Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
504813 | 2en4 RC | 10233 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -16.314 23.359 7.337
2 HA2 GLY 1 1HA GLY 1 -19.181 23.103 7.526
3 HA3 GLY 1 2HA GLY 1 -18.632 23.733 5.979
4 H SER 2 H SER 2 -19.501 21.865 4.959
5 HA SER 2 HA SER 2 -18.868 19.225 5.585
6 HB2 SER 2 1HB SER 2 -20.614 20.013 3.938
7 HB3 SER 2 2HB SER 2 -19.306 20.285 2.787
8 HG SER 2 HG SER 2 -20.381 17.900 3.738
9 H SER 3 H SER 3 -17.572 17.767 4.053
10 HA SER 3 HA SER 3 -15.054 19.047 3.248
11 HB2 SER 3 1HB SER 3 -15.086 17.824 5.589
12 HB3 SER 3 2HB SER 3 -14.946 16.376 4.593
13 HG SER 3 HG SER 3 -12.887 16.934 4.862
14 H GLY 4 H GLY 4 -15.078 18.742 1.105
15 HA2 GLY 4 1HA GLY 4 -15.250 15.977 0.137
16 HA3 GLY 4 2HA GLY 4 -16.308 17.180 -0.586
17 H SER 5 H SER 5 -13.249 15.737 -0.661
18 HA SER 5 HA SER 5 -12.507 17.207 -3.003
19 HB2 SER 5 1HB SER 5 -10.320 18.014 -2.077
20 HB3 SER 5 2HB SER 5 -11.727 18.839 -1.406
21 HG SER 5 HG SER 5 -11.559 17.472 0.419
22 H SER 6 H SER 6 -11.595 15.778 -4.310
23 HA SER 6 HA SER 6 -9.670 13.856 -3.293
24 HB2 SER 6 1HB SER 6 -11.959 12.790 -3.101
25 HB3 SER 6 2HB SER 6 -12.059 12.870 -4.860
26 HG SER 6 HG SER 6 -11.138 10.966 -4.649
27 H GLY 7 H GLY 7 -8.981 12.385 -5.275
28 HA2 GLY 7 1HA GLY 7 -8.355 14.279 -7.430
29 HA3 GLY 7 2HA GLY 7 -7.462 12.811 -7.058
30 H THR 8 H THR 8 -9.273 10.853 -7.070
31 HA THR 8 HA THR 8 -11.129 10.993 -9.230
32 HB THR 8 HB THR 8 -9.038 10.933 -10.540
33 HG1 THR 8 HG1 THR 8 -9.648 9.032 -11.773
34 HG21 THR 8 3HG2 THR 8 -8.339 8.184 -10.093
35 HG22 THR 8 1HG2 THR 8 -8.233 9.082 -8.580
36 HG23 THR 8 2HG2 THR 8 -7.322 9.621 -9.991
37 H LYS 9 H LYS 9 -11.924 8.725 -9.813
38 HA LYS 9 HA LYS 9 -11.988 7.120 -7.348
39 HB2 LYS 9 1HB LYS 9 -14.175 6.413 -7.931
40 HB3 LYS 9 2HB LYS 9 -14.135 8.148 -8.218
41 HG2 LYS 9 1HG LYS 9 -13.484 6.381 -10.503
42 HG3 LYS 9 2HG LYS 9 -15.163 6.432 -9.961
43 HD2 LYS 9 1HD LYS 9 -13.722 9.009 -10.329
44 HD3 LYS 9 2HD LYS 9 -14.235 8.126 -11.769
45 HE2 LYS 9 1HE LYS 9 -16.534 8.040 -10.808
46 HE3 LYS 9 2HE LYS 9 -15.975 9.081 -9.500
47 HZ1 LYS 9 3HZ LYS 9 -15.218 10.581 -11.467
48 HZ2 LYS 9 1HZ LYS 9 -16.832 10.601 -10.959
49 HZ3 LYS 9 2HZ LYS 9 -16.389 9.722 -12.335
50 H GLU 10 H GLU 10 -9.995 7.001 -9.570
51 HA GLU 10 HA GLU 10 -10.251 4.125 -10.086
52 HB2 GLU 10 1HB GLU 10 -9.900 4.276 -12.353
53 HB3 GLU 10 2HB GLU 10 -10.849 5.731 -12.082
54 HG2 GLU 10 1HG GLU 10 -8.546 6.880 -11.796
55 HG3 GLU 10 2HG GLU 10 -7.929 5.458 -12.635
56 H LYS 11 H LYS 11 -8.431 2.999 -9.734
57 HA LYS 11 HA LYS 11 -6.378 2.634 -8.756
58 HB2 LYS 11 1HB LYS 11 -5.412 4.448 -10.961
59 HB3 LYS 11 2HB LYS 11 -4.592 3.058 -10.264
60 HG2 LYS 11 1HG LYS 11 -6.751 1.812 -11.178
61 HG3 LYS 11 2HG LYS 11 -6.738 3.176 -12.299
62 HD2 LYS 11 1HD LYS 11 -4.345 2.641 -12.793
63 HD3 LYS 11 2HD LYS 11 -4.527 1.182 -11.817
64 HE2 LYS 11 1HE LYS 11 -4.989 0.310 -13.871
65 HE3 LYS 11 2HE LYS 11 -6.612 0.824 -13.412
66 HZ1 LYS 11 3HZ LYS 11 -6.295 2.854 -14.671
67 HZ2 LYS 11 1HZ LYS 11 -6.055 1.506 -15.665
68 HZ3 LYS 11 2HZ LYS 11 -4.727 2.384 -15.095
69 HA PRO 12 HA PRO 12 -6.185 7.008 -6.923
70 HB2 PRO 12 1HB PRO 12 -7.385 6.450 -4.553
71 HB3 PRO 12 2HB PRO 12 -8.279 6.992 -5.978
72 HG2 PRO 12 1HG PRO 12 -7.919 4.219 -4.909
73 HG3 PRO 12 2HG PRO 12 -9.383 4.992 -5.543
74 HD2 PRO 12 1HD PRO 12 -7.887 3.281 -7.014
75 HD3 PRO 12 2HD PRO 12 -8.773 4.639 -7.737
76 H TYR 13 H TYR 13 -5.702 3.776 -5.604
77 HA TYR 13 HA TYR 13 -3.853 4.617 -3.583
78 HB2 TYR 13 1HB TYR 13 -4.699 1.947 -4.677
79 HB3 TYR 13 2HB TYR 13 -3.354 2.076 -3.550
80 HD1 TYR 13 HD1 TYR 13 -6.438 4.128 -3.498
81 HD2 TYR 13 HD2 TYR 13 -4.269 0.946 -1.686
82 HE1 TYR 13 HE1 TYR 13 -8.021 4.127 -1.616
83 HE2 TYR 13 HE2 TYR 13 -5.847 0.937 0.200
84 HH TYR 13 HH TYR 13 -8.131 3.434 0.698
85 H LYS 14 H LYS 14 -1.834 5.226 -3.928
86 HA LYS 14 HA LYS 14 -0.410 4.139 -6.268
87 HB2 LYS 14 1HB LYS 14 -0.642 6.440 -6.678
88 HB3 LYS 14 2HB LYS 14 -0.349 6.861 -4.995
89 HG2 LYS 14 1HG LYS 14 1.951 6.540 -5.189
90 HG3 LYS 14 2HG LYS 14 1.787 5.594 -6.669
91 HD2 LYS 14 1HD LYS 14 1.358 7.486 -7.971
92 HD3 LYS 14 2HD LYS 14 0.937 8.469 -6.567
93 HE2 LYS 14 1HE LYS 14 3.689 7.354 -6.737
94 HE3 LYS 14 2HE LYS 14 3.272 8.706 -7.788
95 HZ1 LYS 14 3HZ LYS 14 2.619 8.879 -4.932
96 HZ2 LYS 14 1HZ LYS 14 2.996 10.113 -6.026
97 HZ3 LYS 14 2HZ LYS 14 4.222 9.121 -5.415
98 H CYS 15 H CYS 15 1.375 2.995 -5.892
99 HA CYS 15 HA CYS 15 2.207 2.384 -3.255
100 HB2 CYS 15 1HB CYS 15 2.421 0.821 -5.167
101 HB3 CYS 15 2HB CYS 15 3.660 1.864 -5.857
102 H TYR 16 H TYR 16 3.226 3.781 -1.981
103 HA TYR 16 HA TYR 16 4.766 5.966 -2.966
104 HB2 TYR 16 1HB TYR 16 4.763 4.902 -0.141
105 HB3 TYR 16 2HB TYR 16 5.132 6.538 -0.673
106 HD1 TYR 16 HD1 TYR 16 2.883 7.018 -2.553
107 HD2 TYR 16 HD2 TYR 16 2.937 5.191 1.290
108 HE1 TYR 16 HE1 TYR 16 0.531 7.658 -2.222
109 HE2 TYR 16 HE2 TYR 16 0.585 5.825 1.630
110 HH TYR 16 HH TYR 16 -1.469 6.502 -0.527
111 H GLU 17 H GLU 17 5.469 2.724 -2.633
112 HA GLU 17 HA GLU 17 8.215 2.953 -1.817
113 HB2 GLU 17 1HB GLU 17 6.967 0.596 -3.221
114 HB3 GLU 17 2HB GLU 17 8.353 0.603 -2.140
115 HG2 GLU 17 1HG GLU 17 6.644 1.474 -0.387
116 HG3 GLU 17 2HG GLU 17 5.449 0.801 -1.493
117 H CYS 18 H CYS 18 6.565 2.228 -4.887
118 HA CYS 18 HA CYS 18 9.048 2.970 -6.291
119 HB2 CYS 18 1HB CYS 18 8.380 1.497 -8.101
120 HB3 CYS 18 2HB CYS 18 8.393 0.599 -6.587
121 H GLY 19 H GLY 19 5.524 3.204 -6.289
122 HA2 GLY 19 1HA GLY 19 4.690 5.499 -6.783
123 HA3 GLY 19 2HA GLY 19 5.767 5.470 -8.172
124 H LYS 20 H LYS 20 4.297 2.479 -7.536
125 HA LYS 20 HA LYS 20 2.868 2.520 -9.995
126 HB2 LYS 20 1HB LYS 20 3.135 0.571 -7.735
127 HB3 LYS 20 2HB LYS 20 1.905 0.312 -8.965
128 HG2 LYS 20 1HG LYS 20 4.718 0.822 -9.806
129 HG3 LYS 20 2HG LYS 20 4.267 -0.771 -9.195
130 HD2 LYS 20 1HD LYS 20 2.271 -0.469 -10.902
131 HD3 LYS 20 2HD LYS 20 3.414 0.629 -11.680
132 HE2 LYS 20 1HE LYS 20 5.083 -1.347 -11.411
133 HE3 LYS 20 2HE LYS 20 3.626 -2.321 -11.222
134 HZ1 LYS 20 3HZ LYS 20 4.551 -0.812 -13.576
135 HZ2 LYS 20 1HZ LYS 20 2.904 -1.146 -13.382
136 HZ3 LYS 20 2HZ LYS 20 4.018 -2.415 -13.477
137 H ALA 21 H ALA 21 0.488 1.489 -9.812
138 HA ALA 21 HA ALA 21 -1.059 3.010 -7.837
139 HB1 ALA 21 3HB ALA 21 -1.302 4.495 -9.579
140 HB2 ALA 21 1HB ALA 21 -1.242 3.231 -10.807
141 HB3 ALA 21 2HB ALA 21 -2.693 3.440 -9.826
142 H PHE 22 H PHE 22 -3.304 2.272 -7.652
143 HA PHE 22 HA PHE 22 -4.076 -0.215 -8.849
144 HB2 PHE 22 1HB PHE 22 -3.558 -0.236 -5.872
145 HB3 PHE 22 2HB PHE 22 -4.097 -1.584 -6.868
146 HD1 PHE 22 HD1 PHE 22 -1.249 0.531 -5.955
147 HD2 PHE 22 HD2 PHE 22 -2.555 -2.827 -8.222
148 HE1 PHE 22 HE1 PHE 22 1.093 -0.137 -6.308
149 HE2 PHE 22 HE2 PHE 22 -0.216 -3.500 -8.578
150 HZ PHE 22 HZ PHE 22 1.612 -2.155 -7.620
151 H ARG 23 H ARG 23 -6.252 -0.551 -8.717
152 HA ARG 23 HA ARG 23 -7.928 1.587 -8.084
153 HB2 ARG 23 1HB ARG 23 -8.982 -1.211 -8.032
154 HB3 ARG 23 2HB ARG 23 -9.690 0.236 -8.739
155 HG2 ARG 23 1HG ARG 23 -9.057 -0.730 -10.665
156 HG3 ARG 23 2HG ARG 23 -7.498 -0.001 -10.274
157 HD2 ARG 23 1HD ARG 23 -7.085 -2.218 -8.982
158 HD3 ARG 23 2HD ARG 23 -8.388 -2.843 -9.992
159 HE ARG 23 HE ARG 23 -6.282 -1.503 -11.439
160 HH11 ARG 23 1HH1 ARG 23 -7.444 -4.523 -10.154
161 HH12 ARG 23 2HH1 ARG 23 -6.514 -5.495 -11.246
162 HH21 ARG 23 1HH2 ARG 23 -5.053 -2.772 -12.882
163 HH22 ARG 23 2HH2 ARG 23 -5.154 -4.498 -12.797
164 H THR 24 H THR 24 -7.219 -1.368 -6.251
165 HA THR 24 HA THR 24 -8.405 -0.076 -3.881
166 HB THR 24 HB THR 24 -9.144 -2.173 -3.047
167 HG1 THR 24 HG1 THR 24 -7.349 -3.440 -3.714
168 HG21 THR 24 3HG2 THR 24 -10.725 -1.370 -4.604
169 HG22 THR 24 1HG2 THR 24 -10.517 -3.076 -4.996
170 HG23 THR 24 2HG2 THR 24 -9.729 -1.843 -5.981
171 H ARG 25 H ARG 25 -7.569 -1.593 -1.872
172 HA ARG 25 HA ARG 25 -4.758 -0.989 -1.733
173 HB2 ARG 25 1HB ARG 25 -6.655 -0.887 0.123
174 HB3 ARG 25 2HB ARG 25 -6.137 -2.543 0.406
175 HG2 ARG 25 1HG ARG 25 -4.225 -0.227 0.365
176 HG3 ARG 25 2HG ARG 25 -5.047 -0.773 1.828
177 HD2 ARG 25 1HD ARG 25 -4.016 -2.923 1.688
178 HD3 ARG 25 2HD ARG 25 -3.366 -2.567 0.088
179 HE ARG 25 HE ARG 25 -1.596 -1.562 1.107
180 HH11 ARG 25 1HH1 ARG 25 -4.265 -1.623 3.342
181 HH12 ARG 25 2HH1 ARG 25 -3.350 -0.958 4.655
182 HH21 ARG 25 1HH2 ARG 25 -0.381 -0.686 2.827
183 HH22 ARG 25 2HH2 ARG 25 -1.141 -0.424 4.361
184 H SER 26 H SER 26 -6.680 -3.964 -1.304
185 HA SER 26 HA SER 26 -4.719 -5.813 -0.950
186 HB2 SER 26 1HB SER 26 -7.155 -6.312 -1.001
187 HB3 SER 26 2HB SER 26 -7.116 -6.196 -2.760
188 HG SER 26 HG SER 26 -5.992 -8.037 -2.877
189 H ASN 27 H ASN 27 -5.831 -4.540 -4.073
190 HA ASN 27 HA ASN 27 -4.100 -6.091 -5.671
191 HB2 ASN 27 1HB ASN 27 -6.188 -4.580 -6.276
192 HB3 ASN 27 2HB ASN 27 -4.945 -3.364 -6.554
193 HD21 ASN 27 1HD2 ASN 27 -6.404 -6.268 -7.672
194 HD22 ASN 27 2HD2 ASN 27 -5.531 -6.393 -9.157
195 H LEU 28 H LEU 28 -3.642 -3.166 -3.861
196 HA LEU 28 HA LEU 28 -1.211 -2.407 -5.203
197 HB2 LEU 28 1HB LEU 28 -2.172 -0.539 -4.335
198 HB3 LEU 28 2HB LEU 28 -2.833 -1.394 -2.943
199 HG LEU 28 HG LEU 28 -0.527 -1.421 -1.970
200 HD11 LEU 28 1HD1 LEU 28 1.132 0.104 -2.877
201 HD12 LEU 28 2HD1 LEU 28 0.058 0.502 -4.217
202 HD13 LEU 28 3HD1 LEU 28 0.709 -1.129 -4.065
203 HD21 LEU 28 3HD2 LEU 28 -1.835 1.227 -2.566
204 HD22 LEU 28 1HD2 LEU 28 -0.555 1.001 -1.374
205 HD23 LEU 28 2HD2 LEU 28 -2.105 0.185 -1.168
206 H THR 29 H THR 29 -1.890 -3.389 -1.839
207 HA THR 29 HA THR 29 0.666 -3.755 -0.942
208 HB THR 29 HB THR 29 -1.842 -5.288 -0.286
209 HG1 THR 29 HG1 THR 29 -0.390 -3.653 1.484
210 HG21 THR 29 3HG2 THR 29 -0.468 -6.912 0.483
211 HG22 THR 29 1HG2 THR 29 -0.231 -5.795 1.826
212 HG23 THR 29 2HG2 THR 29 0.942 -5.853 0.510
213 H THR 30 H THR 30 -1.351 -6.216 -2.544
214 HA THR 30 HA THR 30 0.297 -8.382 -2.511
215 HB THR 30 HB THR 30 -1.547 -7.390 -4.668
216 HG1 THR 30 HG1 THR 30 -2.920 -8.651 -3.646
217 HG21 THR 30 3HG2 THR 30 -1.295 -9.653 -5.713
218 HG22 THR 30 1HG2 THR 30 0.122 -9.904 -4.694
219 HG23 THR 30 2HG2 THR 30 0.115 -8.609 -5.891
220 H HIS 31 H HIS 31 0.761 -5.433 -4.274
221 HA HIS 31 HA HIS 31 2.931 -6.580 -5.858
222 HB2 HIS 31 1HB HIS 31 1.811 -5.173 -7.277
223 HB3 HIS 31 2HB HIS 31 1.312 -4.089 -5.982
224 HD1 HIS 31 HD1 HIS 31 4.078 -4.716 -8.405
225 HD2 HIS 31 HD2 HIS 31 3.128 -2.032 -5.380
226 HE1 HIS 31 HE1 HIS 31 5.722 -2.828 -8.640
227 H GLN 32 H GLN 32 2.361 -4.384 -3.192
228 HA GLN 32 HA GLN 32 4.887 -3.187 -3.043
229 HB2 GLN 32 1HB GLN 32 2.848 -3.801 -0.905
230 HB3 GLN 32 2HB GLN 32 4.311 -2.874 -0.599
231 HG2 GLN 32 1HG GLN 32 3.400 -1.474 -2.657
232 HG3 GLN 32 2HG GLN 32 1.864 -2.129 -2.091
233 HE21 GLN 32 1HE2 GLN 32 0.885 -0.531 -1.061
234 HE22 GLN 32 2HE2 GLN 32 1.582 0.447 0.181
235 H VAL 33 H VAL 33 3.950 -6.399 -2.480
236 HA VAL 33 HA VAL 33 5.619 -7.258 -0.444
237 HB VAL 33 HB VAL 33 4.993 -8.797 -2.966
238 HG11 VAL 33 1HG1 VAL 33 5.108 -10.334 -0.538
239 HG12 VAL 33 2HG1 VAL 33 6.021 -10.534 -2.035
240 HG13 VAL 33 3HG1 VAL 33 6.612 -9.446 -0.778
241 HG21 VAL 33 3HG2 VAL 33 3.197 -9.745 -1.278
242 HG22 VAL 33 1HG2 VAL 33 3.369 -8.142 -0.562
243 HG23 VAL 33 2HG2 VAL 33 2.876 -8.307 -2.248
244 H ILE 34 H ILE 34 6.376 -6.483 -3.772
245 HA ILE 34 HA ILE 34 8.897 -7.690 -3.961
246 HB ILE 34 HB ILE 34 9.354 -6.188 -5.795
247 HG12 ILE 34 1HG1 ILE 34 6.993 -4.614 -4.751
248 HG13 ILE 34 2HG1 ILE 34 8.667 -4.079 -4.836
249 HG21 ILE 34 1HG2 ILE 34 7.987 -7.748 -6.698
250 HG22 ILE 34 2HG2 ILE 34 6.703 -7.460 -5.526
251 HG23 ILE 34 3HG2 ILE 34 6.914 -6.362 -6.890
252 HD11 ILE 34 3HD1 ILE 34 6.637 -4.322 -6.987
253 HD12 ILE 34 1HD1 ILE 34 7.795 -3.033 -6.662
254 HD13 ILE 34 2HD1 ILE 34 8.338 -4.541 -7.398
255 H HIS 35 H HIS 35 7.855 -4.780 -2.375
256 HA HIS 35 HA HIS 35 10.597 -3.868 -1.971
257 HB2 HIS 35 1HB HIS 35 8.023 -2.623 -0.989
258 HB3 HIS 35 2HB HIS 35 9.617 -1.874 -1.004
259 HD1 HIS 35 HD1 HIS 35 10.647 -1.625 -3.556
260 HD2 HIS 35 HD2 HIS 35 6.530 -2.016 -3.160
261 HE1 HIS 35 HE1 HIS 35 9.681 -0.780 -5.718
262 H THR 36 H THR 36 8.337 -5.855 -0.463
263 HA THR 36 HA THR 36 9.264 -5.330 2.244
264 HB THR 36 HB THR 36 7.635 -6.946 2.975
265 HG1 THR 36 HG1 THR 36 6.382 -8.079 1.358
266 HG21 THR 36 3HG2 THR 36 5.922 -5.787 0.922
267 HG22 THR 36 1HG2 THR 36 7.005 -4.605 1.658
268 HG23 THR 36 2HG2 THR 36 5.911 -5.548 2.669
269 H GLY 37 H GLY 37 11.057 -6.242 2.992
270 HA2 GLY 37 1HA GLY 37 12.216 -8.533 1.643
271 HA3 GLY 37 2HA GLY 37 12.943 -7.612 2.951
272 H GLU 38 H GLU 38 13.241 -10.251 3.094
273 HA GLU 38 HA GLU 38 11.288 -11.079 5.140
274 HB2 GLU 38 1HB GLU 38 11.478 -12.346 2.822
275 HB3 GLU 38 2HB GLU 38 12.846 -13.116 3.613
276 HG2 GLU 38 1HG GLU 38 11.085 -14.554 4.045
277 HG3 GLU 38 2HG GLU 38 11.214 -13.607 5.526
278 H LYS 39 H LYS 39 12.143 -12.536 6.794
279 HA LYS 39 HA LYS 39 14.149 -11.629 8.295
280 HB2 LYS 39 1HB LYS 39 12.628 -13.668 8.686
281 HB3 LYS 39 2HB LYS 39 13.902 -14.604 7.915
282 HG2 LYS 39 1HG LYS 39 15.357 -14.325 9.657
283 HG3 LYS 39 2HG LYS 39 14.624 -12.803 10.169
284 HD2 LYS 39 1HD LYS 39 13.113 -15.383 10.378
285 HD3 LYS 39 2HD LYS 39 14.270 -14.910 11.624
286 HE2 LYS 39 1HE LYS 39 12.145 -13.006 10.719
287 HE3 LYS 39 2HE LYS 39 11.771 -14.267 11.892
288 HZ1 LYS 39 3HZ LYS 39 13.486 -11.912 12.178
289 HZ2 LYS 39 1HZ LYS 39 13.909 -13.308 13.036
290 HZ3 LYS 39 2HZ LYS 39 12.396 -12.593 13.277
291 H ARG 40 H ARG 40 14.618 -13.983 5.673
292 HA ARG 40 HA ARG 40 17.484 -13.937 5.974
293 HB2 ARG 40 1HB ARG 40 15.559 -15.301 4.130
294 HB3 ARG 40 2HB ARG 40 17.263 -15.229 3.702
295 HG2 ARG 40 1HG ARG 40 16.477 -16.199 6.408
296 HG3 ARG 40 2HG ARG 40 16.311 -17.269 5.014
297 HD2 ARG 40 1HD ARG 40 18.445 -17.731 5.857
298 HD3 ARG 40 2HD ARG 40 18.735 -16.664 4.484
299 HE ARG 40 HE ARG 40 19.623 -15.139 5.928
300 HH11 ARG 40 1HH1 ARG 40 17.637 -17.357 7.733
301 HH12 ARG 40 2HH1 ARG 40 18.079 -16.702 9.275
302 HH21 ARG 40 1HH2 ARG 40 20.213 -14.268 7.952
303 HH22 ARG 40 2HH2 ARG 40 19.543 -14.944 9.399
304 H SER 41 H SER 41 17.908 -11.693 5.685
305 HA SER 41 HA SER 41 17.152 -10.147 3.499
306 HB2 SER 41 1HB SER 41 19.200 -8.784 4.029
307 HB3 SER 41 2HB SER 41 18.159 -9.099 5.417
308 HG SER 41 HG SER 41 20.177 -10.943 4.933
309 H GLY 42 H GLY 42 17.945 -9.819 1.469
310 HA2 GLY 42 1HA GLY 42 19.676 -11.912 0.423
311 HA3 GLY 42 2HA GLY 42 18.769 -10.739 -0.521
312 HA PRO 43 HA PRO 43 23.216 -9.519 -0.725
313 HB2 PRO 43 1HB PRO 43 23.155 -8.907 -3.370
314 HB3 PRO 43 2HB PRO 43 23.445 -10.544 -2.769
315 HG2 PRO 43 1HG PRO 43 20.915 -9.329 -3.809
316 HG3 PRO 43 2HG PRO 43 21.600 -10.933 -4.130
317 HD2 PRO 43 1HD PRO 43 19.594 -10.533 -2.355
318 HD3 PRO 43 2HD PRO 43 20.818 -11.802 -2.143
319 H SER 44 H SER 44 20.190 -8.033 -1.376
320 HA SER 44 HA SER 44 21.373 -5.391 -1.757
321 HB2 SER 44 1HB SER 44 18.471 -6.257 -1.770
322 HB3 SER 44 2HB SER 44 19.062 -4.645 -2.171
323 HG SER 44 HG SER 44 19.648 -5.336 -4.075
324 H SER 45 H SER 45 20.412 -3.561 -0.498
325 HA SER 45 HA SER 45 20.849 -3.925 2.245
326 HB2 SER 45 1HB SER 45 19.922 -1.619 2.480
327 HB3 SER 45 2HB SER 45 21.149 -1.750 1.220
328 HG SER 45 HG SER 45 19.025 -0.614 0.777
329 H GLY 46 H GLY 46 17.822 -3.576 0.416
330 HA2 GLY 46 1HA GLY 46 15.988 -5.074 1.143
331 HA3 GLY 46 2HA GLY 46 16.401 -4.620 2.789
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -3.397 23.867 -14.276
2 HA2 GLY 1 1HA GLY 1 -0.559 24.277 -13.696
3 HA3 GLY 1 2HA GLY 1 -1.648 25.619 -13.377
4 H SER 2 H SER 2 -2.730 25.676 -11.494
5 HA SER 2 HA SER 2 -2.058 23.758 -9.479
6 HB2 SER 2 1HB SER 2 -3.892 26.160 -9.474
7 HB3 SER 2 2HB SER 2 -3.599 25.162 -8.050
8 HG SER 2 HG SER 2 -2.203 26.967 -8.117
9 H SER 3 H SER 3 -2.951 21.836 -10.426
10 HA SER 3 HA SER 3 -5.877 21.648 -10.122
11 HB2 SER 3 1HB SER 3 -4.799 21.324 -12.468
12 HB3 SER 3 2HB SER 3 -4.290 19.758 -11.838
13 HG SER 3 HG SER 3 -6.268 19.476 -12.804
14 H GLY 4 H GLY 4 -2.878 19.726 -9.958
15 HA2 GLY 4 1HA GLY 4 -2.217 18.106 -8.469
16 HA3 GLY 4 2HA GLY 4 -3.469 18.697 -7.386
17 H SER 5 H SER 5 -5.202 17.452 -7.037
18 HA SER 5 HA SER 5 -5.568 15.115 -8.796
19 HB2 SER 5 1HB SER 5 -6.134 15.367 -5.832
20 HB3 SER 5 2HB SER 5 -6.489 13.945 -6.814
21 HG SER 5 HG SER 5 -4.169 14.675 -5.667
22 H SER 6 H SER 6 -7.194 15.645 -10.129
23 HA SER 6 HA SER 6 -9.520 17.071 -9.087
24 HB2 SER 6 1HB SER 6 -8.312 17.597 -11.325
25 HB3 SER 6 2HB SER 6 -9.185 16.195 -11.945
26 HG SER 6 HG SER 6 -11.085 17.376 -10.921
27 H GLY 7 H GLY 7 -10.231 15.258 -7.779
28 HA2 GLY 7 1HA GLY 7 -11.632 13.485 -7.376
29 HA3 GLY 7 2HA GLY 7 -12.303 13.794 -8.971
30 H THR 8 H THR 8 -9.805 12.059 -7.202
31 HA THR 8 HA THR 8 -9.353 10.346 -9.546
32 HB THR 8 HB THR 8 -7.737 10.449 -6.993
33 HG1 THR 8 HG1 THR 8 -7.702 12.417 -8.313
34 HG21 THR 8 3HG2 THR 8 -6.877 9.384 -9.669
35 HG22 THR 8 1HG2 THR 8 -7.707 8.367 -8.492
36 HG23 THR 8 2HG2 THR 8 -6.155 9.100 -8.085
37 H LYS 9 H LYS 9 -10.956 8.848 -9.517
38 HA LYS 9 HA LYS 9 -11.446 7.386 -7.017
39 HB2 LYS 9 1HB LYS 9 -13.075 7.972 -9.436
40 HB3 LYS 9 2HB LYS 9 -13.360 6.438 -8.624
41 HG2 LYS 9 1HG LYS 9 -13.681 7.729 -6.500
42 HG3 LYS 9 2HG LYS 9 -13.631 9.202 -7.472
43 HD2 LYS 9 1HD LYS 9 -15.529 6.956 -8.090
44 HD3 LYS 9 2HD LYS 9 -15.930 8.219 -6.924
45 HE2 LYS 9 1HE LYS 9 -15.287 9.849 -8.821
46 HE3 LYS 9 2HE LYS 9 -15.464 8.448 -9.877
47 HZ1 LYS 9 3HZ LYS 9 -17.720 8.363 -8.403
48 HZ2 LYS 9 1HZ LYS 9 -17.598 9.049 -9.945
49 HZ3 LYS 9 2HZ LYS 9 -17.486 10.030 -8.572
50 H GLU 10 H GLU 10 -10.250 7.057 -10.264
51 HA GLU 10 HA GLU 10 -10.161 4.154 -10.101
52 HB2 GLU 10 1HB GLU 10 -9.757 4.145 -12.357
53 HB3 GLU 10 2HB GLU 10 -10.596 5.684 -12.214
54 HG2 GLU 10 1HG GLU 10 -8.196 6.645 -11.903
55 HG3 GLU 10 2HG GLU 10 -7.703 5.140 -12.677
56 H LYS 11 H LYS 11 -8.361 2.943 -9.777
57 HA LYS 11 HA LYS 11 -6.373 2.551 -8.660
58 HB2 LYS 11 1HB LYS 11 -5.372 4.186 -10.996
59 HB3 LYS 11 2HB LYS 11 -4.482 2.949 -10.118
60 HG2 LYS 11 1HG LYS 11 -6.532 1.458 -10.893
61 HG3 LYS 11 2HG LYS 11 -6.599 2.672 -12.172
62 HD2 LYS 11 1HD LYS 11 -4.159 2.253 -12.572
63 HD3 LYS 11 2HD LYS 11 -4.271 0.901 -11.443
64 HE2 LYS 11 1HE LYS 11 -6.010 -0.108 -12.867
65 HE3 LYS 11 2HE LYS 11 -5.827 1.224 -14.008
66 HZ1 LYS 11 3HZ LYS 11 -3.314 0.045 -13.437
67 HZ2 LYS 11 1HZ LYS 11 -4.097 0.218 -14.927
68 HZ3 LYS 11 2HZ LYS 11 -4.403 -1.138 -13.963
69 HA PRO 12 HA PRO 12 -6.050 6.980 -7.006
70 HB2 PRO 12 1HB PRO 12 -7.277 6.545 -4.624
71 HB3 PRO 12 2HB PRO 12 -8.149 7.053 -6.075
72 HG2 PRO 12 1HG PRO 12 -7.865 4.316 -4.898
73 HG3 PRO 12 2HG PRO 12 -9.306 5.100 -5.571
74 HD2 PRO 12 1HD PRO 12 -7.845 3.296 -6.964
75 HD3 PRO 12 2HD PRO 12 -8.692 4.647 -7.746
76 H TYR 13 H TYR 13 -5.622 3.781 -5.608
77 HA TYR 13 HA TYR 13 -3.787 4.646 -3.581
78 HB2 TYR 13 1HB TYR 13 -4.664 1.964 -4.618
79 HB3 TYR 13 2HB TYR 13 -3.324 2.099 -3.485
80 HD1 TYR 13 HD1 TYR 13 -6.216 4.361 -3.372
81 HD2 TYR 13 HD2 TYR 13 -4.429 0.865 -1.732
82 HE1 TYR 13 HE1 TYR 13 -7.812 4.430 -1.502
83 HE2 TYR 13 HE2 TYR 13 -6.021 0.924 0.142
84 HH TYR 13 HH TYR 13 -7.699 3.464 1.049
85 H LYS 14 H LYS 14 -1.790 5.294 -3.985
86 HA LYS 14 HA LYS 14 -0.358 4.131 -6.281
87 HB2 LYS 14 1HB LYS 14 -0.583 6.466 -6.633
88 HB3 LYS 14 2HB LYS 14 -0.165 6.835 -4.965
89 HG2 LYS 14 1HG LYS 14 2.091 6.484 -5.312
90 HG3 LYS 14 2HG LYS 14 1.820 5.483 -6.740
91 HD2 LYS 14 1HD LYS 14 1.445 7.311 -8.110
92 HD3 LYS 14 2HD LYS 14 1.003 8.360 -6.760
93 HE2 LYS 14 1HE LYS 14 3.776 7.265 -6.934
94 HE3 LYS 14 2HE LYS 14 3.317 8.631 -7.949
95 HZ1 LYS 14 3HZ LYS 14 2.392 9.324 -5.493
96 HZ2 LYS 14 1HZ LYS 14 3.833 9.870 -6.190
97 HZ3 LYS 14 2HZ LYS 14 3.852 8.550 -5.133
98 H CYS 15 H CYS 15 1.494 3.053 -5.950
99 HA CYS 15 HA CYS 15 2.269 2.371 -3.292
100 HB2 CYS 15 1HB CYS 15 2.445 0.827 -5.246
101 HB3 CYS 15 2HB CYS 15 3.749 1.829 -5.874
102 H TYR 16 H TYR 16 3.160 3.933 -2.074
103 HA TYR 16 HA TYR 16 4.787 6.022 -3.039
104 HB2 TYR 16 1HB TYR 16 4.835 4.979 -0.211
105 HB3 TYR 16 2HB TYR 16 5.122 6.624 -0.768
106 HD1 TYR 16 HD1 TYR 16 2.809 6.970 -2.610
107 HD2 TYR 16 HD2 TYR 16 3.034 5.225 1.264
108 HE1 TYR 16 HE1 TYR 16 0.440 7.514 -2.234
109 HE2 TYR 16 HE2 TYR 16 0.665 5.763 1.650
110 HH TYR 16 HH TYR 16 -1.256 7.468 -0.806
111 H GLU 17 H GLU 17 5.460 2.762 -2.626
112 HA GLU 17 HA GLU 17 8.200 2.957 -1.830
113 HB2 GLU 17 1HB GLU 17 6.950 0.636 -3.288
114 HB3 GLU 17 2HB GLU 17 8.317 0.613 -2.183
115 HG2 GLU 17 1HG GLU 17 6.541 1.508 -0.473
116 HG3 GLU 17 2HG GLU 17 5.406 0.766 -1.599
117 H CYS 18 H CYS 18 6.591 2.256 -4.929
118 HA CYS 18 HA CYS 18 9.086 3.035 -6.292
119 HB2 CYS 18 1HB CYS 18 8.485 1.555 -8.109
120 HB3 CYS 18 2HB CYS 18 8.442 0.651 -6.599
121 H GLY 19 H GLY 19 5.549 3.167 -6.416
122 HA2 GLY 19 1HA GLY 19 4.715 5.491 -6.888
123 HA3 GLY 19 2HA GLY 19 5.789 5.448 -8.278
124 H LYS 20 H LYS 20 4.298 2.473 -7.571
125 HA LYS 20 HA LYS 20 2.876 2.471 -10.039
126 HB2 LYS 20 1HB LYS 20 3.169 0.559 -7.755
127 HB3 LYS 20 2HB LYS 20 1.907 0.284 -8.948
128 HG2 LYS 20 1HG LYS 20 4.743 0.726 -9.793
129 HG3 LYS 20 2HG LYS 20 4.185 -0.863 -9.264
130 HD2 LYS 20 1HD LYS 20 2.279 -0.510 -10.970
131 HD3 LYS 20 2HD LYS 20 3.320 0.748 -11.641
132 HE2 LYS 20 1HE LYS 20 4.476 -1.947 -11.119
133 HE3 LYS 20 2HE LYS 20 3.429 -1.732 -12.521
134 HZ1 LYS 20 3HZ LYS 20 4.975 -0.538 -13.590
135 HZ2 LYS 20 1HZ LYS 20 6.065 -1.253 -12.512
136 HZ3 LYS 20 2HZ LYS 20 5.464 0.297 -12.202
137 H ALA 21 H ALA 21 0.496 1.458 -9.849
138 HA ALA 21 HA ALA 21 -1.049 3.002 -7.890
139 HB1 ALA 21 3HB ALA 21 -2.644 3.657 -9.681
140 HB2 ALA 21 1HB ALA 21 -1.049 4.394 -9.842
141 HB3 ALA 21 2HB ALA 21 -1.500 3.032 -10.869
142 H PHE 22 H PHE 22 -3.274 2.259 -7.659
143 HA PHE 22 HA PHE 22 -4.077 -0.222 -8.852
144 HB2 PHE 22 1HB PHE 22 -3.513 -0.252 -5.883
145 HB3 PHE 22 2HB PHE 22 -4.070 -1.596 -6.874
146 HD1 PHE 22 HD1 PHE 22 -1.205 0.493 -5.972
147 HD2 PHE 22 HD2 PHE 22 -2.550 -2.821 -8.279
148 HE1 PHE 22 HE1 PHE 22 1.130 -0.179 -6.361
149 HE2 PHE 22 HE2 PHE 22 -0.217 -3.499 -8.671
150 HZ PHE 22 HZ PHE 22 1.626 -2.179 -7.711
151 H ARG 23 H ARG 23 -6.250 -0.656 -8.556
152 HA ARG 23 HA ARG 23 -7.903 1.534 -7.896
153 HB2 ARG 23 1HB ARG 23 -8.685 -1.373 -8.180
154 HB3 ARG 23 2HB ARG 23 -9.768 0.010 -8.270
155 HG2 ARG 23 1HG ARG 23 -8.297 0.774 -10.232
156 HG3 ARG 23 2HG ARG 23 -7.698 -0.886 -10.235
157 HD2 ARG 23 1HD ARG 23 -9.952 -1.727 -10.542
158 HD3 ARG 23 2HD ARG 23 -10.599 -0.090 -10.446
159 HE ARG 23 HE ARG 23 -8.651 -0.529 -12.539
160 HH11 ARG 23 1HH1 ARG 23 -12.016 -0.489 -11.649
161 HH12 ARG 23 2HH1 ARG 23 -12.578 -0.279 -13.274
162 HH21 ARG 23 1HH2 ARG 23 -9.378 -0.252 -14.684
163 HH22 ARG 23 2HH2 ARG 23 -11.077 -0.145 -15.000
164 H THR 24 H THR 24 -7.408 -1.586 -6.246
165 HA THR 24 HA THR 24 -8.530 -0.375 -3.806
166 HB THR 24 HB THR 24 -9.237 -2.505 -3.071
167 HG1 THR 24 HG1 THR 24 -8.647 -4.366 -4.587
168 HG21 THR 24 3HG2 THR 24 -10.789 -1.747 -4.674
169 HG22 THR 24 1HG2 THR 24 -10.488 -3.432 -5.096
170 HG23 THR 24 2HG2 THR 24 -9.718 -2.141 -6.019
171 H ARG 25 H ARG 25 -7.657 -1.857 -1.827
172 HA ARG 25 HA ARG 25 -4.883 -1.175 -1.631
173 HB2 ARG 25 1HB ARG 25 -6.487 -1.014 0.270
174 HB3 ARG 25 2HB ARG 25 -6.578 -2.769 0.297
175 HG2 ARG 25 1HG ARG 25 -5.077 -1.943 2.016
176 HG3 ARG 25 2HG ARG 25 -4.199 -2.894 0.816
177 HD2 ARG 25 1HD ARG 25 -3.447 -0.845 -0.271
178 HD3 ARG 25 2HD ARG 25 -4.353 0.118 0.895
179 HE ARG 25 HE ARG 25 -2.446 -1.659 2.103
180 HH11 ARG 25 1HH1 ARG 25 -2.923 1.473 0.660
181 HH12 ARG 25 2HH1 ARG 25 -1.573 2.196 1.469
182 HH21 ARG 25 1HH2 ARG 25 -0.666 -0.718 3.175
183 HH22 ARG 25 2HH2 ARG 25 -0.289 0.949 2.899
184 H SER 26 H SER 26 -6.596 -4.283 -1.233
185 HA SER 26 HA SER 26 -4.533 -6.016 -1.031
186 HB2 SER 26 1HB SER 26 -7.028 -6.544 -1.146
187 HB3 SER 26 2HB SER 26 -6.836 -6.588 -2.898
188 HG SER 26 HG SER 26 -5.219 -8.215 -2.558
189 H ASN 27 H ASN 27 -5.722 -4.584 -4.043
190 HA ASN 27 HA ASN 27 -4.002 -5.999 -5.776
191 HB2 ASN 27 1HB ASN 27 -6.096 -4.658 -6.379
192 HB3 ASN 27 2HB ASN 27 -5.071 -3.228 -6.302
193 HD21 ASN 27 1HD2 ASN 27 -6.470 -4.228 -8.581
194 HD22 ASN 27 2HD2 ASN 27 -5.287 -4.612 -9.779
195 H LEU 28 H LEU 28 -3.631 -3.037 -3.936
196 HA LEU 28 HA LEU 28 -1.162 -2.290 -5.204
197 HB2 LEU 28 1HB LEU 28 -2.174 -0.421 -4.396
198 HB3 LEU 28 2HB LEU 28 -2.853 -1.259 -3.002
199 HG LEU 28 HG LEU 28 -0.596 -1.224 -1.956
200 HD11 LEU 28 1HD1 LEU 28 0.837 -1.059 -3.844
201 HD12 LEU 28 2HD1 LEU 28 1.026 0.429 -2.918
202 HD13 LEU 28 3HD1 LEU 28 0.054 0.425 -4.389
203 HD21 LEU 28 3HD2 LEU 28 -2.484 0.824 -2.192
204 HD22 LEU 28 1HD2 LEU 28 -0.913 1.607 -2.358
205 HD23 LEU 28 2HD2 LEU 28 -1.264 0.631 -0.932
206 H THR 29 H THR 29 -1.954 -3.280 -1.867
207 HA THR 29 HA THR 29 0.605 -3.600 -0.905
208 HB THR 29 HB THR 29 -1.886 -5.172 -0.238
209 HG1 THR 29 HG1 THR 29 -2.238 -3.260 0.639
210 HG21 THR 29 3HG2 THR 29 -0.573 -5.641 1.923
211 HG22 THR 29 1HG2 THR 29 0.863 -5.263 0.971
212 HG23 THR 29 2HG2 THR 29 -0.183 -6.602 0.497
213 H THR 30 H THR 30 -1.400 -6.031 -2.551
214 HA THR 30 HA THR 30 0.221 -8.235 -2.397
215 HB THR 30 HB THR 30 -1.583 -7.290 -4.611
216 HG1 THR 30 HG1 THR 30 -2.927 -8.219 -3.270
217 HG21 THR 30 3HG2 THR 30 -1.352 -9.620 -5.541
218 HG22 THR 30 1HG2 THR 30 0.075 -9.807 -4.522
219 HG23 THR 30 2HG2 THR 30 0.047 -8.574 -5.784
220 H HIS 31 H HIS 31 0.690 -5.359 -4.298
221 HA HIS 31 HA HIS 31 2.868 -6.560 -5.817
222 HB2 HIS 31 1HB HIS 31 1.777 -5.159 -7.265
223 HB3 HIS 31 2HB HIS 31 1.292 -4.044 -5.991
224 HD1 HIS 31 HD1 HIS 31 4.048 -4.754 -8.400
225 HD2 HIS 31 HD2 HIS 31 3.147 -2.013 -5.410
226 HE1 HIS 31 HE1 HIS 31 5.727 -2.900 -8.660
227 H GLN 32 H GLN 32 2.327 -4.314 -3.188
228 HA GLN 32 HA GLN 32 4.861 -3.142 -3.048
229 HB2 GLN 32 1HB GLN 32 2.826 -3.734 -0.900
230 HB3 GLN 32 2HB GLN 32 4.295 -2.813 -0.603
231 HG2 GLN 32 1HG GLN 32 3.380 -1.423 -2.670
232 HG3 GLN 32 2HG GLN 32 1.845 -2.059 -2.080
233 HE21 GLN 32 1HE2 GLN 32 0.862 -0.556 -0.943
234 HE22 GLN 32 2HE2 GLN 32 1.594 0.470 0.239
235 H VAL 33 H VAL 33 3.889 -6.343 -2.432
236 HA VAL 33 HA VAL 33 5.576 -7.194 -0.410
237 HB VAL 33 HB VAL 33 4.891 -8.752 -2.906
238 HG11 VAL 33 1HG1 VAL 33 5.845 -9.573 -0.173
239 HG12 VAL 33 2HG1 VAL 33 5.093 -10.696 -1.309
240 HG13 VAL 33 3HG1 VAL 33 6.604 -9.890 -1.733
241 HG21 VAL 33 3HG2 VAL 33 3.114 -9.678 -1.220
242 HG22 VAL 33 1HG2 VAL 33 3.341 -8.113 -0.439
243 HG23 VAL 33 2HG2 VAL 33 2.803 -8.191 -2.116
244 H ILE 34 H ILE 34 6.291 -6.548 -3.787
245 HA ILE 34 HA ILE 34 8.791 -7.761 -3.990
246 HB ILE 34 HB ILE 34 9.246 -6.289 -5.842
247 HG12 ILE 34 1HG1 ILE 34 6.963 -4.633 -4.753
248 HG13 ILE 34 2HG1 ILE 34 8.651 -4.152 -4.892
249 HG21 ILE 34 1HG2 ILE 34 6.497 -7.380 -5.531
250 HG22 ILE 34 2HG2 ILE 34 6.863 -6.416 -6.961
251 HG23 ILE 34 3HG2 ILE 34 7.794 -7.875 -6.620
252 HD11 ILE 34 3HD1 ILE 34 8.264 -4.593 -7.432
253 HD12 ILE 34 1HD1 ILE 34 6.566 -4.388 -7.001
254 HD13 ILE 34 2HD1 ILE 34 7.718 -3.089 -6.690
255 H HIS 35 H HIS 35 7.830 -4.797 -2.438
256 HA HIS 35 HA HIS 35 10.585 -3.926 -2.080
257 HB2 HIS 35 1HB HIS 35 8.033 -2.679 -1.040
258 HB3 HIS 35 2HB HIS 35 9.632 -1.939 -1.047
259 HD1 HIS 35 HD1 HIS 35 10.657 -1.714 -3.625
260 HD2 HIS 35 HD2 HIS 35 6.535 -1.959 -3.167
261 HE1 HIS 35 HE1 HIS 35 9.688 -0.808 -5.761
262 H THR 36 H THR 36 8.319 -5.871 -0.497
263 HA THR 36 HA THR 36 9.400 -5.396 2.166
264 HB THR 36 HB THR 36 7.727 -6.964 2.963
265 HG1 THR 36 HG1 THR 36 7.912 -8.097 0.692
266 HG21 THR 36 3HG2 THR 36 7.157 -4.538 2.227
267 HG22 THR 36 1HG2 THR 36 5.843 -5.652 2.606
268 HG23 THR 36 2HG2 THR 36 6.266 -5.325 0.925
269 H GLY 37 H GLY 37 11.570 -6.117 1.599
270 HA2 GLY 37 1HA GLY 37 11.794 -9.031 1.898
271 HA3 GLY 37 2HA GLY 37 12.663 -8.247 0.587
272 H GLU 38 H GLU 38 12.733 -9.142 3.852
273 HA GLU 38 HA GLU 38 14.888 -7.294 4.524
274 HB2 GLU 38 1HB GLU 38 14.751 -8.477 6.771
275 HB3 GLU 38 2HB GLU 38 13.343 -7.540 6.292
276 HG2 GLU 38 1HG GLU 38 12.181 -9.549 5.630
277 HG3 GLU 38 2HG GLU 38 13.608 -10.521 5.984
278 H LYS 39 H LYS 39 16.253 -8.309 2.833
279 HA LYS 39 HA LYS 39 17.152 -10.833 2.602
280 HB2 LYS 39 1HB LYS 39 18.008 -8.560 1.566
281 HB3 LYS 39 2HB LYS 39 19.249 -8.713 2.802
282 HG2 LYS 39 1HG LYS 39 20.051 -10.733 1.891
283 HG3 LYS 39 2HG LYS 39 18.633 -10.914 0.855
284 HD2 LYS 39 1HD LYS 39 20.503 -8.576 0.598
285 HD3 LYS 39 2HD LYS 39 20.798 -10.103 -0.237
286 HE2 LYS 39 1HE LYS 39 18.149 -8.725 -0.466
287 HE3 LYS 39 2HE LYS 39 19.512 -8.211 -1.458
288 HZ1 LYS 39 3HZ LYS 39 19.657 -10.732 -1.994
289 HZ2 LYS 39 1HZ LYS 39 18.519 -9.768 -2.792
290 HZ3 LYS 39 2HZ LYS 39 18.038 -10.753 -1.504
291 H ARG 40 H ARG 40 18.631 -12.204 3.583
292 HA ARG 40 HA ARG 40 18.907 -11.865 6.430
293 HB2 ARG 40 1HB ARG 40 18.479 -14.049 5.032
294 HB3 ARG 40 2HB ARG 40 20.233 -14.077 4.914
295 HG2 ARG 40 1HG ARG 40 19.826 -15.396 6.761
296 HG3 ARG 40 2HG ARG 40 20.177 -13.824 7.483
297 HD2 ARG 40 1HD ARG 40 17.553 -13.545 7.227
298 HD3 ARG 40 2HD ARG 40 17.609 -15.306 7.293
299 HE ARG 40 HE ARG 40 17.942 -13.523 9.467
300 HH11 ARG 40 1HH1 ARG 40 19.119 -16.536 8.179
301 HH12 ARG 40 2HH1 ARG 40 19.558 -17.177 9.728
302 HH21 ARG 40 1HH2 ARG 40 18.516 -14.356 11.512
303 HH22 ARG 40 2HH2 ARG 40 19.214 -15.936 11.623
304 H SER 41 H SER 41 20.283 -9.849 5.163
305 HA SER 41 HA SER 41 23.106 -10.618 5.510
306 HB2 SER 41 1HB SER 41 22.472 -9.778 3.239
307 HB3 SER 41 2HB SER 41 22.030 -8.239 3.979
308 HG SER 41 HG SER 41 24.600 -9.427 4.170
309 H GLY 42 H GLY 42 22.866 -10.350 7.815
310 HA2 GLY 42 1HA GLY 42 22.203 -7.743 8.866
311 HA3 GLY 42 2HA GLY 42 22.751 -9.134 9.789
312 HA PRO 43 HA PRO 43 26.269 -6.291 10.077
313 HB2 PRO 43 1HB PRO 43 27.242 -7.397 12.358
314 HB3 PRO 43 2HB PRO 43 25.926 -6.216 12.348
315 HG2 PRO 43 1HG PRO 43 25.793 -9.200 12.559
316 HG3 PRO 43 2HG PRO 43 24.886 -7.973 13.462
317 HD2 PRO 43 1HD PRO 43 23.825 -9.318 11.366
318 HD3 PRO 43 2HD PRO 43 23.380 -7.643 11.750
319 H SER 44 H SER 44 26.033 -9.712 9.795
320 HA SER 44 HA SER 44 28.699 -9.811 8.625
321 HB2 SER 44 1HB SER 44 27.844 -11.397 11.034
322 HB3 SER 44 2HB SER 44 29.060 -12.029 9.924
323 HG SER 44 HG SER 44 29.162 -9.670 11.483
324 H SER 45 H SER 45 28.938 -11.373 7.053
325 HA SER 45 HA SER 45 26.446 -12.649 6.195
326 HB2 SER 45 1HB SER 45 27.612 -11.234 4.553
327 HB3 SER 45 2HB SER 45 29.048 -12.248 4.696
328 HG SER 45 HG SER 45 28.014 -13.079 2.982
329 H GLY 46 H GLY 46 29.893 -13.433 6.629
330 HA2 GLY 46 1HA GLY 46 29.233 -16.051 7.624
331 HA3 GLY 46 2HA GLY 46 29.941 -16.088 6.016
Start of MODEL 3
1 H1 GLY 1 H GLY 1 7.470 21.988 -23.530
2 HA2 GLY 1 1HA GLY 1 5.003 21.896 -22.684
3 HA3 GLY 1 2HA GLY 1 4.671 22.218 -24.380
4 H SER 2 H SER 2 5.885 19.886 -22.080
5 HA SER 2 HA SER 2 5.931 17.836 -24.186
6 HB2 SER 2 1HB SER 2 7.289 16.497 -22.675
7 HB3 SER 2 2HB SER 2 8.001 18.103 -22.833
8 HG SER 2 HG SER 2 6.536 17.027 -20.671
9 H SER 3 H SER 3 5.231 15.615 -23.408
10 HA SER 3 HA SER 3 2.521 15.709 -22.670
11 HB2 SER 3 1HB SER 3 3.272 13.864 -23.990
12 HB3 SER 3 2HB SER 3 4.493 13.423 -22.796
13 HG SER 3 HG SER 3 2.835 12.820 -21.390
14 H GLY 4 H GLY 4 1.792 16.288 -20.731
15 HA2 GLY 4 1HA GLY 4 3.379 15.817 -18.345
16 HA3 GLY 4 2HA GLY 4 1.865 16.705 -18.435
17 H SER 5 H SER 5 0.115 15.755 -17.628
18 HA SER 5 HA SER 5 0.223 13.276 -16.332
19 HB2 SER 5 1HB SER 5 -2.092 13.570 -15.861
20 HB3 SER 5 2HB SER 5 -1.398 15.190 -15.895
21 HG SER 5 HG SER 5 -2.706 13.958 -18.091
22 H SER 6 H SER 6 -1.568 11.556 -16.807
23 HA SER 6 HA SER 6 -1.173 10.715 -19.593
24 HB2 SER 6 1HB SER 6 -0.325 9.112 -18.005
25 HB3 SER 6 2HB SER 6 -1.839 9.133 -17.101
26 HG SER 6 HG SER 6 -1.717 7.321 -18.476
27 H GLY 7 H GLY 7 -3.684 10.449 -17.063
28 HA2 GLY 7 1HA GLY 7 -5.826 11.626 -17.970
29 HA3 GLY 7 2HA GLY 7 -5.715 10.357 -19.180
30 H THR 8 H THR 8 -4.794 8.300 -17.418
31 HA THR 8 HA THR 8 -6.967 6.926 -16.730
32 HB THR 8 HB THR 8 -4.662 6.106 -16.357
33 HG1 THR 8 HG1 THR 8 -5.280 4.747 -14.730
34 HG21 THR 8 3HG2 THR 8 -3.267 7.240 -15.044
35 HG22 THR 8 1HG2 THR 8 -4.268 6.826 -13.653
36 HG23 THR 8 2HG2 THR 8 -4.571 8.317 -14.546
37 H LYS 9 H LYS 9 -8.410 6.710 -15.026
38 HA LYS 9 HA LYS 9 -8.583 9.049 -13.245
39 HB2 LYS 9 1HB LYS 9 -10.443 8.737 -14.893
40 HB3 LYS 9 2HB LYS 9 -10.827 7.214 -14.100
41 HG2 LYS 9 1HG LYS 9 -11.055 8.611 -11.962
42 HG3 LYS 9 2HG LYS 9 -11.109 10.003 -13.046
43 HD2 LYS 9 1HD LYS 9 -13.350 9.504 -12.827
44 HD3 LYS 9 2HD LYS 9 -12.933 8.602 -14.286
45 HE2 LYS 9 1HE LYS 9 -12.741 7.300 -11.600
46 HE3 LYS 9 2HE LYS 9 -14.303 7.446 -12.403
47 HZ1 LYS 9 3HZ LYS 9 -13.078 6.407 -14.389
48 HZ2 LYS 9 1HZ LYS 9 -13.532 5.401 -13.107
49 HZ3 LYS 9 2HZ LYS 9 -11.928 5.919 -13.247
50 H GLU 10 H GLU 10 -9.609 5.629 -13.311
51 HA GLU 10 HA GLU 10 -9.831 5.370 -10.520
52 HB2 GLU 10 1HB GLU 10 -10.523 3.813 -12.619
53 HB3 GLU 10 2HB GLU 10 -9.094 2.954 -12.061
54 HG2 GLU 10 1HG GLU 10 -10.627 1.894 -10.794
55 HG3 GLU 10 2HG GLU 10 -10.312 3.255 -9.719
56 H LYS 11 H LYS 11 -8.450 3.300 -9.599
57 HA LYS 11 HA LYS 11 -6.452 2.579 -8.774
58 HB2 LYS 11 1HB LYS 11 -5.089 4.114 -10.983
59 HB3 LYS 11 2HB LYS 11 -4.477 2.722 -10.100
60 HG2 LYS 11 1HG LYS 11 -6.640 1.592 -11.139
61 HG3 LYS 11 2HG LYS 11 -6.398 2.852 -12.351
62 HD2 LYS 11 1HD LYS 11 -4.077 2.088 -12.651
63 HD3 LYS 11 2HD LYS 11 -4.361 0.803 -11.474
64 HE2 LYS 11 1HE LYS 11 -6.298 0.103 -13.004
65 HE3 LYS 11 2HE LYS 11 -5.545 1.142 -14.212
66 HZ1 LYS 11 3HZ LYS 11 -3.719 -0.218 -14.375
67 HZ2 LYS 11 1HZ LYS 11 -4.940 -1.358 -14.105
68 HZ3 LYS 11 2HZ LYS 11 -3.925 -0.890 -12.836
69 HA PRO 12 HA PRO 12 -5.996 6.980 -7.117
70 HB2 PRO 12 1HB PRO 12 -7.301 6.573 -4.772
71 HB3 PRO 12 2HB PRO 12 -8.118 7.108 -6.245
72 HG2 PRO 12 1HG PRO 12 -7.941 4.361 -5.067
73 HG3 PRO 12 2HG PRO 12 -9.340 5.186 -5.779
74 HD2 PRO 12 1HD PRO 12 -7.890 3.345 -7.135
75 HD3 PRO 12 2HD PRO 12 -8.677 4.720 -7.936
76 H TYR 13 H TYR 13 -5.644 3.757 -5.782
77 HA TYR 13 HA TYR 13 -3.875 4.557 -3.666
78 HB2 TYR 13 1HB TYR 13 -4.749 1.909 -4.788
79 HB3 TYR 13 2HB TYR 13 -3.445 2.003 -3.610
80 HD1 TYR 13 HD1 TYR 13 -6.468 4.143 -3.679
81 HD2 TYR 13 HD2 TYR 13 -4.465 0.903 -1.783
82 HE1 TYR 13 HE1 TYR 13 -8.123 4.192 -1.861
83 HE2 TYR 13 HE2 TYR 13 -6.115 0.942 0.040
84 HH TYR 13 HH TYR 13 -8.875 3.166 -0.026
85 H LYS 14 H LYS 14 -1.898 5.280 -4.072
86 HA LYS 14 HA LYS 14 -0.388 4.103 -6.307
87 HB2 LYS 14 1HB LYS 14 -0.595 6.434 -6.664
88 HB3 LYS 14 2HB LYS 14 -0.249 6.803 -4.980
89 HG2 LYS 14 1HG LYS 14 2.025 6.437 -5.232
90 HG3 LYS 14 2HG LYS 14 1.808 5.473 -6.695
91 HD2 LYS 14 1HD LYS 14 1.408 7.358 -8.018
92 HD3 LYS 14 2HD LYS 14 1.054 8.377 -6.621
93 HE2 LYS 14 1HE LYS 14 3.352 8.411 -5.975
94 HE3 LYS 14 2HE LYS 14 3.764 7.180 -7.168
95 HZ1 LYS 14 3HZ LYS 14 3.471 8.682 -8.916
96 HZ2 LYS 14 1HZ LYS 14 4.304 9.572 -7.743
97 HZ3 LYS 14 2HZ LYS 14 2.642 9.801 -7.955
98 H CYS 15 H CYS 15 1.525 3.113 -5.954
99 HA CYS 15 HA CYS 15 2.209 2.411 -3.258
100 HB2 CYS 15 1HB CYS 15 2.407 0.842 -5.191
101 HB3 CYS 15 2HB CYS 15 3.733 1.824 -5.803
102 H TYR 16 H TYR 16 3.175 3.879 -2.008
103 HA TYR 16 HA TYR 16 4.802 5.986 -2.979
104 HB2 TYR 16 1HB TYR 16 4.794 4.949 -0.146
105 HB3 TYR 16 2HB TYR 16 5.131 6.586 -0.700
106 HD1 TYR 16 HD1 TYR 16 2.884 7.067 -2.541
107 HD2 TYR 16 HD2 TYR 16 2.951 5.160 1.261
108 HE1 TYR 16 HE1 TYR 16 0.523 7.670 -2.204
109 HE2 TYR 16 HE2 TYR 16 0.590 5.756 1.609
110 HH TYR 16 HH TYR 16 -1.011 8.035 -0.176
111 H GLU 17 H GLU 17 5.437 2.722 -2.549
112 HA GLU 17 HA GLU 17 8.175 2.898 -1.729
113 HB2 GLU 17 1HB GLU 17 6.871 0.580 -3.152
114 HB3 GLU 17 2HB GLU 17 8.275 0.542 -2.094
115 HG2 GLU 17 1HG GLU 17 6.561 1.486 -0.337
116 HG3 GLU 17 2HG GLU 17 5.390 0.728 -1.415
117 H CYS 18 H CYS 18 6.564 2.216 -4.829
118 HA CYS 18 HA CYS 18 9.082 2.925 -6.188
119 HB2 CYS 18 1HB CYS 18 8.424 1.462 -8.013
120 HB3 CYS 18 2HB CYS 18 8.411 0.562 -6.500
121 H GLY 19 H GLY 19 5.546 3.119 -6.352
122 HA2 GLY 19 1HA GLY 19 4.749 5.453 -6.827
123 HA3 GLY 19 2HA GLY 19 5.853 5.410 -8.194
124 H LYS 20 H LYS 20 4.276 2.460 -7.510
125 HA LYS 20 HA LYS 20 2.911 2.501 -10.020
126 HB2 LYS 20 1HB LYS 20 3.188 0.549 -7.773
127 HB3 LYS 20 2HB LYS 20 1.908 0.304 -8.954
128 HG2 LYS 20 1HG LYS 20 4.712 0.759 -9.873
129 HG3 LYS 20 2HG LYS 20 4.215 -0.831 -9.288
130 HD2 LYS 20 1HD LYS 20 2.251 -0.595 -10.929
131 HD3 LYS 20 2HD LYS 20 3.193 0.710 -11.654
132 HE2 LYS 20 1HE LYS 20 5.102 -1.110 -11.602
133 HE3 LYS 20 2HE LYS 20 3.732 -2.218 -11.578
134 HZ1 LYS 20 3HZ LYS 20 2.975 -0.642 -13.544
135 HZ2 LYS 20 1HZ LYS 20 3.968 -1.987 -13.802
136 HZ3 LYS 20 2HZ LYS 20 4.648 -0.442 -13.702
137 H ALA 21 H ALA 21 0.521 1.477 -9.856
138 HA ALA 21 HA ALA 21 -1.037 3.020 -7.907
139 HB1 ALA 21 3HB ALA 21 -2.651 3.511 -9.847
140 HB2 ALA 21 1HB ALA 21 -1.178 4.473 -9.720
141 HB3 ALA 21 2HB ALA 21 -1.274 3.157 -10.891
142 H PHE 22 H PHE 22 -3.244 2.267 -7.658
143 HA PHE 22 HA PHE 22 -4.065 -0.196 -8.875
144 HB2 PHE 22 1HB PHE 22 -3.487 -0.277 -5.911
145 HB3 PHE 22 2HB PHE 22 -4.028 -1.605 -6.932
146 HD1 PHE 22 HD1 PHE 22 -1.186 0.521 -6.016
147 HD2 PHE 22 HD2 PHE 22 -2.492 -2.809 -8.323
148 HE1 PHE 22 HE1 PHE 22 1.156 -0.117 -6.415
149 HE2 PHE 22 HE2 PHE 22 -0.152 -3.453 -8.724
150 HZ PHE 22 HZ PHE 22 1.676 -2.107 -7.769
151 H ARG 23 H ARG 23 -6.215 -0.814 -8.285
152 HA ARG 23 HA ARG 23 -7.885 1.423 -7.693
153 HB2 ARG 23 1HB ARG 23 -8.671 -1.489 -7.876
154 HB3 ARG 23 2HB ARG 23 -9.736 -0.099 -8.025
155 HG2 ARG 23 1HG ARG 23 -8.206 0.541 -10.019
156 HG3 ARG 23 2HG ARG 23 -7.729 -1.157 -9.963
157 HD2 ARG 23 1HD ARG 23 -9.806 -1.902 -10.586
158 HD3 ARG 23 2HD ARG 23 -10.629 -0.493 -9.918
159 HE ARG 23 HE ARG 23 -9.057 0.347 -12.072
160 HH11 ARG 23 1HH1 ARG 23 -11.870 -1.608 -11.448
161 HH12 ARG 23 2HH1 ARG 23 -12.588 -1.299 -12.994
162 HH21 ARG 23 1HH2 ARG 23 -9.992 0.761 -14.110
163 HH22 ARG 23 2HH2 ARG 23 -11.519 0.048 -14.508
164 H THR 24 H THR 24 -7.535 -1.735 -6.065
165 HA THR 24 HA THR 24 -8.446 -0.452 -3.576
166 HB THR 24 HB THR 24 -9.223 -2.559 -2.806
167 HG1 THR 24 HG1 THR 24 -8.724 -4.484 -3.834
168 HG21 THR 24 3HG2 THR 24 -10.677 -3.342 -4.749
169 HG22 THR 24 1HG2 THR 24 -9.882 -2.091 -5.705
170 HG23 THR 24 2HG2 THR 24 -10.824 -1.648 -4.281
171 H ARG 25 H ARG 25 -7.542 -1.573 -1.561
172 HA ARG 25 HA ARG 25 -4.773 -1.169 -1.462
173 HB2 ARG 25 1HB ARG 25 -6.275 -1.011 0.497
174 HB3 ARG 25 2HB ARG 25 -6.488 -2.757 0.456
175 HG2 ARG 25 1HG ARG 25 -4.896 -2.176 2.160
176 HG3 ARG 25 2HG ARG 25 -4.072 -3.032 0.855
177 HD2 ARG 25 1HD ARG 25 -3.313 -0.885 -0.059
178 HD3 ARG 25 2HD ARG 25 -4.123 -0.044 1.262
179 HE ARG 25 HE ARG 25 -2.229 -2.009 2.151
180 HH11 ARG 25 1HH1 ARG 25 -2.646 1.282 1.093
181 HH12 ARG 25 2HH1 ARG 25 -1.227 1.859 1.902
182 HH21 ARG 25 1HH2 ARG 25 -0.358 -1.261 3.221
183 HH22 ARG 25 2HH2 ARG 25 0.074 0.412 3.111
184 H SER 26 H SER 26 -6.544 -4.251 -1.130
185 HA SER 26 HA SER 26 -4.527 -6.039 -1.020
186 HB2 SER 26 1HB SER 26 -7.023 -6.517 -1.121
187 HB3 SER 26 2HB SER 26 -6.870 -6.467 -2.877
188 HG SER 26 HG SER 26 -6.246 -8.458 -1.169
189 H ASN 27 H ASN 27 -5.766 -4.569 -4.005
190 HA ASN 27 HA ASN 27 -4.041 -5.926 -5.770
191 HB2 ASN 27 1HB ASN 27 -6.158 -4.564 -6.307
192 HB3 ASN 27 2HB ASN 27 -5.105 -3.153 -6.267
193 HD21 ASN 27 1HD2 ASN 27 -4.940 -2.563 -8.323
194 HD22 ASN 27 2HD2 ASN 27 -4.433 -3.587 -9.619
195 H LEU 28 H LEU 28 -3.662 -3.020 -3.856
196 HA LEU 28 HA LEU 28 -1.231 -2.197 -5.146
197 HB2 LEU 28 1HB LEU 28 -2.266 -0.382 -4.233
198 HB3 LEU 28 2HB LEU 28 -2.861 -1.285 -2.842
199 HG LEU 28 HG LEU 28 -0.596 -1.219 -1.865
200 HD11 LEU 28 1HD1 LEU 28 0.033 0.537 -4.234
201 HD12 LEU 28 2HD1 LEU 28 0.705 -1.059 -3.907
202 HD13 LEU 28 3HD1 LEU 28 1.077 0.290 -2.834
203 HD21 LEU 28 3HD2 LEU 28 -2.397 0.988 -2.248
204 HD22 LEU 28 1HD2 LEU 28 -0.741 1.569 -2.074
205 HD23 LEU 28 2HD2 LEU 28 -1.452 0.546 -0.825
206 H THR 29 H THR 29 -1.931 -3.343 -1.839
207 HA THR 29 HA THR 29 0.655 -3.672 -0.953
208 HB THR 29 HB THR 29 -1.778 -5.339 -0.294
209 HG1 THR 29 HG1 THR 29 -0.516 -3.292 1.227
210 HG21 THR 29 3HG2 THR 29 -0.208 -5.544 1.890
211 HG22 THR 29 1HG2 THR 29 1.022 -5.516 0.627
212 HG23 THR 29 2HG2 THR 29 -0.243 -6.745 0.599
213 H THR 30 H THR 30 -1.383 -6.125 -2.542
214 HA THR 30 HA THR 30 0.231 -8.300 -2.556
215 HB THR 30 HB THR 30 -1.528 -7.237 -4.756
216 HG1 THR 30 HG1 THR 30 -1.982 -9.654 -3.443
217 HG21 THR 30 3HG2 THR 30 0.060 -9.799 -4.707
218 HG22 THR 30 1HG2 THR 30 0.093 -8.532 -5.933
219 HG23 THR 30 2HG2 THR 30 -1.340 -9.544 -5.749
220 H HIS 31 H HIS 31 0.693 -5.363 -4.391
221 HA HIS 31 HA HIS 31 2.901 -6.508 -5.904
222 HB2 HIS 31 1HB HIS 31 1.824 -5.075 -7.328
223 HB3 HIS 31 2HB HIS 31 1.308 -4.001 -6.031
224 HD1 HIS 31 HD1 HIS 31 4.101 -4.610 -8.423
225 HD2 HIS 31 HD2 HIS 31 3.138 -1.973 -5.360
226 HE1 HIS 31 HE1 HIS 31 5.765 -2.733 -8.603
227 H GLN 32 H GLN 32 2.321 -4.317 -3.233
228 HA GLN 32 HA GLN 32 4.836 -3.129 -3.031
229 HB2 GLN 32 1HB GLN 32 2.793 -3.825 -0.923
230 HB3 GLN 32 2HB GLN 32 4.255 -2.913 -0.570
231 HG2 GLN 32 1HG GLN 32 3.350 -1.444 -2.592
232 HG3 GLN 32 2HG GLN 32 1.815 -2.102 -2.029
233 HE21 GLN 32 1HE2 GLN 32 0.912 -0.389 -1.068
234 HE22 GLN 32 2HE2 GLN 32 1.611 0.493 0.242
235 H VAL 33 H VAL 33 3.848 -6.354 -2.397
236 HA VAL 33 HA VAL 33 5.538 -7.263 -0.446
237 HB VAL 33 HB VAL 33 4.960 -8.726 -3.025
238 HG11 VAL 33 1HG1 VAL 33 5.879 -9.622 -0.307
239 HG12 VAL 33 2HG1 VAL 33 5.134 -10.725 -1.467
240 HG13 VAL 33 3HG1 VAL 33 6.643 -9.904 -1.871
241 HG21 VAL 33 3HG2 VAL 33 2.846 -8.171 -2.239
242 HG22 VAL 33 1HG2 VAL 33 3.129 -9.756 -1.518
243 HG23 VAL 33 2HG2 VAL 33 3.332 -8.297 -0.548
244 H ILE 34 H ILE 34 6.313 -6.617 -3.831
245 HA ILE 34 HA ILE 34 8.835 -7.715 -4.013
246 HB ILE 34 HB ILE 34 9.325 -6.114 -5.758
247 HG12 ILE 34 1HG1 ILE 34 6.968 -4.591 -4.634
248 HG13 ILE 34 2HG1 ILE 34 8.641 -4.051 -4.724
249 HG21 ILE 34 1HG2 ILE 34 7.044 -6.265 -7.008
250 HG22 ILE 34 2HG2 ILE 34 7.931 -7.737 -6.614
251 HG23 ILE 34 3HG2 ILE 34 6.563 -7.239 -5.618
252 HD11 ILE 34 3HD1 ILE 34 6.575 -4.201 -6.849
253 HD12 ILE 34 1HD1 ILE 34 7.739 -2.927 -6.487
254 HD13 ILE 34 2HD1 ILE 34 8.268 -4.402 -7.298
255 H HIS 35 H HIS 35 7.830 -4.769 -2.413
256 HA HIS 35 HA HIS 35 10.571 -3.950 -1.901
257 HB2 HIS 35 1HB HIS 35 8.005 -2.721 -0.876
258 HB3 HIS 35 2HB HIS 35 9.606 -1.989 -0.856
259 HD1 HIS 35 HD1 HIS 35 10.649 -1.683 -3.411
260 HD2 HIS 35 HD2 HIS 35 6.523 -1.967 -3.006
261 HE1 HIS 35 HE1 HIS 35 9.697 -0.727 -5.533
262 H THR 36 H THR 36 8.126 -5.818 -0.414
263 HA THR 36 HA THR 36 9.110 -5.475 2.285
264 HB THR 36 HB THR 36 7.418 -7.030 2.964
265 HG1 THR 36 HG1 THR 36 6.176 -8.146 1.340
266 HG21 THR 36 3HG2 THR 36 5.567 -5.978 1.127
267 HG22 THR 36 1HG2 THR 36 6.826 -4.757 1.310
268 HG23 THR 36 2HG2 THR 36 5.966 -5.356 2.728
269 H GLY 37 H GLY 37 10.481 -6.785 3.369
270 HA2 GLY 37 1HA GLY 37 11.008 -9.468 2.880
271 HA3 GLY 37 2HA GLY 37 12.154 -8.554 1.911
272 H GLU 38 H GLU 38 11.267 -9.586 5.081
273 HA GLU 38 HA GLU 38 12.523 -8.054 6.868
274 HB2 GLU 38 1HB GLU 38 12.470 -11.029 6.577
275 HB3 GLU 38 2HB GLU 38 13.440 -10.316 7.858
276 HG2 GLU 38 1HG GLU 38 10.474 -10.215 7.472
277 HG3 GLU 38 2HG GLU 38 11.393 -10.790 8.862
278 H LYS 39 H LYS 39 14.294 -6.867 6.474
279 HA LYS 39 HA LYS 39 16.536 -7.826 4.992
280 HB2 LYS 39 1HB LYS 39 16.194 -5.376 6.728
281 HB3 LYS 39 2HB LYS 39 17.605 -5.691 5.727
282 HG2 LYS 39 1HG LYS 39 14.810 -5.491 4.636
283 HG3 LYS 39 2HG LYS 39 15.922 -4.124 4.744
284 HD2 LYS 39 1HD LYS 39 17.557 -5.634 3.443
285 HD3 LYS 39 2HD LYS 39 16.129 -6.598 3.058
286 HE2 LYS 39 1HE LYS 39 16.207 -3.634 2.587
287 HE3 LYS 39 2HE LYS 39 16.838 -4.774 1.399
288 HZ1 LYS 39 3HZ LYS 39 14.301 -3.955 1.477
289 HZ2 LYS 39 1HZ LYS 39 14.185 -5.368 2.400
290 HZ3 LYS 39 2HZ LYS 39 14.787 -5.436 0.822
291 H ARG 40 H ARG 40 18.640 -8.261 5.737
292 HA ARG 40 HA ARG 40 18.704 -9.488 8.366
293 HB2 ARG 40 1HB ARG 40 20.650 -9.453 6.061
294 HB3 ARG 40 2HB ARG 40 21.016 -10.208 7.606
295 HG2 ARG 40 1HG ARG 40 20.277 -11.984 6.335
296 HG3 ARG 40 2HG ARG 40 18.823 -11.517 7.220
297 HD2 ARG 40 1HD ARG 40 18.105 -11.818 5.010
298 HD3 ARG 40 2HD ARG 40 18.261 -10.072 5.197
299 HE ARG 40 HE ARG 40 20.570 -11.443 4.101
300 HH11 ARG 40 1HH1 ARG 40 17.647 -9.657 3.479
301 HH12 ARG 40 2HH1 ARG 40 18.122 -9.182 1.882
302 HH21 ARG 40 1HH2 ARG 40 21.207 -10.824 2.000
303 HH22 ARG 40 2HH2 ARG 40 20.147 -9.847 1.041
304 H SER 41 H SER 41 18.668 -7.649 9.712
305 HA SER 41 HA SER 41 21.218 -6.176 9.777
306 HB2 SER 41 1HB SER 41 18.435 -5.116 10.306
307 HB3 SER 41 2HB SER 41 19.909 -4.238 10.713
308 HG SER 41 HG SER 41 20.427 -4.134 8.552
309 H GLY 42 H GLY 42 21.945 -5.512 11.873
310 HA2 GLY 42 1HA GLY 42 21.946 -5.555 14.225
311 HA3 GLY 42 2HA GLY 42 20.576 -6.655 14.183
312 HA PRO 43 HA PRO 43 24.706 -8.878 14.945
313 HB2 PRO 43 1HB PRO 43 24.349 -9.443 17.577
314 HB3 PRO 43 2HB PRO 43 25.150 -7.972 17.010
315 HG2 PRO 43 1HG PRO 43 22.327 -8.358 17.931
316 HG3 PRO 43 2HG PRO 43 23.455 -7.039 18.300
317 HD2 PRO 43 1HD PRO 43 21.500 -6.807 16.440
318 HD3 PRO 43 2HD PRO 43 23.060 -5.973 16.295
319 H SER 44 H SER 44 21.459 -9.400 14.844
320 HA SER 44 HA SER 44 20.877 -11.802 15.997
321 HB2 SER 44 1HB SER 44 19.266 -12.173 14.179
322 HB3 SER 44 2HB SER 44 19.253 -10.487 14.696
323 HG SER 44 HG SER 44 20.396 -9.929 12.881
324 H SER 45 H SER 45 21.952 -13.652 16.014
325 HA SER 45 HA SER 45 23.450 -14.445 13.609
326 HB2 SER 45 1HB SER 45 24.829 -15.823 15.080
327 HB3 SER 45 2HB SER 45 24.798 -14.161 15.668
328 HG SER 45 HG SER 45 23.370 -14.768 17.262
329 H GLY 46 H GLY 46 20.721 -14.873 13.574
330 HA2 GLY 46 1HA GLY 46 19.143 -16.506 13.233
331 HA3 GLY 46 2HA GLY 46 20.510 -17.546 12.859
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -9.574 23.329 5.580
2 HA2 GLY 1 1HA GLY 1 -10.724 22.207 7.522
3 HA3 GLY 1 2HA GLY 1 -12.102 23.214 7.105
4 H SER 2 H SER 2 -10.932 20.181 6.870
5 HA SER 2 HA SER 2 -12.683 19.582 4.605
6 HB2 SER 2 1HB SER 2 -9.838 18.578 4.852
7 HB3 SER 2 2HB SER 2 -11.008 18.018 3.658
8 HG SER 2 HG SER 2 -9.435 19.814 3.114
9 H SER 3 H SER 3 -14.083 18.076 5.195
10 HA SER 3 HA SER 3 -13.264 16.115 7.239
11 HB2 SER 3 1HB SER 3 -15.896 17.535 6.849
12 HB3 SER 3 2HB SER 3 -15.773 16.043 7.782
13 HG SER 3 HG SER 3 -15.578 18.030 9.020
14 H GLY 4 H GLY 4 -12.798 15.614 4.560
15 HA2 GLY 4 1HA GLY 4 -13.073 13.915 3.037
16 HA3 GLY 4 2HA GLY 4 -14.114 13.131 4.216
17 H SER 5 H SER 5 -14.500 13.150 1.389
18 HA SER 5 HA SER 5 -17.221 14.117 1.332
19 HB2 SER 5 1HB SER 5 -16.853 15.371 -0.826
20 HB3 SER 5 2HB SER 5 -16.150 16.137 0.599
21 HG SER 5 HG SER 5 -14.498 14.370 -0.739
22 H SER 6 H SER 6 -18.317 12.451 0.560
23 HA SER 6 HA SER 6 -17.481 10.144 -0.508
24 HB2 SER 6 1HB SER 6 -19.828 10.525 -0.022
25 HB3 SER 6 2HB SER 6 -19.953 11.671 -1.357
26 HG SER 6 HG SER 6 -19.339 9.851 -2.732
27 H GLY 7 H GLY 7 -16.699 9.336 -2.381
28 HA2 GLY 7 1HA GLY 7 -17.005 10.113 -4.951
29 HA3 GLY 7 2HA GLY 7 -15.781 11.230 -4.364
30 H THR 8 H THR 8 -16.153 8.480 -6.036
31 HA THR 8 HA THR 8 -13.765 7.158 -4.961
32 HB THR 8 HB THR 8 -14.370 5.315 -6.564
33 HG1 THR 8 HG1 THR 8 -16.599 5.443 -7.331
34 HG21 THR 8 3HG2 THR 8 -16.251 4.485 -5.222
35 HG22 THR 8 1HG2 THR 8 -16.478 6.096 -4.545
36 HG23 THR 8 2HG2 THR 8 -14.999 5.198 -4.206
37 H LYS 9 H LYS 9 -12.180 6.316 -6.542
38 HA LYS 9 HA LYS 9 -12.010 7.792 -9.051
39 HB2 LYS 9 1HB LYS 9 -10.790 8.929 -6.974
40 HB3 LYS 9 2HB LYS 9 -9.538 7.765 -7.387
41 HG2 LYS 9 1HG LYS 9 -9.800 8.697 -9.786
42 HG3 LYS 9 2HG LYS 9 -10.581 10.063 -8.986
43 HD2 LYS 9 1HD LYS 9 -7.972 9.117 -7.916
44 HD3 LYS 9 2HD LYS 9 -7.970 10.011 -9.438
45 HE2 LYS 9 1HE LYS 9 -7.751 11.725 -7.924
46 HE3 LYS 9 2HE LYS 9 -9.502 11.670 -8.115
47 HZ1 LYS 9 3HZ LYS 9 -9.048 11.790 -5.811
48 HZ2 LYS 9 1HZ LYS 9 -7.895 10.555 -5.887
49 HZ3 LYS 9 2HZ LYS 9 -9.532 10.198 -6.113
50 H GLU 10 H GLU 10 -10.247 6.985 -10.446
51 HA GLU 10 HA GLU 10 -10.092 4.099 -10.251
52 HB2 GLU 10 1HB GLU 10 -9.594 4.092 -12.498
53 HB3 GLU 10 2HB GLU 10 -10.504 5.591 -12.376
54 HG2 GLU 10 1HG GLU 10 -8.495 6.887 -12.376
55 HG3 GLU 10 2HG GLU 10 -7.503 5.434 -12.276
56 H LYS 11 H LYS 11 -8.280 2.893 -9.930
57 HA LYS 11 HA LYS 11 -6.321 2.515 -8.747
58 HB2 LYS 11 1HB LYS 11 -5.253 4.155 -11.048
59 HB3 LYS 11 2HB LYS 11 -4.410 2.887 -10.168
60 HG2 LYS 11 1HG LYS 11 -6.464 1.446 -11.017
61 HG3 LYS 11 2HG LYS 11 -6.484 2.684 -12.276
62 HD2 LYS 11 1HD LYS 11 -3.993 2.226 -12.543
63 HD3 LYS 11 2HD LYS 11 -4.263 0.787 -11.556
64 HE2 LYS 11 1HE LYS 11 -5.807 -0.098 -13.158
65 HE3 LYS 11 2HE LYS 11 -5.785 1.402 -14.084
66 HZ1 LYS 11 3HZ LYS 11 -3.511 -0.475 -13.730
67 HZ2 LYS 11 1HZ LYS 11 -3.428 1.001 -14.554
68 HZ3 LYS 11 2HZ LYS 11 -4.409 -0.243 -15.145
69 HA PRO 12 HA PRO 12 -6.055 6.944 -7.089
70 HB2 PRO 12 1HB PRO 12 -7.306 6.492 -4.722
71 HB3 PRO 12 2HB PRO 12 -8.166 6.992 -6.183
72 HG2 PRO 12 1HG PRO 12 -7.866 4.257 -5.005
73 HG3 PRO 12 2HG PRO 12 -9.308 5.026 -5.695
74 HD2 PRO 12 1HD PRO 12 -7.810 3.240 -7.072
75 HD3 PRO 12 2HD PRO 12 -8.662 4.582 -7.862
76 H TYR 13 H TYR 13 -5.634 3.754 -5.655
77 HA TYR 13 HA TYR 13 -3.832 4.630 -3.611
78 HB2 TYR 13 1HB TYR 13 -4.629 1.935 -4.687
79 HB3 TYR 13 2HB TYR 13 -3.333 2.098 -3.507
80 HD1 TYR 13 HD1 TYR 13 -6.246 4.322 -3.459
81 HD2 TYR 13 HD2 TYR 13 -4.502 0.801 -1.827
82 HE1 TYR 13 HE1 TYR 13 -7.907 4.348 -1.645
83 HE2 TYR 13 HE2 TYR 13 -6.158 0.816 -0.009
84 HH TYR 13 HH TYR 13 -8.932 2.417 -0.061
85 H LYS 14 H LYS 14 -1.846 5.328 -3.988
86 HA LYS 14 HA LYS 14 -0.356 4.204 -6.266
87 HB2 LYS 14 1HB LYS 14 -0.574 6.522 -6.628
88 HB3 LYS 14 2HB LYS 14 -0.275 6.902 -4.937
89 HG2 LYS 14 1HG LYS 14 2.030 6.475 -5.141
90 HG3 LYS 14 2HG LYS 14 1.822 5.675 -6.701
91 HD2 LYS 14 1HD LYS 14 1.338 7.722 -7.790
92 HD3 LYS 14 2HD LYS 14 1.146 8.574 -6.256
93 HE2 LYS 14 1HE LYS 14 3.603 7.948 -5.839
94 HE3 LYS 14 2HE LYS 14 3.662 7.594 -7.565
95 HZ1 LYS 14 3HZ LYS 14 4.384 9.848 -7.111
96 HZ2 LYS 14 1HZ LYS 14 2.912 10.201 -6.355
97 HZ3 LYS 14 2HZ LYS 14 2.952 9.864 -8.012
98 H CYS 15 H CYS 15 1.432 3.062 -5.883
99 HA CYS 15 HA CYS 15 2.196 2.393 -3.233
100 HB2 CYS 15 1HB CYS 15 2.429 0.864 -5.181
101 HB3 CYS 15 2HB CYS 15 3.710 1.898 -5.805
102 H TYR 16 H TYR 16 3.137 3.839 -1.941
103 HA TYR 16 HA TYR 16 4.725 6.002 -2.851
104 HB2 TYR 16 1HB TYR 16 4.707 4.879 -0.050
105 HB3 TYR 16 2HB TYR 16 5.059 6.530 -0.547
106 HD1 TYR 16 HD1 TYR 16 2.820 7.040 -2.419
107 HD2 TYR 16 HD2 TYR 16 2.865 5.100 1.368
108 HE1 TYR 16 HE1 TYR 16 0.459 7.645 -2.087
109 HE2 TYR 16 HE2 TYR 16 0.504 5.699 1.710
110 HH TYR 16 HH TYR 16 -1.314 6.608 0.808
111 H GLU 17 H GLU 17 5.419 2.741 -2.522
112 HA GLU 17 HA GLU 17 8.155 2.950 -1.692
113 HB2 GLU 17 1HB GLU 17 6.929 0.631 -3.175
114 HB3 GLU 17 2HB GLU 17 8.293 0.610 -2.065
115 HG2 GLU 17 1HG GLU 17 6.507 1.473 -0.352
116 HG3 GLU 17 2HG GLU 17 5.379 0.737 -1.489
117 H CYS 18 H CYS 18 6.553 2.289 -4.803
118 HA CYS 18 HA CYS 18 9.047 3.096 -6.151
119 HB2 CYS 18 1HB CYS 18 8.457 1.630 -7.989
120 HB3 CYS 18 2HB CYS 18 8.448 0.711 -6.487
121 H GLY 19 H GLY 19 5.530 3.292 -6.149
122 HA2 GLY 19 1HA GLY 19 4.651 5.558 -6.645
123 HA3 GLY 19 2HA GLY 19 5.745 5.570 -8.021
124 H LYS 20 H LYS 20 4.353 2.534 -7.467
125 HA LYS 20 HA LYS 20 2.970 2.552 -9.939
126 HB2 LYS 20 1HB LYS 20 3.203 0.632 -7.656
127 HB3 LYS 20 2HB LYS 20 1.973 0.357 -8.883
128 HG2 LYS 20 1HG LYS 20 4.838 0.801 -9.634
129 HG3 LYS 20 2HG LYS 20 4.247 -0.791 -9.153
130 HD2 LYS 20 1HD LYS 20 2.388 -0.324 -10.923
131 HD3 LYS 20 2HD LYS 20 3.546 0.851 -11.552
132 HE2 LYS 20 1HE LYS 20 4.429 -1.944 -10.970
133 HE3 LYS 20 2HE LYS 20 3.537 -1.601 -12.451
134 HZ1 LYS 20 3HZ LYS 20 5.687 -1.308 -13.133
135 HZ2 LYS 20 1HZ LYS 20 6.212 -0.698 -11.644
136 HZ3 LYS 20 2HZ LYS 20 5.300 0.276 -12.684
137 H ALA 21 H ALA 21 0.586 1.455 -9.753
138 HA ALA 21 HA ALA 21 -1.024 3.009 -7.864
139 HB1 ALA 21 3HB ALA 21 -1.312 3.091 -10.857
140 HB2 ALA 21 1HB ALA 21 -2.590 3.593 -9.750
141 HB3 ALA 21 2HB ALA 21 -1.041 4.439 -9.752
142 H PHE 22 H PHE 22 -3.238 2.243 -7.681
143 HA PHE 22 HA PHE 22 -4.004 -0.227 -8.919
144 HB2 PHE 22 1HB PHE 22 -3.498 -0.297 -5.940
145 HB3 PHE 22 2HB PHE 22 -4.018 -1.631 -6.965
146 HD1 PHE 22 HD1 PHE 22 -1.197 0.489 -5.985
147 HD2 PHE 22 HD2 PHE 22 -2.453 -2.829 -8.336
148 HE1 PHE 22 HE1 PHE 22 1.154 -0.151 -6.332
149 HE2 PHE 22 HE2 PHE 22 -0.105 -3.475 -8.686
150 HZ PHE 22 HZ PHE 22 1.702 -2.136 -7.683
151 H ARG 23 H ARG 23 -6.180 -0.672 -8.675
152 HA ARG 23 HA ARG 23 -7.862 1.491 -8.029
153 HB2 ARG 23 1HB ARG 23 -8.616 -1.423 -8.308
154 HB3 ARG 23 2HB ARG 23 -9.707 -0.049 -8.425
155 HG2 ARG 23 1HG ARG 23 -8.209 0.711 -10.370
156 HG3 ARG 23 2HG ARG 23 -7.599 -0.945 -10.350
157 HD2 ARG 23 1HD ARG 23 -9.826 -1.811 -10.708
158 HD3 ARG 23 2HD ARG 23 -10.507 -0.189 -10.595
159 HE ARG 23 HE ARG 23 -8.794 0.080 -12.632
160 HH11 ARG 23 1HH1 ARG 23 -11.197 -2.341 -11.939
161 HH12 ARG 23 2HH1 ARG 23 -11.519 -2.686 -13.606
162 HH21 ARG 23 1HH2 ARG 23 -9.209 -0.365 -14.831
163 HH22 ARG 23 2HH2 ARG 23 -10.387 -1.562 -15.250
164 H THR 24 H THR 24 -7.558 -1.674 -6.408
165 HA THR 24 HA THR 24 -8.711 -0.474 -3.990
166 HB THR 24 HB THR 24 -9.297 -2.643 -3.253
167 HG1 THR 24 HG1 THR 24 -8.067 -3.969 -5.396
168 HG21 THR 24 3HG2 THR 24 -10.868 -2.033 -4.878
169 HG22 THR 24 1HG2 THR 24 -10.395 -3.667 -5.343
170 HG23 THR 24 2HG2 THR 24 -9.730 -2.278 -6.202
171 H ARG 25 H ARG 25 -7.807 -1.964 -1.989
172 HA ARG 25 HA ARG 25 -5.061 -1.113 -1.743
173 HB2 ARG 25 1HB ARG 25 -6.947 -1.057 0.057
174 HB3 ARG 25 2HB ARG 25 -6.508 -2.740 0.319
175 HG2 ARG 25 1HG ARG 25 -4.646 -0.384 0.543
176 HG3 ARG 25 2HG ARG 25 -5.383 -1.254 1.890
177 HD2 ARG 25 1HD ARG 25 -4.249 -3.314 1.132
178 HD3 ARG 25 2HD ARG 25 -3.461 -2.383 -0.141
179 HE ARG 25 HE ARG 25 -2.753 -2.459 2.638
180 HH11 ARG 25 1HH1 ARG 25 -2.654 -0.557 -0.276
181 HH12 ARG 25 2HH1 ARG 25 -1.273 0.365 0.217
182 HH21 ARG 25 1HH2 ARG 25 -0.934 -1.252 3.299
183 HH22 ARG 25 2HH2 ARG 25 -0.294 -0.032 2.250
184 H SER 26 H SER 26 -6.729 -4.229 -1.241
185 HA SER 26 HA SER 26 -4.610 -5.890 -0.877
186 HB2 SER 26 1HB SER 26 -7.073 -6.510 -0.943
187 HB3 SER 26 2HB SER 26 -6.908 -6.625 -2.695
188 HG SER 26 HG SER 26 -5.318 -8.070 -0.842
189 H ASN 27 H ASN 27 -5.692 -4.496 -3.914
190 HA ASN 27 HA ASN 27 -3.980 -6.046 -5.580
191 HB2 ASN 27 1HB ASN 27 -6.114 -4.588 -6.145
192 HB3 ASN 27 2HB ASN 27 -4.911 -3.327 -6.402
193 HD21 ASN 27 1HD2 ASN 27 -6.116 -6.406 -7.479
194 HD22 ASN 27 2HD2 ASN 27 -5.311 -6.411 -9.008
195 H LEU 28 H LEU 28 -3.657 -3.017 -3.856
196 HA LEU 28 HA LEU 28 -1.225 -2.233 -5.152
197 HB2 LEU 28 1HB LEU 28 -2.304 -0.404 -4.306
198 HB3 LEU 28 2HB LEU 28 -2.854 -1.260 -2.867
199 HG LEU 28 HG LEU 28 -0.629 -1.073 -1.889
200 HD11 LEU 28 1HD1 LEU 28 1.197 -0.111 -2.929
201 HD12 LEU 28 2HD1 LEU 28 0.209 0.718 -4.131
202 HD13 LEU 28 3HD1 LEU 28 0.454 -1.025 -4.242
203 HD21 LEU 28 3HD2 LEU 28 -0.696 1.237 -1.370
204 HD22 LEU 28 1HD2 LEU 28 -2.365 0.741 -1.657
205 HD23 LEU 28 2HD2 LEU 28 -1.483 1.630 -2.900
206 H THR 29 H THR 29 -1.983 -3.457 -1.892
207 HA THR 29 HA THR 29 0.635 -3.668 -0.961
208 HB THR 29 HB THR 29 -1.849 -5.220 -0.248
209 HG1 THR 29 HG1 THR 29 -1.768 -3.873 1.570
210 HG21 THR 29 3HG2 THR 29 0.950 -5.683 0.557
211 HG22 THR 29 1HG2 THR 29 -0.430 -6.780 0.573
212 HG23 THR 29 2HG2 THR 29 -0.219 -5.609 1.875
213 H THR 30 H THR 30 -1.382 -6.108 -2.581
214 HA THR 30 HA THR 30 0.237 -8.302 -2.498
215 HB THR 30 HB THR 30 -1.556 -7.302 -4.696
216 HG1 THR 30 HG1 THR 30 -2.842 -8.180 -3.234
217 HG21 THR 30 3HG2 THR 30 0.077 -9.837 -4.655
218 HG22 THR 30 1HG2 THR 30 0.090 -8.569 -5.880
219 HG23 THR 30 2HG2 THR 30 -1.330 -9.598 -5.691
220 H HIS 31 H HIS 31 0.736 -5.379 -4.309
221 HA HIS 31 HA HIS 31 2.916 -6.557 -5.850
222 HB2 HIS 31 1HB HIS 31 1.838 -5.131 -7.282
223 HB3 HIS 31 2HB HIS 31 1.335 -4.043 -5.992
224 HD1 HIS 31 HD1 HIS 31 4.151 -4.719 -8.352
225 HD2 HIS 31 HD2 HIS 31 3.141 -1.989 -5.387
226 HE1 HIS 31 HE1 HIS 31 5.815 -2.846 -8.567
227 H GLN 32 H GLN 32 2.356 -4.282 -3.234
228 HA GLN 32 HA GLN 32 4.890 -3.140 -3.046
229 HB2 GLN 32 1HB GLN 32 2.828 -3.747 -0.930
230 HB3 GLN 32 2HB GLN 32 4.304 -2.852 -0.593
231 HG2 GLN 32 1HG GLN 32 3.439 -1.414 -2.649
232 HG3 GLN 32 2HG GLN 32 1.887 -2.038 -2.092
233 HE21 GLN 32 1HE2 GLN 32 0.948 -0.408 -1.070
234 HE22 GLN 32 2HE2 GLN 32 1.662 0.535 0.189
235 H VAL 33 H VAL 33 3.922 -6.349 -2.488
236 HA VAL 33 HA VAL 33 5.589 -7.223 -0.457
237 HB VAL 33 HB VAL 33 4.923 -8.749 -2.979
238 HG11 VAL 33 1HG1 VAL 33 5.170 -10.729 -1.503
239 HG12 VAL 33 2HG1 VAL 33 6.674 -9.834 -1.733
240 HG13 VAL 33 3HG1 VAL 33 5.765 -9.662 -0.231
241 HG21 VAL 33 3HG2 VAL 33 3.389 -8.345 -0.423
242 HG22 VAL 33 1HG2 VAL 33 2.864 -8.023 -2.075
243 HG23 VAL 33 2HG2 VAL 33 3.072 -9.685 -1.524
244 H ILE 34 H ILE 34 6.332 -6.531 -3.818
245 HA ILE 34 HA ILE 34 8.836 -7.741 -4.015
246 HB ILE 34 HB ILE 34 9.305 -6.248 -5.845
247 HG12 ILE 34 1HG1 ILE 34 7.012 -4.605 -4.756
248 HG13 ILE 34 2HG1 ILE 34 8.701 -4.123 -4.874
249 HG21 ILE 34 1HG2 ILE 34 6.560 -7.353 -5.568
250 HG22 ILE 34 2HG2 ILE 34 6.921 -6.357 -6.977
251 HG23 ILE 34 3HG2 ILE 34 7.861 -7.816 -6.664
252 HD11 ILE 34 3HD1 ILE 34 7.732 -3.031 -6.653
253 HD12 ILE 34 1HD1 ILE 34 8.373 -4.488 -7.411
254 HD13 ILE 34 2HD1 ILE 34 6.655 -4.376 -7.028
255 H HIS 35 H HIS 35 7.860 -4.787 -2.447
256 HA HIS 35 HA HIS 35 10.611 -3.923 -2.050
257 HB2 HIS 35 1HB HIS 35 8.059 -2.683 -1.003
258 HB3 HIS 35 2HB HIS 35 9.657 -1.942 -1.024
259 HD1 HIS 35 HD1 HIS 35 10.657 -1.706 -3.610
260 HD2 HIS 35 HD2 HIS 35 6.540 -1.967 -3.117
261 HE1 HIS 35 HE1 HIS 35 9.666 -0.799 -5.736
262 H THR 36 H THR 36 8.317 -5.871 -0.504
263 HA THR 36 HA THR 36 9.414 -5.440 2.166
264 HB THR 36 HB THR 36 7.674 -6.861 2.992
265 HG1 THR 36 HG1 THR 36 6.296 -7.986 1.528
266 HG21 THR 36 3HG2 THR 36 7.158 -4.492 1.942
267 HG22 THR 36 1HG2 THR 36 5.864 -5.516 2.562
268 HG23 THR 36 2HG2 THR 36 6.184 -5.453 0.829
269 H GLY 37 H GLY 37 11.209 -6.488 0.232
270 HA2 GLY 37 1HA GLY 37 11.408 -9.345 0.737
271 HA3 GLY 37 2HA GLY 37 12.467 -8.390 -0.290
272 H GLU 38 H GLU 38 14.416 -9.014 0.514
273 HA GLU 38 HA GLU 38 16.213 -9.065 1.907
274 HB2 GLU 38 1HB GLU 38 14.588 -6.813 2.972
275 HB3 GLU 38 2HB GLU 38 15.890 -7.418 3.986
276 HG2 GLU 38 1HG GLU 38 16.223 -6.493 1.142
277 HG3 GLU 38 2HG GLU 38 16.547 -5.510 2.569
278 H LYS 39 H LYS 39 14.292 -11.056 2.258
279 HA LYS 39 HA LYS 39 13.373 -12.526 3.778
280 HB2 LYS 39 1HB LYS 39 15.095 -13.499 5.238
281 HB3 LYS 39 2HB LYS 39 15.699 -13.236 3.607
282 HG2 LYS 39 1HG LYS 39 16.994 -11.388 4.272
283 HG3 LYS 39 2HG LYS 39 16.167 -11.270 5.827
284 HD2 LYS 39 1HD LYS 39 17.666 -13.758 5.106
285 HD3 LYS 39 2HD LYS 39 18.535 -12.343 5.704
286 HE2 LYS 39 1HE LYS 39 16.905 -12.347 7.649
287 HE3 LYS 39 2HE LYS 39 16.397 -13.940 7.093
288 HZ1 LYS 39 3HZ LYS 39 18.502 -13.381 8.761
289 HZ2 LYS 39 1HZ LYS 39 19.230 -13.763 7.282
290 HZ3 LYS 39 2HZ LYS 39 18.174 -14.863 8.015
291 H ARG 40 H ARG 40 12.551 -9.932 4.411
292 HA ARG 40 HA ARG 40 12.608 -9.970 7.357
293 HB2 ARG 40 1HB ARG 40 13.638 -7.960 6.223
294 HB3 ARG 40 2HB ARG 40 12.032 -7.570 5.620
295 HG2 ARG 40 1HG ARG 40 12.252 -6.245 7.513
296 HG3 ARG 40 2HG ARG 40 11.310 -7.626 8.080
297 HD2 ARG 40 1HD ARG 40 14.272 -7.764 8.287
298 HD3 ARG 40 2HD ARG 40 13.410 -6.718 9.414
299 HE ARG 40 HE ARG 40 12.389 -9.417 9.201
300 HH11 ARG 40 1HH1 ARG 40 14.517 -7.226 10.872
301 HH12 ARG 40 2HH1 ARG 40 14.588 -8.188 12.312
302 HH21 ARG 40 1HH2 ARG 40 12.475 -10.691 11.090
303 HH22 ARG 40 2HH2 ARG 40 13.427 -10.159 12.434
304 H SER 41 H SER 41 10.847 -11.520 7.241
305 HA SER 41 HA SER 41 8.268 -10.157 7.036
306 HB2 SER 41 1HB SER 41 7.314 -12.208 5.901
307 HB3 SER 41 2HB SER 41 8.391 -11.234 4.901
308 HG SER 41 HG SER 41 9.948 -12.942 6.080
309 H GLY 42 H GLY 42 6.898 -10.673 8.645
310 HA2 GLY 42 1HA GLY 42 6.044 -11.704 10.512
311 HA3 GLY 42 2HA GLY 42 6.818 -13.181 9.956
312 HA PRO 43 HA PRO 43 8.855 -11.751 13.898
313 HB2 PRO 43 1HB PRO 43 8.616 -14.129 15.185
314 HB3 PRO 43 2HB PRO 43 7.359 -12.887 15.221
315 HG2 PRO 43 1HG PRO 43 7.537 -15.352 13.533
316 HG3 PRO 43 2HG PRO 43 6.135 -14.677 14.383
317 HD2 PRO 43 1HD PRO 43 6.531 -14.336 11.726
318 HD3 PRO 43 2HD PRO 43 5.730 -13.115 12.737
319 H SER 44 H SER 44 10.643 -13.097 15.104
320 HA SER 44 HA SER 44 12.701 -13.586 13.243
321 HB2 SER 44 1HB SER 44 12.470 -14.174 16.198
322 HB3 SER 44 2HB SER 44 13.941 -14.479 15.274
323 HG SER 44 HG SER 44 13.522 -12.113 14.622
324 H SER 45 H SER 45 10.800 -15.806 15.268
325 HA SER 45 HA SER 45 12.009 -18.120 14.016
326 HB2 SER 45 1HB SER 45 11.269 -17.934 16.477
327 HB3 SER 45 2HB SER 45 9.632 -18.174 15.868
328 HG SER 45 HG SER 45 11.078 -20.078 16.521
329 H GLY 46 H GLY 46 11.399 -18.099 11.872
330 HA2 GLY 46 1HA GLY 46 8.542 -17.985 11.239
331 HA3 GLY 46 2HA GLY 46 9.863 -17.911 10.082
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -1.513 25.134 -7.974
2 HA2 GLY 1 1HA GLY 1 -1.671 27.600 -8.724
3 HA3 GLY 1 2HA GLY 1 -0.075 27.701 -7.997
4 H SER 2 H SER 2 -1.561 25.173 -10.006
5 HA SER 2 HA SER 2 0.270 25.799 -12.183
6 HB2 SER 2 1HB SER 2 0.337 23.250 -10.587
7 HB3 SER 2 2HB SER 2 0.840 23.270 -12.277
8 HG SER 2 HG SER 2 2.640 23.651 -11.030
9 H SER 3 H SER 3 -0.399 25.040 -14.188
10 HA SER 3 HA SER 3 -3.184 24.128 -14.262
11 HB2 SER 3 1HB SER 3 -1.516 25.253 -16.523
12 HB3 SER 3 2HB SER 3 -3.258 24.982 -16.527
13 HG SER 3 HG SER 3 -2.504 27.195 -16.082
14 H GLY 4 H GLY 4 -3.764 22.197 -15.075
15 HA2 GLY 4 1HA GLY 4 -3.205 20.535 -16.895
16 HA3 GLY 4 2HA GLY 4 -1.603 20.509 -16.173
17 H SER 5 H SER 5 -4.680 19.123 -16.179
18 HA SER 5 HA SER 5 -4.038 17.624 -13.724
19 HB2 SER 5 1HB SER 5 -6.452 17.420 -13.291
20 HB3 SER 5 2HB SER 5 -5.957 19.111 -13.338
21 HG SER 5 HG SER 5 -6.682 18.203 -15.791
22 H SER 6 H SER 6 -3.131 16.818 -16.213
23 HA SER 6 HA SER 6 -4.958 14.859 -17.300
24 HB2 SER 6 1HB SER 6 -3.070 14.309 -18.820
25 HB3 SER 6 2HB SER 6 -3.466 16.028 -18.827
26 HG SER 6 HG SER 6 -1.511 16.407 -18.194
27 H GLY 7 H GLY 7 -5.193 12.865 -16.549
28 HA2 GLY 7 1HA GLY 7 -3.033 11.199 -15.791
29 HA3 GLY 7 2HA GLY 7 -3.830 11.825 -14.355
30 H THR 8 H THR 8 -4.241 9.512 -13.970
31 HA THR 8 HA THR 8 -6.334 8.346 -15.646
32 HB THR 8 HB THR 8 -4.470 6.881 -15.054
33 HG1 THR 8 HG1 THR 8 -7.087 6.379 -14.299
34 HG21 THR 8 3HG2 THR 8 -4.546 8.137 -12.601
35 HG22 THR 8 1HG2 THR 8 -3.599 6.703 -12.997
36 HG23 THR 8 2HG2 THR 8 -5.187 6.532 -12.250
37 H LYS 9 H LYS 9 -8.362 7.805 -14.893
38 HA LYS 9 HA LYS 9 -9.404 9.428 -12.788
39 HB2 LYS 9 1HB LYS 9 -10.787 8.969 -14.707
40 HB3 LYS 9 2HB LYS 9 -10.646 7.234 -14.452
41 HG2 LYS 9 1HG LYS 9 -12.802 7.922 -13.712
42 HG3 LYS 9 2HG LYS 9 -11.840 7.520 -12.288
43 HD2 LYS 9 1HD LYS 9 -11.523 9.793 -11.737
44 HD3 LYS 9 2HD LYS 9 -12.084 10.334 -13.321
45 HE2 LYS 9 1HE LYS 9 -14.327 9.747 -12.821
46 HE3 LYS 9 2HE LYS 9 -13.846 8.858 -11.378
47 HZ1 LYS 9 3HZ LYS 9 -12.974 11.113 -10.582
48 HZ2 LYS 9 1HZ LYS 9 -14.646 10.855 -10.558
49 HZ3 LYS 9 2HZ LYS 9 -13.951 11.776 -11.794
50 H GLU 10 H GLU 10 -9.310 5.884 -13.216
51 HA GLU 10 HA GLU 10 -9.813 5.506 -10.383
52 HB2 GLU 10 1HB GLU 10 -10.739 4.093 -12.374
53 HB3 GLU 10 2HB GLU 10 -9.181 3.283 -12.294
54 HG2 GLU 10 1HG GLU 10 -9.636 2.291 -10.298
55 HG3 GLU 10 2HG GLU 10 -10.714 3.583 -9.774
56 H LYS 11 H LYS 11 -8.440 3.515 -9.475
57 HA LYS 11 HA LYS 11 -6.424 2.712 -8.765
58 HB2 LYS 11 1HB LYS 11 -5.063 4.281 -10.944
59 HB3 LYS 11 2HB LYS 11 -4.510 2.811 -10.152
60 HG2 LYS 11 1HG LYS 11 -6.743 1.850 -11.206
61 HG3 LYS 11 2HG LYS 11 -6.467 3.168 -12.348
62 HD2 LYS 11 1HD LYS 11 -4.280 2.318 -12.879
63 HD3 LYS 11 2HD LYS 11 -4.406 1.089 -11.619
64 HE2 LYS 11 1HE LYS 11 -4.827 0.100 -13.790
65 HE3 LYS 11 2HE LYS 11 -6.300 0.080 -12.821
66 HZ1 LYS 11 3HZ LYS 11 -5.781 2.286 -14.707
67 HZ2 LYS 11 1HZ LYS 11 -7.259 1.735 -14.093
68 HZ3 LYS 11 2HZ LYS 11 -6.435 0.826 -15.257
69 HA PRO 12 HA PRO 12 -5.859 7.073 -7.033
70 HB2 PRO 12 1HB PRO 12 -7.119 6.644 -4.667
71 HB3 PRO 12 2HB PRO 12 -7.958 7.221 -6.111
72 HG2 PRO 12 1HG PRO 12 -7.805 4.450 -4.990
73 HG3 PRO 12 2HG PRO 12 -9.205 5.313 -5.653
74 HD2 PRO 12 1HD PRO 12 -7.818 3.474 -7.077
75 HD3 PRO 12 2HD PRO 12 -8.599 4.877 -7.834
76 H TYR 13 H TYR 13 -5.631 3.843 -5.634
77 HA TYR 13 HA TYR 13 -3.767 4.571 -3.595
78 HB2 TYR 13 1HB TYR 13 -4.716 1.951 -4.726
79 HB3 TYR 13 2HB TYR 13 -3.402 2.012 -3.557
80 HD1 TYR 13 HD1 TYR 13 -6.345 4.251 -3.562
81 HD2 TYR 13 HD2 TYR 13 -4.467 0.885 -1.760
82 HE1 TYR 13 HE1 TYR 13 -7.985 4.324 -1.730
83 HE2 TYR 13 HE2 TYR 13 -6.103 0.948 0.076
84 HH TYR 13 HH TYR 13 -8.500 3.530 0.313
85 H LYS 14 H LYS 14 -1.795 5.278 -4.060
86 HA LYS 14 HA LYS 14 -0.345 4.051 -6.310
87 HB2 LYS 14 1HB LYS 14 -0.509 6.367 -6.720
88 HB3 LYS 14 2HB LYS 14 -0.180 6.774 -5.041
89 HG2 LYS 14 1HG LYS 14 2.096 6.394 -5.259
90 HG3 LYS 14 2HG LYS 14 1.891 5.400 -6.703
91 HD2 LYS 14 1HD LYS 14 1.421 7.290 -8.050
92 HD3 LYS 14 2HD LYS 14 1.223 8.334 -6.641
93 HE2 LYS 14 1HE LYS 14 3.618 8.002 -6.113
94 HE3 LYS 14 2HE LYS 14 3.785 7.055 -7.591
95 HZ1 LYS 14 3HZ LYS 14 4.346 9.584 -7.569
96 HZ2 LYS 14 1HZ LYS 14 2.675 9.767 -7.762
97 HZ3 LYS 14 2HZ LYS 14 3.569 8.897 -8.905
98 H CYS 15 H CYS 15 1.568 3.051 -5.980
99 HA CYS 15 HA CYS 15 2.292 2.365 -3.294
100 HB2 CYS 15 1HB CYS 15 2.462 0.790 -5.225
101 HB3 CYS 15 2HB CYS 15 3.783 1.767 -5.856
102 H TYR 16 H TYR 16 3.119 4.031 -2.140
103 HA TYR 16 HA TYR 16 4.795 6.052 -3.129
104 HB2 TYR 16 1HB TYR 16 4.838 5.104 -0.272
105 HB3 TYR 16 2HB TYR 16 5.078 6.735 -0.886
106 HD1 TYR 16 HD1 TYR 16 2.777 7.034 -2.700
107 HD2 TYR 16 HD2 TYR 16 3.011 5.268 1.164
108 HE1 TYR 16 HE1 TYR 16 0.394 7.524 -2.338
109 HE2 TYR 16 HE2 TYR 16 0.629 5.752 1.536
110 HH TYR 16 HH TYR 16 -1.466 6.701 -0.956
111 H GLU 17 H GLU 17 5.441 2.799 -2.599
112 HA GLU 17 HA GLU 17 8.169 2.993 -1.775
113 HB2 GLU 17 1HB GLU 17 6.930 0.652 -3.211
114 HB3 GLU 17 2HB GLU 17 8.276 0.642 -2.080
115 HG2 GLU 17 1HG GLU 17 6.484 1.573 -0.415
116 HG3 GLU 17 2HG GLU 17 5.355 0.838 -1.552
117 H CYS 18 H CYS 18 6.604 2.261 -4.889
118 HA CYS 18 HA CYS 18 9.127 3.000 -6.223
119 HB2 CYS 18 1HB CYS 18 8.564 1.479 -8.016
120 HB3 CYS 18 2HB CYS 18 8.488 0.608 -6.488
121 H GLY 19 H GLY 19 5.591 3.112 -6.428
122 HA2 GLY 19 1HA GLY 19 4.787 5.446 -6.962
123 HA3 GLY 19 2HA GLY 19 5.859 5.338 -8.351
124 H LYS 20 H LYS 20 4.347 2.403 -7.544
125 HA LYS 20 HA LYS 20 2.919 2.326 -10.005
126 HB2 LYS 20 1HB LYS 20 3.164 0.500 -7.642
127 HB3 LYS 20 2HB LYS 20 1.931 0.190 -8.858
128 HG2 LYS 20 1HG LYS 20 4.700 0.650 -9.807
129 HG3 LYS 20 2HG LYS 20 4.354 -0.874 -8.985
130 HD2 LYS 20 1HD LYS 20 2.470 0.028 -11.100
131 HD3 LYS 20 2HD LYS 20 4.045 -0.586 -11.605
132 HE2 LYS 20 1HE LYS 20 3.650 -2.693 -10.660
133 HE3 LYS 20 2HE LYS 20 2.318 -2.097 -9.671
134 HZ1 LYS 20 3HZ LYS 20 1.094 -1.697 -11.787
135 HZ2 LYS 20 1HZ LYS 20 1.398 -3.328 -11.457
136 HZ3 LYS 20 2HZ LYS 20 2.330 -2.511 -12.607
137 H ALA 21 H ALA 21 0.530 1.392 -9.823
138 HA ALA 21 HA ALA 21 -1.004 2.982 -7.892
139 HB1 ALA 21 3HB ALA 21 -1.014 3.271 -10.833
140 HB2 ALA 21 1HB ALA 21 -2.585 3.299 -10.030
141 HB3 ALA 21 2HB ALA 21 -1.339 4.460 -9.572
142 H PHE 22 H PHE 22 -3.218 2.270 -7.633
143 HA PHE 22 HA PHE 22 -4.097 -0.173 -8.847
144 HB2 PHE 22 1HB PHE 22 -3.518 -0.275 -5.885
145 HB3 PHE 22 2HB PHE 22 -4.071 -1.591 -6.915
146 HD1 PHE 22 HD1 PHE 22 -1.208 0.473 -5.945
147 HD2 PHE 22 HD2 PHE 22 -2.543 -2.783 -8.339
148 HE1 PHE 22 HE1 PHE 22 1.128 -0.191 -6.339
149 HE2 PHE 22 HE2 PHE 22 -0.209 -3.453 -8.736
150 HZ PHE 22 HZ PHE 22 1.630 -2.157 -7.735
151 H ARG 23 H ARG 23 -6.262 -0.713 -8.303
152 HA ARG 23 HA ARG 23 -7.859 1.560 -7.632
153 HB2 ARG 23 1HB ARG 23 -8.743 -1.310 -7.971
154 HB3 ARG 23 2HB ARG 23 -9.760 0.122 -8.055
155 HG2 ARG 23 1HG ARG 23 -8.270 0.834 -10.012
156 HG3 ARG 23 2HG ARG 23 -7.713 -0.841 -10.017
157 HD2 ARG 23 1HD ARG 23 -9.975 -1.629 -10.351
158 HD3 ARG 23 2HD ARG 23 -10.597 0.016 -10.223
159 HE ARG 23 HE ARG 23 -8.919 0.258 -12.276
160 HH11 ARG 23 1HH1 ARG 23 -11.315 -2.166 -11.571
161 HH12 ARG 23 2HH1 ARG 23 -11.646 -2.510 -13.236
162 HH21 ARG 23 1HH2 ARG 23 -9.346 -0.186 -14.473
163 HH22 ARG 23 2HH2 ARG 23 -10.525 -1.384 -14.886
164 H THR 24 H THR 24 -7.482 -1.652 -6.127
165 HA THR 24 HA THR 24 -8.500 -0.502 -3.615
166 HB THR 24 HB THR 24 -9.210 -2.663 -2.940
167 HG1 THR 24 HG1 THR 24 -8.010 -4.293 -3.538
168 HG21 THR 24 3HG2 THR 24 -9.826 -2.055 -5.815
169 HG22 THR 24 1HG2 THR 24 -10.841 -1.824 -4.391
170 HG23 THR 24 2HG2 THR 24 -10.539 -3.449 -5.005
171 H ARG 25 H ARG 25 -7.592 -1.666 -1.623
172 HA ARG 25 HA ARG 25 -4.825 -1.179 -1.485
173 HB2 ARG 25 1HB ARG 25 -6.251 -1.000 0.477
174 HB3 ARG 25 2HB ARG 25 -6.625 -2.716 0.394
175 HG2 ARG 25 1HG ARG 25 -5.012 -2.336 2.128
176 HG3 ARG 25 2HG ARG 25 -4.244 -3.219 0.808
177 HD2 ARG 25 1HD ARG 25 -3.180 -1.221 0.013
178 HD3 ARG 25 2HD ARG 25 -4.079 -0.231 1.161
179 HE ARG 25 HE ARG 25 -2.462 -2.254 2.405
180 HH11 ARG 25 1HH1 ARG 25 -2.509 0.980 1.117
181 HH12 ARG 25 2HH1 ARG 25 -1.165 1.519 2.069
182 HH21 ARG 25 1HH2 ARG 25 -0.692 -1.557 3.663
183 HH22 ARG 25 2HH2 ARG 25 -0.132 0.074 3.517
184 H SER 26 H SER 26 -6.542 -4.290 -1.138
185 HA SER 26 HA SER 26 -4.484 -6.035 -1.021
186 HB2 SER 26 1HB SER 26 -6.899 -6.657 -1.030
187 HB3 SER 26 2HB SER 26 -6.912 -6.451 -2.782
188 HG SER 26 HG SER 26 -5.659 -8.421 -1.225
189 H ASN 27 H ASN 27 -5.788 -4.637 -4.014
190 HA ASN 27 HA ASN 27 -4.078 -5.974 -5.793
191 HB2 ASN 27 1HB ASN 27 -6.195 -4.583 -6.289
192 HB3 ASN 27 2HB ASN 27 -5.115 -3.192 -6.285
193 HD21 ASN 27 1HD2 ASN 27 -4.900 -2.615 -8.330
194 HD22 ASN 27 2HD2 ASN 27 -4.471 -3.665 -9.634
195 H LEU 28 H LEU 28 -3.663 -3.063 -3.890
196 HA LEU 28 HA LEU 28 -1.221 -2.289 -5.202
197 HB2 LEU 28 1HB LEU 28 -2.230 -0.433 -4.351
198 HB3 LEU 28 2HB LEU 28 -2.866 -1.289 -2.948
199 HG LEU 28 HG LEU 28 -0.597 -1.245 -1.949
200 HD11 LEU 28 1HD1 LEU 28 0.032 0.437 -4.368
201 HD12 LEU 28 2HD1 LEU 28 0.764 -1.103 -3.919
202 HD13 LEU 28 3HD1 LEU 28 1.050 0.330 -2.932
203 HD21 LEU 28 3HD2 LEU 28 -2.279 0.457 -1.397
204 HD22 LEU 28 1HD2 LEU 28 -1.681 1.463 -2.716
205 HD23 LEU 28 2HD2 LEU 28 -0.639 1.104 -1.339
206 H THR 29 H THR 29 -1.938 -3.280 -1.848
207 HA THR 29 HA THR 29 0.624 -3.623 -0.933
208 HB THR 29 HB THR 29 -1.820 -5.271 -0.263
209 HG1 THR 29 HG1 THR 29 -1.951 -3.832 1.481
210 HG21 THR 29 3HG2 THR 29 -0.673 -6.022 1.709
211 HG22 THR 29 1HG2 THR 29 0.736 -5.035 1.325
212 HG23 THR 29 2HG2 THR 29 0.326 -6.418 0.311
213 H THR 30 H THR 30 -1.386 -6.045 -2.589
214 HA THR 30 HA THR 30 0.223 -8.247 -2.496
215 HB THR 30 HB THR 30 -1.521 -7.234 -4.732
216 HG1 THR 30 HG1 THR 30 -2.763 -9.091 -3.979
217 HG21 THR 30 3HG2 THR 30 -1.325 -9.568 -5.666
218 HG22 THR 30 1HG2 THR 30 0.072 -9.791 -4.615
219 HG23 THR 30 2HG2 THR 30 0.103 -8.554 -5.872
220 H HIS 31 H HIS 31 0.662 -5.371 -4.448
221 HA HIS 31 HA HIS 31 2.886 -6.538 -5.908
222 HB2 HIS 31 1HB HIS 31 1.816 -5.126 -7.357
223 HB3 HIS 31 2HB HIS 31 1.304 -4.028 -6.079
224 HD1 HIS 31 HD1 HIS 31 4.096 -4.690 -8.456
225 HD2 HIS 31 HD2 HIS 31 3.142 -1.997 -5.440
226 HE1 HIS 31 HE1 HIS 31 5.769 -2.824 -8.667
227 H GLN 32 H GLN 32 2.309 -4.320 -3.263
228 HA GLN 32 HA GLN 32 4.827 -3.130 -3.078
229 HB2 GLN 32 1HB GLN 32 2.785 -3.792 -0.958
230 HB3 GLN 32 2HB GLN 32 4.245 -2.869 -0.626
231 HG2 GLN 32 1HG GLN 32 3.317 -1.452 -2.686
232 HG3 GLN 32 2HG GLN 32 1.792 -2.089 -2.073
233 HE21 GLN 32 1HE2 GLN 32 0.835 -0.599 -0.897
234 HE22 GLN 32 2HE2 GLN 32 1.593 0.415 0.278
235 H VAL 33 H VAL 33 3.841 -6.346 -2.428
236 HA VAL 33 HA VAL 33 5.512 -7.239 -0.451
237 HB VAL 33 HB VAL 33 4.928 -8.705 -3.028
238 HG11 VAL 33 1HG1 VAL 33 6.335 -10.212 -2.162
239 HG12 VAL 33 2HG1 VAL 33 6.340 -9.431 -0.579
240 HG13 VAL 33 3HG1 VAL 33 5.047 -10.554 -1.007
241 HG21 VAL 33 3HG2 VAL 33 3.024 -9.662 -1.848
242 HG22 VAL 33 1HG2 VAL 33 3.402 -8.690 -0.426
243 HG23 VAL 33 2HG2 VAL 33 2.891 -7.905 -1.920
244 H ILE 34 H ILE 34 6.320 -6.619 -3.834
245 HA ILE 34 HA ILE 34 8.853 -7.711 -3.962
246 HB ILE 34 HB ILE 34 9.346 -6.163 -5.747
247 HG12 ILE 34 1HG1 ILE 34 6.984 -4.610 -4.678
248 HG13 ILE 34 2HG1 ILE 34 8.657 -4.072 -4.779
249 HG21 ILE 34 1HG2 ILE 34 6.992 -6.321 -6.947
250 HG22 ILE 34 2HG2 ILE 34 7.983 -7.749 -6.653
251 HG23 ILE 34 3HG2 ILE 34 6.640 -7.371 -5.575
252 HD11 ILE 34 3HD1 ILE 34 7.796 -3.004 -6.585
253 HD12 ILE 34 1HD1 ILE 34 8.268 -4.522 -7.350
254 HD13 ILE 34 2HD1 ILE 34 6.587 -4.251 -6.889
255 H HIS 35 H HIS 35 7.801 -4.730 -2.458
256 HA HIS 35 HA HIS 35 10.527 -3.870 -1.935
257 HB2 HIS 35 1HB HIS 35 7.934 -2.644 -0.977
258 HB3 HIS 35 2HB HIS 35 9.527 -1.895 -0.948
259 HD1 HIS 35 HD1 HIS 35 10.609 -1.651 -3.497
260 HD2 HIS 35 HD2 HIS 35 6.480 -1.945 -3.142
261 HE1 HIS 35 HE1 HIS 35 9.683 -0.752 -5.656
262 H THR 36 H THR 36 8.070 -5.707 -0.417
263 HA THR 36 HA THR 36 9.025 -5.288 2.279
264 HB THR 36 HB THR 36 7.340 -6.835 2.982
265 HG1 THR 36 HG1 THR 36 6.222 -8.128 1.502
266 HG21 THR 36 3HG2 THR 36 5.748 -5.315 2.640
267 HG22 THR 36 1HG2 THR 36 5.599 -5.799 0.951
268 HG23 THR 36 2HG2 THR 36 6.771 -4.565 1.414
269 H GLY 37 H GLY 37 10.738 -6.280 3.107
270 HA2 GLY 37 1HA GLY 37 11.407 -8.763 3.521
271 HA3 GLY 37 2HA GLY 37 11.734 -8.711 1.795
272 H GLU 38 H GLU 38 12.830 -7.826 4.946
273 HA GLU 38 HA GLU 38 15.236 -6.600 3.767
274 HB2 GLU 38 1HB GLU 38 13.682 -5.323 5.448
275 HB3 GLU 38 2HB GLU 38 14.509 -6.297 6.656
276 HG2 GLU 38 1HG GLU 38 16.671 -5.427 5.768
277 HG3 GLU 38 2HG GLU 38 15.743 -4.334 4.743
278 H LYS 39 H LYS 39 14.304 -8.400 6.706
279 HA LYS 39 HA LYS 39 16.947 -9.623 6.786
280 HB2 LYS 39 1HB LYS 39 15.730 -8.684 8.827
281 HB3 LYS 39 2HB LYS 39 14.684 -10.094 8.721
282 HG2 LYS 39 1HG LYS 39 16.211 -10.879 10.202
283 HG3 LYS 39 2HG LYS 39 17.003 -11.364 8.700
284 HD2 LYS 39 1HD LYS 39 17.608 -8.648 9.711
285 HD3 LYS 39 2HD LYS 39 18.253 -10.003 10.640
286 HE2 LYS 39 1HE LYS 39 19.219 -10.901 8.525
287 HE3 LYS 39 2HE LYS 39 18.692 -9.428 7.712
288 HZ1 LYS 39 3HZ LYS 39 20.151 -8.132 9.006
289 HZ2 LYS 39 1HZ LYS 39 21.062 -9.463 8.495
290 HZ3 LYS 39 2HZ LYS 39 20.473 -9.399 10.079
291 H ARG 40 H ARG 40 17.361 -11.777 6.512
292 HA ARG 40 HA ARG 40 17.061 -13.951 5.895
293 HB2 ARG 40 1HB ARG 40 15.145 -13.749 7.615
294 HB3 ARG 40 2HB ARG 40 14.089 -13.625 6.214
295 HG2 ARG 40 1HG ARG 40 13.992 -15.869 6.640
296 HG3 ARG 40 2HG ARG 40 15.312 -15.811 5.470
297 HD2 ARG 40 1HD ARG 40 16.163 -17.175 7.142
298 HD3 ARG 40 2HD ARG 40 16.833 -15.594 7.546
299 HE ARG 40 HE ARG 40 15.509 -15.535 9.437
300 HH11 ARG 40 1HH1 ARG 40 14.627 -18.240 7.430
301 HH12 ARG 40 2HH1 ARG 40 13.639 -18.984 8.643
302 HH21 ARG 40 1HH2 ARG 40 14.211 -16.506 11.042
303 HH22 ARG 40 2HH2 ARG 40 13.401 -17.997 10.696
304 H SER 41 H SER 41 17.189 -11.917 3.965
305 HA SER 41 HA SER 41 15.411 -11.634 1.996
306 HB2 SER 41 1HB SER 41 17.728 -10.801 1.861
307 HB3 SER 41 2HB SER 41 18.293 -12.437 1.521
308 HG SER 41 HG SER 41 16.699 -12.280 -0.309
309 H GLY 42 H GLY 42 14.079 -12.933 0.934
310 HA2 GLY 42 1HA GLY 42 13.163 -14.827 0.011
311 HA3 GLY 42 2HA GLY 42 14.791 -15.145 -0.570
312 HA PRO 43 HA PRO 43 13.947 -17.520 3.609
313 HB2 PRO 43 1HB PRO 43 11.361 -18.315 3.837
314 HB3 PRO 43 2HB PRO 43 11.966 -16.804 4.527
315 HG2 PRO 43 1HG PRO 43 10.469 -17.255 1.974
316 HG3 PRO 43 2HG PRO 43 10.252 -15.981 3.188
317 HD2 PRO 43 1HD PRO 43 11.597 -15.574 0.873
318 HD3 PRO 43 2HD PRO 43 12.017 -14.738 2.381
319 H SER 44 H SER 44 12.226 -18.131 0.600
320 HA SER 44 HA SER 44 12.454 -21.006 0.885
321 HB2 SER 44 1HB SER 44 11.311 -21.102 -1.282
322 HB3 SER 44 2HB SER 44 10.457 -20.022 -0.180
323 HG SER 44 HG SER 44 10.631 -18.662 -1.777
324 H SER 45 H SER 45 13.656 -22.359 -0.493
325 HA SER 45 HA SER 45 15.949 -21.022 -1.775
326 HB2 SER 45 1HB SER 45 16.703 -22.319 0.107
327 HB3 SER 45 2HB SER 45 15.768 -23.719 -0.417
328 HG SER 45 HG SER 45 18.186 -23.473 -0.934
329 H GLY 46 H GLY 46 15.646 -20.974 -3.908
330 HA2 GLY 46 1HA GLY 46 14.319 -23.248 -5.212
331 HA3 GLY 46 2HA GLY 46 14.540 -21.651 -5.911
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -30.011 -1.102 0.033
2 HA2 GLY 1 1HA GLY 1 -29.827 0.718 -1.579
3 HA3 GLY 1 2HA GLY 1 -30.496 1.785 -0.353
4 H SER 2 H SER 2 -28.421 2.890 -1.254
5 HA SER 2 HA SER 2 -26.264 2.279 0.647
6 HB2 SER 2 1HB SER 2 -25.908 1.599 -1.884
7 HB3 SER 2 2HB SER 2 -25.552 3.316 -2.066
8 HG SER 2 HG SER 2 -23.894 3.110 -0.591
9 H SER 3 H SER 3 -24.919 4.089 1.200
10 HA SER 3 HA SER 3 -26.218 6.689 0.707
11 HB2 SER 3 1HB SER 3 -26.485 5.801 3.049
12 HB3 SER 3 2HB SER 3 -24.733 5.904 3.223
13 HG SER 3 HG SER 3 -24.836 8.078 3.124
14 H GLY 4 H GLY 4 -24.948 7.656 -0.765
15 HA2 GLY 4 1HA GLY 4 -22.586 8.884 -0.197
16 HA3 GLY 4 2HA GLY 4 -22.090 7.306 -0.790
17 H SER 5 H SER 5 -21.195 9.379 -2.183
18 HA SER 5 HA SER 5 -22.696 9.166 -4.683
19 HB2 SER 5 1HB SER 5 -22.090 11.703 -3.214
20 HB3 SER 5 2HB SER 5 -22.071 11.713 -4.978
21 HG SER 5 HG SER 5 -24.186 11.587 -3.255
22 H SER 6 H SER 6 -21.313 10.446 -6.443
23 HA SER 6 HA SER 6 -19.160 9.049 -7.158
24 HB2 SER 6 1HB SER 6 -19.512 12.038 -7.447
25 HB3 SER 6 2HB SER 6 -18.262 11.121 -8.287
26 HG SER 6 HG SER 6 -21.043 10.583 -8.469
27 H GLY 7 H GLY 7 -16.984 8.907 -6.756
28 HA2 GLY 7 1HA GLY 7 -15.389 10.682 -5.347
29 HA3 GLY 7 2HA GLY 7 -16.099 9.611 -4.148
30 H THR 8 H THR 8 -16.137 7.223 -5.575
31 HA THR 8 HA THR 8 -13.531 6.274 -5.147
32 HB THR 8 HB THR 8 -14.270 4.188 -6.197
33 HG1 THR 8 HG1 THR 8 -16.757 5.426 -6.759
34 HG21 THR 8 3HG2 THR 8 -16.752 4.615 -4.836
35 HG22 THR 8 1HG2 THR 8 -15.463 5.452 -3.973
36 HG23 THR 8 2HG2 THR 8 -15.331 3.723 -4.295
37 H LYS 9 H LYS 9 -11.946 7.285 -6.299
38 HA LYS 9 HA LYS 9 -12.170 7.744 -9.128
39 HB2 LYS 9 1HB LYS 9 -10.139 8.264 -7.019
40 HB3 LYS 9 2HB LYS 9 -9.564 8.161 -8.677
41 HG2 LYS 9 1HG LYS 9 -11.922 9.878 -8.157
42 HG3 LYS 9 2HG LYS 9 -10.351 10.442 -7.581
43 HD2 LYS 9 1HD LYS 9 -10.304 11.324 -9.683
44 HD3 LYS 9 2HD LYS 9 -9.625 9.733 -10.035
45 HE2 LYS 9 1HE LYS 9 -11.345 10.322 -11.656
46 HE3 LYS 9 2HE LYS 9 -11.843 8.934 -10.689
47 HZ1 LYS 9 3HZ LYS 9 -13.389 11.050 -11.128
48 HZ2 LYS 9 1HZ LYS 9 -12.654 11.533 -9.682
49 HZ3 LYS 9 2HZ LYS 9 -13.516 10.080 -9.748
50 H GLU 10 H GLU 10 -10.113 7.043 -10.461
51 HA GLU 10 HA GLU 10 -10.078 4.130 -10.341
52 HB2 GLU 10 1HB GLU 10 -9.627 4.137 -12.586
53 HB3 GLU 10 2HB GLU 10 -10.448 5.686 -12.451
54 HG2 GLU 10 1HG GLU 10 -8.168 6.732 -12.191
55 HG3 GLU 10 2HG GLU 10 -7.498 5.170 -12.656
56 H LYS 11 H LYS 11 -8.292 2.909 -9.982
57 HA LYS 11 HA LYS 11 -6.336 2.505 -8.809
58 HB2 LYS 11 1HB LYS 11 -5.266 4.130 -11.121
59 HB3 LYS 11 2HB LYS 11 -4.410 2.883 -10.223
60 HG2 LYS 11 1HG LYS 11 -6.458 1.415 -11.049
61 HG3 LYS 11 2HG LYS 11 -6.476 2.629 -12.330
62 HD2 LYS 11 1HD LYS 11 -3.980 2.174 -12.572
63 HD3 LYS 11 2HD LYS 11 -4.255 0.751 -11.564
64 HE2 LYS 11 1HE LYS 11 -4.533 -0.194 -13.618
65 HE3 LYS 11 2HE LYS 11 -6.189 0.335 -13.324
66 HZ1 LYS 11 3HZ LYS 11 -4.148 1.789 -14.919
67 HZ2 LYS 11 1HZ LYS 11 -5.714 2.347 -14.601
68 HZ3 LYS 11 2HZ LYS 11 -5.486 0.954 -15.532
69 HA PRO 12 HA PRO 12 -6.020 6.933 -7.152
70 HB2 PRO 12 1HB PRO 12 -7.303 6.507 -4.798
71 HB3 PRO 12 2HB PRO 12 -8.139 7.020 -6.268
72 HG2 PRO 12 1HG PRO 12 -7.898 4.281 -5.083
73 HG3 PRO 12 2HG PRO 12 -9.319 5.074 -5.788
74 HD2 PRO 12 1HD PRO 12 -7.839 3.260 -7.148
75 HD3 PRO 12 2HD PRO 12 -8.660 4.615 -7.948
76 H TYR 13 H TYR 13 -5.669 3.739 -5.709
77 HA TYR 13 HA TYR 13 -3.883 4.579 -3.641
78 HB2 TYR 13 1HB TYR 13 -4.693 1.904 -4.753
79 HB3 TYR 13 2HB TYR 13 -3.404 2.039 -3.562
80 HD1 TYR 13 HD1 TYR 13 -6.437 4.150 -3.641
81 HD2 TYR 13 HD2 TYR 13 -4.455 0.881 -1.774
82 HE1 TYR 13 HE1 TYR 13 -8.111 4.172 -1.839
83 HE2 TYR 13 HE2 TYR 13 -6.124 0.893 0.033
84 HH TYR 13 HH TYR 13 -8.194 3.420 0.605
85 H LYS 14 H LYS 14 -1.897 5.288 -4.002
86 HA LYS 14 HA LYS 14 -0.372 4.149 -6.250
87 HB2 LYS 14 1HB LYS 14 -0.599 6.467 -6.630
88 HB3 LYS 14 2HB LYS 14 -0.306 6.858 -4.941
89 HG2 LYS 14 1HG LYS 14 1.992 6.483 -5.131
90 HG3 LYS 14 2HG LYS 14 1.811 5.590 -6.643
91 HD2 LYS 14 1HD LYS 14 1.352 7.554 -7.865
92 HD3 LYS 14 2HD LYS 14 1.073 8.496 -6.398
93 HE2 LYS 14 1HE LYS 14 3.569 7.816 -5.897
94 HE3 LYS 14 2HE LYS 14 3.634 7.627 -7.649
95 HZ1 LYS 14 3HZ LYS 14 4.297 9.841 -7.046
96 HZ2 LYS 14 1HZ LYS 14 2.870 10.086 -6.169
97 HZ3 LYS 14 2HZ LYS 14 2.811 9.918 -7.851
98 H CYS 15 H CYS 15 1.451 3.060 -5.847
99 HA CYS 15 HA CYS 15 2.165 2.400 -3.174
100 HB2 CYS 15 1HB CYS 15 2.437 0.854 -5.100
101 HB3 CYS 15 2HB CYS 15 3.715 1.892 -5.722
102 H TYR 16 H TYR 16 3.097 3.842 -1.874
103 HA TYR 16 HA TYR 16 4.668 6.023 -2.771
104 HB2 TYR 16 1HB TYR 16 4.642 4.883 0.024
105 HB3 TYR 16 2HB TYR 16 5.001 6.537 -0.459
106 HD1 TYR 16 HD1 TYR 16 2.752 6.995 -2.375
107 HD2 TYR 16 HD2 TYR 16 2.813 5.166 1.466
108 HE1 TYR 16 HE1 TYR 16 0.390 7.603 -2.055
109 HE2 TYR 16 HE2 TYR 16 0.452 5.768 1.796
110 HH TYR 16 HH TYR 16 -1.269 6.975 1.002
111 H GLU 17 H GLU 17 5.393 2.763 -2.419
112 HA GLU 17 HA GLU 17 8.122 2.994 -1.591
113 HB2 GLU 17 1HB GLU 17 6.930 0.673 -3.097
114 HB3 GLU 17 2HB GLU 17 8.284 0.659 -1.976
115 HG2 GLU 17 1HG GLU 17 6.508 1.467 -0.253
116 HG3 GLU 17 2HG GLU 17 5.362 0.796 -1.412
117 H CYS 18 H CYS 18 6.540 2.351 -4.714
118 HA CYS 18 HA CYS 18 9.032 3.198 -6.042
119 HB2 CYS 18 1HB CYS 18 8.500 1.721 -7.882
120 HB3 CYS 18 2HB CYS 18 8.468 0.798 -6.382
121 H GLY 19 H GLY 19 5.511 3.321 -6.067
122 HA2 GLY 19 1HA GLY 19 4.594 5.574 -6.562
123 HA3 GLY 19 2HA GLY 19 5.693 5.606 -7.934
124 H LYS 20 H LYS 20 4.347 2.547 -7.378
125 HA LYS 20 HA LYS 20 2.997 2.511 -9.859
126 HB2 LYS 20 1HB LYS 20 3.096 0.644 -7.509
127 HB3 LYS 20 2HB LYS 20 2.002 0.333 -8.850
128 HG2 LYS 20 1HG LYS 20 4.841 0.878 -9.500
129 HG3 LYS 20 2HG LYS 20 4.450 -0.672 -8.751
130 HD2 LYS 20 1HD LYS 20 2.771 0.236 -11.029
131 HD3 LYS 20 2HD LYS 20 4.405 -0.330 -11.382
132 HE2 LYS 20 1HE LYS 20 3.921 -2.428 -10.211
133 HE3 LYS 20 2HE LYS 20 2.287 -1.860 -9.872
134 HZ1 LYS 20 3HZ LYS 20 1.710 -2.779 -11.792
135 HZ2 LYS 20 1HZ LYS 20 3.317 -3.067 -12.233
136 HZ3 LYS 20 2HZ LYS 20 2.599 -1.577 -12.584
137 H ALA 21 H ALA 21 0.607 1.414 -9.687
138 HA ALA 21 HA ALA 21 -1.039 3.015 -7.871
139 HB1 ALA 21 3HB ALA 21 -2.553 3.605 -9.770
140 HB2 ALA 21 1HB ALA 21 -0.973 4.387 -9.822
141 HB3 ALA 21 2HB ALA 21 -1.311 3.010 -10.871
142 H PHE 22 H PHE 22 -3.238 2.244 -7.681
143 HA PHE 22 HA PHE 22 -4.007 -0.233 -8.900
144 HB2 PHE 22 1HB PHE 22 -3.518 -0.288 -5.919
145 HB3 PHE 22 2HB PHE 22 -4.020 -1.628 -6.945
146 HD1 PHE 22 HD1 PHE 22 -1.221 0.500 -5.928
147 HD2 PHE 22 HD2 PHE 22 -2.434 -2.809 -8.314
148 HE1 PHE 22 HE1 PHE 22 1.136 -0.127 -6.250
149 HE2 PHE 22 HE2 PHE 22 -0.079 -3.442 -8.640
150 HZ PHE 22 HZ PHE 22 1.710 -2.101 -7.607
151 H ARG 23 H ARG 23 -6.185 -0.678 -8.647
152 HA ARG 23 HA ARG 23 -7.870 1.489 -8.048
153 HB2 ARG 23 1HB ARG 23 -8.568 -1.445 -8.273
154 HB3 ARG 23 2HB ARG 23 -9.715 -0.113 -8.329
155 HG2 ARG 23 1HG ARG 23 -8.194 0.691 -10.313
156 HG3 ARG 23 2HG ARG 23 -7.755 -1.018 -10.372
157 HD2 ARG 23 1HD ARG 23 -9.902 -1.685 -10.914
158 HD3 ARG 23 2HD ARG 23 -10.633 -0.228 -10.243
159 HE ARG 23 HE ARG 23 -10.266 0.856 -12.243
160 HH11 ARG 23 1HH1 ARG 23 -8.608 -2.206 -12.223
161 HH12 ARG 23 2HH1 ARG 23 -8.235 -2.163 -13.914
162 HH21 ARG 23 1HH2 ARG 23 -9.781 0.924 -14.471
163 HH22 ARG 23 2HH2 ARG 23 -8.901 -0.382 -15.192
164 H THR 24 H THR 24 -7.443 -1.592 -6.302
165 HA THR 24 HA THR 24 -8.558 -0.292 -3.907
166 HB THR 24 HB THR 24 -9.292 -2.382 -3.118
167 HG1 THR 24 HG1 THR 24 -7.597 -3.518 -5.106
168 HG21 THR 24 3HG2 THR 24 -9.678 -2.142 -6.088
169 HG22 THR 24 1HG2 THR 24 -10.805 -1.740 -4.794
170 HG23 THR 24 2HG2 THR 24 -10.446 -3.428 -5.157
171 H ARG 25 H ARG 25 -7.699 -1.738 -1.879
172 HA ARG 25 HA ARG 25 -4.910 -1.058 -1.708
173 HB2 ARG 25 1HB ARG 25 -6.832 -0.991 0.120
174 HB3 ARG 25 2HB ARG 25 -6.277 -2.632 0.424
175 HG2 ARG 25 1HG ARG 25 -4.442 -0.251 0.406
176 HG3 ARG 25 2HG ARG 25 -5.248 -0.851 1.857
177 HD2 ARG 25 1HD ARG 25 -4.128 -2.954 1.695
178 HD3 ARG 25 2HD ARG 25 -3.488 -2.552 0.102
179 HE ARG 25 HE ARG 25 -1.793 -1.407 1.120
180 HH11 ARG 25 1HH1 ARG 25 -4.357 -1.907 3.421
181 HH12 ARG 25 2HH1 ARG 25 -3.450 -1.294 4.763
182 HH21 ARG 25 1HH2 ARG 25 -0.587 -0.597 2.879
183 HH22 ARG 25 2HH2 ARG 25 -1.306 -0.548 4.453
184 H SER 26 H SER 26 -6.748 -4.084 -1.274
185 HA SER 26 HA SER 26 -4.717 -5.861 -0.889
186 HB2 SER 26 1HB SER 26 -7.164 -6.405 -0.933
187 HB3 SER 26 2HB SER 26 -7.087 -6.392 -2.695
188 HG SER 26 HG SER 26 -6.624 -8.424 -1.169
189 H ASN 27 H ASN 27 -5.745 -4.437 -3.942
190 HA ASN 27 HA ASN 27 -4.057 -6.037 -5.585
191 HB2 ASN 27 1HB ASN 27 -6.152 -4.586 -6.205
192 HB3 ASN 27 2HB ASN 27 -4.966 -3.298 -6.397
193 HD21 ASN 27 1HD2 ASN 27 -2.845 -4.550 -7.480
194 HD22 ASN 27 2HD2 ASN 27 -3.252 -5.209 -9.025
195 H LEU 28 H LEU 28 -3.657 -3.043 -3.836
196 HA LEU 28 HA LEU 28 -1.222 -2.283 -5.144
197 HB2 LEU 28 1HB LEU 28 -2.187 -0.430 -4.258
198 HB3 LEU 28 2HB LEU 28 -2.852 -1.303 -2.879
199 HG LEU 28 HG LEU 28 -0.582 -1.313 -1.864
200 HD11 LEU 28 1HD1 LEU 28 1.187 -0.031 -2.758
201 HD12 LEU 28 2HD1 LEU 28 0.148 0.681 -3.993
202 HD13 LEU 28 3HD1 LEU 28 0.587 -1.025 -4.086
203 HD21 LEU 28 3HD2 LEU 28 -2.133 0.338 -1.119
204 HD22 LEU 28 1HD2 LEU 28 -1.840 1.339 -2.542
205 HD23 LEU 28 2HD2 LEU 28 -0.572 1.133 -1.334
206 H THR 29 H THR 29 -1.937 -3.448 -1.848
207 HA THR 29 HA THR 29 0.656 -3.752 -0.947
208 HB THR 29 HB THR 29 -1.829 -5.327 -0.286
209 HG1 THR 29 HG1 THR 29 -1.658 -4.050 1.634
210 HG21 THR 29 3HG2 THR 29 0.001 -5.612 1.810
211 HG22 THR 29 1HG2 THR 29 0.913 -5.971 0.345
212 HG23 THR 29 2HG2 THR 29 -0.560 -6.870 0.709
213 H THR 30 H THR 30 -1.365 -6.158 -2.616
214 HA THR 30 HA THR 30 0.251 -8.350 -2.598
215 HB THR 30 HB THR 30 -1.541 -7.285 -4.765
216 HG1 THR 30 HG1 THR 30 -1.665 -9.524 -3.001
217 HG21 THR 30 3HG2 THR 30 -1.303 -9.529 -5.854
218 HG22 THR 30 1HG2 THR 30 0.092 -9.822 -4.817
219 HG23 THR 30 2HG2 THR 30 0.123 -8.501 -5.986
220 H HIS 31 H HIS 31 0.769 -5.378 -4.317
221 HA HIS 31 HA HIS 31 2.959 -6.521 -5.874
222 HB2 HIS 31 1HB HIS 31 1.884 -5.078 -7.290
223 HB3 HIS 31 2HB HIS 31 1.367 -4.013 -5.986
224 HD1 HIS 31 HD1 HIS 31 4.228 -4.658 -8.310
225 HD2 HIS 31 HD2 HIS 31 3.134 -1.942 -5.362
226 HE1 HIS 31 HE1 HIS 31 5.878 -2.769 -8.490
227 H GLN 32 H GLN 32 2.368 -4.257 -3.248
228 HA GLN 32 HA GLN 32 4.894 -3.120 -3.016
229 HB2 GLN 32 1HB GLN 32 2.827 -3.769 -0.916
230 HB3 GLN 32 2HB GLN 32 4.290 -2.855 -0.570
231 HG2 GLN 32 1HG GLN 32 3.404 -1.418 -2.621
232 HG3 GLN 32 2HG GLN 32 1.862 -2.064 -2.062
233 HE21 GLN 32 1HE2 GLN 32 0.882 -0.533 -0.951
234 HE22 GLN 32 2HE2 GLN 32 1.598 0.446 0.279
235 H VAL 33 H VAL 33 3.929 -6.339 -2.494
236 HA VAL 33 HA VAL 33 5.586 -7.232 -0.466
237 HB VAL 33 HB VAL 33 4.956 -8.732 -3.012
238 HG11 VAL 33 1HG1 VAL 33 5.783 -9.654 -0.264
239 HG12 VAL 33 2HG1 VAL 33 5.172 -10.723 -1.528
240 HG13 VAL 33 3HG1 VAL 33 6.680 -9.841 -1.771
241 HG21 VAL 33 3HG2 VAL 33 2.854 -8.161 -2.232
242 HG22 VAL 33 1HG2 VAL 33 3.136 -9.705 -1.427
243 HG23 VAL 33 2HG2 VAL 33 3.357 -8.195 -0.542
244 H ILE 34 H ILE 34 6.350 -6.541 -3.829
245 HA ILE 34 HA ILE 34 8.862 -7.722 -4.009
246 HB ILE 34 HB ILE 34 9.337 -6.222 -5.827
247 HG12 ILE 34 1HG1 ILE 34 7.054 -4.573 -4.727
248 HG13 ILE 34 2HG1 ILE 34 8.745 -4.099 -4.850
249 HG21 ILE 34 1HG2 ILE 34 6.992 -6.322 -6.999
250 HG22 ILE 34 2HG2 ILE 34 7.879 -7.800 -6.628
251 HG23 ILE 34 3HG2 ILE 34 6.562 -7.275 -5.579
252 HD11 ILE 34 3HD1 ILE 34 7.756 -2.991 -6.615
253 HD12 ILE 34 1HD1 ILE 34 8.415 -4.436 -7.383
254 HD13 ILE 34 2HD1 ILE 34 6.694 -4.345 -7.004
255 H HIS 35 H HIS 35 7.863 -4.774 -2.439
256 HA HIS 35 HA HIS 35 10.608 -3.910 -2.005
257 HB2 HIS 35 1HB HIS 35 8.038 -2.679 -0.991
258 HB3 HIS 35 2HB HIS 35 9.635 -1.938 -0.972
259 HD1 HIS 35 HD1 HIS 35 10.691 -1.674 -3.530
260 HD2 HIS 35 HD2 HIS 35 6.564 -1.950 -3.133
261 HE1 HIS 35 HE1 HIS 35 9.746 -0.748 -5.670
262 H THR 36 H THR 36 8.276 -5.845 -0.481
263 HA THR 36 HA THR 36 9.314 -5.420 2.204
264 HB THR 36 HB THR 36 7.605 -6.918 2.971
265 HG1 THR 36 HG1 THR 36 6.690 -8.373 1.701
266 HG21 THR 36 3HG2 THR 36 5.772 -5.611 2.531
267 HG22 THR 36 1HG2 THR 36 6.119 -5.513 0.806
268 HG23 THR 36 2HG2 THR 36 7.048 -4.542 1.949
269 H GLY 37 H GLY 37 10.502 -6.893 3.374
270 HA2 GLY 37 1HA GLY 37 12.274 -8.567 1.965
271 HA3 GLY 37 2HA GLY 37 12.053 -8.552 3.708
272 H GLU 38 H GLU 38 11.635 -10.318 0.874
273 HA GLU 38 HA GLU 38 9.581 -12.055 2.022
274 HB2 GLU 38 1HB GLU 38 9.563 -13.147 -0.185
275 HB3 GLU 38 2HB GLU 38 9.273 -11.417 -0.304
276 HG2 GLU 38 1HG GLU 38 11.591 -11.066 -0.974
277 HG3 GLU 38 2HG GLU 38 11.893 -12.798 -0.843
278 H LYS 39 H LYS 39 12.020 -12.070 3.370
279 HA LYS 39 HA LYS 39 12.645 -14.864 3.272
280 HB2 LYS 39 1HB LYS 39 14.115 -14.200 1.492
281 HB3 LYS 39 2HB LYS 39 14.725 -12.844 2.430
282 HG2 LYS 39 1HG LYS 39 16.434 -14.292 2.755
283 HG3 LYS 39 2HG LYS 39 15.403 -14.794 4.097
284 HD2 LYS 39 1HD LYS 39 14.983 -16.095 1.458
285 HD3 LYS 39 2HD LYS 39 16.424 -16.538 2.376
286 HE2 LYS 39 1HE LYS 39 14.974 -18.064 3.238
287 HE3 LYS 39 2HE LYS 39 14.645 -16.726 4.338
288 HZ1 LYS 39 3HZ LYS 39 13.008 -16.408 2.104
289 HZ2 LYS 39 1HZ LYS 39 12.545 -16.780 3.688
290 HZ3 LYS 39 2HZ LYS 39 12.874 -18.023 2.589
291 H ARG 40 H ARG 40 13.325 -15.581 5.222
292 HA ARG 40 HA ARG 40 13.388 -13.686 7.393
293 HB2 ARG 40 1HB ARG 40 12.390 -16.114 7.324
294 HB3 ARG 40 2HB ARG 40 14.033 -16.589 7.731
295 HG2 ARG 40 1HG ARG 40 13.971 -15.413 9.777
296 HG3 ARG 40 2HG ARG 40 12.489 -14.567 9.326
297 HD2 ARG 40 1HD ARG 40 11.222 -16.603 9.449
298 HD3 ARG 40 2HD ARG 40 12.688 -17.551 9.696
299 HE ARG 40 HE ARG 40 12.663 -16.960 11.912
300 HH11 ARG 40 1HH1 ARG 40 10.458 -14.925 10.146
301 HH12 ARG 40 2HH1 ARG 40 9.771 -14.213 11.568
302 HH21 ARG 40 1HH2 ARG 40 11.766 -16.030 13.792
303 HH22 ARG 40 2HH2 ARG 40 10.516 -14.841 13.641
304 H SER 41 H SER 41 15.498 -13.197 5.678
305 HA SER 41 HA SER 41 17.789 -13.904 7.382
306 HB2 SER 41 1HB SER 41 17.819 -13.806 4.355
307 HB3 SER 41 2HB SER 41 19.212 -14.114 5.391
308 HG SER 41 HG SER 41 16.889 -15.723 5.128
309 H GLY 42 H GLY 42 17.580 -11.864 8.386
310 HA2 GLY 42 1HA GLY 42 18.651 -9.671 6.743
311 HA3 GLY 42 2HA GLY 42 17.218 -9.392 7.720
312 HA PRO 43 HA PRO 43 21.396 -9.335 10.198
313 HB2 PRO 43 1HB PRO 43 22.607 -7.030 9.430
314 HB3 PRO 43 2HB PRO 43 22.955 -8.593 8.682
315 HG2 PRO 43 1HG PRO 43 21.168 -6.391 7.724
316 HG3 PRO 43 2HG PRO 43 22.319 -7.378 6.804
317 HD2 PRO 43 1HD PRO 43 19.654 -7.858 6.795
318 HD3 PRO 43 2HD PRO 43 20.858 -9.153 6.641
319 H SER 44 H SER 44 19.787 -6.350 9.083
320 HA SER 44 HA SER 44 19.561 -5.499 11.887
321 HB2 SER 44 1HB SER 44 19.340 -3.910 9.320
322 HB3 SER 44 2HB SER 44 19.093 -3.241 10.933
323 HG SER 44 HG SER 44 21.454 -4.644 10.504
324 H SER 45 H SER 45 17.668 -5.534 8.869
325 HA SER 45 HA SER 45 15.435 -5.706 8.471
326 HB2 SER 45 1HB SER 45 15.663 -7.155 11.102
327 HB3 SER 45 2HB SER 45 14.107 -6.960 10.296
328 HG SER 45 HG SER 45 14.890 -8.845 9.528
329 H GLY 46 H GLY 46 16.314 -3.250 9.445
330 HA2 GLY 46 1HA GLY 46 14.951 -2.197 11.631
331 HA3 GLY 46 2HA GLY 46 15.465 -1.268 10.231
Start of MODEL 7
1 H1 GLY 1 H GLY 1 2.733 18.471 -10.395
2 HA2 GLY 1 1HA GLY 1 1.347 20.493 -10.887
3 HA3 GLY 1 2HA GLY 1 0.031 19.368 -11.191
4 H SER 2 H SER 2 -1.412 19.619 -9.618
5 HA SER 2 HA SER 2 -0.535 19.249 -6.861
6 HB2 SER 2 1HB SER 2 -2.171 21.628 -7.773
7 HB3 SER 2 2HB SER 2 -1.905 21.178 -6.088
8 HG SER 2 HG SER 2 -0.407 22.747 -6.728
9 H SER 3 H SER 3 -2.417 18.936 -5.379
10 HA SER 3 HA SER 3 -4.508 17.428 -6.785
11 HB2 SER 3 1HB SER 3 -3.494 17.267 -3.940
12 HB3 SER 3 2HB SER 3 -4.889 16.367 -4.533
13 HG SER 3 HG SER 3 -2.236 15.870 -4.867
14 H GLY 4 H GLY 4 -5.445 19.640 -7.224
15 HA2 GLY 4 1HA GLY 4 -6.684 20.978 -4.977
16 HA3 GLY 4 2HA GLY 4 -6.831 21.424 -6.671
17 H SER 5 H SER 5 -8.205 19.974 -8.022
18 HA SER 5 HA SER 5 -10.627 19.320 -6.522
19 HB2 SER 5 1HB SER 5 -10.136 19.661 -9.489
20 HB3 SER 5 2HB SER 5 -11.696 19.243 -8.782
21 HG SER 5 HG SER 5 -11.515 21.487 -9.131
22 H SER 6 H SER 6 -11.871 17.386 -7.181
23 HA SER 6 HA SER 6 -10.049 15.115 -7.549
24 HB2 SER 6 1HB SER 6 -12.817 15.301 -6.347
25 HB3 SER 6 2HB SER 6 -11.985 13.773 -6.634
26 HG SER 6 HG SER 6 -11.264 14.169 -4.681
27 H GLY 7 H GLY 7 -10.617 13.380 -8.945
28 HA2 GLY 7 1HA GLY 7 -12.683 14.016 -10.949
29 HA3 GLY 7 2HA GLY 7 -11.057 13.595 -11.463
30 H THR 8 H THR 8 -12.425 11.950 -12.644
31 HA THR 8 HA THR 8 -13.886 9.917 -11.699
32 HB THR 8 HB THR 8 -12.837 8.400 -13.355
33 HG1 THR 8 HG1 THR 8 -11.149 9.615 -14.675
34 HG21 THR 8 3HG2 THR 8 -14.523 10.077 -14.042
35 HG22 THR 8 1HG2 THR 8 -13.371 9.709 -15.325
36 HG23 THR 8 2HG2 THR 8 -13.218 11.206 -14.406
37 H LYS 9 H LYS 9 -13.719 8.234 -10.343
38 HA LYS 9 HA LYS 9 -11.312 7.971 -8.764
39 HB2 LYS 9 1HB LYS 9 -13.759 7.860 -7.930
40 HB3 LYS 9 2HB LYS 9 -13.735 6.207 -8.531
41 HG2 LYS 9 1HG LYS 9 -11.606 7.156 -6.662
42 HG3 LYS 9 2HG LYS 9 -13.189 6.673 -6.047
43 HD2 LYS 9 1HD LYS 9 -11.563 4.918 -7.871
44 HD3 LYS 9 2HD LYS 9 -11.382 4.880 -6.115
45 HE2 LYS 9 1HE LYS 9 -12.932 3.214 -6.433
46 HE3 LYS 9 2HE LYS 9 -13.984 4.601 -6.156
47 HZ1 LYS 9 3HZ LYS 9 -14.844 4.381 -8.173
48 HZ2 LYS 9 1HZ LYS 9 -14.005 2.920 -8.333
49 HZ3 LYS 9 2HZ LYS 9 -13.320 4.356 -8.907
50 H GLU 10 H GLU 10 -9.679 6.871 -9.654
51 HA GLU 10 HA GLU 10 -10.074 4.094 -10.333
52 HB2 GLU 10 1HB GLU 10 -9.589 4.134 -12.573
53 HB3 GLU 10 2HB GLU 10 -10.445 5.663 -12.429
54 HG2 GLU 10 1HG GLU 10 -8.378 6.879 -12.368
55 HG3 GLU 10 2HG GLU 10 -7.452 5.380 -12.323
56 H LYS 11 H LYS 11 -8.282 2.893 -9.952
57 HA LYS 11 HA LYS 11 -6.336 2.507 -8.755
58 HB2 LYS 11 1HB LYS 11 -5.269 4.135 -11.068
59 HB3 LYS 11 2HB LYS 11 -4.395 2.916 -10.151
60 HG2 LYS 11 1HG LYS 11 -6.406 1.397 -10.976
61 HG3 LYS 11 2HG LYS 11 -6.440 2.597 -12.270
62 HD2 LYS 11 1HD LYS 11 -3.964 2.195 -12.545
63 HD3 LYS 11 2HD LYS 11 -4.148 0.821 -11.452
64 HE2 LYS 11 1HE LYS 11 -5.446 -0.368 -12.962
65 HE3 LYS 11 2HE LYS 11 -5.911 1.080 -13.855
66 HZ1 LYS 11 3HZ LYS 11 -4.106 0.952 -15.145
67 HZ2 LYS 11 1HZ LYS 11 -4.008 -0.656 -14.628
68 HZ3 LYS 11 2HZ LYS 11 -3.078 0.535 -13.868
69 HA PRO 12 HA PRO 12 -6.073 6.940 -7.101
70 HB2 PRO 12 1HB PRO 12 -7.372 6.504 -4.757
71 HB3 PRO 12 2HB PRO 12 -8.200 7.008 -6.235
72 HG2 PRO 12 1HG PRO 12 -7.945 4.273 -5.045
73 HG3 PRO 12 2HG PRO 12 -9.367 5.053 -5.763
74 HD2 PRO 12 1HD PRO 12 -7.858 3.251 -7.108
75 HD3 PRO 12 2HD PRO 12 -8.684 4.598 -7.917
76 H TYR 13 H TYR 13 -5.627 3.734 -5.753
77 HA TYR 13 HA TYR 13 -3.883 4.600 -3.640
78 HB2 TYR 13 1HB TYR 13 -4.685 1.917 -4.736
79 HB3 TYR 13 2HB TYR 13 -3.393 2.061 -3.550
80 HD1 TYR 13 HD1 TYR 13 -6.416 4.182 -3.616
81 HD2 TYR 13 HD2 TYR 13 -4.453 0.890 -1.768
82 HE1 TYR 13 HE1 TYR 13 -8.084 4.209 -1.809
83 HE2 TYR 13 HE2 TYR 13 -6.116 0.907 0.043
84 HH TYR 13 HH TYR 13 -7.702 2.368 1.072
85 H LYS 14 H LYS 14 -1.896 5.308 -3.999
86 HA LYS 14 HA LYS 14 -0.376 4.190 -6.259
87 HB2 LYS 14 1HB LYS 14 -0.596 6.523 -6.577
88 HB3 LYS 14 2HB LYS 14 -0.267 6.866 -4.883
89 HG2 LYS 14 1HG LYS 14 2.022 6.453 -5.125
90 HG3 LYS 14 2HG LYS 14 1.797 5.621 -6.665
91 HD2 LYS 14 1HD LYS 14 1.436 7.609 -7.825
92 HD3 LYS 14 2HD LYS 14 1.042 8.506 -6.356
93 HE2 LYS 14 1HE LYS 14 3.773 7.343 -6.766
94 HE3 LYS 14 2HE LYS 14 3.335 8.893 -7.482
95 HZ1 LYS 14 3HZ LYS 14 2.511 9.067 -4.877
96 HZ2 LYS 14 1HZ LYS 14 3.891 9.784 -5.542
97 HZ3 LYS 14 2HZ LYS 14 4.004 8.278 -4.781
98 H CYS 15 H CYS 15 1.490 3.139 -5.902
99 HA CYS 15 HA CYS 15 2.191 2.417 -3.226
100 HB2 CYS 15 1HB CYS 15 2.402 0.880 -5.178
101 HB3 CYS 15 2HB CYS 15 3.715 1.884 -5.784
102 H TYR 16 H TYR 16 3.146 3.867 -1.946
103 HA TYR 16 HA TYR 16 4.766 5.998 -2.869
104 HB2 TYR 16 1HB TYR 16 4.768 4.906 -0.059
105 HB3 TYR 16 2HB TYR 16 5.083 6.557 -0.582
106 HD1 TYR 16 HD1 TYR 16 2.819 7.020 -2.422
107 HD2 TYR 16 HD2 TYR 16 2.932 5.091 1.368
108 HE1 TYR 16 HE1 TYR 16 0.451 7.586 -2.070
109 HE2 TYR 16 HE2 TYR 16 0.565 5.650 1.730
110 HH TYR 16 HH TYR 16 -1.245 6.624 0.902
111 H GLU 17 H GLU 17 5.416 2.726 -2.487
112 HA GLU 17 HA GLU 17 8.151 2.901 -1.667
113 HB2 GLU 17 1HB GLU 17 6.878 0.601 -3.142
114 HB3 GLU 17 2HB GLU 17 8.261 0.555 -2.058
115 HG2 GLU 17 1HG GLU 17 6.522 1.447 -0.311
116 HG3 GLU 17 2HG GLU 17 5.361 0.729 -1.428
117 H CYS 18 H CYS 18 6.534 2.317 -4.781
118 HA CYS 18 HA CYS 18 9.048 3.072 -6.122
119 HB2 CYS 18 1HB CYS 18 8.438 1.613 -7.967
120 HB3 CYS 18 2HB CYS 18 8.443 0.695 -6.465
121 H GLY 19 H GLY 19 5.522 3.249 -6.193
122 HA2 GLY 19 1HA GLY 19 4.665 5.540 -6.675
123 HA3 GLY 19 2HA GLY 19 5.766 5.540 -8.045
124 H LYS 20 H LYS 20 4.323 2.524 -7.460
125 HA LYS 20 HA LYS 20 2.948 2.556 -9.947
126 HB2 LYS 20 1HB LYS 20 3.247 0.617 -7.698
127 HB3 LYS 20 2HB LYS 20 1.950 0.355 -8.856
128 HG2 LYS 20 1HG LYS 20 4.752 0.808 -9.794
129 HG3 LYS 20 2HG LYS 20 4.229 -0.785 -9.240
130 HD2 LYS 20 1HD LYS 20 2.303 -0.565 -10.875
131 HD3 LYS 20 2HD LYS 20 3.154 0.831 -11.541
132 HE2 LYS 20 1HE LYS 20 5.149 -0.682 -11.844
133 HE3 LYS 20 2HE LYS 20 4.088 -2.030 -11.438
134 HZ1 LYS 20 3HZ LYS 20 3.878 -2.027 -13.686
135 HZ2 LYS 20 1HZ LYS 20 4.139 -0.362 -13.839
136 HZ3 LYS 20 2HZ LYS 20 2.636 -0.938 -13.320
137 H ALA 21 H ALA 21 0.568 1.488 -9.794
138 HA ALA 21 HA ALA 21 -1.034 3.020 -7.875
139 HB1 ALA 21 3HB ALA 21 -1.447 3.041 -10.861
140 HB2 ALA 21 1HB ALA 21 -2.590 3.685 -9.681
141 HB3 ALA 21 2HB ALA 21 -0.988 4.406 -9.843
142 H PHE 22 H PHE 22 -3.254 2.253 -7.691
143 HA PHE 22 HA PHE 22 -4.008 -0.230 -8.908
144 HB2 PHE 22 1HB PHE 22 -3.497 -0.265 -5.929
145 HB3 PHE 22 2HB PHE 22 -4.030 -1.610 -6.932
146 HD1 PHE 22 HD1 PHE 22 -1.193 0.498 -5.982
147 HD2 PHE 22 HD2 PHE 22 -2.479 -2.825 -8.311
148 HE1 PHE 22 HE1 PHE 22 1.152 -0.158 -6.335
149 HE2 PHE 22 HE2 PHE 22 -0.136 -3.487 -8.666
150 HZ PHE 22 HZ PHE 22 1.683 -2.154 -7.677
151 H ARG 23 H ARG 23 -6.183 -0.689 -8.654
152 HA ARG 23 HA ARG 23 -7.873 1.479 -8.029
153 HB2 ARG 23 1HB ARG 23 -8.626 -1.437 -8.294
154 HB3 ARG 23 2HB ARG 23 -9.712 -0.060 -8.433
155 HG2 ARG 23 1HG ARG 23 -8.202 0.679 -10.373
156 HG3 ARG 23 2HG ARG 23 -7.586 -0.975 -10.331
157 HD2 ARG 23 1HD ARG 23 -9.792 -1.857 -10.719
158 HD3 ARG 23 2HD ARG 23 -10.500 -0.247 -10.592
159 HE ARG 23 HE ARG 23 -8.802 0.081 -12.624
160 HH11 ARG 23 1HH1 ARG 23 -11.118 -2.431 -11.956
161 HH12 ARG 23 2HH1 ARG 23 -11.421 -2.776 -13.627
162 HH21 ARG 23 1HH2 ARG 23 -9.192 -0.364 -14.827
163 HH22 ARG 23 2HH2 ARG 23 -10.324 -1.600 -15.259
164 H THR 24 H THR 24 -7.481 -1.659 -6.377
165 HA THR 24 HA THR 24 -8.662 -0.455 -3.968
166 HB THR 24 HB THR 24 -9.255 -2.622 -3.221
167 HG1 THR 24 HG1 THR 24 -8.358 -4.461 -3.996
168 HG21 THR 24 3HG2 THR 24 -10.424 -3.618 -5.259
169 HG22 THR 24 1HG2 THR 24 -9.708 -2.295 -6.178
170 HG23 THR 24 2HG2 THR 24 -10.819 -1.949 -4.852
171 H ARG 25 H ARG 25 -7.774 -1.795 -1.927
172 HA ARG 25 HA ARG 25 -5.018 -1.020 -1.712
173 HB2 ARG 25 1HB ARG 25 -6.954 -0.994 0.082
174 HB3 ARG 25 2HB ARG 25 -6.393 -2.631 0.394
175 HG2 ARG 25 1HG ARG 25 -4.540 -0.270 0.397
176 HG3 ARG 25 2HG ARG 25 -5.420 -0.793 1.834
177 HD2 ARG 25 1HD ARG 25 -4.388 -3.002 1.664
178 HD3 ARG 25 2HD ARG 25 -3.517 -2.487 0.220
179 HE ARG 25 HE ARG 25 -2.912 -1.795 2.965
180 HH11 ARG 25 1HH1 ARG 25 -2.400 -1.094 -0.406
181 HH12 ARG 25 2HH1 ARG 25 -0.901 -0.266 -0.141
182 HH21 ARG 25 1HH2 ARG 25 -0.940 -0.707 3.328
183 HH22 ARG 25 2HH2 ARG 25 -0.072 -0.047 1.983
184 H SER 26 H SER 26 -6.734 -4.117 -1.277
185 HA SER 26 HA SER 26 -4.636 -5.803 -0.852
186 HB2 SER 26 1HB SER 26 -7.215 -6.259 -1.139
187 HB3 SER 26 2HB SER 26 -6.747 -6.681 -2.787
188 HG SER 26 HG SER 26 -5.203 -7.768 -0.756
189 H ASN 27 H ASN 27 -5.743 -4.542 -3.963
190 HA ASN 27 HA ASN 27 -3.968 -6.056 -5.565
191 HB2 ASN 27 1HB ASN 27 -6.098 -4.601 -6.173
192 HB3 ASN 27 2HB ASN 27 -4.885 -3.354 -6.446
193 HD21 ASN 27 1HD2 ASN 27 -6.382 -6.157 -7.653
194 HD22 ASN 27 2HD2 ASN 27 -5.454 -6.312 -9.103
195 H LEU 28 H LEU 28 -3.665 -3.034 -3.839
196 HA LEU 28 HA LEU 28 -1.241 -2.217 -5.126
197 HB2 LEU 28 1HB LEU 28 -2.348 -0.418 -4.236
198 HB3 LEU 28 2HB LEU 28 -2.850 -1.303 -2.797
199 HG LEU 28 HG LEU 28 -0.618 -1.087 -1.859
200 HD11 LEU 28 1HD1 LEU 28 0.423 -1.024 -4.232
201 HD12 LEU 28 2HD1 LEU 28 1.186 -0.117 -2.926
202 HD13 LEU 28 3HD1 LEU 28 0.175 0.718 -4.105
203 HD21 LEU 28 3HD2 LEU 28 -2.326 0.701 -1.534
204 HD22 LEU 28 1HD2 LEU 28 -1.574 1.590 -2.859
205 HD23 LEU 28 2HD2 LEU 28 -0.658 1.259 -1.388
206 H THR 29 H THR 29 -1.987 -3.555 -1.910
207 HA THR 29 HA THR 29 0.638 -3.751 -0.982
208 HB THR 29 HB THR 29 -1.859 -5.282 -0.300
209 HG1 THR 29 HG1 THR 29 -1.636 -3.125 0.461
210 HG21 THR 29 3HG2 THR 29 -0.204 -5.873 1.757
211 HG22 THR 29 1HG2 THR 29 0.930 -5.925 0.408
212 HG23 THR 29 2HG2 THR 29 -0.503 -6.953 0.396
213 H THR 30 H THR 30 -1.368 -6.219 -2.585
214 HA THR 30 HA THR 30 0.270 -8.380 -2.585
215 HB THR 30 HB THR 30 -1.515 -7.337 -4.771
216 HG1 THR 30 HG1 THR 30 -1.946 -9.789 -3.559
217 HG21 THR 30 3HG2 THR 30 0.203 -8.589 -5.921
218 HG22 THR 30 1HG2 THR 30 -1.271 -9.553 -5.865
219 HG23 THR 30 2HG2 THR 30 0.061 -9.914 -4.766
220 H HIS 31 H HIS 31 0.761 -5.410 -4.320
221 HA HIS 31 HA HIS 31 2.959 -6.538 -5.874
222 HB2 HIS 31 1HB HIS 31 1.879 -5.095 -7.285
223 HB3 HIS 31 2HB HIS 31 1.355 -4.038 -5.978
224 HD1 HIS 31 HD1 HIS 31 4.201 -4.642 -8.323
225 HD2 HIS 31 HD2 HIS 31 3.130 -1.974 -5.324
226 HE1 HIS 31 HE1 HIS 31 5.846 -2.747 -8.490
227 H GLN 32 H GLN 32 2.361 -4.307 -3.225
228 HA GLN 32 HA GLN 32 4.885 -3.154 -2.997
229 HB2 GLN 32 1HB GLN 32 2.802 -3.803 -0.916
230 HB3 GLN 32 2HB GLN 32 4.275 -2.919 -0.540
231 HG2 GLN 32 1HG GLN 32 3.437 -1.438 -2.580
232 HG3 GLN 32 2HG GLN 32 1.878 -2.068 -2.051
233 HE21 GLN 32 1HE2 GLN 32 0.958 -0.396 -1.060
234 HE22 GLN 32 2HE2 GLN 32 1.652 0.498 0.244
235 H VAL 33 H VAL 33 3.938 -6.377 -2.504
236 HA VAL 33 HA VAL 33 5.604 -7.266 -0.472
237 HB VAL 33 HB VAL 33 4.974 -8.789 -3.003
238 HG11 VAL 33 1HG1 VAL 33 5.015 -10.687 -1.208
239 HG12 VAL 33 2HG1 VAL 33 6.524 -10.090 -1.902
240 HG13 VAL 33 3HG1 VAL 33 6.008 -9.543 -0.306
241 HG21 VAL 33 3HG2 VAL 33 3.105 -9.714 -1.469
242 HG22 VAL 33 1HG2 VAL 33 3.343 -8.223 -0.557
243 HG23 VAL 33 2HG2 VAL 33 2.869 -8.153 -2.255
244 H ILE 34 H ILE 34 6.347 -6.486 -3.805
245 HA ILE 34 HA ILE 34 8.862 -7.703 -4.005
246 HB ILE 34 HB ILE 34 9.308 -6.236 -5.854
247 HG12 ILE 34 1HG1 ILE 34 7.028 -4.576 -4.765
248 HG13 ILE 34 2HG1 ILE 34 8.717 -4.099 -4.905
249 HG21 ILE 34 1HG2 ILE 34 6.962 -6.369 -7.008
250 HG22 ILE 34 2HG2 ILE 34 7.845 -7.840 -6.602
251 HG23 ILE 34 3HG2 ILE 34 6.533 -7.284 -5.563
252 HD11 ILE 34 3HD1 ILE 34 8.361 -4.495 -7.434
253 HD12 ILE 34 1HD1 ILE 34 6.647 -4.375 -7.036
254 HD13 ILE 34 2HD1 ILE 34 7.730 -3.027 -6.688
255 H HIS 35 H HIS 35 7.836 -4.837 -2.359
256 HA HIS 35 HA HIS 35 10.576 -3.897 -2.002
257 HB2 HIS 35 1HB HIS 35 7.992 -2.700 -0.982
258 HB3 HIS 35 2HB HIS 35 9.579 -1.938 -0.952
259 HD1 HIS 35 HD1 HIS 35 10.645 -1.686 -3.520
260 HD2 HIS 35 HD2 HIS 35 6.519 -1.951 -3.114
261 HE1 HIS 35 HE1 HIS 35 9.698 -0.759 -5.657
262 H THR 36 H THR 36 8.329 -5.895 -0.464
263 HA THR 36 HA THR 36 9.366 -5.428 2.217
264 HB THR 36 HB THR 36 7.666 -6.844 3.030
265 HG1 THR 36 HG1 THR 36 7.357 -7.766 0.348
266 HG21 THR 36 3HG2 THR 36 6.459 -4.977 2.515
267 HG22 THR 36 1HG2 THR 36 5.634 -6.128 1.465
268 HG23 THR 36 2HG2 THR 36 6.864 -5.053 0.801
269 H GLY 37 H GLY 37 10.925 -6.600 3.144
270 HA2 GLY 37 1HA GLY 37 11.389 -9.352 2.493
271 HA3 GLY 37 2HA GLY 37 12.619 -8.295 1.815
272 H GLU 38 H GLU 38 11.655 -10.045 4.520
273 HA GLU 38 HA GLU 38 13.389 -8.511 6.323
274 HB2 GLU 38 1HB GLU 38 12.388 -9.847 8.127
275 HB3 GLU 38 2HB GLU 38 11.164 -9.006 7.186
276 HG2 GLU 38 1HG GLU 38 10.752 -11.100 5.934
277 HG3 GLU 38 2HG GLU 38 11.893 -11.919 7.000
278 H LYS 39 H LYS 39 15.064 -9.512 7.481
279 HA LYS 39 HA LYS 39 16.165 -11.875 6.138
280 HB2 LYS 39 1HB LYS 39 17.400 -9.686 7.795
281 HB3 LYS 39 2HB LYS 39 18.268 -11.175 7.443
282 HG2 LYS 39 1HG LYS 39 18.993 -9.679 5.813
283 HG3 LYS 39 2HG LYS 39 17.787 -10.670 4.987
284 HD2 LYS 39 1HD LYS 39 17.317 -8.448 4.356
285 HD3 LYS 39 2HD LYS 39 16.110 -8.853 5.579
286 HE2 LYS 39 1HE LYS 39 16.791 -6.780 6.301
287 HE3 LYS 39 2HE LYS 39 17.868 -7.829 7.223
288 HZ1 LYS 39 3HZ LYS 39 19.580 -7.465 5.543
289 HZ2 LYS 39 1HZ LYS 39 19.084 -6.004 6.237
290 HZ3 LYS 39 2HZ LYS 39 18.547 -6.431 4.692
291 H ARG 40 H ARG 40 17.142 -13.569 7.391
292 HA ARG 40 HA ARG 40 15.525 -14.459 9.521
293 HB2 ARG 40 1HB ARG 40 16.864 -16.380 9.561
294 HB3 ARG 40 2HB ARG 40 16.956 -15.837 7.891
295 HG2 ARG 40 1HG ARG 40 19.038 -14.861 9.759
296 HG3 ARG 40 2HG ARG 40 19.098 -16.557 9.273
297 HD2 ARG 40 1HD ARG 40 19.273 -15.987 6.980
298 HD3 ARG 40 2HD ARG 40 18.859 -14.303 7.296
299 HE ARG 40 HE ARG 40 21.125 -14.649 8.724
300 HH11 ARG 40 1HH1 ARG 40 20.271 -15.306 5.413
301 HH12 ARG 40 2HH1 ARG 40 21.876 -15.053 4.812
302 HH21 ARG 40 1HH2 ARG 40 23.242 -14.314 7.945
303 HH22 ARG 40 2HH2 ARG 40 23.565 -14.489 6.253
304 H SER 41 H SER 41 16.070 -14.820 11.725
305 HA SER 41 HA SER 41 18.344 -13.315 12.782
306 HB2 SER 41 1HB SER 41 15.497 -12.933 13.742
307 HB3 SER 41 2HB SER 41 16.932 -12.216 14.475
308 HG SER 41 HG SER 41 16.378 -10.651 13.138
309 H GLY 42 H GLY 42 18.834 -13.837 15.030
310 HA2 GLY 42 1HA GLY 42 18.722 -16.623 15.511
311 HA3 GLY 42 2HA GLY 42 19.305 -15.407 16.638
312 HA PRO 43 HA PRO 43 15.444 -17.304 18.381
313 HB2 PRO 43 1HB PRO 43 16.474 -17.703 20.861
314 HB3 PRO 43 2HB PRO 43 16.644 -18.876 19.550
315 HG2 PRO 43 1HG PRO 43 18.604 -16.839 20.535
316 HG3 PRO 43 2HG PRO 43 18.882 -18.529 20.076
317 HD2 PRO 43 1HD PRO 43 19.454 -16.458 18.427
318 HD3 PRO 43 2HD PRO 43 18.924 -18.042 17.823
319 H SER 44 H SER 44 14.657 -15.093 18.095
320 HA SER 44 HA SER 44 15.259 -13.130 20.116
321 HB2 SER 44 1HB SER 44 13.471 -11.801 18.957
322 HB3 SER 44 2HB SER 44 14.775 -12.329 17.894
323 HG SER 44 HG SER 44 12.122 -13.229 18.048
324 H SER 45 H SER 45 13.310 -12.003 21.183
325 HA SER 45 HA SER 45 12.271 -13.436 23.194
326 HB2 SER 45 1HB SER 45 11.929 -11.037 23.052
327 HB3 SER 45 2HB SER 45 10.837 -11.240 21.682
328 HG SER 45 HG SER 45 9.577 -12.591 23.237
329 H GLY 46 H GLY 46 10.979 -15.135 23.437
330 HA2 GLY 46 1HA GLY 46 8.561 -15.766 22.660
331 HA3 GLY 46 2HA GLY 46 9.396 -16.024 21.135
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -23.291 22.060 -4.568
2 HA2 GLY 1 1HA GLY 1 -25.181 20.723 -6.199
3 HA3 GLY 1 2HA GLY 1 -24.111 22.019 -6.713
4 H SER 2 H SER 2 -23.575 18.675 -5.600
5 HA SER 2 HA SER 2 -22.132 17.079 -6.395
6 HB2 SER 2 1HB SER 2 -22.665 16.338 -8.657
7 HB3 SER 2 2HB SER 2 -24.146 16.793 -7.814
8 HG SER 2 HG SER 2 -24.164 18.724 -8.947
9 H SER 3 H SER 3 -20.806 19.492 -6.081
10 HA SER 3 HA SER 3 -19.468 20.727 -8.040
11 HB2 SER 3 1HB SER 3 -19.069 20.871 -5.512
12 HB3 SER 3 2HB SER 3 -17.916 19.555 -5.734
13 HG SER 3 HG SER 3 -17.321 21.297 -7.573
14 H GLY 4 H GLY 4 -17.566 20.413 -9.272
15 HA2 GLY 4 1HA GLY 4 -16.021 19.221 -10.498
16 HA3 GLY 4 2HA GLY 4 -16.208 17.902 -9.351
17 H SER 5 H SER 5 -16.646 18.807 -12.504
18 HA SER 5 HA SER 5 -19.055 17.706 -13.301
19 HB2 SER 5 1HB SER 5 -17.371 18.966 -14.729
20 HB3 SER 5 2HB SER 5 -16.496 17.442 -14.886
21 HG SER 5 HG SER 5 -19.100 18.078 -15.787
22 H SER 6 H SER 6 -15.904 16.083 -12.999
23 HA SER 6 HA SER 6 -17.093 13.498 -13.540
24 HB2 SER 6 1HB SER 6 -14.840 12.627 -13.384
25 HB3 SER 6 2HB SER 6 -14.806 14.105 -14.347
26 HG SER 6 HG SER 6 -14.354 15.074 -12.107
27 H GLY 7 H GLY 7 -16.295 11.664 -11.988
28 HA2 GLY 7 1HA GLY 7 -15.986 12.224 -9.234
29 HA3 GLY 7 2HA GLY 7 -17.682 11.921 -9.581
30 H THR 8 H THR 8 -14.948 10.393 -11.192
31 HA THR 8 HA THR 8 -15.704 7.846 -9.913
32 HB THR 8 HB THR 8 -15.023 6.728 -12.063
33 HG1 THR 8 HG1 THR 8 -14.522 9.343 -12.714
34 HG21 THR 8 3HG2 THR 8 -17.419 8.433 -11.691
35 HG22 THR 8 1HG2 THR 8 -17.295 6.689 -11.921
36 HG23 THR 8 2HG2 THR 8 -17.149 7.774 -13.304
37 H LYS 9 H LYS 9 -14.070 7.691 -8.448
38 HA LYS 9 HA LYS 9 -11.359 8.354 -9.039
39 HB2 LYS 9 1HB LYS 9 -12.729 6.953 -6.760
40 HB3 LYS 9 2HB LYS 9 -10.974 7.014 -6.853
41 HG2 LYS 9 1HG LYS 9 -12.479 9.559 -7.127
42 HG3 LYS 9 2HG LYS 9 -12.361 8.821 -5.528
43 HD2 LYS 9 1HD LYS 9 -10.507 10.221 -5.597
44 HD3 LYS 9 2HD LYS 9 -9.834 8.653 -6.048
45 HE2 LYS 9 1HE LYS 9 -9.583 9.252 -8.265
46 HE3 LYS 9 2HE LYS 9 -10.819 10.506 -8.173
47 HZ1 LYS 9 3HZ LYS 9 -8.633 11.053 -6.429
48 HZ2 LYS 9 1HZ LYS 9 -9.300 12.016 -7.650
49 HZ3 LYS 9 2HZ LYS 9 -8.110 10.875 -8.029
50 H GLU 10 H GLU 10 -9.799 7.148 -9.917
51 HA GLU 10 HA GLU 10 -10.206 4.241 -10.108
52 HB2 GLU 10 1HB GLU 10 -9.831 4.167 -12.364
53 HB3 GLU 10 2HB GLU 10 -10.607 5.741 -12.255
54 HG2 GLU 10 1HG GLU 10 -8.139 6.581 -11.961
55 HG3 GLU 10 2HG GLU 10 -7.760 5.059 -12.766
56 H LYS 11 H LYS 11 -8.421 2.989 -9.806
57 HA LYS 11 HA LYS 11 -6.439 2.575 -8.682
58 HB2 LYS 11 1HB LYS 11 -5.284 4.174 -10.957
59 HB3 LYS 11 2HB LYS 11 -4.608 2.754 -10.170
60 HG2 LYS 11 1HG LYS 11 -6.846 1.658 -11.087
61 HG3 LYS 11 2HG LYS 11 -6.682 2.956 -12.272
62 HD2 LYS 11 1HD LYS 11 -4.776 2.079 -13.171
63 HD3 LYS 11 2HD LYS 11 -4.266 1.346 -11.648
64 HE2 LYS 11 1HE LYS 11 -6.720 0.292 -12.948
65 HE3 LYS 11 2HE LYS 11 -5.167 -0.099 -13.685
66 HZ1 LYS 11 3HZ LYS 11 -5.324 -0.462 -10.810
67 HZ2 LYS 11 1HZ LYS 11 -4.601 -1.438 -11.988
68 HZ3 LYS 11 2HZ LYS 11 -6.270 -1.523 -11.728
69 HA PRO 12 HA PRO 12 -6.012 7.020 -7.099
70 HB2 PRO 12 1HB PRO 12 -7.221 6.641 -4.698
71 HB3 PRO 12 2HB PRO 12 -8.099 7.145 -6.147
72 HG2 PRO 12 1HG PRO 12 -7.852 4.420 -4.933
73 HG3 PRO 12 2HG PRO 12 -9.286 5.220 -5.602
74 HD2 PRO 12 1HD PRO 12 -7.873 3.370 -6.984
75 HD3 PRO 12 2HD PRO 12 -8.703 4.724 -7.776
76 H TYR 13 H TYR 13 -5.661 3.845 -5.609
77 HA TYR 13 HA TYR 13 -3.787 4.696 -3.625
78 HB2 TYR 13 1HB TYR 13 -4.694 2.015 -4.641
79 HB3 TYR 13 2HB TYR 13 -3.354 2.147 -3.507
80 HD1 TYR 13 HD1 TYR 13 -6.293 4.374 -3.471
81 HD2 TYR 13 HD2 TYR 13 -4.404 1.003 -1.691
82 HE1 TYR 13 HE1 TYR 13 -7.890 4.474 -1.604
83 HE2 TYR 13 HE2 TYR 13 -5.997 1.092 0.182
84 HH TYR 13 HH TYR 13 -8.822 2.944 0.105
85 H LYS 14 H LYS 14 -1.759 5.261 -3.992
86 HA LYS 14 HA LYS 14 -0.356 4.079 -6.298
87 HB2 LYS 14 1HB LYS 14 -0.527 6.396 -6.708
88 HB3 LYS 14 2HB LYS 14 -0.169 6.803 -5.034
89 HG2 LYS 14 1HG LYS 14 2.105 6.389 -5.289
90 HG3 LYS 14 2HG LYS 14 1.863 5.434 -6.754
91 HD2 LYS 14 1HD LYS 14 1.404 7.356 -8.047
92 HD3 LYS 14 2HD LYS 14 1.206 8.367 -6.614
93 HE2 LYS 14 1HE LYS 14 3.683 7.704 -6.148
94 HE3 LYS 14 2HE LYS 14 3.709 7.317 -7.868
95 HZ1 LYS 14 3HZ LYS 14 4.443 9.578 -7.472
96 HZ2 LYS 14 1HZ LYS 14 2.987 9.948 -6.694
97 HZ3 LYS 14 2HZ LYS 14 2.994 9.580 -8.345
98 H CYS 15 H CYS 15 1.522 3.031 -5.972
99 HA CYS 15 HA CYS 15 2.279 2.343 -3.307
100 HB2 CYS 15 1HB CYS 15 2.467 0.796 -5.254
101 HB3 CYS 15 2HB CYS 15 3.768 1.802 -5.884
102 H TYR 16 H TYR 16 3.110 3.970 -2.112
103 HA TYR 16 HA TYR 16 4.752 6.039 -3.062
104 HB2 TYR 16 1HB TYR 16 4.789 4.999 -0.232
105 HB3 TYR 16 2HB TYR 16 5.077 6.644 -0.788
106 HD1 TYR 16 HD1 TYR 16 2.765 6.951 -2.658
107 HD2 TYR 16 HD2 TYR 16 2.990 5.278 1.247
108 HE1 TYR 16 HE1 TYR 16 0.393 7.491 -2.297
109 HE2 TYR 16 HE2 TYR 16 0.618 5.812 1.619
110 HH TYR 16 HH TYR 16 -1.034 7.822 0.354
111 H GLU 17 H GLU 17 5.440 2.781 -2.624
112 HA GLU 17 HA GLU 17 8.178 2.997 -1.825
113 HB2 GLU 17 1HB GLU 17 6.954 0.657 -3.273
114 HB3 GLU 17 2HB GLU 17 8.306 0.653 -2.150
115 HG2 GLU 17 1HG GLU 17 6.515 1.540 -0.463
116 HG3 GLU 17 2HG GLU 17 5.386 0.807 -1.602
117 H CYS 18 H CYS 18 6.591 2.232 -4.923
118 HA CYS 18 HA CYS 18 9.079 3.029 -6.286
119 HB2 CYS 18 1HB CYS 18 8.502 1.525 -8.087
120 HB3 CYS 18 2HB CYS 18 8.451 0.636 -6.568
121 H GLY 19 H GLY 19 5.543 3.137 -6.414
122 HA2 GLY 19 1HA GLY 19 4.708 5.459 -6.916
123 HA3 GLY 19 2HA GLY 19 5.767 5.387 -8.316
124 H LYS 20 H LYS 20 4.327 2.410 -7.582
125 HA LYS 20 HA LYS 20 2.872 2.359 -10.018
126 HB2 LYS 20 1HB LYS 20 3.040 0.502 -7.658
127 HB3 LYS 20 2HB LYS 20 1.935 0.188 -8.989
128 HG2 LYS 20 1HG LYS 20 4.760 0.737 -9.680
129 HG3 LYS 20 2HG LYS 20 4.396 -0.805 -8.902
130 HD2 LYS 20 1HD LYS 20 2.669 0.053 -11.164
131 HD3 LYS 20 2HD LYS 20 4.303 -0.500 -11.537
132 HE2 LYS 20 1HE LYS 20 3.897 -2.613 -10.493
133 HE3 LYS 20 2HE LYS 20 2.350 -2.060 -9.854
134 HZ1 LYS 20 3HZ LYS 20 2.129 -3.482 -11.832
135 HZ2 LYS 20 1HZ LYS 20 2.974 -2.334 -12.744
136 HZ3 LYS 20 2HZ LYS 20 1.474 -1.941 -12.070
137 H ALA 21 H ALA 21 0.491 1.419 -9.852
138 HA ALA 21 HA ALA 21 -1.045 2.989 -7.903
139 HB1 ALA 21 3HB ALA 21 -1.343 3.055 -10.890
140 HB2 ALA 21 1HB ALA 21 -2.661 3.504 -9.808
141 HB3 ALA 21 2HB ALA 21 -1.144 4.403 -9.771
142 H PHE 22 H PHE 22 -3.278 2.271 -7.670
143 HA PHE 22 HA PHE 22 -4.103 -0.218 -8.828
144 HB2 PHE 22 1HB PHE 22 -3.542 -0.215 -5.858
145 HB3 PHE 22 2HB PHE 22 -4.110 -1.567 -6.833
146 HD1 PHE 22 HD1 PHE 22 -1.227 0.522 -5.973
147 HD2 PHE 22 HD2 PHE 22 -2.599 -2.836 -8.199
148 HE1 PHE 22 HE1 PHE 22 1.102 -0.176 -6.349
149 HE2 PHE 22 HE2 PHE 22 -0.272 -3.540 -8.579
150 HZ PHE 22 HZ PHE 22 1.582 -2.210 -7.652
151 H ARG 23 H ARG 23 -6.278 -0.690 -8.439
152 HA ARG 23 HA ARG 23 -7.930 1.531 -7.882
153 HB2 ARG 23 1HB ARG 23 -8.382 -1.367 -8.433
154 HB3 ARG 23 2HB ARG 23 -9.714 -0.425 -7.775
155 HG2 ARG 23 1HG ARG 23 -8.215 0.533 -10.179
156 HG3 ARG 23 2HG ARG 23 -9.493 -0.675 -10.329
157 HD2 ARG 23 1HD ARG 23 -11.097 0.825 -9.347
158 HD3 ARG 23 2HD ARG 23 -9.836 2.006 -8.996
159 HE ARG 23 HE ARG 23 -9.869 2.671 -11.205
160 HH11 ARG 23 1HH1 ARG 23 -11.786 -0.205 -10.788
161 HH12 ARG 23 2HH1 ARG 23 -12.504 -0.111 -12.361
162 HH21 ARG 23 1HH2 ARG 23 -10.809 2.805 -13.279
163 HH22 ARG 23 2HH2 ARG 23 -11.947 1.601 -13.778
164 H THR 24 H THR 24 -7.210 -1.411 -6.027
165 HA THR 24 HA THR 24 -8.259 -0.048 -3.633
166 HB THR 24 HB THR 24 -9.049 -2.129 -2.745
167 HG1 THR 24 HG1 THR 24 -8.705 -4.080 -3.796
168 HG21 THR 24 3HG2 THR 24 -10.559 -2.890 -4.748
169 HG22 THR 24 1HG2 THR 24 -9.872 -1.473 -5.541
170 HG23 THR 24 2HG2 THR 24 -10.770 -1.292 -4.034
171 H ARG 25 H ARG 25 -7.451 -1.609 -1.645
172 HA ARG 25 HA ARG 25 -4.633 -1.133 -1.543
173 HB2 ARG 25 1HB ARG 25 -6.148 -0.876 0.414
174 HB3 ARG 25 2HB ARG 25 -6.375 -2.620 0.428
175 HG2 ARG 25 1HG ARG 25 -4.753 -1.904 2.102
176 HG3 ARG 25 2HG ARG 25 -4.013 -2.946 0.885
177 HD2 ARG 25 1HD ARG 25 -3.112 -0.989 -0.257
178 HD3 ARG 25 2HD ARG 25 -3.879 0.067 0.929
179 HE ARG 25 HE ARG 25 -2.067 -1.891 2.037
180 HH11 ARG 25 1HH1 ARG 25 -2.439 1.331 0.770
181 HH12 ARG 25 2HH1 ARG 25 -1.030 1.947 1.568
182 HH21 ARG 25 1HH2 ARG 25 -0.210 -1.091 3.092
183 HH22 ARG 25 2HH2 ARG 25 0.237 0.569 2.888
184 H SER 26 H SER 26 -6.546 -4.119 -1.131
185 HA SER 26 HA SER 26 -4.622 -6.001 -0.991
186 HB2 SER 26 1HB SER 26 -7.089 -6.432 -1.033
187 HB3 SER 26 2HB SER 26 -7.041 -6.279 -2.789
188 HG SER 26 HG SER 26 -6.390 -8.264 -2.864
189 H ASN 27 H ASN 27 -5.779 -4.517 -4.000
190 HA ASN 27 HA ASN 27 -4.106 -5.996 -5.729
191 HB2 ASN 27 1HB ASN 27 -6.173 -4.623 -6.339
192 HB3 ASN 27 2HB ASN 27 -5.122 -3.210 -6.279
193 HD21 ASN 27 1HD2 ASN 27 -5.573 -2.870 -8.493
194 HD22 ASN 27 2HD2 ASN 27 -4.779 -3.801 -9.712
195 H LEU 28 H LEU 28 -3.637 -3.059 -3.887
196 HA LEU 28 HA LEU 28 -1.185 -2.338 -5.199
197 HB2 LEU 28 1HB LEU 28 -2.140 -0.466 -4.331
198 HB3 LEU 28 2HB LEU 28 -2.800 -1.318 -2.936
199 HG LEU 28 HG LEU 28 -0.529 -1.339 -1.937
200 HD11 LEU 28 1HD1 LEU 28 1.266 -0.146 -2.866
201 HD12 LEU 28 2HD1 LEU 28 0.240 0.623 -4.076
202 HD13 LEU 28 3HD1 LEU 28 0.609 -1.097 -4.197
203 HD21 LEU 28 3HD2 LEU 28 -2.240 0.961 -2.376
204 HD22 LEU 28 1HD2 LEU 28 -0.571 1.424 -2.045
205 HD23 LEU 28 2HD2 LEU 28 -1.447 0.406 -0.901
206 H THR 29 H THR 29 -1.918 -3.388 -1.867
207 HA THR 29 HA THR 29 0.645 -3.763 -0.953
208 HB THR 29 HB THR 29 -1.852 -5.331 -0.310
209 HG1 THR 29 HG1 THR 29 -0.569 -3.619 1.490
210 HG21 THR 29 3HG2 THR 29 -0.454 -6.857 0.583
211 HG22 THR 29 1HG2 THR 29 -0.238 -5.656 1.856
212 HG23 THR 29 2HG2 THR 29 0.929 -5.763 0.537
213 H THR 30 H THR 30 -1.395 -6.154 -2.621
214 HA THR 30 HA THR 30 0.214 -8.359 -2.573
215 HB THR 30 HB THR 30 -1.581 -7.328 -4.759
216 HG1 THR 30 HG1 THR 30 -2.983 -8.774 -3.900
217 HG21 THR 30 3HG2 THR 30 -1.394 -9.650 -5.728
218 HG22 THR 30 1HG2 THR 30 0.032 -9.875 -4.715
219 HG23 THR 30 2HG2 THR 30 0.021 -8.622 -5.956
220 H HIS 31 H HIS 31 0.722 -5.411 -4.332
221 HA HIS 31 HA HIS 31 2.893 -6.584 -5.897
222 HB2 HIS 31 1HB HIS 31 1.784 -5.177 -7.328
223 HB3 HIS 31 2HB HIS 31 1.301 -4.074 -6.042
224 HD1 HIS 31 HD1 HIS 31 4.050 -4.756 -8.467
225 HD2 HIS 31 HD2 HIS 31 3.154 -2.045 -5.448
226 HE1 HIS 31 HE1 HIS 31 5.724 -2.895 -8.715
227 H GLN 32 H GLN 32 2.319 -4.373 -3.244
228 HA GLN 32 HA GLN 32 4.848 -3.187 -3.082
229 HB2 GLN 32 1HB GLN 32 2.773 -3.782 -0.978
230 HB3 GLN 32 2HB GLN 32 4.255 -2.904 -0.623
231 HG2 GLN 32 1HG GLN 32 3.416 -1.458 -2.693
232 HG3 GLN 32 2HG GLN 32 1.857 -2.057 -2.130
233 HE21 GLN 32 1HE2 GLN 32 0.895 -0.589 -0.936
234 HE22 GLN 32 2HE2 GLN 32 1.647 0.418 0.249
235 H VAL 33 H VAL 33 3.894 -6.396 -2.511
236 HA VAL 33 HA VAL 33 5.546 -7.263 -0.471
237 HB VAL 33 HB VAL 33 4.956 -8.799 -3.004
238 HG11 VAL 33 1HG1 VAL 33 6.373 -10.230 -1.991
239 HG12 VAL 33 2HG1 VAL 33 6.169 -9.478 -0.408
240 HG13 VAL 33 3HG1 VAL 33 4.960 -10.614 -1.008
241 HG21 VAL 33 3HG2 VAL 33 2.887 -7.960 -2.082
242 HG22 VAL 33 1HG2 VAL 33 3.013 -9.689 -1.759
243 HG23 VAL 33 2HG2 VAL 33 3.336 -8.526 -0.473
244 H ILE 34 H ILE 34 6.352 -6.381 -3.744
245 HA ILE 34 HA ILE 34 8.882 -7.616 -3.907
246 HB ILE 34 HB ILE 34 9.347 -6.130 -5.753
247 HG12 ILE 34 1HG1 ILE 34 6.945 -4.581 -4.766
248 HG13 ILE 34 2HG1 ILE 34 8.612 -4.019 -4.836
249 HG21 ILE 34 1HG2 ILE 34 7.030 -6.386 -6.966
250 HG22 ILE 34 2HG2 ILE 34 7.998 -7.800 -6.550
251 HG23 ILE 34 3HG2 ILE 34 6.635 -7.335 -5.533
252 HD11 ILE 34 3HD1 ILE 34 8.307 -4.548 -7.401
253 HD12 ILE 34 1HD1 ILE 34 6.608 -4.298 -7.000
254 HD13 ILE 34 2HD1 ILE 34 7.784 -3.018 -6.696
255 H HIS 35 H HIS 35 7.777 -4.789 -2.268
256 HA HIS 35 HA HIS 35 10.492 -3.778 -1.893
257 HB2 HIS 35 1HB HIS 35 7.868 -2.633 -0.918
258 HB3 HIS 35 2HB HIS 35 9.438 -1.837 -0.861
259 HD1 HIS 35 HD1 HIS 35 10.543 -1.520 -3.387
260 HD2 HIS 35 HD2 HIS 35 6.422 -1.966 -3.101
261 HE1 HIS 35 HE1 HIS 35 9.618 -0.630 -5.550
262 H THR 36 H THR 36 8.471 -5.978 -0.461
263 HA THR 36 HA THR 36 9.301 -5.408 2.279
264 HB THR 36 HB THR 36 7.722 -6.986 3.008
265 HG1 THR 36 HG1 THR 36 7.219 -7.967 0.411
266 HG21 THR 36 3HG2 THR 36 6.493 -5.126 2.273
267 HG22 THR 36 1HG2 THR 36 5.658 -6.506 1.563
268 HG23 THR 36 2HG2 THR 36 6.738 -5.524 0.573
269 H GLY 37 H GLY 37 11.519 -5.928 0.902
270 HA2 GLY 37 1HA GLY 37 13.401 -7.236 1.489
271 HA3 GLY 37 2HA GLY 37 12.318 -8.536 1.966
272 H GLU 38 H GLU 38 14.699 -8.415 0.136
273 HA GLU 38 HA GLU 38 13.392 -9.662 -2.190
274 HB2 GLU 38 1HB GLU 38 14.608 -7.322 -2.452
275 HB3 GLU 38 2HB GLU 38 16.044 -8.335 -2.518
276 HG2 GLU 38 1HG GLU 38 15.555 -8.233 -4.729
277 HG3 GLU 38 2HG GLU 38 14.609 -9.654 -4.292
278 H LYS 39 H LYS 39 16.545 -9.359 -0.551
279 HA LYS 39 HA LYS 39 17.785 -11.610 -1.521
280 HB2 LYS 39 1HB LYS 39 18.641 -9.792 0.114
281 HB3 LYS 39 2HB LYS 39 18.032 -10.853 1.377
282 HG2 LYS 39 1HG LYS 39 20.204 -11.543 1.260
283 HG3 LYS 39 2HG LYS 39 19.455 -12.657 0.114
284 HD2 LYS 39 1HD LYS 39 21.228 -11.938 -1.140
285 HD3 LYS 39 2HD LYS 39 20.028 -10.726 -1.597
286 HE2 LYS 39 1HE LYS 39 20.939 -9.193 0.073
287 HE3 LYS 39 2HE LYS 39 22.124 -10.407 0.552
288 HZ1 LYS 39 3HZ LYS 39 22.638 -8.512 -1.218
289 HZ2 LYS 39 1HZ LYS 39 22.058 -9.702 -2.271
290 HZ3 LYS 39 2HZ LYS 39 23.379 -10.031 -1.268
291 H ARG 40 H ARG 40 15.718 -11.403 1.371
292 HA ARG 40 HA ARG 40 15.773 -14.263 1.743
293 HB2 ARG 40 1HB ARG 40 14.231 -12.060 3.118
294 HB3 ARG 40 2HB ARG 40 14.110 -13.757 3.563
295 HG2 ARG 40 1HG ARG 40 16.623 -13.692 3.911
296 HG3 ARG 40 2HG ARG 40 16.481 -11.936 3.803
297 HD2 ARG 40 1HD ARG 40 14.999 -13.691 5.758
298 HD3 ARG 40 2HD ARG 40 16.441 -12.747 6.128
299 HE ARG 40 HE ARG 40 14.213 -11.238 5.066
300 HH11 ARG 40 1HH1 ARG 40 15.863 -12.396 7.904
301 HH12 ARG 40 2HH1 ARG 40 15.190 -11.189 8.948
302 HH21 ARG 40 1HH2 ARG 40 13.319 -9.643 6.431
303 HH22 ARG 40 2HH2 ARG 40 13.742 -9.624 8.109
304 H SER 41 H SER 41 14.889 -13.863 -0.768
305 HA SER 41 HA SER 41 11.968 -13.998 -0.719
306 HB2 SER 41 1HB SER 41 14.018 -13.453 -2.809
307 HB3 SER 41 2HB SER 41 12.512 -14.210 -3.329
308 HG SER 41 HG SER 41 12.876 -11.689 -2.969
309 H GLY 42 H GLY 42 14.693 -15.847 -2.098
310 HA2 GLY 42 1HA GLY 42 14.301 -18.325 -1.258
311 HA3 GLY 42 2HA GLY 42 12.956 -18.178 -2.380
312 HA PRO 43 HA PRO 43 17.185 -18.068 -4.806
313 HB2 PRO 43 1HB PRO 43 19.152 -19.478 -3.575
314 HB3 PRO 43 2HB PRO 43 18.928 -17.740 -3.345
315 HG2 PRO 43 1HG PRO 43 18.062 -20.010 -1.596
316 HG3 PRO 43 2HG PRO 43 18.796 -18.462 -1.138
317 HD2 PRO 43 1HD PRO 43 16.136 -18.929 -0.938
318 HD3 PRO 43 2HD PRO 43 16.799 -17.323 -1.303
319 H SER 44 H SER 44 18.385 -19.891 -5.914
320 HA SER 44 HA SER 44 17.171 -22.517 -5.490
321 HB2 SER 44 1HB SER 44 15.919 -21.064 -7.260
322 HB3 SER 44 2HB SER 44 17.305 -21.431 -8.287
323 HG SER 44 HG SER 44 16.100 -23.134 -8.698
324 H SER 45 H SER 45 18.741 -23.966 -5.410
325 HA SER 45 HA SER 45 21.385 -23.665 -5.682
326 HB2 SER 45 1HB SER 45 19.611 -26.010 -6.186
327 HB3 SER 45 2HB SER 45 21.312 -26.152 -6.631
328 HG SER 45 HG SER 45 20.156 -25.778 -4.098
329 H GLY 46 H GLY 46 19.277 -24.641 -8.387
330 HA2 GLY 46 1HA GLY 46 20.369 -23.063 -10.345
331 HA3 GLY 46 2HA GLY 46 21.400 -24.486 -10.308
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -5.680 23.882 -11.721
2 HA2 GLY 1 1HA GLY 1 -4.275 23.000 -13.480
3 HA3 GLY 1 2HA GLY 1 -3.476 24.429 -12.842
4 H SER 2 H SER 2 -3.759 20.966 -12.029
5 HA SER 2 HA SER 2 -0.849 20.961 -11.554
6 HB2 SER 2 1HB SER 2 -3.103 19.719 -10.047
7 HB3 SER 2 2HB SER 2 -1.579 18.835 -10.124
8 HG SER 2 HG SER 2 -0.557 20.730 -9.302
9 H SER 3 H SER 3 -1.854 20.566 -14.108
10 HA SER 3 HA SER 3 -2.046 19.064 -15.839
11 HB2 SER 3 1HB SER 3 0.415 19.282 -15.377
12 HB3 SER 3 2HB SER 3 0.312 17.807 -14.417
13 HG SER 3 HG SER 3 0.661 16.872 -16.270
14 H GLY 4 H GLY 4 -3.851 18.388 -13.838
15 HA2 GLY 4 1HA GLY 4 -4.407 15.690 -14.484
16 HA3 GLY 4 2HA GLY 4 -3.731 15.779 -12.864
17 H SER 5 H SER 5 -6.442 16.598 -14.899
18 HA SER 5 HA SER 5 -7.985 17.277 -12.481
19 HB2 SER 5 1HB SER 5 -7.584 19.102 -14.285
20 HB3 SER 5 2HB SER 5 -8.770 18.203 -15.232
21 HG SER 5 HG SER 5 -9.779 19.820 -14.001
22 H SER 6 H SER 6 -9.146 15.541 -11.955
23 HA SER 6 HA SER 6 -10.931 14.400 -13.957
24 HB2 SER 6 1HB SER 6 -10.321 12.095 -13.407
25 HB3 SER 6 2HB SER 6 -8.916 12.968 -14.020
26 HG SER 6 HG SER 6 -8.709 11.631 -12.005
27 H GLY 7 H GLY 7 -12.482 12.810 -12.888
28 HA2 GLY 7 1HA GLY 7 -13.126 13.799 -10.177
29 HA3 GLY 7 2HA GLY 7 -14.346 13.428 -11.387
30 H THR 8 H THR 8 -13.604 11.020 -12.353
31 HA THR 8 HA THR 8 -14.577 9.212 -10.493
32 HB THR 8 HB THR 8 -14.483 8.798 -12.942
33 HG1 THR 8 HG1 THR 8 -14.493 7.091 -11.114
34 HG21 THR 8 3HG2 THR 8 -11.554 8.449 -12.348
35 HG22 THR 8 1HG2 THR 8 -12.309 9.475 -13.567
36 HG23 THR 8 2HG2 THR 8 -12.321 7.722 -13.759
37 H LYS 9 H LYS 9 -13.589 7.513 -9.311
38 HA LYS 9 HA LYS 9 -10.870 8.175 -8.410
39 HB2 LYS 9 1HB LYS 9 -11.435 6.898 -6.376
40 HB3 LYS 9 2HB LYS 9 -12.541 8.238 -6.648
41 HG2 LYS 9 1HG LYS 9 -13.918 6.322 -7.882
42 HG3 LYS 9 2HG LYS 9 -13.029 5.323 -6.729
43 HD2 LYS 9 1HD LYS 9 -14.395 7.798 -5.770
44 HD3 LYS 9 2HD LYS 9 -15.355 6.352 -6.089
45 HE2 LYS 9 1HE LYS 9 -12.881 6.065 -4.465
46 HE3 LYS 9 2HE LYS 9 -14.281 6.829 -3.714
47 HZ1 LYS 9 3HZ LYS 9 -13.829 4.073 -4.333
48 HZ2 LYS 9 1HZ LYS 9 -15.309 4.625 -4.941
49 HZ3 LYS 9 2HZ LYS 9 -14.965 4.770 -3.291
50 H GLU 10 H GLU 10 -9.971 7.071 -10.278
51 HA GLU 10 HA GLU 10 -10.156 4.141 -10.133
52 HB2 GLU 10 1HB GLU 10 -9.770 4.027 -12.384
53 HB3 GLU 10 2HB GLU 10 -10.540 5.606 -12.309
54 HG2 GLU 10 1HG GLU 10 -8.067 6.436 -12.010
55 HG3 GLU 10 2HG GLU 10 -7.694 4.902 -12.793
56 H LYS 11 H LYS 11 -8.378 2.893 -9.791
57 HA LYS 11 HA LYS 11 -6.402 2.493 -8.650
58 HB2 LYS 11 1HB LYS 11 -5.378 4.025 -11.046
59 HB3 LYS 11 2HB LYS 11 -4.496 2.821 -10.116
60 HG2 LYS 11 1HG LYS 11 -6.554 1.310 -10.823
61 HG3 LYS 11 2HG LYS 11 -6.620 2.470 -12.152
62 HD2 LYS 11 1HD LYS 11 -4.177 2.021 -12.532
63 HD3 LYS 11 2HD LYS 11 -4.305 0.709 -11.357
64 HE2 LYS 11 1HE LYS 11 -4.671 -0.463 -13.281
65 HE3 LYS 11 2HE LYS 11 -6.328 0.002 -12.902
66 HZ1 LYS 11 3HZ LYS 11 -5.255 0.400 -15.271
67 HZ2 LYS 11 1HZ LYS 11 -4.774 1.848 -14.540
68 HZ3 LYS 11 2HZ LYS 11 -6.415 1.447 -14.623
69 HA PRO 12 HA PRO 12 -5.982 6.965 -7.138
70 HB2 PRO 12 1HB PRO 12 -7.220 6.632 -4.744
71 HB3 PRO 12 2HB PRO 12 -8.080 7.113 -6.212
72 HG2 PRO 12 1HG PRO 12 -7.856 4.408 -4.948
73 HG3 PRO 12 2HG PRO 12 -9.279 5.203 -5.647
74 HD2 PRO 12 1HD PRO 12 -7.857 3.324 -6.981
75 HD3 PRO 12 2HD PRO 12 -8.674 4.667 -7.806
76 H TYR 13 H TYR 13 -5.625 3.803 -5.639
77 HA TYR 13 HA TYR 13 -3.792 4.676 -3.622
78 HB2 TYR 13 1HB TYR 13 -4.657 1.982 -4.644
79 HB3 TYR 13 2HB TYR 13 -3.344 2.134 -3.481
80 HD1 TYR 13 HD1 TYR 13 -6.209 4.422 -3.440
81 HD2 TYR 13 HD2 TYR 13 -4.520 0.895 -1.765
82 HE1 TYR 13 HE1 TYR 13 -7.847 4.515 -1.608
83 HE2 TYR 13 HE2 TYR 13 -6.154 0.977 0.071
84 HH TYR 13 HH TYR 13 -7.679 2.305 1.120
85 H LYS 14 H LYS 14 -1.812 5.361 -4.057
86 HA LYS 14 HA LYS 14 -0.356 4.159 -6.316
87 HB2 LYS 14 1HB LYS 14 -0.558 6.490 -6.684
88 HB3 LYS 14 2HB LYS 14 -0.172 6.867 -5.010
89 HG2 LYS 14 1HG LYS 14 2.096 6.467 -5.310
90 HG3 LYS 14 2HG LYS 14 1.833 5.520 -6.776
91 HD2 LYS 14 1HD LYS 14 1.440 7.417 -8.075
92 HD3 LYS 14 2HD LYS 14 1.098 8.425 -6.667
93 HE2 LYS 14 1HE LYS 14 3.463 8.255 -6.003
94 HE3 LYS 14 2HE LYS 14 3.787 7.298 -7.448
95 HZ1 LYS 14 3HZ LYS 14 2.856 9.284 -8.706
96 HZ2 LYS 14 1HZ LYS 14 4.391 9.460 -8.017
97 HZ3 LYS 14 2HZ LYS 14 3.042 10.152 -7.267
98 H CYS 15 H CYS 15 1.505 3.093 -5.976
99 HA CYS 15 HA CYS 15 2.254 2.421 -3.301
100 HB2 CYS 15 1HB CYS 15 2.412 0.848 -5.234
101 HB3 CYS 15 2HB CYS 15 3.730 1.825 -5.873
102 H TYR 16 H TYR 16 3.162 3.991 -2.106
103 HA TYR 16 HA TYR 16 4.815 6.046 -3.098
104 HB2 TYR 16 1HB TYR 16 4.860 5.047 -0.255
105 HB3 TYR 16 2HB TYR 16 5.146 6.682 -0.840
106 HD1 TYR 16 HD1 TYR 16 2.847 7.064 -2.651
107 HD2 TYR 16 HD2 TYR 16 3.046 5.254 1.194
108 HE1 TYR 16 HE1 TYR 16 0.479 7.616 -2.275
109 HE2 TYR 16 HE2 TYR 16 0.679 5.799 1.581
110 HH TYR 16 HH TYR 16 -0.955 7.927 0.270
111 H GLU 17 H GLU 17 5.448 2.783 -2.625
112 HA GLU 17 HA GLU 17 8.187 2.951 -1.829
113 HB2 GLU 17 1HB GLU 17 6.913 0.634 -3.274
114 HB3 GLU 17 2HB GLU 17 8.276 0.603 -2.165
115 HG2 GLU 17 1HG GLU 17 6.510 1.532 -0.465
116 HG3 GLU 17 2HG GLU 17 5.367 0.800 -1.590
117 H CYS 18 H CYS 18 6.567 2.297 -4.930
118 HA CYS 18 HA CYS 18 9.080 3.026 -6.288
119 HB2 CYS 18 1HB CYS 18 8.476 1.534 -8.098
120 HB3 CYS 18 2HB CYS 18 8.439 0.643 -6.580
121 H GLY 19 H GLY 19 5.549 3.198 -6.391
122 HA2 GLY 19 1HA GLY 19 4.722 5.507 -6.900
123 HA3 GLY 19 2HA GLY 19 5.805 5.454 -8.284
124 H LYS 20 H LYS 20 4.289 2.491 -7.556
125 HA LYS 20 HA LYS 20 2.885 2.478 -10.037
126 HB2 LYS 20 1HB LYS 20 3.153 0.577 -7.739
127 HB3 LYS 20 2HB LYS 20 1.908 0.298 -8.950
128 HG2 LYS 20 1HG LYS 20 4.759 0.732 -9.750
129 HG3 LYS 20 2HG LYS 20 4.188 -0.854 -9.227
130 HD2 LYS 20 1HD LYS 20 2.298 -0.451 -10.970
131 HD3 LYS 20 2HD LYS 20 3.415 0.742 -11.638
132 HE2 LYS 20 1HE LYS 20 4.390 -2.015 -11.038
133 HE3 LYS 20 2HE LYS 20 3.438 -1.732 -12.494
134 HZ1 LYS 20 3HZ LYS 20 6.125 -0.797 -11.820
135 HZ2 LYS 20 1HZ LYS 20 5.156 0.219 -12.765
136 HZ3 LYS 20 2HZ LYS 20 5.512 -1.347 -13.297
137 H ALA 21 H ALA 21 0.501 1.432 -9.812
138 HA ALA 21 HA ALA 21 -1.049 2.999 -7.880
139 HB1 ALA 21 3HB ALA 21 -1.141 4.433 -9.740
140 HB2 ALA 21 1HB ALA 21 -1.359 3.093 -10.867
141 HB3 ALA 21 2HB ALA 21 -2.663 3.543 -9.767
142 H PHE 22 H PHE 22 -3.260 2.250 -7.631
143 HA PHE 22 HA PHE 22 -4.082 -0.217 -8.838
144 HB2 PHE 22 1HB PHE 22 -3.492 -0.280 -5.875
145 HB3 PHE 22 2HB PHE 22 -4.054 -1.613 -6.878
146 HD1 PHE 22 HD1 PHE 22 -1.185 0.467 -5.967
147 HD2 PHE 22 HD2 PHE 22 -2.541 -2.817 -8.312
148 HE1 PHE 22 HE1 PHE 22 1.148 -0.197 -6.379
149 HE2 PHE 22 HE2 PHE 22 -0.211 -3.487 -8.727
150 HZ PHE 22 HZ PHE 22 1.637 -2.177 -7.760
151 H ARG 23 H ARG 23 -6.251 -0.695 -8.461
152 HA ARG 23 HA ARG 23 -7.903 1.500 -7.809
153 HB2 ARG 23 1HB ARG 23 -8.666 -1.417 -8.033
154 HB3 ARG 23 2HB ARG 23 -9.767 -0.048 -8.109
155 HG2 ARG 23 1HG ARG 23 -8.348 0.709 -10.117
156 HG3 ARG 23 2HG ARG 23 -7.745 -0.949 -10.120
157 HD2 ARG 23 1HD ARG 23 -9.884 -1.837 -10.535
158 HD3 ARG 23 2HD ARG 23 -10.681 -0.322 -10.116
159 HE ARG 23 HE ARG 23 -9.452 -1.007 -12.645
160 HH11 ARG 23 1HH1 ARG 23 -10.694 1.514 -10.590
161 HH12 ARG 23 2HH1 ARG 23 -10.953 2.627 -11.893
162 HH21 ARG 23 1HH2 ARG 23 -9.788 0.449 -14.368
163 HH22 ARG 23 2HH2 ARG 23 -10.439 2.020 -14.041
164 H THR 24 H THR 24 -7.474 -1.625 -6.141
165 HA THR 24 HA THR 24 -8.482 -0.352 -3.684
166 HB THR 24 HB THR 24 -9.213 -2.466 -2.906
167 HG1 THR 24 HG1 THR 24 -8.736 -4.322 -4.507
168 HG21 THR 24 3HG2 THR 24 -10.809 -1.664 -4.437
169 HG22 THR 24 1HG2 THR 24 -10.566 -3.351 -4.888
170 HG23 THR 24 2HG2 THR 24 -9.803 -2.068 -5.828
171 H ARG 25 H ARG 25 -7.604 -1.804 -1.701
172 HA ARG 25 HA ARG 25 -4.822 -1.191 -1.554
173 HB2 ARG 25 1HB ARG 25 -6.255 -0.986 0.407
174 HB3 ARG 25 2HB ARG 25 -6.614 -2.707 0.351
175 HG2 ARG 25 1HG ARG 25 -5.006 -2.323 2.071
176 HG3 ARG 25 2HG ARG 25 -4.205 -3.163 0.742
177 HD2 ARG 25 1HD ARG 25 -3.231 -1.095 -0.033
178 HD3 ARG 25 2HD ARG 25 -4.126 -0.181 1.181
179 HE ARG 25 HE ARG 25 -2.367 -2.225 2.227
180 HH11 ARG 25 1HH1 ARG 25 -2.738 1.118 1.327
181 HH12 ARG 25 2HH1 ARG 25 -1.432 1.667 2.324
182 HH21 ARG 25 1HH2 ARG 25 -0.646 -1.514 3.544
183 HH22 ARG 25 2HH2 ARG 25 -0.242 0.169 3.584
184 H SER 26 H SER 26 -6.563 -4.287 -1.197
185 HA SER 26 HA SER 26 -4.523 -6.049 -1.043
186 HB2 SER 26 1HB SER 26 -6.993 -6.585 -1.130
187 HB3 SER 26 2HB SER 26 -6.873 -6.511 -2.888
188 HG SER 26 HG SER 26 -5.756 -8.368 -1.101
189 H ASN 27 H ASN 27 -5.752 -4.621 -4.051
190 HA ASN 27 HA ASN 27 -4.019 -5.991 -5.796
191 HB2 ASN 27 1HB ASN 27 -6.127 -4.643 -6.365
192 HB3 ASN 27 2HB ASN 27 -5.090 -3.221 -6.307
193 HD21 ASN 27 1HD2 ASN 27 -5.323 -2.749 -8.464
194 HD22 ASN 27 2HD2 ASN 27 -4.625 -3.714 -9.715
195 H LEU 28 H LEU 28 -3.645 -3.069 -3.903
196 HA LEU 28 HA LEU 28 -1.192 -2.282 -5.185
197 HB2 LEU 28 1HB LEU 28 -2.224 -0.435 -4.340
198 HB3 LEU 28 2HB LEU 28 -2.863 -1.298 -2.943
199 HG LEU 28 HG LEU 28 -0.616 -1.232 -1.917
200 HD11 LEU 28 1HD1 LEU 28 0.463 -0.955 -4.269
201 HD12 LEU 28 2HD1 LEU 28 1.202 -0.185 -2.865
202 HD13 LEU 28 3HD1 LEU 28 0.214 0.766 -3.973
203 HD21 LEU 28 3HD2 LEU 28 -2.500 0.752 -2.048
204 HD22 LEU 28 1HD2 LEU 28 -1.018 1.605 -2.477
205 HD23 LEU 28 2HD2 LEU 28 -1.117 0.723 -0.953
206 H THR 29 H THR 29 -1.944 -3.300 -1.847
207 HA THR 29 HA THR 29 0.622 -3.631 -0.916
208 HB THR 29 HB THR 29 -1.849 -5.233 -0.245
209 HG1 THR 29 HG1 THR 29 -1.292 -3.774 1.755
210 HG21 THR 29 3HG2 THR 29 0.926 -5.346 0.862
211 HG22 THR 29 1HG2 THR 29 -0.204 -6.659 0.537
212 HG23 THR 29 2HG2 THR 29 -0.450 -5.609 1.932
213 H THR 30 H THR 30 -1.390 -6.049 -2.573
214 HA THR 30 HA THR 30 0.225 -8.254 -2.461
215 HB THR 30 HB THR 30 -1.555 -7.266 -4.678
216 HG1 THR 30 HG1 THR 30 -1.857 -8.704 -2.409
217 HG21 THR 30 3HG2 THR 30 0.074 -8.565 -5.839
218 HG22 THR 30 1HG2 THR 30 -1.343 -9.591 -5.624
219 HG23 THR 30 2HG2 THR 30 0.067 -9.807 -4.587
220 H HIS 31 H HIS 31 0.686 -5.362 -4.356
221 HA HIS 31 HA HIS 31 2.882 -6.543 -5.862
222 HB2 HIS 31 1HB HIS 31 1.794 -5.135 -7.304
223 HB3 HIS 31 2HB HIS 31 1.301 -4.030 -6.025
224 HD1 HIS 31 HD1 HIS 31 4.060 -4.711 -8.436
225 HD2 HIS 31 HD2 HIS 31 3.159 -2.006 -5.413
226 HE1 HIS 31 HE1 HIS 31 5.738 -2.853 -8.673
227 H GLN 32 H GLN 32 2.322 -4.336 -3.208
228 HA GLN 32 HA GLN 32 4.853 -3.152 -3.050
229 HB2 GLN 32 1HB GLN 32 2.801 -3.761 -0.924
230 HB3 GLN 32 2HB GLN 32 4.272 -2.853 -0.601
231 HG2 GLN 32 1HG GLN 32 3.380 -1.437 -2.665
232 HG3 GLN 32 2HG GLN 32 1.838 -2.065 -2.086
233 HE21 GLN 32 1HE2 GLN 32 0.865 -0.561 -0.941
234 HE22 GLN 32 2HE2 GLN 32 1.602 0.448 0.252
235 H VAL 33 H VAL 33 3.864 -6.356 -2.425
236 HA VAL 33 HA VAL 33 5.542 -7.223 -0.414
237 HB VAL 33 HB VAL 33 4.894 -8.762 -2.931
238 HG11 VAL 33 1HG1 VAL 33 5.016 -10.309 -0.516
239 HG12 VAL 33 2HG1 VAL 33 5.934 -10.496 -2.011
240 HG13 VAL 33 3HG1 VAL 33 6.520 -9.418 -0.744
241 HG21 VAL 33 3HG2 VAL 33 3.305 -8.156 -0.477
242 HG22 VAL 33 1HG2 VAL 33 2.796 -8.200 -2.165
243 HG23 VAL 33 2HG2 VAL 33 3.089 -9.705 -1.293
244 H ILE 34 H ILE 34 6.291 -6.549 -3.779
245 HA ILE 34 HA ILE 34 8.799 -7.750 -3.961
246 HB ILE 34 HB ILE 34 9.271 -6.254 -5.794
247 HG12 ILE 34 1HG1 ILE 34 6.952 -4.636 -4.725
248 HG13 ILE 34 2HG1 ILE 34 8.635 -4.133 -4.837
249 HG21 ILE 34 1HG2 ILE 34 7.860 -7.826 -6.641
250 HG22 ILE 34 2HG2 ILE 34 6.558 -7.420 -5.524
251 HG23 ILE 34 3HG2 ILE 34 6.874 -6.392 -6.922
252 HD11 ILE 34 3HD1 ILE 34 7.764 -3.072 -6.651
253 HD12 ILE 34 1HD1 ILE 34 8.256 -4.594 -7.394
254 HD13 ILE 34 2HD1 ILE 34 6.568 -4.331 -6.954
255 H HIS 35 H HIS 35 7.816 -4.761 -2.450
256 HA HIS 35 HA HIS 35 10.566 -3.910 -2.029
257 HB2 HIS 35 1HB HIS 35 8.005 -2.642 -1.038
258 HB3 HIS 35 2HB HIS 35 9.607 -1.911 -1.036
259 HD1 HIS 35 HD1 HIS 35 10.659 -1.717 -3.607
260 HD2 HIS 35 HD2 HIS 35 6.532 -1.936 -3.187
261 HE1 HIS 35 HE1 HIS 35 9.716 -0.827 -5.761
262 H THR 36 H THR 36 8.193 -5.767 -0.453
263 HA THR 36 HA THR 36 9.237 -5.304 2.218
264 HB THR 36 HB THR 36 7.492 -6.663 3.036
265 HG1 THR 36 HG1 THR 36 6.223 -7.955 1.513
266 HG21 THR 36 3HG2 THR 36 5.571 -5.916 1.214
267 HG22 THR 36 1HG2 THR 36 6.859 -4.746 0.926
268 HG23 THR 36 2HG2 THR 36 6.170 -4.920 2.540
269 H GLY 37 H GLY 37 10.253 -6.881 3.498
270 HA2 GLY 37 1HA GLY 37 10.819 -9.509 2.725
271 HA3 GLY 37 2HA GLY 37 12.141 -8.496 2.164
272 H GLU 38 H GLU 38 11.385 -10.527 4.524
273 HA GLU 38 HA GLU 38 13.214 -9.233 6.400
274 HB2 GLU 38 1HB GLU 38 11.086 -8.620 7.310
275 HB3 GLU 38 2HB GLU 38 10.463 -10.251 7.105
276 HG2 GLU 38 1HG GLU 38 11.643 -11.074 8.910
277 HG3 GLU 38 2HG GLU 38 12.825 -9.768 8.863
278 H LYS 39 H LYS 39 14.829 -10.624 6.608
279 HA LYS 39 HA LYS 39 14.189 -13.478 6.948
280 HB2 LYS 39 1HB LYS 39 15.286 -12.676 4.693
281 HB3 LYS 39 2HB LYS 39 16.756 -12.641 5.658
282 HG2 LYS 39 1HG LYS 39 15.043 -15.083 5.667
283 HG3 LYS 39 2HG LYS 39 16.127 -14.771 4.309
284 HD2 LYS 39 1HD LYS 39 17.061 -14.727 7.169
285 HD3 LYS 39 2HD LYS 39 17.044 -16.202 6.199
286 HE2 LYS 39 1HE LYS 39 18.358 -13.744 5.127
287 HE3 LYS 39 2HE LYS 39 19.198 -14.725 6.328
288 HZ1 LYS 39 3HZ LYS 39 19.798 -16.084 4.706
289 HZ2 LYS 39 1HZ LYS 39 18.924 -15.187 3.569
290 HZ3 LYS 39 2HZ LYS 39 18.176 -16.455 4.402
291 H ARG 40 H ARG 40 14.297 -13.107 9.223
292 HA ARG 40 HA ARG 40 17.035 -12.682 10.226
293 HB2 ARG 40 1HB ARG 40 15.573 -10.917 10.992
294 HB3 ARG 40 2HB ARG 40 14.383 -12.088 11.545
295 HG2 ARG 40 1HG ARG 40 17.120 -12.239 12.684
296 HG3 ARG 40 2HG ARG 40 16.068 -10.920 13.203
297 HD2 ARG 40 1HD ARG 40 14.315 -12.800 13.556
298 HD3 ARG 40 2HD ARG 40 15.714 -13.872 13.542
299 HE ARG 40 HE ARG 40 16.172 -13.177 15.659
300 HH11 ARG 40 1HH1 ARG 40 14.259 -10.728 14.090
301 HH12 ARG 40 2HH1 ARG 40 14.138 -9.732 15.502
302 HH21 ARG 40 1HH2 ARG 40 16.020 -11.875 17.525
303 HH22 ARG 40 2HH2 ARG 40 15.142 -10.385 17.456
304 H SER 41 H SER 41 17.914 -14.598 10.663
305 HA SER 41 HA SER 41 16.535 -16.393 12.486
306 HB2 SER 41 1HB SER 41 16.638 -18.326 11.126
307 HB3 SER 41 2HB SER 41 15.986 -17.070 10.074
308 HG SER 41 HG SER 41 17.560 -17.803 8.841
309 H GLY 42 H GLY 42 17.913 -17.684 13.696
310 HA2 GLY 42 1HA GLY 42 20.729 -16.883 13.565
311 HA3 GLY 42 2HA GLY 42 19.931 -17.632 14.940
312 HA PRO 43 HA PRO 43 21.991 -21.337 13.709
313 HB2 PRO 43 1HB PRO 43 20.668 -23.040 15.357
314 HB3 PRO 43 2HB PRO 43 21.915 -21.925 15.928
315 HG2 PRO 43 1HG PRO 43 18.936 -21.650 16.035
316 HG3 PRO 43 2HG PRO 43 20.140 -21.274 17.282
317 HD2 PRO 43 1HD PRO 43 19.014 -19.368 15.723
318 HD3 PRO 43 2HD PRO 43 20.678 -19.245 16.330
319 H SER 44 H SER 44 21.362 -23.609 13.038
320 HA SER 44 HA SER 44 19.743 -23.586 10.812
321 HB2 SER 44 1HB SER 44 19.829 -26.032 10.876
322 HB3 SER 44 2HB SER 44 21.400 -25.352 11.299
323 HG SER 44 HG SER 44 20.169 -27.104 12.671
324 H SER 45 H SER 45 17.637 -24.093 10.353
325 HA SER 45 HA SER 45 15.814 -25.204 12.215
326 HB2 SER 45 1HB SER 45 15.943 -23.079 13.347
327 HB3 SER 45 2HB SER 45 15.719 -22.204 11.833
328 HG SER 45 HG SER 45 13.628 -23.333 11.735
329 H GLY 46 H GLY 46 14.200 -26.096 11.093
330 HA2 GLY 46 1HA GLY 46 12.644 -26.446 9.426
331 HA3 GLY 46 2HA GLY 46 12.980 -24.824 8.838
Start of MODEL 10
1 H1 GLY 1 H GLY 1 1.177 17.586 -29.356
2 HA2 GLY 1 1HA GLY 1 1.271 17.840 -26.819
3 HA3 GLY 1 2HA GLY 1 -0.475 17.988 -26.946
4 H SER 2 H SER 2 -1.715 16.162 -27.526
5 HA SER 2 HA SER 2 -2.278 13.957 -27.535
6 HB2 SER 2 1HB SER 2 -0.304 14.022 -29.287
7 HB3 SER 2 2HB SER 2 0.551 13.120 -28.036
8 HG SER 2 HG SER 2 -1.141 12.170 -29.794
9 H SER 3 H SER 3 -1.718 15.136 -25.091
10 HA SER 3 HA SER 3 -0.326 13.009 -23.605
11 HB2 SER 3 1HB SER 3 -0.813 15.913 -22.931
12 HB3 SER 3 2HB SER 3 -0.234 14.740 -21.748
13 HG SER 3 HG SER 3 1.668 14.712 -22.688
14 H GLY 4 H GLY 4 -3.091 15.246 -23.311
15 HA2 GLY 4 1HA GLY 4 -5.240 14.825 -22.571
16 HA3 GLY 4 2HA GLY 4 -4.821 13.123 -22.450
17 H SER 5 H SER 5 -6.331 13.705 -20.503
18 HA SER 5 HA SER 5 -4.732 13.513 -18.166
19 HB2 SER 5 1HB SER 5 -5.342 15.565 -17.043
20 HB3 SER 5 2HB SER 5 -4.597 15.977 -18.587
21 HG SER 5 HG SER 5 -6.652 17.072 -17.964
22 H SER 6 H SER 6 -5.824 12.022 -17.088
23 HA SER 6 HA SER 6 -8.534 12.443 -16.274
24 HB2 SER 6 1HB SER 6 -9.032 11.600 -18.488
25 HB3 SER 6 2HB SER 6 -7.940 10.234 -18.257
26 HG SER 6 HG SER 6 -9.391 9.257 -17.044
27 H GLY 7 H GLY 7 -8.691 11.653 -14.283
28 HA2 GLY 7 1HA GLY 7 -7.856 9.065 -13.518
29 HA3 GLY 7 2HA GLY 7 -6.649 10.237 -13.008
30 H THR 8 H THR 8 -10.157 9.654 -12.883
31 HA THR 8 HA THR 8 -10.116 10.626 -10.106
32 HB THR 8 HB THR 8 -12.428 11.553 -10.506
33 HG1 THR 8 HG1 THR 8 -12.424 10.339 -12.681
34 HG21 THR 8 3HG2 THR 8 -10.351 12.943 -10.408
35 HG22 THR 8 1HG2 THR 8 -11.642 13.644 -11.382
36 HG23 THR 8 2HG2 THR 8 -10.273 12.857 -12.167
37 H LYS 9 H LYS 9 -10.815 9.126 -8.746
38 HA LYS 9 HA LYS 9 -11.991 7.398 -7.841
39 HB2 LYS 9 1HB LYS 9 -13.923 8.650 -8.990
40 HB3 LYS 9 2HB LYS 9 -13.803 7.424 -10.245
41 HG2 LYS 9 1HG LYS 9 -14.140 5.693 -8.478
42 HG3 LYS 9 2HG LYS 9 -14.460 7.003 -7.340
43 HD2 LYS 9 1HD LYS 9 -15.978 6.962 -9.898
44 HD3 LYS 9 2HD LYS 9 -16.413 5.788 -8.653
45 HE2 LYS 9 1HE LYS 9 -17.775 7.523 -8.054
46 HE3 LYS 9 2HE LYS 9 -16.344 7.920 -7.105
47 HZ1 LYS 9 3HZ LYS 9 -16.336 9.873 -8.122
48 HZ2 LYS 9 1HZ LYS 9 -17.583 9.412 -9.168
49 HZ3 LYS 9 2HZ LYS 9 -15.973 9.091 -9.578
50 H GLU 10 H GLU 10 -9.724 6.883 -9.414
51 HA GLU 10 HA GLU 10 -10.178 4.101 -10.020
52 HB2 GLU 10 1HB GLU 10 -9.824 4.084 -12.280
53 HB3 GLU 10 2HB GLU 10 -10.633 5.638 -12.131
54 HG2 GLU 10 1HG GLU 10 -8.312 6.654 -11.946
55 HG3 GLU 10 2HG GLU 10 -7.707 5.090 -12.488
56 H LYS 11 H LYS 11 -8.377 2.891 -9.711
57 HA LYS 11 HA LYS 11 -6.373 2.505 -8.617
58 HB2 LYS 11 1HB LYS 11 -5.405 4.117 -10.983
59 HB3 LYS 11 2HB LYS 11 -4.503 2.888 -10.106
60 HG2 LYS 11 1HG LYS 11 -6.560 1.387 -10.835
61 HG3 LYS 11 2HG LYS 11 -6.654 2.591 -12.123
62 HD2 LYS 11 1HD LYS 11 -4.155 2.169 -12.456
63 HD3 LYS 11 2HD LYS 11 -4.385 0.737 -11.450
64 HE2 LYS 11 1HE LYS 11 -6.217 0.058 -13.043
65 HE3 LYS 11 2HE LYS 11 -5.681 1.367 -14.094
66 HZ1 LYS 11 3HZ LYS 11 -4.666 -0.676 -14.783
67 HZ2 LYS 11 1HZ LYS 11 -4.073 -0.972 -13.226
68 HZ3 LYS 11 2HZ LYS 11 -3.467 0.323 -14.129
69 HA PRO 12 HA PRO 12 -6.017 6.949 -7.009
70 HB2 PRO 12 1HB PRO 12 -7.214 6.540 -4.607
71 HB3 PRO 12 2HB PRO 12 -8.103 7.037 -6.051
72 HG2 PRO 12 1HG PRO 12 -7.812 4.310 -4.852
73 HG3 PRO 12 2HG PRO 12 -9.259 5.093 -5.513
74 HD2 PRO 12 1HD PRO 12 -7.822 3.271 -6.909
75 HD3 PRO 12 2HD PRO 12 -8.675 4.617 -7.691
76 H TYR 13 H TYR 13 -5.581 3.762 -5.586
77 HA TYR 13 HA TYR 13 -3.726 4.631 -3.584
78 HB2 TYR 13 1HB TYR 13 -4.591 1.945 -4.620
79 HB3 TYR 13 2HB TYR 13 -3.248 2.089 -3.491
80 HD1 TYR 13 HD1 TYR 13 -6.175 4.313 -3.381
81 HD2 TYR 13 HD2 TYR 13 -4.321 0.861 -1.722
82 HE1 TYR 13 HE1 TYR 13 -7.765 4.368 -1.505
83 HE2 TYR 13 HE2 TYR 13 -5.906 0.906 0.158
84 HH TYR 13 HH TYR 13 -7.543 2.037 1.160
85 H LYS 14 H LYS 14 -1.746 5.312 -4.019
86 HA LYS 14 HA LYS 14 -0.320 4.148 -6.318
87 HB2 LYS 14 1HB LYS 14 -0.577 6.478 -6.682
88 HB3 LYS 14 2HB LYS 14 -0.144 6.862 -5.022
89 HG2 LYS 14 1HG LYS 14 2.115 6.516 -5.393
90 HG3 LYS 14 2HG LYS 14 1.829 5.528 -6.827
91 HD2 LYS 14 1HD LYS 14 1.380 7.380 -8.164
92 HD3 LYS 14 2HD LYS 14 1.028 8.415 -6.778
93 HE2 LYS 14 1HE LYS 14 3.421 8.285 -6.139
94 HE3 LYS 14 2HE LYS 14 3.731 7.365 -7.611
95 HZ1 LYS 14 3HZ LYS 14 3.170 10.206 -7.281
96 HZ2 LYS 14 1HZ LYS 14 2.515 9.458 -8.650
97 HZ3 LYS 14 2HZ LYS 14 4.185 9.424 -8.385
98 H CYS 15 H CYS 15 1.476 3.008 -5.961
99 HA CYS 15 HA CYS 15 2.303 2.390 -3.316
100 HB2 CYS 15 1HB CYS 15 2.471 0.812 -5.229
101 HB3 CYS 15 2HB CYS 15 3.738 1.821 -5.918
102 H TYR 16 H TYR 16 3.236 3.925 -2.107
103 HA TYR 16 HA TYR 16 4.837 6.024 -3.114
104 HB2 TYR 16 1HB TYR 16 4.901 5.004 -0.276
105 HB3 TYR 16 2HB TYR 16 5.199 6.642 -0.847
106 HD1 TYR 16 HD1 TYR 16 2.876 6.982 -2.685
107 HD2 TYR 16 HD2 TYR 16 3.114 5.290 1.212
108 HE1 TYR 16 HE1 TYR 16 0.514 7.549 -2.301
109 HE2 TYR 16 HE2 TYR 16 0.752 5.851 1.606
110 HH TYR 16 HH TYR 16 -1.285 7.125 -0.948
111 H GLU 17 H GLU 17 5.516 2.767 -2.663
112 HA GLU 17 HA GLU 17 8.263 2.973 -1.897
113 HB2 GLU 17 1HB GLU 17 7.012 0.634 -3.324
114 HB3 GLU 17 2HB GLU 17 8.377 0.628 -2.217
115 HG2 GLU 17 1HG GLU 17 6.605 1.532 -0.515
116 HG3 GLU 17 2HG GLU 17 5.465 0.791 -1.637
117 H CYS 18 H CYS 18 6.622 2.255 -4.975
118 HA CYS 18 HA CYS 18 9.103 3.027 -6.368
119 HB2 CYS 18 1HB CYS 18 8.509 1.514 -8.158
120 HB3 CYS 18 2HB CYS 18 8.478 0.631 -6.635
121 H GLY 19 H GLY 19 5.577 3.189 -6.378
122 HA2 GLY 19 1HA GLY 19 4.717 5.475 -6.902
123 HA3 GLY 19 2HA GLY 19 5.773 5.421 -8.306
124 H LYS 20 H LYS 20 4.368 2.424 -7.603
125 HA LYS 20 HA LYS 20 2.907 2.377 -10.032
126 HB2 LYS 20 1HB LYS 20 3.089 0.515 -7.677
127 HB3 LYS 20 2HB LYS 20 1.974 0.201 -9.000
128 HG2 LYS 20 1HG LYS 20 4.799 0.755 -9.701
129 HG3 LYS 20 2HG LYS 20 4.429 -0.795 -8.940
130 HD2 LYS 20 1HD LYS 20 2.704 0.099 -11.189
131 HD3 LYS 20 2HD LYS 20 4.334 -0.461 -11.571
132 HE2 LYS 20 1HE LYS 20 2.642 -2.102 -9.750
133 HE3 LYS 20 2HE LYS 20 2.298 -2.130 -11.479
134 HZ1 LYS 20 3HZ LYS 20 4.221 -3.584 -10.143
135 HZ2 LYS 20 1HZ LYS 20 5.079 -2.409 -11.006
136 HZ3 LYS 20 2HZ LYS 20 4.025 -3.453 -11.818
137 H ALA 21 H ALA 21 0.529 1.406 -9.851
138 HA ALA 21 HA ALA 21 -1.015 2.969 -7.906
139 HB1 ALA 21 3HB ALA 21 -1.395 3.003 -10.892
140 HB2 ALA 21 1HB ALA 21 -2.616 3.563 -9.749
141 HB3 ALA 21 2HB ALA 21 -1.047 4.366 -9.828
142 H PHE 22 H PHE 22 -3.228 2.230 -7.648
143 HA PHE 22 HA PHE 22 -4.062 -0.242 -8.836
144 HB2 PHE 22 1HB PHE 22 -3.478 -0.296 -5.873
145 HB3 PHE 22 2HB PHE 22 -4.024 -1.632 -6.879
146 HD1 PHE 22 HD1 PHE 22 -1.174 0.501 -6.000
147 HD2 PHE 22 HD2 PHE 22 -2.495 -2.862 -8.251
148 HE1 PHE 22 HE1 PHE 22 1.166 -0.149 -6.397
149 HE2 PHE 22 HE2 PHE 22 -0.158 -3.517 -8.650
150 HZ PHE 22 HZ PHE 22 1.677 -2.161 -7.722
151 H ARG 23 H ARG 23 -6.229 -0.736 -8.412
152 HA ARG 23 HA ARG 23 -7.871 1.482 -7.770
153 HB2 ARG 23 1HB ARG 23 -8.610 -1.438 -8.045
154 HB3 ARG 23 2HB ARG 23 -9.744 -0.094 -8.030
155 HG2 ARG 23 1HG ARG 23 -8.275 0.744 -10.040
156 HG3 ARG 23 2HG ARG 23 -7.863 -0.968 -10.157
157 HD2 ARG 23 1HD ARG 23 -10.007 -1.586 -10.701
158 HD3 ARG 23 2HD ARG 23 -10.727 -0.197 -9.888
159 HE ARG 23 HE ARG 23 -10.465 1.041 -11.813
160 HH11 ARG 23 1HH1 ARG 23 -8.759 -1.980 -12.099
161 HH12 ARG 23 2HH1 ARG 23 -8.459 -1.799 -13.796
162 HH21 ARG 23 1HH2 ARG 23 -10.077 1.291 -14.046
163 HH22 ARG 23 2HH2 ARG 23 -9.208 0.062 -14.903
164 H THR 24 H THR 24 -7.583 -1.681 -6.140
165 HA THR 24 HA THR 24 -8.566 -0.416 -3.676
166 HB THR 24 HB THR 24 -9.266 -2.540 -2.911
167 HG1 THR 24 HG1 THR 24 -7.955 -4.140 -3.357
168 HG21 THR 24 3HG2 THR 24 -9.806 -2.145 -5.838
169 HG22 THR 24 1HG2 THR 24 -10.863 -1.820 -4.465
170 HG23 THR 24 2HG2 THR 24 -10.526 -3.484 -4.945
171 H ARG 25 H ARG 25 -7.673 -1.907 -1.701
172 HA ARG 25 HA ARG 25 -4.906 -1.208 -1.520
173 HB2 ARG 25 1HB ARG 25 -6.334 -1.026 0.434
174 HB3 ARG 25 2HB ARG 25 -6.706 -2.743 0.361
175 HG2 ARG 25 1HG ARG 25 -5.104 -2.335 2.105
176 HG3 ARG 25 2HG ARG 25 -4.335 -3.247 0.804
177 HD2 ARG 25 1HD ARG 25 -3.162 -1.358 0.033
178 HD3 ARG 25 2HD ARG 25 -4.167 -0.253 0.970
179 HE ARG 25 HE ARG 25 -3.030 -1.689 2.906
180 HH11 ARG 25 1HH1 ARG 25 -1.667 -0.193 0.073
181 HH12 ARG 25 2HH1 ARG 25 -0.121 0.084 0.803
182 HH21 ARG 25 1HH2 ARG 25 -0.998 -1.330 3.879
183 HH22 ARG 25 2HH2 ARG 25 0.259 -0.564 2.968
184 H SER 26 H SER 26 -6.597 -4.338 -1.217
185 HA SER 26 HA SER 26 -4.494 -6.047 -1.048
186 HB2 SER 26 1HB SER 26 -6.968 -6.629 -1.106
187 HB3 SER 26 2HB SER 26 -6.844 -6.604 -2.865
188 HG SER 26 HG SER 26 -4.934 -8.107 -1.538
189 H ASN 27 H ASN 27 -5.756 -4.576 -4.009
190 HA ASN 27 HA ASN 27 -4.061 -5.945 -5.804
191 HB2 ASN 27 1HB ASN 27 -6.177 -4.594 -6.329
192 HB3 ASN 27 2HB ASN 27 -5.144 -3.169 -6.263
193 HD21 ASN 27 1HD2 ASN 27 -4.795 -6.438 -7.604
194 HD22 ASN 27 2HD2 ASN 27 -4.347 -5.921 -9.190
195 H LEU 28 H LEU 28 -3.637 -3.089 -3.841
196 HA LEU 28 HA LEU 28 -1.202 -2.283 -5.164
197 HB2 LEU 28 1HB LEU 28 -2.253 -0.442 -4.308
198 HB3 LEU 28 2HB LEU 28 -2.834 -1.303 -2.884
199 HG LEU 28 HG LEU 28 -0.557 -1.205 -1.934
200 HD11 LEU 28 1HD1 LEU 28 0.769 -1.103 -3.929
201 HD12 LEU 28 2HD1 LEU 28 1.065 0.355 -2.983
202 HD13 LEU 28 3HD1 LEU 28 0.022 0.423 -4.403
203 HD21 LEU 28 3HD2 LEU 28 -0.675 1.049 -1.239
204 HD22 LEU 28 1HD2 LEU 28 -2.337 0.547 -1.545
205 HD23 LEU 28 2HD2 LEU 28 -1.486 1.545 -2.725
206 H THR 29 H THR 29 -1.932 -3.294 -1.819
207 HA THR 29 HA THR 29 0.642 -3.643 -0.916
208 HB THR 29 HB THR 29 -1.853 -5.186 -0.205
209 HG1 THR 29 HG1 THR 29 -1.592 -2.858 0.295
210 HG21 THR 29 3HG2 THR 29 -0.407 -5.616 1.942
211 HG22 THR 29 1HG2 THR 29 0.941 -5.429 0.822
212 HG23 THR 29 2HG2 THR 29 -0.268 -6.683 0.545
213 H THR 30 H THR 30 -1.397 -5.997 -2.615
214 HA THR 30 HA THR 30 0.178 -8.243 -2.486
215 HB THR 30 HB THR 30 -1.591 -7.224 -4.697
216 HG1 THR 30 HG1 THR 30 -2.973 -8.776 -3.880
217 HG21 THR 30 3HG2 THR 30 -0.033 -9.805 -4.609
218 HG22 THR 30 1HG2 THR 30 0.037 -8.551 -5.847
219 HG23 THR 30 2HG2 THR 30 -1.419 -9.531 -5.665
220 H HIS 31 H HIS 31 0.695 -5.346 -4.349
221 HA HIS 31 HA HIS 31 2.871 -6.562 -5.862
222 HB2 HIS 31 1HB HIS 31 1.797 -5.153 -7.315
223 HB3 HIS 31 2HB HIS 31 1.314 -4.035 -6.044
224 HD1 HIS 31 HD1 HIS 31 4.108 -4.790 -8.405
225 HD2 HIS 31 HD2 HIS 31 3.150 -1.994 -5.485
226 HE1 HIS 31 HE1 HIS 31 5.795 -2.943 -8.664
227 H GLN 32 H GLN 32 2.326 -4.270 -3.264
228 HA GLN 32 HA GLN 32 4.874 -3.140 -3.101
229 HB2 GLN 32 1HB GLN 32 2.803 -3.680 -0.976
230 HB3 GLN 32 2HB GLN 32 4.284 -2.787 -0.662
231 HG2 GLN 32 1HG GLN 32 3.424 -1.395 -2.754
232 HG3 GLN 32 2HG GLN 32 1.870 -1.994 -2.176
233 HE21 GLN 32 1HE2 GLN 32 0.952 -0.317 -1.206
234 HE22 GLN 32 2HE2 GLN 32 1.676 0.648 0.031
235 H VAL 33 H VAL 33 3.875 -6.326 -2.504
236 HA VAL 33 HA VAL 33 5.517 -7.182 -0.442
237 HB VAL 33 HB VAL 33 4.874 -8.758 -2.937
238 HG11 VAL 33 1HG1 VAL 33 5.187 -10.710 -1.585
239 HG12 VAL 33 2HG1 VAL 33 6.621 -9.694 -1.425
240 HG13 VAL 33 3HG1 VAL 33 5.416 -9.730 -0.137
241 HG21 VAL 33 3HG2 VAL 33 2.769 -8.148 -2.229
242 HG22 VAL 33 1HG2 VAL 33 3.023 -9.630 -1.308
243 HG23 VAL 33 2HG2 VAL 33 3.247 -8.061 -0.534
244 H ILE 34 H ILE 34 6.303 -6.448 -3.767
245 HA ILE 34 HA ILE 34 8.799 -7.722 -3.930
246 HB ILE 34 HB ILE 34 9.287 -6.273 -5.795
247 HG12 ILE 34 1HG1 ILE 34 6.965 -4.619 -4.787
248 HG13 ILE 34 2HG1 ILE 34 8.653 -4.127 -4.879
249 HG21 ILE 34 1HG2 ILE 34 6.859 -6.411 -6.900
250 HG22 ILE 34 2HG2 ILE 34 7.880 -7.826 -6.653
251 HG23 ILE 34 3HG2 ILE 34 6.593 -7.456 -5.505
252 HD11 ILE 34 3HD1 ILE 34 6.640 -4.413 -7.053
253 HD12 ILE 34 1HD1 ILE 34 7.756 -3.090 -6.714
254 HD13 ILE 34 2HD1 ILE 34 8.355 -4.591 -7.421
255 H HIS 35 H HIS 35 7.805 -4.774 -2.392
256 HA HIS 35 HA HIS 35 10.554 -3.879 -2.017
257 HB2 HIS 35 1HB HIS 35 7.984 -2.626 -1.031
258 HB3 HIS 35 2HB HIS 35 9.580 -1.883 -1.022
259 HD1 HIS 35 HD1 HIS 35 10.643 -1.669 -3.581
260 HD2 HIS 35 HD2 HIS 35 6.516 -1.950 -3.195
261 HE1 HIS 35 HE1 HIS 35 9.704 -0.793 -5.743
262 H THR 36 H THR 36 8.354 -5.892 -0.490
263 HA THR 36 HA THR 36 9.331 -5.352 2.206
264 HB THR 36 HB THR 36 7.637 -6.781 3.018
265 HG1 THR 36 HG1 THR 36 6.365 -7.937 1.199
266 HG21 THR 36 3HG2 THR 36 6.505 -4.855 2.425
267 HG22 THR 36 1HG2 THR 36 5.591 -6.080 1.546
268 HG23 THR 36 2HG2 THR 36 6.785 -5.096 0.700
269 H GLY 37 H GLY 37 11.276 -6.281 0.382
270 HA2 GLY 37 1HA GLY 37 11.675 -9.094 1.132
271 HA3 GLY 37 2HA GLY 37 12.525 -8.245 -0.150
272 H GLU 38 H GLU 38 14.582 -7.858 0.281
273 HA GLU 38 HA GLU 38 15.756 -8.271 2.797
274 HB2 GLU 38 1HB GLU 38 16.881 -8.349 0.517
275 HB3 GLU 38 2HB GLU 38 16.944 -6.593 0.591
276 HG2 GLU 38 1HG GLU 38 18.043 -8.142 2.875
277 HG3 GLU 38 2HG GLU 38 18.964 -8.084 1.373
278 H LYS 39 H LYS 39 15.453 -5.189 1.021
279 HA LYS 39 HA LYS 39 16.015 -3.650 3.375
280 HB2 LYS 39 1HB LYS 39 15.420 -1.707 1.876
281 HB3 LYS 39 2HB LYS 39 16.737 -2.724 1.306
282 HG2 LYS 39 1HG LYS 39 15.426 -3.684 -0.371
283 HG3 LYS 39 2HG LYS 39 13.920 -3.148 0.376
284 HD2 LYS 39 1HD LYS 39 15.972 -1.206 -0.648
285 HD3 LYS 39 2HD LYS 39 14.717 -1.880 -1.691
286 HE2 LYS 39 1HE LYS 39 14.016 -0.589 0.920
287 HE3 LYS 39 2HE LYS 39 14.298 0.388 -0.520
288 HZ1 LYS 39 3HZ LYS 39 12.010 -0.016 -0.479
289 HZ2 LYS 39 1HZ LYS 39 12.200 -1.648 -0.076
290 HZ3 LYS 39 2HZ LYS 39 12.604 -1.108 -1.627
291 H ARG 40 H ARG 40 14.340 -4.441 4.779
292 HA ARG 40 HA ARG 40 11.596 -3.737 4.104
293 HB2 ARG 40 1HB ARG 40 12.285 -5.906 5.266
294 HB3 ARG 40 2HB ARG 40 12.564 -4.925 6.699
295 HG2 ARG 40 1HG ARG 40 10.152 -4.126 6.394
296 HG3 ARG 40 2HG ARG 40 9.983 -5.494 5.292
297 HD2 ARG 40 1HD ARG 40 10.281 -7.053 6.975
298 HD3 ARG 40 2HD ARG 40 11.129 -5.913 8.019
299 HE ARG 40 HE ARG 40 9.099 -5.157 8.810
300 HH11 ARG 40 1HH1 ARG 40 8.610 -7.263 6.082
301 HH12 ARG 40 2HH1 ARG 40 6.899 -7.394 6.324
302 HH21 ARG 40 1HH2 ARG 40 6.848 -5.321 9.139
303 HH22 ARG 40 2HH2 ARG 40 5.898 -6.287 8.062
304 H SER 41 H SER 41 13.927 -3.042 6.708
305 HA SER 41 HA SER 41 12.285 -0.924 7.765
306 HB2 SER 41 1HB SER 41 14.128 -0.589 9.360
307 HB3 SER 41 2HB SER 41 13.681 -2.292 9.258
308 HG SER 41 HG SER 41 16.014 -1.711 9.168
309 H GLY 42 H GLY 42 12.073 0.571 6.091
310 HA2 GLY 42 1HA GLY 42 14.561 2.014 5.408
311 HA3 GLY 42 2HA GLY 42 13.234 1.806 4.275
312 HA PRO 43 HA PRO 43 12.087 5.878 5.614
313 HB2 PRO 43 1HB PRO 43 9.835 6.062 4.110
314 HB3 PRO 43 2HB PRO 43 11.458 6.246 3.435
315 HG2 PRO 43 1HG PRO 43 9.658 3.854 3.413
316 HG3 PRO 43 2HG PRO 43 10.662 4.511 2.107
317 HD2 PRO 43 1HD PRO 43 11.417 2.377 3.592
318 HD3 PRO 43 2HD PRO 43 12.584 3.536 2.924
319 H SER 44 H SER 44 11.415 5.855 7.699
320 HA SER 44 HA SER 44 9.528 4.266 8.901
321 HB2 SER 44 1HB SER 44 9.442 5.877 10.683
322 HB3 SER 44 2HB SER 44 11.086 5.883 10.045
323 HG SER 44 HG SER 44 10.493 7.741 8.817
324 H SER 45 H SER 45 7.495 3.917 8.323
325 HA SER 45 HA SER 45 5.757 6.222 7.819
326 HB2 SER 45 1HB SER 45 5.993 3.788 6.037
327 HB3 SER 45 2HB SER 45 4.667 4.948 5.945
328 HG SER 45 HG SER 45 6.278 5.487 4.456
329 H GLY 46 H GLY 46 3.598 5.933 8.397
330 HA2 GLY 46 1HA GLY 46 2.104 3.780 8.929
331 HA3 GLY 46 2HA GLY 46 3.166 3.803 10.328
Start of MODEL 11
1 H1 GLY 1 H GLY 1 1.216 12.160 -18.162
2 HA2 GLY 1 1HA GLY 1 3.372 13.629 -19.476
3 HA3 GLY 1 2HA GLY 1 2.871 12.120 -20.226
4 H SER 2 H SER 2 0.177 12.140 -19.988
5 HA SER 2 HA SER 2 -0.551 14.433 -21.670
6 HB2 SER 2 1HB SER 2 -0.951 12.341 -22.772
7 HB3 SER 2 2HB SER 2 -1.781 11.689 -21.359
8 HG SER 2 HG SER 2 -3.548 12.682 -21.939
9 H SER 3 H SER 3 -1.120 16.005 -20.230
10 HA SER 3 HA SER 3 -2.952 15.391 -18.057
11 HB2 SER 3 1HB SER 3 -1.111 16.911 -17.578
12 HB3 SER 3 2HB SER 3 -1.624 17.986 -18.879
13 HG SER 3 HG SER 3 -3.678 18.097 -17.642
14 H GLY 4 H GLY 4 -4.943 16.568 -17.748
15 HA2 GLY 4 1HA GLY 4 -6.993 17.328 -18.444
16 HA3 GLY 4 2HA GLY 4 -6.125 18.222 -19.683
17 H SER 5 H SER 5 -6.655 14.749 -19.079
18 HA SER 5 HA SER 5 -8.152 14.533 -21.564
19 HB2 SER 5 1HB SER 5 -5.552 14.215 -21.893
20 HB3 SER 5 2HB SER 5 -5.881 12.613 -21.233
21 HG SER 5 HG SER 5 -7.713 12.830 -22.962
22 H SER 6 H SER 6 -9.674 12.977 -21.484
23 HA SER 6 HA SER 6 -10.209 11.693 -19.006
24 HB2 SER 6 1HB SER 6 -12.109 10.664 -20.192
25 HB3 SER 6 2HB SER 6 -12.014 12.395 -20.512
26 HG SER 6 HG SER 6 -12.369 11.156 -22.418
27 H GLY 7 H GLY 7 -8.607 10.275 -18.427
28 HA2 GLY 7 1HA GLY 7 -8.240 7.953 -20.220
29 HA3 GLY 7 2HA GLY 7 -6.941 8.611 -19.236
30 H THR 8 H THR 8 -6.490 7.369 -17.558
31 HA THR 8 HA THR 8 -8.486 5.546 -16.503
32 HB THR 8 HB THR 8 -5.576 5.921 -15.773
33 HG1 THR 8 HG1 THR 8 -5.483 3.815 -16.872
34 HG21 THR 8 3HG2 THR 8 -6.098 4.793 -13.910
35 HG22 THR 8 1HG2 THR 8 -6.362 3.401 -14.958
36 HG23 THR 8 2HG2 THR 8 -7.721 4.424 -14.493
37 H LYS 9 H LYS 9 -9.946 6.856 -15.413
38 HA LYS 9 HA LYS 9 -9.063 8.740 -13.422
39 HB2 LYS 9 1HB LYS 9 -11.177 8.918 -14.844
40 HB3 LYS 9 2HB LYS 9 -11.869 7.700 -13.781
41 HG2 LYS 9 1HG LYS 9 -12.617 9.566 -12.733
42 HG3 LYS 9 2HG LYS 9 -11.061 9.394 -11.916
43 HD2 LYS 9 1HD LYS 9 -10.071 11.082 -13.227
44 HD3 LYS 9 2HD LYS 9 -11.385 11.050 -14.405
45 HE2 LYS 9 1HE LYS 9 -11.790 12.980 -13.156
46 HE3 LYS 9 2HE LYS 9 -12.886 11.786 -12.463
47 HZ1 LYS 9 3HZ LYS 9 -10.291 11.870 -11.210
48 HZ2 LYS 9 1HZ LYS 9 -11.831 11.846 -10.510
49 HZ3 LYS 9 2HZ LYS 9 -11.170 13.306 -11.050
50 H GLU 10 H GLU 10 -8.928 5.538 -13.397
51 HA GLU 10 HA GLU 10 -9.829 5.254 -10.611
52 HB2 GLU 10 1HB GLU 10 -10.483 3.681 -12.710
53 HB3 GLU 10 2HB GLU 10 -9.045 2.846 -12.140
54 HG2 GLU 10 1HG GLU 10 -10.568 1.765 -10.878
55 HG3 GLU 10 2HG GLU 10 -10.284 3.136 -9.806
56 H LYS 11 H LYS 11 -8.429 3.238 -9.644
57 HA LYS 11 HA LYS 11 -6.424 2.542 -8.811
58 HB2 LYS 11 1HB LYS 11 -5.023 4.091 -10.980
59 HB3 LYS 11 2HB LYS 11 -4.466 2.655 -10.132
60 HG2 LYS 11 1HG LYS 11 -6.638 1.617 -11.245
61 HG3 LYS 11 2HG LYS 11 -6.341 2.910 -12.410
62 HD2 LYS 11 1HD LYS 11 -4.195 2.076 -12.937
63 HD3 LYS 11 2HD LYS 11 -4.187 0.999 -11.538
64 HE2 LYS 11 1HE LYS 11 -4.649 -0.446 -13.289
65 HE3 LYS 11 2HE LYS 11 -6.254 -0.079 -12.659
66 HZ1 LYS 11 3HZ LYS 11 -5.448 0.184 -15.249
67 HZ2 LYS 11 1HZ LYS 11 -5.423 1.774 -14.672
68 HZ3 LYS 11 2HZ LYS 11 -6.842 0.861 -14.571
69 HA PRO 12 HA PRO 12 -6.049 6.958 -7.175
70 HB2 PRO 12 1HB PRO 12 -7.366 6.543 -4.837
71 HB3 PRO 12 2HB PRO 12 -8.179 7.056 -6.320
72 HG2 PRO 12 1HG PRO 12 -7.968 4.320 -5.126
73 HG3 PRO 12 2HG PRO 12 -9.375 5.118 -5.852
74 HD2 PRO 12 1HD PRO 12 -7.885 3.293 -7.187
75 HD3 PRO 12 2HD PRO 12 -8.689 4.651 -8.002
76 H TYR 13 H TYR 13 -5.667 3.750 -5.806
77 HA TYR 13 HA TYR 13 -3.921 4.592 -3.689
78 HB2 TYR 13 1HB TYR 13 -4.754 1.923 -4.793
79 HB3 TYR 13 2HB TYR 13 -3.457 2.043 -3.609
80 HD1 TYR 13 HD1 TYR 13 -6.439 4.219 -3.650
81 HD2 TYR 13 HD2 TYR 13 -4.539 0.870 -1.839
82 HE1 TYR 13 HE1 TYR 13 -8.103 4.262 -1.839
83 HE2 TYR 13 HE2 TYR 13 -6.198 0.903 -0.023
84 HH TYR 13 HH TYR 13 -7.784 2.986 0.981
85 H LYS 14 H LYS 14 -1.916 5.262 -4.017
86 HA LYS 14 HA LYS 14 -0.387 4.114 -6.258
87 HB2 LYS 14 1HB LYS 14 -0.573 6.426 -6.657
88 HB3 LYS 14 2HB LYS 14 -0.327 6.827 -4.962
89 HG2 LYS 14 1HG LYS 14 1.969 6.479 -5.084
90 HG3 LYS 14 2HG LYS 14 1.841 5.523 -6.562
91 HD2 LYS 14 1HD LYS 14 1.453 7.421 -7.887
92 HD3 LYS 14 2HD LYS 14 1.062 8.423 -6.488
93 HE2 LYS 14 1HE LYS 14 3.427 8.164 -5.737
94 HE3 LYS 14 2HE LYS 14 3.767 7.334 -7.254
95 HZ1 LYS 14 3HZ LYS 14 4.356 9.677 -7.363
96 HZ2 LYS 14 1HZ LYS 14 2.763 10.118 -7.003
97 HZ3 LYS 14 2HZ LYS 14 3.113 9.322 -8.453
98 H CYS 15 H CYS 15 1.506 3.110 -5.871
99 HA CYS 15 HA CYS 15 2.169 2.414 -3.178
100 HB2 CYS 15 1HB CYS 15 2.443 0.864 -5.105
101 HB3 CYS 15 2HB CYS 15 3.737 1.893 -5.712
102 H TYR 16 H TYR 16 3.221 3.718 -1.844
103 HA TYR 16 HA TYR 16 4.770 5.938 -2.748
104 HB2 TYR 16 1HB TYR 16 4.712 4.797 0.047
105 HB3 TYR 16 2HB TYR 16 5.103 6.445 -0.433
106 HD1 TYR 16 HD1 TYR 16 2.876 6.946 -2.363
107 HD2 TYR 16 HD2 TYR 16 2.878 5.110 1.475
108 HE1 TYR 16 HE1 TYR 16 0.523 7.595 -2.058
109 HE2 TYR 16 HE2 TYR 16 0.525 5.753 1.791
110 HH TYR 16 HH TYR 16 -1.337 7.239 -0.797
111 H GLU 17 H GLU 17 5.457 2.682 -2.472
112 HA GLU 17 HA GLU 17 8.192 2.887 -1.615
113 HB2 GLU 17 1HB GLU 17 6.927 0.569 -3.072
114 HB3 GLU 17 2HB GLU 17 8.332 0.539 -2.015
115 HG2 GLU 17 1HG GLU 17 6.641 1.396 -0.223
116 HG3 GLU 17 2HG GLU 17 5.442 0.716 -1.321
117 H CYS 18 H CYS 18 6.562 2.302 -4.720
118 HA CYS 18 HA CYS 18 9.072 3.048 -6.074
119 HB2 CYS 18 1HB CYS 18 8.423 1.615 -7.930
120 HB3 CYS 18 2HB CYS 18 8.442 0.683 -6.436
121 H GLY 19 H GLY 19 5.538 3.221 -6.179
122 HA2 GLY 19 1HA GLY 19 4.686 5.527 -6.616
123 HA3 GLY 19 2HA GLY 19 5.803 5.557 -7.972
124 H LYS 20 H LYS 20 4.293 2.549 -7.404
125 HA LYS 20 HA LYS 20 2.973 2.613 -9.929
126 HB2 LYS 20 1HB LYS 20 3.154 0.641 -7.681
127 HB3 LYS 20 2HB LYS 20 1.966 0.398 -8.955
128 HG2 LYS 20 1HG LYS 20 4.797 0.916 -9.713
129 HG3 LYS 20 2HG LYS 20 4.346 -0.679 -9.105
130 HD2 LYS 20 1HD LYS 20 2.399 -0.430 -10.859
131 HD3 LYS 20 2HD LYS 20 3.518 0.711 -11.609
132 HE2 LYS 20 1HE LYS 20 5.256 -1.168 -11.384
133 HE3 LYS 20 2HE LYS 20 3.874 -2.227 -11.109
134 HZ1 LYS 20 3HZ LYS 20 3.003 -1.143 -13.275
135 HZ2 LYS 20 1HZ LYS 20 4.158 -2.375 -13.369
136 HZ3 LYS 20 2HZ LYS 20 4.628 -0.760 -13.543
137 H ALA 21 H ALA 21 0.582 1.482 -9.741
138 HA ALA 21 HA ALA 21 -1.032 3.035 -7.856
139 HB1 ALA 21 3HB ALA 21 -1.261 3.152 -10.848
140 HB2 ALA 21 1HB ALA 21 -2.606 3.567 -9.785
141 HB3 ALA 21 2HB ALA 21 -1.101 4.483 -9.703
142 H PHE 22 H PHE 22 -3.244 2.264 -7.673
143 HA PHE 22 HA PHE 22 -4.004 -0.206 -8.912
144 HB2 PHE 22 1HB PHE 22 -3.509 -0.281 -5.933
145 HB3 PHE 22 2HB PHE 22 -4.009 -1.615 -6.967
146 HD1 PHE 22 HD1 PHE 22 -1.215 0.514 -5.941
147 HD2 PHE 22 HD2 PHE 22 -2.423 -2.781 -8.349
148 HE1 PHE 22 HE1 PHE 22 1.144 -0.102 -6.275
149 HE2 PHE 22 HE2 PHE 22 -0.066 -3.403 -8.685
150 HZ PHE 22 HZ PHE 22 1.720 -2.064 -7.647
151 H ARG 23 H ARG 23 -6.175 -0.757 -8.530
152 HA ARG 23 HA ARG 23 -7.870 1.436 -7.926
153 HB2 ARG 23 1HB ARG 23 -8.649 -1.473 -8.167
154 HB3 ARG 23 2HB ARG 23 -9.701 -0.077 -8.360
155 HG2 ARG 23 1HG ARG 23 -8.126 0.576 -10.287
156 HG3 ARG 23 2HG ARG 23 -7.575 -1.099 -10.198
157 HD2 ARG 23 1HD ARG 23 -9.756 -1.925 -10.668
158 HD3 ARG 23 2HD ARG 23 -10.472 -0.327 -10.468
159 HE ARG 23 HE ARG 23 -9.838 0.198 -12.612
160 HH11 ARG 23 1HH1 ARG 23 -8.240 -2.727 -11.606
161 HH12 ARG 23 2HH1 ARG 23 -7.628 -3.090 -13.186
162 HH21 ARG 23 1HH2 ARG 23 -9.038 -0.270 -14.696
163 HH22 ARG 23 2HH2 ARG 23 -8.082 -1.692 -14.942
164 H THR 24 H THR 24 -7.450 -1.709 -6.296
165 HA THR 24 HA THR 24 -8.569 -0.501 -3.856
166 HB THR 24 HB THR 24 -9.246 -2.647 -3.129
167 HG1 THR 24 HG1 THR 24 -8.135 -3.998 -5.323
168 HG21 THR 24 3HG2 THR 24 -10.784 -1.861 -4.752
169 HG22 THR 24 1HG2 THR 24 -10.511 -3.562 -5.127
170 HG23 THR 24 2HG2 THR 24 -9.719 -2.310 -6.084
171 H ARG 25 H ARG 25 -7.691 -1.671 -1.809
172 HA ARG 25 HA ARG 25 -4.915 -1.084 -1.649
173 HB2 ARG 25 1HB ARG 25 -6.837 -1.063 0.176
174 HB3 ARG 25 2HB ARG 25 -6.268 -2.702 0.460
175 HG2 ARG 25 1HG ARG 25 -4.489 -0.277 0.504
176 HG3 ARG 25 2HG ARG 25 -5.248 -0.978 1.935
177 HD2 ARG 25 1HD ARG 25 -4.070 -3.050 1.606
178 HD3 ARG 25 2HD ARG 25 -3.421 -2.482 0.068
179 HE ARG 25 HE ARG 25 -1.854 -1.232 1.211
180 HH11 ARG 25 1HH1 ARG 25 -4.209 -2.523 3.427
181 HH12 ARG 25 2HH1 ARG 25 -3.298 -2.108 4.841
182 HH21 ARG 25 1HH2 ARG 25 -0.646 -0.681 3.066
183 HH22 ARG 25 2HH2 ARG 25 -1.272 -1.060 4.635
184 H SER 26 H SER 26 -6.725 -4.137 -1.315
185 HA SER 26 HA SER 26 -4.656 -5.890 -0.934
186 HB2 SER 26 1HB SER 26 -7.269 -6.249 -1.207
187 HB3 SER 26 2HB SER 26 -6.804 -6.703 -2.847
188 HG SER 26 HG SER 26 -5.882 -7.850 -0.421
189 H ASN 27 H ASN 27 -5.738 -4.454 -3.964
190 HA ASN 27 HA ASN 27 -4.050 -6.009 -5.645
191 HB2 ASN 27 1HB ASN 27 -6.157 -4.569 -6.229
192 HB3 ASN 27 2HB ASN 27 -4.989 -3.260 -6.395
193 HD21 ASN 27 1HD2 ASN 27 -5.548 -6.602 -7.427
194 HD22 ASN 27 2HD2 ASN 27 -4.908 -6.399 -9.018
195 H LEU 28 H LEU 28 -3.643 -3.051 -3.840
196 HA LEU 28 HA LEU 28 -1.204 -2.289 -5.159
197 HB2 LEU 28 1HB LEU 28 -2.186 -0.423 -4.313
198 HB3 LEU 28 2HB LEU 28 -2.855 -1.274 -2.923
199 HG LEU 28 HG LEU 28 -0.615 -1.248 -1.875
200 HD11 LEU 28 1HD1 LEU 28 0.443 -0.931 -4.269
201 HD12 LEU 28 2HD1 LEU 28 1.236 -0.308 -2.822
202 HD13 LEU 28 3HD1 LEU 28 0.300 0.777 -3.849
203 HD21 LEU 28 3HD2 LEU 28 -2.380 0.962 -2.315
204 HD22 LEU 28 1HD2 LEU 28 -0.723 1.547 -2.160
205 HD23 LEU 28 2HD2 LEU 28 -1.432 0.560 -0.882
206 H THR 29 H THR 29 -1.958 -3.397 -1.851
207 HA THR 29 HA THR 29 0.620 -3.688 -0.911
208 HB THR 29 HB THR 29 -1.852 -5.296 -0.269
209 HG1 THR 29 HG1 THR 29 -1.622 -3.967 1.691
210 HG21 THR 29 3HG2 THR 29 0.213 -6.595 0.217
211 HG22 THR 29 1HG2 THR 29 -0.707 -6.179 1.662
212 HG23 THR 29 2HG2 THR 29 0.753 -5.277 1.256
213 H THR 30 H THR 30 -1.367 -6.116 -2.588
214 HA THR 30 HA THR 30 0.263 -8.301 -2.516
215 HB THR 30 HB THR 30 -1.522 -7.283 -4.710
216 HG1 THR 30 HG1 THR 30 -2.910 -8.385 -3.570
217 HG21 THR 30 3HG2 THR 30 -1.259 -9.547 -5.759
218 HG22 THR 30 1HG2 THR 30 0.138 -9.802 -4.715
219 HG23 THR 30 2HG2 THR 30 0.153 -8.502 -5.907
220 H HIS 31 H HIS 31 0.732 -5.369 -4.340
221 HA HIS 31 HA HIS 31 2.942 -6.509 -5.857
222 HB2 HIS 31 1HB HIS 31 1.869 -5.070 -7.278
223 HB3 HIS 31 2HB HIS 31 1.350 -4.002 -5.977
224 HD1 HIS 31 HD1 HIS 31 4.175 -4.621 -8.338
225 HD2 HIS 31 HD2 HIS 31 3.154 -1.958 -5.317
226 HE1 HIS 31 HE1 HIS 31 5.834 -2.739 -8.512
227 H GLN 32 H GLN 32 2.354 -4.315 -3.187
228 HA GLN 32 HA GLN 32 4.887 -3.155 -2.976
229 HB2 GLN 32 1HB GLN 32 2.809 -3.787 -0.882
230 HB3 GLN 32 2HB GLN 32 4.279 -2.886 -0.530
231 HG2 GLN 32 1HG GLN 32 3.422 -1.433 -2.576
232 HG3 GLN 32 2HG GLN 32 1.868 -2.076 -2.046
233 HE21 GLN 32 1HE2 GLN 32 0.885 -0.520 -0.967
234 HE22 GLN 32 2HE2 GLN 32 1.581 0.437 0.291
235 H VAL 33 H VAL 33 3.966 -6.373 -2.557
236 HA VAL 33 HA VAL 33 5.607 -7.267 -0.489
237 HB VAL 33 HB VAL 33 4.939 -8.772 -3.022
238 HG11 VAL 33 1HG1 VAL 33 5.213 -10.767 -1.620
239 HG12 VAL 33 2HG1 VAL 33 6.703 -9.827 -1.720
240 HG13 VAL 33 3HG1 VAL 33 5.702 -9.744 -0.270
241 HG21 VAL 33 3HG2 VAL 33 2.866 -8.101 -2.168
242 HG22 VAL 33 1HG2 VAL 33 3.102 -9.721 -1.509
243 HG23 VAL 33 2HG2 VAL 33 3.386 -8.306 -0.495
244 H ILE 34 H ILE 34 6.355 -6.483 -3.819
245 HA ILE 34 HA ILE 34 8.853 -7.718 -4.044
246 HB ILE 34 HB ILE 34 9.323 -6.202 -5.854
247 HG12 ILE 34 1HG1 ILE 34 7.040 -4.563 -4.738
248 HG13 ILE 34 2HG1 ILE 34 8.732 -4.089 -4.848
249 HG21 ILE 34 1HG2 ILE 34 7.863 -7.771 -6.664
250 HG22 ILE 34 2HG2 ILE 34 6.556 -7.268 -5.593
251 HG23 ILE 34 3HG2 ILE 34 6.964 -6.293 -7.005
252 HD11 ILE 34 3HD1 ILE 34 6.683 -4.300 -7.005
253 HD12 ILE 34 1HD1 ILE 34 7.766 -2.965 -6.611
254 HD13 ILE 34 2HD1 ILE 34 8.400 -4.415 -7.391
255 H HIS 35 H HIS 35 7.880 -4.808 -2.406
256 HA HIS 35 HA HIS 35 10.634 -3.947 -2.006
257 HB2 HIS 35 1HB HIS 35 8.084 -2.720 -0.939
258 HB3 HIS 35 2HB HIS 35 9.683 -1.983 -0.944
259 HD1 HIS 35 HD1 HIS 35 10.689 -1.706 -3.524
260 HD2 HIS 35 HD2 HIS 35 6.571 -1.960 -3.042
261 HE1 HIS 35 HE1 HIS 35 9.705 -0.758 -5.635
262 H THR 36 H THR 36 8.350 -5.929 -0.498
263 HA THR 36 HA THR 36 9.504 -5.564 2.167
264 HB THR 36 HB THR 36 7.686 -6.757 3.053
265 HG1 THR 36 HG1 THR 36 7.490 -7.828 0.454
266 HG21 THR 36 3HG2 THR 36 5.932 -5.408 2.497
267 HG22 THR 36 1HG2 THR 36 6.183 -5.608 0.764
268 HG23 THR 36 2HG2 THR 36 7.219 -4.518 1.685
269 H GLY 37 H GLY 37 10.415 -7.289 3.344
270 HA2 GLY 37 1HA GLY 37 10.707 -9.919 2.417
271 HA3 GLY 37 2HA GLY 37 12.100 -8.997 1.872
272 H GLU 38 H GLU 38 13.711 -8.523 3.285
273 HA GLU 38 HA GLU 38 13.286 -8.927 6.138
274 HB2 GLU 38 1HB GLU 38 15.109 -10.492 6.386
275 HB3 GLU 38 2HB GLU 38 13.945 -11.143 5.241
276 HG2 GLU 38 1HG GLU 38 15.369 -10.443 3.387
277 HG3 GLU 38 2HG GLU 38 16.535 -9.784 4.532
278 H LYS 39 H LYS 39 15.339 -8.381 7.377
279 HA LYS 39 HA LYS 39 16.848 -6.784 7.971
280 HB2 LYS 39 1HB LYS 39 17.588 -7.517 5.186
281 HB3 LYS 39 2HB LYS 39 18.339 -6.078 5.864
282 HG2 LYS 39 1HG LYS 39 19.874 -7.621 6.495
283 HG3 LYS 39 2HG LYS 39 18.797 -7.718 7.890
284 HD2 LYS 39 1HD LYS 39 18.222 -9.473 5.561
285 HD3 LYS 39 2HD LYS 39 19.601 -9.882 6.583
286 HE2 LYS 39 1HE LYS 39 16.959 -9.260 7.831
287 HE3 LYS 39 2HE LYS 39 17.235 -10.848 7.117
288 HZ1 LYS 39 3HZ LYS 39 17.815 -10.301 9.627
289 HZ2 LYS 39 1HZ LYS 39 19.285 -9.839 8.928
290 HZ3 LYS 39 2HZ LYS 39 18.707 -11.415 8.718
291 H ARG 40 H ARG 40 14.285 -5.828 7.371
292 HA ARG 40 HA ARG 40 14.881 -3.212 6.151
293 HB2 ARG 40 1HB ARG 40 12.337 -4.827 6.201
294 HB3 ARG 40 2HB ARG 40 12.346 -3.109 5.827
295 HG2 ARG 40 1HG ARG 40 13.980 -5.129 4.317
296 HG3 ARG 40 2HG ARG 40 12.345 -4.655 3.852
297 HD2 ARG 40 1HD ARG 40 14.553 -2.655 4.252
298 HD3 ARG 40 2HD ARG 40 14.272 -3.451 2.705
299 HE ARG 40 HE ARG 40 11.848 -2.462 3.260
300 HH11 ARG 40 1HH1 ARG 40 15.013 -1.018 3.362
301 HH12 ARG 40 2HH1 ARG 40 14.442 0.574 2.987
302 HH21 ARG 40 1HH2 ARG 40 11.083 -0.371 2.766
303 HH22 ARG 40 2HH2 ARG 40 12.206 0.941 2.649
304 H SER 41 H SER 41 15.541 -3.646 8.797
305 HA SER 41 HA SER 41 15.121 -3.018 10.967
306 HB2 SER 41 1HB SER 41 14.431 -0.694 9.214
307 HB3 SER 41 2HB SER 41 14.133 -0.564 10.948
308 HG SER 41 HG SER 41 16.583 -0.982 9.604
309 H GLY 42 H GLY 42 13.118 -4.726 10.107
310 HA2 GLY 42 1HA GLY 42 10.507 -4.088 10.145
311 HA3 GLY 42 2HA GLY 42 11.126 -5.471 11.034
312 HA PRO 43 HA PRO 43 9.926 -1.669 13.834
313 HB2 PRO 43 1HB PRO 43 7.256 -1.303 13.509
314 HB3 PRO 43 2HB PRO 43 8.468 -0.402 12.591
315 HG2 PRO 43 1HG PRO 43 6.871 -2.800 11.777
316 HG3 PRO 43 2HG PRO 43 7.251 -1.340 10.845
317 HD2 PRO 43 1HD PRO 43 8.592 -3.669 10.515
318 HD3 PRO 43 2HD PRO 43 9.364 -2.085 10.301
319 H SER 44 H SER 44 8.998 -4.803 13.229
320 HA SER 44 HA SER 44 7.025 -5.393 15.082
321 HB2 SER 44 1HB SER 44 7.697 -7.102 13.564
322 HB3 SER 44 2HB SER 44 9.372 -7.025 14.109
323 HG SER 44 HG SER 44 8.619 -7.802 16.156
324 H SER 45 H SER 45 6.955 -5.756 17.244
325 HA SER 45 HA SER 45 8.958 -4.580 18.873
326 HB2 SER 45 1HB SER 45 6.688 -6.384 19.741
327 HB3 SER 45 2HB SER 45 7.573 -5.241 20.751
328 HG SER 45 HG SER 45 5.691 -4.250 20.123
329 H GLY 46 H GLY 46 10.876 -5.464 19.260
330 HA2 GLY 46 1HA GLY 46 12.054 -7.159 20.553
331 HA3 GLY 46 2HA GLY 46 10.969 -8.354 19.858
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -24.216 21.620 -9.516
2 HA2 GLY 1 1HA GLY 1 -23.112 21.961 -11.790
3 HA3 GLY 1 2HA GLY 1 -21.754 22.554 -10.845
4 H SER 2 H SER 2 -23.921 19.750 -10.483
5 HA SER 2 HA SER 2 -21.517 18.057 -10.305
6 HB2 SER 2 1HB SER 2 -24.150 17.999 -8.902
7 HB3 SER 2 2HB SER 2 -23.347 16.461 -9.219
8 HG SER 2 HG SER 2 -22.871 17.770 -7.179
9 H SER 3 H SER 3 -21.448 17.888 -12.621
10 HA SER 3 HA SER 3 -23.265 15.814 -13.611
11 HB2 SER 3 1HB SER 3 -22.812 18.517 -14.820
12 HB3 SER 3 2HB SER 3 -23.110 17.139 -15.881
13 HG SER 3 HG SER 3 -25.129 17.515 -15.452
14 H GLY 4 H GLY 4 -22.429 14.954 -15.787
15 HA2 GLY 4 1HA GLY 4 -20.758 13.690 -16.749
16 HA3 GLY 4 2HA GLY 4 -19.901 15.225 -16.779
17 H SER 5 H SER 5 -20.832 13.088 -14.091
18 HA SER 5 HA SER 5 -18.725 13.450 -12.441
19 HB2 SER 5 1HB SER 5 -19.957 10.748 -13.032
20 HB3 SER 5 2HB SER 5 -19.099 11.203 -11.560
21 HG SER 5 HG SER 5 -20.931 11.921 -10.855
22 H SER 6 H SER 6 -18.797 11.144 -15.144
23 HA SER 6 HA SER 6 -16.347 9.948 -14.864
24 HB2 SER 6 1HB SER 6 -18.030 10.641 -17.231
25 HB3 SER 6 2HB SER 6 -16.390 10.057 -17.516
26 HG SER 6 HG SER 6 -18.556 8.745 -16.284
27 H GLY 7 H GLY 7 -14.260 10.503 -15.116
28 HA2 GLY 7 1HA GLY 7 -13.109 12.338 -16.777
29 HA3 GLY 7 2HA GLY 7 -13.607 13.289 -15.385
30 H THR 8 H THR 8 -13.110 11.571 -13.306
31 HA THR 8 HA THR 8 -10.278 11.820 -13.050
32 HB THR 8 HB THR 8 -12.127 10.322 -11.191
33 HG1 THR 8 HG1 THR 8 -11.824 12.617 -10.149
34 HG21 THR 8 3HG2 THR 8 -10.486 10.622 -9.545
35 HG22 THR 8 1HG2 THR 8 -9.651 11.866 -10.474
36 HG23 THR 8 2HG2 THR 8 -9.568 10.180 -10.984
37 H LYS 9 H LYS 9 -8.720 10.215 -12.863
38 HA LYS 9 HA LYS 9 -9.365 7.735 -14.251
39 HB2 LYS 9 1HB LYS 9 -6.921 7.410 -14.336
40 HB3 LYS 9 2HB LYS 9 -7.408 8.960 -15.012
41 HG2 LYS 9 1HG LYS 9 -6.925 9.742 -12.512
42 HG3 LYS 9 2HG LYS 9 -5.836 8.354 -12.582
43 HD2 LYS 9 1HD LYS 9 -5.832 10.332 -14.819
44 HD3 LYS 9 2HD LYS 9 -5.011 10.734 -13.308
45 HE2 LYS 9 1HE LYS 9 -3.707 8.653 -13.494
46 HE3 LYS 9 2HE LYS 9 -4.501 8.308 -15.029
47 HZ1 LYS 9 3HZ LYS 9 -3.126 10.879 -14.699
48 HZ2 LYS 9 1HZ LYS 9 -3.359 9.955 -16.097
49 HZ3 LYS 9 2HZ LYS 9 -2.195 9.492 -14.961
50 H GLU 10 H GLU 10 -9.555 5.814 -13.287
51 HA GLU 10 HA GLU 10 -9.713 5.551 -10.505
52 HB2 GLU 10 1HB GLU 10 -10.498 4.025 -12.593
53 HB3 GLU 10 2HB GLU 10 -9.098 3.107 -12.055
54 HG2 GLU 10 1HG GLU 10 -10.655 2.111 -10.765
55 HG3 GLU 10 2HG GLU 10 -10.271 3.459 -9.696
56 H LYS 11 H LYS 11 -8.408 3.435 -9.592
57 HA LYS 11 HA LYS 11 -6.430 2.627 -8.799
58 HB2 LYS 11 1HB LYS 11 -5.029 4.109 -11.020
59 HB3 LYS 11 2HB LYS 11 -4.471 2.686 -10.151
60 HG2 LYS 11 1HG LYS 11 -6.695 1.660 -11.170
61 HG3 LYS 11 2HG LYS 11 -6.410 2.915 -12.378
62 HD2 LYS 11 1HD LYS 11 -4.351 2.006 -13.007
63 HD3 LYS 11 2HD LYS 11 -4.216 1.055 -11.526
64 HE2 LYS 11 1HE LYS 11 -5.750 -0.532 -12.262
65 HE3 LYS 11 2HE LYS 11 -6.440 0.553 -13.468
66 HZ1 LYS 11 3HZ LYS 11 -3.629 -0.133 -13.791
67 HZ2 LYS 11 1HZ LYS 11 -4.838 0.065 -14.958
68 HZ3 LYS 11 2HZ LYS 11 -4.741 -1.375 -14.077
69 HA PRO 12 HA PRO 12 -5.762 7.022 -7.177
70 HB2 PRO 12 1HB PRO 12 -7.119 6.723 -4.844
71 HB3 PRO 12 2HB PRO 12 -7.883 7.289 -6.335
72 HG2 PRO 12 1HG PRO 12 -7.888 4.551 -5.124
73 HG3 PRO 12 2HG PRO 12 -9.226 5.450 -5.863
74 HD2 PRO 12 1HD PRO 12 -7.872 3.509 -7.180
75 HD3 PRO 12 2HD PRO 12 -8.565 4.919 -8.007
76 H TYR 13 H TYR 13 -5.645 3.806 -5.772
77 HA TYR 13 HA TYR 13 -3.880 4.502 -3.633
78 HB2 TYR 13 1HB TYR 13 -4.802 1.898 -4.824
79 HB3 TYR 13 2HB TYR 13 -3.550 1.939 -3.588
80 HD1 TYR 13 HD1 TYR 13 -6.449 4.226 -3.721
81 HD2 TYR 13 HD2 TYR 13 -4.734 0.801 -1.868
82 HE1 TYR 13 HE1 TYR 13 -8.182 4.309 -1.976
83 HE2 TYR 13 HE2 TYR 13 -6.462 0.874 -0.119
84 HH TYR 13 HH TYR 13 -8.793 3.513 0.051
85 H LYS 14 H LYS 14 -1.961 5.352 -4.182
86 HA LYS 14 HA LYS 14 -0.395 4.064 -6.305
87 HB2 LYS 14 1HB LYS 14 -0.516 6.373 -6.723
88 HB3 LYS 14 2HB LYS 14 -0.293 6.783 -5.027
89 HG2 LYS 14 1HG LYS 14 1.983 6.482 -5.110
90 HG3 LYS 14 2HG LYS 14 1.895 5.386 -6.491
91 HD2 LYS 14 1HD LYS 14 1.432 7.193 -7.985
92 HD3 LYS 14 2HD LYS 14 1.235 8.323 -6.643
93 HE2 LYS 14 1HE LYS 14 3.657 7.765 -6.053
94 HE3 LYS 14 2HE LYS 14 3.753 7.030 -7.652
95 HZ1 LYS 14 3HZ LYS 14 2.751 9.355 -8.330
96 HZ2 LYS 14 1HZ LYS 14 4.417 9.123 -8.156
97 HZ3 LYS 14 2HZ LYS 14 3.529 9.846 -6.911
98 H CYS 15 H CYS 15 1.528 3.091 -5.917
99 HA CYS 15 HA CYS 15 2.125 2.311 -3.236
100 HB2 CYS 15 1HB CYS 15 2.490 0.827 -5.186
101 HB3 CYS 15 2HB CYS 15 3.757 1.910 -5.753
102 H TYR 16 H TYR 16 3.207 3.476 -1.805
103 HA TYR 16 HA TYR 16 4.763 5.764 -2.608
104 HB2 TYR 16 1HB TYR 16 4.549 4.639 0.181
105 HB3 TYR 16 2HB TYR 16 4.899 6.296 -0.297
106 HD1 TYR 16 HD1 TYR 16 2.822 6.913 -2.223
107 HD2 TYR 16 HD2 TYR 16 2.569 4.669 1.383
108 HE1 TYR 16 HE1 TYR 16 0.433 7.471 -2.050
109 HE2 TYR 16 HE2 TYR 16 0.179 5.220 1.565
110 HH TYR 16 HH TYR 16 -1.581 6.640 -1.000
111 H GLU 17 H GLU 17 5.551 2.779 -3.016
112 HA GLU 17 HA GLU 17 8.219 2.917 -1.790
113 HB2 GLU 17 1HB GLU 17 6.951 0.522 -3.116
114 HB3 GLU 17 2HB GLU 17 8.380 0.547 -2.093
115 HG2 GLU 17 1HG GLU 17 6.694 1.511 -0.324
116 HG3 GLU 17 2HG GLU 17 5.509 0.704 -1.348
117 H CYS 18 H CYS 18 6.574 2.256 -4.863
118 HA CYS 18 HA CYS 18 9.096 2.895 -6.250
119 HB2 CYS 18 1HB CYS 18 8.449 1.389 -8.035
120 HB3 CYS 18 2HB CYS 18 8.412 0.520 -6.504
121 H GLY 19 H GLY 19 5.580 3.183 -6.262
122 HA2 GLY 19 1HA GLY 19 4.765 5.461 -6.817
123 HA3 GLY 19 2HA GLY 19 5.861 5.407 -8.189
124 H LYS 20 H LYS 20 4.311 2.455 -7.481
125 HA LYS 20 HA LYS 20 2.935 2.459 -9.980
126 HB2 LYS 20 1HB LYS 20 3.144 0.547 -7.681
127 HB3 LYS 20 2HB LYS 20 1.939 0.278 -8.933
128 HG2 LYS 20 1HG LYS 20 4.827 0.692 -9.612
129 HG3 LYS 20 2HG LYS 20 4.199 -0.894 -9.159
130 HD2 LYS 20 1HD LYS 20 2.408 -0.428 -10.974
131 HD3 LYS 20 2HD LYS 20 3.549 0.788 -11.552
132 HE2 LYS 20 1HE LYS 20 4.382 -2.052 -11.046
133 HE3 LYS 20 2HE LYS 20 3.670 -1.555 -12.581
134 HZ1 LYS 20 3HZ LYS 20 5.465 -0.204 -13.070
135 HZ2 LYS 20 1HZ LYS 20 6.209 -1.535 -12.336
136 HZ3 LYS 20 2HZ LYS 20 5.981 -0.106 -11.461
137 H ALA 21 H ALA 21 0.542 1.441 -9.796
138 HA ALA 21 HA ALA 21 -1.018 2.998 -7.865
139 HB1 ALA 21 3HB ALA 21 -1.200 4.489 -9.613
140 HB2 ALA 21 1HB ALA 21 -1.151 3.222 -10.839
141 HB3 ALA 21 2HB ALA 21 -2.610 3.462 -9.876
142 H PHE 22 H PHE 22 -3.227 2.259 -7.633
143 HA PHE 22 HA PHE 22 -4.072 -0.172 -8.893
144 HB2 PHE 22 1HB PHE 22 -3.537 -0.328 -5.926
145 HB3 PHE 22 2HB PHE 22 -4.026 -1.632 -7.004
146 HD1 PHE 22 HD1 PHE 22 -1.247 0.561 -6.013
147 HD2 PHE 22 HD2 PHE 22 -2.433 -2.817 -8.314
148 HE1 PHE 22 HE1 PHE 22 1.117 -0.026 -6.364
149 HE2 PHE 22 HE2 PHE 22 -0.071 -3.410 -8.668
150 HZ PHE 22 HZ PHE 22 1.707 -2.014 -7.691
151 H ARG 23 H ARG 23 -6.210 -0.859 -8.166
152 HA ARG 23 HA ARG 23 -7.847 1.426 -7.521
153 HB2 ARG 23 1HB ARG 23 -8.676 -1.446 -7.972
154 HB3 ARG 23 2HB ARG 23 -9.732 -0.040 -7.972
155 HG2 ARG 23 1HG ARG 23 -8.203 0.788 -9.898
156 HG3 ARG 23 2HG ARG 23 -7.745 -0.913 -10.019
157 HD2 ARG 23 1HD ARG 23 -9.823 -1.564 -10.720
158 HD3 ARG 23 2HD ARG 23 -10.638 -0.245 -9.882
159 HE ARG 23 HE ARG 23 -9.261 1.038 -11.811
160 HH11 ARG 23 1HH1 ARG 23 -11.416 -1.696 -11.861
161 HH12 ARG 23 2HH1 ARG 23 -11.993 -1.377 -13.463
162 HH21 ARG 23 1HH2 ARG 23 -10.014 1.469 -13.921
163 HH22 ARG 23 2HH2 ARG 23 -11.194 0.423 -14.634
164 H THR 24 H THR 24 -7.590 -1.861 -6.153
165 HA THR 24 HA THR 24 -8.562 -0.788 -3.594
166 HB THR 24 HB THR 24 -9.282 -2.969 -3.002
167 HG1 THR 24 HG1 THR 24 -8.245 -4.124 -5.356
168 HG21 THR 24 3HG2 THR 24 -10.605 -3.684 -5.083
169 HG22 THR 24 1HG2 THR 24 -9.866 -2.290 -5.870
170 HG23 THR 24 2HG2 THR 24 -10.888 -2.063 -4.451
171 H ARG 25 H ARG 25 -7.559 -1.482 -1.625
172 HA ARG 25 HA ARG 25 -4.834 -1.185 -1.495
173 HB2 ARG 25 1HB ARG 25 -6.317 -1.036 0.456
174 HB3 ARG 25 2HB ARG 25 -6.573 -2.775 0.400
175 HG2 ARG 25 1HG ARG 25 -4.990 -2.296 2.120
176 HG3 ARG 25 2HG ARG 25 -4.141 -3.087 0.790
177 HD2 ARG 25 1HD ARG 25 -3.368 -0.904 -0.007
178 HD3 ARG 25 2HD ARG 25 -4.214 -0.119 1.326
179 HE ARG 25 HE ARG 25 -2.273 -2.122 2.097
180 HH11 ARG 25 1HH1 ARG 25 -2.901 1.245 1.474
181 HH12 ARG 25 2HH1 ARG 25 -1.557 1.804 2.415
182 HH21 ARG 25 1HH2 ARG 25 -0.500 -1.398 3.337
183 HH22 ARG 25 2HH2 ARG 25 -0.192 0.300 3.473
184 H SER 26 H SER 26 -6.541 -4.304 -1.167
185 HA SER 26 HA SER 26 -4.477 -6.043 -1.039
186 HB2 SER 26 1HB SER 26 -7.028 -6.495 -1.213
187 HB3 SER 26 2HB SER 26 -6.729 -6.631 -2.945
188 HG SER 26 HG SER 26 -6.590 -8.619 -1.598
189 H ASN 27 H ASN 27 -5.731 -4.581 -4.018
190 HA ASN 27 HA ASN 27 -4.000 -5.923 -5.791
191 HB2 ASN 27 1HB ASN 27 -6.126 -4.581 -6.327
192 HB3 ASN 27 2HB ASN 27 -5.093 -3.156 -6.270
193 HD21 ASN 27 1HD2 ASN 27 -6.552 -4.156 -8.516
194 HD22 ASN 27 2HD2 ASN 27 -5.397 -4.537 -9.744
195 H LEU 28 H LEU 28 -3.644 -3.013 -3.874
196 HA LEU 28 HA LEU 28 -1.208 -2.188 -5.160
197 HB2 LEU 28 1HB LEU 28 -2.274 -0.370 -4.281
198 HB3 LEU 28 2HB LEU 28 -2.857 -1.256 -2.874
199 HG LEU 28 HG LEU 28 -0.612 -1.138 -1.884
200 HD11 LEU 28 1HD1 LEU 28 0.351 -0.815 -4.350
201 HD12 LEU 28 2HD1 LEU 28 1.213 -0.275 -2.909
202 HD13 LEU 28 3HD1 LEU 28 0.276 0.877 -3.859
203 HD21 LEU 28 3HD2 LEU 28 -2.204 0.573 -1.296
204 HD22 LEU 28 1HD2 LEU 28 -1.796 1.501 -2.740
205 HD23 LEU 28 2HD2 LEU 28 -0.604 1.300 -1.454
206 H THR 29 H THR 29 -1.930 -3.276 -1.838
207 HA THR 29 HA THR 29 0.653 -3.590 -0.935
208 HB THR 29 HB THR 29 -1.793 -5.227 -0.250
209 HG1 THR 29 HG1 THR 29 -1.316 -3.777 1.742
210 HG21 THR 29 3HG2 THR 29 0.864 -5.090 1.181
211 HG22 THR 29 1HG2 THR 29 0.223 -6.488 0.319
212 HG23 THR 29 2HG2 THR 29 -0.583 -5.904 1.776
213 H THR 30 H THR 30 -1.377 -6.043 -2.527
214 HA THR 30 HA THR 30 0.239 -8.229 -2.474
215 HB THR 30 HB THR 30 -1.544 -7.215 -4.675
216 HG1 THR 30 HG1 THR 30 -2.000 -9.635 -3.410
217 HG21 THR 30 3HG2 THR 30 0.093 -9.745 -4.627
218 HG22 THR 30 1HG2 THR 30 0.071 -8.494 -5.869
219 HG23 THR 30 2HG2 THR 30 -1.333 -9.538 -5.643
220 H HIS 31 H HIS 31 0.682 -5.333 -4.379
221 HA HIS 31 HA HIS 31 2.875 -6.498 -5.892
222 HB2 HIS 31 1HB HIS 31 1.802 -5.057 -7.310
223 HB3 HIS 31 2HB HIS 31 1.304 -3.978 -6.011
224 HD1 HIS 31 HD1 HIS 31 4.102 -4.634 -8.395
225 HD2 HIS 31 HD2 HIS 31 3.128 -1.941 -5.384
226 HE1 HIS 31 HE1 HIS 31 5.772 -2.765 -8.598
227 H GLN 32 H GLN 32 2.345 -4.278 -3.231
228 HA GLN 32 HA GLN 32 4.900 -3.152 -3.065
229 HB2 GLN 32 1HB GLN 32 2.851 -3.726 -0.923
230 HB3 GLN 32 2HB GLN 32 4.324 -2.810 -0.633
231 HG2 GLN 32 1HG GLN 32 3.397 -1.434 -2.714
232 HG3 GLN 32 2HG GLN 32 1.867 -2.048 -2.089
233 HE21 GLN 32 1HE2 GLN 32 0.940 -0.437 -1.039
234 HE22 GLN 32 2HE2 GLN 32 1.695 0.563 0.150
235 H VAL 33 H VAL 33 3.857 -6.337 -2.465
236 HA VAL 33 HA VAL 33 5.512 -7.232 -0.439
237 HB VAL 33 HB VAL 33 4.824 -8.766 -2.949
238 HG11 VAL 33 1HG1 VAL 33 5.120 -10.745 -1.597
239 HG12 VAL 33 2HG1 VAL 33 6.589 -9.768 -1.537
240 HG13 VAL 33 3HG1 VAL 33 5.467 -9.761 -0.175
241 HG21 VAL 33 3HG2 VAL 33 3.281 -8.329 -0.400
242 HG22 VAL 33 1HG2 VAL 33 2.781 -7.959 -2.051
243 HG23 VAL 33 2HG2 VAL 33 2.931 -9.637 -1.530
244 H ILE 34 H ILE 34 6.283 -6.479 -3.765
245 HA ILE 34 HA ILE 34 8.767 -7.770 -3.955
246 HB ILE 34 HB ILE 34 9.256 -6.310 -5.808
247 HG12 ILE 34 1HG1 ILE 34 6.974 -4.631 -4.754
248 HG13 ILE 34 2HG1 ILE 34 8.667 -4.164 -4.874
249 HG21 ILE 34 1HG2 ILE 34 6.876 -6.419 -6.947
250 HG22 ILE 34 2HG2 ILE 34 7.804 -7.879 -6.607
251 HG23 ILE 34 3HG2 ILE 34 6.503 -7.389 -5.523
252 HD11 ILE 34 3HD1 ILE 34 8.234 -4.688 -7.434
253 HD12 ILE 34 1HD1 ILE 34 6.579 -4.299 -6.965
254 HD13 ILE 34 2HD1 ILE 34 7.867 -3.120 -6.715
255 H HIS 35 H HIS 35 7.808 -4.848 -2.356
256 HA HIS 35 HA HIS 35 10.567 -3.972 -1.999
257 HB2 HIS 35 1HB HIS 35 8.012 -2.720 -0.971
258 HB3 HIS 35 2HB HIS 35 9.614 -1.987 -0.959
259 HD1 HIS 35 HD1 HIS 35 10.662 -1.750 -3.527
260 HD2 HIS 35 HD2 HIS 35 6.536 -1.981 -3.106
261 HE1 HIS 35 HE1 HIS 35 9.716 -0.826 -5.666
262 H THR 36 H THR 36 8.395 -6.018 -0.494
263 HA THR 36 HA THR 36 9.330 -5.505 2.215
264 HB THR 36 HB THR 36 7.682 -6.985 2.979
265 HG1 THR 36 HG1 THR 36 7.162 -7.991 0.387
266 HG21 THR 36 3HG2 THR 36 6.436 -5.168 2.295
267 HG22 THR 36 1HG2 THR 36 5.651 -6.470 1.403
268 HG23 THR 36 2HG2 THR 36 6.810 -5.418 0.590
269 H GLY 37 H GLY 37 11.369 -6.273 0.448
270 HA2 GLY 37 1HA GLY 37 12.827 -8.099 1.832
271 HA3 GLY 37 2HA GLY 37 11.877 -9.096 0.740
272 H GLU 38 H GLU 38 14.518 -9.295 0.486
273 HA GLU 38 HA GLU 38 15.041 -7.887 -2.039
274 HB2 GLU 38 1HB GLU 38 16.311 -7.059 0.130
275 HB3 GLU 38 2HB GLU 38 17.327 -8.454 -0.205
276 HG2 GLU 38 1HG GLU 38 18.187 -6.347 -1.160
277 HG3 GLU 38 2HG GLU 38 17.902 -7.603 -2.363
278 H LYS 39 H LYS 39 15.397 -9.278 -3.625
279 HA LYS 39 HA LYS 39 15.395 -12.002 -3.464
280 HB2 LYS 39 1HB LYS 39 15.357 -10.431 -5.532
281 HB3 LYS 39 2HB LYS 39 17.104 -10.636 -5.522
282 HG2 LYS 39 1HG LYS 39 16.352 -12.247 -7.018
283 HG3 LYS 39 2HG LYS 39 16.621 -13.149 -5.526
284 HD2 LYS 39 1HD LYS 39 14.078 -12.535 -5.124
285 HD3 LYS 39 2HD LYS 39 14.075 -12.430 -6.886
286 HE2 LYS 39 1HE LYS 39 14.707 -14.682 -7.126
287 HE3 LYS 39 2HE LYS 39 15.200 -14.809 -5.438
288 HZ1 LYS 39 3HZ LYS 39 12.441 -14.086 -5.755
289 HZ2 LYS 39 1HZ LYS 39 13.136 -15.306 -4.811
290 HZ3 LYS 39 2HZ LYS 39 12.806 -15.586 -6.446
291 H ARG 40 H ARG 40 16.757 -13.547 -2.825
292 HA ARG 40 HA ARG 40 19.458 -12.753 -2.017
293 HB2 ARG 40 1HB ARG 40 17.746 -13.999 -0.503
294 HB3 ARG 40 2HB ARG 40 18.219 -15.421 -1.423
295 HG2 ARG 40 1HG ARG 40 20.613 -14.837 -0.795
296 HG3 ARG 40 2HG ARG 40 19.911 -13.715 0.371
297 HD2 ARG 40 1HD ARG 40 19.012 -16.566 0.295
298 HD3 ARG 40 2HD ARG 40 20.516 -16.134 1.108
299 HE ARG 40 HE ARG 40 17.824 -15.514 1.970
300 HH11 ARG 40 1HH1 ARG 40 21.222 -14.831 2.297
301 HH12 ARG 40 2HH1 ARG 40 21.065 -14.142 3.878
302 HH21 ARG 40 1HH2 ARG 40 17.604 -14.609 4.052
303 HH22 ARG 40 2HH2 ARG 40 19.007 -14.017 4.877
304 H SER 41 H SER 41 21.252 -13.513 -2.974
305 HA SER 41 HA SER 41 20.984 -14.949 -5.451
306 HB2 SER 41 1HB SER 41 23.330 -14.545 -5.749
307 HB3 SER 41 2HB SER 41 22.635 -13.082 -5.050
308 HG SER 41 HG SER 41 23.437 -14.789 -3.117
309 H GLY 42 H GLY 42 20.948 -17.082 -5.649
310 HA2 GLY 42 1HA GLY 42 22.647 -18.722 -3.931
311 HA3 GLY 42 2HA GLY 42 20.918 -19.027 -3.856
312 HA PRO 43 HA PRO 43 22.495 -21.878 -7.066
313 HB2 PRO 43 1HB PRO 43 20.684 -23.825 -6.520
314 HB3 PRO 43 2HB PRO 43 22.195 -23.638 -5.621
315 HG2 PRO 43 1HG PRO 43 19.434 -22.740 -4.893
316 HG3 PRO 43 2HG PRO 43 20.665 -23.508 -3.874
317 HD2 PRO 43 1HD PRO 43 20.199 -20.841 -3.834
318 HD3 PRO 43 2HD PRO 43 21.809 -21.534 -3.548
319 H SER 44 H SER 44 21.101 -23.171 -8.718
320 HA SER 44 HA SER 44 19.652 -21.364 -10.260
321 HB2 SER 44 1HB SER 44 20.729 -23.580 -10.973
322 HB3 SER 44 2HB SER 44 19.247 -24.350 -10.408
323 HG SER 44 HG SER 44 19.585 -22.498 -12.513
324 H SER 45 H SER 45 17.344 -21.762 -11.017
325 HA SER 45 HA SER 45 15.604 -22.477 -8.755
326 HB2 SER 45 1HB SER 45 15.998 -19.923 -9.216
327 HB3 SER 45 2HB SER 45 14.874 -20.188 -10.549
328 HG SER 45 HG SER 45 14.434 -20.273 -7.797
329 H GLY 46 H GLY 46 15.577 -21.626 -12.221
330 HA2 GLY 46 1HA GLY 46 13.184 -22.626 -13.023
331 HA3 GLY 46 2HA GLY 46 14.638 -22.758 -14.001
Start of MODEL 13
1 H1 GLY 1 H GLY 1 1.596 24.380 -22.645
2 HA2 GLY 1 1HA GLY 1 -0.751 25.574 -23.956
3 HA3 GLY 1 2HA GLY 1 -0.451 23.852 -24.135
4 H SER 2 H SER 2 -2.105 26.128 -22.391
5 HA SER 2 HA SER 2 -2.101 24.694 -19.865
6 HB2 SER 2 1HB SER 2 -2.322 27.300 -20.311
7 HB3 SER 2 2HB SER 2 -4.035 26.898 -20.440
8 HG SER 2 HG SER 2 -3.058 25.661 -18.305
9 H SER 3 H SER 3 -4.112 23.976 -18.868
10 HA SER 3 HA SER 3 -6.435 23.538 -20.487
11 HB2 SER 3 1HB SER 3 -4.418 21.373 -20.136
12 HB3 SER 3 2HB SER 3 -6.120 20.928 -20.026
13 HG SER 3 HG SER 3 -6.413 21.887 -22.089
14 H GLY 4 H GLY 4 -7.981 21.971 -19.279
15 HA2 GLY 4 1HA GLY 4 -7.768 22.605 -16.403
16 HA3 GLY 4 2HA GLY 4 -9.286 22.482 -17.281
17 H SER 5 H SER 5 -9.680 21.045 -15.342
18 HA SER 5 HA SER 5 -8.686 18.323 -15.870
19 HB2 SER 5 1HB SER 5 -9.209 17.832 -13.504
20 HB3 SER 5 2HB SER 5 -8.045 19.148 -13.657
21 HG SER 5 HG SER 5 -10.795 19.296 -13.019
22 H SER 6 H SER 6 -10.143 17.282 -17.070
23 HA SER 6 HA SER 6 -12.978 17.486 -16.289
24 HB2 SER 6 1HB SER 6 -11.917 16.861 -19.054
25 HB3 SER 6 2HB SER 6 -13.602 17.114 -18.599
26 HG SER 6 HG SER 6 -12.304 19.238 -17.784
27 H GLY 7 H GLY 7 -14.194 15.604 -16.191
28 HA2 GLY 7 1HA GLY 7 -14.625 13.338 -16.094
29 HA3 GLY 7 2HA GLY 7 -13.135 13.061 -16.983
30 H THR 8 H THR 8 -13.597 11.256 -15.145
31 HA THR 8 HA THR 8 -11.894 12.027 -12.865
32 HB THR 8 HB THR 8 -13.060 10.365 -11.494
33 HG1 THR 8 HG1 THR 8 -15.198 9.701 -12.587
34 HG21 THR 8 3HG2 THR 8 -15.461 11.712 -12.312
35 HG22 THR 8 1HG2 THR 8 -14.097 12.827 -12.374
36 HG23 THR 8 2HG2 THR 8 -14.472 11.975 -10.876
37 H LYS 9 H LYS 9 -10.462 10.425 -12.051
38 HA LYS 9 HA LYS 9 -9.871 8.268 -13.971
39 HB2 LYS 9 1HB LYS 9 -8.036 10.112 -12.467
40 HB3 LYS 9 2HB LYS 9 -7.472 8.545 -13.032
41 HG2 LYS 9 1HG LYS 9 -6.840 10.080 -14.687
42 HG3 LYS 9 2HG LYS 9 -8.255 9.247 -15.335
43 HD2 LYS 9 1HD LYS 9 -9.673 11.109 -14.758
44 HD3 LYS 9 2HD LYS 9 -8.336 11.921 -13.940
45 HE2 LYS 9 1HE LYS 9 -7.154 12.155 -16.041
46 HE3 LYS 9 2HE LYS 9 -8.410 11.247 -16.880
47 HZ1 LYS 9 3HZ LYS 9 -8.460 13.792 -16.988
48 HZ2 LYS 9 1HZ LYS 9 -9.068 13.719 -15.410
49 HZ3 LYS 9 2HZ LYS 9 -9.911 12.980 -16.676
50 H GLU 10 H GLU 10 -8.929 6.332 -13.092
51 HA GLU 10 HA GLU 10 -9.785 5.854 -10.320
52 HB2 GLU 10 1HB GLU 10 -10.583 4.506 -12.491
53 HB3 GLU 10 2HB GLU 10 -9.132 3.584 -12.122
54 HG2 GLU 10 1HG GLU 10 -9.981 2.753 -10.178
55 HG3 GLU 10 2HG GLU 10 -11.034 4.141 -9.913
56 H LYS 11 H LYS 11 -8.465 3.717 -9.537
57 HA LYS 11 HA LYS 11 -6.487 2.881 -8.774
58 HB2 LYS 11 1HB LYS 11 -5.086 4.465 -10.922
59 HB3 LYS 11 2HB LYS 11 -4.530 3.000 -10.123
60 HG2 LYS 11 1HG LYS 11 -6.781 2.055 -11.196
61 HG3 LYS 11 2HG LYS 11 -6.438 3.342 -12.354
62 HD2 LYS 11 1HD LYS 11 -4.143 2.417 -12.612
63 HD3 LYS 11 2HD LYS 11 -4.610 1.073 -11.566
64 HE2 LYS 11 1HE LYS 11 -6.327 0.408 -13.144
65 HE3 LYS 11 2HE LYS 11 -5.959 1.797 -14.166
66 HZ1 LYS 11 3HZ LYS 11 -3.886 -0.201 -13.511
67 HZ2 LYS 11 1HZ LYS 11 -3.936 0.890 -14.804
68 HZ3 LYS 11 2HZ LYS 11 -4.964 -0.454 -14.790
69 HA PRO 12 HA PRO 12 -5.829 7.175 -6.917
70 HB2 PRO 12 1HB PRO 12 -7.119 6.710 -4.574
71 HB3 PRO 12 2HB PRO 12 -7.932 7.347 -6.009
72 HG2 PRO 12 1HG PRO 12 -7.854 4.543 -4.965
73 HG3 PRO 12 2HG PRO 12 -9.227 5.456 -5.615
74 HD2 PRO 12 1HD PRO 12 -7.871 3.626 -7.079
75 HD3 PRO 12 2HD PRO 12 -8.612 5.068 -7.802
76 H TYR 13 H TYR 13 -5.642 3.890 -5.673
77 HA TYR 13 HA TYR 13 -3.811 4.506 -3.565
78 HB2 TYR 13 1HB TYR 13 -4.768 1.952 -4.832
79 HB3 TYR 13 2HB TYR 13 -3.467 1.943 -3.646
80 HD1 TYR 13 HD1 TYR 13 -6.436 4.162 -3.619
81 HD2 TYR 13 HD2 TYR 13 -4.518 0.789 -1.874
82 HE1 TYR 13 HE1 TYR 13 -8.097 4.163 -1.806
83 HE2 TYR 13 HE2 TYR 13 -6.175 0.780 -0.057
84 HH TYR 13 HH TYR 13 -8.463 1.571 0.353
85 H LYS 14 H LYS 14 -1.867 5.302 -4.049
86 HA LYS 14 HA LYS 14 -0.370 4.109 -6.284
87 HB2 LYS 14 1HB LYS 14 -0.559 6.426 -6.670
88 HB3 LYS 14 2HB LYS 14 -0.255 6.819 -4.983
89 HG2 LYS 14 1HG LYS 14 2.037 6.403 -5.178
90 HG3 LYS 14 2HG LYS 14 1.836 5.521 -6.694
91 HD2 LYS 14 1HD LYS 14 1.461 7.479 -7.917
92 HD3 LYS 14 2HD LYS 14 1.098 8.421 -6.469
93 HE2 LYS 14 1HE LYS 14 3.399 8.367 -5.790
94 HE3 LYS 14 2HE LYS 14 3.805 7.248 -7.090
95 HZ1 LYS 14 3HZ LYS 14 4.444 9.194 -8.037
96 HZ2 LYS 14 1HZ LYS 14 3.304 10.126 -7.203
97 HZ3 LYS 14 2HZ LYS 14 2.827 9.198 -8.534
98 H CYS 15 H CYS 15 1.509 3.074 -5.928
99 HA CYS 15 HA CYS 15 2.222 2.376 -3.253
100 HB2 CYS 15 1HB CYS 15 2.453 0.831 -5.191
101 HB3 CYS 15 2HB CYS 15 3.745 1.852 -5.813
102 H TYR 16 H TYR 16 3.116 3.890 -1.992
103 HA TYR 16 HA TYR 16 4.732 6.015 -2.916
104 HB2 TYR 16 1HB TYR 16 4.729 4.945 -0.097
105 HB3 TYR 16 2HB TYR 16 5.028 6.595 -0.631
106 HD1 TYR 16 HD1 TYR 16 2.768 7.012 -2.492
107 HD2 TYR 16 HD2 TYR 16 2.884 5.125 1.320
108 HE1 TYR 16 HE1 TYR 16 0.393 7.554 -2.159
109 HE2 TYR 16 HE2 TYR 16 0.508 5.661 1.663
110 HH TYR 16 HH TYR 16 -1.188 7.845 -0.317
111 H GLU 17 H GLU 17 5.418 2.757 -2.529
112 HA GLU 17 HA GLU 17 8.152 2.979 -1.695
113 HB2 GLU 17 1HB GLU 17 6.918 0.631 -3.127
114 HB3 GLU 17 2HB GLU 17 8.288 0.630 -2.025
115 HG2 GLU 17 1HG GLU 17 6.546 1.508 -0.301
116 HG3 GLU 17 2HG GLU 17 5.376 0.820 -1.425
117 H CYS 18 H CYS 18 6.560 2.239 -4.794
118 HA CYS 18 HA CYS 18 9.067 2.978 -6.154
119 HB2 CYS 18 1HB CYS 18 8.388 1.531 -7.993
120 HB3 CYS 18 2HB CYS 18 8.405 0.621 -6.486
121 H GLY 19 H GLY 19 5.531 3.175 -6.316
122 HA2 GLY 19 1HA GLY 19 4.726 5.506 -6.774
123 HA3 GLY 19 2HA GLY 19 5.840 5.486 -8.133
124 H LYS 20 H LYS 20 4.274 2.520 -7.501
125 HA LYS 20 HA LYS 20 2.930 2.585 -10.021
126 HB2 LYS 20 1HB LYS 20 3.160 0.608 -7.785
127 HB3 LYS 20 2HB LYS 20 1.933 0.370 -9.022
128 HG2 LYS 20 1HG LYS 20 4.753 0.872 -9.846
129 HG3 LYS 20 2HG LYS 20 4.287 -0.726 -9.257
130 HD2 LYS 20 1HD LYS 20 2.306 -0.401 -10.967
131 HD3 LYS 20 2HD LYS 20 3.444 0.717 -11.723
132 HE2 LYS 20 1HE LYS 20 5.134 -1.199 -11.576
133 HE3 LYS 20 2HE LYS 20 3.744 -2.233 -11.247
134 HZ1 LYS 20 3HZ LYS 20 4.683 -1.358 -13.722
135 HZ2 LYS 20 1HZ LYS 20 3.176 -0.629 -13.479
136 HZ3 LYS 20 2HZ LYS 20 3.322 -2.312 -13.404
137 H ALA 21 H ALA 21 0.541 1.512 -9.853
138 HA ALA 21 HA ALA 21 -1.040 3.036 -7.912
139 HB1 ALA 21 3HB ALA 21 -1.305 3.187 -10.900
140 HB2 ALA 21 1HB ALA 21 -2.635 3.597 -9.816
141 HB3 ALA 21 2HB ALA 21 -1.124 4.504 -9.742
142 H PHE 22 H PHE 22 -3.247 2.271 -7.698
143 HA PHE 22 HA PHE 22 -4.017 -0.198 -8.951
144 HB2 PHE 22 1HB PHE 22 -3.542 -0.247 -5.967
145 HB3 PHE 22 2HB PHE 22 -4.049 -1.588 -6.989
146 HD1 PHE 22 HD1 PHE 22 -1.238 0.569 -6.036
147 HD2 PHE 22 HD2 PHE 22 -2.471 -2.824 -8.292
148 HE1 PHE 22 HE1 PHE 22 1.116 -0.072 -6.354
149 HE2 PHE 22 HE2 PHE 22 -0.119 -3.470 -8.612
150 HZ PHE 22 HZ PHE 22 1.678 -2.094 -7.642
151 H ARG 23 H ARG 23 -6.173 -0.887 -8.324
152 HA ARG 23 HA ARG 23 -7.881 1.367 -7.827
153 HB2 ARG 23 1HB ARG 23 -8.348 -1.537 -8.439
154 HB3 ARG 23 2HB ARG 23 -9.679 -0.499 -7.947
155 HG2 ARG 23 1HG ARG 23 -9.062 1.027 -9.840
156 HG3 ARG 23 2HG ARG 23 -7.936 -0.220 -10.379
157 HD2 ARG 23 1HD ARG 23 -9.811 -1.812 -10.526
158 HD3 ARG 23 2HD ARG 23 -10.918 -0.525 -10.050
159 HE ARG 23 HE ARG 23 -9.759 0.547 -12.199
160 HH11 ARG 23 1HH1 ARG 23 -11.099 -2.621 -11.664
161 HH12 ARG 23 2HH1 ARG 23 -11.566 -2.846 -13.317
162 HH21 ARG 23 1HH2 ARG 23 -10.369 0.263 -14.379
163 HH22 ARG 23 2HH2 ARG 23 -11.150 -1.205 -14.861
164 H THR 24 H THR 24 -7.440 -1.780 -6.206
165 HA THR 24 HA THR 24 -8.550 -0.578 -3.758
166 HB THR 24 HB THR 24 -9.223 -2.738 -3.031
167 HG1 THR 24 HG1 THR 24 -8.038 -3.930 -5.318
168 HG21 THR 24 3HG2 THR 24 -10.894 -2.076 -4.470
169 HG22 THR 24 1HG2 THR 24 -10.427 -3.612 -5.198
170 HG23 THR 24 2HG2 THR 24 -9.836 -2.097 -5.881
171 H ARG 25 H ARG 25 -7.671 -1.692 -1.712
172 HA ARG 25 HA ARG 25 -4.913 -1.135 -1.528
173 HB2 ARG 25 1HB ARG 25 -6.849 -1.251 0.289
174 HB3 ARG 25 2HB ARG 25 -6.223 -2.881 0.502
175 HG2 ARG 25 1HG ARG 25 -4.599 -0.354 0.715
176 HG3 ARG 25 2HG ARG 25 -5.235 -1.282 2.074
177 HD2 ARG 25 1HD ARG 25 -3.937 -3.240 1.275
178 HD3 ARG 25 2HD ARG 25 -3.233 -2.217 0.023
179 HE ARG 25 HE ARG 25 -2.467 -2.335 2.762
180 HH11 ARG 25 1HH1 ARG 25 -2.753 -0.188 0.037
181 HH12 ARG 25 2HH1 ARG 25 -1.512 0.888 0.588
182 HH21 ARG 25 1HH2 ARG 25 -0.832 -0.926 3.499
183 HH22 ARG 25 2HH2 ARG 25 -0.419 0.467 2.557
184 H SER 26 H SER 26 -6.614 -4.254 -1.173
185 HA SER 26 HA SER 26 -4.514 -5.960 -0.930
186 HB2 SER 26 1HB SER 26 -7.023 -6.497 -1.045
187 HB3 SER 26 2HB SER 26 -6.797 -6.610 -2.790
188 HG SER 26 HG SER 26 -6.266 -8.595 -2.319
189 H ASN 27 H ASN 27 -5.744 -4.580 -3.949
190 HA ASN 27 HA ASN 27 -3.996 -5.991 -5.668
191 HB2 ASN 27 1HB ASN 27 -6.166 -4.544 -6.144
192 HB3 ASN 27 2HB ASN 27 -4.980 -3.269 -6.404
193 HD21 ASN 27 1HD2 ASN 27 -4.354 -3.043 -8.414
194 HD22 ASN 27 2HD2 ASN 27 -4.297 -4.286 -9.614
195 H LEU 28 H LEU 28 -3.666 -3.067 -3.797
196 HA LEU 28 HA LEU 28 -1.278 -2.183 -5.132
197 HB2 LEU 28 1HB LEU 28 -2.405 -0.407 -4.216
198 HB3 LEU 28 2HB LEU 28 -2.866 -1.307 -2.772
199 HG LEU 28 HG LEU 28 -0.630 -1.056 -1.867
200 HD11 LEU 28 1HD1 LEU 28 -0.003 0.507 -4.367
201 HD12 LEU 28 2HD1 LEU 28 0.593 -1.110 -3.996
202 HD13 LEU 28 3HD1 LEU 28 1.068 0.257 -2.988
203 HD21 LEU 28 3HD2 LEU 28 -2.371 0.733 -1.575
204 HD22 LEU 28 1HD2 LEU 28 -1.567 1.624 -2.867
205 HD23 LEU 28 2HD2 LEU 28 -0.702 1.266 -1.372
206 H THR 29 H THR 29 -1.964 -3.479 -1.882
207 HA THR 29 HA THR 29 0.675 -3.693 -1.013
208 HB THR 29 HB THR 29 -1.766 -5.305 -0.271
209 HG1 THR 29 HG1 THR 29 -1.923 -3.863 1.350
210 HG21 THR 29 3HG2 THR 29 -0.557 -6.224 1.581
211 HG22 THR 29 1HG2 THR 29 0.876 -5.275 1.187
212 HG23 THR 29 2HG2 THR 29 0.359 -6.578 0.116
213 H THR 30 H THR 30 -1.377 -6.163 -2.553
214 HA THR 30 HA THR 30 0.234 -8.339 -2.562
215 HB THR 30 HB THR 30 -1.541 -7.291 -4.757
216 HG1 THR 30 HG1 THR 30 -1.739 -9.433 -2.884
217 HG21 THR 30 3HG2 THR 30 0.097 -8.605 -5.913
218 HG22 THR 30 1HG2 THR 30 -1.363 -9.581 -5.758
219 HG23 THR 30 2HG2 THR 30 0.012 -9.877 -4.695
220 H HIS 31 H HIS 31 0.726 -5.396 -4.354
221 HA HIS 31 HA HIS 31 2.913 -6.563 -5.894
222 HB2 HIS 31 1HB HIS 31 1.830 -5.150 -7.332
223 HB3 HIS 31 2HB HIS 31 1.311 -4.064 -6.047
224 HD1 HIS 31 HD1 HIS 31 4.140 -4.716 -8.398
225 HD2 HIS 31 HD2 HIS 31 3.097 -1.993 -5.439
226 HE1 HIS 31 HE1 HIS 31 5.787 -2.828 -8.612
227 H GLN 32 H GLN 32 2.333 -4.299 -3.275
228 HA GLN 32 HA GLN 32 4.851 -3.124 -3.089
229 HB2 GLN 32 1HB GLN 32 2.795 -3.764 -0.978
230 HB3 GLN 32 2HB GLN 32 4.266 -2.866 -0.628
231 HG2 GLN 32 1HG GLN 32 3.375 -1.433 -2.697
232 HG3 GLN 32 2HG GLN 32 1.837 -2.042 -2.087
233 HE21 GLN 32 1HE2 GLN 32 0.937 -0.412 -1.035
234 HE22 GLN 32 2HE2 GLN 32 1.697 0.542 0.188
235 H VAL 33 H VAL 33 3.850 -6.332 -2.383
236 HA VAL 33 HA VAL 33 5.538 -7.203 -0.413
237 HB VAL 33 HB VAL 33 4.963 -8.725 -2.959
238 HG11 VAL 33 1HG1 VAL 33 6.554 -9.986 -1.857
239 HG12 VAL 33 2HG1 VAL 33 5.991 -9.492 -0.259
240 HG13 VAL 33 3HG1 VAL 33 5.054 -10.647 -1.207
241 HG21 VAL 33 3HG2 VAL 33 3.127 -9.706 -1.391
242 HG22 VAL 33 1HG2 VAL 33 3.312 -8.179 -0.529
243 HG23 VAL 33 2HG2 VAL 33 2.840 -8.180 -2.228
244 H ILE 34 H ILE 34 6.316 -6.635 -3.811
245 HA ILE 34 HA ILE 34 8.838 -7.744 -3.959
246 HB ILE 34 HB ILE 34 9.326 -6.212 -5.757
247 HG12 ILE 34 1HG1 ILE 34 6.995 -4.624 -4.670
248 HG13 ILE 34 2HG1 ILE 34 8.674 -4.109 -4.789
249 HG21 ILE 34 1HG2 ILE 34 7.923 -7.809 -6.607
250 HG22 ILE 34 2HG2 ILE 34 6.585 -7.352 -5.554
251 HG23 ILE 34 3HG2 ILE 34 6.986 -6.356 -6.953
252 HD11 ILE 34 3HD1 ILE 34 8.275 -4.545 -7.349
253 HD12 ILE 34 1HD1 ILE 34 6.590 -4.295 -6.892
254 HD13 ILE 34 2HD1 ILE 34 7.784 -3.033 -6.585
255 H HIS 35 H HIS 35 7.827 -4.764 -2.436
256 HA HIS 35 HA HIS 35 10.562 -3.909 -1.961
257 HB2 HIS 35 1HB HIS 35 7.990 -2.688 -0.942
258 HB3 HIS 35 2HB HIS 35 9.584 -1.938 -0.944
259 HD1 HIS 35 HD1 HIS 35 10.609 -1.679 -3.515
260 HD2 HIS 35 HD2 HIS 35 6.489 -1.980 -3.072
261 HE1 HIS 35 HE1 HIS 35 9.636 -0.771 -5.648
262 H THR 36 H THR 36 8.139 -5.757 -0.406
263 HA THR 36 HA THR 36 9.159 -5.355 2.272
264 HB THR 36 HB THR 36 7.479 -6.902 3.005
265 HG1 THR 36 HG1 THR 36 7.411 -8.546 1.593
266 HG21 THR 36 3HG2 THR 36 5.588 -5.889 1.202
267 HG22 THR 36 1HG2 THR 36 6.855 -4.667 1.297
268 HG23 THR 36 2HG2 THR 36 6.044 -5.212 2.765
269 H GLY 37 H GLY 37 10.839 -6.403 3.102
270 HA2 GLY 37 1HA GLY 37 11.491 -9.074 2.024
271 HA3 GLY 37 2HA GLY 37 12.740 -7.868 2.300
272 H GLU 38 H GLU 38 9.950 -8.766 4.306
273 HA GLU 38 HA GLU 38 11.778 -9.126 6.560
274 HB2 GLU 38 1HB GLU 38 8.805 -8.712 6.351
275 HB3 GLU 38 2HB GLU 38 9.554 -9.248 7.848
276 HG2 GLU 38 1HG GLU 38 11.075 -7.185 7.556
277 HG3 GLU 38 2HG GLU 38 9.835 -6.633 6.432
278 H LYS 39 H LYS 39 12.631 -11.159 6.152
279 HA LYS 39 HA LYS 39 10.885 -13.419 5.704
280 HB2 LYS 39 1HB LYS 39 13.871 -13.224 6.125
281 HB3 LYS 39 2HB LYS 39 13.019 -14.727 5.794
282 HG2 LYS 39 1HG LYS 39 12.637 -12.461 3.913
283 HG3 LYS 39 2HG LYS 39 14.173 -13.330 3.881
284 HD2 LYS 39 1HD LYS 39 11.561 -14.802 3.812
285 HD3 LYS 39 2HD LYS 39 12.267 -14.133 2.339
286 HE2 LYS 39 1HE LYS 39 14.368 -15.390 2.900
287 HE3 LYS 39 2HE LYS 39 13.469 -16.183 4.192
288 HZ1 LYS 39 3HZ LYS 39 12.792 -17.648 2.695
289 HZ2 LYS 39 1HZ LYS 39 13.513 -16.787 1.430
290 HZ3 LYS 39 2HZ LYS 39 11.931 -16.425 1.906
291 H ARG 40 H ARG 40 13.256 -12.545 8.224
292 HA ARG 40 HA ARG 40 11.534 -13.856 10.201
293 HB2 ARG 40 1HB ARG 40 13.338 -15.437 9.483
294 HB3 ARG 40 2HB ARG 40 14.522 -14.280 10.076
295 HG2 ARG 40 1HG ARG 40 13.197 -14.477 12.306
296 HG3 ARG 40 2HG ARG 40 12.615 -15.988 11.603
297 HD2 ARG 40 1HD ARG 40 14.741 -16.926 11.550
298 HD3 ARG 40 2HD ARG 40 15.540 -15.357 11.647
299 HE ARG 40 HE ARG 40 15.316 -15.406 13.942
300 HH11 ARG 40 1HH1 ARG 40 13.494 -18.001 12.504
301 HH12 ARG 40 2HH1 ARG 40 13.200 -18.804 14.011
302 HH21 ARG 40 1HH2 ARG 40 14.936 -16.454 15.932
303 HH22 ARG 40 2HH2 ARG 40 14.020 -17.923 15.960
304 H SER 41 H SER 41 11.472 -12.872 12.169
305 HA SER 41 HA SER 41 13.111 -10.442 12.462
306 HB2 SER 41 1HB SER 41 11.267 -9.575 13.887
307 HB3 SER 41 2HB SER 41 10.747 -9.914 12.237
308 HG SER 41 HG SER 41 10.035 -12.004 13.106
309 H GLY 42 H GLY 42 14.828 -11.339 13.578
310 HA2 GLY 42 1HA GLY 42 14.610 -11.513 16.368
311 HA3 GLY 42 2HA GLY 42 14.614 -13.147 15.722
312 HA PRO 43 HA PRO 43 19.010 -11.880 16.428
313 HB2 PRO 43 1HB PRO 43 19.739 -14.220 17.596
314 HB3 PRO 43 2HB PRO 43 19.031 -12.875 18.499
315 HG2 PRO 43 1HG PRO 43 17.720 -15.359 17.464
316 HG3 PRO 43 2HG PRO 43 17.522 -14.561 19.035
317 HD2 PRO 43 1HD PRO 43 15.736 -14.273 17.020
318 HD3 PRO 43 2HD PRO 43 16.070 -12.982 18.192
319 H SER 44 H SER 44 20.906 -12.702 15.425
320 HA SER 44 HA SER 44 20.394 -14.755 13.372
321 HB2 SER 44 1HB SER 44 20.697 -12.283 12.629
322 HB3 SER 44 2HB SER 44 22.401 -12.546 12.997
323 HG SER 44 HG SER 44 22.410 -13.280 11.015
324 H SER 45 H SER 45 21.204 -16.342 14.843
325 HA SER 45 HA SER 45 24.069 -16.158 15.454
326 HB2 SER 45 1HB SER 45 22.843 -16.695 17.410
327 HB3 SER 45 2HB SER 45 21.846 -17.874 16.557
328 HG SER 45 HG SER 45 24.574 -18.344 16.517
329 H GLY 46 H GLY 46 25.542 -17.459 14.522
330 HA2 GLY 46 1HA GLY 46 24.557 -19.695 12.869
331 HA3 GLY 46 2HA GLY 46 25.705 -18.536 12.216
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -5.510 25.826 -15.203
2 HA2 GLY 1 1HA GLY 1 -4.271 23.880 -15.647
3 HA3 GLY 1 2HA GLY 1 -3.001 24.474 -14.587
4 H SER 2 H SER 2 -6.458 24.103 -13.905
5 HA SER 2 HA SER 2 -5.767 22.527 -11.549
6 HB2 SER 2 1HB SER 2 -8.478 23.579 -12.387
7 HB3 SER 2 2HB SER 2 -8.032 22.943 -10.804
8 HG SER 2 HG SER 2 -7.939 25.421 -11.523
9 H SER 3 H SER 3 -5.801 20.390 -11.614
10 HA SER 3 HA SER 3 -6.292 18.728 -13.652
11 HB2 SER 3 1HB SER 3 -5.601 18.201 -11.197
12 HB3 SER 3 2HB SER 3 -7.323 17.906 -10.951
13 HG SER 3 HG SER 3 -7.021 16.517 -12.948
14 H GLY 4 H GLY 4 -7.932 18.559 -15.023
15 HA2 GLY 4 1HA GLY 4 -10.636 19.227 -14.148
16 HA3 GLY 4 2HA GLY 4 -10.110 18.981 -15.807
17 H SER 5 H SER 5 -11.814 17.665 -13.260
18 HA SER 5 HA SER 5 -12.081 15.137 -14.679
19 HB2 SER 5 1HB SER 5 -10.289 15.064 -12.745
20 HB3 SER 5 2HB SER 5 -11.716 14.961 -11.714
21 HG SER 5 HG SER 5 -10.562 13.011 -13.041
22 H SER 6 H SER 6 -13.993 13.970 -14.131
23 HA SER 6 HA SER 6 -15.988 15.582 -12.679
24 HB2 SER 6 1HB SER 6 -16.153 15.313 -15.287
25 HB3 SER 6 2HB SER 6 -16.788 13.718 -14.886
26 HG SER 6 HG SER 6 -18.014 15.439 -13.318
27 H GLY 7 H GLY 7 -15.449 14.365 -10.775
28 HA2 GLY 7 1HA GLY 7 -15.650 12.612 -9.296
29 HA3 GLY 7 2HA GLY 7 -17.189 12.354 -10.105
30 H THR 8 H THR 8 -13.725 11.765 -10.723
31 HA THR 8 HA THR 8 -14.451 9.032 -11.550
32 HB THR 8 HB THR 8 -12.273 10.696 -12.825
33 HG1 THR 8 HG1 THR 8 -14.970 10.245 -13.511
34 HG21 THR 8 3HG2 THR 8 -12.715 7.919 -12.767
35 HG22 THR 8 1HG2 THR 8 -11.587 8.808 -13.790
36 HG23 THR 8 2HG2 THR 8 -13.218 8.465 -14.367
37 H LYS 9 H LYS 9 -13.687 7.734 -10.010
38 HA LYS 9 HA LYS 9 -11.001 8.276 -8.927
39 HB2 LYS 9 1HB LYS 9 -13.134 8.244 -7.409
40 HB3 LYS 9 2HB LYS 9 -12.983 6.497 -7.553
41 HG2 LYS 9 1HG LYS 9 -11.008 6.433 -6.372
42 HG3 LYS 9 2HG LYS 9 -10.615 8.116 -6.734
43 HD2 LYS 9 1HD LYS 9 -11.236 8.245 -4.514
44 HD3 LYS 9 2HD LYS 9 -12.753 8.627 -5.332
45 HE2 LYS 9 1HE LYS 9 -13.297 7.072 -3.640
46 HE3 LYS 9 2HE LYS 9 -13.316 6.169 -5.153
47 HZ1 LYS 9 3HZ LYS 9 -11.956 4.757 -4.134
48 HZ2 LYS 9 1HZ LYS 9 -11.660 5.816 -2.849
49 HZ3 LYS 9 2HZ LYS 9 -10.749 5.934 -4.269
50 H GLU 10 H GLU 10 -9.638 7.078 -10.127
51 HA GLU 10 HA GLU 10 -10.139 4.184 -10.226
52 HB2 GLU 10 1HB GLU 10 -9.768 4.003 -12.473
53 HB3 GLU 10 2HB GLU 10 -10.474 5.613 -12.441
54 HG2 GLU 10 1HG GLU 10 -7.996 6.382 -12.182
55 HG3 GLU 10 2HG GLU 10 -7.642 4.794 -12.862
56 H LYS 11 H LYS 11 -8.384 2.894 -9.883
57 HA LYS 11 HA LYS 11 -6.421 2.466 -8.731
58 HB2 LYS 11 1HB LYS 11 -5.342 3.953 -11.130
59 HB3 LYS 11 2HB LYS 11 -4.511 2.716 -10.196
60 HG2 LYS 11 1HG LYS 11 -6.624 1.287 -10.917
61 HG3 LYS 11 2HG LYS 11 -6.629 2.446 -12.249
62 HD2 LYS 11 1HD LYS 11 -4.553 1.759 -13.022
63 HD3 LYS 11 2HD LYS 11 -4.091 1.067 -11.465
64 HE2 LYS 11 1HE LYS 11 -6.372 -0.069 -13.042
65 HE3 LYS 11 2HE LYS 11 -4.707 -0.522 -13.407
66 HZ1 LYS 11 3HZ LYS 11 -5.016 -0.733 -10.658
67 HZ2 LYS 11 1HZ LYS 11 -4.831 -1.991 -11.774
68 HZ3 LYS 11 2HZ LYS 11 -6.380 -1.465 -11.342
69 HA PRO 12 HA PRO 12 -5.907 6.946 -7.273
70 HB2 PRO 12 1HB PRO 12 -7.166 6.674 -4.882
71 HB3 PRO 12 2HB PRO 12 -8.006 7.156 -6.361
72 HG2 PRO 12 1HG PRO 12 -7.853 4.464 -5.061
73 HG3 PRO 12 2HG PRO 12 -9.253 5.282 -5.778
74 HD2 PRO 12 1HD PRO 12 -7.869 3.353 -7.080
75 HD3 PRO 12 2HD PRO 12 -8.649 4.704 -7.926
76 H TYR 13 H TYR 13 -5.666 3.809 -5.685
77 HA TYR 13 HA TYR 13 -3.839 4.644 -3.666
78 HB2 TYR 13 1HB TYR 13 -4.676 1.958 -4.737
79 HB3 TYR 13 2HB TYR 13 -3.406 2.107 -3.528
80 HD1 TYR 13 HD1 TYR 13 -6.327 4.339 -3.620
81 HD2 TYR 13 HD2 TYR 13 -4.588 0.900 -1.816
82 HE1 TYR 13 HE1 TYR 13 -8.030 4.415 -1.847
83 HE2 TYR 13 HE2 TYR 13 -6.286 0.966 -0.038
84 HH TYR 13 HH TYR 13 -8.160 1.933 0.683
85 H LYS 14 H LYS 14 -1.854 5.339 -4.069
86 HA LYS 14 HA LYS 14 -0.356 4.145 -6.304
87 HB2 LYS 14 1HB LYS 14 -0.556 6.479 -6.663
88 HB3 LYS 14 2HB LYS 14 -0.191 6.847 -4.982
89 HG2 LYS 14 1HG LYS 14 2.077 6.473 -5.256
90 HG3 LYS 14 2HG LYS 14 1.842 5.495 -6.706
91 HD2 LYS 14 1HD LYS 14 1.519 7.346 -8.059
92 HD3 LYS 14 2HD LYS 14 1.048 8.378 -6.707
93 HE2 LYS 14 1HE LYS 14 3.813 7.263 -6.798
94 HE3 LYS 14 2HE LYS 14 3.404 8.629 -7.834
95 HZ1 LYS 14 3HZ LYS 14 4.162 8.759 -5.214
96 HZ2 LYS 14 1HZ LYS 14 2.489 9.001 -5.156
97 HZ3 LYS 14 2HZ LYS 14 3.456 10.007 -6.111
98 H CYS 15 H CYS 15 1.532 3.119 -5.945
99 HA CYS 15 HA CYS 15 2.221 2.418 -3.257
100 HB2 CYS 15 1HB CYS 15 2.426 0.858 -5.193
101 HB3 CYS 15 2HB CYS 15 3.747 1.848 -5.806
102 H TYR 16 H TYR 16 3.161 3.904 -2.003
103 HA TYR 16 HA TYR 16 4.795 6.010 -2.949
104 HB2 TYR 16 1HB TYR 16 4.798 4.954 -0.124
105 HB3 TYR 16 2HB TYR 16 5.109 6.598 -0.670
106 HD1 TYR 16 HD1 TYR 16 2.834 7.006 -2.526
107 HD2 TYR 16 HD2 TYR 16 2.972 5.182 1.315
108 HE1 TYR 16 HE1 TYR 16 0.465 7.572 -2.179
109 HE2 TYR 16 HE2 TYR 16 0.604 5.742 1.673
110 HH TYR 16 HH TYR 16 -1.484 6.414 -0.551
111 H GLU 17 H GLU 17 5.437 2.743 -2.544
112 HA GLU 17 HA GLU 17 8.169 2.912 -1.712
113 HB2 GLU 17 1HB GLU 17 6.905 0.611 -3.193
114 HB3 GLU 17 2HB GLU 17 8.274 0.567 -2.091
115 HG2 GLU 17 1HG GLU 17 6.505 1.471 -0.374
116 HG3 GLU 17 2HG GLU 17 5.366 0.737 -1.502
117 H CYS 18 H CYS 18 6.575 2.299 -4.834
118 HA CYS 18 HA CYS 18 9.092 3.070 -6.162
119 HB2 CYS 18 1HB CYS 18 8.522 1.586 -7.995
120 HB3 CYS 18 2HB CYS 18 8.506 0.681 -6.485
121 H GLY 19 H GLY 19 5.557 3.161 -6.321
122 HA2 GLY 19 1HA GLY 19 4.712 5.481 -6.814
123 HA3 GLY 19 2HA GLY 19 5.787 5.428 -8.203
124 H LYS 20 H LYS 20 4.344 2.440 -7.496
125 HA LYS 20 HA LYS 20 2.927 2.390 -9.955
126 HB2 LYS 20 1HB LYS 20 3.081 0.534 -7.595
127 HB3 LYS 20 2HB LYS 20 1.964 0.222 -8.917
128 HG2 LYS 20 1HG LYS 20 4.789 0.756 -9.626
129 HG3 LYS 20 2HG LYS 20 4.417 -0.785 -8.850
130 HD2 LYS 20 1HD LYS 20 2.687 0.091 -11.101
131 HD3 LYS 20 2HD LYS 20 4.314 -0.474 -11.484
132 HE2 LYS 20 1HE LYS 20 2.571 -2.080 -9.665
133 HE3 LYS 20 2HE LYS 20 2.321 -2.158 -11.408
134 HZ1 LYS 20 3HZ LYS 20 4.190 -3.330 -11.703
135 HZ2 LYS 20 1HZ LYS 20 4.053 -3.691 -10.056
136 HZ3 LYS 20 2HZ LYS 20 5.071 -2.440 -10.565
137 H ALA 21 H ALA 21 0.540 1.387 -9.762
138 HA ALA 21 HA ALA 21 -1.026 2.967 -7.854
139 HB1 ALA 21 3HB ALA 21 -1.176 4.427 -9.643
140 HB2 ALA 21 1HB ALA 21 -1.183 3.129 -10.836
141 HB3 ALA 21 2HB ALA 21 -2.615 3.428 -9.850
142 H PHE 22 H PHE 22 -3.251 2.239 -7.645
143 HA PHE 22 HA PHE 22 -4.072 -0.224 -8.859
144 HB2 PHE 22 1HB PHE 22 -3.553 -0.296 -5.885
145 HB3 PHE 22 2HB PHE 22 -4.073 -1.626 -6.915
146 HD1 PHE 22 HD1 PHE 22 -1.248 0.506 -5.952
147 HD2 PHE 22 HD2 PHE 22 -2.508 -2.846 -8.253
148 HE1 PHE 22 HE1 PHE 22 1.102 -0.137 -6.295
149 HE2 PHE 22 HE2 PHE 22 -0.160 -3.495 -8.599
150 HZ PHE 22 HZ PHE 22 1.648 -2.141 -7.618
151 H ARG 23 H ARG 23 -6.248 -0.729 -8.451
152 HA ARG 23 HA ARG 23 -7.884 1.507 -7.812
153 HB2 ARG 23 1HB ARG 23 -8.630 -1.396 -8.219
154 HB3 ARG 23 2HB ARG 23 -9.766 -0.056 -8.155
155 HG2 ARG 23 1HG ARG 23 -8.423 0.914 -10.115
156 HG3 ARG 23 2HG ARG 23 -7.754 -0.711 -10.270
157 HD2 ARG 23 1HD ARG 23 -9.914 -1.646 -10.645
158 HD3 ARG 23 2HD ARG 23 -10.707 -0.130 -10.219
159 HE ARG 23 HE ARG 23 -9.015 0.358 -12.385
160 HH11 ARG 23 1HH1 ARG 23 -11.906 -1.438 -11.650
161 HH12 ARG 23 2HH1 ARG 23 -12.536 -1.335 -13.260
162 HH21 ARG 23 1HH2 ARG 23 -9.834 0.500 -14.509
163 HH22 ARG 23 2HH2 ARG 23 -11.356 -0.233 -14.886
164 H THR 24 H THR 24 -7.573 -1.691 -6.258
165 HA THR 24 HA THR 24 -8.695 -0.532 -3.803
166 HB THR 24 HB THR 24 -9.435 -2.633 -3.163
167 HG1 THR 24 HG1 THR 24 -8.193 -4.259 -4.970
168 HG21 THR 24 3HG2 THR 24 -10.783 -2.090 -5.013
169 HG22 THR 24 1HG2 THR 24 -10.313 -3.768 -5.281
170 HG23 THR 24 2HG2 THR 24 -9.504 -2.474 -6.166
171 H ARG 25 H ARG 25 -7.799 -1.926 -1.803
172 HA ARG 25 HA ARG 25 -5.060 -1.144 -1.554
173 HB2 ARG 25 1HB ARG 25 -6.548 -0.967 0.353
174 HB3 ARG 25 2HB ARG 25 -6.872 -2.695 0.302
175 HG2 ARG 25 1HG ARG 25 -5.342 -2.272 2.078
176 HG3 ARG 25 2HG ARG 25 -4.466 -3.097 0.787
177 HD2 ARG 25 1HD ARG 25 -3.518 -1.003 0.042
178 HD3 ARG 25 2HD ARG 25 -4.476 -0.114 1.225
179 HE ARG 25 HE ARG 25 -2.023 -1.522 1.694
180 HH11 ARG 25 1HH1 ARG 25 -4.982 -0.398 3.145
181 HH12 ARG 25 2HH1 ARG 25 -4.328 -0.345 4.748
182 HH21 ARG 25 1HH2 ARG 25 -1.151 -1.457 3.801
183 HH22 ARG 25 2HH2 ARG 25 -2.149 -0.947 5.120
184 H SER 26 H SER 26 -6.671 -4.315 -1.253
185 HA SER 26 HA SER 26 -4.493 -5.941 -1.006
186 HB2 SER 26 1HB SER 26 -7.000 -6.553 -1.088
187 HB3 SER 26 2HB SER 26 -6.764 -6.713 -2.829
188 HG SER 26 HG SER 26 -6.392 -8.707 -1.969
189 H ASN 27 H ASN 27 -5.743 -4.479 -3.956
190 HA ASN 27 HA ASN 27 -4.085 -5.888 -5.764
191 HB2 ASN 27 1HB ASN 27 -5.791 -3.453 -5.878
192 HB3 ASN 27 2HB ASN 27 -4.569 -3.639 -7.133
193 HD21 ASN 27 1HD2 ASN 27 -7.242 -3.611 -7.736
194 HD22 ASN 27 2HD2 ASN 27 -7.729 -5.179 -8.273
195 H LEU 28 H LEU 28 -3.613 -3.045 -3.798
196 HA LEU 28 HA LEU 28 -1.187 -2.250 -5.140
197 HB2 LEU 28 1HB LEU 28 -2.174 -0.400 -4.251
198 HB3 LEU 28 2HB LEU 28 -2.802 -1.273 -2.854
199 HG LEU 28 HG LEU 28 -0.528 -1.259 -1.875
200 HD11 LEU 28 1HD1 LEU 28 0.503 -0.939 -4.242
201 HD12 LEU 28 2HD1 LEU 28 1.278 -0.202 -2.840
202 HD13 LEU 28 3HD1 LEU 28 0.272 0.778 -3.907
203 HD21 LEU 28 3HD2 LEU 28 -1.818 1.365 -2.585
204 HD22 LEU 28 1HD2 LEU 28 -0.480 1.227 -1.444
205 HD23 LEU 28 2HD2 LEU 28 -2.011 0.418 -1.109
206 H THR 29 H THR 29 -1.879 -3.290 -1.796
207 HA THR 29 HA THR 29 0.695 -3.669 -0.920
208 HB THR 29 HB THR 29 -1.765 -5.282 -0.229
209 HG1 THR 29 HG1 THR 29 -1.697 -2.972 0.269
210 HG21 THR 29 3HG2 THR 29 0.373 -6.476 0.287
211 HG22 THR 29 1HG2 THR 29 -0.602 -6.093 1.706
212 HG23 THR 29 2HG2 THR 29 0.818 -5.120 1.323
213 H THR 30 H THR 30 -1.373 -6.049 -2.565
214 HA THR 30 HA THR 30 0.210 -8.272 -2.520
215 HB THR 30 HB THR 30 -1.565 -7.216 -4.711
216 HG1 THR 30 HG1 THR 30 -3.018 -8.364 -3.675
217 HG21 THR 30 3HG2 THR 30 -1.404 -9.495 -5.722
218 HG22 THR 30 1HG2 THR 30 -0.040 -9.821 -4.655
219 HG23 THR 30 2HG2 THR 30 0.073 -8.543 -5.865
220 H HIS 31 H HIS 31 0.736 -5.339 -4.313
221 HA HIS 31 HA HIS 31 2.905 -6.537 -5.858
222 HB2 HIS 31 1HB HIS 31 1.833 -5.118 -7.299
223 HB3 HIS 31 2HB HIS 31 1.331 -4.020 -6.016
224 HD1 HIS 31 HD1 HIS 31 4.114 -4.692 -8.404
225 HD2 HIS 31 HD2 HIS 31 3.174 -1.992 -5.390
226 HE1 HIS 31 HE1 HIS 31 5.790 -2.830 -8.622
227 H GLN 32 H GLN 32 2.354 -4.328 -3.202
228 HA GLN 32 HA GLN 32 4.881 -3.149 -3.034
229 HB2 GLN 32 1HB GLN 32 2.844 -3.794 -0.904
230 HB3 GLN 32 2HB GLN 32 4.312 -2.882 -0.578
231 HG2 GLN 32 1HG GLN 32 3.394 -1.452 -2.627
232 HG3 GLN 32 2HG GLN 32 1.862 -2.088 -2.028
233 HE21 GLN 32 1HE2 GLN 32 0.941 -0.455 -0.991
234 HE22 GLN 32 2HE2 GLN 32 1.680 0.494 0.249
235 H VAL 33 H VAL 33 3.910 -6.365 -2.447
236 HA VAL 33 HA VAL 33 5.591 -7.258 -0.454
237 HB VAL 33 HB VAL 33 4.972 -8.754 -3.004
238 HG11 VAL 33 1HG1 VAL 33 6.136 -9.511 -0.379
239 HG12 VAL 33 2HG1 VAL 33 5.049 -10.657 -1.165
240 HG13 VAL 33 3HG1 VAL 33 6.505 -10.109 -1.996
241 HG21 VAL 33 3HG2 VAL 33 3.371 -8.280 -0.516
242 HG22 VAL 33 1HG2 VAL 33 2.874 -8.150 -2.203
243 HG23 VAL 33 2HG2 VAL 33 3.136 -9.737 -1.480
244 H ILE 34 H ILE 34 6.342 -6.584 -3.828
245 HA ILE 34 HA ILE 34 8.861 -7.736 -4.011
246 HB ILE 34 HB ILE 34 9.329 -6.213 -5.820
247 HG12 ILE 34 1HG1 ILE 34 7.015 -4.610 -4.718
248 HG13 ILE 34 2HG1 ILE 34 8.698 -4.106 -4.837
249 HG21 ILE 34 1HG2 ILE 34 6.569 -7.313 -5.586
250 HG22 ILE 34 2HG2 ILE 34 6.992 -6.350 -7.001
251 HG23 ILE 34 3HG2 ILE 34 7.899 -7.816 -6.629
252 HD11 ILE 34 3HD1 ILE 34 7.769 -3.014 -6.617
253 HD12 ILE 34 1HD1 ILE 34 8.325 -4.500 -7.389
254 HD13 ILE 34 2HD1 ILE 34 6.625 -4.312 -6.958
255 H HIS 35 H HIS 35 7.850 -4.802 -2.425
256 HA HIS 35 HA HIS 35 10.594 -3.932 -1.989
257 HB2 HIS 35 1HB HIS 35 8.020 -2.702 -0.986
258 HB3 HIS 35 2HB HIS 35 9.617 -1.959 -0.957
259 HD1 HIS 35 HD1 HIS 35 10.685 -1.712 -3.519
260 HD2 HIS 35 HD2 HIS 35 6.556 -1.953 -3.126
261 HE1 HIS 35 HE1 HIS 35 9.751 -0.781 -5.660
262 H THR 36 H THR 36 8.233 -5.840 -0.459
263 HA THR 36 HA THR 36 9.370 -5.458 2.205
264 HB THR 36 HB THR 36 7.553 -6.740 3.061
265 HG1 THR 36 HG1 THR 36 6.936 -8.371 1.865
266 HG21 THR 36 3HG2 THR 36 7.105 -4.390 2.133
267 HG22 THR 36 1HG2 THR 36 5.710 -5.414 2.469
268 HG23 THR 36 2HG2 THR 36 6.276 -5.211 0.811
269 H GLY 37 H GLY 37 10.804 -6.809 3.090
270 HA2 GLY 37 1HA GLY 37 11.608 -9.022 3.562
271 HA3 GLY 37 2HA GLY 37 11.079 -9.513 1.960
272 H GLU 38 H GLU 38 12.964 -6.648 2.824
273 HA GLU 38 HA GLU 38 15.271 -7.818 1.422
274 HB2 GLU 38 1HB GLU 38 13.829 -6.050 0.136
275 HB3 GLU 38 2HB GLU 38 14.655 -4.897 1.174
276 HG2 GLU 38 1HG GLU 38 16.109 -6.896 -0.531
277 HG3 GLU 38 2HG GLU 38 15.675 -5.283 -1.092
278 H LYS 39 H LYS 39 14.294 -5.005 3.386
279 HA LYS 39 HA LYS 39 16.859 -4.496 4.430
280 HB2 LYS 39 1HB LYS 39 14.839 -2.944 4.412
281 HB3 LYS 39 2HB LYS 39 14.260 -3.839 5.811
282 HG2 LYS 39 1HG LYS 39 15.324 -2.061 6.799
283 HG3 LYS 39 2HG LYS 39 16.599 -3.282 6.802
284 HD2 LYS 39 1HD LYS 39 17.148 -2.198 4.453
285 HD3 LYS 39 2HD LYS 39 16.332 -0.806 5.170
286 HE2 LYS 39 1HE LYS 39 17.924 -1.383 7.203
287 HE3 LYS 39 2HE LYS 39 18.895 -2.114 5.925
288 HZ1 LYS 39 3HZ LYS 39 19.578 0.144 6.243
289 HZ2 LYS 39 1HZ LYS 39 17.994 0.711 6.067
290 HZ3 LYS 39 2HZ LYS 39 18.801 0.032 4.745
291 H ARG 40 H ARG 40 18.012 -5.769 5.710
292 HA ARG 40 HA ARG 40 17.137 -8.054 6.997
293 HB2 ARG 40 1HB ARG 40 19.447 -6.281 7.814
294 HB3 ARG 40 2HB ARG 40 19.226 -7.962 8.279
295 HG2 ARG 40 1HG ARG 40 19.391 -8.617 5.914
296 HG3 ARG 40 2HG ARG 40 19.678 -6.928 5.488
297 HD2 ARG 40 1HD ARG 40 21.396 -8.438 7.442
298 HD3 ARG 40 2HD ARG 40 21.728 -8.398 5.711
299 HE ARG 40 HE ARG 40 21.485 -5.771 6.452
300 HH11 ARG 40 1HH1 ARG 40 23.481 -8.459 7.407
301 HH12 ARG 40 2HH1 ARG 40 24.835 -7.468 7.840
302 HH21 ARG 40 1HH2 ARG 40 23.260 -4.456 7.019
303 HH22 ARG 40 2HH2 ARG 40 24.707 -5.191 7.620
304 H SER 41 H SER 41 17.558 -4.796 8.350
305 HA SER 41 HA SER 41 16.887 -5.363 10.991
306 HB2 SER 41 1HB SER 41 17.819 -3.192 10.102
307 HB3 SER 41 2HB SER 41 16.193 -2.802 9.540
308 HG SER 41 HG SER 41 16.446 -3.587 12.193
309 H GLY 42 H GLY 42 14.779 -4.351 8.309
310 HA2 GLY 42 1HA GLY 42 12.561 -4.940 7.943
311 HA3 GLY 42 2HA GLY 42 12.565 -5.798 9.476
312 HA PRO 43 HA PRO 43 10.687 -1.352 9.666
313 HB2 PRO 43 1HB PRO 43 8.134 -1.782 8.848
314 HB3 PRO 43 2HB PRO 43 9.423 -1.278 7.749
315 HG2 PRO 43 1HG PRO 43 8.302 -4.012 8.225
316 HG3 PRO 43 2HG PRO 43 8.730 -3.230 6.692
317 HD2 PRO 43 1HD PRO 43 10.341 -5.037 7.905
318 HD3 PRO 43 2HD PRO 43 10.975 -3.689 6.940
319 H SER 44 H SER 44 10.911 -1.801 11.892
320 HA SER 44 HA SER 44 8.503 -2.963 13.131
321 HB2 SER 44 1HB SER 44 11.387 -3.255 13.989
322 HB3 SER 44 2HB SER 44 10.021 -3.668 15.025
323 HG SER 44 HG SER 44 10.500 -4.770 12.453
324 H SER 45 H SER 45 7.640 -0.827 13.234
325 HA SER 45 HA SER 45 8.900 0.846 15.309
326 HB2 SER 45 1HB SER 45 8.042 2.814 14.216
327 HB3 SER 45 2HB SER 45 8.896 1.855 13.007
328 HG SER 45 HG SER 45 6.813 2.649 12.321
329 H GLY 46 H GLY 46 7.348 2.208 16.536
330 HA2 GLY 46 1HA GLY 46 4.577 1.447 16.572
331 HA3 GLY 46 2HA GLY 46 5.484 0.766 17.914
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -9.764 26.207 -7.674
2 HA2 GLY 1 1HA GLY 1 -11.206 26.119 -9.522
3 HA3 GLY 1 2HA GLY 1 -10.847 27.807 -9.854
4 H SER 2 H SER 2 -8.569 25.135 -9.409
5 HA SER 2 HA SER 2 -7.209 25.862 -11.844
6 HB2 SER 2 1HB SER 2 -6.160 25.005 -9.628
7 HB3 SER 2 2HB SER 2 -6.593 23.403 -10.225
8 HG SER 2 HG SER 2 -4.419 24.492 -10.770
9 H SER 3 H SER 3 -8.236 25.327 -13.679
10 HA SER 3 HA SER 3 -9.873 23.036 -13.993
11 HB2 SER 3 1HB SER 3 -9.857 25.240 -15.358
12 HB3 SER 3 2HB SER 3 -8.576 24.473 -16.297
13 HG SER 3 HG SER 3 -11.174 24.148 -16.561
14 H GLY 4 H GLY 4 -8.802 21.156 -13.495
15 HA2 GLY 4 1HA GLY 4 -7.174 20.028 -15.555
16 HA3 GLY 4 2HA GLY 4 -6.230 20.405 -14.122
17 H SER 5 H SER 5 -6.251 19.021 -12.442
18 HA SER 5 HA SER 5 -7.793 16.566 -12.777
19 HB2 SER 5 1HB SER 5 -6.307 15.650 -11.033
20 HB3 SER 5 2HB SER 5 -5.387 16.346 -12.367
21 HG SER 5 HG SER 5 -4.996 16.890 -9.918
22 H SER 6 H SER 6 -9.748 16.544 -11.891
23 HA SER 6 HA SER 6 -10.158 17.931 -9.328
24 HB2 SER 6 1HB SER 6 -11.564 18.568 -11.362
25 HB3 SER 6 2HB SER 6 -12.333 16.990 -11.200
26 HG SER 6 HG SER 6 -13.239 17.599 -9.334
27 H GLY 7 H GLY 7 -8.889 15.472 -9.238
28 HA2 GLY 7 1HA GLY 7 -9.024 13.613 -7.865
29 HA3 GLY 7 2HA GLY 7 -10.706 14.012 -7.550
30 H THR 8 H THR 8 -8.930 11.599 -8.602
31 HA THR 8 HA THR 8 -10.841 10.802 -10.701
32 HB THR 8 HB THR 8 -9.036 9.201 -11.453
33 HG1 THR 8 HG1 THR 8 -7.459 10.840 -9.729
34 HG21 THR 8 3HG2 THR 8 -9.199 12.073 -11.827
35 HG22 THR 8 1HG2 THR 8 -8.918 10.799 -13.012
36 HG23 THR 8 2HG2 THR 8 -7.566 11.468 -12.098
37 H LYS 9 H LYS 9 -12.035 9.033 -10.362
38 HA LYS 9 HA LYS 9 -11.666 7.577 -7.867
39 HB2 LYS 9 1HB LYS 9 -13.890 7.819 -9.862
40 HB3 LYS 9 2HB LYS 9 -13.871 6.468 -8.736
41 HG2 LYS 9 1HG LYS 9 -13.832 8.037 -6.859
42 HG3 LYS 9 2HG LYS 9 -13.868 9.388 -7.995
43 HD2 LYS 9 1HD LYS 9 -15.984 7.267 -8.072
44 HD3 LYS 9 2HD LYS 9 -16.082 8.594 -6.912
45 HE2 LYS 9 1HE LYS 9 -15.569 9.226 -9.778
46 HE3 LYS 9 2HE LYS 9 -17.200 8.767 -9.292
47 HZ1 LYS 9 3HZ LYS 9 -17.518 10.799 -8.514
48 HZ2 LYS 9 1HZ LYS 9 -15.972 11.253 -9.029
49 HZ3 LYS 9 2HZ LYS 9 -16.199 10.650 -7.465
50 H GLU 10 H GLU 10 -9.687 7.102 -9.810
51 HA GLU 10 HA GLU 10 -10.106 4.237 -10.235
52 HB2 GLU 10 1HB GLU 10 -9.618 4.238 -12.484
53 HB3 GLU 10 2HB GLU 10 -10.508 5.747 -12.346
54 HG2 GLU 10 1HG GLU 10 -8.230 6.858 -12.045
55 HG3 GLU 10 2HG GLU 10 -7.554 5.339 -12.630
56 H LYS 11 H LYS 11 -8.312 2.998 -9.934
57 HA LYS 11 HA LYS 11 -6.351 2.572 -8.776
58 HB2 LYS 11 1HB LYS 11 -5.279 4.239 -11.056
59 HB3 LYS 11 2HB LYS 11 -4.438 2.956 -10.196
60 HG2 LYS 11 1HG LYS 11 -6.517 1.545 -11.055
61 HG3 LYS 11 2HG LYS 11 -6.509 2.791 -12.305
62 HD2 LYS 11 1HD LYS 11 -4.098 2.303 -12.687
63 HD3 LYS 11 2HD LYS 11 -4.232 0.964 -11.545
64 HE2 LYS 11 1HE LYS 11 -4.473 0.002 -13.682
65 HE3 LYS 11 2HE LYS 11 -6.102 0.086 -13.015
66 HZ1 LYS 11 3HZ LYS 11 -6.022 0.809 -15.329
67 HZ2 LYS 11 1HZ LYS 11 -4.933 2.038 -14.923
68 HZ3 LYS 11 2HZ LYS 11 -6.509 2.070 -14.311
69 HA PRO 12 HA PRO 12 -6.020 6.968 -7.042
70 HB2 PRO 12 1HB PRO 12 -7.280 6.498 -4.684
71 HB3 PRO 12 2HB PRO 12 -8.131 7.037 -6.137
72 HG2 PRO 12 1HG PRO 12 -7.877 4.277 -5.004
73 HG3 PRO 12 2HG PRO 12 -9.305 5.081 -5.682
74 HD2 PRO 12 1HD PRO 12 -7.835 3.294 -7.088
75 HD3 PRO 12 2HD PRO 12 -8.665 4.663 -7.856
76 H TYR 13 H TYR 13 -5.665 3.752 -5.643
77 HA TYR 13 HA TYR 13 -3.849 4.562 -3.590
78 HB2 TYR 13 1HB TYR 13 -4.692 1.903 -4.713
79 HB3 TYR 13 2HB TYR 13 -3.387 2.018 -3.538
80 HD1 TYR 13 HD1 TYR 13 -6.442 4.110 -3.593
81 HD2 TYR 13 HD2 TYR 13 -4.386 0.895 -1.712
82 HE1 TYR 13 HE1 TYR 13 -8.092 4.130 -1.769
83 HE2 TYR 13 HE2 TYR 13 -6.031 0.905 0.116
84 HH TYR 13 HH TYR 13 -8.964 2.420 -0.057
85 H LYS 14 H LYS 14 -1.872 5.280 -3.990
86 HA LYS 14 HA LYS 14 -0.375 4.128 -6.250
87 HB2 LYS 14 1HB LYS 14 -0.621 6.447 -6.636
88 HB3 LYS 14 2HB LYS 14 -0.282 6.846 -4.957
89 HG2 LYS 14 1HG LYS 14 2.004 6.498 -5.206
90 HG3 LYS 14 2HG LYS 14 1.794 5.548 -6.679
91 HD2 LYS 14 1HD LYS 14 1.336 7.450 -7.973
92 HD3 LYS 14 2HD LYS 14 1.018 8.447 -6.551
93 HE2 LYS 14 1HE LYS 14 3.397 8.260 -5.928
94 HE3 LYS 14 2HE LYS 14 3.691 7.334 -7.398
95 HZ1 LYS 14 3HZ LYS 14 3.554 10.140 -7.063
96 HZ2 LYS 14 1HZ LYS 14 2.390 9.641 -8.185
97 HZ3 LYS 14 2HZ LYS 14 4.019 9.252 -8.426
98 H CYS 15 H CYS 15 1.425 3.010 -5.849
99 HA CYS 15 HA CYS 15 2.184 2.387 -3.185
100 HB2 CYS 15 1HB CYS 15 2.424 0.820 -5.098
101 HB3 CYS 15 2HB CYS 15 3.697 1.848 -5.748
102 H TYR 16 H TYR 16 3.152 3.823 -1.907
103 HA TYR 16 HA TYR 16 4.719 5.991 -2.855
104 HB2 TYR 16 1HB TYR 16 4.707 4.893 -0.042
105 HB3 TYR 16 2HB TYR 16 5.076 6.536 -0.553
106 HD1 TYR 16 HD1 TYR 16 2.826 7.009 -2.449
107 HD2 TYR 16 HD2 TYR 16 2.884 5.193 1.398
108 HE1 TYR 16 HE1 TYR 16 0.472 7.644 -2.121
109 HE2 TYR 16 HE2 TYR 16 0.530 5.821 1.737
110 HH TYR 16 HH TYR 16 -1.031 7.682 0.794
111 H GLU 17 H GLU 17 5.426 2.732 -2.462
112 HA GLU 17 HA GLU 17 8.161 2.954 -1.654
113 HB2 GLU 17 1HB GLU 17 6.937 0.629 -3.130
114 HB3 GLU 17 2HB GLU 17 8.307 0.613 -2.028
115 HG2 GLU 17 1HG GLU 17 6.559 1.450 -0.288
116 HG3 GLU 17 2HG GLU 17 5.393 0.776 -1.426
117 H CYS 18 H CYS 18 6.545 2.338 -4.763
118 HA CYS 18 HA CYS 18 9.040 3.141 -6.111
119 HB2 CYS 18 1HB CYS 18 8.488 1.655 -7.937
120 HB3 CYS 18 2HB CYS 18 8.456 0.742 -6.432
121 H GLY 19 H GLY 19 5.515 3.267 -6.143
122 HA2 GLY 19 1HA GLY 19 4.612 5.531 -6.639
123 HA3 GLY 19 2HA GLY 19 5.704 5.546 -8.016
124 H LYS 20 H LYS 20 4.316 2.508 -7.405
125 HA LYS 20 HA LYS 20 2.958 2.463 -9.888
126 HB2 LYS 20 1HB LYS 20 3.112 0.606 -7.539
127 HB3 LYS 20 2HB LYS 20 1.948 0.299 -8.821
128 HG2 LYS 20 1HG LYS 20 4.753 0.809 -9.625
129 HG3 LYS 20 2HG LYS 20 4.394 -0.728 -8.833
130 HD2 LYS 20 1HD LYS 20 2.734 0.261 -11.129
131 HD3 LYS 20 2HD LYS 20 4.248 -0.605 -11.404
132 HE2 LYS 20 1HE LYS 20 3.234 -2.348 -9.761
133 HE3 LYS 20 2HE LYS 20 1.703 -1.574 -10.165
134 HZ1 LYS 20 3HZ LYS 20 3.341 -2.226 -12.447
135 HZ2 LYS 20 1HZ LYS 20 1.690 -2.487 -12.189
136 HZ3 LYS 20 2HZ LYS 20 2.825 -3.575 -11.566
137 H ALA 21 H ALA 21 0.566 1.395 -9.711
138 HA ALA 21 HA ALA 21 -1.058 3.003 -7.879
139 HB1 ALA 21 3HB ALA 21 -1.014 4.376 -9.824
140 HB2 ALA 21 1HB ALA 21 -1.335 2.999 -10.878
141 HB3 ALA 21 2HB ALA 21 -2.587 3.581 -9.780
142 H PHE 22 H PHE 22 -3.265 2.248 -7.681
143 HA PHE 22 HA PHE 22 -4.053 -0.231 -8.884
144 HB2 PHE 22 1HB PHE 22 -3.552 -0.274 -5.905
145 HB3 PHE 22 2HB PHE 22 -4.064 -1.617 -6.923
146 HD1 PHE 22 HD1 PHE 22 -1.253 0.490 -5.909
147 HD2 PHE 22 HD2 PHE 22 -2.489 -2.801 -8.308
148 HE1 PHE 22 HE1 PHE 22 1.100 -0.149 -6.238
149 HE2 PHE 22 HE2 PHE 22 -0.138 -3.447 -8.639
150 HZ PHE 22 HZ PHE 22 1.660 -2.121 -7.603
151 H ARG 23 H ARG 23 -6.231 -0.606 -8.692
152 HA ARG 23 HA ARG 23 -7.894 1.560 -8.057
153 HB2 ARG 23 1HB ARG 23 -8.703 -1.346 -8.242
154 HB3 ARG 23 2HB ARG 23 -9.748 0.053 -8.447
155 HG2 ARG 23 1HG ARG 23 -8.201 0.675 -10.396
156 HG3 ARG 23 2HG ARG 23 -7.625 -0.989 -10.281
157 HD2 ARG 23 1HD ARG 23 -9.865 -1.826 -10.638
158 HD3 ARG 23 2HD ARG 23 -10.510 -0.185 -10.629
159 HE ARG 23 HE ARG 23 -8.570 -0.335 -12.628
160 HH11 ARG 23 1HH1 ARG 23 -11.705 -1.662 -11.897
161 HH12 ARG 23 2HH1 ARG 23 -12.156 -1.852 -13.559
162 HH21 ARG 23 1HH2 ARG 23 -9.153 -0.581 -14.819
163 HH22 ARG 23 2HH2 ARG 23 -10.703 -1.238 -15.220
164 H THR 24 H THR 24 -7.351 -1.492 -6.307
165 HA THR 24 HA THR 24 -8.526 -0.231 -3.917
166 HB THR 24 HB THR 24 -9.228 -2.342 -3.131
167 HG1 THR 24 HG1 THR 24 -7.348 -3.536 -3.666
168 HG21 THR 24 3HG2 THR 24 -9.669 -2.066 -6.093
169 HG22 THR 24 1HG2 THR 24 -10.767 -1.660 -4.775
170 HG23 THR 24 2HG2 THR 24 -10.430 -3.349 -5.153
171 H ARG 25 H ARG 25 -7.657 -1.731 -1.910
172 HA ARG 25 HA ARG 25 -4.860 -1.036 -1.750
173 HB2 ARG 25 1HB ARG 25 -6.791 -0.945 0.083
174 HB3 ARG 25 2HB ARG 25 -6.207 -2.570 0.417
175 HG2 ARG 25 1HG ARG 25 -4.370 -0.200 0.305
176 HG3 ARG 25 2HG ARG 25 -5.209 -0.682 1.780
177 HD2 ARG 25 1HD ARG 25 -4.105 -2.773 1.837
178 HD3 ARG 25 2HD ARG 25 -3.507 -2.582 0.189
179 HE ARG 25 HE ARG 25 -1.722 -1.452 1.039
180 HH11 ARG 25 1HH1 ARG 25 -4.315 -1.322 3.358
181 HH12 ARG 25 2HH1 ARG 25 -3.369 -0.518 4.566
182 HH21 ARG 25 1HH2 ARG 25 -0.466 -0.394 2.621
183 HH22 ARG 25 2HH2 ARG 25 -1.180 0.010 4.146
184 H SER 26 H SER 26 -6.748 -4.032 -1.343
185 HA SER 26 HA SER 26 -4.755 -5.841 -0.900
186 HB2 SER 26 1HB SER 26 -7.157 -6.415 -0.959
187 HB3 SER 26 2HB SER 26 -7.141 -6.270 -2.717
188 HG SER 26 HG SER 26 -5.770 -8.159 -1.110
189 H ASN 27 H ASN 27 -5.748 -4.496 -4.016
190 HA ASN 27 HA ASN 27 -3.997 -6.092 -5.583
191 HB2 ASN 27 1HB ASN 27 -6.092 -4.659 -6.267
192 HB3 ASN 27 2HB ASN 27 -4.899 -3.381 -6.479
193 HD21 ASN 27 1HD2 ASN 27 -6.477 -5.884 -7.956
194 HD22 ASN 27 2HD2 ASN 27 -5.426 -6.117 -9.307
195 H LEU 28 H LEU 28 -3.657 -3.071 -3.872
196 HA LEU 28 HA LEU 28 -1.214 -2.293 -5.147
197 HB2 LEU 28 1HB LEU 28 -2.210 -0.449 -4.277
198 HB3 LEU 28 2HB LEU 28 -2.880 -1.326 -2.903
199 HG LEU 28 HG LEU 28 -0.627 -1.305 -1.858
200 HD11 LEU 28 1HD1 LEU 28 0.644 -1.068 -3.972
201 HD12 LEU 28 2HD1 LEU 28 1.109 0.102 -2.738
202 HD13 LEU 28 3HD1 LEU 28 0.083 0.601 -4.082
203 HD21 LEU 28 3HD2 LEU 28 -2.308 0.367 -1.270
204 HD22 LEU 28 1HD2 LEU 28 -1.746 1.402 -2.583
205 HD23 LEU 28 2HD2 LEU 28 -0.682 1.051 -1.220
206 H THR 29 H THR 29 -1.957 -3.469 -1.861
207 HA THR 29 HA THR 29 0.634 -3.740 -0.933
208 HB THR 29 HB THR 29 -1.830 -5.356 -0.284
209 HG1 THR 29 HG1 THR 29 -1.360 -4.028 1.750
210 HG21 THR 29 3HG2 THR 29 -0.445 -6.857 0.647
211 HG22 THR 29 1HG2 THR 29 -0.149 -5.623 1.870
212 HG23 THR 29 2HG2 THR 29 0.952 -5.792 0.503
213 H THR 30 H THR 30 -1.353 -6.156 -2.625
214 HA THR 30 HA THR 30 0.281 -8.341 -2.574
215 HB THR 30 HB THR 30 -1.509 -7.307 -4.758
216 HG1 THR 30 HG1 THR 30 -2.833 -8.284 -3.422
217 HG21 THR 30 3HG2 THR 30 0.159 -8.520 -5.967
218 HG22 THR 30 1HG2 THR 30 -1.249 -9.570 -5.816
219 HG23 THR 30 2HG2 THR 30 0.154 -9.823 -4.779
220 H HIS 31 H HIS 31 0.746 -5.390 -4.365
221 HA HIS 31 HA HIS 31 2.961 -6.518 -5.889
222 HB2 HIS 31 1HB HIS 31 1.871 -5.092 -7.312
223 HB3 HIS 31 2HB HIS 31 1.351 -4.020 -6.015
224 HD1 HIS 31 HD1 HIS 31 4.183 -4.647 -8.370
225 HD2 HIS 31 HD2 HIS 31 3.137 -1.956 -5.382
226 HE1 HIS 31 HE1 HIS 31 5.830 -2.756 -8.560
227 H GLN 32 H GLN 32 2.349 -4.288 -3.247
228 HA GLN 32 HA GLN 32 4.866 -3.112 -3.028
229 HB2 GLN 32 1HB GLN 32 2.798 -3.770 -0.932
230 HB3 GLN 32 2HB GLN 32 4.256 -2.852 -0.581
231 HG2 GLN 32 1HG GLN 32 3.367 -1.422 -2.642
232 HG3 GLN 32 2HG GLN 32 1.829 -2.065 -2.070
233 HE21 GLN 32 1HE2 GLN 32 0.843 -0.582 -0.909
234 HE22 GLN 32 2HE2 GLN 32 1.572 0.423 0.292
235 H VAL 33 H VAL 33 3.910 -6.335 -2.468
236 HA VAL 33 HA VAL 33 5.580 -7.208 -0.447
237 HB VAL 33 HB VAL 33 4.957 -8.726 -2.983
238 HG11 VAL 33 1HG1 VAL 33 6.055 -9.493 -0.316
239 HG12 VAL 33 2HG1 VAL 33 5.064 -10.644 -1.214
240 HG13 VAL 33 3HG1 VAL 33 6.548 -10.013 -1.927
241 HG21 VAL 33 3HG2 VAL 33 3.140 -9.700 -1.401
242 HG22 VAL 33 1HG2 VAL 33 3.360 -8.192 -0.512
243 HG23 VAL 33 2HG2 VAL 33 2.853 -8.155 -2.201
244 H ILE 34 H ILE 34 6.333 -6.566 -3.827
245 HA ILE 34 HA ILE 34 8.845 -7.723 -4.011
246 HB ILE 34 HB ILE 34 9.320 -6.204 -5.818
247 HG12 ILE 34 1HG1 ILE 34 7.024 -4.578 -4.710
248 HG13 ILE 34 2HG1 ILE 34 8.712 -4.092 -4.825
249 HG21 ILE 34 1HG2 ILE 34 6.972 -6.310 -6.988
250 HG22 ILE 34 2HG2 ILE 34 7.875 -7.783 -6.636
251 HG23 ILE 34 3HG2 ILE 34 6.555 -7.283 -5.578
252 HD11 ILE 34 3HD1 ILE 34 8.353 -4.460 -7.375
253 HD12 ILE 34 1HD1 ILE 34 6.648 -4.288 -6.961
254 HD13 ILE 34 2HD1 ILE 34 7.779 -2.984 -6.600
255 H HIS 35 H HIS 35 7.857 -4.769 -2.438
256 HA HIS 35 HA HIS 35 10.603 -3.916 -2.001
257 HB2 HIS 35 1HB HIS 35 8.035 -2.690 -0.973
258 HB3 HIS 35 2HB HIS 35 9.633 -1.950 -0.949
259 HD1 HIS 35 HD1 HIS 35 10.688 -1.677 -3.510
260 HD2 HIS 35 HD2 HIS 35 6.561 -1.935 -3.105
261 HE1 HIS 35 HE1 HIS 35 9.743 -0.733 -5.641
262 H THR 36 H THR 36 8.295 -5.879 -0.490
263 HA THR 36 HA THR 36 9.331 -5.462 2.199
264 HB THR 36 HB THR 36 7.633 -6.983 2.956
265 HG1 THR 36 HG1 THR 36 7.386 -8.598 1.564
266 HG21 THR 36 3HG2 THR 36 6.062 -5.611 0.856
267 HG22 THR 36 1HG2 THR 36 7.080 -4.591 1.871
268 HG23 THR 36 2HG2 THR 36 5.850 -5.619 2.606
269 H GLY 37 H GLY 37 9.921 -7.422 3.499
270 HA2 GLY 37 1HA GLY 37 10.733 -9.841 2.347
271 HA3 GLY 37 2HA GLY 37 12.108 -8.747 2.313
272 H GLU 38 H GLU 38 13.345 -9.885 3.776
273 HA GLU 38 HA GLU 38 12.277 -10.019 6.520
274 HB2 GLU 38 1HB GLU 38 12.986 -12.174 5.192
275 HB3 GLU 38 2HB GLU 38 14.610 -11.670 5.635
276 HG2 GLU 38 1HG GLU 38 12.355 -12.512 7.410
277 HG3 GLU 38 2HG GLU 38 13.991 -13.161 7.307
278 H LYS 39 H LYS 39 15.014 -9.163 4.497
279 HA LYS 39 HA LYS 39 16.789 -8.446 6.582
280 HB2 LYS 39 1HB LYS 39 16.637 -7.924 3.645
281 HB3 LYS 39 2HB LYS 39 17.745 -6.960 4.612
282 HG2 LYS 39 1HG LYS 39 17.806 -9.916 4.917
283 HG3 LYS 39 2HG LYS 39 18.510 -9.197 3.467
284 HD2 LYS 39 1HD LYS 39 19.208 -8.230 6.226
285 HD3 LYS 39 2HD LYS 39 20.060 -9.574 5.463
286 HE2 LYS 39 1HE LYS 39 19.741 -6.906 4.117
287 HE3 LYS 39 2HE LYS 39 21.078 -7.248 5.214
288 HZ1 LYS 39 3HZ LYS 39 21.926 -8.865 3.790
289 HZ2 LYS 39 1HZ LYS 39 21.455 -7.623 2.742
290 HZ3 LYS 39 2HZ LYS 39 20.488 -9.000 2.909
291 H ARG 40 H ARG 40 17.139 -6.544 7.628
292 HA ARG 40 HA ARG 40 16.609 -4.544 8.580
293 HB2 ARG 40 1HB ARG 40 15.982 -3.912 5.692
294 HB3 ARG 40 2HB ARG 40 16.063 -2.705 6.968
295 HG2 ARG 40 1HG ARG 40 18.349 -2.884 7.180
296 HG3 ARG 40 2HG ARG 40 18.389 -4.511 6.499
297 HD2 ARG 40 1HD ARG 40 17.452 -2.290 4.762
298 HD3 ARG 40 2HD ARG 40 19.176 -2.389 5.120
299 HE ARG 40 HE ARG 40 18.660 -4.886 4.339
300 HH11 ARG 40 1HH1 ARG 40 17.759 -1.824 2.948
301 HH12 ARG 40 2HH1 ARG 40 17.737 -2.422 1.322
302 HH21 ARG 40 1HH2 ARG 40 18.634 -5.685 2.202
303 HH22 ARG 40 2HH2 ARG 40 18.234 -4.618 0.899
304 H SER 41 H SER 41 14.606 -6.454 8.816
305 HA SER 41 HA SER 41 12.251 -4.725 8.978
306 HB2 SER 41 1HB SER 41 12.382 -7.387 7.576
307 HB3 SER 41 2HB SER 41 10.868 -6.780 8.247
308 HG SER 41 HG SER 41 11.324 -4.832 6.963
309 H GLY 42 H GLY 42 10.517 -5.745 10.354
310 HA2 GLY 42 1HA GLY 42 11.777 -6.804 12.744
311 HA3 GLY 42 2HA GLY 42 10.111 -6.268 12.591
312 HA PRO 43 HA PRO 43 9.478 -10.698 12.949
313 HB2 PRO 43 1HB PRO 43 6.803 -10.513 13.376
314 HB3 PRO 43 2HB PRO 43 8.000 -10.227 14.644
315 HG2 PRO 43 1HG PRO 43 6.506 -8.246 12.969
316 HG3 PRO 43 2HG PRO 43 6.852 -8.206 14.707
317 HD2 PRO 43 1HD PRO 43 8.281 -6.778 12.904
318 HD3 PRO 43 2HD PRO 43 8.999 -7.432 14.390
319 H SER 44 H SER 44 9.989 -10.932 10.664
320 HA SER 44 HA SER 44 7.603 -10.941 8.935
321 HB2 SER 44 1HB SER 44 9.396 -9.447 8.145
322 HB3 SER 44 2HB SER 44 10.520 -10.805 8.130
323 HG SER 44 HG SER 44 9.584 -11.586 6.375
324 H SER 45 H SER 45 6.799 -12.867 8.469
325 HA SER 45 HA SER 45 8.160 -15.279 9.178
326 HB2 SER 45 1HB SER 45 5.499 -14.581 8.024
327 HB3 SER 45 2HB SER 45 6.082 -16.232 7.813
328 HG SER 45 HG SER 45 4.813 -15.582 9.817
329 H GLY 46 H GLY 46 9.702 -16.196 8.006
330 HA2 GLY 46 1HA GLY 46 9.661 -17.308 5.605
331 HA3 GLY 46 2HA GLY 46 9.884 -15.626 5.148
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -0.244 14.483 -20.615
2 HA2 GLY 1 1HA GLY 1 -3.027 13.559 -20.239
3 HA3 GLY 1 2HA GLY 1 -1.963 13.933 -18.891
4 H SER 2 H SER 2 -3.887 15.322 -18.376
5 HA SER 2 HA SER 2 -4.836 17.378 -18.159
6 HB2 SER 2 1HB SER 2 -2.163 18.185 -19.316
7 HB3 SER 2 2HB SER 2 -3.356 19.346 -18.735
8 HG SER 2 HG SER 2 -1.632 17.770 -17.330
9 H SER 3 H SER 3 -5.635 15.932 -20.386
10 HA SER 3 HA SER 3 -5.500 17.132 -22.863
11 HB2 SER 3 1HB SER 3 -6.580 14.997 -22.622
12 HB3 SER 3 2HB SER 3 -7.809 15.678 -21.556
13 HG SER 3 HG SER 3 -7.455 16.120 -24.329
14 H GLY 4 H GLY 4 -7.844 17.797 -20.266
15 HA2 GLY 4 1HA GLY 4 -8.037 20.444 -20.274
16 HA3 GLY 4 2HA GLY 4 -8.892 20.070 -21.763
17 H SER 5 H SER 5 -10.391 17.937 -21.219
18 HA SER 5 HA SER 5 -12.030 18.769 -18.914
19 HB2 SER 5 1HB SER 5 -12.894 19.124 -21.370
20 HB3 SER 5 2HB SER 5 -13.236 17.396 -21.290
21 HG SER 5 HG SER 5 -14.533 17.795 -19.474
22 H SER 6 H SER 6 -10.002 16.907 -18.609
23 HA SER 6 HA SER 6 -11.504 14.385 -18.332
24 HB2 SER 6 1HB SER 6 -9.529 13.143 -18.721
25 HB3 SER 6 2HB SER 6 -9.502 14.419 -19.938
26 HG SER 6 HG SER 6 -7.849 14.005 -17.758
27 H GLY 7 H GLY 7 -11.858 13.723 -16.319
28 HA2 GLY 7 1HA GLY 7 -9.938 14.422 -14.217
29 HA3 GLY 7 2HA GLY 7 -11.609 14.924 -14.006
30 H THR 8 H THR 8 -12.889 12.665 -15.079
31 HA THR 8 HA THR 8 -12.946 10.976 -12.828
32 HB THR 8 HB THR 8 -14.362 9.476 -14.241
33 HG1 THR 8 HG1 THR 8 -14.855 10.223 -16.356
34 HG21 THR 8 3HG2 THR 8 -16.212 11.019 -14.446
35 HG22 THR 8 1HG2 THR 8 -15.110 12.396 -14.430
36 HG23 THR 8 2HG2 THR 8 -15.300 11.401 -12.986
37 H LYS 9 H LYS 9 -11.324 9.685 -12.249
38 HA LYS 9 HA LYS 9 -10.273 7.794 -14.212
39 HB2 LYS 9 1HB LYS 9 -8.633 9.752 -12.626
40 HB3 LYS 9 2HB LYS 9 -7.950 8.217 -13.149
41 HG2 LYS 9 1HG LYS 9 -8.199 8.775 -15.431
42 HG3 LYS 9 2HG LYS 9 -9.222 10.163 -15.053
43 HD2 LYS 9 1HD LYS 9 -7.353 11.304 -14.024
44 HD3 LYS 9 2HD LYS 9 -6.321 9.892 -14.264
45 HE2 LYS 9 1HE LYS 9 -6.931 10.192 -16.768
46 HE3 LYS 9 2HE LYS 9 -7.392 11.824 -16.285
47 HZ1 LYS 9 3HZ LYS 9 -5.193 12.250 -15.528
48 HZ2 LYS 9 1HZ LYS 9 -5.069 11.607 -17.088
49 HZ3 LYS 9 2HZ LYS 9 -4.727 10.639 -15.745
50 H GLU 10 H GLU 10 -8.715 6.213 -12.988
51 HA GLU 10 HA GLU 10 -9.824 5.644 -10.323
52 HB2 GLU 10 1HB GLU 10 -10.537 4.199 -12.494
53 HB3 GLU 10 2HB GLU 10 -9.095 3.320 -12.003
54 HG2 GLU 10 1HG GLU 10 -10.605 2.183 -10.774
55 HG3 GLU 10 2HG GLU 10 -10.283 3.486 -9.631
56 H LYS 11 H LYS 11 -8.420 3.536 -9.534
57 HA LYS 11 HA LYS 11 -6.409 2.790 -8.765
58 HB2 LYS 11 1HB LYS 11 -5.096 4.418 -10.939
59 HB3 LYS 11 2HB LYS 11 -4.451 3.005 -10.114
60 HG2 LYS 11 1HG LYS 11 -6.620 1.884 -11.150
61 HG3 LYS 11 2HG LYS 11 -6.415 3.186 -12.323
62 HD2 LYS 11 1HD LYS 11 -4.019 2.445 -12.559
63 HD3 LYS 11 2HD LYS 11 -4.442 1.029 -11.594
64 HE2 LYS 11 1HE LYS 11 -5.997 0.280 -13.234
65 HE3 LYS 11 2HE LYS 11 -5.885 1.799 -14.122
66 HZ1 LYS 11 3HZ LYS 11 -4.615 -0.090 -15.101
67 HZ2 LYS 11 1HZ LYS 11 -3.593 -0.046 -13.754
68 HZ3 LYS 11 2HZ LYS 11 -3.684 1.287 -14.790
69 HA PRO 12 HA PRO 12 -5.927 7.117 -6.932
70 HB2 PRO 12 1HB PRO 12 -7.198 6.613 -4.587
71 HB3 PRO 12 2HB PRO 12 -8.036 7.209 -6.025
72 HG2 PRO 12 1HG PRO 12 -7.844 4.416 -4.965
73 HG3 PRO 12 2HG PRO 12 -9.253 5.270 -5.621
74 HD2 PRO 12 1HD PRO 12 -7.824 3.487 -7.074
75 HD3 PRO 12 2HD PRO 12 -8.622 4.894 -7.806
76 H TYR 13 H TYR 13 -5.631 3.855 -5.638
77 HA TYR 13 HA TYR 13 -3.779 4.587 -3.575
78 HB2 TYR 13 1HB TYR 13 -4.750 1.972 -4.695
79 HB3 TYR 13 2HB TYR 13 -3.419 2.024 -3.544
80 HD1 TYR 13 HD1 TYR 13 -6.311 4.316 -3.472
81 HD2 TYR 13 HD2 TYR 13 -4.504 0.863 -1.765
82 HE1 TYR 13 HE1 TYR 13 -7.925 4.395 -1.618
83 HE2 TYR 13 HE2 TYR 13 -6.113 0.932 0.093
84 HH TYR 13 HH TYR 13 -8.889 2.469 0.067
85 H LYS 14 H LYS 14 -1.811 5.295 -4.059
86 HA LYS 14 HA LYS 14 -0.372 4.045 -6.303
87 HB2 LYS 14 1HB LYS 14 -0.547 6.349 -6.759
88 HB3 LYS 14 2HB LYS 14 -0.223 6.792 -5.088
89 HG2 LYS 14 1HG LYS 14 2.058 6.415 -5.297
90 HG3 LYS 14 2HG LYS 14 1.858 5.406 -6.732
91 HD2 LYS 14 1HD LYS 14 1.459 7.251 -8.115
92 HD3 LYS 14 2HD LYS 14 1.103 8.311 -6.749
93 HE2 LYS 14 1HE LYS 14 3.467 8.136 -6.048
94 HE3 LYS 14 2HE LYS 14 3.795 7.162 -7.480
95 HZ1 LYS 14 3HZ LYS 14 3.806 9.934 -7.267
96 HZ2 LYS 14 1HZ LYS 14 2.486 9.532 -8.246
97 HZ3 LYS 14 2HZ LYS 14 4.038 9.002 -8.660
98 H CYS 15 H CYS 15 1.536 3.045 -5.963
99 HA CYS 15 HA CYS 15 2.281 2.401 -3.278
100 HB2 CYS 15 1HB CYS 15 2.484 0.802 -5.168
101 HB3 CYS 15 2HB CYS 15 3.751 1.812 -5.856
102 H TYR 16 H TYR 16 3.241 3.891 -2.049
103 HA TYR 16 HA TYR 16 4.825 6.014 -3.051
104 HB2 TYR 16 1HB TYR 16 4.849 4.983 -0.215
105 HB3 TYR 16 2HB TYR 16 5.192 6.617 -0.771
106 HD1 TYR 16 HD1 TYR 16 2.923 7.068 -2.622
107 HD2 TYR 16 HD2 TYR 16 3.028 5.248 1.223
108 HE1 TYR 16 HE1 TYR 16 0.568 7.684 -2.273
109 HE2 TYR 16 HE2 TYR 16 0.673 5.859 1.582
110 HH TYR 16 HH TYR 16 -0.974 8.067 -0.384
111 H GLU 17 H GLU 17 5.514 2.760 -2.598
112 HA GLU 17 HA GLU 17 8.256 2.978 -1.816
113 HB2 GLU 17 1HB GLU 17 7.015 0.632 -3.240
114 HB3 GLU 17 2HB GLU 17 8.382 0.631 -2.135
115 HG2 GLU 17 1HG GLU 17 6.619 1.528 -0.427
116 HG3 GLU 17 2HG GLU 17 5.470 0.799 -1.547
117 H CYS 18 H CYS 18 6.640 2.223 -4.899
118 HA CYS 18 HA CYS 18 9.125 2.996 -6.283
119 HB2 CYS 18 1HB CYS 18 8.530 1.487 -8.073
120 HB3 CYS 18 2HB CYS 18 8.479 0.604 -6.551
121 H GLY 19 H GLY 19 5.588 3.119 -6.388
122 HA2 GLY 19 1HA GLY 19 4.748 5.435 -6.889
123 HA3 GLY 19 2HA GLY 19 5.812 5.373 -8.286
124 H LYS 20 H LYS 20 4.354 2.397 -7.549
125 HA LYS 20 HA LYS 20 2.924 2.339 -10.000
126 HB2 LYS 20 1HB LYS 20 3.134 0.500 -7.640
127 HB3 LYS 20 2HB LYS 20 1.936 0.193 -8.891
128 HG2 LYS 20 1HG LYS 20 4.736 0.667 -9.747
129 HG3 LYS 20 2HG LYS 20 4.354 -0.870 -8.967
130 HD2 LYS 20 1HD LYS 20 2.763 0.219 -11.278
131 HD3 LYS 20 2HD LYS 20 4.180 -0.810 -11.498
132 HE2 LYS 20 1HE LYS 20 2.064 -1.728 -9.626
133 HE3 LYS 20 2HE LYS 20 1.724 -1.802 -11.354
134 HZ1 LYS 20 3HZ LYS 20 3.927 -3.138 -9.889
135 HZ2 LYS 20 1HZ LYS 20 3.872 -3.035 -11.577
136 HZ3 LYS 20 2HZ LYS 20 2.659 -3.866 -10.740
137 H ALA 21 H ALA 21 0.536 1.422 -9.859
138 HA ALA 21 HA ALA 21 -1.011 3.010 -7.933
139 HB1 ALA 21 3HB ALA 21 -0.981 4.380 -9.886
140 HB2 ALA 21 1HB ALA 21 -1.387 3.011 -10.921
141 HB3 ALA 21 2HB ALA 21 -2.576 3.636 -9.778
142 H PHE 22 H PHE 22 -3.215 2.288 -7.659
143 HA PHE 22 HA PHE 22 -4.090 -0.166 -8.853
144 HB2 PHE 22 1HB PHE 22 -3.515 -0.251 -5.890
145 HB3 PHE 22 2HB PHE 22 -4.045 -1.576 -6.921
146 HD1 PHE 22 HD1 PHE 22 -1.215 0.524 -5.935
147 HD2 PHE 22 HD2 PHE 22 -2.494 -2.749 -8.337
148 HE1 PHE 22 HE1 PHE 22 1.132 -0.112 -6.313
149 HE2 PHE 22 HE2 PHE 22 -0.149 -3.390 -8.718
150 HZ PHE 22 HZ PHE 22 1.667 -2.072 -7.705
151 H ARG 23 H ARG 23 -6.256 -0.686 -8.335
152 HA ARG 23 HA ARG 23 -7.857 1.577 -7.669
153 HB2 ARG 23 1HB ARG 23 -8.732 -1.300 -7.967
154 HB3 ARG 23 2HB ARG 23 -9.754 0.127 -8.068
155 HG2 ARG 23 1HG ARG 23 -8.267 0.815 -10.038
156 HG3 ARG 23 2HG ARG 23 -7.713 -0.860 -10.022
157 HD2 ARG 23 1HD ARG 23 -9.992 -1.641 -10.321
158 HD3 ARG 23 2HD ARG 23 -10.590 0.016 -10.249
159 HE ARG 23 HE ARG 23 -10.000 0.279 -12.440
160 HH11 ARG 23 1HH1 ARG 23 -8.352 -2.504 -11.154
161 HH12 ARG 23 2HH1 ARG 23 -7.712 -2.997 -12.687
162 HH21 ARG 23 1HH2 ARG 23 -9.164 -0.359 -14.464
163 HH22 ARG 23 2HH2 ARG 23 -8.174 -1.775 -14.569
164 H THR 24 H THR 24 -7.450 -1.609 -6.120
165 HA THR 24 HA THR 24 -8.461 -0.427 -3.619
166 HB THR 24 HB THR 24 -9.177 -2.576 -2.914
167 HG1 THR 24 HG1 THR 24 -8.257 -3.895 -5.209
168 HG21 THR 24 3HG2 THR 24 -10.569 -3.367 -4.891
169 HG22 THR 24 1HG2 THR 24 -9.793 -2.085 -5.820
170 HG23 THR 24 2HG2 THR 24 -10.774 -1.683 -4.410
171 H ARG 25 H ARG 25 -7.566 -1.741 -1.642
172 HA ARG 25 HA ARG 25 -4.785 -1.208 -1.514
173 HB2 ARG 25 1HB ARG 25 -6.280 -1.034 0.438
174 HB3 ARG 25 2HB ARG 25 -6.523 -2.775 0.400
175 HG2 ARG 25 1HG ARG 25 -4.936 -2.251 2.111
176 HG3 ARG 25 2HG ARG 25 -4.097 -3.075 0.795
177 HD2 ARG 25 1HD ARG 25 -3.238 -0.981 -0.030
178 HD3 ARG 25 2HD ARG 25 -4.188 -0.084 1.154
179 HE ARG 25 HE ARG 25 -2.204 -1.993 2.135
180 HH11 ARG 25 1HH1 ARG 25 -3.182 1.308 1.613
181 HH12 ARG 25 2HH1 ARG 25 -2.012 1.965 2.708
182 HH21 ARG 25 1HH2 ARG 25 -0.660 -1.140 3.580
183 HH22 ARG 25 2HH2 ARG 25 -0.577 0.572 3.826
184 H SER 26 H SER 26 -6.536 -4.299 -1.151
185 HA SER 26 HA SER 26 -4.499 -6.068 -1.027
186 HB2 SER 26 1HB SER 26 -6.927 -6.655 -1.043
187 HB3 SER 26 2HB SER 26 -6.923 -6.466 -2.796
188 HG SER 26 HG SER 26 -5.875 -8.301 -3.006
189 H ASN 27 H ASN 27 -5.758 -4.622 -4.012
190 HA ASN 27 HA ASN 27 -4.048 -5.997 -5.780
191 HB2 ASN 27 1HB ASN 27 -6.183 -4.551 -6.239
192 HB3 ASN 27 2HB ASN 27 -5.031 -3.226 -6.370
193 HD21 ASN 27 1HD2 ASN 27 -6.744 -5.253 -8.155
194 HD22 ASN 27 2HD2 ASN 27 -5.699 -5.458 -9.516
195 H LEU 28 H LEU 28 -3.658 -3.072 -3.896
196 HA LEU 28 HA LEU 28 -1.221 -2.284 -5.208
197 HB2 LEU 28 1HB LEU 28 -2.241 -0.432 -4.365
198 HB3 LEU 28 2HB LEU 28 -2.878 -1.289 -2.962
199 HG LEU 28 HG LEU 28 -0.614 -1.229 -1.954
200 HD11 LEU 28 1HD1 LEU 28 0.739 -1.083 -3.939
201 HD12 LEU 28 2HD1 LEU 28 1.039 0.329 -2.927
202 HD13 LEU 28 3HD1 LEU 28 0.021 0.472 -4.359
203 HD21 LEU 28 3HD2 LEU 28 -2.515 0.670 -1.925
204 HD22 LEU 28 1HD2 LEU 28 -1.163 1.606 -2.563
205 HD23 LEU 28 2HD2 LEU 28 -1.011 0.785 -1.010
206 H THR 29 H THR 29 -1.945 -3.300 -1.864
207 HA THR 29 HA THR 29 0.625 -3.612 -0.943
208 HB THR 29 HB THR 29 -1.814 -5.263 -0.266
209 HG1 THR 29 HG1 THR 29 -2.180 -3.730 1.204
210 HG21 THR 29 3HG2 THR 29 -0.374 -5.517 1.931
211 HG22 THR 29 1HG2 THR 29 0.968 -5.310 0.806
212 HG23 THR 29 2HG2 THR 29 -0.176 -6.634 0.580
213 H THR 30 H THR 30 -1.375 -6.057 -2.578
214 HA THR 30 HA THR 30 0.249 -8.247 -2.482
215 HB THR 30 HB THR 30 -1.516 -7.255 -4.710
216 HG1 THR 30 HG1 THR 30 -2.946 -8.592 -3.801
217 HG21 THR 30 3HG2 THR 30 -1.296 -9.556 -5.678
218 HG22 THR 30 1HG2 THR 30 0.079 -9.814 -4.605
219 HG23 THR 30 2HG2 THR 30 0.148 -8.557 -5.840
220 H HIS 31 H HIS 31 0.685 -5.364 -4.412
221 HA HIS 31 HA HIS 31 2.905 -6.528 -5.887
222 HB2 HIS 31 1HB HIS 31 1.826 -5.125 -7.339
223 HB3 HIS 31 2HB HIS 31 1.307 -4.028 -6.063
224 HD1 HIS 31 HD1 HIS 31 4.140 -4.703 -8.402
225 HD2 HIS 31 HD2 HIS 31 3.094 -1.955 -5.466
226 HE1 HIS 31 HE1 HIS 31 5.790 -2.818 -8.626
227 H GLN 32 H GLN 32 2.320 -4.301 -3.250
228 HA GLN 32 HA GLN 32 4.860 -3.131 -3.082
229 HB2 GLN 32 1HB GLN 32 2.776 -3.684 -0.971
230 HB3 GLN 32 2HB GLN 32 4.247 -2.776 -0.650
231 HG2 GLN 32 1HG GLN 32 3.383 -1.402 -2.756
232 HG3 GLN 32 2HG GLN 32 1.833 -2.007 -2.174
233 HE21 GLN 32 1HE2 GLN 32 0.838 -0.639 -0.898
234 HE22 GLN 32 2HE2 GLN 32 1.581 0.457 0.210
235 H VAL 33 H VAL 33 3.848 -6.317 -2.449
236 HA VAL 33 HA VAL 33 5.511 -7.147 -0.390
237 HB VAL 33 HB VAL 33 4.820 -8.763 -2.846
238 HG11 VAL 33 1HG1 VAL 33 6.271 -10.146 -1.786
239 HG12 VAL 33 2HG1 VAL 33 6.017 -9.389 -0.212
240 HG13 VAL 33 3HG1 VAL 33 4.831 -10.531 -0.844
241 HG21 VAL 33 3HG2 VAL 33 2.732 -8.114 -2.113
242 HG22 VAL 33 1HG2 VAL 33 2.983 -9.592 -1.185
243 HG23 VAL 33 2HG2 VAL 33 3.235 -8.021 -0.425
244 H ILE 34 H ILE 34 6.259 -6.449 -3.726
245 HA ILE 34 HA ILE 34 8.738 -7.756 -3.916
246 HB ILE 34 HB ILE 34 9.212 -6.339 -5.803
247 HG12 ILE 34 1HG1 ILE 34 6.953 -4.621 -4.760
248 HG13 ILE 34 2HG1 ILE 34 8.649 -4.171 -4.901
249 HG21 ILE 34 1HG2 ILE 34 7.743 -7.896 -6.578
250 HG22 ILE 34 2HG2 ILE 34 6.468 -7.412 -5.460
251 HG23 ILE 34 3HG2 ILE 34 6.797 -6.442 -6.895
252 HD11 ILE 34 3HD1 ILE 34 7.781 -3.138 -6.736
253 HD12 ILE 34 1HD1 ILE 34 8.242 -4.689 -7.438
254 HD13 ILE 34 2HD1 ILE 34 6.561 -4.383 -6.999
255 H HIS 35 H HIS 35 7.795 -4.820 -2.343
256 HA HIS 35 HA HIS 35 10.555 -3.929 -2.037
257 HB2 HIS 35 1HB HIS 35 8.016 -2.668 -0.983
258 HB3 HIS 35 2HB HIS 35 9.615 -1.931 -1.020
259 HD1 HIS 35 HD1 HIS 35 10.606 -1.733 -3.613
260 HD2 HIS 35 HD2 HIS 35 6.490 -1.975 -3.100
261 HE1 HIS 35 HE1 HIS 35 9.609 -0.850 -5.746
262 H THR 36 H THR 36 8.265 -5.826 -0.408
263 HA THR 36 HA THR 36 9.341 -5.331 2.244
264 HB THR 36 HB THR 36 7.659 -6.762 3.088
265 HG1 THR 36 HG1 THR 36 7.265 -7.668 0.411
266 HG21 THR 36 3HG2 THR 36 6.224 -5.639 0.711
267 HG22 THR 36 1HG2 THR 36 6.957 -4.559 1.896
268 HG23 THR 36 2HG2 THR 36 5.711 -5.703 2.396
269 H GLY 37 H GLY 37 10.870 -6.511 3.225
270 HA2 GLY 37 1HA GLY 37 11.503 -9.028 3.428
271 HA3 GLY 37 2HA GLY 37 11.966 -8.801 1.748
272 H GLU 38 H GLU 38 13.717 -7.390 1.253
273 HA GLU 38 HA GLU 38 15.588 -7.102 3.504
274 HB2 GLU 38 1HB GLU 38 16.139 -7.265 0.535
275 HB3 GLU 38 2HB GLU 38 17.363 -7.076 1.783
276 HG2 GLU 38 1HG GLU 38 15.587 -9.445 1.285
277 HG3 GLU 38 2HG GLU 38 17.344 -9.357 1.162
278 H LYS 39 H LYS 39 16.256 -5.146 4.124
279 HA LYS 39 HA LYS 39 15.357 -2.831 2.563
280 HB2 LYS 39 1HB LYS 39 14.693 -3.094 4.992
281 HB3 LYS 39 2HB LYS 39 16.385 -2.840 5.401
282 HG2 LYS 39 1HG LYS 39 16.210 -0.651 4.128
283 HG3 LYS 39 2HG LYS 39 14.464 -0.908 4.142
284 HD2 LYS 39 1HD LYS 39 14.890 0.445 6.014
285 HD3 LYS 39 2HD LYS 39 14.694 -1.182 6.669
286 HE2 LYS 39 1HE LYS 39 17.198 -1.402 6.581
287 HE3 LYS 39 2HE LYS 39 17.264 0.315 6.187
288 HZ1 LYS 39 3HZ LYS 39 17.557 -0.215 8.585
289 HZ2 LYS 39 1HZ LYS 39 15.954 -0.756 8.623
290 HZ3 LYS 39 2HZ LYS 39 16.293 0.863 8.267
291 H ARG 40 H ARG 40 17.028 -2.805 1.029
292 HA ARG 40 HA ARG 40 19.644 -1.980 2.107
293 HB2 ARG 40 1HB ARG 40 19.359 -4.279 0.824
294 HB3 ARG 40 2HB ARG 40 19.445 -3.240 -0.592
295 HG2 ARG 40 1HG ARG 40 21.645 -3.786 -0.338
296 HG3 ARG 40 2HG ARG 40 21.576 -2.303 0.615
297 HD2 ARG 40 1HD ARG 40 22.646 -3.655 2.107
298 HD3 ARG 40 2HD ARG 40 20.974 -4.003 2.548
299 HE ARG 40 HE ARG 40 21.203 -6.126 1.670
300 HH11 ARG 40 1HH1 ARG 40 23.984 -4.188 0.878
301 HH12 ARG 40 2HH1 ARG 40 24.924 -5.532 0.318
302 HH21 ARG 40 1HH2 ARG 40 22.429 -7.903 0.935
303 HH22 ARG 40 2HH2 ARG 40 24.038 -7.644 0.350
304 H SER 41 H SER 41 17.569 -1.819 -0.785
305 HA SER 41 HA SER 41 18.866 0.349 -1.998
306 HB2 SER 41 1HB SER 41 16.048 -0.705 -2.212
307 HB3 SER 41 2HB SER 41 16.609 0.667 -3.166
308 HG SER 41 HG SER 41 18.143 -1.674 -3.151
309 H GLY 42 H GLY 42 16.053 0.263 0.173
310 HA2 GLY 42 1HA GLY 42 15.624 3.069 0.167
311 HA3 GLY 42 2HA GLY 42 14.995 1.931 1.350
312 HA PRO 43 HA PRO 43 18.804 4.497 2.853
313 HB2 PRO 43 1HB PRO 43 17.652 6.822 3.649
314 HB3 PRO 43 2HB PRO 43 18.339 6.594 2.037
315 HG2 PRO 43 1HG PRO 43 15.481 6.446 2.917
316 HG3 PRO 43 2HG PRO 43 16.168 7.206 1.470
317 HD2 PRO 43 1HD PRO 43 14.977 4.775 1.411
318 HD3 PRO 43 2HD PRO 43 16.325 5.204 0.338
319 H SER 44 H SER 44 19.308 4.646 5.034
320 HA SER 44 HA SER 44 17.142 3.876 6.877
321 HB2 SER 44 1HB SER 44 19.216 2.330 6.402
322 HB3 SER 44 2HB SER 44 20.033 3.420 7.521
323 HG SER 44 HG SER 44 17.551 2.468 8.316
324 H SER 45 H SER 45 16.655 6.165 7.103
325 HA SER 45 HA SER 45 16.975 8.303 7.926
326 HB2 SER 45 1HB SER 45 17.021 8.287 10.328
327 HB3 SER 45 2HB SER 45 16.143 6.849 9.810
328 HG SER 45 HG SER 45 18.909 6.839 10.422
329 H GLY 46 H GLY 46 19.238 7.594 6.466
330 HA2 GLY 46 1HA GLY 46 21.120 9.256 6.499
331 HA3 GLY 46 2HA GLY 46 21.424 8.681 8.131
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -15.413 29.717 -11.594
2 HA2 GLY 1 1HA GLY 1 -12.881 31.182 -11.331
3 HA3 GLY 1 2HA GLY 1 -13.680 30.613 -9.873
4 H SER 2 H SER 2 -13.177 28.646 -9.158
5 HA SER 2 HA SER 2 -11.961 26.746 -11.052
6 HB2 SER 2 1HB SER 2 -10.136 27.580 -9.757
7 HB3 SER 2 2HB SER 2 -11.053 27.447 -8.257
8 HG SER 2 HG SER 2 -9.496 25.727 -8.667
9 H SER 3 H SER 3 -12.774 24.741 -11.024
10 HA SER 3 HA SER 3 -15.144 24.144 -9.658
11 HB2 SER 3 1HB SER 3 -14.701 22.960 -11.674
12 HB3 SER 3 2HB SER 3 -13.141 22.390 -11.082
13 HG SER 3 HG SER 3 -15.039 20.893 -11.025
14 H GLY 4 H GLY 4 -11.909 22.713 -9.154
15 HA2 GLY 4 1HA GLY 4 -11.194 22.809 -6.723
16 HA3 GLY 4 2HA GLY 4 -12.753 22.064 -6.400
17 H SER 5 H SER 5 -11.981 20.184 -5.513
18 HA SER 5 HA SER 5 -9.867 18.639 -6.467
19 HB2 SER 5 1HB SER 5 -10.920 18.339 -4.244
20 HB3 SER 5 2HB SER 5 -12.345 17.659 -5.029
21 HG SER 5 HG SER 5 -10.891 16.043 -5.910
22 H SER 6 H SER 6 -9.718 16.896 -7.847
23 HA SER 6 HA SER 6 -11.621 16.850 -10.003
24 HB2 SER 6 1HB SER 6 -9.053 16.574 -10.155
25 HB3 SER 6 2HB SER 6 -9.349 14.901 -9.680
26 HG SER 6 HG SER 6 -11.030 15.198 -11.545
27 H GLY 7 H GLY 7 -10.628 14.645 -7.419
28 HA2 GLY 7 1HA GLY 7 -12.083 13.124 -6.351
29 HA3 GLY 7 2HA GLY 7 -13.167 13.229 -7.731
30 H THR 8 H THR 8 -10.124 11.868 -6.586
31 HA THR 8 HA THR 8 -9.878 10.123 -8.877
32 HB THR 8 HB THR 8 -8.299 9.967 -6.309
33 HG1 THR 8 HG1 THR 8 -8.186 11.789 -8.425
34 HG21 THR 8 3HG2 THR 8 -6.636 8.873 -7.630
35 HG22 THR 8 1HG2 THR 8 -7.504 9.227 -9.123
36 HG23 THR 8 2HG2 THR 8 -8.174 8.078 -7.965
37 H LYS 9 H LYS 9 -10.769 8.181 -9.072
38 HA LYS 9 HA LYS 9 -11.522 6.712 -6.637
39 HB2 LYS 9 1HB LYS 9 -13.200 7.031 -9.133
40 HB3 LYS 9 2HB LYS 9 -13.578 5.946 -7.802
41 HG2 LYS 9 1HG LYS 9 -13.158 8.818 -7.181
42 HG3 LYS 9 2HG LYS 9 -14.652 8.346 -7.994
43 HD2 LYS 9 1HD LYS 9 -13.705 6.901 -5.543
44 HD3 LYS 9 2HD LYS 9 -14.611 8.410 -5.414
45 HE2 LYS 9 1HE LYS 9 -16.535 7.484 -6.277
46 HE3 LYS 9 2HE LYS 9 -15.664 6.224 -7.149
47 HZ1 LYS 9 3HZ LYS 9 -16.866 6.068 -4.627
48 HZ2 LYS 9 1HZ LYS 9 -15.199 5.876 -4.414
49 HZ3 LYS 9 2HZ LYS 9 -16.039 4.856 -5.470
50 H GLU 10 H GLU 10 -10.517 6.655 -9.984
51 HA GLU 10 HA GLU 10 -10.244 3.747 -9.937
52 HB2 GLU 10 1HB GLU 10 -10.155 3.798 -12.236
53 HB3 GLU 10 2HB GLU 10 -11.139 5.221 -11.921
54 HG2 GLU 10 1HG GLU 10 -8.986 6.554 -12.016
55 HG3 GLU 10 2HG GLU 10 -8.238 5.099 -12.674
56 H LYS 11 H LYS 11 -8.409 2.838 -9.321
57 HA LYS 11 HA LYS 11 -6.226 2.539 -8.748
58 HB2 LYS 11 1HB LYS 11 -5.458 4.391 -10.982
59 HB3 LYS 11 2HB LYS 11 -4.650 2.928 -10.432
60 HG2 LYS 11 1HG LYS 11 -7.379 2.562 -11.475
61 HG3 LYS 11 2HG LYS 11 -6.163 3.069 -12.650
62 HD2 LYS 11 1HD LYS 11 -4.721 1.183 -11.776
63 HD3 LYS 11 2HD LYS 11 -6.146 0.617 -10.902
64 HE2 LYS 11 1HE LYS 11 -6.422 1.188 -13.805
65 HE3 LYS 11 2HE LYS 11 -5.540 -0.263 -13.329
66 HZ1 LYS 11 3HZ LYS 11 -7.433 -1.063 -12.161
67 HZ2 LYS 11 1HZ LYS 11 -7.958 -0.600 -13.701
68 HZ3 LYS 11 2HZ LYS 11 -8.269 0.393 -12.367
69 HA PRO 12 HA PRO 12 -6.085 7.024 -7.108
70 HB2 PRO 12 1HB PRO 12 -7.339 6.631 -4.732
71 HB3 PRO 12 2HB PRO 12 -8.195 7.113 -6.201
72 HG2 PRO 12 1HG PRO 12 -7.924 4.397 -4.972
73 HG3 PRO 12 2HG PRO 12 -9.357 5.169 -5.675
74 HD2 PRO 12 1HD PRO 12 -7.881 3.341 -7.020
75 HD3 PRO 12 2HD PRO 12 -8.719 4.677 -7.834
76 H TYR 13 H TYR 13 -5.613 3.838 -5.728
77 HA TYR 13 HA TYR 13 -3.820 4.739 -3.667
78 HB2 TYR 13 1HB TYR 13 -4.682 2.042 -4.675
79 HB3 TYR 13 2HB TYR 13 -3.349 2.194 -3.537
80 HD1 TYR 13 HD1 TYR 13 -6.315 4.385 -3.523
81 HD2 TYR 13 HD2 TYR 13 -4.393 1.045 -1.720
82 HE1 TYR 13 HE1 TYR 13 -7.921 4.474 -1.662
83 HE2 TYR 13 HE2 TYR 13 -5.995 1.123 0.145
84 HH TYR 13 HH TYR 13 -8.538 3.601 0.281
85 H LYS 14 H LYS 14 -1.795 5.330 -4.010
86 HA LYS 14 HA LYS 14 -0.348 4.160 -6.296
87 HB2 LYS 14 1HB LYS 14 -0.522 6.464 -6.728
88 HB3 LYS 14 2HB LYS 14 -0.239 6.892 -5.045
89 HG2 LYS 14 1HG LYS 14 2.057 6.487 -5.208
90 HG3 LYS 14 2HG LYS 14 1.878 5.569 -6.705
91 HD2 LYS 14 1HD LYS 14 1.446 7.515 -7.965
92 HD3 LYS 14 2HD LYS 14 1.170 8.486 -6.517
93 HE2 LYS 14 1HE LYS 14 3.569 8.104 -5.912
94 HE3 LYS 14 2HE LYS 14 3.785 7.346 -7.489
95 HZ1 LYS 14 3HZ LYS 14 3.414 10.158 -6.815
96 HZ2 LYS 14 1HZ LYS 14 2.693 9.617 -8.247
97 HZ3 LYS 14 2HZ LYS 14 4.362 9.451 -8.025
98 H CYS 15 H CYS 15 1.481 3.066 -5.919
99 HA CYS 15 HA CYS 15 2.236 2.447 -3.241
100 HB2 CYS 15 1HB CYS 15 2.415 0.839 -5.127
101 HB3 CYS 15 2HB CYS 15 3.700 1.826 -5.815
102 H TYR 16 H TYR 16 3.294 3.837 -1.992
103 HA TYR 16 HA TYR 16 4.877 5.973 -3.000
104 HB2 TYR 16 1HB TYR 16 4.912 4.912 -0.174
105 HB3 TYR 16 2HB TYR 16 5.283 6.545 -0.717
106 HD1 TYR 16 HD1 TYR 16 2.984 6.996 -2.570
107 HD2 TYR 16 HD2 TYR 16 3.134 5.264 1.314
108 HE1 TYR 16 HE1 TYR 16 0.645 7.656 -2.192
109 HE2 TYR 16 HE2 TYR 16 0.795 5.919 1.702
110 HH TYR 16 HH TYR 16 -0.774 8.141 0.151
111 H GLU 17 H GLU 17 5.519 2.705 -2.599
112 HA GLU 17 HA GLU 17 8.275 2.874 -1.844
113 HB2 GLU 17 1HB GLU 17 6.966 0.561 -3.265
114 HB3 GLU 17 2HB GLU 17 8.361 0.526 -2.196
115 HG2 GLU 17 1HG GLU 17 6.673 1.424 -0.426
116 HG3 GLU 17 2HG GLU 17 5.468 0.758 -1.527
117 H CYS 18 H CYS 18 6.602 2.184 -4.912
118 HA CYS 18 HA CYS 18 9.084 2.919 -6.322
119 HB2 CYS 18 1HB CYS 18 8.411 1.451 -8.131
120 HB3 CYS 18 2HB CYS 18 8.411 0.549 -6.619
121 H GLY 19 H GLY 19 5.562 3.174 -6.298
122 HA2 GLY 19 1HA GLY 19 4.728 5.465 -6.786
123 HA3 GLY 19 2HA GLY 19 5.807 5.447 -8.173
124 H LYS 20 H LYS 20 4.324 2.455 -7.551
125 HA LYS 20 HA LYS 20 2.911 2.504 -10.018
126 HB2 LYS 20 1HB LYS 20 3.173 0.557 -7.760
127 HB3 LYS 20 2HB LYS 20 1.920 0.307 -8.969
128 HG2 LYS 20 1HG LYS 20 4.723 0.786 -9.857
129 HG3 LYS 20 2HG LYS 20 4.266 -0.801 -9.234
130 HD2 LYS 20 1HD LYS 20 2.245 -0.477 -10.910
131 HD3 LYS 20 2HD LYS 20 3.393 0.599 -11.711
132 HE2 LYS 20 1HE LYS 20 5.037 -1.251 -11.742
133 HE3 LYS 20 2HE LYS 20 3.816 -2.312 -11.040
134 HZ1 LYS 20 3HZ LYS 20 4.226 -2.041 -13.662
135 HZ2 LYS 20 1HZ LYS 20 3.000 -0.898 -13.433
136 HZ3 LYS 20 2HZ LYS 20 2.747 -2.510 -12.988
137 H ALA 21 H ALA 21 0.522 1.463 -9.822
138 HA ALA 21 HA ALA 21 -1.025 3.025 -7.879
139 HB1 ALA 21 3HB ALA 21 -1.523 3.000 -10.853
140 HB2 ALA 21 1HB ALA 21 -2.609 3.694 -9.649
141 HB3 ALA 21 2HB ALA 21 -0.999 4.375 -9.882
142 H PHE 22 H PHE 22 -3.252 2.282 -7.646
143 HA PHE 22 HA PHE 22 -4.047 -0.215 -8.807
144 HB2 PHE 22 1HB PHE 22 -3.485 -0.207 -5.838
145 HB3 PHE 22 2HB PHE 22 -4.041 -1.564 -6.812
146 HD1 PHE 22 HD1 PHE 22 -1.177 0.566 -5.976
147 HD2 PHE 22 HD2 PHE 22 -2.519 -2.832 -8.160
148 HE1 PHE 22 HE1 PHE 22 1.159 -0.108 -6.356
149 HE2 PHE 22 HE2 PHE 22 -0.186 -3.512 -8.543
150 HZ PHE 22 HZ PHE 22 1.657 -2.150 -7.640
151 H ARG 23 H ARG 23 -6.221 -0.638 -8.525
152 HA ARG 23 HA ARG 23 -7.880 1.551 -7.894
153 HB2 ARG 23 1HB ARG 23 -8.523 -1.378 -8.266
154 HB3 ARG 23 2HB ARG 23 -9.741 -0.120 -8.099
155 HG2 ARG 23 1HG ARG 23 -8.472 0.973 -10.100
156 HG3 ARG 23 2HG ARG 23 -7.880 -0.669 -10.359
157 HD2 ARG 23 1HD ARG 23 -9.953 -1.478 -10.898
158 HD3 ARG 23 2HD ARG 23 -10.794 -0.275 -9.922
159 HE ARG 23 HE ARG 23 -9.772 1.240 -11.868
160 HH11 ARG 23 1HH1 ARG 23 -11.491 -1.785 -11.978
161 HH12 ARG 23 2HH1 ARG 23 -12.198 -1.477 -13.530
162 HH21 ARG 23 1HH2 ARG 23 -10.696 1.658 -13.911
163 HH22 ARG 23 2HH2 ARG 23 -11.744 0.482 -14.629
164 H THR 24 H THR 24 -7.380 -1.537 -6.187
165 HA THR 24 HA THR 24 -8.484 -0.273 -3.764
166 HB THR 24 HB THR 24 -9.266 -2.353 -3.008
167 HG1 THR 24 HG1 THR 24 -7.827 -3.644 -5.102
168 HG21 THR 24 3HG2 THR 24 -10.763 -1.662 -4.681
169 HG22 THR 24 1HG2 THR 24 -10.444 -3.356 -5.052
170 HG23 THR 24 2HG2 THR 24 -9.646 -2.085 -5.978
171 H ARG 25 H ARG 25 -7.630 -1.813 -1.786
172 HA ARG 25 HA ARG 25 -4.843 -1.154 -1.600
173 HB2 ARG 25 1HB ARG 25 -6.161 -0.852 0.368
174 HB3 ARG 25 2HB ARG 25 -6.769 -2.501 0.290
175 HG2 ARG 25 1HG ARG 25 -5.156 -2.384 2.037
176 HG3 ARG 25 2HG ARG 25 -4.452 -3.305 0.707
177 HD2 ARG 25 1HD ARG 25 -3.107 -1.472 0.033
178 HD3 ARG 25 2HD ARG 25 -3.982 -0.358 1.083
179 HE ARG 25 HE ARG 25 -2.955 -2.166 2.814
180 HH11 ARG 25 1HH1 ARG 25 -1.573 -0.226 0.275
181 HH12 ARG 25 2HH1 ARG 25 -0.024 -0.096 1.039
182 HH21 ARG 25 1HH2 ARG 25 -0.920 -2.003 3.830
183 HH22 ARG 25 2HH2 ARG 25 0.347 -1.108 3.061
184 H SER 26 H SER 26 -6.639 -4.219 -1.255
185 HA SER 26 HA SER 26 -4.614 -6.002 -1.010
186 HB2 SER 26 1HB SER 26 -7.091 -6.509 -1.132
187 HB3 SER 26 2HB SER 26 -6.935 -6.477 -2.888
188 HG SER 26 HG SER 26 -5.081 -8.057 -2.294
189 H ASN 27 H ASN 27 -5.788 -4.641 -4.072
190 HA ASN 27 HA ASN 27 -4.024 -6.057 -5.750
191 HB2 ASN 27 1HB ASN 27 -6.147 -4.580 -6.279
192 HB3 ASN 27 2HB ASN 27 -4.947 -3.306 -6.477
193 HD21 ASN 27 1HD2 ASN 27 -5.603 -6.644 -7.465
194 HD22 ASN 27 2HD2 ASN 27 -4.992 -6.469 -9.072
195 H LEU 28 H LEU 28 -3.657 -3.148 -3.863
196 HA LEU 28 HA LEU 28 -1.216 -2.330 -5.151
197 HB2 LEU 28 1HB LEU 28 -2.276 -0.505 -4.280
198 HB3 LEU 28 2HB LEU 28 -2.867 -1.385 -2.872
199 HG LEU 28 HG LEU 28 -0.590 -1.293 -1.907
200 HD11 LEU 28 1HD1 LEU 28 1.123 0.040 -2.873
201 HD12 LEU 28 2HD1 LEU 28 0.048 0.611 -4.148
202 HD13 LEU 28 3HD1 LEU 28 0.564 -1.075 -4.120
203 HD21 LEU 28 3HD2 LEU 28 -2.338 0.398 -1.394
204 HD22 LEU 28 1HD2 LEU 28 -1.657 1.425 -2.655
205 HD23 LEU 28 2HD2 LEU 28 -0.690 1.010 -1.239
206 H THR 29 H THR 29 -1.938 -3.369 -1.813
207 HA THR 29 HA THR 29 0.632 -3.704 -0.904
208 HB THR 29 HB THR 29 -1.865 -5.252 -0.225
209 HG1 THR 29 HG1 THR 29 -0.518 -2.998 0.764
210 HG21 THR 29 3HG2 THR 29 -0.261 -6.797 0.429
211 HG22 THR 29 1HG2 THR 29 -0.456 -5.824 1.886
212 HG23 THR 29 2HG2 THR 29 0.925 -5.553 0.822
213 H THR 30 H THR 30 -1.381 -6.102 -2.585
214 HA THR 30 HA THR 30 0.231 -8.312 -2.494
215 HB THR 30 HB THR 30 -1.569 -7.296 -4.676
216 HG1 THR 30 HG1 THR 30 -2.706 -9.256 -3.953
217 HG21 THR 30 3HG2 THR 30 0.059 -9.836 -4.681
218 HG22 THR 30 1HG2 THR 30 0.103 -8.536 -5.871
219 HG23 THR 30 2HG2 THR 30 -1.331 -9.553 -5.728
220 H HIS 31 H HIS 31 0.731 -5.383 -4.298
221 HA HIS 31 HA HIS 31 2.918 -6.557 -5.832
222 HB2 HIS 31 1HB HIS 31 1.838 -5.142 -7.272
223 HB3 HIS 31 2HB HIS 31 1.327 -4.051 -5.988
224 HD1 HIS 31 HD1 HIS 31 4.143 -4.717 -8.347
225 HD2 HIS 31 HD2 HIS 31 3.131 -1.994 -5.377
226 HE1 HIS 31 HE1 HIS 31 5.802 -2.839 -8.563
227 H GLN 32 H GLN 32 2.340 -4.291 -3.215
228 HA GLN 32 HA GLN 32 4.867 -3.131 -3.026
229 HB2 GLN 32 1HB GLN 32 2.803 -3.744 -0.914
230 HB3 GLN 32 2HB GLN 32 4.273 -2.840 -0.577
231 HG2 GLN 32 1HG GLN 32 3.410 -1.407 -2.633
232 HG3 GLN 32 2HG GLN 32 1.858 -2.044 -2.092
233 HE21 GLN 32 1HE2 GLN 32 0.878 -0.479 -1.023
234 HE22 GLN 32 2HE2 GLN 32 1.579 0.490 0.224
235 H VAL 33 H VAL 33 3.898 -6.340 -2.435
236 HA VAL 33 HA VAL 33 5.589 -7.189 -0.409
237 HB VAL 33 HB VAL 33 4.895 -8.759 -2.895
238 HG11 VAL 33 1HG1 VAL 33 6.592 -9.901 -1.704
239 HG12 VAL 33 2HG1 VAL 33 5.830 -9.561 -0.149
240 HG13 VAL 33 3HG1 VAL 33 5.074 -10.689 -1.275
241 HG21 VAL 33 3HG2 VAL 33 3.110 -9.657 -1.186
242 HG22 VAL 33 1HG2 VAL 33 3.331 -8.067 -0.455
243 HG23 VAL 33 2HG2 VAL 33 2.803 -8.201 -2.133
244 H ILE 34 H ILE 34 6.293 -6.494 -3.769
245 HA ILE 34 HA ILE 34 8.791 -7.735 -3.985
246 HB ILE 34 HB ILE 34 9.235 -6.276 -5.851
247 HG12 ILE 34 1HG1 ILE 34 6.953 -4.618 -4.763
248 HG13 ILE 34 2HG1 ILE 34 8.638 -4.133 -4.919
249 HG21 ILE 34 1HG2 ILE 34 6.442 -7.292 -5.543
250 HG22 ILE 34 2HG2 ILE 34 6.920 -6.451 -7.017
251 HG23 ILE 34 3HG2 ILE 34 7.761 -7.922 -6.529
252 HD11 ILE 34 3HD1 ILE 34 7.593 -3.081 -6.695
253 HD12 ILE 34 1HD1 ILE 34 8.294 -4.521 -7.433
254 HD13 ILE 34 2HD1 ILE 34 6.572 -4.474 -7.050
255 H HIS 35 H HIS 35 7.827 -4.801 -2.402
256 HA HIS 35 HA HIS 35 10.591 -3.926 -2.066
257 HB2 HIS 35 1HB HIS 35 8.060 -2.623 -1.047
258 HB3 HIS 35 2HB HIS 35 9.665 -1.903 -1.112
259 HD1 HIS 35 HD1 HIS 35 10.638 -1.738 -3.702
260 HD2 HIS 35 HD2 HIS 35 6.525 -1.993 -3.179
261 HE1 HIS 35 HE1 HIS 35 9.634 -0.900 -5.851
262 H THR 36 H THR 36 8.256 -5.785 -0.460
263 HA THR 36 HA THR 36 9.332 -5.286 2.199
264 HB THR 36 HB THR 36 7.602 -6.717 3.039
265 HG1 THR 36 HG1 THR 36 6.413 -8.048 1.738
266 HG21 THR 36 3HG2 THR 36 6.728 -4.576 2.588
267 HG22 THR 36 1HG2 THR 36 5.554 -5.698 1.902
268 HG23 THR 36 2HG2 THR 36 6.697 -4.865 0.848
269 H GLY 37 H GLY 37 11.485 -6.066 1.726
270 HA2 GLY 37 1HA GLY 37 11.616 -9.019 1.744
271 HA3 GLY 37 2HA GLY 37 12.770 -8.033 0.857
272 H GLU 38 H GLU 38 12.872 -9.977 3.245
273 HA GLU 38 HA GLU 38 14.543 -8.235 4.933
274 HB2 GLU 38 1HB GLU 38 12.325 -8.994 5.964
275 HB3 GLU 38 2HB GLU 38 13.022 -10.608 5.995
276 HG2 GLU 38 1HG GLU 38 14.900 -9.703 7.348
277 HG3 GLU 38 2HG GLU 38 14.045 -8.163 7.417
278 H LYS 39 H LYS 39 16.584 -8.878 5.145
279 HA LYS 39 HA LYS 39 17.242 -11.711 4.752
280 HB2 LYS 39 1HB LYS 39 19.069 -11.207 3.289
281 HB3 LYS 39 2HB LYS 39 17.634 -10.429 2.634
282 HG2 LYS 39 1HG LYS 39 18.367 -8.304 3.209
283 HG3 LYS 39 2HG LYS 39 19.518 -8.917 4.399
284 HD2 LYS 39 1HD LYS 39 19.761 -9.400 1.434
285 HD3 LYS 39 2HD LYS 39 20.543 -8.059 2.274
286 HE2 LYS 39 1HE LYS 39 22.236 -9.590 2.331
287 HE3 LYS 39 2HE LYS 39 21.412 -10.004 3.833
288 HZ1 LYS 39 3HZ LYS 39 21.113 -12.040 3.057
289 HZ2 LYS 39 1HZ LYS 39 21.886 -11.636 1.608
290 HZ3 LYS 39 2HZ LYS 39 20.213 -11.441 1.757
291 H ARG 40 H ARG 40 19.178 -12.401 5.766
292 HA ARG 40 HA ARG 40 19.671 -11.725 8.296
293 HB2 ARG 40 1HB ARG 40 21.537 -12.683 6.162
294 HB3 ARG 40 2HB ARG 40 22.182 -12.293 7.751
295 HG2 ARG 40 1HG ARG 40 21.759 -14.590 7.812
296 HG3 ARG 40 2HG ARG 40 20.410 -13.859 8.683
297 HD2 ARG 40 1HD ARG 40 20.140 -14.337 5.755
298 HD3 ARG 40 2HD ARG 40 20.015 -15.711 6.853
299 HE ARG 40 HE ARG 40 18.364 -13.496 7.621
300 HH11 ARG 40 1HH1 ARG 40 18.577 -16.321 5.598
301 HH12 ARG 40 2HH1 ARG 40 16.861 -16.534 5.490
302 HH21 ARG 40 1HH2 ARG 40 16.103 -13.765 7.486
303 HH22 ARG 40 2HH2 ARG 40 15.455 -15.079 6.563
304 H SER 41 H SER 41 19.835 -9.761 9.162
305 HA SER 41 HA SER 41 21.996 -8.016 8.254
306 HB2 SER 41 1HB SER 41 20.639 -6.078 8.052
307 HB3 SER 41 2HB SER 41 19.791 -7.340 7.159
308 HG SER 41 HG SER 41 18.820 -5.875 9.077
309 H GLY 42 H GLY 42 23.175 -7.414 9.942
310 HA2 GLY 42 1HA GLY 42 21.896 -6.723 12.461
311 HA3 GLY 42 2HA GLY 42 22.968 -8.115 12.512
312 HA PRO 43 HA PRO 43 25.217 -3.850 12.626
313 HB2 PRO 43 1HB PRO 43 25.169 -3.279 15.279
314 HB3 PRO 43 2HB PRO 43 23.944 -2.691 14.148
315 HG2 PRO 43 1HG PRO 43 23.828 -5.023 16.022
316 HG3 PRO 43 2HG PRO 43 22.586 -3.806 15.671
317 HD2 PRO 43 1HD PRO 43 22.553 -6.281 14.572
318 HD3 PRO 43 2HD PRO 43 21.935 -4.850 13.722
319 H SER 44 H SER 44 26.914 -5.338 12.109
320 HA SER 44 HA SER 44 28.402 -6.296 14.467
321 HB2 SER 44 1HB SER 44 28.152 -7.493 11.706
322 HB3 SER 44 2HB SER 44 29.423 -7.968 12.833
323 HG SER 44 HG SER 44 26.723 -7.994 13.630
324 H SER 45 H SER 45 30.812 -6.584 13.921
325 HA SER 45 HA SER 45 31.711 -4.160 12.509
326 HB2 SER 45 1HB SER 45 33.153 -5.655 14.711
327 HB3 SER 45 2HB SER 45 33.625 -4.113 13.998
328 HG SER 45 HG SER 45 31.301 -3.566 14.757
329 H GLY 46 H GLY 46 32.953 -7.388 13.408
330 HA2 GLY 46 1HA GLY 46 34.333 -8.837 12.279
331 HA3 GLY 46 2HA GLY 46 33.443 -8.326 10.852
Start of MODEL 18
1 H1 GLY 1 H GLY 1 1.738 24.208 -19.584
2 HA2 GLY 1 1HA GLY 1 -0.892 24.178 -19.614
3 HA3 GLY 1 2HA GLY 1 -0.026 22.699 -19.224
4 H SER 2 H SER 2 -2.582 24.352 -18.304
5 HA SER 2 HA SER 2 -2.259 24.681 -15.509
6 HB2 SER 2 1HB SER 2 -4.726 24.830 -15.457
7 HB3 SER 2 2HB SER 2 -4.037 25.829 -16.737
8 HG SER 2 HG SER 2 -5.895 24.057 -17.025
9 H SER 3 H SER 3 -3.888 22.137 -17.400
10 HA SER 3 HA SER 3 -4.650 20.066 -16.764
11 HB2 SER 3 1HB SER 3 -2.124 19.872 -17.157
12 HB3 SER 3 2HB SER 3 -1.969 19.835 -15.401
13 HG SER 3 HG SER 3 -2.541 17.829 -17.014
14 H GLY 4 H GLY 4 -5.603 21.979 -14.999
15 HA2 GLY 4 1HA GLY 4 -5.471 20.530 -12.425
16 HA3 GLY 4 2HA GLY 4 -5.594 22.281 -12.521
17 H SER 5 H SER 5 -7.290 19.316 -13.508
18 HA SER 5 HA SER 5 -9.814 20.609 -12.770
19 HB2 SER 5 1HB SER 5 -10.914 19.756 -14.797
20 HB3 SER 5 2HB SER 5 -9.601 20.859 -15.208
21 HG SER 5 HG SER 5 -8.583 19.279 -16.155
22 H SER 6 H SER 6 -11.612 19.018 -12.584
23 HA SER 6 HA SER 6 -10.931 16.926 -10.870
24 HB2 SER 6 1HB SER 6 -13.249 16.268 -10.974
25 HB3 SER 6 2HB SER 6 -13.180 18.029 -11.029
26 HG SER 6 HG SER 6 -14.195 17.910 -12.851
27 H GLY 7 H GLY 7 -11.614 14.586 -11.252
28 HA2 GLY 7 1HA GLY 7 -10.997 13.707 -13.989
29 HA3 GLY 7 2HA GLY 7 -10.041 13.080 -12.654
30 H THR 8 H THR 8 -10.677 10.952 -13.043
31 HA THR 8 HA THR 8 -13.431 10.354 -12.195
32 HB THR 8 HB THR 8 -13.463 8.430 -13.761
33 HG1 THR 8 HG1 THR 8 -10.946 9.509 -14.441
34 HG21 THR 8 3HG2 THR 8 -13.838 11.151 -14.348
35 HG22 THR 8 1HG2 THR 8 -14.541 9.766 -15.183
36 HG23 THR 8 2HG2 THR 8 -13.021 10.460 -15.749
37 H LYS 9 H LYS 9 -13.346 9.289 -10.338
38 HA LYS 9 HA LYS 9 -11.257 8.288 -8.980
39 HB2 LYS 9 1HB LYS 9 -13.683 8.350 -8.253
40 HB3 LYS 9 2HB LYS 9 -13.889 6.813 -9.083
41 HG2 LYS 9 1HG LYS 9 -12.357 5.730 -7.612
42 HG3 LYS 9 2HG LYS 9 -11.888 7.268 -6.883
43 HD2 LYS 9 1HD LYS 9 -14.195 7.543 -6.052
44 HD3 LYS 9 2HD LYS 9 -14.606 5.964 -6.727
45 HE2 LYS 9 1HE LYS 9 -12.533 5.196 -5.290
46 HE3 LYS 9 2HE LYS 9 -12.915 6.652 -4.373
47 HZ1 LYS 9 3HZ LYS 9 -13.998 4.501 -3.632
48 HZ2 LYS 9 1HZ LYS 9 -14.974 4.627 -5.008
49 HZ3 LYS 9 2HZ LYS 9 -15.019 5.835 -3.825
50 H GLU 10 H GLU 10 -9.694 6.902 -9.449
51 HA GLU 10 HA GLU 10 -10.143 4.251 -10.279
52 HB2 GLU 10 1HB GLU 10 -9.697 4.211 -12.522
53 HB3 GLU 10 2HB GLU 10 -10.483 5.779 -12.418
54 HG2 GLU 10 1HG GLU 10 -8.054 6.652 -12.049
55 HG3 GLU 10 2HG GLU 10 -7.604 5.126 -12.808
56 H LYS 11 H LYS 11 -8.352 3.003 -9.966
57 HA LYS 11 HA LYS 11 -6.406 2.584 -8.776
58 HB2 LYS 11 1HB LYS 11 -5.245 4.224 -11.026
59 HB3 LYS 11 2HB LYS 11 -4.504 2.863 -10.193
60 HG2 LYS 11 1HG LYS 11 -6.661 1.624 -11.134
61 HG3 LYS 11 2HG LYS 11 -6.532 2.899 -12.347
62 HD2 LYS 11 1HD LYS 11 -4.131 2.246 -12.648
63 HD3 LYS 11 2HD LYS 11 -4.439 0.862 -11.596
64 HE2 LYS 11 1HE LYS 11 -6.185 0.097 -13.151
65 HE3 LYS 11 2HE LYS 11 -5.823 1.459 -14.210
66 HZ1 LYS 11 3HZ LYS 11 -3.808 0.563 -14.819
67 HZ2 LYS 11 1HZ LYS 11 -4.755 -0.831 -14.670
68 HZ3 LYS 11 2HZ LYS 11 -3.680 -0.404 -13.437
69 HA PRO 12 HA PRO 12 -6.065 7.002 -7.100
70 HB2 PRO 12 1HB PRO 12 -7.337 6.565 -4.742
71 HB3 PRO 12 2HB PRO 12 -8.180 7.087 -6.205
72 HG2 PRO 12 1HG PRO 12 -7.938 4.342 -5.035
73 HG3 PRO 12 2HG PRO 12 -9.361 5.141 -5.729
74 HD2 PRO 12 1HD PRO 12 -7.890 3.331 -7.106
75 HD3 PRO 12 2HD PRO 12 -8.712 4.692 -7.895
76 H TYR 13 H TYR 13 -5.690 3.794 -5.706
77 HA TYR 13 HA TYR 13 -3.900 4.620 -3.631
78 HB2 TYR 13 1HB TYR 13 -4.720 1.954 -4.754
79 HB3 TYR 13 2HB TYR 13 -3.422 2.079 -3.573
80 HD1 TYR 13 HD1 TYR 13 -6.474 4.171 -3.634
81 HD2 TYR 13 HD2 TYR 13 -4.440 0.935 -1.765
82 HE1 TYR 13 HE1 TYR 13 -8.134 4.184 -1.820
83 HE2 TYR 13 HE2 TYR 13 -6.096 0.938 0.055
84 HH TYR 13 HH TYR 13 -8.944 2.130 -0.052
85 H LYS 14 H LYS 14 -1.885 5.262 -3.943
86 HA LYS 14 HA LYS 14 -0.387 4.165 -6.231
87 HB2 LYS 14 1HB LYS 14 -0.618 6.500 -6.561
88 HB3 LYS 14 2HB LYS 14 -0.267 6.852 -4.874
89 HG2 LYS 14 1HG LYS 14 2.019 6.436 -5.143
90 HG3 LYS 14 2HG LYS 14 1.773 5.592 -6.674
91 HD2 LYS 14 1HD LYS 14 1.385 7.575 -7.842
92 HD3 LYS 14 2HD LYS 14 1.035 8.483 -6.369
93 HE2 LYS 14 1HE LYS 14 3.744 7.289 -6.769
94 HE3 LYS 14 2HE LYS 14 3.322 8.789 -7.594
95 HZ1 LYS 14 3HZ LYS 14 4.390 9.243 -5.490
96 HZ2 LYS 14 1HZ LYS 14 3.232 8.330 -4.661
97 HZ3 LYS 14 2HZ LYS 14 2.782 9.763 -5.438
98 H CYS 15 H CYS 15 1.441 3.070 -5.855
99 HA CYS 15 HA CYS 15 2.159 2.377 -3.186
100 HB2 CYS 15 1HB CYS 15 2.384 0.845 -5.142
101 HB3 CYS 15 2HB CYS 15 3.698 1.855 -5.737
102 H TYR 16 H TYR 16 3.048 3.894 -1.922
103 HA TYR 16 HA TYR 16 4.682 6.008 -2.836
104 HB2 TYR 16 1HB TYR 16 4.656 4.930 -0.019
105 HB3 TYR 16 2HB TYR 16 4.980 6.578 -0.546
106 HD1 TYR 16 HD1 TYR 16 2.731 7.007 -2.432
107 HD2 TYR 16 HD2 TYR 16 2.812 5.155 1.398
108 HE1 TYR 16 HE1 TYR 16 0.360 7.579 -2.112
109 HE2 TYR 16 HE2 TYR 16 0.441 5.721 1.728
110 HH TYR 16 HH TYR 16 -1.579 6.693 -0.741
111 H GLU 17 H GLU 17 5.348 2.743 -2.432
112 HA GLU 17 HA GLU 17 8.069 2.928 -1.576
113 HB2 GLU 17 1HB GLU 17 6.843 0.630 -3.092
114 HB3 GLU 17 2HB GLU 17 8.197 0.588 -1.972
115 HG2 GLU 17 1HG GLU 17 6.398 1.463 -0.272
116 HG3 GLU 17 2HG GLU 17 5.282 0.727 -1.420
117 H CYS 18 H CYS 18 6.514 2.337 -4.721
118 HA CYS 18 HA CYS 18 9.039 3.141 -6.013
119 HB2 CYS 18 1HB CYS 18 8.510 1.664 -7.863
120 HB3 CYS 18 2HB CYS 18 8.483 0.748 -6.360
121 H GLY 19 H GLY 19 5.506 3.202 -6.201
122 HA2 GLY 19 1HA GLY 19 4.642 5.513 -6.690
123 HA3 GLY 19 2HA GLY 19 5.732 5.482 -8.068
124 H LYS 20 H LYS 20 4.325 2.470 -7.411
125 HA LYS 20 HA LYS 20 2.932 2.424 -9.881
126 HB2 LYS 20 1HB LYS 20 3.214 0.560 -7.562
127 HB3 LYS 20 2HB LYS 20 1.940 0.258 -8.737
128 HG2 LYS 20 1HG LYS 20 4.668 0.753 -9.781
129 HG3 LYS 20 2HG LYS 20 4.366 -0.783 -8.966
130 HD2 LYS 20 1HD LYS 20 2.525 0.228 -11.108
131 HD3 LYS 20 2HD LYS 20 4.001 -0.652 -11.513
132 HE2 LYS 20 1HE LYS 20 2.124 -1.792 -9.493
133 HE3 LYS 20 2HE LYS 20 1.726 -1.919 -11.206
134 HZ1 LYS 20 3HZ LYS 20 4.438 -2.656 -10.607
135 HZ2 LYS 20 1HZ LYS 20 3.270 -3.477 -11.514
136 HZ3 LYS 20 2HZ LYS 20 3.300 -3.638 -9.831
137 H ALA 21 H ALA 21 0.557 1.459 -9.788
138 HA ALA 21 HA ALA 21 -1.048 2.999 -7.871
139 HB1 ALA 21 3HB ALA 21 -1.131 4.436 -9.710
140 HB2 ALA 21 1HB ALA 21 -1.234 3.105 -10.863
141 HB3 ALA 21 2HB ALA 21 -2.616 3.493 -9.838
142 H PHE 22 H PHE 22 -3.280 2.258 -7.707
143 HA PHE 22 HA PHE 22 -4.048 -0.228 -8.911
144 HB2 PHE 22 1HB PHE 22 -3.576 -0.250 -5.926
145 HB3 PHE 22 2HB PHE 22 -4.095 -1.598 -6.933
146 HD1 PHE 22 HD1 PHE 22 -1.268 0.506 -5.944
147 HD2 PHE 22 HD2 PHE 22 -2.524 -2.821 -8.283
148 HE1 PHE 22 HE1 PHE 22 1.080 -0.157 -6.255
149 HE2 PHE 22 HE2 PHE 22 -0.178 -3.490 -8.597
150 HZ PHE 22 HZ PHE 22 1.628 -2.159 -7.582
151 H ARG 23 H ARG 23 -6.229 -0.705 -8.613
152 HA ARG 23 HA ARG 23 -7.901 1.504 -8.023
153 HB2 ARG 23 1HB ARG 23 -8.361 -1.371 -8.717
154 HB3 ARG 23 2HB ARG 23 -9.707 -0.401 -8.135
155 HG2 ARG 23 1HG ARG 23 -9.080 1.261 -9.964
156 HG3 ARG 23 2HG ARG 23 -8.079 -0.034 -10.624
157 HD2 ARG 23 1HD ARG 23 -9.965 -1.445 -10.938
158 HD3 ARG 23 2HD ARG 23 -11.004 -0.370 -10.004
159 HE ARG 23 HE ARG 23 -9.833 0.792 -12.382
160 HH11 ARG 23 1HH1 ARG 23 -12.554 -0.867 -10.981
161 HH12 ARG 23 2HH1 ARG 23 -13.665 -0.355 -12.209
162 HH21 ARG 23 1HH2 ARG 23 -11.285 1.472 -14.005
163 HH22 ARG 23 2HH2 ARG 23 -12.941 0.974 -13.929
164 H THR 24 H THR 24 -7.275 -1.550 -6.320
165 HA THR 24 HA THR 24 -8.526 -0.371 -3.924
166 HB THR 24 HB THR 24 -9.218 -2.511 -3.195
167 HG1 THR 24 HG1 THR 24 -8.309 -4.341 -3.860
168 HG21 THR 24 3HG2 THR 24 -9.719 -1.947 -6.079
169 HG22 THR 24 1HG2 THR 24 -10.840 -1.934 -4.719
170 HG23 THR 24 2HG2 THR 24 -10.300 -3.468 -5.401
171 H ARG 25 H ARG 25 -7.675 -1.623 -1.877
172 HA ARG 25 HA ARG 25 -4.900 -1.008 -1.680
173 HB2 ARG 25 1HB ARG 25 -6.801 -0.957 0.133
174 HB3 ARG 25 2HB ARG 25 -6.333 -2.634 0.384
175 HG2 ARG 25 1HG ARG 25 -4.555 -0.218 0.641
176 HG3 ARG 25 2HG ARG 25 -5.187 -1.212 1.955
177 HD2 ARG 25 1HD ARG 25 -3.993 -3.161 0.819
178 HD3 ARG 25 2HD ARG 25 -3.153 -1.938 -0.133
179 HE ARG 25 HE ARG 25 -2.602 -2.668 2.550
180 HH11 ARG 25 1HH1 ARG 25 -2.700 0.072 0.404
181 HH12 ARG 25 2HH1 ARG 25 -1.508 0.970 1.284
182 HH21 ARG 25 1HH2 ARG 25 -1.031 -1.495 3.718
183 HH22 ARG 25 2HH2 ARG 25 -0.559 0.077 3.169
184 H SER 26 H SER 26 -6.645 -4.080 -1.162
185 HA SER 26 HA SER 26 -4.593 -5.814 -0.854
186 HB2 SER 26 1HB SER 26 -7.037 -6.397 -0.899
187 HB3 SER 26 2HB SER 26 -6.949 -6.393 -2.661
188 HG SER 26 HG SER 26 -6.560 -8.460 -2.165
189 H ASN 27 H ASN 27 -5.783 -4.578 -3.956
190 HA ASN 27 HA ASN 27 -4.050 -6.073 -5.597
191 HB2 ASN 27 1HB ASN 27 -6.158 -4.577 -6.155
192 HB3 ASN 27 2HB ASN 27 -4.934 -3.338 -6.419
193 HD21 ASN 27 1HD2 ASN 27 -6.734 -5.590 -7.919
194 HD22 ASN 27 2HD2 ASN 27 -5.730 -5.924 -9.284
195 H LEU 28 H LEU 28 -3.660 -3.045 -3.883
196 HA LEU 28 HA LEU 28 -1.223 -2.308 -5.195
197 HB2 LEU 28 1HB LEU 28 -2.206 -0.445 -4.342
198 HB3 LEU 28 2HB LEU 28 -2.849 -1.295 -2.939
199 HG LEU 28 HG LEU 28 -0.610 -1.246 -1.912
200 HD11 LEU 28 1HD1 LEU 28 0.399 -0.940 -4.357
201 HD12 LEU 28 2HD1 LEU 28 1.247 -0.410 -2.905
202 HD13 LEU 28 3HD1 LEU 28 0.343 0.755 -3.873
203 HD21 LEU 28 3HD2 LEU 28 -0.747 1.561 -2.320
204 HD22 LEU 28 1HD2 LEU 28 -1.324 0.617 -0.947
205 HD23 LEU 28 2HD2 LEU 28 -2.391 0.923 -2.318
206 H THR 29 H THR 29 -1.948 -3.439 -1.890
207 HA THR 29 HA THR 29 0.642 -3.713 -0.968
208 HB THR 29 HB THR 29 -1.772 -5.410 -0.311
209 HG1 THR 29 HG1 THR 29 -0.738 -2.968 0.593
210 HG21 THR 29 3HG2 THR 29 0.515 -6.419 0.229
211 HG22 THR 29 1HG2 THR 29 -0.632 -6.268 1.560
212 HG23 THR 29 2HG2 THR 29 0.686 -5.107 1.395
213 H THR 30 H THR 30 -1.353 -6.167 -2.603
214 HA THR 30 HA THR 30 0.284 -8.339 -2.561
215 HB THR 30 HB THR 30 -1.488 -7.318 -4.769
216 HG1 THR 30 HG1 THR 30 -2.318 -8.229 -2.729
217 HG21 THR 30 3HG2 THR 30 0.118 -9.872 -4.715
218 HG22 THR 30 1HG2 THR 30 0.191 -8.588 -5.921
219 HG23 THR 30 2HG2 THR 30 -1.253 -9.592 -5.788
220 H HIS 31 H HIS 31 0.728 -5.410 -4.406
221 HA HIS 31 HA HIS 31 2.946 -6.542 -5.915
222 HB2 HIS 31 1HB HIS 31 1.862 -5.115 -7.340
223 HB3 HIS 31 2HB HIS 31 1.340 -4.043 -6.043
224 HD1 HIS 31 HD1 HIS 31 4.156 -4.653 -8.414
225 HD2 HIS 31 HD2 HIS 31 3.142 -1.993 -5.388
226 HE1 HIS 31 HE1 HIS 31 5.807 -2.765 -8.598
227 H GLN 32 H GLN 32 2.350 -4.404 -3.215
228 HA GLN 32 HA GLN 32 4.874 -3.202 -3.021
229 HB2 GLN 32 1HB GLN 32 2.811 -3.857 -0.919
230 HB3 GLN 32 2HB GLN 32 4.272 -2.939 -0.576
231 HG2 GLN 32 1HG GLN 32 3.371 -1.511 -2.633
232 HG3 GLN 32 2HG GLN 32 1.835 -2.154 -2.053
233 HE21 GLN 32 1HE2 GLN 32 0.900 -0.510 -1.041
234 HE22 GLN 32 2HE2 GLN 32 1.618 0.434 0.215
235 H VAL 33 H VAL 33 3.937 -6.425 -2.535
236 HA VAL 33 HA VAL 33 5.583 -7.323 -0.497
237 HB VAL 33 HB VAL 33 4.978 -8.807 -3.058
238 HG11 VAL 33 1HG1 VAL 33 5.317 -10.117 -0.406
239 HG12 VAL 33 2HG1 VAL 33 5.630 -10.745 -2.025
240 HG13 VAL 33 3HG1 VAL 33 6.756 -9.604 -1.288
241 HG21 VAL 33 3HG2 VAL 33 3.386 -8.444 -0.534
242 HG22 VAL 33 1HG2 VAL 33 2.891 -8.131 -2.197
243 HG23 VAL 33 2HG2 VAL 33 3.112 -9.790 -1.641
244 H ILE 34 H ILE 34 6.377 -6.479 -3.800
245 HA ILE 34 HA ILE 34 8.903 -7.679 -3.981
246 HB ILE 34 HB ILE 34 9.374 -6.153 -5.788
247 HG12 ILE 34 1HG1 ILE 34 7.013 -4.585 -4.736
248 HG13 ILE 34 2HG1 ILE 34 8.691 -4.056 -4.804
249 HG21 ILE 34 1HG2 ILE 34 6.966 -6.302 -6.926
250 HG22 ILE 34 2HG2 ILE 34 8.005 -7.709 -6.705
251 HG23 ILE 34 3HG2 ILE 34 6.697 -7.392 -5.566
252 HD11 ILE 34 3HD1 ILE 34 6.669 -4.248 -6.965
253 HD12 ILE 34 1HD1 ILE 34 7.845 -2.980 -6.621
254 HD13 ILE 34 2HD1 ILE 34 8.367 -4.486 -7.377
255 H HIS 35 H HIS 35 7.835 -4.793 -2.366
256 HA HIS 35 HA HIS 35 10.565 -3.873 -1.920
257 HB2 HIS 35 1HB HIS 35 7.960 -2.680 -0.951
258 HB3 HIS 35 2HB HIS 35 9.546 -1.918 -0.886
259 HD1 HIS 35 HD1 HIS 35 10.663 -1.638 -3.423
260 HD2 HIS 35 HD2 HIS 35 6.530 -1.939 -3.117
261 HE1 HIS 35 HE1 HIS 35 9.759 -0.707 -5.577
262 H THR 36 H THR 36 8.293 -5.892 -0.455
263 HA THR 36 HA THR 36 9.268 -5.440 2.254
264 HB THR 36 HB THR 36 7.559 -6.908 3.011
265 HG1 THR 36 HG1 THR 36 6.253 -8.017 1.311
266 HG21 THR 36 3HG2 THR 36 5.921 -5.834 0.840
267 HG22 THR 36 1HG2 THR 36 6.988 -4.639 1.575
268 HG23 THR 36 2HG2 THR 36 5.840 -5.530 2.575
269 H GLY 37 H GLY 37 10.372 -6.973 3.478
270 HA2 GLY 37 1HA GLY 37 12.321 -8.489 2.190
271 HA3 GLY 37 2HA GLY 37 11.849 -8.684 3.872
272 H GLU 38 H GLU 38 10.458 -10.330 4.456
273 HA GLU 38 HA GLU 38 10.565 -12.743 3.291
274 HB2 GLU 38 1HB GLU 38 9.390 -12.047 5.469
275 HB3 GLU 38 2HB GLU 38 7.958 -11.816 4.476
276 HG2 GLU 38 1HG GLU 38 8.499 -14.255 3.684
277 HG3 GLU 38 2HG GLU 38 9.370 -14.326 5.215
278 H LYS 39 H LYS 39 9.683 -13.849 1.627
279 HA LYS 39 HA LYS 39 7.677 -12.453 -0.020
280 HB2 LYS 39 1HB LYS 39 10.119 -12.610 -0.903
281 HB3 LYS 39 2HB LYS 39 9.728 -14.298 -1.207
282 HG2 LYS 39 1HG LYS 39 9.226 -13.364 -3.232
283 HG3 LYS 39 2HG LYS 39 7.653 -13.284 -2.436
284 HD2 LYS 39 1HD LYS 39 7.818 -11.144 -3.246
285 HD3 LYS 39 2HD LYS 39 8.536 -10.934 -1.648
286 HE2 LYS 39 1HE LYS 39 10.031 -9.854 -3.072
287 HE3 LYS 39 2HE LYS 39 10.771 -11.433 -2.812
288 HZ1 LYS 39 3HZ LYS 39 10.401 -10.353 -5.216
289 HZ2 LYS 39 1HZ LYS 39 8.972 -11.249 -5.080
290 HZ3 LYS 39 2HZ LYS 39 10.470 -12.022 -4.945
291 H ARG 40 H ARG 40 5.842 -13.542 -0.208
292 HA ARG 40 HA ARG 40 5.468 -16.134 0.826
293 HB2 ARG 40 1HB ARG 40 3.673 -14.440 0.637
294 HB3 ARG 40 2HB ARG 40 3.710 -14.620 -1.112
295 HG2 ARG 40 1HG ARG 40 2.997 -16.927 -0.920
296 HG3 ARG 40 2HG ARG 40 3.030 -16.808 0.841
297 HD2 ARG 40 1HD ARG 40 1.391 -14.847 -0.682
298 HD3 ARG 40 2HD ARG 40 0.792 -16.498 -0.531
299 HE ARG 40 HE ARG 40 1.371 -15.914 2.007
300 HH11 ARG 40 1HH1 ARG 40 -0.337 -14.102 -0.426
301 HH12 ARG 40 2HH1 ARG 40 -1.360 -13.289 0.712
302 HH21 ARG 40 1HH2 ARG 40 0.030 -14.851 3.515
303 HH22 ARG 40 2HH2 ARG 40 -1.150 -13.715 2.953
304 H SER 41 H SER 41 5.193 -15.062 -2.569
305 HA SER 41 HA SER 41 5.984 -17.782 -3.382
306 HB2 SER 41 1HB SER 41 3.647 -17.016 -3.995
307 HB3 SER 41 2HB SER 41 4.400 -15.821 -5.050
308 HG SER 41 HG SER 41 4.531 -18.643 -5.224
309 H GLY 42 H GLY 42 7.583 -18.049 -4.891
310 HA2 GLY 42 1HA GLY 42 8.613 -16.063 -6.581
311 HA3 GLY 42 2HA GLY 42 9.559 -16.056 -5.100
312 HA PRO 43 HA PRO 43 10.290 -20.002 -7.876
313 HB2 PRO 43 1HB PRO 43 11.050 -19.149 -10.339
314 HB3 PRO 43 2HB PRO 43 9.378 -19.559 -9.937
315 HG2 PRO 43 1HG PRO 43 10.687 -16.871 -10.083
316 HG3 PRO 43 2HG PRO 43 9.094 -17.373 -10.678
317 HD2 PRO 43 1HD PRO 43 9.423 -16.025 -8.352
318 HD3 PRO 43 2HD PRO 43 8.126 -17.214 -8.592
319 H SER 44 H SER 44 11.993 -16.971 -8.691
320 HA SER 44 HA SER 44 14.560 -18.307 -8.459
321 HB2 SER 44 1HB SER 44 13.963 -16.545 -10.228
322 HB3 SER 44 2HB SER 44 14.132 -15.359 -8.934
323 HG SER 44 HG SER 44 16.215 -15.530 -9.093
324 H SER 45 H SER 45 16.319 -17.125 -7.229
325 HA SER 45 HA SER 45 15.260 -16.319 -4.602
326 HB2 SER 45 1HB SER 45 16.525 -18.412 -4.524
327 HB3 SER 45 2HB SER 45 17.907 -17.623 -5.285
328 HG SER 45 HG SER 45 16.897 -16.459 -2.967
329 H GLY 46 H GLY 46 17.846 -15.702 -6.953
330 HA2 GLY 46 1HA GLY 46 18.669 -13.298 -5.547
331 HA3 GLY 46 2HA GLY 46 19.376 -13.940 -7.022
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -15.290 28.964 -1.747
2 HA2 GLY 1 1HA GLY 1 -17.376 29.008 -0.243
3 HA3 GLY 1 2HA GLY 1 -18.232 28.819 -1.766
4 H SER 2 H SER 2 -18.134 26.847 -2.871
5 HA SER 2 HA SER 2 -17.665 24.575 -1.144
6 HB2 SER 2 1HB SER 2 -18.676 24.687 -3.997
7 HB3 SER 2 2HB SER 2 -18.685 23.262 -2.958
8 HG SER 2 HG SER 2 -20.089 24.397 -1.552
9 H SER 3 H SER 3 -15.589 24.001 -0.921
10 HA SER 3 HA SER 3 -13.526 24.394 -2.741
11 HB2 SER 3 1HB SER 3 -13.550 23.585 -0.215
12 HB3 SER 3 2HB SER 3 -13.438 21.993 -0.964
13 HG SER 3 HG SER 3 -11.552 22.669 -2.007
14 H GLY 4 H GLY 4 -15.343 21.384 -2.122
15 HA2 GLY 4 1HA GLY 4 -16.159 20.070 -3.987
16 HA3 GLY 4 2HA GLY 4 -14.750 20.590 -4.901
17 H SER 5 H SER 5 -16.083 18.069 -3.228
18 HA SER 5 HA SER 5 -13.461 16.919 -2.550
19 HB2 SER 5 1HB SER 5 -14.507 15.574 -0.931
20 HB3 SER 5 2HB SER 5 -15.343 17.120 -0.790
21 HG SER 5 HG SER 5 -16.758 15.936 -2.522
22 H SER 6 H SER 6 -12.709 15.222 -3.653
23 HA SER 6 HA SER 6 -14.177 14.276 -5.941
24 HB2 SER 6 1HB SER 6 -11.416 13.885 -4.861
25 HB3 SER 6 2HB SER 6 -12.038 12.718 -6.028
26 HG SER 6 HG SER 6 -11.107 15.202 -6.453
27 H GLY 7 H GLY 7 -15.363 12.480 -6.103
28 HA2 GLY 7 1HA GLY 7 -15.554 10.748 -3.751
29 HA3 GLY 7 2HA GLY 7 -16.706 10.827 -5.075
30 H THR 8 H THR 8 -16.162 9.798 -7.082
31 HA THR 8 HA THR 8 -14.822 7.297 -6.678
32 HB THR 8 HB THR 8 -15.428 6.801 -9.000
33 HG1 THR 8 HG1 THR 8 -15.241 9.304 -9.424
34 HG21 THR 8 3HG2 THR 8 -17.321 6.211 -7.953
35 HG22 THR 8 1HG2 THR 8 -17.995 7.708 -8.594
36 HG23 THR 8 2HG2 THR 8 -17.329 7.669 -6.962
37 H LYS 9 H LYS 9 -12.826 6.687 -7.280
38 HA LYS 9 HA LYS 9 -11.297 8.348 -9.132
39 HB2 LYS 9 1HB LYS 9 -10.935 8.983 -6.624
40 HB3 LYS 9 2HB LYS 9 -9.988 7.502 -6.570
41 HG2 LYS 9 1HG LYS 9 -8.343 8.988 -7.061
42 HG3 LYS 9 2HG LYS 9 -8.848 8.566 -8.699
43 HD2 LYS 9 1HD LYS 9 -10.388 10.547 -8.630
44 HD3 LYS 9 2HD LYS 9 -9.624 11.005 -7.106
45 HE2 LYS 9 1HE LYS 9 -8.000 10.509 -9.578
46 HE3 LYS 9 2HE LYS 9 -8.761 12.072 -9.284
47 HZ1 LYS 9 3HZ LYS 9 -6.466 10.866 -8.002
48 HZ2 LYS 9 1HZ LYS 9 -7.553 11.609 -6.940
49 HZ3 LYS 9 2HZ LYS 9 -6.863 12.499 -8.202
50 H GLU 10 H GLU 10 -10.100 7.160 -10.487
51 HA GLU 10 HA GLU 10 -10.100 4.282 -10.170
52 HB2 GLU 10 1HB GLU 10 -9.672 4.156 -12.417
53 HB3 GLU 10 2HB GLU 10 -10.425 5.743 -12.352
54 HG2 GLU 10 1HG GLU 10 -8.215 6.788 -12.307
55 HG3 GLU 10 2HG GLU 10 -7.466 5.194 -12.391
56 H LYS 11 H LYS 11 -8.346 2.985 -9.841
57 HA LYS 11 HA LYS 11 -6.400 2.545 -8.655
58 HB2 LYS 11 1HB LYS 11 -5.318 4.027 -11.057
59 HB3 LYS 11 2HB LYS 11 -4.468 2.818 -10.104
60 HG2 LYS 11 1HG LYS 11 -6.566 1.350 -10.812
61 HG3 LYS 11 2HG LYS 11 -6.566 2.484 -12.164
62 HD2 LYS 11 1HD LYS 11 -4.264 1.922 -12.675
63 HD3 LYS 11 2HD LYS 11 -4.186 0.860 -11.267
64 HE2 LYS 11 1HE LYS 11 -5.568 -0.732 -12.235
65 HE3 LYS 11 2HE LYS 11 -6.264 0.419 -13.373
66 HZ1 LYS 11 3HZ LYS 11 -3.830 -1.144 -13.579
67 HZ2 LYS 11 1HZ LYS 11 -3.709 0.454 -14.121
68 HZ3 LYS 11 2HZ LYS 11 -4.864 -0.582 -14.795
69 HA PRO 12 HA PRO 12 -5.877 7.009 -7.161
70 HB2 PRO 12 1HB PRO 12 -7.126 6.712 -4.770
71 HB3 PRO 12 2HB PRO 12 -7.972 7.206 -6.241
72 HG2 PRO 12 1HG PRO 12 -7.810 4.502 -4.966
73 HG3 PRO 12 2HG PRO 12 -9.214 5.324 -5.671
74 HD2 PRO 12 1HD PRO 12 -7.830 3.410 -6.995
75 HD3 PRO 12 2HD PRO 12 -8.616 4.767 -7.826
76 H TYR 13 H TYR 13 -5.611 3.853 -5.621
77 HA TYR 13 HA TYR 13 -3.769 4.684 -3.605
78 HB2 TYR 13 1HB TYR 13 -4.652 2.006 -4.655
79 HB3 TYR 13 2HB TYR 13 -3.354 2.138 -3.473
80 HD1 TYR 13 HD1 TYR 13 -6.220 4.434 -3.481
81 HD2 TYR 13 HD2 TYR 13 -4.544 0.922 -1.761
82 HE1 TYR 13 HE1 TYR 13 -7.884 4.533 -1.672
83 HE2 TYR 13 HE2 TYR 13 -6.204 1.010 0.052
84 HH TYR 13 HH TYR 13 -8.956 2.870 -0.064
85 H LYS 14 H LYS 14 -1.808 5.412 -4.082
86 HA LYS 14 HA LYS 14 -0.336 4.180 -6.310
87 HB2 LYS 14 1HB LYS 14 -0.520 6.510 -6.683
88 HB3 LYS 14 2HB LYS 14 -0.149 6.888 -5.006
89 HG2 LYS 14 1HG LYS 14 2.130 6.389 -5.286
90 HG3 LYS 14 2HG LYS 14 1.844 5.575 -6.826
91 HD2 LYS 14 1HD LYS 14 1.517 7.578 -7.964
92 HD3 LYS 14 2HD LYS 14 1.171 8.475 -6.484
93 HE2 LYS 14 1HE LYS 14 3.866 7.267 -7.051
94 HE3 LYS 14 2HE LYS 14 3.427 8.889 -7.585
95 HZ1 LYS 14 3HZ LYS 14 3.155 9.596 -5.363
96 HZ2 LYS 14 1HZ LYS 14 4.623 8.756 -5.408
97 HZ3 LYS 14 2HZ LYS 14 3.247 8.019 -4.758
98 H CYS 15 H CYS 15 1.499 3.083 -5.951
99 HA CYS 15 HA CYS 15 2.237 2.420 -3.274
100 HB2 CYS 15 1HB CYS 15 2.389 0.833 -5.189
101 HB3 CYS 15 2HB CYS 15 3.708 1.799 -5.843
102 H TYR 16 H TYR 16 3.129 4.017 -2.093
103 HA TYR 16 HA TYR 16 4.811 6.042 -3.083
104 HB2 TYR 16 1HB TYR 16 4.846 5.058 -0.235
105 HB3 TYR 16 2HB TYR 16 5.133 6.690 -0.829
106 HD1 TYR 16 HD1 TYR 16 2.823 7.023 -2.661
107 HD2 TYR 16 HD2 TYR 16 3.042 5.313 1.229
108 HE1 TYR 16 HE1 TYR 16 0.456 7.577 -2.290
109 HE2 TYR 16 HE2 TYR 16 0.675 5.861 1.610
110 HH TYR 16 HH TYR 16 -1.266 7.463 -0.899
111 H GLU 17 H GLU 17 5.419 2.774 -2.564
112 HA GLU 17 HA GLU 17 8.156 2.928 -1.769
113 HB2 GLU 17 1HB GLU 17 6.878 0.611 -3.209
114 HB3 GLU 17 2HB GLU 17 8.228 0.579 -2.083
115 HG2 GLU 17 1HG GLU 17 6.470 1.512 -0.397
116 HG3 GLU 17 2HG GLU 17 5.312 0.830 -1.537
117 H CYS 18 H CYS 18 6.542 2.281 -4.873
118 HA CYS 18 HA CYS 18 9.064 2.989 -6.224
119 HB2 CYS 18 1HB CYS 18 8.480 1.478 -8.020
120 HB3 CYS 18 2HB CYS 18 8.418 0.601 -6.495
121 H GLY 19 H GLY 19 5.537 3.173 -6.325
122 HA2 GLY 19 1HA GLY 19 4.713 5.473 -6.865
123 HA3 GLY 19 2HA GLY 19 5.798 5.405 -8.246
124 H LYS 20 H LYS 20 4.303 2.441 -7.518
125 HA LYS 20 HA LYS 20 2.907 2.395 -9.994
126 HB2 LYS 20 1HB LYS 20 3.050 0.540 -7.634
127 HB3 LYS 20 2HB LYS 20 1.921 0.236 -8.947
128 HG2 LYS 20 1HG LYS 20 4.744 0.744 -9.680
129 HG3 LYS 20 2HG LYS 20 4.367 -0.791 -8.895
130 HD2 LYS 20 1HD LYS 20 2.777 0.201 -11.240
131 HD3 LYS 20 2HD LYS 20 4.284 -0.690 -11.462
132 HE2 LYS 20 1HE LYS 20 3.253 -2.449 -9.916
133 HE3 LYS 20 2HE LYS 20 1.724 -1.616 -10.193
134 HZ1 LYS 20 3HZ LYS 20 1.744 -2.161 -12.434
135 HZ2 LYS 20 1HZ LYS 20 2.324 -3.571 -11.700
136 HZ3 LYS 20 2HZ LYS 20 3.400 -2.506 -12.454
137 H ALA 21 H ALA 21 0.511 1.383 -9.781
138 HA ALA 21 HA ALA 21 -1.048 2.995 -7.896
139 HB1 ALA 21 3HB ALA 21 -2.628 3.537 -9.809
140 HB2 ALA 21 1HB ALA 21 -1.093 4.404 -9.779
141 HB3 ALA 21 2HB ALA 21 -1.321 3.050 -10.887
142 H PHE 22 H PHE 22 -3.255 2.265 -7.639
143 HA PHE 22 HA PHE 22 -4.108 -0.194 -8.837
144 HB2 PHE 22 1HB PHE 22 -3.531 -0.264 -5.873
145 HB3 PHE 22 2HB PHE 22 -4.086 -1.593 -6.886
146 HD1 PHE 22 HD1 PHE 22 -1.222 0.491 -5.957
147 HD2 PHE 22 HD2 PHE 22 -2.561 -2.805 -8.293
148 HE1 PHE 22 HE1 PHE 22 1.114 -0.175 -6.349
149 HE2 PHE 22 HE2 PHE 22 -0.228 -3.478 -8.688
150 HZ PHE 22 HZ PHE 22 1.613 -2.163 -7.715
151 H ARG 23 H ARG 23 -6.283 -0.637 -8.467
152 HA ARG 23 HA ARG 23 -7.898 1.584 -7.792
153 HB2 ARG 23 1HB ARG 23 -8.724 -1.311 -8.070
154 HB3 ARG 23 2HB ARG 23 -9.787 0.088 -8.145
155 HG2 ARG 23 1HG ARG 23 -8.383 0.841 -10.133
156 HG3 ARG 23 2HG ARG 23 -7.724 -0.796 -10.130
157 HD2 ARG 23 1HD ARG 23 -9.952 -1.720 -10.404
158 HD3 ARG 23 2HD ARG 23 -10.653 -0.104 -10.321
159 HE ARG 23 HE ARG 23 -9.287 -1.304 -12.575
160 HH11 ARG 23 1HH1 ARG 23 -10.492 1.611 -11.102
161 HH12 ARG 23 2HH1 ARG 23 -10.563 2.491 -12.593
162 HH21 ARG 23 1HH2 ARG 23 -9.376 -0.157 -14.545
163 HH22 ARG 23 2HH2 ARG 23 -9.929 1.484 -14.551
164 H THR 24 H THR 24 -7.427 -1.550 -6.163
165 HA THR 24 HA THR 24 -8.490 -0.332 -3.700
166 HB THR 24 HB THR 24 -9.194 -2.470 -2.955
167 HG1 THR 24 HG1 THR 24 -8.355 -4.304 -3.683
168 HG21 THR 24 3HG2 THR 24 -9.789 -2.001 -5.863
169 HG22 THR 24 1HG2 THR 24 -10.808 -1.675 -4.461
170 HG23 THR 24 2HG2 THR 24 -10.520 -3.338 -4.975
171 H ARG 25 H ARG 25 -7.608 -1.834 -1.740
172 HA ARG 25 HA ARG 25 -4.821 -1.197 -1.585
173 HB2 ARG 25 1HB ARG 25 -6.243 -0.956 0.374
174 HB3 ARG 25 2HB ARG 25 -6.636 -2.670 0.331
175 HG2 ARG 25 1HG ARG 25 -5.022 -2.295 2.052
176 HG3 ARG 25 2HG ARG 25 -4.243 -3.177 0.736
177 HD2 ARG 25 1HD ARG 25 -3.257 -1.109 -0.086
178 HD3 ARG 25 2HD ARG 25 -4.073 -0.199 1.184
179 HE ARG 25 HE ARG 25 -2.341 -2.315 2.117
180 HH11 ARG 25 1HH1 ARG 25 -2.626 1.052 1.280
181 HH12 ARG 25 2HH1 ARG 25 -1.260 1.538 2.227
182 HH21 ARG 25 1HH2 ARG 25 -0.539 -1.688 3.368
183 HH22 ARG 25 2HH2 ARG 25 -0.073 -0.022 3.414
184 H SER 26 H SER 26 -6.584 -4.278 -1.198
185 HA SER 26 HA SER 26 -4.561 -6.054 -1.018
186 HB2 SER 26 1HB SER 26 -7.175 -6.375 -1.325
187 HB3 SER 26 2HB SER 26 -6.704 -6.736 -2.985
188 HG SER 26 HG SER 26 -5.473 -7.975 -0.760
189 H ASN 27 H ASN 27 -5.754 -4.644 -4.048
190 HA ASN 27 HA ASN 27 -3.998 -6.041 -5.756
191 HB2 ASN 27 1HB ASN 27 -6.132 -4.645 -6.304
192 HB3 ASN 27 2HB ASN 27 -5.012 -3.289 -6.397
193 HD21 ASN 27 1HD2 ASN 27 -5.776 -3.225 -8.627
194 HD22 ASN 27 2HD2 ASN 27 -5.002 -4.230 -9.800
195 H LEU 28 H LEU 28 -3.671 -3.087 -3.908
196 HA LEU 28 HA LEU 28 -1.231 -2.270 -5.186
197 HB2 LEU 28 1HB LEU 28 -2.279 -0.441 -4.326
198 HB3 LEU 28 2HB LEU 28 -2.908 -1.320 -2.935
199 HG LEU 28 HG LEU 28 -0.665 -1.232 -1.905
200 HD11 LEU 28 1HD1 LEU 28 1.140 -0.131 -2.842
201 HD12 LEU 28 2HD1 LEU 28 0.137 0.761 -3.984
202 HD13 LEU 28 3HD1 LEU 28 0.436 -0.959 -4.231
203 HD21 LEU 28 3HD2 LEU 28 -1.090 0.776 -0.972
204 HD22 LEU 28 1HD2 LEU 28 -2.567 0.677 -1.932
205 HD23 LEU 28 2HD2 LEU 28 -1.188 1.600 -2.528
206 H THR 29 H THR 29 -1.958 -3.340 -1.859
207 HA THR 29 HA THR 29 0.623 -3.631 -0.943
208 HB THR 29 HB THR 29 -1.784 -5.329 -0.260
209 HG1 THR 29 HG1 THR 29 -0.953 -3.561 1.617
210 HG21 THR 29 3HG2 THR 29 -0.647 -6.213 1.556
211 HG22 THR 29 1HG2 THR 29 0.573 -4.941 1.544
212 HG23 THR 29 2HG2 THR 29 0.604 -6.203 0.313
213 H THR 30 H THR 30 -1.381 -6.109 -2.529
214 HA THR 30 HA THR 30 0.252 -8.281 -2.459
215 HB THR 30 HB THR 30 -1.518 -7.295 -4.686
216 HG1 THR 30 HG1 THR 30 -1.821 -9.631 -3.116
217 HG21 THR 30 3HG2 THR 30 0.116 -9.825 -4.578
218 HG22 THR 30 1HG2 THR 30 0.106 -8.595 -5.841
219 HG23 THR 30 2HG2 THR 30 -1.300 -9.634 -5.611
220 H HIS 31 H HIS 31 0.676 -5.395 -4.387
221 HA HIS 31 HA HIS 31 2.897 -6.553 -5.867
222 HB2 HIS 31 1HB HIS 31 1.800 -5.158 -7.316
223 HB3 HIS 31 2HB HIS 31 1.293 -4.055 -6.041
224 HD1 HIS 31 HD1 HIS 31 4.080 -4.726 -8.426
225 HD2 HIS 31 HD2 HIS 31 3.114 -2.001 -5.442
226 HE1 HIS 31 HE1 HIS 31 5.738 -2.851 -8.666
227 H GLN 32 H GLN 32 2.307 -4.337 -3.225
228 HA GLN 32 HA GLN 32 4.820 -3.125 -3.059
229 HB2 GLN 32 1HB GLN 32 2.782 -3.772 -0.930
230 HB3 GLN 32 2HB GLN 32 4.236 -2.836 -0.612
231 HG2 GLN 32 1HG GLN 32 3.297 -1.451 -2.687
232 HG3 GLN 32 2HG GLN 32 1.777 -2.091 -2.066
233 HE21 GLN 32 1HE2 GLN 32 0.807 -0.612 -0.891
234 HE22 GLN 32 2HE2 GLN 32 1.559 0.429 0.265
235 H VAL 33 H VAL 33 3.852 -6.339 -2.388
236 HA VAL 33 HA VAL 33 5.552 -7.185 -0.398
237 HB VAL 33 HB VAL 33 4.920 -8.732 -2.914
238 HG11 VAL 33 1HG1 VAL 33 6.625 -9.872 -1.749
239 HG12 VAL 33 2HG1 VAL 33 5.878 -9.549 -0.183
240 HG13 VAL 33 3HG1 VAL 33 5.122 -10.681 -1.306
241 HG21 VAL 33 3HG2 VAL 33 3.337 -8.173 -0.441
242 HG22 VAL 33 1HG2 VAL 33 2.819 -8.180 -2.127
243 HG23 VAL 33 2HG2 VAL 33 3.127 -9.703 -1.293
244 H ILE 34 H ILE 34 6.282 -6.609 -3.799
245 HA ILE 34 HA ILE 34 8.798 -7.745 -3.980
246 HB ILE 34 HB ILE 34 9.259 -6.237 -5.803
247 HG12 ILE 34 1HG1 ILE 34 6.954 -4.622 -4.700
248 HG13 ILE 34 2HG1 ILE 34 8.636 -4.120 -4.835
249 HG21 ILE 34 1HG2 ILE 34 7.832 -7.827 -6.618
250 HG22 ILE 34 2HG2 ILE 34 6.519 -7.360 -5.538
251 HG23 ILE 34 3HG2 ILE 34 6.892 -6.373 -6.951
252 HD11 ILE 34 3HD1 ILE 34 6.539 -4.324 -6.929
253 HD12 ILE 34 1HD1 ILE 34 7.716 -3.047 -6.625
254 HD13 ILE 34 2HD1 ILE 34 8.227 -4.554 -7.385
255 H HIS 35 H HIS 35 7.812 -4.762 -2.453
256 HA HIS 35 HA HIS 35 10.561 -3.913 -2.027
257 HB2 HIS 35 1HB HIS 35 7.995 -2.656 -1.034
258 HB3 HIS 35 2HB HIS 35 9.596 -1.923 -1.011
259 HD1 HIS 35 HD1 HIS 35 10.670 -1.698 -3.569
260 HD2 HIS 35 HD2 HIS 35 6.539 -1.932 -3.189
261 HE1 HIS 35 HE1 HIS 35 9.744 -0.787 -5.722
262 H THR 36 H THR 36 8.192 -5.783 -0.459
263 HA THR 36 HA THR 36 9.257 -5.341 2.211
264 HB THR 36 HB THR 36 7.521 -6.778 3.015
265 HG1 THR 36 HG1 THR 36 6.168 -7.905 1.492
266 HG21 THR 36 3HG2 THR 36 6.045 -5.434 0.808
267 HG22 THR 36 1HG2 THR 36 6.995 -4.431 1.903
268 HG23 THR 36 2HG2 THR 36 5.711 -5.458 2.539
269 H GLY 37 H GLY 37 11.126 -6.370 0.354
270 HA2 GLY 37 1HA GLY 37 11.502 -9.109 1.399
271 HA3 GLY 37 2HA GLY 37 12.013 -8.613 -0.207
272 H GLU 38 H GLU 38 14.174 -8.882 -0.106
273 HA GLU 38 HA GLU 38 16.336 -8.719 0.638
274 HB2 GLU 38 1HB GLU 38 15.369 -5.912 1.213
275 HB3 GLU 38 2HB GLU 38 17.050 -6.400 1.056
276 HG2 GLU 38 1HG GLU 38 16.193 -7.279 -1.287
277 HG3 GLU 38 2HG GLU 38 14.977 -6.029 -1.027
278 H LYS 39 H LYS 39 14.952 -9.999 2.548
279 HA LYS 39 HA LYS 39 14.626 -10.300 4.821
280 HB2 LYS 39 1HB LYS 39 17.174 -10.716 4.018
281 HB3 LYS 39 2HB LYS 39 17.444 -9.520 5.278
282 HG2 LYS 39 1HG LYS 39 16.128 -12.209 5.553
283 HG3 LYS 39 2HG LYS 39 17.651 -11.670 6.264
284 HD2 LYS 39 1HD LYS 39 16.619 -10.476 7.908
285 HD3 LYS 39 2HD LYS 39 15.216 -10.100 6.905
286 HE2 LYS 39 1HE LYS 39 15.649 -12.934 7.682
287 HE3 LYS 39 2HE LYS 39 15.096 -11.817 8.929
288 HZ1 LYS 39 3HZ LYS 39 13.305 -12.991 7.664
289 HZ2 LYS 39 1HZ LYS 39 13.753 -12.094 6.302
290 HZ3 LYS 39 2HZ LYS 39 13.174 -11.305 7.681
291 H ARG 40 H ARG 40 13.518 -7.954 4.482
292 HA ARG 40 HA ARG 40 14.806 -5.880 6.022
293 HB2 ARG 40 1HB ARG 40 13.471 -5.146 4.186
294 HB3 ARG 40 2HB ARG 40 12.095 -6.102 4.719
295 HG2 ARG 40 1HG ARG 40 11.456 -4.013 5.388
296 HG3 ARG 40 2HG ARG 40 12.256 -4.594 6.850
297 HD2 ARG 40 1HD ARG 40 13.773 -3.076 4.758
298 HD3 ARG 40 2HD ARG 40 12.818 -2.231 5.976
299 HE ARG 40 HE ARG 40 14.706 -4.181 6.989
300 HH11 ARG 40 1HH1 ARG 40 14.078 -0.849 6.202
301 HH12 ARG 40 2HH1 ARG 40 15.328 -0.234 7.232
302 HH21 ARG 40 1HH2 ARG 40 16.355 -3.384 8.349
303 HH22 ARG 40 2HH2 ARG 40 16.623 -1.677 8.453
304 H SER 41 H SER 41 11.745 -7.685 6.366
305 HA SER 41 HA SER 41 11.855 -7.152 9.257
306 HB2 SER 41 1HB SER 41 9.831 -6.415 7.869
307 HB3 SER 41 2HB SER 41 9.435 -8.129 7.744
308 HG SER 41 HG SER 41 9.396 -6.443 9.976
309 H GLY 42 H GLY 42 11.412 -8.838 10.740
310 HA2 GLY 42 1HA GLY 42 12.196 -11.471 9.716
311 HA3 GLY 42 2HA GLY 42 12.267 -10.954 11.394
312 HA PRO 43 HA PRO 43 8.406 -13.536 10.463
313 HB2 PRO 43 1HB PRO 43 9.108 -15.742 11.882
314 HB3 PRO 43 2HB PRO 43 9.494 -15.538 10.169
315 HG2 PRO 43 1HG PRO 43 11.230 -15.097 12.567
316 HG3 PRO 43 2HG PRO 43 11.628 -15.881 11.027
317 HD2 PRO 43 1HD PRO 43 12.341 -13.331 11.590
318 HD3 PRO 43 2HD PRO 43 11.954 -13.873 9.944
319 H SER 44 H SER 44 10.234 -12.452 13.149
320 HA SER 44 HA SER 44 9.759 -12.164 15.379
321 HB2 SER 44 1HB SER 44 8.497 -10.355 14.159
322 HB3 SER 44 2HB SER 44 7.058 -11.368 14.273
323 HG SER 44 HG SER 44 8.232 -11.160 16.681
324 H SER 45 H SER 45 9.458 -14.836 14.712
325 HA SER 45 HA SER 45 6.927 -15.829 15.643
326 HB2 SER 45 1HB SER 45 8.638 -16.938 13.999
327 HB3 SER 45 2HB SER 45 9.397 -17.524 15.479
328 HG SER 45 HG SER 45 7.943 -19.032 15.398
329 H GLY 46 H GLY 46 6.507 -16.930 17.575
330 HA2 GLY 46 1HA GLY 46 6.859 -17.604 19.771
331 HA3 GLY 46 2HA GLY 46 8.534 -17.093 19.629
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -13.316 23.414 10.243
2 HA2 GLY 1 1HA GLY 1 -14.843 21.224 11.424
3 HA3 GLY 1 2HA GLY 1 -15.760 22.440 10.548
4 H SER 2 H SER 2 -12.555 21.155 9.774
5 HA SER 2 HA SER 2 -13.699 20.041 7.296
6 HB2 SER 2 1HB SER 2 -12.205 22.154 7.130
7 HB3 SER 2 2HB SER 2 -10.871 21.054 7.479
8 HG SER 2 HG SER 2 -12.577 21.135 5.245
9 H SER 3 H SER 3 -13.220 17.981 6.816
10 HA SER 3 HA SER 3 -11.114 16.644 8.381
11 HB2 SER 3 1HB SER 3 -13.585 16.174 9.057
12 HB3 SER 3 2HB SER 3 -13.629 15.203 7.585
13 HG SER 3 HG SER 3 -11.434 14.505 8.793
14 H GLY 4 H GLY 4 -13.280 16.166 5.582
15 HA2 GLY 4 1HA GLY 4 -12.042 16.083 3.391
16 HA3 GLY 4 2HA GLY 4 -11.000 14.911 4.183
17 H SER 5 H SER 5 -12.022 14.048 1.929
18 HA SER 5 HA SER 5 -14.015 12.087 2.790
19 HB2 SER 5 1HB SER 5 -15.220 13.942 1.631
20 HB3 SER 5 2HB SER 5 -14.256 13.619 0.190
21 HG SER 5 HG SER 5 -15.798 11.610 1.446
22 H SER 6 H SER 6 -13.973 10.128 1.636
23 HA SER 6 HA SER 6 -11.472 9.699 0.156
24 HB2 SER 6 1HB SER 6 -11.625 7.378 0.794
25 HB3 SER 6 2HB SER 6 -11.878 8.359 2.238
26 HG SER 6 HG SER 6 -14.199 8.095 1.724
27 H GLY 7 H GLY 7 -11.485 9.106 -1.928
28 HA2 GLY 7 1HA GLY 7 -14.037 8.202 -3.098
29 HA3 GLY 7 2HA GLY 7 -13.104 9.480 -3.862
30 H THR 8 H THR 8 -13.870 6.413 -4.267
31 HA THR 8 HA THR 8 -11.202 5.431 -4.950
32 HB THR 8 HB THR 8 -12.691 3.896 -3.740
33 HG1 THR 8 HG1 THR 8 -12.289 3.047 -6.433
34 HG21 THR 8 3HG2 THR 8 -14.423 3.910 -6.210
35 HG22 THR 8 1HG2 THR 8 -14.813 4.791 -4.734
36 HG23 THR 8 2HG2 THR 8 -14.704 3.031 -4.708
37 H LYS 9 H LYS 9 -11.902 7.530 -6.535
38 HA LYS 9 HA LYS 9 -13.330 7.265 -8.810
39 HB2 LYS 9 1HB LYS 9 -10.656 8.499 -8.287
40 HB3 LYS 9 2HB LYS 9 -11.265 8.448 -9.936
41 HG2 LYS 9 1HG LYS 9 -13.115 9.798 -9.409
42 HG3 LYS 9 2HG LYS 9 -12.876 9.583 -7.673
43 HD2 LYS 9 1HD LYS 9 -10.964 10.963 -7.663
44 HD3 LYS 9 2HD LYS 9 -10.823 10.914 -9.422
45 HE2 LYS 9 1HE LYS 9 -11.763 12.984 -9.142
46 HE3 LYS 9 2HE LYS 9 -13.215 12.000 -9.315
47 HZ1 LYS 9 3HZ LYS 9 -12.343 13.545 -7.090
48 HZ2 LYS 9 1HZ LYS 9 -12.627 11.940 -6.637
49 HZ3 LYS 9 2HZ LYS 9 -13.853 12.839 -7.378
50 H GLU 10 H GLU 10 -9.853 6.507 -8.921
51 HA GLU 10 HA GLU 10 -10.139 3.894 -9.919
52 HB2 GLU 10 1HB GLU 10 -9.930 4.087 -12.219
53 HB3 GLU 10 2HB GLU 10 -11.021 5.413 -11.841
54 HG2 GLU 10 1HG GLU 10 -8.955 6.888 -11.764
55 HG3 GLU 10 2HG GLU 10 -8.101 5.539 -12.512
56 H LYS 11 H LYS 11 -8.303 2.949 -9.359
57 HA LYS 11 HA LYS 11 -6.134 2.639 -8.736
58 HB2 LYS 11 1HB LYS 11 -5.298 4.636 -10.807
59 HB3 LYS 11 2HB LYS 11 -4.539 3.113 -10.364
60 HG2 LYS 11 1HG LYS 11 -7.249 2.922 -11.507
61 HG3 LYS 11 2HG LYS 11 -5.975 3.468 -12.600
62 HD2 LYS 11 1HD LYS 11 -4.636 1.475 -11.909
63 HD3 LYS 11 2HD LYS 11 -6.042 0.910 -11.003
64 HE2 LYS 11 1HE LYS 11 -6.086 1.524 -13.952
65 HE3 LYS 11 2HE LYS 11 -5.775 -0.082 -13.294
66 HZ1 LYS 11 3HZ LYS 11 -8.206 1.429 -12.565
67 HZ2 LYS 11 1HZ LYS 11 -7.924 -0.235 -12.454
68 HZ3 LYS 11 2HZ LYS 11 -8.149 0.485 -13.968
69 HA PRO 12 HA PRO 12 -6.082 7.004 -6.801
70 HB2 PRO 12 1HB PRO 12 -7.365 6.432 -4.478
71 HB3 PRO 12 2HB PRO 12 -8.206 7.000 -5.925
72 HG2 PRO 12 1HG PRO 12 -7.910 4.211 -4.877
73 HG3 PRO 12 2HG PRO 12 -9.345 5.007 -5.550
74 HD2 PRO 12 1HD PRO 12 -7.818 3.296 -6.990
75 HD3 PRO 12 2HD PRO 12 -8.665 4.672 -7.727
76 H TYR 13 H TYR 13 -5.551 3.738 -5.667
77 HA TYR 13 HA TYR 13 -3.788 4.546 -3.527
78 HB2 TYR 13 1HB TYR 13 -4.654 1.894 -4.649
79 HB3 TYR 13 2HB TYR 13 -3.334 1.999 -3.489
80 HD1 TYR 13 HD1 TYR 13 -6.354 4.135 -3.478
81 HD2 TYR 13 HD2 TYR 13 -4.344 0.844 -1.680
82 HE1 TYR 13 HE1 TYR 13 -7.982 4.155 -1.634
83 HE2 TYR 13 HE2 TYR 13 -5.967 0.854 0.168
84 HH TYR 13 HH TYR 13 -8.873 2.508 0.054
85 H LYS 14 H LYS 14 -1.845 5.322 -4.003
86 HA LYS 14 HA LYS 14 -0.368 4.160 -6.267
87 HB2 LYS 14 1HB LYS 14 -0.577 6.472 -6.644
88 HB3 LYS 14 2HB LYS 14 -0.281 6.864 -4.955
89 HG2 LYS 14 1HG LYS 14 2.016 6.505 -5.149
90 HG3 LYS 14 2HG LYS 14 1.838 5.598 -6.653
91 HD2 LYS 14 1HD LYS 14 1.383 7.544 -7.896
92 HD3 LYS 14 2HD LYS 14 1.076 8.498 -6.443
93 HE2 LYS 14 1HE LYS 14 3.508 8.073 -5.838
94 HE3 LYS 14 2HE LYS 14 3.707 7.483 -7.487
95 HZ1 LYS 14 3HZ LYS 14 3.686 10.141 -6.566
96 HZ2 LYS 14 1HZ LYS 14 2.395 9.930 -7.639
97 HZ3 LYS 14 2HZ LYS 14 3.972 9.569 -8.132
98 H CYS 15 H CYS 15 1.455 3.054 -5.916
99 HA CYS 15 HA CYS 15 2.239 2.384 -3.266
100 HB2 CYS 15 1HB CYS 15 2.444 0.838 -5.199
101 HB3 CYS 15 2HB CYS 15 3.711 1.868 -5.858
102 H TYR 16 H TYR 16 3.209 3.828 -1.994
103 HA TYR 16 HA TYR 16 4.783 5.987 -2.940
104 HB2 TYR 16 1HB TYR 16 4.817 4.879 -0.134
105 HB3 TYR 16 2HB TYR 16 5.150 6.529 -0.647
106 HD1 TYR 16 HD1 TYR 16 2.862 6.984 -2.493
107 HD2 TYR 16 HD2 TYR 16 3.011 5.128 1.332
108 HE1 TYR 16 HE1 TYR 16 0.504 7.578 -2.120
109 HE2 TYR 16 HE2 TYR 16 0.653 5.714 1.715
110 HH TYR 16 HH TYR 16 -1.251 6.440 0.710
111 H GLU 17 H GLU 17 5.479 2.729 -2.616
112 HA GLU 17 HA GLU 17 8.227 2.935 -1.828
113 HB2 GLU 17 1HB GLU 17 6.983 0.614 -3.290
114 HB3 GLU 17 2HB GLU 17 8.356 0.596 -2.192
115 HG2 GLU 17 1HG GLU 17 6.597 1.454 -0.459
116 HG3 GLU 17 2HG GLU 17 5.447 0.740 -1.588
117 H CYS 18 H CYS 18 6.584 2.250 -4.913
118 HA CYS 18 HA CYS 18 9.049 3.081 -6.300
119 HB2 CYS 18 1HB CYS 18 8.471 1.581 -8.113
120 HB3 CYS 18 2HB CYS 18 8.488 0.680 -6.601
121 H GLY 19 H GLY 19 5.568 3.339 -6.108
122 HA2 GLY 19 1HA GLY 19 4.643 5.545 -6.666
123 HA3 GLY 19 2HA GLY 19 5.700 5.545 -8.070
124 H LYS 20 H LYS 20 4.411 2.489 -7.505
125 HA LYS 20 HA LYS 20 2.955 2.453 -9.914
126 HB2 LYS 20 1HB LYS 20 3.214 0.593 -7.584
127 HB3 LYS 20 2HB LYS 20 1.977 0.285 -8.796
128 HG2 LYS 20 1HG LYS 20 4.739 0.791 -9.748
129 HG3 LYS 20 2HG LYS 20 4.404 -0.752 -8.960
130 HD2 LYS 20 1HD LYS 20 2.633 0.280 -11.149
131 HD3 LYS 20 2HD LYS 20 4.127 -0.583 -11.521
132 HE2 LYS 20 1HE LYS 20 2.264 -1.798 -9.550
133 HE3 LYS 20 2HE LYS 20 1.805 -1.836 -11.252
134 HZ1 LYS 20 3HZ LYS 20 3.021 -3.710 -11.232
135 HZ2 LYS 20 1HZ LYS 20 3.922 -3.261 -9.872
136 HZ3 LYS 20 2HZ LYS 20 4.332 -2.655 -11.397
137 H ALA 21 H ALA 21 0.577 1.453 -9.765
138 HA ALA 21 HA ALA 21 -1.012 3.007 -7.850
139 HB1 ALA 21 3HB ALA 21 -2.546 3.709 -9.642
140 HB2 ALA 21 1HB ALA 21 -0.923 4.368 -9.851
141 HB3 ALA 21 2HB ALA 21 -1.454 3.002 -10.833
142 H PHE 22 H PHE 22 -3.232 2.259 -7.652
143 HA PHE 22 HA PHE 22 -4.022 -0.214 -8.866
144 HB2 PHE 22 1HB PHE 22 -3.498 -0.263 -5.890
145 HB3 PHE 22 2HB PHE 22 -4.040 -1.601 -6.898
146 HD1 PHE 22 HD1 PHE 22 -1.187 0.537 -6.019
147 HD2 PHE 22 HD2 PHE 22 -2.500 -2.867 -8.212
148 HE1 PHE 22 HE1 PHE 22 1.154 -0.131 -6.378
149 HE2 PHE 22 HE2 PHE 22 -0.162 -3.540 -8.574
150 HZ PHE 22 HZ PHE 22 1.669 -2.172 -7.656
151 H ARG 23 H ARG 23 -6.199 -0.545 -8.722
152 HA ARG 23 HA ARG 23 -7.854 1.607 -8.042
153 HB2 ARG 23 1HB ARG 23 -8.464 -1.310 -8.517
154 HB3 ARG 23 2HB ARG 23 -9.716 -0.105 -8.246
155 HG2 ARG 23 1HG ARG 23 -8.628 1.156 -10.207
156 HG3 ARG 23 2HG ARG 23 -7.843 -0.384 -10.561
157 HD2 ARG 23 1HD ARG 23 -9.832 -1.431 -11.079
158 HD3 ARG 23 2HD ARG 23 -10.792 -0.311 -10.113
159 HE ARG 23 HE ARG 23 -9.983 0.013 -12.861
160 HH11 ARG 23 1HH1 ARG 23 -11.073 1.608 -9.964
161 HH12 ARG 23 2HH1 ARG 23 -11.707 2.984 -10.804
162 HH21 ARG 23 1HH2 ARG 23 -10.813 1.820 -13.978
163 HH22 ARG 23 2HH2 ARG 23 -11.559 3.103 -13.087
164 H THR 24 H THR 24 -7.379 -1.498 -6.360
165 HA THR 24 HA THR 24 -8.565 -0.282 -3.953
166 HB THR 24 HB THR 24 -9.375 -2.337 -3.277
167 HG1 THR 24 HG1 THR 24 -7.562 -3.633 -5.057
168 HG21 THR 24 3HG2 THR 24 -10.602 -1.758 -5.247
169 HG22 THR 24 1HG2 THR 24 -10.319 -3.498 -5.291
170 HG23 THR 24 2HG2 THR 24 -9.346 -2.421 -6.292
171 H ARG 25 H ARG 25 -7.691 -1.804 -1.963
172 HA ARG 25 HA ARG 25 -4.905 -1.068 -1.767
173 HB2 ARG 25 1HB ARG 25 -6.810 -0.960 0.054
174 HB3 ARG 25 2HB ARG 25 -6.322 -2.622 0.356
175 HG2 ARG 25 1HG ARG 25 -4.375 -0.336 0.349
176 HG3 ARG 25 2HG ARG 25 -5.244 -0.855 1.794
177 HD2 ARG 25 1HD ARG 25 -4.245 -3.023 1.701
178 HD3 ARG 25 2HD ARG 25 -3.550 -2.693 0.115
179 HE ARG 25 HE ARG 25 -1.806 -1.645 1.151
180 HH11 ARG 25 1HH1 ARG 25 -4.465 -1.875 3.386
181 HH12 ARG 25 2HH1 ARG 25 -3.557 -1.269 4.731
182 HH21 ARG 25 1HH2 ARG 25 -0.600 -0.845 2.914
183 HH22 ARG 25 2HH2 ARG 25 -1.359 -0.682 4.461
184 H SER 26 H SER 26 -6.743 -4.094 -1.325
185 HA SER 26 HA SER 26 -4.693 -5.858 -0.930
186 HB2 SER 26 1HB SER 26 -7.290 -6.223 -1.132
187 HB3 SER 26 2HB SER 26 -6.898 -6.652 -2.797
188 HG SER 26 HG SER 26 -6.893 -8.374 -1.089
189 H ASN 27 H ASN 27 -5.776 -4.478 -3.985
190 HA ASN 27 HA ASN 27 -4.113 -6.094 -5.635
191 HB2 ASN 27 1HB ASN 27 -5.805 -3.674 -6.010
192 HB3 ASN 27 2HB ASN 27 -4.557 -3.982 -7.215
193 HD21 ASN 27 1HD2 ASN 27 -6.794 -4.055 -8.355
194 HD22 ASN 27 2HD2 ASN 27 -7.444 -5.642 -8.569
195 H LEU 28 H LEU 28 -3.649 -3.154 -3.847
196 HA LEU 28 HA LEU 28 -1.228 -2.409 -5.225
197 HB2 LEU 28 1HB LEU 28 -2.181 -0.520 -4.404
198 HB3 LEU 28 2HB LEU 28 -2.856 -1.342 -2.999
199 HG LEU 28 HG LEU 28 -0.560 -1.350 -2.004
200 HD11 LEU 28 1HD1 LEU 28 0.146 0.700 -4.073
201 HD12 LEU 28 2HD1 LEU 28 0.516 -1.008 -4.306
202 HD13 LEU 28 3HD1 LEU 28 1.199 -0.138 -2.933
203 HD21 LEU 28 3HD2 LEU 28 -2.311 0.331 -1.457
204 HD22 LEU 28 1HD2 LEU 28 -1.610 1.394 -2.678
205 HD23 LEU 28 2HD2 LEU 28 -0.662 0.929 -1.265
206 H THR 29 H THR 29 -1.914 -3.346 -1.849
207 HA THR 29 HA THR 29 0.653 -3.669 -0.945
208 HB THR 29 HB THR 29 -1.836 -5.218 -0.244
209 HG1 THR 29 HG1 THR 29 -1.527 -3.898 1.704
210 HG21 THR 29 3HG2 THR 29 -0.397 -6.770 0.572
211 HG22 THR 29 1HG2 THR 29 -0.256 -5.614 1.896
212 HG23 THR 29 2HG2 THR 29 0.960 -5.645 0.618
213 H THR 30 H THR 30 -1.347 -6.102 -2.591
214 HA THR 30 HA THR 30 0.278 -8.299 -2.475
215 HB THR 30 HB THR 30 -1.530 -7.321 -4.669
216 HG1 THR 30 HG1 THR 30 -1.620 -9.237 -2.600
217 HG21 THR 30 3HG2 THR 30 -1.273 -9.523 -5.753
218 HG22 THR 30 1HG2 THR 30 0.040 -9.902 -4.639
219 HG23 THR 30 2HG2 THR 30 0.217 -8.582 -5.795
220 H HIS 31 H HIS 31 0.751 -5.394 -4.329
221 HA HIS 31 HA HIS 31 2.947 -6.573 -5.846
222 HB2 HIS 31 1HB HIS 31 1.858 -5.183 -7.303
223 HB3 HIS 31 2HB HIS 31 1.339 -4.079 -6.032
224 HD1 HIS 31 HD1 HIS 31 4.176 -4.768 -8.366
225 HD2 HIS 31 HD2 HIS 31 3.113 -1.990 -5.465
226 HE1 HIS 31 HE1 HIS 31 5.818 -2.879 -8.611
227 H GLN 32 H GLN 32 2.359 -4.282 -3.254
228 HA GLN 32 HA GLN 32 4.885 -3.109 -3.086
229 HB2 GLN 32 1HB GLN 32 2.829 -3.691 -0.956
230 HB3 GLN 32 2HB GLN 32 4.289 -2.760 -0.652
231 HG2 GLN 32 1HG GLN 32 3.390 -1.396 -2.743
232 HG3 GLN 32 2HG GLN 32 1.852 -2.034 -2.163
233 HE21 GLN 32 1HE2 GLN 32 0.859 -0.483 -1.093
234 HE22 GLN 32 2HE2 GLN 32 1.569 0.544 0.101
235 H VAL 33 H VAL 33 3.907 -6.306 -2.420
236 HA VAL 33 HA VAL 33 5.600 -7.114 -0.383
237 HB VAL 33 HB VAL 33 4.905 -8.737 -2.835
238 HG11 VAL 33 1HG1 VAL 33 4.990 -10.552 -0.933
239 HG12 VAL 33 2HG1 VAL 33 6.460 -10.032 -1.759
240 HG13 VAL 33 3HG1 VAL 33 6.064 -9.380 -0.168
241 HG21 VAL 33 3HG2 VAL 33 2.808 -8.200 -2.104
242 HG22 VAL 33 1HG2 VAL 33 3.131 -9.590 -1.068
243 HG23 VAL 33 2HG2 VAL 33 3.330 -7.955 -0.438
244 H ILE 34 H ILE 34 6.301 -6.513 -3.765
245 HA ILE 34 HA ILE 34 8.792 -7.756 -3.964
246 HB ILE 34 HB ILE 34 9.244 -6.320 -5.845
247 HG12 ILE 34 1HG1 ILE 34 6.972 -4.635 -4.778
248 HG13 ILE 34 2HG1 ILE 34 8.661 -4.164 -4.929
249 HG21 ILE 34 1HG2 ILE 34 6.507 -7.416 -5.494
250 HG22 ILE 34 2HG2 ILE 34 6.835 -6.450 -6.932
251 HG23 ILE 34 3HG2 ILE 34 7.786 -7.899 -6.608
252 HD11 ILE 34 3HD1 ILE 34 6.586 -4.469 -7.048
253 HD12 ILE 34 1HD1 ILE 34 7.680 -3.123 -6.731
254 HD13 ILE 34 2HD1 ILE 34 8.297 -4.610 -7.451
255 H HIS 35 H HIS 35 7.852 -4.788 -2.424
256 HA HIS 35 HA HIS 35 10.619 -3.924 -2.103
257 HB2 HIS 35 1HB HIS 35 8.090 -2.619 -1.081
258 HB3 HIS 35 2HB HIS 35 9.696 -1.899 -1.134
259 HD1 HIS 35 HD1 HIS 35 10.685 -1.702 -3.708
260 HD2 HIS 35 HD2 HIS 35 6.569 -2.009 -3.232
261 HE1 HIS 35 HE1 HIS 35 9.694 -0.866 -5.863
262 H THR 36 H THR 36 8.323 -5.801 -0.480
263 HA THR 36 HA THR 36 9.482 -5.308 2.158
264 HB THR 36 HB THR 36 7.665 -6.431 3.103
265 HG1 THR 36 HG1 THR 36 7.619 -7.783 0.657
266 HG21 THR 36 3HG2 THR 36 5.858 -5.212 2.389
267 HG22 THR 36 1HG2 THR 36 6.201 -5.495 0.683
268 HG23 THR 36 2HG2 THR 36 7.155 -4.322 1.592
269 H GLY 37 H GLY 37 10.359 -6.996 3.439
270 HA2 GLY 37 1HA GLY 37 10.773 -9.623 2.387
271 HA3 GLY 37 2HA GLY 37 12.217 -8.632 2.243
272 H GLU 38 H GLU 38 13.238 -7.862 4.153
273 HA GLU 38 HA GLU 38 12.985 -9.714 6.358
274 HB2 GLU 38 1HB GLU 38 15.155 -8.668 5.289
275 HB3 GLU 38 2HB GLU 38 14.828 -7.361 6.417
276 HG2 GLU 38 1HG GLU 38 15.221 -8.671 8.265
277 HG3 GLU 38 2HG GLU 38 14.882 -10.172 7.405
278 H LYS 39 H LYS 39 10.866 -9.058 7.066
279 HA LYS 39 HA LYS 39 10.105 -6.518 7.863
280 HB2 LYS 39 1HB LYS 39 9.329 -9.260 8.814
281 HB3 LYS 39 2HB LYS 39 8.646 -7.824 9.564
282 HG2 LYS 39 1HG LYS 39 8.539 -8.121 6.600
283 HG3 LYS 39 2HG LYS 39 7.400 -9.011 7.612
284 HD2 LYS 39 1HD LYS 39 6.485 -7.028 8.502
285 HD3 LYS 39 2HD LYS 39 7.822 -6.048 7.898
286 HE2 LYS 39 1HE LYS 39 7.085 -6.605 5.581
287 HE3 LYS 39 2HE LYS 39 5.675 -7.404 6.273
288 HZ1 LYS 39 3HZ LYS 39 6.363 -4.543 6.677
289 HZ2 LYS 39 1HZ LYS 39 4.965 -5.328 7.220
290 HZ3 LYS 39 2HZ LYS 39 5.225 -5.112 5.562
291 H ARG 40 H ARG 40 10.985 -5.177 9.282
292 HA ARG 40 HA ARG 40 13.077 -5.518 10.927
293 HB2 ARG 40 1HB ARG 40 10.623 -3.878 11.585
294 HB3 ARG 40 2HB ARG 40 12.201 -3.687 12.338
295 HG2 ARG 40 1HG ARG 40 11.722 -3.366 9.387
296 HG3 ARG 40 2HG ARG 40 11.661 -2.033 10.541
297 HD2 ARG 40 1HD ARG 40 14.005 -2.783 11.245
298 HD3 ARG 40 2HD ARG 40 14.008 -3.736 9.762
299 HE ARG 40 HE ARG 40 14.371 -1.813 8.590
300 HH11 ARG 40 1HH1 ARG 40 13.097 -0.987 11.722
301 HH12 ARG 40 2HH1 ARG 40 13.299 0.719 11.498
302 HH21 ARG 40 1HH2 ARG 40 14.642 0.431 8.283
303 HH22 ARG 40 2HH2 ARG 40 14.177 1.525 9.541
304 H SER 41 H SER 41 13.352 -5.830 13.227
305 HA SER 41 HA SER 41 11.788 -8.069 14.177
306 HB2 SER 41 1HB SER 41 13.471 -8.357 15.830
307 HB3 SER 41 2HB SER 41 14.325 -7.861 14.369
308 HG SER 41 HG SER 41 14.133 -5.660 15.287
309 H GLY 42 H GLY 42 11.310 -8.055 16.645
310 HA2 GLY 42 1HA GLY 42 9.342 -6.051 17.091
311 HA3 GLY 42 2HA GLY 42 9.844 -7.283 18.240
312 HA PRO 43 HA PRO 43 11.846 -2.920 18.949
313 HB2 PRO 43 1HB PRO 43 9.825 -1.433 19.984
314 HB3 PRO 43 2HB PRO 43 10.226 -1.443 18.262
315 HG2 PRO 43 1HG PRO 43 8.071 -2.929 19.714
316 HG3 PRO 43 2HG PRO 43 7.991 -2.076 18.162
317 HD2 PRO 43 1HD PRO 43 8.240 -4.767 18.335
318 HD3 PRO 43 2HD PRO 43 8.951 -3.826 17.008
319 H SER 44 H SER 44 10.272 -5.345 20.522
320 HA SER 44 HA SER 44 10.535 -6.208 22.623
321 HB2 SER 44 1HB SER 44 12.787 -4.957 22.494
322 HB3 SER 44 2HB SER 44 12.002 -3.715 23.469
323 HG SER 44 HG SER 44 11.504 -5.459 24.972
324 H SER 45 H SER 45 8.227 -4.866 21.919
325 HA SER 45 HA SER 45 7.408 -3.757 24.514
326 HB2 SER 45 1HB SER 45 7.722 -1.913 22.862
327 HB3 SER 45 2HB SER 45 6.503 -2.670 21.837
328 HG SER 45 HG SER 45 5.766 -0.955 23.311
329 H GLY 46 H GLY 46 5.805 -4.904 25.356
330 HA2 GLY 46 1HA GLY 46 3.367 -5.497 24.449
331 HA3 GLY 46 2HA GLY 46 4.318 -6.752 23.669