 34 HA GLN 34 4.462 13.995 7.911
217 1HB GLN 34 HB2 GLN 34 3.540 12.181 6.310
218 2HB GLN 34 HB1 GLN 34 4.429 13.040 5.059
219 1HG GLN 34 HG2 GLN 34 6.276 11.982 5.635
220 2HG GLN 34 HG1 GLN 34 6.176 12.671 7.254
221 1HE2 GLN 34 1HE2 GLN 34 6.162 9.869 5.460
222 2HE2 GLN 34 2HE2 GLN 34 5.569 8.776 6.662
223 H ASN 35 HN ASN 35 6.488 14.855 7.632
224 HA ASN 35 HA ASN 35 7.956 16.514 7.135
225 1HB ASN 35 HB2 ASN 35 8.741 16.519 4.918
226 2HB ASN 35 HB1 ASN 35 8.047 14.914 5.130
227 1HD2 ASN 35 1HD2 ASN 35 6.375 14.290 3.881
228 2HD2 ASN 35 2HD2 ASN 35 5.673 15.264 2.638
229 H GLY 36 HN GLY 36 5.158 17.303 7.643
230 1HA GLY 36 HA1 GLY 36 5.434 20.070 6.991
231 2HA GLY 36 HA2 GLY 36 4.079 19.329 7.826
232 H GLN 37 HN GLN 37 3.273 17.496 5.856
233 HA GLN 37 HA GLN 37 1.956 19.328 4.023
234 1HB GLN 37 HB2 GLN 37 3.532 16.956 3.005
235 2HB GLN 37 HB1 GLN 37 2.528 18.019 2.032
236 1HG GLN 37 HG2 GLN 37 4.957 18.917 3.563
237 2HG GLN 37 HG1 GLN 37 4.963 18.461 1.862
238 1HE2 GLN 37 1HE2 GLN 37 2.726 19.592 0.888
239 2HE2 GLN 37 2HE2 GLN 37 2.794 21.311 1.040
240 H TRP 38 HN TRP 38 -0.101 18.703 3.560
241 HA TRP 38 HA TRP 38 -1.264 16.570 5.010
242 1HB TRP 38 HB2 TRP 38 -2.259 18.376 2.822
243 2HB TRP 38 HB1 TRP 38 -3.244 17.037 3.397
244 HD1 TRP 38 HD1 TRP 38 -3.405 20.440 3.769
245 HE1 TRP 38 HE1 TRP 38 -4.117 21.239 6.112
246 HE3 TRP 38 HE3 TRP 38 -2.459 16.164 6.412
247 HZ2 TRP 38 HZ2 TRP 38 -4.261 20.193 8.729
248 HZ3 TRP 38 HZ3 TRP 38 -2.913 16.147 8.830
249 HH2 TRP 38 HH2 TRP 38 -3.796 18.121 9.962
250 H CYS 39 HN CYS 39 -2.059 14.576 4.317
251 HA CYS 39 HA CYS 39 -2.007 13.679 1.658
252 1HB CYS 39 HB2 CYS 39 -0.080 11.920 2.324
253 2HB CYS 39 HB1 CYS 39 0.225 13.395 1.425
254 H GLY 40 HN GLY 40 -2.498 11.401 1.431
255 1HA GLY 40 HA1 GLY 40 -4.183 9.878 2.093
256 2HA GLY 40 HA2 GLY 40 -4.002 10.435 3.751
257 H ILE 41 HN ILE 41 -3.784 8.337 4.575
258 HA ILE 41 HA ILE 41 -1.106 7.247 4.257
259 HB ILE 41 HB ILE 41 -3.278 6.890 6.283
260 1HG1 ILE 41 2HG1 ILE 41 -1.155 7.255 7.747
261 2HG1 ILE 41 1HG1 ILE 41 -0.428 7.809 6.241
262 1HG2 ILE 41 2HG2 ILE 41 -1.089 4.955 5.682
263 2HG2 ILE 41 1HG2 ILE 41 -1.615 5.200 7.348
264 3HG2 ILE 41 3HG2 ILE 41 -2.768 4.651 6.131
265 1HD1 ILE 41 2HD1 ILE 41 -3.035 8.987 6.779
266 2HD1 ILE 41 1HD1 ILE 41 -1.818 9.358 7.999
267 3HD1 ILE 41 3HD1 ILE 41 -1.518 9.748 6.306
268 H ASP 42 HN ASP 42 -1.045 6.101 2.380
269 HA ASP 42 HA ASP 42 -2.853 3.781 2.208
270 1HB ASP 42 HB2 ASP 42 -2.801 5.798 0.372
271 2HB ASP 42 HB1 ASP 42 -1.619 4.681 -0.313
272 H TYR 43 HN TYR 43 -1.577 2.214 3.023
273 HA TYR 43 HA TYR 43 1.204 2.034 2.696
274 1HB TYR 43 HB2 TYR 43 -0.591 -0.349 3.115
275 2HB TYR 43 HB1 TYR 43 1.055 -0.106 3.691
276 HD1 TYR 43 HD1 TYR 43 0.638 2.745 4.724
277 HD2 TYR 43 HD2 TYR 43 -1.620 -0.828 5.205
278 HE1 TYR 43 HE1 TYR 43 -0.237 3.595 6.861
279 HE2 TYR 43 HE2 TYR 43 -2.501 0.010 7.342
280 HH TYR 43 HH TYR 43 -1.278 2.146 9.126
281 H SER 44 HN SER 44 -1.258 1.532 0.432
282 HA SER 44 HA SER 44 0.605 0.068 -1.300
283 1HB SER 44 HB2 SER 44 -2.297 -0.417 -0.793
284 2HB SER 44 HB1 SER 44 -1.654 -0.735 -2.405
285 HG SER 44 HG SER 44 -1.404 -2.608 -1.282
286 H TYR 45 HN TYR 45 0.736 2.759 -1.378
287 HA TYR 45 HA TYR 45 -1.063 3.748 -3.413
288 1HB TYR 45 HB2 TYR 45 -0.307 5.864 -2.932
289 2HB TYR 45 HB1 TYR 45 0.009 5.061 -1.399
290 HD1 TYR 45 HD1 TYR 45 1.332 7.563 -2.888
291 HD2 TYR 45 HD2 TYR 45 2.447 3.524 -2.218
292 HE1 TYR 45 HE1 TYR 45 3.695 8.208 -3.029
293 HE2 TYR 45 HE2 TYR 45 4.806 4.142 -2.373
294 HH TYR 45 HH TYR 45 5.942 7.184 -2.082
295 H GLY 46 HN GLY 46 0.695 1.528 -4.122
296 1HA GLY 46 HA1 GLY 46 1.654 2.615 -6.612
297 2HA GLY 46 HA2 GLY 46 1.625 0.922 -6.154
298 H GLN 47 HN GLN 47 3.244 0.413 -4.297
299 HA GLN 47 HA GLN 47 5.776 1.779 -4.944
300 1HB GLN 47 HB2 GLN 47 4.550 1.404 -2.422
301 2HB GLN 47 HB1 GLN 47 5.938 0.325 -2.466
302 1HG GLN 47 HG2 GLN 47 6.359 3.100 -3.397
303 2HG GLN 47 HG1 GLN 47 6.095 2.856 -1.671
304 1HE2 GLN 47 1HE2 GLN 47 7.884 2.642 -0.554
305 2HE2 GLN 47 2HE2 GLN 47 9.365 1.951 -1.113
306 H ASN 48 HN ASN 48 7.635 0.125 -4.025
307 HA ASN 48 HA ASN 48 7.716 -1.955 -5.914
308 1HB ASN 48 HB2 ASN 48 9.375 -1.541 -3.418
309 2HB ASN 48 HB1 ASN 48 9.751 -2.698 -4.692
310 1HD2 ASN 48 1HD2 ASN 48 9.375 -1.409 -6.964
311 2HD2 ASN 48 2HD2 ASN 48 10.383 -0.010 -7.080
312 H GLN 49 HN GLN 49 7.092 -4.027 -5.855
313 HA GLN 49 HA GLN 49 5.632 -4.950 -3.510
314 1HB GLN 49 HB2 GLN 49 4.335 -5.428 -5.343
315 2HB GLN 49 HB1 GLN 49 5.713 -5.634 -6.407
316 1HG GLN 49 HG2 GLN 49 6.020 -7.861 -5.750
317 2HG GLN 49 HG1 GLN 49 4.998 -7.670 -4.326
318 1HE2 GLN 49 1HE2 GLN 49 4.237 -6.471 -7.536
319 2HE2 GLN 49 2HE2 GLN 49 2.894 -7.520 -7.813
320 H GLY 50 HN GLY 50 8.472 -4.743 -3.244
321 1HA GLY 50 HA1 GLY 50 10.414 -6.058 -3.012
322 2HA GLY 50 HA2 GLY 50 9.463 -7.486 -3.388
323 H ASN 51 HN ASN 51 7.375 -6.598 -1.411
324 HA ASN 51 HA ASN 51 6.827 -7.137 0.733
325 1HB ASN 51 HB2 ASN 51 8.604 -9.060 0.033
326 2HB ASN 51 HB1 ASN 51 9.433 -8.348 1.414
327 1HD2 ASN 51 1HD2 ASN 51 7.197 -7.614 2.922
328 2HD2 ASN 51 2HD2 ASN 51 6.422 -9.052 3.484
329 H GLU 52 HN GLU 52 7.864 -4.599 0.240
330 HA GLU 52 HA GLU 52 9.898 -3.902 2.115
331 1HB GLU 52 HB2 GLU 52 7.850 -2.131 0.768
332 2HB GLU 52 HB1 GLU 52 9.306 -1.584 1.588
333 1HG GLU 52 HG2 GLU 52 10.380 -3.293 -0.190
334 2HG GLU 52 HG1 GLU 52 8.961 -2.756 -1.087
335 H SER 53 HN SER 53 6.394 -3.973 2.165
336 HA SER 53 HA SER 53 6.373 -3.917 5.040
337 1HB SER 53 HB2 SER 53 6.426 -1.460 4.208
338 2HB SER 53 HB1 SER 53 4.761 -1.753 3.706
339 HG SER 53 HG SER 53 5.858 -1.617 6.272
340 H CYS 54 HN CYS 54 3.837 -3.673 5.689
341 HA CYS 54 HA CYS 54 2.100 -4.941 3.761
342 1HB CYS 54 HB2 CYS 54 1.587 -6.849 5.351
343 2HB CYS 54 HB1 CYS 54 3.132 -6.931 4.514
344 H THR 55 HN THR 55 -0.058 -5.530 4.894
345 HA THR 55 HA THR 55 -0.865 -3.175 6.392
346 HB THR 55 HB THR 55 -2.548 -5.412 5.240
347 HG1 THR 55 HG1 THR 55 -2.946 -3.934 3.566
348 1HG2 THR 55 1HG2 THR 55 -3.231 -3.126 6.863
349 2HG2 THR 55 3HG2 THR 55 -4.037 -3.082 5.294
350 3HG2 THR 55 2HG2 THR 55 -4.227 -4.486 6.346
351 H GLY 56 HN GLY 56 -1.986 -3.294 8.377
352 1HA GLY 56 HA1 GLY 56 -2.036 -5.882 9.730
353 2HA GLY 56 HA2 GLY 56 -2.784 -4.397 10.302
354 H ASN 57 HN ASN 57 0.070 -3.267 9.428
355 HA ASN 57 HA ASN 57 1.737 -4.301 11.532
356 1HB ASN 57 HB2 ASN 57 3.327 -2.562 10.821
357 2HB ASN 57 HB1 ASN 57 2.745 -3.513 9.460
358 1HD2 ASN 57 1HD2 ASN 57 1.285 -2.574 8.000
359 2HD2 ASN 57 2HD2 ASN 57 1.115 -0.860 7.873
360 H GLY 58 HN GLY 58 -0.887 -2.359 11.621
361 1HA GLY 58 HA1 GLY 58 -0.903 -0.148 12.867
362 2HA GLY 58 HA2 GLY 58 0.095 -0.996 14.043
363 H SER 59 HN SER 59 -1.594 -3.482 13.322
364 HA SER 59 HA SER 59 -3.495 -3.104 15.450
365 1HB SER 59 HB2 SER 59 -5.312 -4.026 13.664
366 2HB SER 59 HB1 SER 59 -5.114 -2.321 14.067
367 HG SER 59 HG SER 59 -4.224 -3.732 11.806
368 H TYR 60 HN TYR 60 -3.231 -5.269 12.608
369 HA TYR 60 HA TYR 60 -2.828 -7.505 14.478
370 1HB TYR 60 HB2 TYR 60 -4.267 -8.461 12.200
371 2HB TYR 60 HB1 TYR 60 -4.739 -8.496 13.893
372 HD1 TYR 60 HD1 TYR 60 -4.494 -5.890 11.209
373 HD2 TYR 60 HD2 TYR 60 -6.834 -7.645 14.298
374 HE1 TYR 60 HE1 TYR 60 -6.314 -4.311 10.717
375 HE2 TYR 60 HE2 TYR 60 -8.659 -6.068 13.819
376 HH TYR 60 HH TYR 60 -9.020 -3.925 12.791
377 HA PRO 61 HA PRO 61 0.598 -8.989 12.165
378 1HB PRO 61 HB2 PRO 61 -0.319 -11.594 11.607
379 2HB PRO 61 HB1 PRO 61 0.628 -11.090 13.008
380 1HG PRO 61 HG2 PRO 61 -2.321 -11.469 12.747
381 2HG PRO 61 HG1 PRO 61 -1.258 -11.819 14.125
382 1HD PRO 61 HD2 PRO 61 -2.832 -9.676 14.151
383 2HD PRO 61 HD1 PRO 61 -1.170 -9.573 14.776
384 H CYS 62 HN CYS 62 1.294 -9.508 10.053
385 HA CYS 62 HA CYS 62 -0.591 -8.759 7.995
386 1HB CYS 62 HB2 CYS 62 2.338 -9.504 7.794
387 2HB CYS 62 HB1 CYS 62 1.364 -8.819 6.496
388 H CYS 63 HN CYS 63 -1.305 -10.040 6.308
389 HA CYS 63 HA CYS 63 -1.671 -12.776 6.877
390 1HB CYS 63 HB2 CYS 63 -2.195 -11.146 4.396
391 2HB CYS 63 HB1 CYS 63 -2.611 -12.850 4.519
392 H ASN 64 HN ASN 64 -0.244 -11.460 3.944
393 HA ASN 64 HA ASN 64 2.043 -11.990 3.287
394 1HB ASN 64 HB2 ASN 64 2.973 -14.132 3.499
395 2HB ASN 64 HB1 ASN 64 2.135 -13.894 5.024
396 1HD2 ASN 64 1HD2 ASN 64 1.807 -15.339 1.821
397 2HD2 ASN 64 2HD2 ASN 64 0.786 -16.643 2.313
398 H THR 65 HN THR 65 -1.039 -12.389 2.478
399 HA THR 65 HA THR 65 -0.390 -13.361 -0.224
400 HB THR 65 HB THR 65 -1.765 -14.989 1.066
401 HG1 THR 65 HG1 THR 65 -1.998 -14.680 -1.249
402 1HG2 THR 65 2HG2 THR 65 -3.039 -13.048 2.271
403 2HG2 THR 65 1HG2 THR 65 -4.113 -13.170 0.877
404 3HG2 THR 65 3HG2 THR 65 -3.848 -14.573 1.912
405 H CYS 66 HN CYS 66 -1.573 -12.382 -1.948
406 HA CYS 66 HA CYS 66 -2.329 -9.635 -1.369
407 1HB CYS 66 HB2 CYS 66 -0.965 -9.693 -3.263
408 2HB CYS 66 HB1 CYS 66 -1.677 -11.187 -3.857
409 H GLN 67 HN GLN 67 -3.893 -12.435 -1.143
410 HA GLN 67 HA GLN 67 -6.349 -11.773 -2.502
411 1HB GLN 67 HB2 GLN 67 -5.983 -14.086 -2.397
412 2HB GLN 67 HB1 GLN 67 -5.421 -14.021 -0.735
413 1HG GLN 67 HG2 GLN 67 -8.136 -13.144 -0.830
414 2HG GLN 67 HG1 GLN 67 -7.988 -14.670 -1.696
415 1HE2 GLN 67 1HE2 GLN 67 -6.060 -13.587 1.048
416 2HE2 GLN 67 2HE2 GLN 67 -6.588 -14.820 2.136
417 H ALA 68 HN ALA 68 -6.989 -9.827 -1.621
418 HA ALA 68 HA ALA 68 -7.370 -9.677 1.256
419 1HB ALA 68 HB3 ALA 68 -6.504 -7.823 -0.609
420 2HB ALA 68 HB2 ALA 68 -8.136 -7.301 -0.189
421 3HB ALA 68 HB1 ALA 68 -6.927 -7.521 1.077
422 H THR 69 HN THR 69 -9.145 -10.921 1.559
423 HA THR 69 HA THR 69 -11.505 -10.873 0.061
424 HB THR 69 HB THR 69 -11.476 -12.701 1.433
425 HG1 THR 69 HG1 THR 69 -13.035 -12.460 3.001
426 1HG2 THR 69 2HG2 THR 69 -10.303 -10.935 3.545
427 2HG2 THR 69 1HG2 THR 69 -10.898 -12.562 3.890
428 3HG2 THR 69 3HG2 THR 69 -9.577 -12.328 2.741
429 H TYR 70 HN TYR 70 -10.279 -8.623 2.400
430 HA TYR 70 HA TYR 70 -12.591 -6.939 1.944
431 1HB TYR 70 HB2 TYR 70 -13.428 -6.852 4.069
432 2HB TYR 70 HB1 TYR 70 -12.853 -8.512 4.061
433 HD1 TYR 70 HD1 TYR 70 -11.454 -9.238 5.767
434 HD2 TYR 70 HD2 TYR 70 -11.765 -5.068 4.987
435 HE1 TYR 70 HE1 TYR 70 -10.094 -8.770 7.762
436 HE2 TYR 70 HE2 TYR 70 -10.406 -4.588 6.980
437 HH TYR 70 HH TYR 70 -8.520 -6.731 8.481
438 H THR 71 HN THR 71 -12.191 -4.776 2.190
439 HA THR 71 HA THR 71 -9.440 -4.039 2.945
440 HB THR 71 HB THR 71 -11.165 -2.872 0.752
441 HG1 THR 71 HG1 THR 71 -9.809 -3.839 -0.592
442 1HG2 THR 71 3HG2 THR 71 -9.632 -1.260 2.112
443 2HG2 THR 71 2HG2 THR 71 -8.341 -2.045 1.198
444 3HG2 THR 71 1HG2 THR 71 -9.641 -1.211 0.348
445 H ASP 72 HN ASP 72 -9.190 -2.338 4.298
446 HA ASP 72 HA ASP 72 -11.647 -0.970 5.164
447 1HB ASP 72 HB2 ASP 72 -10.115 -2.644 6.711
448 2HB ASP 72 HB1 ASP 72 -9.460 -1.063 7.124
449 H GLY 73 HN GLY 73 -10.513 0.907 6.834
450 1HA GLY 73 HA1 GLY 73 -9.781 3.082 6.673
451 2HA GLY 73 HA2 GLY 73 -9.640 2.850 4.939
452 H ASP 74 HN ASP 74 -7.865 0.389 6.203
453 HA ASP 74 HA ASP 74 -5.426 2.046 6.238
454 1HB ASP 74 HB2 ASP 74 -6.365 -0.047 8.071
455 2HB ASP 74 HB1 ASP 74 -4.697 -0.252 7.545
456 H GLY 75 HN GLY 75 -7.041 0.186 4.224
457 1HA GLY 75 HA1 GLY 75 -4.638 -1.241 3.267
458 2HA GLY 75 HA2 GLY 75 -5.707 -0.360 2.185
459 H ASP 76 HN ASP 76 -4.982 -3.136 2.035
460 HA ASP 76 HA ASP 76 -7.675 -4.253 2.026
461 1HB ASP 76 HB2 ASP 76 -5.541 -5.978 1.004
462 2HB ASP 76 HB1 ASP 76 -7.036 -5.462 0.237
463 H TRP 77 HN TRP 77 -7.843 -6.654 2.616
464 HA TRP 77 HA TRP 77 -6.021 -7.551 4.675
465 1HB TRP 77 HB2 TRP 77 -8.901 -7.018 5.405
466 2HB TRP 77 HB1 TRP 77 -7.634 -7.620 6.469
467 HD1 TRP 77 HD1 TRP 77 -8.838 -4.389 4.779
468 HE1 TRP 77 HE1 TRP 77 -7.744 -2.392 5.970
469 HE3 TRP 77 HE3 TRP 77 -5.621 -6.926 7.832
470 HZ2 TRP 77 HZ2 TRP 77 -5.782 -1.951 7.939
471 HZ3 TRP 77 HZ3 TRP 77 -4.167 -5.641 9.338
472 HH2 TRP 77 HH2 TRP 77 -4.245 -3.200 9.392
473 H ALA 78 HN ALA 78 -6.394 -9.696 5.394
474 HA ALA 78 HA ALA 78 -8.447 -11.234 4.034
475 1HB ALA 78 HB2 ALA 78 -6.252 -11.134 2.670
476 2HB ALA 78 HB3 ALA 78 -7.061 -12.681 2.893
477 3HB ALA 78 HB1 ALA 78 -5.655 -12.273 3.873
478 H PHE 79 HN PHE 79 -8.528 -13.501 4.817
479 HA PHE 79 HA PHE 79 -7.900 -13.570 7.682
480 1HB PHE 79 HB2 PHE 79 -10.270 -13.875 7.001
481 2HB PHE 79 HB1 PHE 79 -9.803 -15.312 6.099
482 HD1 PHE 79 HD1 PHE 79 -10.693 -17.147 7.159
483 HD2 PHE 79 HD2 PHE 79 -8.858 -14.098 9.494
484 HE1 PHE 79 HE1 PHE 79 -10.999 -18.516 9.181
485 HE2 PHE 79 HE2 PHE 79 -9.161 -15.461 11.520
486 HZ PHE 79 HZ PHE 79 -10.232 -17.674 11.364
487 H GLU 80 HN GLU 80 -5.978 -14.481 8.047
488 HA GLU 80 HA GLU 80 -5.505 -17.160 6.982
489 1HB GLU 80 HB2 GLU 80 -4.180 -16.116 5.421
490 2HB GLU 80 HB1 GLU 80 -3.835 -14.749 6.463
491 1HG GLU 80 HG2 GLU 80 -1.821 -15.973 6.099
492 2HG GLU 80 HG1 GLU 80 -2.313 -16.189 7.778
493 H ASN 81 HN ASN 81 -4.240 -18.473 8.299
494 HA ASN 81 HA ASN 81 -3.328 -19.250 10.231
495 1HB ASN 81 HB2 ASN 81 -2.329 -16.540 10.003
496 2HB ASN 81 HB1 ASN 81 -2.532 -16.996 11.692
497 1HD2 ASN 81 1HD2 ASN 81 -1.135 -18.094 8.640
498 2HD2 ASN 81 2HD2 ASN 81 0.197 -18.934 9.348
499 H GLY 82 HN GLY 82 -6.144 -17.924 10.016
500 1HA GLY 82 HA1 GLY 82 -6.930 -18.598 12.683
501 2HA GLY 82 HA2 GLY 82 -7.979 -18.001 11.407
502 H ASN 83 HN ASN 83 -6.366 -15.586 10.962
503 HA ASN 83 HA ASN 83 -7.499 -14.017 13.132
504 1HB ASN 83 HB2 ASN 83 -4.605 -13.568 12.440
505 2HB ASN 83 HB1 ASN 83 -5.510 -12.959 13.823
506 1HD2 ASN 83 1HD2 ASN 83 -3.643 -15.522 12.545
507 2HD2 ASN 83 2HD2 ASN 83 -3.642 -16.525 13.952
508 H TRP 84 HN TRP 84 -7.686 -11.773 12.655
509 HA TRP 84 HA TRP 84 -8.085 -11.246 9.860
510 1HB TRP 84 HB2 TRP 84 -8.451 -9.601 12.361
511 2HB TRP 84 HB1 TRP 84 -8.697 -8.923 10.754
512 HD1 TRP 84 HD1 TRP 84 -10.694 -10.198 13.412
513 HE1 TRP 84 HE1 TRP 84 -12.922 -11.189 12.589
514 HE3 TRP 84 HE3 TRP 84 -9.580 -10.688 8.446
515 HZ2 TRP 84 HZ2 TRP 84 -14.057 -12.064 10.156
516 HZ3 TRP 84 HZ3 TRP 84 -11.292 -11.611 6.938
517 HH2 TRP 84 HH2 TRP 84 -13.484 -12.284 7.778
518 H CYS 85 HN CYS 85 -5.952 -11.462 9.069
519 HA CYS 85 HA CYS 85 -3.986 -9.481 9.911
520 1HB CYS 85 HB2 CYS 85 -2.509 -10.735 8.287
521 2HB CYS 85 HB1 CYS 85 -3.085 -11.664 9.666
522 H GLY 86 HN GLY 86 -2.653 -8.514 8.006
523 1HA GLY 86 HA1 GLY 86 -3.182 -6.553 6.688
524 2HA GLY 86 HA2 GLY 86 -4.609 -7.394 6.105
525 H ILE 87 HN ILE 87 -3.736 -6.666 4.014
526 HA ILE 87 HA ILE 87 -2.252 -8.808 2.766
527 HB ILE 87 HB ILE 87 -4.001 -6.627 1.884
528 1HG1 ILE 87 2HG1 ILE 87 -4.846 -8.227 0.398
529 2HG1 ILE 87 1HG1 ILE 87 -3.340 -9.127 0.361
530 1HG2 ILE 87 2HG2 ILE 87 -1.960 -5.816 0.807
531 2HG2 ILE 87 1HG2 ILE 87 -1.710 -7.405 0.078
532 3HG2 ILE 87 3HG2 ILE 87 -3.110 -6.435 -0.375
533 1HD1 ILE 87 1HD1 ILE 87 -4.115 -9.296 2.996
534 2HD1 ILE 87 3HD1 ILE 87 -5.631 -9.389 2.102
535 3HD1 ILE 87 2HD1 ILE 87 -4.330 -10.528 1.755
536 H LYS 88 HN LYS 88 -0.172 -8.783 2.153
537 HA LYS 88 HA LYS 88 1.566 -6.738 3.061
538 1HB LYS 88 HB2 LYS 88 2.218 -8.770 0.926
539 2HB LYS 88 HB1 LYS 88 3.333 -7.967 2.020
540 1HG LYS 88 HG2 LYS 88 1.206 -9.633 3.230
541 2HG LYS 88 HG1 LYS 88 2.519 -10.456 2.386
542 1HD LYS 88 HD2 LYS 88 3.952 -8.718 3.834
543 2HD LYS 88 HD1 LYS 88 2.554 -8.892 4.897
544 1HE LYS 88 HE2 LYS 88 4.337 -10.486 5.449
545 2HE LYS 88 HE1 LYS 88 2.855 -11.296 4.947
546 1HZ LYS 88 HZ2 LYS 88 4.442 -10.865 2.677
547 2HZ LYS 88 HZ1 LYS 88 5.421 -11.561 3.868
548 3HZ LYS 88 HZ3 LYS 88 4.000 -12.338 3.381
549 H ASN 89 HN ASN 89 2.677 -5.152 1.872
550 HA ASN 89 HA ASN 89 1.347 -3.630 0.079
551 1HB ASN 89 HB2 ASN 89 3.351 -2.499 -0.360
552 2HB ASN 89 HB1 ASN 89 3.638 -3.236 1.208
553 1HD2 ASN 89 1HD2 ASN 89 4.893 -5.190 1.276
554 2HD2 ASN 89 2HD2 ASN 89 6.094 -5.475 0.067
555 H SER 90 HN SER 90 3.547 -6.262 -0.778
556 HA SER 90 HA SER 90 3.828 -6.330 -3.374
557 1HB SER 90 HB2 SER 90 4.542 -8.298 -2.489
558 2HB SER 90 HB1 SER 90 3.129 -8.467 -1.452
559 HG SER 90 HG SER 90 2.702 -9.959 -2.912
560 H CYS 91 HN CYS 91 0.632 -6.606 -1.941
561 HA CYS 91 HA CYS 91 -0.602 -7.330 -4.450
562 1HB CYS 91 HB2 CYS 91 -1.433 -8.099 -2.195
563 2HB CYS 91 HB1 CYS 91 -1.981 -6.448 -1.929
564 H LYS 92 HN LYS 92 0.777 -4.992 -4.776
565 HA LYS 92 HA LYS 92 -1.261 -2.878 -4.777
566 1HB LYS 92 HB2 LYS 92 1.675 -2.637 -5.400
567 2HB LYS 92 HB1 LYS 92 0.544 -1.314 -5.232
568 1HG LYS 92 HG2 LYS 92 0.900 -1.203 -3.058
569 2HG LYS 92 HG1 LYS 92 0.547 -2.915 -2.858
570 1HD LYS 92 HD2 LYS 92 3.196 -1.606 -3.444
571 2HD LYS 92 HD1 LYS 92 2.764 -2.636 -2.083
572 1HE LYS 92 HE2 LYS 92 3.867 -4.184 -3.295
573 2HE LYS 92 HE1 LYS 92 2.298 -4.349 -4.073
574 1HZ LYS 92 HZ1 LYS 92 3.573 -2.290 -5.395
575 2HZ LYS 92 HZ3 LYS 92 4.756 -3.477 -5.190
576 3HZ LYS 92 HZ2 LYS 92 3.309 -3.857 -5.972
577 H GLN 93 HN GLN 93 1.173 -4.386 -6.856
578 HA GLN 93 HA GLN 93 -0.564 -3.846 -9.162
579 1HB GLN 93 HB2 GLN 93 1.577 -3.467 -10.491
580 2HB GLN 93 HB1 GLN 93 1.095 -2.189 -9.386
581 1HG GLN 93 HG2 GLN 93 2.766 -3.941 -7.940
582 2HG GLN 93 HG1 GLN 93 3.543 -3.638 -9.493
583 1HE2 GLN 93 1HE2 GLN 93 1.647 -1.724 -7.176
584 2HE2 GLN 93 2HE2 GLN 93 2.764 -0.408 -7.092
585 H GLN 94 HN GLN 94 2.357 -5.159 -10.187
586 HA GLN 94 HA GLN 94 1.848 -7.896 -9.529
587 1HB GLN 94 HB2 GLN 94 1.196 -6.873 -12.289
588 2HB GLN 94 HB1 GLN 94 1.561 -8.563 -11.973
589 1HG GLN 94 HG2 GLN 94 -0.316 -8.288 -10.163
590 2HG GLN 94 HG1 GLN 94 -0.803 -6.946 -11.196
591 1HE2 GLN 94 1HE2 GLN 94 -0.823 -10.310 -10.744
592 2HE2 GLN 94 2HE2 GLN 94 -1.597 -10.746 -12.225
593 HA PRO 95 HA PRO 95 5.585 -7.610 -12.789
594 1HB PRO 95 HB2 PRO 95 6.347 -4.886 -12.860
595 2HB PRO 95 HB1 PRO 95 5.643 -5.826 -14.178
596 1HG PRO 95 HG2 PRO 95 4.319 -3.986 -12.242
597 2HG PRO 95 HG1 PRO 95 3.943 -4.284 -13.950
598 1HD PRO 95 HD2 PRO 95 2.405 -5.290 -12.040
599 2HD PRO 95 HD1 PRO 95 2.802 -6.261 -13.473
600 H GLN 96 HN GLN 96 5.048 -5.601 -9.969
601 HA GLN 96 HA GLN 96 6.356 -5.038 -8.187
602 1HB GLN 96 HB2 GLN 96 7.398 -6.895 -7.079
603 2HB GLN 96 HB1 GLN 96 5.921 -7.470 -7.840
604 1HG GLN 96 HG2 GLN 96 7.113 -8.570 -9.550
605 2HG GLN 96 HG1 GLN 96 8.617 -7.754 -9.127
606 1HE2 GLN 96 1HE2 GLN 96 6.227 -9.354 -7.071
607 2HE2 GLN 96 2HE2 GLN 96 7.314 -10.528 -6.417
608 H ASN 97 HN ASN 97 7.460 -4.362 -10.809
609 HA ASN 97 HA ASN 97 9.337 -3.364 -11.622
610 1HB ASN 97 HB2 ASN 97 9.543 -2.651 -9.162
611 2HB ASN 97 HB1 ASN 97 10.731 -3.942 -9.013
612 1HD2 ASN 97 1HD2 ASN 97 9.962 -0.968 -10.718
613 2HD2 ASN 97 2HD2 ASN 97 11.594 -0.546 -11.097
614 H ASN 98 HN ASN 98 10.658 -5.873 -9.454
615 HA ASN 98 HA ASN 98 12.491 -6.762 -11.479
616 1HB ASN 98 HB2 ASN 98 11.906 -7.503 -8.647
617 2HB ASN 98 HB1 ASN 98 12.772 -8.663 -9.649
618 1HD2 ASN 98 1HD2 ASN 98 12.845 -5.127 -9.358
619 2HD2 ASN 98 2HD2 ASN 98 14.547 -5.015 -9.086
620 H ASN 99 HN ASN 99 12.160 -8.267 -12.974
621 HA ASN 99 HA ASN 99 9.725 -9.894 -12.798
622 1HB ASN 99 HB2 ASN 99 11.329 -8.783 -15.040
623 2HB ASN 99 HB1 ASN 99 10.546 -10.336 -15.310
624 1HD2 ASN 99 1HD2 ASN 99 10.059 -7.657 -16.455
625 2HD2 ASN 99 2HD2 ASN 99 8.385 -7.338 -16.175
626 H GLN 100 HN GLN 100 9.782 -12.133 -13.295
627 HA GLN 100 HA GLN 100 10.587 -14.252 -13.118
628 1HB GLN 100 HB2 GLN 100 11.962 -13.314 -15.094
629 2HB GLN 100 HB1 GLN 100 13.290 -13.225 -13.945
630 1HG GLN 100 HG2 GLN 100 11.757 -15.741 -14.546
631 2HG GLN 100 HG1 GLN 100 13.254 -15.279 -15.354
632 1HE2 GLN 100 1HE2 GLN 100 11.874 -16.807 -12.684
633 2HE2 GLN 100 2HE2 GLN 100 13.317 -17.070 -11.772
No H/Q in entry = 633
Start of MODEL 6
1 H1 ALA 1 HT1 ALA 1 4.687 4.382 -4.850
2 H2 ALA 1 HT3 ALA 1 6.283 3.801 -5.076
3 H3 ALA 1 HT2 ALA 1 5.988 5.098 -3.991
4 HA ALA 1 HA ALA 1 6.870 6.049 -5.871
5 1HB ALA 1 HB3 ALA 1 4.973 4.257 -7.366
6 2HB ALA 1 HB1 ALA 1 6.735 4.289 -7.442
7 3HB ALA 1 HB2 ALA 1 5.799 5.621 -8.119
8 H MET 2 HN MET 2 3.516 5.570 -6.900
9 HA MET 2 HA MET 2 2.454 7.781 -5.483
10 1HB MET 2 HB2 MET 2 4.008 8.559 -7.624
11 2HB MET 2 HB1 MET 2 2.381 8.580 -8.288
12 1HG MET 2 HG2 MET 2 1.836 10.421 -7.176
13 2HG MET 2 HG1 MET 2 2.513 9.808 -5.667
14 1HE MET 2 HE1 MET 2 4.139 10.583 -4.561
15 2HE MET 2 HE3 MET 2 5.564 11.498 -5.051
16 3HE MET 2 HE2 MET 2 4.019 12.321 -4.838
17 H ALA 3 HN ALA 3 0.695 6.549 -5.089
18 HA ALA 3 HA ALA 3 -1.270 6.347 -7.188
19 1HB ALA 3 HB1 ALA 3 -1.073 3.751 -5.881
20 2HB ALA 3 HB2 ALA 3 0.358 4.148 -6.833
21 3HB ALA 3 HB3 ALA 3 -1.234 4.147 -7.594
22 H CYS 4 HN CYS 4 -0.920 7.718 -4.671
23 HA CYS 4 HA CYS 4 -2.540 6.469 -2.680
24 1HB CYS 4 HB2 CYS 4 -2.382 8.653 -1.531
25 2HB CYS 4 HB1 CYS 4 -0.808 8.055 -2.045
26 H TRP 5 HN TRP 5 -4.681 6.411 -2.564
27 HA TRP 5 HA TRP 5 -6.409 7.347 -4.509
28 1HB TRP 5 HB2 TRP 5 -8.198 7.070 -2.727
29 2HB TRP 5 HB1 TRP 5 -7.183 5.661 -3.019
30 HD1 TRP 5 HD1 TRP 5 -5.549 4.912 -1.073
31 HE1 TRP 5 HE1 TRP 5 -5.412 5.505 1.433
32 HE3 TRP 5 HE3 TRP 5 -8.580 8.980 -1.092
33 HZ2 TRP 5 HZ2 TRP 5 -6.486 7.474 3.169
34 HZ3 TRP 5 HZ3 TRP 5 -8.993 10.177 1.017
35 HH2 TRP 5 HH2 TRP 5 -7.963 9.439 3.104
36 H ALA 6 HN ALA 6 -5.000 9.033 -1.830
37 HA ALA 6 HA ALA 6 -6.812 11.127 -1.487
38 1HB ALA 6 HB3 ALA 6 -3.903 11.699 -1.276
39 2HB ALA 6 HB1 ALA 6 -4.589 10.461 -0.224
40 3HB ALA 6 HB2 ALA 6 -5.222 12.107 -0.178
41 H GLN 7 HN GLN 7 -3.975 10.922 -3.648
42 HA GLN 7 HA GLN 7 -4.187 13.478 -4.754
43 1HB GLN 7 HB2 GLN 7 -2.812 12.666 -6.580
44 2HB GLN 7 HB1 GLN 7 -2.219 12.035 -5.051
45 1HG GLN 7 HG2 GLN 7 -2.609 9.914 -5.632
46 2HG GLN 7 HG1 GLN 7 -4.137 10.299 -6.421
47 1HE2 GLN 7 1HE2 GLN 7 -4.076 9.662 -8.446
48 2HE2 GLN 7 2HE2 GLN 7 -2.745 9.838 -9.534
49 H SER 8 HN SER 8 -6.142 10.694 -5.240
50 HA SER 8 HA SER 8 -7.148 11.247 -7.809
51 1HB SER 8 HB2 SER 8 -8.703 9.982 -5.544
52 2HB SER 8 HB1 SER 8 -8.934 9.738 -7.276
53 HG SER 8 HG SER 8 -6.940 8.687 -7.349
54 H GLN 9 HN GLN 9 -7.602 12.787 -4.779
55 HA GLN 9 HA GLN 9 -9.924 14.273 -5.798
56 1HB GLN 9 HB2 GLN 9 -8.968 14.251 -2.943
57 2HB GLN 9 HB1 GLN 9 -10.538 14.750 -3.558
58 1HG GLN 9 HG2 GLN 9 -10.387 12.140 -4.370
59 2HG GLN 9 HG1 GLN 9 -9.568 12.108 -2.809
60 1HE2 GLN 9 1HE2 GLN 9 -10.843 11.691 -1.169
61 2HE2 GLN 9 2HE2 GLN 9 -12.520 12.085 -1.045
62 H GLY 10 HN GLY 10 -6.653 14.552 -4.586
63 1HA GLY 10 HA1 GLY 10 -6.784 17.469 -4.652
64 2HA GLY 10 HA2 GLY 10 -5.757 16.697 -5.849
65 H TYR 11 HN TYR 11 -6.031 15.183 -2.753
66 HA TYR 11 HA TYR 11 -3.886 16.569 -1.484
67 1HB TYR 11 HB2 TYR 11 -5.277 13.958 -0.915
68 2HB TYR 11 HB1 TYR 11 -3.922 14.522 0.057
69 HD1 TYR 11 HD1 TYR 11 -4.166 16.431 1.546
70 HD2 TYR 11 HD2 TYR 11 -7.429 15.080 -0.828
71 HE1 TYR 11 HE1 TYR 11 -5.708 17.774 2.910
72 HE2 TYR 11 HE2 TYR 11 -8.978 16.422 0.528
73 HH TYR 11 HH TYR 11 -8.740 18.578 2.006
74 H ASN 12 HN ASN 12 -1.738 16.023 -1.260
75 HA ASN 12 HA ASN 12 -0.623 14.428 -3.383
76 1HB ASN 12 HB2 ASN 12 0.371 16.588 -2.524
77 2HB ASN 12 HB1 ASN 12 0.850 15.706 -1.077
78 1HD2 ASN 12 1HD2 ASN 12 2.950 16.604 -1.969
79 2HD2 ASN 12 2HD2 ASN 12 3.837 15.566 -3.027
80 H CYS 13 HN CYS 13 0.933 12.691 -3.026
81 HA CYS 13 HA CYS 13 -0.062 10.769 -1.185
82 1HB CYS 13 HB2 CYS 13 2.409 10.738 -2.923
83 2HB CYS 13 HB1 CYS 13 1.793 9.352 -2.030
84 H CYS 14 HN CYS 14 0.719 10.046 0.686
85 HA CYS 14 HA CYS 14 2.705 11.703 2.026
86 1HB CYS 14 HB2 CYS 14 1.834 9.959 3.950
87 2HB CYS 14 HB1 CYS 14 1.127 11.538 3.634
88 H ASN 15 HN ASN 15 4.680 11.002 1.378
89 HA ASN 15 HA ASN 15 5.617 8.528 0.779
90 1HB ASN 15 HB2 ASN 15 7.021 10.488 0.609
91 2HB ASN 15 HB1 ASN 15 6.999 10.710 2.355
92 1HD2 ASN 15 1HD2 ASN 15 9.022 10.436 2.954
93 2HD2 ASN 15 2HD2 ASN 15 10.003 9.059 2.592
94 H ASN 16 HN ASN 16 6.547 6.782 1.914
95 HA ASN 16 HA ASN 16 6.394 5.146 3.500
96 1HB ASN 16 HB2 ASN 16 7.474 5.658 5.587
97 2HB ASN 16 HB1 ASN 16 8.299 6.542 4.307
98 1HD2 ASN 16 1HD2 ASN 16 7.905 8.801 4.123
99 2HD2 ASN 16 2HD2 ASN 16 7.415 9.719 5.499
100 HA PRO 17 HA PRO 17 2.219 6.773 5.051
101 1HB PRO 17 HB2 PRO 17 0.713 4.969 3.652
102 2HB PRO 17 HB1 PRO 17 1.113 6.584 3.056
103 1HG PRO 17 HG2 PRO 17 2.394 3.955 2.419
104 2HG PRO 17 HG1 PRO 17 1.991 5.299 1.333
105 1HD PRO 17 HD2 PRO 17 4.500 4.883 2.226
106 2HD PRO 17 HD1 PRO 17 3.860 6.514 1.936
107 H SER 18 HN SER 18 3.985 3.847 4.876
108 HA SER 18 HA SER 18 2.240 2.212 6.433
109 1HB SER 18 HB2 SER 18 3.934 1.259 4.915
110 2HB SER 18 HB1 SER 18 5.211 1.933 5.928
111 HG SER 18 HG SER 18 4.595 -0.342 6.298
112 H SER 19 HN SER 19 4.119 4.865 7.247
113 HA SER 19 HA SER 19 3.959 4.152 10.075
114 1HB SER 19 HB2 SER 19 6.342 3.876 8.821
115 2HB SER 19 HB1 SER 19 6.439 5.571 9.300
116 HG SER 19 HG SER 19 5.907 4.846 11.454
117 H THR 20 HN THR 20 2.819 6.114 7.932
118 HA THR 20 HA THR 20 3.524 8.704 8.849
119 HB THR 20 HB THR 20 1.390 7.556 7.080
120 HG1 THR 20 HG1 THR 20 2.491 8.729 5.533
121 1HG2 THR 20 3HG2 THR 20 1.631 10.452 7.816
122 2HG2 THR 20 2HG2 THR 20 0.628 9.786 6.528
123 3HG2 THR 20 1HG2 THR 20 0.290 9.380 8.211
124 H LYS 21 HN LYS 21 2.287 10.134 10.113
125 HA LYS 21 HA LYS 21 0.672 8.807 12.136
126 1HB LYS 21 HB2 LYS 21 2.417 10.333 12.889
127 2HB LYS 21 HB1 LYS 21 1.702 11.643 11.961
128 1HG LYS 21 HG2 LYS 21 1.002 12.048 14.139
129 2HG LYS 21 HG1 LYS 21 -0.389 11.262 13.388
130 1HD LYS 21 HD2 LYS 21 -0.203 10.163 15.428
131 2HD LYS 21 HD1 LYS 21 0.634 9.080 14.315
132 1HE LYS 21 HE2 LYS 21 2.365 9.165 15.713
133 2HE LYS 21 HE1 LYS 21 2.610 10.823 15.167
134 1HZ LYS 21 HZ2 LYS 21 0.649 10.385 17.286
135 2HZ LYS 21 HZ1 LYS 21 2.280 10.218 17.699
136 3HZ LYS 21 HZ3 LYS 21 1.715 11.676 17.050
137 H VAL 22 HN VAL 22 -1.435 8.603 11.760
138 HA VAL 22 HA VAL 22 -2.844 10.498 10.099
139 HB VAL 22 HB VAL 22 -3.734 7.909 11.382
140 1HG1 VAL 22 1HG1 VAL 22 -5.423 9.884 10.744
141 2HG1 VAL 22 3HG1 VAL 22 -5.282 9.106 9.170
142 3HG1 VAL 22 2HG1 VAL 22 -5.826 8.179 10.568
143 1HG2 VAL 22 2HG2 VAL 22 -2.016 7.874 9.492
144 2HG2 VAL 22 1HG2 VAL 22 -3.458 6.874 9.307
145 3HG2 VAL 22 3HG2 VAL 22 -3.336 8.414 8.454
146 H GLU 23 HN GLU 23 -3.124 12.307 11.303
147 HA GLU 23 HA GLU 23 -4.134 12.105 14.021
148 1HB GLU 23 HB2 GLU 23 -4.152 14.796 12.938
149 2HB GLU 23 HB1 GLU 23 -3.264 14.156 14.313
150 1HG GLU 23 HG2 GLU 23 -1.565 13.284 12.693
151 2HG GLU 23 HG1 GLU 23 -2.414 14.170 11.427
152 H TYR 24 HN TYR 24 -5.353 12.006 10.951
153 HA TYR 24 HA TYR 24 -8.021 12.772 11.938
154 1HB TYR 24 HB2 TYR 24 -6.891 14.595 10.501
155 2HB TYR 24 HB1 TYR 24 -7.195 13.513 9.148
156 HD1 TYR 24 HD1 TYR 24 -8.509 16.145 11.078
157 HD2 TYR 24 HD2 TYR 24 -9.677 12.659 8.937
158 HE1 TYR 24 HE1 TYR 24 -10.797 17.028 10.899
159 HE2 TYR 24 HE2 TYR 24 -11.969 13.533 8.752
160 HH TYR 24 HH TYR 24 -13.431 15.109 9.820
161 H THR 25 HN THR 25 -9.746 11.630 11.099
162 HA THR 25 HA THR 25 -9.384 9.804 8.907
163 HB THR 25 HB THR 25 -9.964 8.650 11.640
164 HG1 THR 25 HG1 THR 25 -7.638 8.642 10.036
165 1HG2 THR 25 1HG2 THR 25 -10.792 7.622 9.295
166 2HG2 THR 25 3HG2 THR 25 -9.178 6.915 9.405
167 3HG2 THR 25 2HG2 THR 25 -10.347 6.650 10.700
168 H ASP 26 HN ASP 26 -11.158 10.133 7.789
169 HA ASP 26 HA ASP 26 -13.719 10.368 9.229
170 1HB ASP 26 HB2 ASP 26 -12.501 12.195 7.452
171 2HB ASP 26 HB1 ASP 26 -13.843 11.476 6.569
172 H ALA 27 HN ALA 27 -15.334 10.262 6.898
173 HA ALA 27 HA ALA 27 -15.503 7.442 6.550
174 1HB ALA 27 HB1 ALA 27 -17.412 7.896 5.153
175 2HB ALA 27 HB2 ALA 27 -16.950 9.592 5.011
176 3HB ALA 27 HB3 ALA 27 -17.468 8.947 6.568
177 H SER 28 HN SER 28 -13.486 9.673 5.121
178 HA SER 28 HA SER 28 -13.448 8.429 2.493
179 1HB SER 28 HB2 SER 28 -11.487 10.096 2.194
180 2HB SER 28 HB1 SER 28 -13.121 10.747 2.331
181 HG SER 28 HG SER 28 -11.732 11.888 3.688
182 H GLY 29 HN GLY 29 -11.732 8.358 5.506
183 1HA GLY 29 HA1 GLY 29 -9.534 6.820 4.332
184 2HA GLY 29 HA2 GLY 29 -10.557 6.021 5.515
185 H GLN 30 HN GLN 30 -7.645 7.136 5.327
186 HA GLN 30 HA GLN 30 -7.685 8.451 7.966
187 1HB GLN 30 HB2 GLN 30 -5.267 6.953 7.106
188 2HB GLN 30 HB1 GLN 30 -5.947 7.157 8.712
189 1HG GLN 30 HG2 GLN 30 -6.234 4.906 8.255
190 2HG GLN 30 HG1 GLN 30 -7.815 5.612 7.924
191 1HE2 GLN 30 1HE2 GLN 30 -4.862 4.415 6.463
192 2HE2 GLN 30 2HE2 GLN 30 -5.550 4.043 4.922
193 H TRP 31 HN TRP 31 -6.531 10.308 8.197
194 HA TRP 31 HA TRP 31 -4.795 11.106 5.961
195 1HB TRP 31 HB2 TRP 31 -6.599 13.019 7.441
196 2HB TRP 31 HB1 TRP 31 -5.650 13.341 5.996
197 HD1 TRP 31 HD1 TRP 31 -8.752 11.312 7.094
198 HE1 TRP 31 HE1 TRP 31 -10.291 11.044 5.049
199 HE3 TRP 31 HE3 TRP 31 -5.755 13.437 3.541
200 HZ2 TRP 31 HZ2 TRP 31 -10.242 11.656 2.292
201 HZ3 TRP 31 HZ3 TRP 31 -6.575 13.556 1.225
202 HH2 TRP 31 HH2 TRP 31 -8.770 12.684 0.614
203 H GLY 32 HN GLY 32 -3.109 12.570 6.477
204 1HA GLY 32 HA1 GLY 32 -1.482 12.051 8.532
205 2HA GLY 32 HA2 GLY 32 -2.599 13.195 9.265
206 H VAL 33 HN VAL 33 0.198 13.623 8.932
207 HA VAL 33 HA VAL 33 0.460 15.456 6.693
208 HB VAL 33 HB VAL 33 0.728 16.446 9.534
209 1HG1 VAL 33 1HG1 VAL 33 2.382 17.396 7.950
210 2HG1 VAL 33 3HG1 VAL 33 1.047 17.955 6.941
211 3HG1 VAL 33 2HG1 VAL 33 1.249 18.597 8.572
212 1HG2 VAL 33 1HG2 VAL 33 -1.346 16.933 7.411
213 2HG2 VAL 33 3HG2 VAL 33 -1.581 16.327 9.051
214 3HG2 VAL 33 2HG2 VAL 33 -1.120 18.009 8.790
215 H GLN 34 HN GLN 34 2.241 14.491 5.878
216 HA GLN 34 HA GLN 34 4.562 14.247 7.680
217 1HB GLN 34 HB2 GLN 34 3.487 12.184 6.333
218 2HB GLN 34 HB1 GLN 34 4.584 12.787 5.095
219 1HG GLN 34 HG2 GLN 34 6.390 12.040 6.159
220 2HG GLN 34 HG1 GLN 34 5.807 12.581 7.732
221 1HE2 GLN 34 1HE2 GLN 34 5.447 10.055 5.309
222 2HE2 GLN 34 2HE2 GLN 34 5.026 8.793 6.415
223 H ASN 35 HN ASN 35 6.122 15.646 7.342
224 HA ASN 35 HA ASN 35 7.611 17.006 6.307
225 1HB ASN 35 HB2 ASN 35 8.345 16.226 4.341
226 2HB ASN 35 HB1 ASN 35 6.961 15.143 4.312
227 1HD2 ASN 35 1HD2 ASN 35 5.248 15.590 2.966
228 2HD2 ASN 35 2HD2 ASN 35 5.308 16.808 1.743
229 H GLY 36 HN GLY 36 4.667 17.604 6.879
230 1HA GLY 36 HA1 GLY 36 4.794 20.336 5.960
231 2HA GLY 36 HA2 GLY 36 3.580 19.646 7.026
232 H GLN 37 HN GLN 37 2.716 17.534 5.350
233 HA GLN 37 HA GLN 37 1.084 19.082 3.507
234 1HB GLN 37 HB2 GLN 37 2.636 16.679 2.540
235 2HB GLN 37 HB1 GLN 37 1.542 17.675 1.591
236 1HG GLN 37 HG2 GLN 37 3.134 19.606 2.166
237 2HG GLN 37 HG1 GLN 37 4.271 18.338 2.622
238 1HE2 GLN 37 1HE2 GLN 37 2.241 19.482 -0.029
239 2HE2 GLN 37 2HE2 GLN 37 3.255 18.896 -1.298
240 H TRP 38 HN TRP 38 -0.957 18.368 3.439
241 HA TRP 38 HA TRP 38 -1.745 16.184 5.112
242 1HB TRP 38 HB2 TRP 38 -3.237 18.072 3.299
243 2HB TRP 38 HB1 TRP 38 -4.049 16.725 4.091
244 HD1 TRP 38 HD1 TRP 38 -3.049 20.248 4.648
245 HE1 TRP 38 HE1 TRP 38 -3.473 20.924 7.097
246 HE3 TRP 38 HE3 TRP 38 -3.884 15.615 6.633
247 HZ2 TRP 38 HZ2 TRP 38 -4.082 19.656 9.546
248 HZ3 TRP 38 HZ3 TRP 38 -4.380 15.430 9.035
249 HH2 TRP 38 HH2 TRP 38 -4.476 17.410 10.461
250 H CYS 39 HN CYS 39 -2.588 14.193 4.525
251 HA CYS 39 HA CYS 39 -2.980 13.469 1.768
252 1HB CYS 39 HB2 CYS 39 -0.630 13.313 1.664
253 2HB CYS 39 HB1 CYS 39 -0.539 12.526 3.236
254 H GLY 40 HN GLY 40 -3.824 11.386 1.468
255 1HA GLY 40 HA1 GLY 40 -5.457 9.843 2.173
256 2HA GLY 40 HA2 GLY 40 -5.095 10.265 3.846
257 H ILE 41 HN ILE 41 -3.962 8.773 4.955
258 HA ILE 41 HA ILE 41 -1.632 7.574 4.059
259 HB ILE 41 HB ILE 41 -3.475 6.993 6.331
260 1HG1 ILE 41 2HG1 ILE 41 -1.458 7.536 7.621
261 2HG1 ILE 41 1HG1 ILE 41 -0.532 7.656 6.129
262 1HG2 ILE 41 2HG2 ILE 41 -1.172 5.244 5.492
263 2HG2 ILE 41 1HG2 ILE 41 -1.898 5.222 7.099
264 3HG2 ILE 41 3HG2 ILE 41 -2.859 4.768 5.691
265 1HD1 ILE 41 1HD1 ILE 41 -2.940 9.362 6.493
266 2HD1 ILE 41 3HD1 ILE 41 -1.432 9.791 7.295
267 3HD1 ILE 41 2HD1 ILE 41 -1.485 9.649 5.537
268 H ASP 42 HN ASP 42 -1.184 6.028 2.723
269 HA ASP 42 HA ASP 42 -3.080 3.840 2.296
270 1HB ASP 42 HB2 ASP 42 -2.919 5.821 0.441
271 2HB ASP 42 HB1 ASP 42 -1.648 4.738 -0.129
272 H TYR 43 HN TYR 43 -2.000 2.084 2.881
273 HA TYR 43 HA TYR 43 0.874 1.989 2.798
274 1HB TYR 43 HB2 TYR 43 -0.919 -0.370 3.329
275 2HB TYR 43 HB1 TYR 43 0.713 -0.078 3.922
276 HD1 TYR 43 HD1 TYR 43 0.374 2.757 4.857
277 HD2 TYR 43 HD2 TYR 43 -2.107 -0.667 5.338
278 HE1 TYR 43 HE1 TYR 43 -0.549 3.724 6.923
279 HE2 TYR 43 HE2 TYR 43 -3.035 0.290 7.405
280 HH TYR 43 HH TYR 43 -2.310 1.954 9.152
281 H SER 44 HN SER 44 -1.265 1.791 0.383
282 HA SER 44 HA SER 44 0.502 0.116 -1.210
283 1HB SER 44 HB2 SER 44 -2.393 -0.393 -0.703
284 2HB SER 44 HB1 SER 44 -1.763 -0.712 -2.320
285 HG SER 44 HG SER 44 -1.465 -2.151 -0.052
286 H TYR 45 HN TYR 45 0.605 2.795 -1.306
287 HA TYR 45 HA TYR 45 -1.163 3.779 -3.369
288 1HB TYR 45 HB2 TYR 45 -0.451 5.888 -2.823
289 2HB TYR 45 HB1 TYR 45 -0.085 5.064 -1.315
290 HD1 TYR 45 HD1 TYR 45 1.148 7.652 -2.626
291 HD2 TYR 45 HD2 TYR 45 2.381 3.594 -2.358
292 HE1 TYR 45 HE1 TYR 45 3.494 8.362 -2.813
293 HE2 TYR 45 HE2 TYR 45 4.721 4.280 -2.557
294 HH TYR 45 HH TYR 45 5.679 7.305 -3.581
295 H GLY 46 HN GLY 46 0.599 1.562 -4.072
296 1HA GLY 46 HA1 GLY 46 1.673 2.708 -6.501
297 2HA GLY 46 HA2 GLY 46 1.552 0.999 -6.117
298 H GLN 47 HN GLN 47 3.097 0.170 -4.481
299 HA GLN 47 HA GLN 47 5.661 1.611 -4.671
300 1HB GLN 47 HB2 GLN 47 4.691 -0.215 -2.463
301 2HB GLN 47 HB1 GLN 47 6.290 0.511 -2.544
302 1HG GLN 47 HG2 GLN 47 5.563 2.520 -1.851
303 2HG GLN 47 HG1 GLN 47 4.038 2.391 -2.729
304 1HE2 GLN 47 1HE2 GLN 47 4.438 3.325 -0.047
305 2HE2 GLN 47 2HE2 GLN 47 3.542 2.278 0.993
306 H ASN 48 HN ASN 48 7.583 0.170 -4.558
307 HA ASN 48 HA ASN 48 7.103 -2.241 -6.161
308 1HB ASN 48 HB2 ASN 48 9.656 -0.656 -5.800
309 2HB ASN 48 HB1 ASN 48 9.436 -2.028 -6.881
310 1HD2 ASN 48 1HD2 ASN 48 7.017 -1.503 -8.006
311 2HD2 ASN 48 2HD2 ASN 48 7.101 -0.051 -8.937
312 H GLN 49 HN GLN 49 9.059 -3.878 -5.820
313 HA GLN 49 HA GLN 49 8.931 -4.589 -3.009
314 1HB GLN 49 HB2 GLN 49 8.985 -6.726 -3.692
315 2HB GLN 49 HB1 GLN 49 8.772 -6.098 -5.321
316 1HG GLN 49 HG2 GLN 49 11.381 -5.966 -5.295
317 2HG GLN 49 HG1 GLN 49 11.227 -7.134 -3.982
318 1HE2 GLN 49 1HE2 GLN 49 10.905 -9.207 -4.467
319 2HE2 GLN 49 2HE2 GLN 49 10.610 -9.824 -6.054
320 H GLY 50 HN GLY 50 10.621 -2.353 -3.965
321 1HA GLY 50 HA1 GLY 50 12.920 -1.775 -4.069
322 2HA GLY 50 HA2 GLY 50 13.321 -3.368 -3.445
323 H ASN 51 HN ASN 51 11.259 -3.144 -1.324
324 HA ASN 51 HA ASN 51 11.277 -2.662 0.904
325 1HB ASN 51 HB2 ASN 51 13.914 -2.714 0.340
326 2HB ASN 51 HB1 ASN 51 13.750 -1.028 0.823
327 1HD2 ASN 51 1HD2 ASN 51 12.357 -4.101 1.932
328 2HD2 ASN 51 2HD2 ASN 51 12.769 -3.881 3.595
329 H GLU 52 HN GLU 52 9.631 -1.170 -0.456
330 HA GLU 52 HA GLU 52 10.187 1.653 -0.020
331 1HB GLU 52 HB2 GLU 52 7.984 0.142 -1.395
332 2HB GLU 52 HB1 GLU 52 7.812 1.852 -1.022
333 1HG GLU 52 HG2 GLU 52 10.336 1.296 -2.311
334 2HG GLU 52 HG1 GLU 52 8.971 0.743 -3.280
335 H SER 53 HN SER 53 8.374 -0.945 1.387
336 HA SER 53 HA SER 53 7.800 0.629 3.720
337 1HB SER 53 HB2 SER 53 5.420 0.547 3.663
338 2HB SER 53 HB1 SER 53 5.920 1.164 2.088
339 HG SER 53 HG SER 53 4.421 -0.415 1.711
340 H CYS 54 HN CYS 54 5.864 -0.983 4.889
341 HA CYS 54 HA CYS 54 7.038 -3.673 4.814
342 1HB CYS 54 HB2 CYS 54 7.248 -3.804 7.164
343 2HB CYS 54 HB1 CYS 54 7.904 -2.227 6.742
344 H THR 55 HN THR 55 5.655 -5.356 5.741
345 HA THR 55 HA THR 55 2.851 -4.805 5.136
346 HB THR 55 HB THR 55 4.318 -7.392 5.701
347 HG1 THR 55 HG1 THR 55 3.072 -6.480 3.328
348 1HG2 THR 55 2HG2 THR 55 1.420 -7.016 4.969
349 2HG2 THR 55 1HG2 THR 55 2.285 -8.557 4.962
350 3HG2 THR 55 3HG2 THR 55 2.049 -7.682 6.476
351 H GLY 56 HN GLY 56 1.174 -5.683 6.602
352 1HA GLY 56 HA1 GLY 56 1.864 -6.159 9.343
353 2HA GLY 56 HA2 GLY 56 0.242 -5.998 8.687
354 H ASN 57 HN ASN 57 1.380 -3.346 7.487
355 HA ASN 57 HA ASN 57 1.661 -1.709 9.838
356 1HB ASN 57 HB2 ASN 57 1.453 0.177 8.064
357 2HB ASN 57 HB1 ASN 57 2.887 -0.839 8.072
358 1HD2 ASN 57 1HD2 ASN 57 -0.225 -1.923 6.861
359 2HD2 ASN 57 2HD2 ASN 57 0.241 -1.992 5.204
360 H GLY 58 HN GLY 58 -0.958 -3.210 8.676
361 1HA GLY 58 HA1 GLY 58 -3.213 -2.561 8.392
362 2HA GLY 58 HA2 GLY 58 -2.794 -0.949 8.950
363 H SER 59 HN SER 59 -1.281 -2.915 11.068
364 HA SER 59 HA SER 59 -3.257 -2.456 13.093
365 1HB SER 59 HB2 SER 59 -4.191 -4.499 12.206
366 2HB SER 59 HB1 SER 59 -2.614 -5.288 12.251
367 HG SER 59 HG SER 59 -2.807 -5.588 14.345
368 H TYR 60 HN TYR 60 -0.487 -4.630 12.497
369 HA TYR 60 HA TYR 60 0.674 -3.723 15.039
370 1HB TYR 60 HB2 TYR 60 2.073 -5.931 13.764
371 2HB TYR 60 HB1 TYR 60 1.370 -5.832 15.374
372 HD1 TYR 60 HD1 TYR 60 0.742 -6.744 11.871
373 HD2 TYR 60 HD2 TYR 60 -0.804 -6.749 15.833
374 HE1 TYR 60 HE1 TYR 60 -1.020 -8.310 11.174
375 HE2 TYR 60 HE2 TYR 60 -2.573 -8.314 15.147
376 HH TYR 60 HH TYR 60 -2.498 -10.034 12.283
377 HA PRO 61 HA PRO 61 4.204 -1.996 12.958
378 1HB PRO 61 HB2 PRO 61 6.317 -2.667 14.406
379 2HB PRO 61 HB1 PRO 61 4.974 -1.795 15.158
380 1HG PRO 61 HG2 PRO 61 5.629 -4.719 15.264
381 2HG PRO 61 HG1 PRO 61 5.100 -3.643 16.572
382 1HD PRO 61 HD2 PRO 61 3.444 -5.341 15.139
383 2HD PRO 61 HD1 PRO 61 2.897 -3.921 16.051
384 H CYS 62 HN CYS 62 6.454 -2.383 12.012
385 HA CYS 62 HA CYS 62 6.355 -4.678 10.288
386 1HB CYS 62 HB2 CYS 62 8.781 -2.931 10.484
387 2HB CYS 62 HB1 CYS 62 8.060 -3.679 9.067
388 H CYS 63 HN CYS 63 8.507 -5.963 10.005
389 HA CYS 63 HA CYS 63 9.334 -6.800 12.701
390 1HB CYS 63 HB2 CYS 63 8.408 -8.269 10.465
391 2HB CYS 63 HB1 CYS 63 10.103 -8.687 10.681
392 H ASN 64 HN ASN 64 10.500 -5.878 9.556
393 HA ASN 64 HA ASN 64 12.484 -4.699 9.158
394 1HB ASN 64 HB2 ASN 64 13.063 -4.528 11.551
395 2HB ASN 64 HB1 ASN 64 13.628 -6.195 11.528
396 1HD2 ASN 64 1HD2 ASN 64 15.587 -6.674 10.727
397 2HD2 ASN 64 2HD2 ASN 64 16.728 -5.492 10.191
398 H THR 65 HN THR 65 11.757 -7.968 9.393
399 HA THR 65 HA THR 65 14.003 -8.693 7.644
400 HB THR 65 HB THR 65 13.590 -9.862 9.921
401 HG1 THR 65 HG1 THR 65 13.992 -11.202 7.469
402 1HG2 THR 65 2HG2 THR 65 11.175 -10.290 9.565
403 2HG2 THR 65 1HG2 THR 65 11.606 -11.415 8.279
404 3HG2 THR 65 3HG2 THR 65 12.112 -11.736 9.937
405 H CYS 66 HN CYS 66 13.587 -9.512 5.642
406 HA CYS 66 HA CYS 66 10.844 -9.332 4.702
407 1HB CYS 66 HB2 CYS 66 11.710 -9.049 2.602
408 2HB CYS 66 HB1 CYS 66 13.131 -8.579 3.522
409 H GLN 67 HN GLN 67 12.359 -11.564 6.354
410 HA GLN 67 HA GLN 67 11.667 -13.912 4.788
411 1HB GLN 67 HB2 GLN 67 13.682 -14.306 5.863
412 2HB GLN 67 HB1 GLN 67 13.232 -13.364 7.273
413 1HG GLN 67 HG2 GLN 67 11.562 -15.702 7.033
414 2HG GLN 67 HG1 GLN 67 13.269 -16.135 7.024
415 1HE2 GLN 67 1HE2 GLN 67 11.860 -13.359 8.666
416 2HE2 GLN 67 2HE2 GLN 67 12.215 -13.896 10.268
417 H ALA 68 HN ALA 68 9.487 -14.157 4.768
418 HA ALA 68 HA ALA 68 7.968 -13.728 7.194
419 1HB ALA 68 HB3 ALA 68 7.382 -13.800 4.373
420 2HB ALA 68 HB2 ALA 68 6.234 -14.767 5.303
421 3HB ALA 68 HB1 ALA 68 6.484 -13.065 5.702
422 H THR 69 HN THR 69 7.257 -15.198 8.501
423 HA THR 69 HA THR 69 7.913 -17.999 7.982
424 HB THR 69 HB THR 69 8.628 -17.834 10.106
425 HG1 THR 69 HG1 THR 69 6.725 -18.934 10.570
426 1HG2 THR 69 1HG2 THR 69 8.537 -15.361 9.962
427 2HG2 THR 69 3HG2 THR 69 6.891 -15.431 10.604
428 3HG2 THR 69 2HG2 THR 69 8.246 -15.997 11.585
429 H TYR 70 HN TYR 70 5.274 -15.852 8.012
430 HA TYR 70 HA TYR 70 3.447 -18.002 7.411
431 1HB TYR 70 HB2 TYR 70 2.088 -17.890 9.237
432 2HB TYR 70 HB1 TYR 70 3.566 -17.350 10.022
433 HD1 TYR 70 HD1 TYR 70 0.687 -15.880 8.123
434 HD2 TYR 70 HD2 TYR 70 3.428 -15.479 11.353
435 HE1 TYR 70 HE1 TYR 70 -0.446 -13.819 8.820
436 HE2 TYR 70 HE2 TYR 70 2.302 -13.408 12.056
437 HH TYR 70 HH TYR 70 -0.543 -12.549 11.403
438 H THR 71 HN THR 71 1.918 -17.357 5.965
439 HA THR 71 HA THR 71 1.799 -14.471 5.381
440 HB THR 71 HB THR 71 1.514 -16.819 3.504
441 HG1 THR 71 HG1 THR 71 3.363 -15.931 2.570
442 1HG2 THR 71 3HG2 THR 71 -0.027 -14.882 2.985
443 2HG2 THR 71 2HG2 THR 71 1.432 -13.928 2.711
444 3HG2 THR 71 1HG2 THR 71 1.109 -15.350 1.718
445 H ASP 72 HN ASP 72 -0.150 -13.497 5.151
446 HA ASP 72 HA ASP 72 -2.514 -15.169 5.668
447 1HB ASP 72 HB2 ASP 72 -1.522 -13.173 7.297
448 2HB ASP 72 HB1 ASP 72 -2.784 -12.344 6.391
449 H GLY 73 HN GLY 73 -4.467 -13.259 5.278
450 1HA GLY 73 HA1 GLY 73 -5.812 -12.624 3.516
451 2HA GLY 73 HA2 GLY 73 -4.583 -13.219 2.415
452 H ASP 74 HN ASP 74 -2.790 -11.251 4.239
453 HA ASP 74 HA ASP 74 -3.377 -8.939 2.509
454 1HB ASP 74 HB2 ASP 74 -2.327 -8.664 5.320
455 2HB ASP 74 HB1 ASP 74 -2.977 -7.407 4.274
456 H GLY 75 HN GLY 75 -1.277 -11.318 2.940
457 1HA GLY 75 HA1 GLY 75 1.103 -9.617 2.569
458 2HA GLY 75 HA2 GLY 75 0.748 -10.945 1.472
459 H ASP 76 HN ASP 76 3.153 -10.854 2.780
460 HA ASP 76 HA ASP 76 2.988 -13.295 4.338
461 1HB ASP 76 HB2 ASP 76 5.603 -11.935 3.926
462 2HB ASP 76 HB1 ASP 76 5.188 -13.641 3.820
463 H TRP 77 HN TRP 77 4.228 -13.504 6.367
464 HA TRP 77 HA TRP 77 4.486 -11.034 7.900
465 1HB TRP 77 HB2 TRP 77 2.852 -13.379 8.867
466 2HB TRP 77 HB1 TRP 77 3.131 -11.870 9.728
467 HD1 TRP 77 HD1 TRP 77 1.231 -13.215 6.641
468 HE1 TRP 77 HE1 TRP 77 -0.701 -11.608 6.128
469 HE3 TRP 77 HE3 TRP 77 2.295 -9.555 10.049
470 HZ2 TRP 77 HZ2 TRP 77 -1.653 -9.129 7.039
471 HZ3 TRP 77 HZ3 TRP 77 0.813 -7.597 10.158
472 HH2 TRP 77 HH2 TRP 77 -1.121 -7.389 8.685
473 H ALA 78 HN ALA 78 5.650 -11.207 9.853
474 HA ALA 78 HA ALA 78 7.227 -13.651 10.153
475 1HB ALA 78 HB1 ALA 78 9.149 -11.923 10.715
476 2HB ALA 78 HB2 ALA 78 8.228 -10.914 9.600
477 3HB ALA 78 HB3 ALA 78 8.847 -12.478 9.069
478 H PHE 79 HN PHE 79 8.532 -13.558 12.260
479 HA PHE 79 HA PHE 79 7.053 -12.093 14.335
480 1HB PHE 79 HB2 PHE 79 6.219 -14.411 14.263
481 2HB PHE 79 HB1 PHE 79 7.861 -15.006 14.489
482 HD1 PHE 79 HD1 PHE 79 8.607 -15.466 16.620
483 HD2 PHE 79 HD2 PHE 79 5.340 -12.789 16.103
484 HE1 PHE 79 HE1 PHE 79 8.309 -15.367 19.060
485 HE2 PHE 79 HE2 PHE 79 5.036 -12.684 18.543
486 HZ PHE 79 HZ PHE 79 6.522 -13.974 20.024
487 H GLU 80 HN GLU 80 8.523 -10.708 15.088
488 HA GLU 80 HA GLU 80 11.014 -11.804 16.143
489 1HB GLU 80 HB2 GLU 80 12.443 -10.373 15.029
490 2HB GLU 80 HB1 GLU 80 11.267 -10.740 13.779
491 1HG GLU 80 HG2 GLU 80 11.396 -8.493 13.518
492 2HG GLU 80 HG1 GLU 80 10.111 -8.563 14.724
493 H ASN 81 HN ASN 81 12.024 -10.446 17.751
494 HA ASN 81 HA ASN 81 11.950 -9.199 19.651
495 1HB ASN 81 HB2 ASN 81 10.704 -7.526 17.578
496 2HB ASN 81 HB1 ASN 81 10.274 -7.075 19.225
497 1HD2 ASN 81 1HD2 ASN 81 13.295 -8.460 18.052
498 2HD2 ASN 81 2HD2 ASN 81 14.288 -7.114 18.485
499 H GLY 82 HN GLY 82 9.796 -11.248 18.998
500 1HA GLY 82 HA1 GLY 82 8.313 -10.943 21.401
501 2HA GLY 82 HA2 GLY 82 8.055 -12.173 20.174
502 H ASN 83 HN ASN 83 7.560 -10.348 18.000
503 HA ASN 83 HA ASN 83 4.812 -9.649 18.700
504 1HB ASN 83 HB2 ASN 83 5.233 -7.445 17.329
505 2HB ASN 83 HB1 ASN 83 5.611 -7.511 19.047
506 1HD2 ASN 83 1HD2 ASN 83 6.805 -6.998 15.918
507 2HD2 ASN 83 2HD2 ASN 83 8.472 -6.804 16.326
508 H TRP 84 HN TRP 84 3.376 -9.792 17.027
509 HA TRP 84 HA TRP 84 4.255 -11.235 14.696
510 1HB TRP 84 HB2 TRP 84 1.539 -10.227 15.563
511 2HB TRP 84 HB1 TRP 84 1.810 -11.153 14.091
512 HD1 TRP 84 HD1 TRP 84 0.777 -11.654 17.532
513 HE1 TRP 84 HE1 TRP 84 1.046 -14.111 18.252
514 HE3 TRP 84 HE3 TRP 84 3.765 -13.296 13.723
515 HZ2 TRP 84 HZ2 TRP 84 2.352 -16.437 17.328
516 HZ3 TRP 84 HZ3 TRP 84 4.480 -15.650 13.715
517 HH2 TRP 84 HH2 TRP 84 3.789 -17.187 15.482
518 H CYS 85 HN CYS 85 5.609 -9.697 13.709
519 HA CYS 85 HA CYS 85 4.352 -7.288 12.643
520 1HB CYS 85 HB2 CYS 85 6.970 -7.368 11.685
521 2HB CYS 85 HB1 CYS 85 6.379 -6.424 13.043
522 H GLY 86 HN GLY 86 4.577 -6.749 10.366
523 1HA GLY 86 HA1 GLY 86 3.784 -7.456 8.264
524 2HA GLY 86 HA2 GLY 86 4.123 -9.118 8.718
525 H ILE 87 HN ILE 87 5.049 -9.166 6.485
526 HA ILE 87 HA ILE 87 7.893 -8.784 6.659
527 HB ILE 87 HB ILE 87 6.136 -10.410 5.061
528 1HG1 ILE 87 2HG1 ILE 87 8.043 -11.837 4.936
529 2HG1 ILE 87 1HG1 ILE 87 9.144 -10.499 5.241
530 1HG2 ILE 87 2HG2 ILE 87 6.583 -8.801 3.267
531 2HG2 ILE 87 1HG2 ILE 87 8.318 -9.025 3.512
532 3HG2 ILE 87 3HG2 ILE 87 7.326 -10.368 2.945
533 1HD1 ILE 87 2HD1 ILE 87 7.147 -11.544 7.229
534 2HD1 ILE 87 1HD1 ILE 87 8.845 -12.010 7.160
535 3HD1 ILE 87 3HD1 ILE 87 8.407 -10.341 7.511
536 H LYS 88 HN LYS 88 9.189 -7.574 5.293
537 HA LYS 88 HA LYS 88 8.321 -4.980 4.775
538 1HB LYS 88 HB2 LYS 88 10.688 -6.299 3.473
539 2HB LYS 88 HB1 LYS 88 10.468 -4.590 3.827
540 1HG LYS 88 HG2 LYS 88 10.813 -6.804 5.831
541 2HG LYS 88 HG1 LYS 88 11.999 -5.569 5.409
542 1HD LYS 88 HD2 LYS 88 11.152 -4.541 7.237
543 2HD LYS 88 HD1 LYS 88 9.924 -4.001 6.091
544 1HE LYS 88 HE2 LYS 88 9.116 -4.992 8.301
545 2HE LYS 88 HE1 LYS 88 8.377 -5.602 6.823
546 1HZ LYS 88 HZ1 LYS 88 10.721 -7.024 7.809
547 2HZ LYS 88 HZ3 LYS 88 9.304 -7.187 8.716
548 3HZ LYS 88 HZ2 LYS 88 9.320 -7.627 7.086
549 H ASN 89 HN ASN 89 8.454 -3.864 2.669
550 HA ASN 89 HA ASN 89 6.603 -4.982 0.851
551 1HB ASN 89 HB2 ASN 89 7.178 -2.489 1.391
552 2HB ASN 89 HB1 ASN 89 8.380 -2.684 0.119
553 1HD2 ASN 89 1HD2 ASN 89 5.765 -1.175 0.431
554 2HD2 ASN 89 2HD2 ASN 89 4.898 -1.550 -1.014
555 H SER 90 HN SER 90 9.925 -5.412 1.208
556 HA SER 90 HA SER 90 10.654 -5.727 -1.522
557 1HB SER 90 HB2 SER 90 12.475 -5.238 -0.175
558 2HB SER 90 HB1 SER 90 11.924 -6.296 1.125
559 HG SER 90 HG SER 90 12.673 -8.040 0.034
560 H CYS 91 HN CYS 91 10.504 -8.176 1.057
561 HA CYS 91 HA CYS 91 10.207 -10.247 -0.959
562 1HB CYS 91 HB2 CYS 91 10.626 -10.370 2.023
563 2HB CYS 91 HB1 CYS 91 10.338 -11.798 1.040
564 H LYS 92 HN LYS 92 8.046 -8.744 -1.072
565 HA LYS 92 HA LYS 92 5.955 -10.250 0.347
566 1HB LYS 92 HB2 LYS 92 4.478 -8.290 -0.258
567 2HB LYS 92 HB1 LYS 92 5.744 -7.955 0.913
568 1HG LYS 92 HG2 LYS 92 6.030 -6.149 -0.406
569 2HG LYS 92 HG1 LYS 92 7.055 -7.269 -1.294
570 1HD LYS 92 HD2 LYS 92 5.705 -6.202 -2.905
571 2HD LYS 92 HD1 LYS 92 5.021 -7.816 -2.689
572 1HE LYS 92 HE2 LYS 92 3.197 -6.308 -2.729
573 2HE LYS 92 HE1 LYS 92 3.412 -6.801 -1.049
574 1HZ LYS 92 HZ2 LYS 92 4.715 -4.352 -2.030
575 2HZ LYS 92 HZ1 LYS 92 3.074 -4.317 -1.620
576 3HZ LYS 92 HZ3 LYS 92 4.228 -4.749 -0.460
577 H GLN 93 HN GLN 93 7.100 -9.088 -2.746
578 HA GLN 93 HA GLN 93 5.544 -11.130 -4.096
579 1HB GLN 93 HB2 GLN 93 5.167 -8.183 -4.627
580 2HB GLN 93 HB1 GLN 93 4.738 -9.418 -5.800
581 1HG GLN 93 HG2 GLN 93 3.631 -9.326 -3.007
582 2HG GLN 93 HG1 GLN 93 2.854 -8.569 -4.397
583 1HE2 GLN 93 1HE2 GLN 93 3.917 -11.629 -3.045
584 2HE2 GLN 93 2HE2 GLN 93 2.815 -12.620 -3.934
585 H GLN 94 HN GLN 94 5.983 -10.692 -6.639
586 HA GLN 94 HA GLN 94 8.883 -10.331 -6.865
587 1HB GLN 94 HB2 GLN 94 7.050 -12.356 -8.002
588 2HB GLN 94 HB1 GLN 94 8.354 -11.799 -9.044
589 1HG GLN 94 HG2 GLN 94 8.595 -13.085 -6.344
590 2HG GLN 94 HG1 GLN 94 9.040 -13.773 -7.904
591 1HE2 GLN 94 1HE2 GLN 94 10.937 -13.140 -8.888
592 2HE2 GLN 94 2HE2 GLN 94 12.156 -12.227 -8.073
593 HA PRO 95 HA PRO 95 7.324 -8.431 -10.973
594 1HB PRO 95 HB2 PRO 95 4.694 -8.643 -11.589
595 2HB PRO 95 HB1 PRO 95 5.870 -9.899 -12.002
596 1HG PRO 95 HG2 PRO 95 4.024 -9.761 -9.635
597 2HG PRO 95 HG1 PRO 95 4.302 -11.117 -10.742
598 1HD PRO 95 HD2 PRO 95 5.474 -11.006 -8.368
599 2HD PRO 95 HD1 PRO 95 6.335 -11.627 -9.790
600 H GLN 96 HN GLN 96 7.440 -7.128 -8.549
601 HA GLN 96 HA GLN 96 5.302 -5.685 -7.635
602 1HB GLN 96 HB2 GLN 96 7.017 -3.876 -7.122
603 2HB GLN 96 HB1 GLN 96 7.338 -5.476 -6.471
604 1HG GLN 96 HG2 GLN 96 9.394 -5.068 -7.299
605 2HG GLN 96 HG1 GLN 96 8.667 -5.685 -8.780
606 1HE2 GLN 96 1HE2 GLN 96 10.874 -3.772 -8.314
607 2HE2 GLN 96 2HE2 GLN 96 10.440 -2.352 -9.197
608 H ASN 97 HN ASN 97 7.018 -5.278 -10.634
609 HA ASN 97 HA ASN 97 6.423 -2.674 -11.322
610 1HB ASN 97 HB2 ASN 97 7.821 -4.336 -12.623
611 2HB ASN 97 HB1 ASN 97 6.315 -4.987 -13.260
612 1HD2 ASN 97 1HD2 ASN 97 7.592 -4.314 -15.246
613 2HD2 ASN 97 2HD2 ASN 97 7.280 -2.726 -15.850
614 H ASN 98 HN ASN 98 4.301 -5.423 -11.156
615 HA ASN 98 HA ASN 98 2.029 -3.681 -11.661
616 1HB ASN 98 HB2 ASN 98 2.887 -5.867 -13.473
617 2HB ASN 98 HB1 ASN 98 1.165 -5.782 -13.112
618 1HD2 ASN 98 1HD2 ASN 98 0.467 -3.295 -13.089
619 2HD2 ASN 98 2HD2 ASN 98 0.871 -2.467 -14.550
620 H ASN 99 HN ASN 99 0.139 -4.352 -10.673
621 HA ASN 99 HA ASN 99 0.436 -6.651 -8.861
622 1HB ASN 99 HB2 ASN 99 -0.908 -4.001 -8.597
623 2HB ASN 99 HB1 ASN 99 -1.606 -5.373 -7.742
624 1HD2 ASN 99 1HD2 ASN 99 -0.884 -3.576 -6.092
625 2HD2 ASN 99 2HD2 ASN 99 0.642 -3.884 -5.344
626 H GLN 100 HN GLN 100 -0.275 -8.196 -10.369
627 HA GLN 100 HA GLN 100 -1.744 -9.383 -11.659
628 1HB GLN 100 HB2 GLN 100 -3.975 -9.722 -10.489
629 2HB GLN 100 HB1 GLN 100 -2.536 -10.121 -9.564
630 1HG GLN 100 HG2 GLN 100 -2.698 -8.046 -8.342
631 2HG GLN 100 HG1 GLN 100 -4.073 -7.545 -9.325
632 1HE2 GLN 100 1HE2 GLN 100 -5.800 -9.426 -9.389
633 2HE2 GLN 100 2HE2 GLN 100 -6.266 -9.996 -7.826
No H/Q in entry = 633