Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
588753 | 2rv0 RC | 11480 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 1H GLY 1 22.362 4.616 20.238
2 H2 GLY 1 2H GLY 1 23.942 4.411 19.858
3 H3 GLY 1 3H GLY 1 22.780 3.672 18.968
4 HA2 GLY 1 1HA GLY 1 23.200 6.585 19.145
5 HA3 GLY 1 2HA GLY 1 23.671 5.566 17.773
6 H SER 2 H SER 2 22.005 7.766 17.445
7 HA SER 2 HA SER 2 19.197 6.977 17.375
8 HB2 SER 2 1HB SER 2 20.048 9.325 17.697
9 HB3 SER 2 2HB SER 2 20.508 9.331 15.981
10 HG SER 2 HG SER 2 18.394 10.200 16.372
11 H SER 3 H SER 3 17.889 6.820 15.463
12 HA SER 3 HA SER 3 18.935 4.972 13.533
13 HB2 SER 3 1HB SER 3 16.298 6.484 13.507
14 HB3 SER 3 2HB SER 3 16.686 5.038 12.561
15 HG SER 3 HG SER 3 16.890 3.868 14.503
16 H GLY 4 H GLY 4 19.337 5.134 11.366
17 HA2 GLY 4 1HA GLY 4 20.006 7.739 10.185
18 HA3 GLY 4 2HA GLY 4 20.193 6.151 9.450
19 H SER 5 H SER 5 19.388 7.838 7.707
20 HA SER 5 HA SER 5 16.610 8.419 7.432
21 HB2 SER 5 1HB SER 5 18.692 7.966 5.260
22 HB3 SER 5 2HB SER 5 17.127 8.778 5.062
23 HG SER 5 HG SER 5 18.854 10.269 5.383
24 H SER 6 H SER 6 14.962 7.436 6.212
25 HA SER 6 HA SER 6 15.315 4.653 5.255
26 HB2 SER 6 1HB SER 6 14.759 4.574 7.706
27 HB3 SER 6 2HB SER 6 13.226 5.384 7.338
28 HG SER 6 HG SER 6 13.046 3.081 7.403
29 H GLY 7 H GLY 7 13.615 3.868 3.991
30 HA2 GLY 7 1HA GLY 7 11.220 5.219 3.285
31 HA3 GLY 7 2HA GLY 7 12.439 5.566 2.048
32 H ARG 8 H ARG 8 9.913 3.875 2.033
33 HA ARG 8 HA ARG 8 11.023 1.273 1.056
34 HB2 ARG 8 1HB ARG 8 8.779 1.590 3.102
35 HB3 ARG 8 2HB ARG 8 9.256 0.077 2.331
36 HG2 ARG 8 1HG ARG 8 11.539 0.302 3.343
37 HG3 ARG 8 2HG ARG 8 10.976 1.750 4.209
38 HD2 ARG 8 1HD ARG 8 9.206 0.402 5.303
39 HD3 ARG 8 2HD ARG 8 9.809 -1.047 4.469
40 HE ARG 8 HE ARG 8 11.960 0.207 5.888
41 HH11 ARG 8 2HH1 ARG 8 9.095 -1.676 6.611
42 HH12 ARG 8 1HH1 ARG 8 9.767 -2.300 8.093
43 HH21 ARG 8 2HH2 ARG 8 12.757 -0.626 7.785
44 HH22 ARG 8 1HH2 ARG 8 11.789 -1.714 8.736
45 H SER 9 H SER 9 9.689 0.043 -0.230
46 HA SER 9 HA SER 9 7.339 1.358 -1.522
47 HB2 SER 9 1HB SER 9 7.769 -0.126 -3.438
48 HB3 SER 9 2HB SER 9 9.116 0.977 -3.119
49 HG SER 9 HG SER 9 9.839 -1.170 -3.504
50 H TYR 10 H TYR 10 5.684 -0.250 -2.286
51 HA TYR 10 HA TYR 10 5.167 -2.337 -0.202
52 HB2 TYR 10 1HB TYR 10 3.207 -0.216 -1.148
53 HB3 TYR 10 2HB TYR 10 2.944 -1.429 0.097
54 HD1 TYR 10 1HD TYR 10 3.988 -1.214 2.332
55 HD2 TYR 10 2HD TYR 10 4.555 1.790 -0.714
56 HE1 TYR 10 1HE TYR 10 4.928 0.337 4.036
57 HE2 TYR 10 2HE TYR 10 5.546 3.321 0.989
58 HH TYR 10 HH TYR 10 5.857 2.394 4.434
59 H SER 11 H SER 11 3.528 -3.901 -0.749
60 HA SER 11 HA SER 11 2.797 -4.122 -3.628
61 HB2 SER 11 1HB SER 11 3.943 -6.400 -1.981
62 HB3 SER 11 2HB SER 11 3.318 -6.501 -3.639
63 HG SER 11 HG SER 11 5.612 -6.307 -3.568
64 H CYS 12 H CYS 12 0.751 -4.778 -3.981
65 HA CYS 12 HA CYS 12 -1.177 -4.669 -1.994
66 HB2 CYS 12 1HB CYS 12 -1.609 -4.246 -4.317
67 HB3 CYS 12 2HB CYS 12 -1.284 -5.943 -4.729
68 HA PRO 13 HA PRO 13 -0.849 -8.813 -0.228
69 HB2 PRO 13 1HB PRO 13 -2.866 -8.701 1.617
70 HB3 PRO 13 2HB PRO 13 -1.322 -7.817 1.798
71 HG2 PRO 13 1HG PRO 13 -3.962 -6.754 0.751
72 HG3 PRO 13 2HG PRO 13 -2.882 -6.022 1.977
73 HD2 PRO 13 1HD PRO 13 -2.835 -5.277 -0.653
74 HD3 PRO 13 2HD PRO 13 -1.348 -5.312 0.342
75 H VAL 14 H VAL 14 -3.355 -7.686 -2.248
76 HA VAL 14 HA VAL 14 -4.767 -10.335 -2.230
77 HB VAL 14 HB VAL 14 -5.907 -7.702 -3.174
78 HG11 VAL 14 1HG1 VAL 14 -7.070 -9.681 -4.068
79 HG12 VAL 14 2HG1 VAL 14 -7.208 -10.358 -2.428
80 HG13 VAL 14 3HG1 VAL 14 -8.076 -8.873 -2.867
81 HG21 VAL 14 3HG2 VAL 14 -6.115 -9.018 -0.438
82 HG22 VAL 14 1HG2 VAL 14 -5.516 -7.386 -0.819
83 HG23 VAL 14 2HG2 VAL 14 -7.221 -7.755 -1.017
84 H CYS 15 H CYS 15 -3.272 -7.918 -4.397
85 HA CYS 15 HA CYS 15 -3.388 -9.946 -6.570
86 HB2 CYS 15 1HB CYS 15 -4.007 -8.374 -8.196
87 HB3 CYS 15 2HB CYS 15 -5.239 -8.423 -6.935
88 H GLU 16 H GLU 16 -1.283 -8.432 -4.751
89 HA GLU 16 HA GLU 16 0.918 -8.092 -4.768
90 HB2 GLU 16 1HB GLU 16 0.507 -10.487 -5.806
91 HB3 GLU 16 2HB GLU 16 1.234 -9.770 -7.235
92 HG2 GLU 16 1HG GLU 16 2.953 -10.882 -6.031
93 HG3 GLU 16 2HG GLU 16 3.245 -9.165 -5.810
94 H LYS 17 H LYS 17 -0.724 -6.302 -6.784
95 HA LYS 17 HA LYS 17 1.224 -5.181 -8.566
96 HB2 LYS 17 1HB LYS 17 -1.159 -4.687 -8.802
97 HB3 LYS 17 2HB LYS 17 -1.192 -3.904 -7.211
98 HG2 LYS 17 1HG LYS 17 0.382 -2.200 -7.985
99 HG3 LYS 17 2HG LYS 17 0.499 -2.976 -9.576
100 HD2 LYS 17 1HD LYS 17 -1.884 -2.439 -9.971
101 HD3 LYS 17 2HD LYS 17 -1.994 -1.692 -8.372
102 HE2 LYS 17 1HE LYS 17 -0.187 -0.816 -10.678
103 HE3 LYS 17 2HE LYS 17 -1.661 -0.001 -10.157
104 HZ1 LYS 17 3HZ LYS 17 0.826 -0.253 -8.518
105 HZ2 LYS 17 1HZ LYS 17 -0.551 0.458 -8.014
106 HZ3 LYS 17 2HZ LYS 17 0.292 1.102 -9.256
107 H SER 18 H SER 18 2.775 -3.644 -8.337
108 HA SER 18 HA SER 18 3.776 -3.026 -5.649
109 HB2 SER 18 1HB SER 18 4.826 -2.243 -8.388
110 HB3 SER 18 2HB SER 18 5.629 -1.920 -6.844
111 HG SER 18 HG SER 18 4.986 -4.495 -7.906
112 H PHE 19 H PHE 19 4.035 -1.056 -4.718
113 HA PHE 19 HA PHE 19 2.910 1.416 -5.931
114 HB2 PHE 19 1HB PHE 19 2.177 0.187 -3.248
115 HB3 PHE 19 2HB PHE 19 1.901 1.880 -3.628
116 HD1 PHE 19 2HD PHE 19 0.285 2.573 -5.351
117 HD2 PHE 19 1HD PHE 19 0.759 -1.566 -4.240
118 HE1 PHE 19 2HE PHE 19 -1.877 2.034 -6.452
119 HE2 PHE 19 1HE PHE 19 -1.372 -2.115 -5.389
120 HZ PHE 19 HZ PHE 19 -2.675 -0.318 -6.517
121 H SER 20 H SER 20 3.836 3.330 -5.214
122 HA SER 20 HA SER 20 6.512 3.068 -4.028
123 HB2 SER 20 1HB SER 20 6.749 5.411 -4.846
124 HB3 SER 20 2HB SER 20 6.335 4.233 -6.103
125 HG SER 20 HG SER 20 5.060 6.144 -6.248
126 H GLU 21 H GLU 21 3.404 4.094 -2.865
127 HA GLU 21 HA GLU 21 4.652 5.195 -0.401
128 HB2 GLU 21 1HB GLU 21 2.458 6.615 -1.947
129 HB3 GLU 21 2HB GLU 21 3.094 7.084 -0.371
130 HG2 GLU 21 1HG GLU 21 5.352 7.404 -1.438
131 HG3 GLU 21 2HG GLU 21 4.595 7.142 -3.017
132 H ASP 22 H ASP 22 3.429 5.074 1.454
133 HA ASP 22 HA ASP 22 1.736 2.862 1.824
134 HB2 ASP 22 1HB ASP 22 3.138 3.890 3.543
135 HB3 ASP 22 2HB ASP 22 2.190 5.374 3.479
136 H ARG 23 H ARG 23 0.854 6.293 1.355
137 HA ARG 23 HA ARG 23 -1.979 5.959 1.765
138 HB2 ARG 23 1HB ARG 23 -2.210 8.173 0.799
139 HB3 ARG 23 2HB ARG 23 -0.870 8.132 1.944
140 HG2 ARG 23 1HG ARG 23 0.742 7.982 0.040
141 HG3 ARG 23 2HG ARG 23 -0.616 8.054 -1.100
142 HD2 ARG 23 1HD ARG 23 -1.232 10.273 -0.302
143 HD3 ARG 23 2HD ARG 23 0.048 10.216 0.932
144 HE ARG 23 HE ARG 23 1.372 9.746 -1.489
145 HH11 ARG 23 2HH1 ARG 23 -0.500 12.477 -0.302
146 HH12 ARG 23 1HH1 ARG 23 0.422 13.594 -1.274
147 HH21 ARG 23 2HH2 ARG 23 2.453 11.094 -2.557
148 HH22 ARG 23 1HH2 ARG 23 2.104 12.827 -2.574
149 H LEU 24 H LEU 24 0.007 5.318 -1.054
150 HA LEU 24 HA LEU 24 -2.265 5.360 -2.916
151 HB2 LEU 24 1HB LEU 24 0.608 4.430 -3.289
152 HB3 LEU 24 2HB LEU 24 -0.602 4.571 -4.564
153 HG LEU 24 HG LEU 24 0.453 6.909 -2.921
154 HD11 LEU 24 1HD1 LEU 24 1.637 7.535 -4.971
155 HD12 LEU 24 2HD1 LEU 24 1.025 6.082 -5.797
156 HD13 LEU 24 3HD1 LEU 24 2.151 5.934 -4.430
157 HD21 LEU 24 3HD2 LEU 24 -1.373 6.843 -5.359
158 HD22 LEU 24 1HD2 LEU 24 -0.639 8.303 -4.659
159 HD23 LEU 24 2HD2 LEU 24 -1.813 7.380 -3.721
160 H ILE 25 H ILE 25 -0.256 2.794 -1.368
161 HA ILE 25 HA ILE 25 -1.858 0.673 -2.498
162 HB ILE 25 HB ILE 25 0.397 0.268 -1.685
163 HG12 ILE 25 1HG1 ILE 25 -1.697 -1.392 -0.216
164 HG13 ILE 25 2HG1 ILE 25 -1.321 -1.534 -1.936
165 HG21 ILE 25 1HG2 ILE 25 0.349 1.698 0.348
166 HG22 ILE 25 2HG2 ILE 25 -0.718 0.507 1.141
167 HG23 ILE 25 3HG2 ILE 25 0.943 0.086 0.683
168 HD11 ILE 25 3HD1 ILE 25 0.611 -2.096 0.353
169 HD12 ILE 25 1HD1 ILE 25 -0.218 -3.276 -0.647
170 HD13 ILE 25 2HD1 ILE 25 0.991 -2.203 -1.390
171 H LYS 26 H LYS 26 -2.170 2.524 0.591
172 HA LYS 26 HA LYS 26 -4.477 1.064 1.515
173 HB2 LYS 26 1HB LYS 26 -3.438 3.866 2.054
174 HB3 LYS 26 2HB LYS 26 -4.936 3.264 2.780
175 HG2 LYS 26 1HG LYS 26 -3.804 1.412 3.844
176 HG3 LYS 26 2HG LYS 26 -2.280 1.790 3.025
177 HD2 LYS 26 1HD LYS 26 -2.129 3.933 4.203
178 HD3 LYS 26 2HD LYS 26 -3.685 3.635 5.012
179 HE2 LYS 26 1HE LYS 26 -2.794 1.705 6.184
180 HE3 LYS 26 2HE LYS 26 -1.310 1.740 5.220
181 HZ1 LYS 26 3HZ LYS 26 -0.720 3.826 6.205
182 HZ2 LYS 26 1HZ LYS 26 -0.965 2.739 7.402
183 HZ3 LYS 26 2HZ LYS 26 -2.097 3.889 7.108
184 H SER 27 H SER 27 -4.292 3.941 -0.623
185 HA SER 27 HA SER 27 -7.115 4.205 -1.022
186 HB2 SER 27 1HB SER 27 -4.839 4.828 -2.949
187 HB3 SER 27 2HB SER 27 -6.526 5.337 -3.136
188 HG SER 27 HG SER 27 -4.678 6.072 -1.104
189 H HIS 28 H HIS 28 -4.712 2.168 -2.779
190 HA HIS 28 HA HIS 28 -6.560 1.022 -4.629
191 HB2 HIS 28 1HB HIS 28 -4.187 0.917 -4.962
192 HB3 HIS 28 2HB HIS 28 -3.936 0.040 -3.462
193 HD1 HIS 28 1HD HIS 28 -5.611 -0.603 -6.903
194 HD2 HIS 28 2HD HIS 28 -3.868 -2.535 -3.600
195 HE1 HIS 28 1HE HIS 28 -5.380 -3.039 -7.570
196 H ILE 29 H ILE 29 -5.499 -0.207 -1.409
197 HA ILE 29 HA ILE 29 -7.164 -2.528 -1.416
198 HB ILE 29 HB ILE 29 -6.046 -0.871 0.870
199 HG12 ILE 29 1HG1 ILE 29 -5.210 -3.599 -0.244
200 HG13 ILE 29 2HG1 ILE 29 -4.422 -2.085 -0.669
201 HG21 ILE 29 1HG2 ILE 29 -6.580 -2.803 2.352
202 HG22 ILE 29 2HG2 ILE 29 -8.034 -2.078 1.707
203 HG23 ILE 29 3HG2 ILE 29 -7.429 -3.596 1.007
204 HD11 ILE 29 3HD1 ILE 29 -3.825 -1.725 1.731
205 HD12 ILE 29 1HD1 ILE 29 -4.439 -3.363 2.081
206 HD13 ILE 29 2HD1 ILE 29 -3.076 -3.145 0.978
207 H LYS 30 H LYS 30 -7.910 0.820 -0.329
208 HA LYS 30 HA LYS 30 -10.579 0.204 0.579
209 HB2 LYS 30 1HB LYS 30 -9.187 2.785 -0.225
210 HB3 LYS 30 2HB LYS 30 -10.863 2.745 0.334
211 HG2 LYS 30 1HG LYS 30 -10.224 1.769 2.467
212 HG3 LYS 30 2HG LYS 30 -8.534 1.637 1.962
213 HD2 LYS 30 1HD LYS 30 -8.396 4.109 1.746
214 HD3 LYS 30 2HD LYS 30 -10.096 4.242 2.254
215 HE2 LYS 30 1HE LYS 30 -9.514 3.118 4.408
216 HE3 LYS 30 2HE LYS 30 -7.822 3.045 3.904
217 HZ1 LYS 30 3HZ LYS 30 -8.242 4.972 5.323
218 HZ2 LYS 30 1HZ LYS 30 -9.380 5.546 4.308
219 HZ3 LYS 30 2HZ LYS 30 -7.816 5.491 3.835
220 H THR 31 H THR 31 -9.422 1.115 -2.677
221 HA THR 31 HA THR 31 -12.163 1.424 -3.673
222 HB THR 31 HB THR 31 -10.945 1.836 -5.825
223 HG1 THR 31 1HG THR 31 -8.639 2.094 -4.277
224 HG21 THR 31 3HG2 THR 31 -10.165 3.582 -3.457
225 HG22 THR 31 1HG2 THR 31 -11.632 3.723 -4.445
226 HG23 THR 31 2HG2 THR 31 -10.047 4.045 -5.171
227 H ASN 32 H ASN 32 -9.557 -0.974 -3.998
228 HA ASN 32 HA ASN 32 -11.208 -2.535 -5.942
229 HB2 ASN 32 1HB ASN 32 -8.226 -2.504 -5.305
230 HB3 ASN 32 2HB ASN 32 -8.992 -3.698 -6.332
231 HD21 ASN 32 1HD2 ASN 32 -8.656 -0.075 -6.080
232 HD22 ASN 32 2HD2 ASN 32 -8.652 0.107 -7.822
233 H HIS 33 H HIS 33 -9.937 -2.779 -2.658
234 HA HIS 33 HA HIS 33 -10.945 -5.581 -2.477
235 HB2 HIS 33 1HB HIS 33 -8.348 -4.622 -1.251
236 HB3 HIS 33 2HB HIS 33 -8.955 -6.268 -1.359
237 HD1 HIS 33 1HD HIS 33 -9.395 -6.729 -4.379
238 HD2 HIS 33 2HD HIS 33 -6.308 -4.391 -2.759
239 HE1 HIS 33 1HE HIS 33 -7.571 -6.686 -6.143
240 HA PRO 34 HA PRO 34 -11.890 -2.519 1.120
241 HB2 PRO 34 1HB PRO 34 -14.644 -2.325 0.984
242 HB3 PRO 34 2HB PRO 34 -13.499 -1.240 0.138
243 HG2 PRO 34 1HG PRO 34 -14.924 -3.684 -0.962
244 HG3 PRO 34 2HG PRO 34 -14.783 -2.055 -1.703
245 HD2 PRO 34 1HD PRO 34 -13.122 -4.048 -2.445
246 HD3 PRO 34 2HD PRO 34 -12.500 -2.383 -2.216
247 H GLU 35 H GLU 35 -13.806 -5.404 0.194
248 HA GLU 35 HA GLU 35 -14.522 -6.088 2.925
249 HB2 GLU 35 1HB GLU 35 -15.477 -8.085 1.971
250 HB3 GLU 35 2HB GLU 35 -15.921 -6.678 1.009
251 HG2 GLU 35 1HG GLU 35 -14.143 -7.275 -0.655
252 HG3 GLU 35 2HG GLU 35 -13.749 -8.703 0.304
253 H VAL 36 H VAL 36 -11.568 -6.194 1.477
254 HA VAL 36 HA VAL 36 -10.584 -8.589 2.954
255 HB VAL 36 HB VAL 36 -8.965 -7.324 0.772
256 HG11 VAL 36 1HG1 VAL 36 -8.094 -9.272 2.023
257 HG12 VAL 36 2HG1 VAL 36 -9.534 -10.213 1.580
258 HG13 VAL 36 3HG1 VAL 36 -8.382 -9.697 0.333
259 HG21 VAL 36 3HG2 VAL 36 -10.056 -8.687 -0.984
260 HG22 VAL 36 1HG2 VAL 36 -11.347 -9.123 0.155
261 HG23 VAL 36 2HG2 VAL 36 -11.141 -7.439 -0.379
262 H SER 37 H SER 37 -10.706 -5.299 3.221
263 HA SER 37 HA SER 37 -8.037 -4.567 4.043
264 HB2 SER 37 1HB SER 37 -9.822 -3.031 3.152
265 HB3 SER 37 2HB SER 37 -10.676 -3.211 4.698
266 HG SER 37 HG SER 37 -9.275 -1.374 4.718
Start of MODEL 2
1 H1 GLY 1 1H GLY 1 23.708 3.441 -12.385
2 H2 GLY 1 2H GLY 1 23.319 2.171 -11.426
3 H3 GLY 1 3H GLY 1 24.890 2.553 -11.678
4 HA2 GLY 1 1HA GLY 1 24.629 4.660 -10.535
5 HA3 GLY 1 2HA GLY 1 22.932 4.230 -10.249
6 H SER 2 H SER 2 23.267 4.390 -7.975
7 HA SER 2 HA SER 2 25.230 2.930 -6.509
8 HB2 SER 2 1HB SER 2 22.526 3.965 -5.578
9 HB3 SER 2 2HB SER 2 23.893 3.510 -4.543
10 HG SER 2 HG SER 2 23.808 5.779 -4.927
11 H SER 3 H SER 3 25.071 1.097 -5.172
12 HA SER 3 HA SER 3 23.695 -1.138 -6.277
13 HB2 SER 3 1HB SER 3 25.064 -0.907 -3.573
14 HB3 SER 3 2HB SER 3 24.714 -2.401 -4.463
15 HG SER 3 HG SER 3 26.881 -1.696 -4.768
16 H GLY 4 H GLY 4 22.570 1.117 -3.910
17 HA2 GLY 4 1HA GLY 4 19.953 0.044 -3.749
18 HA3 GLY 4 2HA GLY 4 20.835 -0.456 -2.302
19 H SER 5 H SER 5 18.797 0.968 -1.665
20 HA SER 5 HA SER 5 19.870 3.523 -0.678
21 HB2 SER 5 1HB SER 5 18.014 4.867 -1.427
22 HB3 SER 5 2HB SER 5 18.768 4.110 -2.835
23 HG SER 5 HG SER 5 16.506 3.929 -2.949
24 H SER 6 H SER 6 18.388 4.534 0.940
25 HA SER 6 HA SER 6 17.487 2.546 2.846
26 HB2 SER 6 1HB SER 6 17.309 5.576 2.974
27 HB3 SER 6 2HB SER 6 17.148 4.446 4.330
28 HG SER 6 HG SER 6 19.267 5.330 4.181
29 H GLY 7 H GLY 7 15.785 3.885 0.270
30 HA2 GLY 7 1HA GLY 7 13.225 4.458 1.492
31 HA3 GLY 7 2HA GLY 7 13.561 4.279 -0.224
32 H ARG 8 H ARG 8 11.209 3.407 0.677
33 HA ARG 8 HA ARG 8 11.324 0.432 0.482
34 HB2 ARG 8 1HB ARG 8 9.475 1.914 2.412
35 HB3 ARG 8 2HB ARG 8 9.539 0.183 2.114
36 HG2 ARG 8 1HG ARG 8 10.781 0.201 4.012
37 HG3 ARG 8 2HG ARG 8 12.089 0.455 2.861
38 HD2 ARG 8 1HD ARG 8 11.583 3.023 3.271
39 HD3 ARG 8 2HD ARG 8 10.713 2.468 4.691
40 HE ARG 8 HE ARG 8 13.607 2.533 4.218
41 HH11 ARG 8 2HH1 ARG 8 11.196 1.060 6.309
42 HH12 ARG 8 1HH1 ARG 8 12.374 0.701 7.542
43 HH21 ARG 8 2HH2 ARG 8 15.018 2.057 5.798
44 HH22 ARG 8 1HH2 ARG 8 14.497 1.256 7.257
45 H SER 9 H SER 9 9.476 -0.566 -0.337
46 HA SER 9 HA SER 9 7.421 1.115 -1.685
47 HB2 SER 9 1HB SER 9 7.432 -0.414 -3.601
48 HB3 SER 9 2HB SER 9 8.983 0.419 -3.410
49 HG SER 9 HG SER 9 9.265 -1.823 -3.816
50 H TYR 10 H TYR 10 5.477 -0.179 -2.280
51 HA TYR 10 HA TYR 10 4.746 -2.038 -0.052
52 HB2 TYR 10 1HB TYR 10 3.091 0.209 -1.252
53 HB3 TYR 10 2HB TYR 10 2.638 -0.832 0.092
54 HD1 TYR 10 1HD TYR 10 3.614 -0.504 2.338
55 HD2 TYR 10 2HD TYR 10 4.800 1.976 -0.987
56 HE1 TYR 10 1HE TYR 10 4.823 1.024 3.898
57 HE2 TYR 10 2HE TYR 10 6.045 3.470 0.563
58 HH TYR 10 HH TYR 10 6.649 3.883 2.738
59 H SER 11 H SER 11 3.200 -3.644 -0.487
60 HA SER 11 HA SER 11 2.621 -4.168 -3.381
61 HB2 SER 11 1HB SER 11 3.593 -6.182 -1.331
62 HB3 SER 11 2HB SER 11 3.134 -6.523 -3.010
63 HG SER 11 HG SER 11 5.412 -6.270 -2.747
64 H CYS 12 H CYS 12 0.643 -4.897 -3.880
65 HA CYS 12 HA CYS 12 -1.498 -4.679 -2.103
66 HB2 CYS 12 1HB CYS 12 -1.685 -4.430 -4.494
67 HB3 CYS 12 2HB CYS 12 -1.277 -6.142 -4.737
68 HA PRO 13 HA PRO 13 -1.331 -8.698 -0.049
69 HB2 PRO 13 1HB PRO 13 -3.581 -8.529 1.496
70 HB3 PRO 13 2HB PRO 13 -2.107 -7.565 1.813
71 HG2 PRO 13 1HG PRO 13 -4.607 -6.701 0.323
72 HG3 PRO 13 2HG PRO 13 -3.748 -5.839 1.638
73 HD2 PRO 13 1HD PRO 13 -3.335 -5.271 -1.002
74 HD3 PRO 13 2HD PRO 13 -2.008 -5.185 0.194
75 H VAL 14 H VAL 14 -3.595 -7.805 -2.457
76 HA VAL 14 HA VAL 14 -4.847 -10.543 -2.459
77 HB VAL 14 HB VAL 14 -6.105 -7.909 -3.264
78 HG11 VAL 14 1HG1 VAL 14 -8.208 -9.250 -3.454
79 HG12 VAL 14 2HG1 VAL 14 -7.016 -9.697 -4.671
80 HG13 VAL 14 3HG1 VAL 14 -7.256 -10.734 -3.245
81 HG21 VAL 14 3HG2 VAL 14 -7.656 -8.406 -1.356
82 HG22 VAL 14 1HG2 VAL 14 -6.624 -9.777 -0.908
83 HG23 VAL 14 2HG2 VAL 14 -6.002 -8.115 -0.830
84 H CYS 15 H CYS 15 -3.498 -7.986 -4.571
85 HA CYS 15 HA CYS 15 -3.416 -9.999 -6.757
86 HB2 CYS 15 1HB CYS 15 -4.177 -8.551 -8.356
87 HB3 CYS 15 2HB CYS 15 -5.370 -8.569 -7.065
88 H GLU 16 H GLU 16 -1.458 -8.696 -4.891
89 HA GLU 16 HA GLU 16 0.772 -8.404 -4.765
90 HB2 GLU 16 1HB GLU 16 0.861 -9.831 -7.434
91 HB3 GLU 16 2HB GLU 16 2.154 -9.736 -6.254
92 HG2 GLU 16 1HG GLU 16 -0.498 -11.190 -5.908
93 HG3 GLU 16 2HG GLU 16 1.071 -11.916 -6.207
94 H LYS 17 H LYS 17 -0.711 -6.389 -6.831
95 HA LYS 17 HA LYS 17 1.414 -5.299 -8.403
96 HB2 LYS 17 1HB LYS 17 -1.200 -4.109 -7.412
97 HB3 LYS 17 2HB LYS 17 -0.115 -3.255 -8.521
98 HG2 LYS 17 1HG LYS 17 -0.328 -4.964 -10.214
99 HG3 LYS 17 2HG LYS 17 -1.159 -6.038 -9.094
100 HD2 LYS 17 1HD LYS 17 -3.015 -4.261 -8.945
101 HD3 LYS 17 2HD LYS 17 -2.206 -3.438 -10.282
102 HE2 LYS 17 1HE LYS 17 -4.019 -4.812 -11.136
103 HE3 LYS 17 2HE LYS 17 -2.476 -5.470 -11.693
104 HZ1 LYS 17 3HZ LYS 17 -4.056 -7.176 -10.816
105 HZ2 LYS 17 1HZ LYS 17 -3.938 -6.506 -9.314
106 HZ3 LYS 17 2HZ LYS 17 -2.633 -7.180 -10.003
107 H SER 18 H SER 18 2.659 -3.518 -8.237
108 HA SER 18 HA SER 18 3.589 -2.898 -5.503
109 HB2 SER 18 1HB SER 18 4.888 -2.298 -8.176
110 HB3 SER 18 2HB SER 18 5.615 -2.081 -6.573
111 HG SER 18 HG SER 18 6.229 -4.071 -7.563
112 H PHE 19 H PHE 19 3.717 -0.933 -4.591
113 HA PHE 19 HA PHE 19 2.863 1.519 -6.055
114 HB2 PHE 19 1HB PHE 19 1.794 0.523 -3.384
115 HB3 PHE 19 2HB PHE 19 1.495 2.119 -4.053
116 HD1 PHE 19 1HD PHE 19 0.721 -1.486 -4.373
117 HD2 PHE 19 2HD PHE 19 0.018 2.443 -6.008
118 HE1 PHE 19 1HE PHE 19 -1.181 -2.374 -5.690
119 HE2 PHE 19 2HE PHE 19 -1.879 1.547 -7.334
120 HZ PHE 19 HZ PHE 19 -2.467 -0.867 -7.194
121 H SER 20 H SER 20 3.719 3.441 -5.326
122 HA SER 20 HA SER 20 6.342 3.148 -4.110
123 HB2 SER 20 1HB SER 20 4.984 5.610 -5.255
124 HB3 SER 20 2HB SER 20 6.716 5.411 -4.919
125 HG SER 20 HG SER 20 6.215 5.024 -7.130
126 H GLU 21 H GLU 21 3.335 4.076 -2.739
127 HA GLU 21 HA GLU 21 4.668 5.336 -0.392
128 HB2 GLU 21 1HB GLU 21 2.310 6.559 -1.872
129 HB3 GLU 21 2HB GLU 21 2.974 7.107 -0.335
130 HG2 GLU 21 1HG GLU 21 5.095 7.710 -1.432
131 HG3 GLU 21 2HG GLU 21 4.474 7.131 -2.986
132 H ASP 22 H ASP 22 3.505 5.200 1.557
133 HA ASP 22 HA ASP 22 1.759 2.948 1.791
134 HB2 ASP 22 1HB ASP 22 1.883 3.255 4.080
135 HB3 ASP 22 2HB ASP 22 3.418 3.897 3.522
136 H ARG 23 H ARG 23 1.032 6.240 1.051
137 HA ARG 23 HA ARG 23 -1.831 6.008 1.755
138 HB2 ARG 23 1HB ARG 23 -2.085 8.198 0.724
139 HB3 ARG 23 2HB ARG 23 -0.832 8.178 1.962
140 HG2 ARG 23 1HG ARG 23 0.928 8.173 0.233
141 HG3 ARG 23 2HG ARG 23 -0.291 8.072 -1.044
142 HD2 ARG 23 1HD ARG 23 0.507 10.361 -0.855
143 HD3 ARG 23 2HD ARG 23 -1.190 10.261 -0.413
144 HE ARG 23 HE ARG 23 -0.693 10.867 1.770
145 HH11 ARG 23 2HH1 ARG 23 2.410 10.269 0.161
146 HH12 ARG 23 1HH1 ARG 23 3.287 10.957 1.504
147 HH21 ARG 23 2HH2 ARG 23 0.530 11.706 3.400
148 HH22 ARG 23 1HH2 ARG 23 2.263 11.740 3.266
149 H LEU 24 H LEU 24 0.166 5.462 -1.095
150 HA LEU 24 HA LEU 24 -2.079 5.299 -2.953
151 HB2 LEU 24 1HB LEU 24 0.815 4.367 -3.134
152 HB3 LEU 24 2HB LEU 24 -0.342 4.244 -4.452
153 HG LEU 24 HG LEU 24 0.498 6.881 -3.177
154 HD11 LEU 24 1HD1 LEU 24 2.371 5.774 -4.351
155 HD12 LEU 24 2HD1 LEU 24 1.819 7.207 -5.225
156 HD13 LEU 24 3HD1 LEU 24 1.358 5.589 -5.801
157 HD21 LEU 24 3HD2 LEU 24 -0.502 7.877 -5.218
158 HD22 LEU 24 1HD2 LEU 24 -1.708 7.060 -4.223
159 HD23 LEU 24 2HD2 LEU 24 -1.099 6.274 -5.700
160 H ILE 25 H ILE 25 -0.166 2.873 -1.095
161 HA ILE 25 HA ILE 25 -1.634 0.646 -2.093
162 HB ILE 25 HB ILE 25 0.589 0.620 -0.896
163 HG12 ILE 25 1HG1 ILE 25 0.166 -1.502 0.372
164 HG13 ILE 25 2HG1 ILE 25 -1.563 -1.315 0.053
165 HG21 ILE 25 1HG2 ILE 25 0.707 0.510 1.501
166 HG22 ILE 25 2HG2 ILE 25 -0.096 2.011 1.043
167 HG23 ILE 25 3HG2 ILE 25 -1.055 0.645 1.664
168 HD11 ILE 25 3HD1 ILE 25 -1.092 -1.411 -2.393
169 HD12 ILE 25 1HD1 ILE 25 0.655 -1.528 -2.027
170 HD13 ILE 25 2HD1 ILE 25 -0.460 -2.823 -1.541
171 H LYS 26 H LYS 26 -2.304 2.801 0.691
172 HA LYS 26 HA LYS 26 -4.646 1.413 1.635
173 HB2 LYS 26 1HB LYS 26 -3.755 4.319 1.833
174 HB3 LYS 26 2HB LYS 26 -5.248 3.723 2.566
175 HG2 LYS 26 1HG LYS 26 -4.047 2.145 3.960
176 HG3 LYS 26 2HG LYS 26 -2.520 2.518 3.161
177 HD2 LYS 26 1HD LYS 26 -2.764 4.928 3.987
178 HD3 LYS 26 2HD LYS 26 -4.207 4.407 4.868
179 HE2 LYS 26 1HE LYS 26 -2.465 4.343 6.476
180 HE3 LYS 26 2HE LYS 26 -2.758 2.661 6.020
181 HZ1 LYS 26 3HZ LYS 26 -0.850 3.063 4.360
182 HZ2 LYS 26 1HZ LYS 26 -0.426 2.944 5.952
183 HZ3 LYS 26 2HZ LYS 26 -0.480 4.394 5.207
184 H SER 27 H SER 27 -4.369 4.142 -0.720
185 HA SER 27 HA SER 27 -7.116 4.240 -1.405
186 HB2 SER 27 1HB SER 27 -4.659 4.808 -3.103
187 HB3 SER 27 2HB SER 27 -6.326 5.171 -3.593
188 HG SER 27 HG SER 27 -5.303 6.972 -2.590
189 H HIS 28 H HIS 28 -4.541 2.133 -2.854
190 HA HIS 28 HA HIS 28 -6.291 0.898 -4.742
191 HB2 HIS 28 1HB HIS 28 -3.851 0.780 -4.908
192 HB3 HIS 28 2HB HIS 28 -3.761 -0.165 -3.422
193 HD1 HIS 28 1HD HIS 28 -5.512 -0.566 -6.887
194 HD2 HIS 28 2HD HIS 28 -3.697 -2.739 -3.779
195 HE1 HIS 28 1HE HIS 28 -5.531 -2.985 -7.641
196 H ILE 29 H ILE 29 -5.398 -0.186 -1.420
197 HA ILE 29 HA ILE 29 -7.032 -2.532 -1.449
198 HB ILE 29 HB ILE 29 -6.022 -0.805 0.838
199 HG12 ILE 29 1HG1 ILE 29 -5.136 -3.565 -0.151
200 HG13 ILE 29 2HG1 ILE 29 -4.346 -2.067 -0.623
201 HG21 ILE 29 1HG2 ILE 29 -7.432 -3.510 0.941
202 HG22 ILE 29 2HG2 ILE 29 -6.606 -2.753 2.320
203 HG23 ILE 29 3HG2 ILE 29 -8.028 -1.989 1.640
204 HD11 ILE 29 3HD1 ILE 29 -3.043 -3.044 1.115
205 HD12 ILE 29 1HD1 ILE 29 -3.819 -1.592 1.773
206 HD13 ILE 29 2HD1 ILE 29 -4.438 -3.211 2.186
207 H LYS 30 H LYS 30 -7.855 0.839 -0.501
208 HA LYS 30 HA LYS 30 -10.538 0.169 0.366
209 HB2 LYS 30 1HB LYS 30 -9.179 2.785 -0.388
210 HB3 LYS 30 2HB LYS 30 -10.866 2.700 0.137
211 HG2 LYS 30 1HG LYS 30 -10.237 1.697 2.269
212 HG3 LYS 30 2HG LYS 30 -8.533 1.649 1.799
213 HD2 LYS 30 1HD LYS 30 -8.501 4.128 1.633
214 HD3 LYS 30 2HD LYS 30 -10.216 4.175 2.099
215 HE2 LYS 30 1HE LYS 30 -9.633 3.028 4.246
216 HE3 LYS 30 2HE LYS 30 -7.927 3.058 3.785
217 HZ1 LYS 30 3HZ LYS 30 -9.633 5.461 4.202
218 HZ2 LYS 30 1HZ LYS 30 -8.057 5.504 3.767
219 HZ3 LYS 30 2HZ LYS 30 -8.487 4.926 5.233
220 H THR 31 H THR 31 -9.308 1.159 -2.846
221 HA THR 31 HA THR 31 -12.000 1.422 -3.936
222 HB THR 31 HB THR 31 -10.740 1.711 -6.072
223 HG1 THR 31 1HG THR 31 -8.441 1.929 -4.499
224 HG21 THR 31 3HG2 THR 31 -11.374 3.678 -4.795
225 HG22 THR 31 1HG2 THR 31 -9.766 3.911 -5.502
226 HG23 THR 31 2HG2 THR 31 -9.933 3.531 -3.772
227 H ASN 32 H ASN 32 -9.451 -1.058 -4.069
228 HA ASN 32 HA ASN 32 -11.115 -2.653 -5.978
229 HB2 ASN 32 1HB ASN 32 -8.138 -2.624 -5.347
230 HB3 ASN 32 2HB ASN 32 -8.913 -3.867 -6.308
231 HD21 ASN 32 2HD2 ASN 32 -8.541 -0.240 -6.251
232 HD22 ASN 32 1HD2 ASN 32 -8.556 -0.152 -8.000
233 H HIS 33 H HIS 33 -9.834 -2.856 -2.680
234 HA HIS 33 HA HIS 33 -10.878 -5.641 -2.460
235 HB2 HIS 33 1HB HIS 33 -8.201 -4.760 -1.358
236 HB3 HIS 33 2HB HIS 33 -8.849 -6.393 -1.456
237 HD1 HIS 33 1HD HIS 33 -9.348 -6.963 -4.385
238 HD2 HIS 33 2HD HIS 33 -6.365 -4.331 -3.044
239 HE1 HIS 33 1HE HIS 33 -7.657 -6.823 -6.276
240 HA PRO 34 HA PRO 34 -11.486 -2.694 1.320
241 HB2 PRO 34 1HB PRO 34 -14.218 -2.296 1.331
242 HB3 PRO 34 2HB PRO 34 -13.049 -1.250 0.469
243 HG2 PRO 34 1HG PRO 34 -14.668 -3.562 -0.654
244 HG3 PRO 34 2HG PRO 34 -14.496 -1.903 -1.323
245 HD2 PRO 34 1HD PRO 34 -12.981 -3.926 -2.266
246 HD3 PRO 34 2HD PRO 34 -12.259 -2.309 -1.990
247 H GLU 35 H GLU 35 -13.101 -5.600 0.255
248 HA GLU 35 HA GLU 35 -14.147 -6.490 2.781
249 HB2 GLU 35 1HB GLU 35 -14.403 -8.631 1.677
250 HB3 GLU 35 2HB GLU 35 -14.929 -7.326 0.617
251 HG2 GLU 35 1HG GLU 35 -12.758 -7.460 -0.617
252 HG3 GLU 35 2HG GLU 35 -12.243 -8.774 0.439
253 H VAL 36 H VAL 36 -10.842 -6.295 1.747
254 HA VAL 36 HA VAL 36 -9.940 -8.605 3.296
255 HB VAL 36 HB VAL 36 -8.930 -7.589 1.125
256 HG11 VAL 36 1HG1 VAL 36 -8.488 -5.306 2.145
257 HG12 VAL 36 2HG1 VAL 36 -7.218 -6.060 3.123
258 HG13 VAL 36 3HG1 VAL 36 -7.101 -6.074 1.353
259 HG21 VAL 36 3HG2 VAL 36 -8.061 -9.566 2.258
260 HG22 VAL 36 1HG2 VAL 36 -6.749 -8.550 1.642
261 HG23 VAL 36 2HG2 VAL 36 -7.127 -8.544 3.375
262 H SER 37 H SER 37 -10.597 -5.328 4.065
263 HA SER 37 HA SER 37 -8.740 -4.922 6.236
264 HB2 SER 37 1HB SER 37 -11.359 -3.530 5.558
265 HB3 SER 37 2HB SER 37 -10.167 -2.958 6.738
266 HG SER 37 HG SER 37 -8.627 -2.813 5.043
Start of MODEL 3
1 H1 GLY 1 1H GLY 1 26.499 -7.905 -9.928
2 H2 GLY 1 2H GLY 1 26.031 -8.743 -8.600
3 H3 GLY 1 3H GLY 1 27.090 -7.503 -8.453
4 HA2 GLY 1 1HA GLY 1 25.420 -5.909 -9.148
5 HA3 GLY 1 2HA GLY 1 24.274 -7.254 -9.286
6 H SER 2 H SER 2 22.887 -6.240 -7.746
7 HA SER 2 HA SER 2 23.756 -5.719 -5.009
8 HB2 SER 2 1HB SER 2 21.366 -5.213 -4.641
9 HB3 SER 2 2HB SER 2 22.055 -4.328 -6.011
10 HG SER 2 HG SER 2 19.986 -5.269 -6.470
11 H SER 3 H SER 3 22.720 -6.694 -3.124
12 HA SER 3 HA SER 3 22.965 -9.549 -3.114
13 HB2 SER 3 1HB SER 3 21.855 -7.718 -0.957
14 HB3 SER 3 2HB SER 3 22.459 -9.370 -0.739
15 HG SER 3 HG SER 3 24.044 -7.795 -0.204
16 H GLY 4 H GLY 4 20.182 -7.594 -3.753
17 HA2 GLY 4 1HA GLY 4 18.456 -9.691 -4.410
18 HA3 GLY 4 2HA GLY 4 18.101 -9.297 -2.727
19 H SER 5 H SER 5 16.069 -9.004 -4.325
20 HA SER 5 HA SER 5 15.870 -6.376 -5.573
21 HB2 SER 5 1HB SER 5 13.753 -8.521 -5.236
22 HB3 SER 5 2HB SER 5 13.687 -7.123 -6.326
23 HG SER 5 HG SER 5 14.369 -9.034 -7.405
24 H SER 6 H SER 6 16.161 -6.418 -2.586
25 HA SER 6 HA SER 6 13.613 -5.698 -1.412
26 HB2 SER 6 1HB SER 6 15.005 -5.142 0.577
27 HB3 SER 6 2HB SER 6 15.242 -6.781 -0.045
28 HG SER 6 HG SER 6 17.231 -5.719 0.447
29 H GLY 7 H GLY 7 13.098 -3.695 -0.380
30 HA2 GLY 7 1HA GLY 7 14.381 -1.201 -0.761
31 HA3 GLY 7 2HA GLY 7 13.229 -1.420 -2.082
32 H ARG 8 H ARG 8 12.583 0.650 -0.777
33 HA ARG 8 HA ARG 8 10.907 0.154 1.608
34 HB2 ARG 8 1HB ARG 8 11.600 2.711 0.107
35 HB3 ARG 8 2HB ARG 8 10.626 2.632 1.580
36 HG2 ARG 8 1HG ARG 8 12.534 1.577 2.790
37 HG3 ARG 8 2HG ARG 8 13.536 1.752 1.338
38 HD2 ARG 8 1HD ARG 8 13.215 4.201 1.397
39 HD3 ARG 8 2HD ARG 8 12.210 4.057 2.837
40 HE ARG 8 HE ARG 8 15.138 3.831 2.649
41 HH11 ARG 8 2HH1 ARG 8 12.407 3.216 4.765
42 HH12 ARG 8 1HH1 ARG 8 13.413 3.163 6.187
43 HH21 ARG 8 2HH2 ARG 8 16.350 3.749 4.502
44 HH22 ARG 8 1HH2 ARG 8 15.583 3.456 6.035
45 H SER 9 H SER 9 10.264 -0.071 -1.667
46 HA SER 9 HA SER 9 7.663 1.086 -1.866
47 HB2 SER 9 1HB SER 9 8.809 -1.254 -3.428
48 HB3 SER 9 2HB SER 9 7.440 -0.230 -3.902
49 HG SER 9 HG SER 9 9.414 0.424 -4.899
50 H TYR 10 H TYR 10 5.641 0.016 -2.179
51 HA TYR 10 HA TYR 10 5.129 -2.189 -0.232
52 HB2 TYR 10 1HB TYR 10 3.278 -0.013 -1.277
53 HB3 TYR 10 2HB TYR 10 2.892 -1.216 -0.058
54 HD1 TYR 10 2HD TYR 10 4.901 1.832 -0.772
55 HD2 TYR 10 1HD TYR 10 3.605 -0.959 2.251
56 HE1 TYR 10 2HE TYR 10 5.858 3.303 0.990
57 HE2 TYR 10 1HE TYR 10 4.508 0.550 4.020
58 HH TYR 10 HH TYR 10 6.199 3.612 3.238
59 H SER 11 H SER 11 3.512 -3.804 -0.806
60 HA SER 11 HA SER 11 2.548 -3.797 -3.580
61 HB2 SER 11 1HB SER 11 3.103 -6.146 -3.989
62 HB3 SER 11 2HB SER 11 4.533 -5.117 -3.847
63 HG SER 11 HG SER 11 4.857 -5.895 -1.751
64 H CYS 12 H CYS 12 0.631 -4.738 -3.955
65 HA CYS 12 HA CYS 12 -1.265 -4.671 -1.959
66 HB2 CYS 12 1HB CYS 12 -1.726 -4.337 -4.288
67 HB3 CYS 12 2HB CYS 12 -1.303 -6.016 -4.662
68 HA PRO 13 HA PRO 13 -0.837 -8.760 -0.074
69 HB2 PRO 13 1HB PRO 13 -2.892 -8.667 1.725
70 HB3 PRO 13 2HB PRO 13 -1.392 -7.710 1.909
71 HG2 PRO 13 1HG PRO 13 -4.049 -6.798 0.766
72 HG3 PRO 13 2HG PRO 13 -3.037 -5.982 1.995
73 HD2 PRO 13 1HD PRO 13 -2.948 -5.316 -0.654
74 HD3 PRO 13 2HD PRO 13 -1.492 -5.258 0.382
75 H VAL 14 H VAL 14 -3.377 -7.757 -2.143
76 HA VAL 14 HA VAL 14 -4.675 -10.464 -2.102
77 HB VAL 14 HB VAL 14 -5.869 -7.864 -3.087
78 HG11 VAL 14 1HG1 VAL 14 -8.013 -9.125 -2.942
79 HG12 VAL 14 2HG1 VAL 14 -6.914 -9.831 -4.125
80 HG13 VAL 14 3HG1 VAL 14 -7.107 -10.594 -2.530
81 HG21 VAL 14 3HG2 VAL 14 -7.297 -7.994 -1.036
82 HG22 VAL 14 1HG2 VAL 14 -6.255 -9.300 -0.429
83 HG23 VAL 14 2HG2 VAL 14 -5.608 -7.662 -0.681
84 H CYS 15 H CYS 15 -3.293 -7.996 -4.295
85 HA CYS 15 HA CYS 15 -3.258 -10.045 -6.448
86 HB2 CYS 15 1HB CYS 15 -4.135 -8.630 -8.043
87 HB3 CYS 15 2HB CYS 15 -5.276 -8.675 -6.702
88 H GLU 16 H GLU 16 -1.281 -8.502 -4.695
89 HA GLU 16 HA GLU 16 0.920 -8.045 -4.692
90 HB2 GLU 16 1HB GLU 16 0.951 -9.787 -7.168
91 HB3 GLU 16 2HB GLU 16 2.336 -9.401 -6.146
92 HG2 GLU 16 1HG GLU 16 1.194 -10.458 -4.198
93 HG3 GLU 16 2HG GLU 16 -0.135 -10.943 -5.255
94 H LYS 17 H LYS 17 -0.762 -6.287 -6.803
95 HA LYS 17 HA LYS 17 1.233 -5.080 -8.474
96 HB2 LYS 17 1HB LYS 17 -1.381 -4.019 -7.337
97 HB3 LYS 17 2HB LYS 17 -0.394 -3.108 -8.491
98 HG2 LYS 17 1HG LYS 17 -0.632 -4.775 -10.203
99 HG3 LYS 17 2HG LYS 17 -1.285 -5.941 -9.060
100 HD2 LYS 17 1HD LYS 17 -3.262 -4.298 -8.729
101 HD3 LYS 17 2HD LYS 17 -2.625 -3.421 -10.121
102 HE2 LYS 17 1HE LYS 17 -4.391 -4.921 -10.843
103 HE3 LYS 17 2HE LYS 17 -2.853 -5.478 -11.513
104 HZ1 LYS 17 3HZ LYS 17 -2.773 -7.187 -9.820
105 HZ2 LYS 17 1HZ LYS 17 -4.256 -7.275 -10.512
106 HZ3 LYS 17 2HZ LYS 17 -4.056 -6.593 -9.025
107 H SER 18 H SER 18 2.507 -3.320 -8.275
108 HA SER 18 HA SER 18 3.405 -2.780 -5.521
109 HB2 SER 18 1HB SER 18 5.475 -1.952 -6.587
110 HB3 SER 18 2HB SER 18 5.078 -3.639 -6.955
111 HG SER 18 HG SER 18 5.722 -2.473 -8.831
112 H PHE 19 H PHE 19 3.840 -0.826 -4.622
113 HA PHE 19 HA PHE 19 2.869 1.674 -5.919
114 HB2 PHE 19 1HB PHE 19 1.982 0.634 -3.200
115 HB3 PHE 19 2HB PHE 19 1.605 2.219 -3.854
116 HD1 PHE 19 2HD PHE 19 0.140 2.428 -5.904
117 HD2 PHE 19 1HD PHE 19 0.717 -1.330 -3.865
118 HE1 PHE 19 2HE PHE 19 -1.796 1.466 -7.126
119 HE2 PHE 19 1HE PHE 19 -1.210 -2.287 -5.097
120 HZ PHE 19 HZ PHE 19 -2.448 -0.904 -6.751
121 H SER 20 H SER 20 3.895 3.531 -5.256
122 HA SER 20 HA SER 20 6.484 3.191 -4.019
123 HB2 SER 20 1HB SER 20 5.082 5.739 -4.900
124 HB3 SER 20 2HB SER 20 6.816 5.533 -4.589
125 HG SER 20 HG SER 20 6.317 5.378 -6.827
126 H GLU 21 H GLU 21 3.419 4.119 -2.671
127 HA GLU 21 HA GLU 21 4.681 5.098 -0.158
128 HB2 GLU 21 1HB GLU 21 2.563 6.599 -1.743
129 HB3 GLU 21 2HB GLU 21 3.081 6.990 -0.105
130 HG2 GLU 21 1HG GLU 21 5.364 7.469 -0.912
131 HG3 GLU 21 2HG GLU 21 4.883 7.052 -2.563
132 H ASP 22 H ASP 22 3.391 4.942 1.692
133 HA ASP 22 HA ASP 22 1.686 2.710 1.889
134 HB2 ASP 22 1HB ASP 22 3.030 3.648 3.717
135 HB3 ASP 22 2HB ASP 22 2.030 5.100 3.736
136 H ARG 23 H ARG 23 0.837 6.147 1.494
137 HA ARG 23 HA ARG 23 -2.021 5.795 1.790
138 HB2 ARG 23 1HB ARG 23 -2.211 8.039 0.817
139 HB3 ARG 23 2HB ARG 23 -1.056 7.958 2.145
140 HG2 ARG 23 1HG ARG 23 0.830 7.970 0.554
141 HG3 ARG 23 2HG ARG 23 -0.299 7.994 -0.815
142 HD2 ARG 23 1HD ARG 23 -1.153 10.162 -0.156
143 HD3 ARG 23 2HD ARG 23 -0.206 10.135 1.347
144 HE ARG 23 HE ARG 23 1.793 9.879 -0.437
145 HH11 ARG 23 2HH1 ARG 23 -0.792 12.266 -0.489
146 HH12 ARG 23 1HH1 ARG 23 0.205 13.397 -1.364
147 HH21 ARG 23 2HH2 ARG 23 2.905 11.224 -1.480
148 HH22 ARG 23 1HH2 ARG 23 2.315 12.826 -1.934
149 H LEU 24 H LEU 24 0.104 5.300 -0.971
150 HA LEU 24 HA LEU 24 -2.068 5.329 -2.937
151 HB2 LEU 24 1HB LEU 24 0.806 4.344 -3.102
152 HB3 LEU 24 2HB LEU 24 -0.311 4.395 -4.459
153 HG LEU 24 HG LEU 24 0.603 6.848 -2.895
154 HD11 LEU 24 1HD1 LEU 24 2.441 5.788 -4.167
155 HD12 LEU 24 2HD1 LEU 24 1.969 7.337 -4.877
156 HD13 LEU 24 3HD1 LEU 24 1.445 5.818 -5.639
157 HD21 LEU 24 3HD2 LEU 24 -1.578 7.238 -3.939
158 HD22 LEU 24 1HD2 LEU 24 -0.981 6.590 -5.485
159 HD23 LEU 24 2HD2 LEU 24 -0.323 8.104 -4.826
160 H ILE 25 H ILE 25 -0.206 2.737 -1.258
161 HA ILE 25 HA ILE 25 -1.827 0.642 -2.419
162 HB ILE 25 HB ILE 25 0.381 0.164 -1.558
163 HG12 ILE 25 1HG1 ILE 25 -1.781 -1.382 -0.068
164 HG13 ILE 25 2HG1 ILE 25 -1.393 -1.584 -1.779
165 HG21 ILE 25 1HG2 ILE 25 -0.760 0.543 1.242
166 HG22 ILE 25 2HG2 ILE 25 0.883 0.016 0.828
167 HG23 ILE 25 3HG2 ILE 25 0.382 1.643 0.421
168 HD11 ILE 25 3HD1 ILE 25 0.903 -2.289 -1.172
169 HD12 ILE 25 1HD1 ILE 25 0.484 -2.154 0.557
170 HD13 ILE 25 2HD1 ILE 25 -0.351 -3.326 -0.454
171 H LYS 26 H LYS 26 -2.205 2.546 0.641
172 HA LYS 26 HA LYS 26 -4.565 1.160 1.511
173 HB2 LYS 26 1HB LYS 26 -3.516 3.969 1.974
174 HB3 LYS 26 2HB LYS 26 -5.110 3.481 2.561
175 HG2 LYS 26 1HG LYS 26 -4.147 1.604 3.810
176 HG3 LYS 26 2HG LYS 26 -2.520 2.031 3.251
177 HD2 LYS 26 1HD LYS 26 -2.624 4.175 4.435
178 HD3 LYS 26 2HD LYS 26 -4.331 3.923 4.817
179 HE2 LYS 26 1HE LYS 26 -3.081 3.466 6.800
180 HE3 LYS 26 2HE LYS 26 -3.748 1.943 6.202
181 HZ1 LYS 26 3HZ LYS 26 -1.544 1.438 5.271
182 HZ2 LYS 26 1HZ LYS 26 -1.397 1.749 6.869
183 HZ3 LYS 26 2HZ LYS 26 -0.953 2.873 5.762
184 H SER 27 H SER 27 -4.341 3.999 -0.722
185 HA SER 27 HA SER 27 -7.153 4.097 -1.238
186 HB2 SER 27 1HB SER 27 -4.771 4.951 -2.905
187 HB3 SER 27 2HB SER 27 -6.460 5.218 -3.392
188 HG SER 27 HG SER 27 -5.564 6.998 -2.200
189 H HIS 28 H HIS 28 -4.619 2.089 -2.841
190 HA HIS 28 HA HIS 28 -6.399 0.898 -4.743
191 HB2 HIS 28 1HB HIS 28 -3.994 0.739 -4.967
192 HB3 HIS 28 2HB HIS 28 -3.851 -0.131 -3.447
193 HD1 HIS 28 1HD HIS 28 -5.601 -0.744 -6.873
194 HD2 HIS 28 2HD HIS 28 -3.808 -2.706 -3.616
195 HE1 HIS 28 1HE HIS 28 -5.579 -3.206 -7.481
196 H ILE 29 H ILE 29 -5.494 -0.198 -1.436
197 HA ILE 29 HA ILE 29 -7.179 -2.508 -1.416
198 HB ILE 29 HB ILE 29 -6.103 -0.776 0.836
199 HG12 ILE 29 1HG1 ILE 29 -5.284 -3.550 -0.171
200 HG13 ILE 29 2HG1 ILE 29 -4.454 -2.061 -0.600
201 HG21 ILE 29 1HG2 ILE 29 -8.135 -1.921 1.665
202 HG22 ILE 29 2HG2 ILE 29 -7.526 -3.475 1.052
203 HG23 ILE 29 3HG2 ILE 29 -6.705 -2.629 2.381
204 HD11 ILE 29 3HD1 ILE 29 -4.585 -3.285 2.171
205 HD12 ILE 29 1HD1 ILE 29 -3.184 -3.115 1.109
206 HD13 ILE 29 2HD1 ILE 29 -3.929 -1.666 1.813
207 H LYS 30 H LYS 30 -7.933 0.887 -0.494
208 HA LYS 30 HA LYS 30 -10.637 0.332 0.358
209 HB2 LYS 30 1HB LYS 30 -9.232 2.861 -0.569
210 HB3 LYS 30 2HB LYS 30 -10.924 2.847 -0.059
211 HG2 LYS 30 1HG LYS 30 -10.315 1.948 2.145
212 HG3 LYS 30 2HG LYS 30 -8.609 1.945 1.713
213 HD2 LYS 30 1HD LYS 30 -10.403 4.407 1.892
214 HD3 LYS 30 2HD LYS 30 -9.225 3.886 3.106
215 HE2 LYS 30 1HE LYS 30 -7.395 4.146 1.429
216 HE3 LYS 30 2HE LYS 30 -8.577 4.722 0.245
217 HZ1 LYS 30 3HZ LYS 30 -7.963 6.074 2.817
218 HZ2 LYS 30 1HZ LYS 30 -9.063 6.591 1.727
219 HZ3 LYS 30 2HZ LYS 30 -7.480 6.577 1.338
220 H THR 31 H THR 31 -9.365 1.119 -2.896
221 HA THR 31 HA THR 31 -12.058 1.368 -4.008
222 HB THR 31 HB THR 31 -10.767 1.630 -6.139
223 HG1 THR 31 1HG THR 31 -8.503 1.941 -4.537
224 HG21 THR 31 3HG2 THR 31 -9.849 3.858 -5.591
225 HG22 THR 31 1HG2 THR 31 -10.026 3.503 -3.857
226 HG23 THR 31 2HG2 THR 31 -11.460 3.608 -4.897
227 H ASN 32 H ASN 32 -9.508 -1.106 -4.054
228 HA ASN 32 HA ASN 32 -11.130 -2.754 -5.952
229 HB2 ASN 32 1HB ASN 32 -8.167 -2.723 -5.250
230 HB3 ASN 32 2HB ASN 32 -8.927 -3.969 -6.218
231 HD21 ASN 32 1HD2 ASN 32 -8.529 -0.347 -6.185
232 HD22 ASN 32 2HD2 ASN 32 -8.501 -0.272 -7.935
233 H HIS 33 H HIS 33 -9.936 -2.835 -2.625
234 HA HIS 33 HA HIS 33 -10.953 -5.622 -2.329
235 HB2 HIS 33 1HB HIS 33 -8.355 -4.609 -1.149
236 HB3 HIS 33 2HB HIS 33 -8.964 -6.259 -1.165
237 HD1 HIS 33 1HD HIS 33 -9.414 -6.924 -4.123
238 HD2 HIS 33 2HD HIS 33 -6.363 -4.401 -2.724
239 HE1 HIS 33 1HE HIS 33 -7.632 -6.936 -5.931
240 HA PRO 34 HA PRO 34 -11.898 -2.494 1.201
241 HB2 PRO 34 1HB PRO 34 -14.606 -2.083 0.974
242 HB3 PRO 34 2HB PRO 34 -13.373 -1.132 0.093
243 HG2 PRO 34 1HG PRO 34 -14.931 -3.543 -0.909
244 HG3 PRO 34 2HG PRO 34 -14.719 -1.950 -1.715
245 HD2 PRO 34 1HD PRO 34 -13.136 -4.036 -2.368
246 HD3 PRO 34 2HD PRO 34 -12.449 -2.389 -2.197
247 H GLU 35 H GLU 35 -13.556 -5.451 0.225
248 HA GLU 35 HA GLU 35 -14.470 -6.028 2.978
249 HB2 GLU 35 1HB GLU 35 -15.620 -7.909 2.029
250 HB3 GLU 35 2HB GLU 35 -15.977 -6.449 1.112
251 HG2 GLU 35 1HG GLU 35 -14.319 -7.160 -0.631
252 HG3 GLU 35 2HG GLU 35 -14.022 -8.640 0.282
253 H VAL 36 H VAL 36 -11.523 -6.181 1.663
254 HA VAL 36 HA VAL 36 -10.766 -8.830 2.819
255 HB VAL 36 HB VAL 36 -9.108 -7.565 0.675
256 HG11 VAL 36 1HG1 VAL 36 -9.957 -10.441 1.244
257 HG12 VAL 36 2HG1 VAL 36 -8.798 -9.927 0.002
258 HG13 VAL 36 3HG1 VAL 36 -8.407 -9.709 1.706
259 HG21 VAL 36 3HG2 VAL 36 -11.339 -7.359 -0.366
260 HG22 VAL 36 1HG2 VAL 36 -10.403 -8.637 -1.134
261 HG23 VAL 36 2HG2 VAL 36 -11.681 -9.060 0.024
262 H SER 37 H SER 37 -10.503 -5.635 3.538
263 HA SER 37 HA SER 37 -7.694 -5.385 4.216
264 HB2 SER 37 1HB SER 37 -8.402 -3.277 5.290
265 HB3 SER 37 2HB SER 37 -8.935 -3.427 3.606
266 HG SER 37 HG SER 37 -10.635 -2.687 5.013
Start of MODEL 4
1 H1 GLY 1 1H GLY 1 8.235 -3.018 -11.421
2 H2 GLY 1 2H GLY 1 9.495 -2.498 -10.512
3 H3 GLY 1 3H GLY 1 8.092 -1.652 -10.525
4 HA2 GLY 1 1HA GLY 1 6.910 -3.472 -9.470
5 HA3 GLY 1 2HA GLY 1 8.435 -4.373 -9.439
6 H SER 2 H SER 2 9.045 -4.464 -7.343
7 HA SER 2 HA SER 2 8.597 -2.326 -5.419
8 HB2 SER 2 1HB SER 2 9.742 -3.868 -3.876
9 HB3 SER 2 2HB SER 2 8.440 -4.662 -4.771
10 HG SER 2 HG SER 2 10.327 -5.950 -4.741
11 H SER 3 H SER 3 10.422 -1.578 -3.990
12 HA SER 3 HA SER 3 12.590 -0.381 -5.568
13 HB2 SER 3 1HB SER 3 11.964 -0.198 -2.603
14 HB3 SER 3 2HB SER 3 13.097 0.821 -3.499
15 HG SER 3 HG SER 3 10.776 1.531 -3.075
16 H GLY 4 H GLY 4 12.230 -3.311 -3.847
17 HA2 GLY 4 1HA GLY 4 13.712 -4.984 -3.259
18 HA3 GLY 4 2HA GLY 4 14.895 -4.186 -4.293
19 H SER 5 H SER 5 16.684 -4.432 -2.983
20 HA SER 5 HA SER 5 16.773 -3.824 -0.171
21 HB2 SER 5 1HB SER 5 19.050 -3.978 -2.182
22 HB3 SER 5 2HB SER 5 19.188 -4.078 -0.415
23 HG SER 5 HG SER 5 19.175 -6.154 -1.403
24 H SER 6 H SER 6 16.695 -1.674 -2.848
25 HA SER 6 HA SER 6 18.517 0.326 -1.793
26 HB2 SER 6 1HB SER 6 16.569 0.488 -4.116
27 HB3 SER 6 2HB SER 6 17.901 1.605 -3.774
28 HG SER 6 HG SER 6 18.477 0.006 -5.328
29 H GLY 7 H GLY 7 15.213 -0.277 -1.055
30 HA2 GLY 7 1HA GLY 7 14.974 1.858 0.756
31 HA3 GLY 7 2HA GLY 7 14.267 2.429 -0.755
32 H ARG 8 H ARG 8 12.492 2.578 0.953
33 HA ARG 8 HA ARG 8 10.988 0.299 1.805
34 HB2 ARG 8 1HB ARG 8 10.763 2.499 2.842
35 HB3 ARG 8 2HB ARG 8 10.239 3.210 1.320
36 HG2 ARG 8 1HG ARG 8 8.353 2.979 2.777
37 HG3 ARG 8 2HG ARG 8 8.145 1.927 1.389
38 HD2 ARG 8 1HD ARG 8 7.373 0.749 3.334
39 HD3 ARG 8 2HD ARG 8 8.847 -0.029 2.794
40 HE ARG 8 HE ARG 8 9.942 0.629 4.740
41 HH11 ARG 8 2HH1 ARG 8 6.871 2.373 4.676
42 HH12 ARG 8 1HH1 ARG 8 7.009 2.797 6.359
43 HH21 ARG 8 2HH2 ARG 8 10.035 1.258 6.853
44 HH22 ARG 8 1HH2 ARG 8 8.750 2.204 7.542
45 H SER 9 H SER 9 9.431 -0.879 0.921
46 HA SER 9 HA SER 9 8.352 -0.251 -1.802
47 HB2 SER 9 1HB SER 9 9.025 -3.011 -0.702
48 HB3 SER 9 2HB SER 9 8.327 -2.639 -2.285
49 HG SER 9 HG SER 9 10.916 -2.001 -1.308
50 H TYR 10 H TYR 10 6.210 -0.870 -2.193
51 HA TYR 10 HA TYR 10 4.666 -2.194 -0.022
52 HB2 TYR 10 1HB TYR 10 3.660 0.170 -1.639
53 HB3 TYR 10 2HB TYR 10 2.767 -0.728 -0.428
54 HD1 TYR 10 1HD TYR 10 3.419 -0.536 2.014
55 HD2 TYR 10 2HD TYR 10 5.170 1.939 -1.056
56 HE1 TYR 10 1HE TYR 10 4.247 1.049 3.755
57 HE2 TYR 10 2HE TYR 10 5.994 3.517 0.682
58 HH TYR 10 HH TYR 10 6.062 4.020 2.919
59 H SER 11 H SER 11 3.340 -3.817 -0.790
60 HA SER 11 HA SER 11 2.484 -3.760 -3.595
61 HB2 SER 11 1HB SER 11 3.055 -6.118 -3.999
62 HB3 SER 11 2HB SER 11 4.473 -5.080 -3.801
63 HG SER 11 HG SER 11 4.680 -7.039 -2.625
64 H CYS 12 H CYS 12 0.545 -4.653 -4.013
65 HA CYS 12 HA CYS 12 -1.358 -4.572 -2.035
66 HB2 CYS 12 1HB CYS 12 -1.807 -4.211 -4.356
67 HB3 CYS 12 2HB CYS 12 -1.411 -5.894 -4.747
68 HA PRO 13 HA PRO 13 -1.070 -8.641 -0.109
69 HB2 PRO 13 1HB PRO 13 -3.257 -8.553 1.536
70 HB3 PRO 13 2HB PRO 13 -1.772 -7.599 1.827
71 HG2 PRO 13 1HG PRO 13 -4.335 -6.683 0.480
72 HG3 PRO 13 2HG PRO 13 -3.423 -5.871 1.790
73 HD2 PRO 13 1HD PRO 13 -3.114 -5.180 -0.824
74 HD3 PRO 13 2HD PRO 13 -1.728 -5.175 0.306
75 H VAL 14 H VAL 14 -3.532 -7.683 -2.317
76 HA VAL 14 HA VAL 14 -4.730 -10.441 -2.356
77 HB VAL 14 HB VAL 14 -5.980 -7.831 -3.241
78 HG11 VAL 14 1HG1 VAL 14 -6.898 -9.696 -4.541
79 HG12 VAL 14 2HG1 VAL 14 -7.133 -10.648 -3.057
80 HG13 VAL 14 3HG1 VAL 14 -8.084 -9.176 -3.346
81 HG21 VAL 14 3HG2 VAL 14 -5.852 -7.903 -0.803
82 HG22 VAL 14 1HG2 VAL 14 -7.512 -8.215 -1.302
83 HG23 VAL 14 2HG2 VAL 14 -6.482 -9.566 -0.785
84 H CYS 15 H CYS 15 -3.370 -7.898 -4.479
85 HA CYS 15 HA CYS 15 -3.267 -9.927 -6.661
86 HB2 CYS 15 1HB CYS 15 -3.931 -8.379 -8.285
87 HB3 CYS 15 2HB CYS 15 -5.187 -8.499 -7.054
88 H GLU 16 H GLU 16 -1.329 -8.314 -4.756
89 HA GLU 16 HA GLU 16 0.861 -7.810 -4.680
90 HB2 GLU 16 1HB GLU 16 1.091 -9.697 -7.037
91 HB3 GLU 16 2HB GLU 16 2.399 -9.186 -5.969
92 HG2 GLU 16 1HG GLU 16 1.202 -10.179 -4.024
93 HG3 GLU 16 2HG GLU 16 -0.051 -10.780 -5.114
94 H LYS 17 H LYS 17 -0.824 -6.192 -6.807
95 HA LYS 17 HA LYS 17 1.008 -4.919 -8.558
96 HB2 LYS 17 1HB LYS 17 -1.452 -4.629 -8.585
97 HB3 LYS 17 2HB LYS 17 -1.376 -3.738 -7.061
98 HG2 LYS 17 1HG LYS 17 -0.094 -1.942 -8.111
99 HG3 LYS 17 2HG LYS 17 0.040 -2.869 -9.619
100 HD2 LYS 17 1HD LYS 17 -2.378 -2.717 -9.987
101 HD3 LYS 17 2HD LYS 17 -2.611 -1.998 -8.394
102 HE2 LYS 17 1HE LYS 17 -2.747 -0.223 -9.986
103 HE3 LYS 17 2HE LYS 17 -1.243 -0.024 -9.083
104 HZ1 LYS 17 3HZ LYS 17 -0.930 0.286 -11.483
105 HZ2 LYS 17 1HZ LYS 17 -1.455 -1.223 -11.801
106 HZ3 LYS 17 2HZ LYS 17 -0.057 -0.994 -10.982
107 H SER 18 H SER 18 2.576 -3.418 -8.321
108 HA SER 18 HA SER 18 3.583 -2.887 -5.607
109 HB2 SER 18 1HB SER 18 4.748 -2.229 -8.329
110 HB3 SER 18 2HB SER 18 5.543 -1.941 -6.773
111 HG SER 18 HG SER 18 4.658 -4.499 -7.687
112 H PHE 19 H PHE 19 3.926 -0.936 -4.652
113 HA PHE 19 HA PHE 19 3.044 1.584 -5.962
114 HB2 PHE 19 1HB PHE 19 2.118 0.580 -3.245
115 HB3 PHE 19 2HB PHE 19 1.855 2.205 -3.857
116 HD1 PHE 19 2HD PHE 19 0.400 2.576 -5.878
117 HD2 PHE 19 1HD PHE 19 0.717 -1.276 -3.965
118 HE1 PHE 19 2HE PHE 19 -1.688 1.843 -7.006
119 HE2 PHE 19 1HE PHE 19 -1.342 -2.022 -5.134
120 HZ PHE 19 HZ PHE 19 -2.553 -0.456 -6.641
121 H SER 20 H SER 20 3.970 3.479 -5.119
122 HA SER 20 HA SER 20 6.594 3.086 -3.824
123 HB2 SER 20 1HB SER 20 7.017 5.379 -4.693
124 HB3 SER 20 2HB SER 20 6.595 4.194 -5.942
125 HG SER 20 HG SER 20 5.451 6.175 -6.202
126 H GLU 21 H GLU 21 3.505 4.126 -2.798
127 HA GLU 21 HA GLU 21 4.631 5.369 -0.341
128 HB2 GLU 21 1HB GLU 21 2.347 6.570 -1.937
129 HB3 GLU 21 2HB GLU 21 2.993 7.164 -0.410
130 HG2 GLU 21 1HG GLU 21 5.165 7.655 -1.540
131 HG3 GLU 21 2HG GLU 21 4.445 7.179 -3.087
132 H ASP 22 H ASP 22 3.270 5.216 1.503
133 HA ASP 22 HA ASP 22 1.604 2.915 1.631
134 HB2 ASP 22 1HB ASP 22 1.269 3.424 3.888
135 HB3 ASP 22 2HB ASP 22 2.916 3.915 3.524
136 H ARG 23 H ARG 23 0.774 6.369 1.263
137 HA ARG 23 HA ARG 23 -2.068 6.056 1.498
138 HB2 ARG 23 1HB ARG 23 -2.231 8.272 0.486
139 HB3 ARG 23 2HB ARG 23 -1.029 8.208 1.772
140 HG2 ARG 23 1HG ARG 23 0.792 8.113 0.085
141 HG3 ARG 23 2HG ARG 23 -0.408 8.183 -1.221
142 HD2 ARG 23 1HD ARG 23 -1.137 10.393 -0.506
143 HD3 ARG 23 2HD ARG 23 -0.117 10.299 0.945
144 HE ARG 23 HE ARG 23 1.445 9.966 -1.484
145 HH11 ARG 23 2HH1 ARG 23 -0.098 12.561 0.302
146 HH12 ARG 23 1HH1 ARG 23 1.144 13.704 -0.137
147 HH21 ARG 23 2HH2 ARG 23 3.072 11.355 -1.785
148 HH22 ARG 23 1HH2 ARG 23 2.880 13.049 -1.366
149 H LEU 24 H LEU 24 0.025 5.389 -1.227
150 HA LEU 24 HA LEU 24 -2.161 5.346 -3.181
151 HB2 LEU 24 1HB LEU 24 0.711 4.359 -3.330
152 HB3 LEU 24 2HB LEU 24 -0.426 4.361 -4.675
153 HG LEU 24 HG LEU 24 0.497 6.874 -3.223
154 HD11 LEU 24 1HD1 LEU 24 1.331 5.726 -5.922
155 HD12 LEU 24 2HD1 LEU 24 2.335 5.769 -4.455
156 HD13 LEU 24 3HD1 LEU 24 1.852 7.281 -5.230
157 HD21 LEU 24 3HD2 LEU 24 -0.443 8.042 -5.198
158 HD22 LEU 24 1HD2 LEU 24 -1.691 7.208 -4.271
159 HD23 LEU 24 2HD2 LEU 24 -1.098 6.500 -5.793
160 H ILE 25 H ILE 25 -0.271 2.813 -1.424
161 HA ILE 25 HA ILE 25 -1.915 0.693 -2.506
162 HB ILE 25 HB ILE 25 0.324 0.241 -1.693
163 HG12 ILE 25 1HG1 ILE 25 -1.799 -1.296 -0.136
164 HG13 ILE 25 2HG1 ILE 25 -1.457 -1.513 -1.856
165 HG21 ILE 25 1HG2 ILE 25 -0.766 0.657 1.124
166 HG22 ILE 25 2HG2 ILE 25 0.864 0.115 0.696
167 HG23 ILE 25 3HG2 ILE 25 0.366 1.737 0.266
168 HD11 ILE 25 3HD1 ILE 25 0.487 -2.061 0.428
169 HD12 ILE 25 1HD1 ILE 25 -0.385 -3.242 -0.540
170 HD13 ILE 25 2HD1 ILE 25 0.849 -2.219 -1.311
171 H LYS 26 H LYS 26 -2.188 2.646 0.516
172 HA LYS 26 HA LYS 26 -4.504 1.313 1.558
173 HB2 LYS 26 1HB LYS 26 -3.512 4.181 1.756
174 HB3 LYS 26 2HB LYS 26 -4.972 3.629 2.583
175 HG2 LYS 26 1HG LYS 26 -3.780 2.038 3.914
176 HG3 LYS 26 2HG LYS 26 -2.299 2.223 2.969
177 HD2 LYS 26 1HD LYS 26 -2.104 4.585 3.714
178 HD3 LYS 26 2HD LYS 26 -3.577 4.397 4.691
179 HE2 LYS 26 1HE LYS 26 -2.499 2.658 6.045
180 HE3 LYS 26 2HE LYS 26 -1.066 2.690 5.006
181 HZ1 LYS 26 3HZ LYS 26 -0.751 4.008 7.035
182 HZ2 LYS 26 1HZ LYS 26 -1.986 4.999 6.633
183 HZ3 LYS 26 2HZ LYS 26 -0.629 4.953 5.705
184 H SER 27 H SER 27 -4.321 4.051 -0.770
185 HA SER 27 HA SER 27 -7.133 4.257 -1.227
186 HB2 SER 27 1HB SER 27 -4.840 4.819 -3.152
187 HB3 SER 27 2HB SER 27 -6.529 5.305 -3.377
188 HG SER 27 HG SER 27 -4.687 6.155 -1.391
189 H HIS 28 H HIS 28 -4.687 2.178 -2.888
190 HA HIS 28 HA HIS 28 -6.513 0.990 -4.722
191 HB2 HIS 28 1HB HIS 28 -4.111 0.856 -5.009
192 HB3 HIS 28 2HB HIS 28 -3.923 -0.036 -3.505
193 HD1 HIS 28 1HD HIS 28 -5.698 -0.611 -6.922
194 HD2 HIS 28 2HD HIS 28 -3.893 -2.616 -3.696
195 HE1 HIS 28 1HE HIS 28 -5.664 -3.063 -7.569
196 H ILE 29 H ILE 29 -5.506 -0.178 -1.466
197 HA ILE 29 HA ILE 29 -7.165 -2.505 -1.457
198 HB ILE 29 HB ILE 29 -6.092 -0.788 0.810
199 HG12 ILE 29 1HG1 ILE 29 -5.227 -3.534 -0.236
200 HG13 ILE 29 2HG1 ILE 29 -4.434 -2.024 -0.667
201 HG21 ILE 29 1HG2 ILE 29 -8.092 -1.986 1.641
202 HG22 ILE 29 2HG2 ILE 29 -7.471 -3.509 0.977
203 HG23 ILE 29 3HG2 ILE 29 -6.647 -2.696 2.322
204 HD11 ILE 29 3HD1 ILE 29 -4.507 -3.264 2.100
205 HD12 ILE 29 1HD1 ILE 29 -3.121 -3.055 1.026
206 HD13 ILE 29 2HD1 ILE 29 -3.894 -1.628 1.744
207 H LYS 30 H LYS 30 -7.917 0.861 -0.420
208 HA LYS 30 HA LYS 30 -10.588 0.216 0.481
209 HB2 LYS 30 1HB LYS 30 -9.231 2.828 -0.294
210 HB3 LYS 30 2HB LYS 30 -10.884 2.767 0.303
211 HG2 LYS 30 1HG LYS 30 -8.506 1.684 1.876
212 HG3 LYS 30 2HG LYS 30 -9.146 3.322 2.031
213 HD2 LYS 30 1HD LYS 30 -11.357 2.386 2.707
214 HD3 LYS 30 2HD LYS 30 -10.674 0.746 2.623
215 HE2 LYS 30 1HE LYS 30 -8.973 1.356 4.314
216 HE3 LYS 30 2HE LYS 30 -9.629 2.996 4.395
217 HZ1 LYS 30 3HZ LYS 30 -11.125 0.531 5.127
218 HZ2 LYS 30 1HZ LYS 30 -11.726 2.050 5.202
219 HZ3 LYS 30 2HZ LYS 30 -10.502 1.607 6.186
220 H THR 31 H THR 31 -9.425 1.110 -2.757
221 HA THR 31 HA THR 31 -12.163 1.411 -3.771
222 HB THR 31 HB THR 31 -10.943 1.793 -5.920
223 HG1 THR 31 1HG THR 31 -8.634 2.052 -4.372
224 HG21 THR 31 3HG2 THR 31 -10.039 4.007 -5.303
225 HG22 THR 31 1HG2 THR 31 -10.147 3.572 -3.581
226 HG23 THR 31 2HG2 THR 31 -11.620 3.703 -4.561
227 H ASN 32 H ASN 32 -9.561 -1.002 -4.018
228 HA ASN 32 HA ASN 32 -11.195 -2.578 -5.963
229 HB2 ASN 32 1HB ASN 32 -8.219 -2.547 -5.314
230 HB3 ASN 32 2HB ASN 32 -8.984 -3.755 -6.324
231 HD21 ASN 32 1HD2 ASN 32 -8.655 -0.128 -6.130
232 HD22 ASN 32 2HD2 ASN 32 -8.645 0.025 -7.875
233 H HIS 33 H HIS 33 -9.957 -2.823 -2.653
234 HA HIS 33 HA HIS 33 -11.008 -5.615 -2.495
235 HB2 HIS 33 1HB HIS 33 -8.371 -4.720 -1.296
236 HB3 HIS 33 2HB HIS 33 -9.028 -6.351 -1.377
237 HD1 HIS 33 1HD HIS 33 -9.465 -6.920 -4.344
238 HD2 HIS 33 2HD HIS 33 -6.436 -4.399 -2.900
239 HE1 HIS 33 1HE HIS 33 -7.710 -6.840 -6.176
240 HA PRO 34 HA PRO 34 -12.310 -2.668 0.927
241 HB2 PRO 34 1HB PRO 34 -15.032 -3.793 0.356
242 HB3 PRO 34 2HB PRO 34 -14.561 -2.102 0.733
243 HG2 PRO 34 1HG PRO 34 -15.146 -2.799 -1.815
244 HG3 PRO 34 2HG PRO 34 -13.694 -1.789 -1.493
245 HD2 PRO 34 1HD PRO 34 -13.831 -4.802 -1.870
246 HD3 PRO 34 2HD PRO 34 -12.783 -3.616 -2.685
247 H GLU 35 H GLU 35 -12.905 -6.082 0.507
248 HA GLU 35 HA GLU 35 -14.057 -6.615 3.101
249 HB2 GLU 35 1HB GLU 35 -13.916 -8.942 2.451
250 HB3 GLU 35 2HB GLU 35 -14.535 -7.967 1.123
251 HG2 GLU 35 1HG GLU 35 -12.286 -8.001 0.043
252 HG3 GLU 35 2HG GLU 35 -11.662 -8.975 1.375
253 H VAL 36 H VAL 36 -10.944 -5.725 2.471
254 HA VAL 36 HA VAL 36 -9.803 -7.169 4.810
255 HB VAL 36 HB VAL 36 -9.087 -8.366 2.885
256 HG11 VAL 36 1HG1 VAL 36 -9.422 -6.813 1.081
257 HG12 VAL 36 2HG1 VAL 36 -8.152 -5.735 1.692
258 HG13 VAL 36 3HG1 VAL 36 -7.738 -7.344 1.064
259 HG21 VAL 36 3HG2 VAL 36 -7.392 -7.987 4.664
260 HG22 VAL 36 1HG2 VAL 36 -6.692 -8.260 3.062
261 HG23 VAL 36 2HG2 VAL 36 -6.747 -6.617 3.721
262 H SER 37 H SER 37 -8.306 -6.093 6.021
263 HA SER 37 HA SER 37 -7.491 -3.328 5.413
264 HB2 SER 37 1HB SER 37 -8.350 -2.497 7.599
265 HB3 SER 37 2HB SER 37 -9.614 -2.890 6.426
266 HG SER 37 HG SER 37 -8.721 -4.712 8.438
Start of MODEL 5
1 H1 GLY 1 1H GLY 1 28.881 -9.886 -4.541
2 H2 GLY 1 2H GLY 1 28.868 -11.518 -4.399
3 H3 GLY 1 3H GLY 1 28.831 -10.577 -3.058
4 HA2 GLY 1 1HA GLY 1 26.702 -10.757 -5.092
5 HA3 GLY 1 2HA GLY 1 26.647 -11.488 -3.478
6 H SER 2 H SER 2 24.658 -10.252 -3.227
7 HA SER 2 HA SER 2 25.130 -7.628 -1.975
8 HB2 SER 2 1HB SER 2 24.570 -7.204 -4.414
9 HB3 SER 2 2HB SER 2 22.980 -7.929 -4.106
10 HG SER 2 HG SER 2 23.012 -5.618 -3.870
11 H SER 3 H SER 3 23.204 -6.886 -0.771
12 HA SER 3 HA SER 3 21.446 -9.080 0.240
13 HB2 SER 3 1HB SER 3 23.202 -7.292 1.967
14 HB3 SER 3 2HB SER 3 21.977 -8.428 2.561
15 HG SER 3 HG SER 3 24.098 -9.321 2.598
16 H GLY 4 H GLY 4 19.587 -8.421 1.359
17 HA2 GLY 4 1HA GLY 4 17.865 -7.022 2.048
18 HA3 GLY 4 2HA GLY 4 18.829 -5.607 1.651
19 H SER 5 H SER 5 16.342 -5.290 1.088
20 HA SER 5 HA SER 5 15.466 -6.347 -1.474
21 HB2 SER 5 1HB SER 5 14.178 -4.235 0.288
22 HB3 SER 5 2HB SER 5 13.405 -5.149 -1.021
23 HG SER 5 HG SER 5 12.952 -6.067 1.028
24 H SER 6 H SER 6 17.407 -3.663 -0.782
25 HA SER 6 HA SER 6 17.992 -1.742 -1.821
26 HB2 SER 6 1HB SER 6 17.350 -3.319 -4.328
27 HB3 SER 6 2HB SER 6 18.382 -1.881 -4.229
28 HG SER 6 HG SER 6 19.595 -3.832 -4.160
29 H GLY 7 H GLY 7 15.216 -1.712 -0.996
30 HA2 GLY 7 1HA GLY 7 14.364 0.764 -2.123
31 HA3 GLY 7 2HA GLY 7 13.440 -0.546 -2.864
32 H ARG 8 H ARG 8 12.057 1.274 -1.539
33 HA ARG 8 HA ARG 8 11.195 0.051 1.073
34 HB2 ARG 8 1HB ARG 8 11.147 2.976 0.231
35 HB3 ARG 8 2HB ARG 8 10.531 2.355 1.754
36 HG2 ARG 8 1HG ARG 8 13.471 2.269 0.943
37 HG3 ARG 8 2HG ARG 8 12.707 3.514 1.916
38 HD2 ARG 8 1HD ARG 8 13.776 2.092 3.454
39 HD3 ARG 8 2HD ARG 8 12.042 1.755 3.595
40 HE ARG 8 HE ARG 8 13.277 -0.032 1.698
41 HH11 ARG 8 1HH2 ARG 8 13.121 0.355 5.178
42 HH12 ARG 8 2HH2 ARG 8 13.335 -1.355 5.449
43 HH21 ARG 8 2HH1 ARG 8 13.484 -2.103 2.073
44 HH22 ARG 8 1HH1 ARG 8 13.558 -2.741 3.703
45 H SER 9 H SER 9 10.240 -0.141 -1.905
46 HA SER 9 HA SER 9 7.635 0.970 -2.035
47 HB2 SER 9 1HB SER 9 8.701 -1.448 -3.532
48 HB3 SER 9 2HB SER 9 7.334 -0.419 -4.002
49 HG SER 9 HG SER 9 9.282 0.159 -5.091
50 H TYR 10 H TYR 10 5.609 -0.017 -2.134
51 HA TYR 10 HA TYR 10 5.125 -2.215 -0.178
52 HB2 TYR 10 1HB TYR 10 3.246 -0.074 -1.243
53 HB3 TYR 10 2HB TYR 10 2.890 -1.250 0.013
54 HD1 TYR 10 2HD TYR 10 4.824 1.815 -0.814
55 HD2 TYR 10 1HD TYR 10 3.672 -0.940 2.301
56 HE1 TYR 10 2HE TYR 10 5.773 3.355 0.900
57 HE2 TYR 10 1HE TYR 10 4.569 0.627 4.014
58 HH TYR 10 HH TYR 10 5.650 2.612 4.402
59 H SER 11 H SER 11 3.473 -3.810 -0.705
60 HA SER 11 HA SER 11 2.723 -4.074 -3.571
61 HB2 SER 11 1HB SER 11 4.780 -5.391 -3.239
62 HB3 SER 11 2HB SER 11 3.980 -6.304 -1.942
63 HG SER 11 HG SER 11 3.897 -7.333 -4.030
64 H CYS 12 H CYS 12 0.687 -4.734 -3.885
65 HA CYS 12 HA CYS 12 -1.222 -4.673 -1.873
66 HB2 CYS 12 1HB CYS 12 -1.679 -4.225 -4.183
67 HB3 CYS 12 2HB CYS 12 -1.323 -5.907 -4.622
68 HA PRO 13 HA PRO 13 -0.867 -8.821 -0.127
69 HB2 PRO 13 1HB PRO 13 -2.963 -8.782 1.631
70 HB3 PRO 13 2HB PRO 13 -1.459 -7.848 1.883
71 HG2 PRO 13 1HG PRO 13 -4.080 -6.866 0.708
72 HG3 PRO 13 2HG PRO 13 -3.093 -6.109 1.998
73 HD2 PRO 13 1HD PRO 13 -2.922 -5.330 -0.609
74 HD3 PRO 13 2HD PRO 13 -1.482 -5.357 0.453
75 H VAL 14 H VAL 14 -3.411 -7.740 -2.172
76 HA VAL 14 HA VAL 14 -4.683 -10.460 -2.247
77 HB VAL 14 HB VAL 14 -5.860 -7.822 -3.141
78 HG11 VAL 14 1HG1 VAL 14 -7.099 -10.587 -2.814
79 HG12 VAL 14 2HG1 VAL 14 -8.006 -9.097 -3.137
80 HG13 VAL 14 3HG1 VAL 14 -6.873 -9.705 -4.342
81 HG21 VAL 14 3HG2 VAL 14 -5.666 -7.796 -0.709
82 HG22 VAL 14 1HG2 VAL 14 -7.346 -8.069 -1.152
83 HG23 VAL 14 2HG2 VAL 14 -6.351 -9.435 -0.604
84 H CYS 15 H CYS 15 -3.257 -7.940 -4.354
85 HA CYS 15 HA CYS 15 -3.240 -9.940 -6.564
86 HB2 CYS 15 1HB CYS 15 -3.903 -8.353 -8.157
87 HB3 CYS 15 2HB CYS 15 -5.138 -8.464 -6.903
88 H GLU 16 H GLU 16 -1.227 -8.307 -4.687
89 HA GLU 16 HA GLU 16 0.960 -7.772 -4.704
90 HB2 GLU 16 1HB GLU 16 1.123 -9.801 -6.946
91 HB3 GLU 16 2HB GLU 16 2.464 -9.229 -5.948
92 HG2 GLU 16 1HG GLU 16 1.326 -10.099 -3.913
93 HG3 GLU 16 2HG GLU 16 0.037 -10.758 -4.924
94 H LYS 17 H LYS 17 -0.740 -6.097 -6.527
95 HA LYS 17 HA LYS 17 1.077 -4.926 -8.461
96 HB2 LYS 17 1HB LYS 17 -1.371 -4.667 -8.576
97 HB3 LYS 17 2HB LYS 17 -1.368 -3.769 -7.053
98 HG2 LYS 17 1HG LYS 17 -0.076 -1.957 -8.064
99 HG3 LYS 17 2HG LYS 17 0.128 -2.888 -9.561
100 HD2 LYS 17 1HD LYS 17 -2.276 -2.773 -10.017
101 HD3 LYS 17 2HD LYS 17 -2.578 -2.048 -8.439
102 HE2 LYS 17 1HE LYS 17 -2.677 -0.285 -10.051
103 HE3 LYS 17 2HE LYS 17 -1.214 -0.059 -9.087
104 HZ1 LYS 17 3HZ LYS 17 -1.293 -1.277 -11.802
105 HZ2 LYS 17 1HZ LYS 17 0.066 -1.022 -10.927
106 HZ3 LYS 17 2HZ LYS 17 -0.804 0.242 -11.473
107 H SER 18 H SER 18 2.615 -3.403 -8.217
108 HA SER 18 HA SER 18 3.569 -2.823 -5.523
109 HB2 SER 18 1HB SER 18 4.750 -2.057 -8.209
110 HB3 SER 18 2HB SER 18 5.546 -1.921 -6.630
111 HG SER 18 HG SER 18 6.127 -3.852 -7.753
112 H PHE 19 H PHE 19 3.870 -0.864 -4.545
113 HA PHE 19 HA PHE 19 2.927 1.645 -5.852
114 HB2 PHE 19 1HB PHE 19 2.023 0.587 -3.148
115 HB3 PHE 19 2HB PHE 19 1.726 2.217 -3.731
116 HD1 PHE 19 2HD PHE 19 0.286 2.601 -5.758
117 HD2 PHE 19 1HD PHE 19 0.655 -1.278 -3.907
118 HE1 PHE 19 2HE PHE 19 -1.738 1.829 -6.972
119 HE2 PHE 19 1HE PHE 19 -1.351 -2.054 -5.144
120 HZ PHE 19 HZ PHE 19 -2.542 -0.502 -6.680
121 H SER 20 H SER 20 3.939 3.513 -5.191
122 HA SER 20 HA SER 20 6.529 3.197 -3.913
123 HB2 SER 20 1HB SER 20 5.145 5.716 -4.902
124 HB3 SER 20 2HB SER 20 6.871 5.520 -4.542
125 HG SER 20 HG SER 20 6.427 5.304 -6.788
126 H GLU 21 H GLU 21 3.437 4.103 -2.667
127 HA GLU 21 HA GLU 21 4.594 5.178 -0.138
128 HB2 GLU 21 1HB GLU 21 2.723 6.557 -2.071
129 HB3 GLU 21 2HB GLU 21 2.555 6.857 -0.352
130 HG2 GLU 21 1HG GLU 21 5.199 7.263 -1.792
131 HG3 GLU 21 2HG GLU 21 3.956 8.505 -1.683
132 H ASP 22 H ASP 22 3.359 4.889 1.678
133 HA ASP 22 HA ASP 22 1.631 2.684 1.879
134 HB2 ASP 22 1HB ASP 22 2.976 3.631 3.702
135 HB3 ASP 22 2HB ASP 22 1.978 5.085 3.709
136 H ARG 23 H ARG 23 0.827 6.121 1.440
137 HA ARG 23 HA ARG 23 -2.017 5.863 1.813
138 HB2 ARG 23 1HB ARG 23 -2.160 8.108 1.060
139 HB3 ARG 23 2HB ARG 23 -0.672 7.963 1.985
140 HG2 ARG 23 1HG ARG 23 0.451 7.600 -0.395
141 HG3 ARG 23 2HG ARG 23 -1.056 8.274 -1.010
142 HD2 ARG 23 1HD ARG 23 0.472 10.078 -0.851
143 HD3 ARG 23 2HD ARG 23 -0.655 10.292 0.486
144 HE ARG 23 HE ARG 23 2.178 9.245 0.673
145 HH11 ARG 23 2HH1 ARG 23 -0.466 10.808 2.400
146 HH12 ARG 23 1HH1 ARG 23 0.532 11.035 3.811
147 HH21 ARG 23 2HH2 ARG 23 3.292 9.528 2.361
148 HH22 ARG 23 1HH2 ARG 23 2.664 10.325 3.808
149 H LEU 24 H LEU 24 0.002 5.192 -0.962
150 HA LEU 24 HA LEU 24 -2.226 5.237 -2.887
151 HB2 LEU 24 1HB LEU 24 0.669 4.356 -3.190
152 HB3 LEU 24 2HB LEU 24 -0.506 4.495 -4.495
153 HG LEU 24 HG LEU 24 0.528 6.812 -2.809
154 HD11 LEU 24 1HD1 LEU 24 2.204 5.852 -4.366
155 HD12 LEU 24 2HD1 LEU 24 1.696 7.475 -4.859
156 HD13 LEU 24 3HD1 LEU 24 1.060 6.051 -5.712
157 HD21 LEU 24 3HD2 LEU 24 -0.579 8.243 -4.512
158 HD22 LEU 24 1HD2 LEU 24 -1.745 7.304 -3.577
159 HD23 LEU 24 2HD2 LEU 24 -1.324 6.797 -5.230
160 H ILE 25 H ILE 25 -0.295 2.732 -1.182
161 HA ILE 25 HA ILE 25 -1.845 0.585 -2.389
162 HB ILE 25 HB ILE 25 0.363 0.127 -1.529
163 HG12 ILE 25 1HG1 ILE 25 -1.781 -1.412 -0.011
164 HG13 ILE 25 2HG1 ILE 25 -1.421 -1.625 -1.727
165 HG21 ILE 25 1HG2 ILE 25 0.864 -0.000 0.859
166 HG22 ILE 25 2HG2 ILE 25 0.353 1.619 0.439
167 HG23 ILE 25 3HG2 ILE 25 -0.782 0.519 1.268
168 HD11 ILE 25 3HD1 ILE 25 0.509 -2.171 0.568
169 HD12 ILE 25 1HD1 ILE 25 -0.360 -3.358 -0.391
170 HD13 ILE 25 2HD1 ILE 25 0.873 -2.340 -1.171
171 H LYS 26 H LYS 26 -2.231 2.500 0.662
172 HA LYS 26 HA LYS 26 -4.562 1.100 1.562
173 HB2 LYS 26 1HB LYS 26 -3.535 3.922 1.998
174 HB3 LYS 26 2HB LYS 26 -5.124 3.430 2.596
175 HG2 LYS 26 1HG LYS 26 -4.141 1.564 3.850
176 HG3 LYS 26 2HG LYS 26 -2.519 2.011 3.291
177 HD2 LYS 26 1HD LYS 26 -2.652 4.157 4.464
178 HD3 LYS 26 2HD LYS 26 -4.358 3.889 4.840
179 HE2 LYS 26 1HE LYS 26 -3.110 3.461 6.831
180 HE3 LYS 26 2HE LYS 26 -3.766 1.929 6.243
181 HZ1 LYS 26 3HZ LYS 26 -1.555 1.426 5.327
182 HZ2 LYS 26 1HZ LYS 26 -1.413 1.760 6.921
183 HZ3 LYS 26 2HZ LYS 26 -0.976 2.871 5.796
184 H SER 27 H SER 27 -4.431 3.972 -0.658
185 HA SER 27 HA SER 27 -7.276 3.996 -1.010
186 HB2 SER 27 1HB SER 27 -6.916 5.445 -2.886
187 HB3 SER 27 2HB SER 27 -5.867 5.924 -1.541
188 HG SER 27 HG SER 27 -4.797 5.904 -3.590
189 H HIS 28 H HIS 28 -4.721 2.250 -2.851
190 HA HIS 28 HA HIS 28 -6.454 1.041 -4.749
191 HB2 HIS 28 1HB HIS 28 -4.068 0.898 -5.011
192 HB3 HIS 28 2HB HIS 28 -3.874 0.057 -3.477
193 HD1 HIS 28 1HD HIS 28 -5.590 -0.662 -6.893
194 HD2 HIS 28 2HD HIS 28 -3.853 -2.540 -3.556
195 HE1 HIS 28 1HE HIS 28 -5.550 -3.137 -7.441
196 H ILE 29 H ILE 29 -5.490 -0.258 -1.516
197 HA ILE 29 HA ILE 29 -7.130 -2.589 -1.696
198 HB ILE 29 HB ILE 29 -6.135 -1.067 0.740
199 HG12 ILE 29 1HG1 ILE 29 -5.128 -3.656 -0.558
200 HG13 ILE 29 2HG1 ILE 29 -4.378 -2.087 -0.798
201 HG21 ILE 29 1HG2 ILE 29 -6.658 -3.076 2.065
202 HG22 ILE 29 2HG2 ILE 29 -8.127 -2.507 1.311
203 HG23 ILE 29 3HG2 ILE 29 -7.287 -3.899 0.623
204 HD11 ILE 29 3HD1 ILE 29 -4.502 -3.617 1.819
205 HD12 ILE 29 1HD1 ILE 29 -3.089 -3.245 0.831
206 HD13 ILE 29 2HD1 ILE 29 -3.939 -1.932 1.665
207 H LYS 30 H LYS 30 -7.970 0.709 -0.494
208 HA LYS 30 HA LYS 30 -10.681 -0.156 0.229
209 HB2 LYS 30 1HB LYS 30 -9.437 2.605 0.029
210 HB3 LYS 30 2HB LYS 30 -11.070 2.292 0.599
211 HG2 LYS 30 1HG LYS 30 -8.501 1.366 1.949
212 HG3 LYS 30 2HG LYS 30 -9.589 2.643 2.460
213 HD2 LYS 30 1HD LYS 30 -10.260 0.982 3.878
214 HD3 LYS 30 2HD LYS 30 -11.402 0.707 2.556
215 HE2 LYS 30 1HE LYS 30 -9.835 -1.073 1.670
216 HE3 LYS 30 2HE LYS 30 -8.755 -0.757 3.024
217 HZ1 LYS 30 3HZ LYS 30 -10.465 -1.542 4.533
218 HZ2 LYS 30 1HZ LYS 30 -10.177 -2.659 3.413
219 HZ3 LYS 30 2HZ LYS 30 -11.543 -1.780 3.298
220 H THR 31 H THR 31 -9.411 0.823 -2.856
221 HA THR 31 HA THR 31 -12.154 1.248 -3.896
222 HB THR 31 HB THR 31 -10.887 1.693 -6.007
223 HG1 THR 31 1HG THR 31 -8.640 1.997 -4.380
224 HG21 THR 31 3HG2 THR 31 -10.224 3.460 -3.620
225 HG22 THR 31 1HG2 THR 31 -11.672 3.558 -4.642
226 HG23 THR 31 2HG2 THR 31 -10.081 3.930 -5.330
227 H ASN 32 H ASN 32 -9.504 -1.108 -4.122
228 HA ASN 32 HA ASN 32 -11.033 -2.682 -6.147
229 HB2 ASN 32 1HB ASN 32 -8.101 -2.655 -5.317
230 HB3 ASN 32 2HB ASN 32 -8.801 -3.842 -6.401
231 HD21 ASN 32 1HD2 ASN 32 -8.474 -0.226 -6.100
232 HD22 ASN 32 2HD2 ASN 32 -8.381 -0.022 -7.837
233 H HIS 33 H HIS 33 -9.916 -2.942 -2.801
234 HA HIS 33 HA HIS 33 -11.117 -5.662 -2.604
235 HB2 HIS 33 1HB HIS 33 -8.499 -4.931 -1.268
236 HB3 HIS 33 2HB HIS 33 -9.219 -6.524 -1.473
237 HD1 HIS 33 1HD HIS 33 -9.406 -6.952 -4.490
238 HD2 HIS 33 2HD HIS 33 -6.447 -4.581 -2.694
239 HE1 HIS 33 1HE HIS 33 -7.512 -6.823 -6.176
240 HA PRO 34 HA PRO 34 -12.211 -2.214 0.466
241 HB2 PRO 34 1HB PRO 34 -14.991 -3.287 0.054
242 HB3 PRO 34 2HB PRO 34 -14.458 -1.587 0.273
243 HG2 PRO 34 1HG PRO 34 -15.060 -2.488 -2.199
244 HG3 PRO 34 2HG PRO 34 -13.559 -1.527 -1.965
245 HD2 PRO 34 1HD PRO 34 -13.855 -4.546 -2.090
246 HD3 PRO 34 2HD PRO 34 -12.726 -3.488 -2.967
247 H GLU 35 H GLU 35 -13.413 -5.551 0.552
248 HA GLU 35 HA GLU 35 -14.361 -5.486 3.261
249 HB2 GLU 35 1HB GLU 35 -14.794 -7.847 2.946
250 HB3 GLU 35 2HB GLU 35 -15.298 -6.934 1.528
251 HG2 GLU 35 1HG GLU 35 -13.216 -7.624 0.341
252 HG3 GLU 35 2HG GLU 35 -12.707 -8.535 1.763
253 H VAL 36 H VAL 36 -11.186 -5.507 2.285
254 HA VAL 36 HA VAL 36 -10.220 -6.794 4.798
255 HB VAL 36 HB VAL 36 -9.769 -8.327 3.043
256 HG11 VAL 36 1HG1 VAL 36 -8.385 -7.794 1.062
257 HG12 VAL 36 2HG1 VAL 36 -9.938 -6.955 1.049
258 HG13 VAL 36 3HG1 VAL 36 -8.463 -6.068 1.480
259 HG21 VAL 36 3HG2 VAL 36 -7.165 -6.855 3.594
260 HG22 VAL 36 1HG2 VAL 36 -7.968 -7.983 4.717
261 HG23 VAL 36 2HG2 VAL 36 -7.373 -8.559 3.153
262 H SER 37 H SER 37 -8.592 -5.763 5.884
263 HA SER 37 HA SER 37 -7.615 -3.108 4.923
264 HB2 SER 37 1HB SER 37 -8.901 -3.682 7.617
265 HB3 SER 37 2HB SER 37 -8.039 -2.193 7.192
266 HG SER 37 HG SER 37 -10.390 -2.125 6.932
Start of MODEL 6
1 H1 GLY 1 1H GLY 1 14.886 3.889 -11.105
2 H2 GLY 1 2H GLY 1 14.050 5.298 -11.144
3 H3 GLY 1 3H GLY 1 13.742 4.196 -9.972
4 HA2 GLY 1 1HA GLY 1 15.930 4.490 -9.023
5 HA3 GLY 1 2HA GLY 1 16.276 5.671 -10.300
6 H SER 2 H SER 2 16.218 5.968 -7.347
7 HA SER 2 HA SER 2 14.294 8.243 -7.094
8 HB2 SER 2 1HB SER 2 14.780 6.080 -5.009
9 HB3 SER 2 2HB SER 2 13.796 7.538 -4.790
10 HG SER 2 HG SER 2 12.529 5.698 -5.343
11 H SER 3 H SER 3 14.883 9.868 -5.613
12 HA SER 3 HA SER 3 17.698 10.424 -5.403
13 HB2 SER 3 1HB SER 3 15.339 11.818 -4.084
14 HB3 SER 3 2HB SER 3 16.985 12.462 -4.245
15 HG SER 3 HG SER 3 15.582 13.233 -5.901
16 H GLY 4 H GLY 4 18.971 10.781 -3.548
17 HA2 GLY 4 1HA GLY 4 19.725 10.550 -1.370
18 HA3 GLY 4 2HA GLY 4 18.128 10.022 -0.861
19 H SER 5 H SER 5 19.986 8.787 0.394
20 HA SER 5 HA SER 5 21.115 6.456 -0.957
21 HB2 SER 5 1HB SER 5 22.211 7.855 0.852
22 HB3 SER 5 2HB SER 5 21.111 7.087 2.012
23 HG SER 5 HG SER 5 23.156 6.017 1.837
24 H SER 6 H SER 6 18.203 7.035 0.859
25 HA SER 6 HA SER 6 17.597 4.108 1.051
26 HB2 SER 6 1HB SER 6 17.054 6.233 3.157
27 HB3 SER 6 2HB SER 6 16.536 4.540 3.229
28 HG SER 6 HG SER 6 18.484 4.912 4.396
29 H GLY 7 H GLY 7 15.391 3.524 1.114
30 HA2 GLY 7 1HA GLY 7 13.191 5.341 0.773
31 HA3 GLY 7 2HA GLY 7 13.669 4.650 -0.781
32 H ARG 8 H ARG 8 11.236 4.019 -0.219
33 HA ARG 8 HA ARG 8 11.227 1.186 0.741
34 HB2 ARG 8 1HB ARG 8 9.121 3.259 1.478
35 HB3 ARG 8 2HB ARG 8 9.092 1.542 1.889
36 HG2 ARG 8 1HG ARG 8 11.250 1.904 3.192
37 HG3 ARG 8 2HG ARG 8 11.021 3.643 2.949
38 HD2 ARG 8 1HD ARG 8 9.170 1.714 4.402
39 HD3 ARG 8 2HD ARG 8 10.141 2.983 5.137
40 HE ARG 8 HE ARG 8 7.562 3.248 3.751
41 HH11 ARG 8 2HH1 ARG 8 10.306 5.137 4.861
42 HH12 ARG 8 1HH1 ARG 8 9.403 6.624 4.785
43 HH21 ARG 8 2HH2 ARG 8 6.505 5.107 3.688
44 HH22 ARG 8 1HH2 ARG 8 7.278 6.611 4.136
45 H SER 9 H SER 9 9.546 -0.102 -0.022
46 HA SER 9 HA SER 9 7.753 0.928 -2.135
47 HB2 SER 9 1HB SER 9 8.115 -1.049 -3.536
48 HB3 SER 9 2HB SER 9 9.580 -0.066 -3.387
49 HG SER 9 HG SER 9 10.023 -2.304 -3.131
50 H TYR 10 H TYR 10 5.882 -0.364 -2.477
51 HA TYR 10 HA TYR 10 5.061 -2.132 -0.208
52 HB2 TYR 10 1HB TYR 10 3.463 0.110 -1.509
53 HB3 TYR 10 2HB TYR 10 2.890 -0.974 -0.256
54 HD1 TYR 10 2HD TYR 10 5.265 1.816 -0.984
55 HD2 TYR 10 1HD TYR 10 3.321 -0.532 2.069
56 HE1 TYR 10 2HE TYR 10 6.078 3.405 0.757
57 HE2 TYR 10 1HE TYR 10 4.082 1.086 3.795
58 HH TYR 10 HH TYR 10 5.214 3.002 4.217
59 H SER 11 H SER 11 3.519 -3.779 -0.788
60 HA SER 11 HA SER 11 2.566 -3.817 -3.566
61 HB2 SER 11 1HB SER 11 3.144 -6.158 -3.954
62 HB3 SER 11 2HB SER 11 4.564 -5.116 -3.808
63 HG SER 11 HG SER 11 4.882 -5.877 -1.704
64 H CYS 12 H CYS 12 0.659 -4.764 -3.946
65 HA CYS 12 HA CYS 12 -1.232 -4.678 -1.940
66 HB2 CYS 12 1HB CYS 12 -1.699 -4.309 -4.259
67 HB3 CYS 12 2HB CYS 12 -1.303 -5.990 -4.656
68 HA PRO 13 HA PRO 13 -0.890 -8.790 -0.086
69 HB2 PRO 13 1HB PRO 13 -2.955 -8.675 1.696
70 HB3 PRO 13 2HB PRO 13 -1.446 -7.736 1.897
71 HG2 PRO 13 1HG PRO 13 -4.081 -6.786 0.726
72 HG3 PRO 13 2HG PRO 13 -3.076 -5.991 1.976
73 HD2 PRO 13 1HD PRO 13 -2.941 -5.308 -0.665
74 HD3 PRO 13 2HD PRO 13 -1.495 -5.280 0.387
75 H VAL 14 H VAL 14 -3.442 -7.719 -2.129
76 HA VAL 14 HA VAL 14 -4.769 -10.417 -2.121
77 HB VAL 14 HB VAL 14 -5.898 -7.715 -2.892
78 HG11 VAL 14 1HG1 VAL 14 -7.237 -10.453 -2.813
79 HG12 VAL 14 2HG1 VAL 14 -8.079 -8.901 -3.014
80 HG13 VAL 14 3HG1 VAL 14 -6.962 -9.453 -4.259
81 HG21 VAL 14 3HG2 VAL 14 -6.467 -9.548 -0.519
82 HG22 VAL 14 1HG2 VAL 14 -5.702 -7.946 -0.457
83 HG23 VAL 14 2HG2 VAL 14 -7.393 -8.089 -0.927
84 H CYS 15 H CYS 15 -3.351 -7.949 -4.290
85 HA CYS 15 HA CYS 15 -3.374 -9.982 -6.458
86 HB2 CYS 15 1HB CYS 15 -4.201 -8.532 -8.046
87 HB3 CYS 15 2HB CYS 15 -5.348 -8.551 -6.709
88 H GLU 16 H GLU 16 -1.356 -8.471 -4.689
89 HA GLU 16 HA GLU 16 0.856 -8.067 -4.692
90 HB2 GLU 16 1HB GLU 16 0.848 -9.850 -7.138
91 HB3 GLU 16 2HB GLU 16 2.238 -9.483 -6.113
92 HG2 GLU 16 1HG GLU 16 1.060 -10.481 -4.157
93 HG3 GLU 16 2HG GLU 16 -0.276 -10.948 -5.214
94 H LYS 17 H LYS 17 -0.782 -6.259 -6.744
95 HA LYS 17 HA LYS 17 1.227 -5.140 -8.473
96 HB2 LYS 17 1HB LYS 17 -1.350 -3.996 -7.332
97 HB3 LYS 17 2HB LYS 17 -0.347 -3.131 -8.509
98 HG2 LYS 17 1HG LYS 17 -0.633 -4.838 -10.184
99 HG3 LYS 17 2HG LYS 17 -1.347 -5.942 -9.014
100 HD2 LYS 17 1HD LYS 17 -3.247 -4.219 -8.735
101 HD3 LYS 17 2HD LYS 17 -2.560 -3.380 -10.127
102 HE2 LYS 17 1HE LYS 17 -4.390 -4.810 -10.845
103 HE3 LYS 17 2HE LYS 17 -2.873 -5.425 -11.512
104 HZ1 LYS 17 3HZ LYS 17 -4.349 -7.164 -10.509
105 HZ2 LYS 17 1HZ LYS 17 -4.110 -6.493 -9.022
106 HZ3 LYS 17 2HZ LYS 17 -2.858 -7.137 -9.830
107 H SER 18 H SER 18 2.498 -3.381 -8.327
108 HA SER 18 HA SER 18 3.516 -2.849 -5.608
109 HB2 SER 18 1HB SER 18 4.768 -2.266 -8.305
110 HB3 SER 18 2HB SER 18 5.543 -2.061 -6.721
111 HG SER 18 HG SER 18 6.063 -4.083 -7.714
112 H PHE 19 H PHE 19 3.890 -0.913 -4.682
113 HA PHE 19 HA PHE 19 3.058 1.622 -6.000
114 HB2 PHE 19 1HB PHE 19 2.103 0.679 -3.269
115 HB3 PHE 19 2HB PHE 19 1.775 2.247 -3.988
116 HD1 PHE 19 2HD PHE 19 0.323 2.412 -6.053
117 HD2 PHE 19 1HD PHE 19 0.808 -1.279 -3.869
118 HE1 PHE 19 2HE PHE 19 -1.630 1.445 -7.244
119 HE2 PHE 19 1HE PHE 19 -1.137 -2.240 -5.071
120 HZ PHE 19 HZ PHE 19 -2.335 -0.893 -6.783
121 H SER 20 H SER 20 3.945 3.525 -5.055
122 HA SER 20 HA SER 20 6.548 3.077 -3.729
123 HB2 SER 20 1HB SER 20 7.003 5.393 -4.498
124 HB3 SER 20 2HB SER 20 6.597 4.263 -5.800
125 HG SER 20 HG SER 20 5.477 6.263 -6.005
126 H GLU 21 H GLU 21 3.446 4.044 -2.673
127 HA GLU 21 HA GLU 21 4.593 5.200 -0.185
128 HB2 GLU 21 1HB GLU 21 2.289 6.483 -1.685
129 HB3 GLU 21 2HB GLU 21 2.978 6.997 -0.147
130 HG2 GLU 21 1HG GLU 21 5.140 7.479 -1.326
131 HG3 GLU 21 2HG GLU 21 4.328 7.151 -2.865
132 H ASP 22 H ASP 22 3.351 4.993 1.647
133 HA ASP 22 HA ASP 22 1.581 2.840 2.020
134 HB2 ASP 22 1HB ASP 22 2.907 3.938 3.769
135 HB3 ASP 22 2HB ASP 22 1.978 5.423 3.583
136 H ARG 23 H ARG 23 0.831 6.283 1.394
137 HA ARG 23 HA ARG 23 -2.032 6.044 1.585
138 HB2 ARG 23 1HB ARG 23 -2.094 8.220 0.427
139 HB3 ARG 23 2HB ARG 23 -1.008 8.200 1.814
140 HG2 ARG 23 1HG ARG 23 0.951 8.059 0.362
141 HG3 ARG 23 2HG ARG 23 -0.060 7.935 -1.081
142 HD2 ARG 23 1HD ARG 23 -0.134 10.314 0.814
143 HD3 ARG 23 2HD ARG 23 0.960 10.228 -0.556
144 HE ARG 23 HE ARG 23 -1.938 10.666 -0.629
145 HH11 ARG 23 2HH1 ARG 23 0.864 9.828 -2.637
146 HH12 ARG 23 1HH1 ARG 23 0.040 10.353 -4.082
147 HH21 ARG 23 2HH2 ARG 23 -2.885 11.253 -2.537
148 HH22 ARG 23 1HH2 ARG 23 -2.013 11.101 -4.033
149 H LEU 24 H LEU 24 0.136 5.349 -1.102
150 HA LEU 24 HA LEU 24 -2.013 5.319 -3.096
151 HB2 LEU 24 1HB LEU 24 0.880 4.386 -3.180
152 HB3 LEU 24 2HB LEU 24 -0.220 4.314 -4.552
153 HG LEU 24 HG LEU 24 0.600 6.886 -3.138
154 HD11 LEU 24 1HD1 LEU 24 1.954 7.298 -5.143
155 HD12 LEU 24 2HD1 LEU 24 1.477 5.721 -5.813
156 HD13 LEU 24 3HD1 LEU 24 2.470 5.812 -4.340
157 HD21 LEU 24 3HD2 LEU 24 -0.353 7.978 -5.170
158 HD22 LEU 24 1HD2 LEU 24 -1.578 7.180 -4.182
159 HD23 LEU 24 2HD2 LEU 24 -1.003 6.407 -5.682
160 H ILE 25 H ILE 25 -0.150 2.782 -1.327
161 HA ILE 25 HA ILE 25 -1.738 0.665 -2.481
162 HB ILE 25 HB ILE 25 0.474 0.234 -1.574
163 HG12 ILE 25 1HG1 ILE 25 -1.706 -1.345 -0.146
164 HG13 ILE 25 2HG1 ILE 25 -1.295 -1.526 -1.855
165 HG21 ILE 25 1HG2 ILE 25 -0.750 0.550 1.202
166 HG22 ILE 25 2HG2 ILE 25 0.915 0.079 0.821
167 HG23 ILE 25 3HG2 ILE 25 0.376 1.700 0.434
168 HD11 ILE 25 3HD1 ILE 25 0.569 -2.107 0.487
169 HD12 ILE 25 1HD1 ILE 25 -0.282 -3.277 -0.518
170 HD13 ILE 25 2HD1 ILE 25 0.979 -2.253 -1.245
171 H LYS 26 H LYS 26 -2.167 2.575 0.563
172 HA LYS 26 HA LYS 26 -4.519 1.144 1.404
173 HB2 LYS 26 1HB LYS 26 -3.500 3.954 1.937
174 HB3 LYS 26 2HB LYS 26 -5.045 3.381 2.584
175 HG2 LYS 26 1HG LYS 26 -3.998 1.542 3.755
176 HG3 LYS 26 2HG LYS 26 -2.421 1.897 3.030
177 HD2 LYS 26 1HD LYS 26 -2.338 4.065 4.166
178 HD3 LYS 26 2HD LYS 26 -3.948 3.794 4.874
179 HE2 LYS 26 1HE LYS 26 -3.155 1.901 6.160
180 HE3 LYS 26 2HE LYS 26 -1.612 1.888 5.292
181 HZ1 LYS 26 3HZ LYS 26 -1.388 2.952 7.458
182 HZ2 LYS 26 1HZ LYS 26 -2.488 4.102 7.062
183 HZ3 LYS 26 2HZ LYS 26 -1.061 4.000 6.244
184 H SER 27 H SER 27 -4.251 4.021 -0.741
185 HA SER 27 HA SER 27 -7.023 4.296 -1.289
186 HB2 SER 27 1HB SER 27 -5.281 5.912 -1.966
187 HB3 SER 27 2HB SER 27 -4.679 4.760 -3.175
188 HG SER 27 HG SER 27 -6.166 6.321 -4.038
189 H HIS 28 H HIS 28 -4.590 2.229 -2.975
190 HA HIS 28 HA HIS 28 -6.379 1.024 -4.808
191 HB2 HIS 28 1HB HIS 28 -3.986 0.872 -5.092
192 HB3 HIS 28 2HB HIS 28 -3.784 0.053 -3.550
193 HD1 HIS 28 1HD HIS 28 -5.312 -0.692 -7.029
194 HD2 HIS 28 2HD HIS 28 -3.875 -2.557 -3.545
195 HE1 HIS 28 1HE HIS 28 -5.325 -3.174 -7.527
196 H ILE 29 H ILE 29 -5.404 -0.187 -1.566
197 HA ILE 29 HA ILE 29 -7.041 -2.525 -1.604
198 HB ILE 29 HB ILE 29 -5.917 -0.862 0.677
199 HG12 ILE 29 1HG1 ILE 29 -5.108 -3.598 -0.433
200 HG13 ILE 29 2HG1 ILE 29 -4.308 -2.086 -0.844
201 HG21 ILE 29 1HG2 ILE 29 -7.317 -3.570 0.858
202 HG22 ILE 29 2HG2 ILE 29 -6.447 -2.772 2.185
203 HG23 ILE 29 3HG2 ILE 29 -7.903 -2.044 1.554
204 HD11 ILE 29 3HD1 ILE 29 -2.972 -3.162 0.802
205 HD12 ILE 29 1HD1 ILE 29 -3.729 -1.757 1.575
206 HD13 ILE 29 2HD1 ILE 29 -4.340 -3.405 1.889
207 H LYS 30 H LYS 30 -7.824 0.807 -0.514
208 HA LYS 30 HA LYS 30 -10.435 0.026 0.500
209 HB2 LYS 30 1HB LYS 30 -9.156 2.716 -0.115
210 HB3 LYS 30 2HB LYS 30 -10.785 2.581 0.517
211 HG2 LYS 30 1HG LYS 30 -8.271 1.561 1.910
212 HG3 LYS 30 2HG LYS 30 -9.133 3.040 2.292
213 HD2 LYS 30 1HD LYS 30 -10.108 0.178 2.665
214 HD3 LYS 30 2HD LYS 30 -9.650 1.307 3.922
215 HE2 LYS 30 1HE LYS 30 -12.045 1.650 2.055
216 HE3 LYS 30 2HE LYS 30 -12.115 0.985 3.685
217 HZ1 LYS 30 3HZ LYS 30 -12.679 3.332 3.699
218 HZ2 LYS 30 1HZ LYS 30 -11.251 3.754 3.034
219 HZ3 LYS 30 2HZ LYS 30 -11.299 3.114 4.540
220 H THR 31 H THR 31 -9.420 0.963 -2.712
221 HA THR 31 HA THR 31 -12.282 1.174 -3.517
222 HB THR 31 HB THR 31 -10.568 2.961 -4.004
223 HG1 THR 31 1HG THR 31 -12.167 1.879 -6.080
224 HG21 THR 31 3HG2 THR 31 -9.288 2.851 -6.009
225 HG22 THR 31 1HG2 THR 31 -9.909 1.236 -6.413
226 HG23 THR 31 2HG2 THR 31 -8.821 1.461 -5.019
227 H ASN 32 H ASN 32 -9.716 -1.132 -3.778
228 HA ASN 32 HA ASN 32 -11.327 -2.682 -5.795
229 HB2 ASN 32 1HB ASN 32 -8.369 -2.908 -5.108
230 HB3 ASN 32 2HB ASN 32 -9.237 -3.878 -6.289
231 HD21 ASN 32 1HD2 ASN 32 -7.815 -0.778 -5.647
232 HD22 ASN 32 2HD2 ASN 32 -8.011 -0.147 -7.292
233 H HIS 33 H HIS 33 -9.992 -2.876 -2.515
234 HA HIS 33 HA HIS 33 -10.944 -5.686 -2.294
235 HB2 HIS 33 1HB HIS 33 -8.369 -4.565 -1.149
236 HB3 HIS 33 2HB HIS 33 -8.865 -6.244 -1.158
237 HD1 HIS 33 1HD HIS 33 -9.481 -6.666 -4.248
238 HD2 HIS 33 2HD HIS 33 -6.283 -4.490 -2.618
239 HE1 HIS 33 1HE HIS 33 -7.678 -6.649 -6.036
240 HA PRO 34 HA PRO 34 -11.565 -2.897 1.616
241 HB2 PRO 34 1HB PRO 34 -14.138 -1.964 1.541
242 HB3 PRO 34 2HB PRO 34 -12.762 -1.129 0.757
243 HG2 PRO 34 1HG PRO 34 -14.754 -3.039 -0.516
244 HG3 PRO 34 2HG PRO 34 -14.260 -1.413 -1.094
245 HD2 PRO 34 1HD PRO 34 -13.114 -3.663 -2.083
246 HD3 PRO 34 2HD PRO 34 -12.138 -2.196 -1.773
247 H GLU 35 H GLU 35 -13.684 -5.297 0.186
248 HA GLU 35 HA GLU 35 -14.412 -6.371 2.878
249 HB2 GLU 35 1HB GLU 35 -16.240 -7.513 1.798
250 HB3 GLU 35 2HB GLU 35 -16.304 -5.789 1.453
251 HG2 GLU 35 1HG GLU 35 -15.317 -6.204 -0.805
252 HG3 GLU 35 2HG GLU 35 -15.258 -7.931 -0.456
253 H VAL 36 H VAL 36 -11.876 -6.721 1.044
254 HA VAL 36 HA VAL 36 -11.809 -9.716 0.979
255 HB VAL 36 HB VAL 36 -10.317 -7.899 -0.922
256 HG11 VAL 36 1HG1 VAL 36 -9.483 -10.201 -0.825
257 HG12 VAL 36 2HG1 VAL 36 -11.127 -10.830 -1.077
258 HG13 VAL 36 3HG1 VAL 36 -10.301 -9.922 -2.361
259 HG21 VAL 36 3HG2 VAL 36 -13.070 -9.113 -1.363
260 HG22 VAL 36 1HG2 VAL 36 -12.667 -7.379 -1.335
261 HG23 VAL 36 2HG2 VAL 36 -12.053 -8.396 -2.632
262 H SER 37 H SER 37 -10.055 -6.806 1.861
263 HA SER 37 HA SER 37 -7.504 -8.033 2.408
264 HB2 SER 37 1HB SER 37 -6.995 -5.918 3.553
265 HB3 SER 37 2HB SER 37 -7.656 -5.681 1.925
266 HG SER 37 HG SER 37 -8.638 -4.285 3.519
Start of MODEL 7
1 H1 GLY 1 1H GLY 1 20.705 -7.665 -1.006
2 H2 GLY 1 2H GLY 1 20.109 -7.673 0.522
3 H3 GLY 1 3H GLY 1 21.374 -6.705 0.138
4 HA2 GLY 1 1HA GLY 1 18.628 -6.443 -0.909
5 HA3 GLY 1 2HA GLY 1 19.367 -5.396 0.316
6 H SER 2 H SER 2 18.893 -3.611 -1.114
7 HA SER 2 HA SER 2 21.096 -3.032 -2.986
8 HB2 SER 2 1HB SER 2 19.218 -4.068 -4.340
9 HB3 SER 2 2HB SER 2 18.208 -2.684 -3.877
10 HG SER 2 HG SER 2 19.304 -2.396 -5.903
11 H SER 3 H SER 3 21.219 -0.750 -3.538
12 HA SER 3 HA SER 3 20.880 0.914 -1.217
13 HB2 SER 3 1HB SER 3 21.733 1.663 -4.036
14 HB3 SER 3 2HB SER 3 21.934 2.660 -2.582
15 HG SER 3 HG SER 3 23.836 1.466 -3.094
16 H GLY 4 H GLY 4 19.691 2.778 -0.882
17 HA2 GLY 4 1HA GLY 4 18.025 4.124 -2.732
18 HA3 GLY 4 2HA GLY 4 17.022 2.966 -1.854
19 H SER 5 H SER 5 16.565 5.702 -1.707
20 HA SER 5 HA SER 5 16.769 6.186 1.178
21 HB2 SER 5 1HB SER 5 18.879 7.169 0.216
22 HB3 SER 5 2HB SER 5 17.877 8.250 -0.770
23 HG SER 5 HG SER 5 18.565 9.193 1.238
24 H SER 6 H SER 6 15.364 7.813 1.901
25 HA SER 6 HA SER 6 13.400 8.826 2.175
26 HB2 SER 6 1HB SER 6 14.485 10.451 0.683
27 HB3 SER 6 2HB SER 6 13.651 9.722 -0.703
28 HG SER 6 HG SER 6 12.529 11.542 0.184
29 H GLY 7 H GLY 7 13.054 7.338 -1.086
30 HA2 GLY 7 1HA GLY 7 10.206 6.785 -0.723
31 HA3 GLY 7 2HA GLY 7 11.221 6.284 -2.071
32 H ARG 8 H ARG 8 9.283 4.657 -0.988
33 HA ARG 8 HA ARG 8 10.845 2.274 -0.194
34 HB2 ARG 8 1HB ARG 8 10.120 3.219 1.944
35 HB3 ARG 8 2HB ARG 8 8.451 3.334 1.377
36 HG2 ARG 8 1HG ARG 8 8.245 0.909 1.294
37 HG3 ARG 8 2HG ARG 8 9.973 0.705 1.656
38 HD2 ARG 8 1HD ARG 8 9.629 1.716 3.887
39 HD3 ARG 8 2HD ARG 8 7.938 2.018 3.503
40 HE ARG 8 HE ARG 8 7.409 -0.228 3.784
41 HH11 ARG 8 2HH1 ARG 8 10.899 0.058 4.023
42 HH12 ARG 8 1HH1 ARG 8 11.074 -1.563 4.639
43 HH21 ARG 8 2HH2 ARG 8 7.712 -2.273 4.577
44 HH22 ARG 8 1HH2 ARG 8 9.315 -2.839 4.943
45 H SER 9 H SER 9 9.985 0.358 -0.930
46 HA SER 9 HA SER 9 7.794 0.531 -2.920
47 HB2 SER 9 1HB SER 9 9.680 -1.755 -2.263
48 HB3 SER 9 2HB SER 9 8.484 -1.721 -3.573
49 HG SER 9 HG SER 9 10.597 -1.130 -4.291
50 H TYR 10 H TYR 10 5.855 -0.358 -2.706
51 HA TYR 10 HA TYR 10 5.195 -2.118 -0.375
52 HB2 TYR 10 1HB TYR 10 3.463 0.059 -1.604
53 HB3 TYR 10 2HB TYR 10 3.025 -0.994 -0.273
54 HD1 TYR 10 2HD TYR 10 5.231 1.829 -1.300
55 HD2 TYR 10 1HD TYR 10 3.668 -0.468 2.001
56 HE1 TYR 10 2HE TYR 10 6.101 3.527 0.284
57 HE2 TYR 10 1HE TYR 10 4.509 1.262 3.589
58 HH TYR 10 HH TYR 10 6.259 4.188 2.479
59 H SER 11 H SER 11 3.594 -3.745 -0.818
60 HA SER 11 HA SER 11 2.728 -4.079 -3.645
61 HB2 SER 11 1HB SER 11 4.813 -5.371 -3.342
62 HB3 SER 11 2HB SER 11 4.043 -6.281 -2.025
63 HG SER 11 HG SER 11 3.918 -7.322 -4.104
64 H CYS 12 H CYS 12 0.701 -4.769 -3.882
65 HA CYS 12 HA CYS 12 -1.159 -4.661 -1.832
66 HB2 CYS 12 1HB CYS 12 -1.684 -4.289 -4.137
67 HB3 CYS 12 2HB CYS 12 -1.300 -5.972 -4.544
68 HA PRO 13 HA PRO 13 -0.721 -8.775 -0.002
69 HB2 PRO 13 1HB PRO 13 -2.685 -8.659 1.892
70 HB3 PRO 13 2HB PRO 13 -1.162 -7.728 2.014
71 HG2 PRO 13 1HG PRO 13 -3.853 -6.763 0.997
72 HG3 PRO 13 2HG PRO 13 -2.774 -5.975 2.188
73 HD2 PRO 13 1HD PRO 13 -2.790 -5.288 -0.459
74 HD3 PRO 13 2HD PRO 13 -1.286 -5.262 0.512
75 H VAL 14 H VAL 14 -3.330 -7.693 -1.939
76 HA VAL 14 HA VAL 14 -4.711 -10.355 -1.844
77 HB VAL 14 HB VAL 14 -5.836 -7.752 -2.887
78 HG11 VAL 14 1HG1 VAL 14 -8.014 -8.915 -2.609
79 HG12 VAL 14 2HG1 VAL 14 -6.981 -9.737 -3.776
80 HG13 VAL 14 3HG1 VAL 14 -7.153 -10.395 -2.132
81 HG21 VAL 14 3HG2 VAL 14 -6.163 -9.018 -0.139
82 HG22 VAL 14 1HG2 VAL 14 -5.487 -7.415 -0.513
83 HG23 VAL 14 2HG2 VAL 14 -7.198 -7.721 -0.780
84 H CYS 15 H CYS 15 -3.272 -7.978 -4.103
85 HA CYS 15 HA CYS 15 -3.347 -10.062 -6.221
86 HB2 CYS 15 1HB CYS 15 -4.205 -8.632 -7.826
87 HB3 CYS 15 2HB CYS 15 -5.327 -8.637 -6.468
88 H GLU 16 H GLU 16 -1.284 -8.396 -4.547
89 HA GLU 16 HA GLU 16 0.908 -7.878 -4.682
90 HB2 GLU 16 1HB GLU 16 0.893 -9.932 -6.906
91 HB3 GLU 16 2HB GLU 16 2.301 -9.395 -5.985
92 HG2 GLU 16 1HG GLU 16 1.237 -10.207 -3.886
93 HG3 GLU 16 2HG GLU 16 -0.117 -10.839 -4.825
94 H LYS 17 H LYS 17 -0.815 -6.163 -6.464
95 HA LYS 17 HA LYS 17 1.047 -5.087 -8.450
96 HB2 LYS 17 1HB LYS 17 -1.505 -4.004 -7.202
97 HB3 LYS 17 2HB LYS 17 -0.561 -3.106 -8.403
98 HG2 LYS 17 1HG LYS 17 -0.863 -4.805 -10.084
99 HG3 LYS 17 2HG LYS 17 -1.512 -5.935 -8.900
100 HD2 LYS 17 1HD LYS 17 -3.445 -4.262 -8.549
101 HD3 LYS 17 2HD LYS 17 -2.820 -3.391 -9.950
102 HE2 LYS 17 1HE LYS 17 -4.643 -4.857 -10.620
103 HE3 LYS 17 2HE LYS 17 -3.136 -5.415 -11.356
104 HZ1 LYS 17 3HZ LYS 17 -3.011 -7.166 -9.727
105 HZ2 LYS 17 1HZ LYS 17 -4.535 -7.210 -10.325
106 HZ3 LYS 17 2HZ LYS 17 -4.228 -6.566 -8.837
107 H SER 18 H SER 18 2.345 -3.351 -8.327
108 HA SER 18 HA SER 18 3.378 -2.800 -5.625
109 HB2 SER 18 1HB SER 18 5.417 -2.030 -6.791
110 HB3 SER 18 2HB SER 18 4.971 -3.715 -7.108
111 HG SER 18 HG SER 18 5.560 -2.598 -9.031
112 H PHE 19 H PHE 19 3.851 -0.859 -4.756
113 HA PHE 19 HA PHE 19 2.950 1.660 -6.060
114 HB2 PHE 19 1HB PHE 19 2.071 0.719 -3.301
115 HB3 PHE 19 2HB PHE 19 1.717 2.283 -4.011
116 HD1 PHE 19 2HD PHE 19 0.216 2.444 -6.040
117 HD2 PHE 19 1HD PHE 19 0.766 -1.245 -3.867
118 HE1 PHE 19 2HE PHE 19 -1.764 1.471 -7.183
119 HE2 PHE 19 1HE PHE 19 -1.204 -2.212 -5.021
120 HZ PHE 19 HZ PHE 19 -2.451 -0.869 -6.703
121 H SER 20 H SER 20 3.774 3.576 -5.070
122 HA SER 20 HA SER 20 6.448 3.171 -3.833
123 HB2 SER 20 1HB SER 20 5.330 5.573 -5.308
124 HB3 SER 20 2HB SER 20 7.009 5.326 -4.790
125 HG SER 20 HG SER 20 6.690 4.774 -7.000
126 H GLU 21 H GLU 21 3.456 4.001 -2.627
127 HA GLU 21 HA GLU 21 4.626 5.398 -0.305
128 HB2 GLU 21 1HB GLU 21 2.219 6.524 -1.771
129 HB3 GLU 21 2HB GLU 21 2.921 7.128 -0.274
130 HG2 GLU 21 1HG GLU 21 5.011 7.710 -1.511
131 HG3 GLU 21 2HG GLU 21 4.220 7.234 -3.026
132 H ASP 22 H ASP 22 3.418 5.143 1.600
133 HA ASP 22 HA ASP 22 1.790 2.845 1.882
134 HB2 ASP 22 1HB ASP 22 3.149 3.879 3.662
135 HB3 ASP 22 2HB ASP 22 2.078 5.281 3.679
136 H ARG 23 H ARG 23 0.866 6.258 1.430
137 HA ARG 23 HA ARG 23 -1.979 5.849 1.766
138 HB2 ARG 23 1HB ARG 23 -2.244 8.084 0.850
139 HB3 ARG 23 2HB ARG 23 -0.996 8.033 2.092
140 HG2 ARG 23 1HG ARG 23 0.762 8.050 0.330
141 HG3 ARG 23 2HG ARG 23 -0.493 8.123 -0.924
142 HD2 ARG 23 1HD ARG 23 -1.261 10.283 -0.105
143 HD3 ARG 23 2HD ARG 23 -0.170 10.180 1.295
144 HE ARG 23 HE ARG 23 1.273 9.955 -1.218
145 HH11 ARG 23 2HH1 ARG 23 -0.231 12.463 0.719
146 HH12 ARG 23 1HH1 ARG 23 0.965 13.645 0.256
147 HH21 ARG 23 2HH2 ARG 23 2.857 11.386 -1.553
148 HH22 ARG 23 1HH2 ARG 23 2.651 13.063 -1.079
149 H LEU 24 H LEU 24 0.114 5.356 -1.009
150 HA LEU 24 HA LEU 24 -2.085 5.288 -2.945
151 HB2 LEU 24 1HB LEU 24 0.821 4.403 -3.095
152 HB3 LEU 24 2HB LEU 24 -0.309 4.268 -4.435
153 HG LEU 24 HG LEU 24 0.432 6.908 -3.110
154 HD11 LEU 24 1HD1 LEU 24 1.387 5.676 -5.735
155 HD12 LEU 24 2HD1 LEU 24 2.361 5.851 -4.257
156 HD13 LEU 24 3HD1 LEU 24 1.801 7.291 -5.116
157 HD21 LEU 24 3HD2 LEU 24 -1.082 6.286 -5.684
158 HD22 LEU 24 1HD2 LEU 24 -0.541 7.900 -5.169
159 HD23 LEU 24 2HD2 LEU 24 -1.750 7.041 -4.216
160 H ILE 25 H ILE 25 -0.138 2.773 -1.230
161 HA ILE 25 HA ILE 25 -1.737 0.640 -2.339
162 HB ILE 25 HB ILE 25 0.508 0.223 -1.536
163 HG12 ILE 25 1HG1 ILE 25 -1.578 -1.387 -0.006
164 HG13 ILE 25 2HG1 ILE 25 -1.249 -1.560 -1.732
165 HG21 ILE 25 1HG2 ILE 25 -0.588 0.532 1.292
166 HG22 ILE 25 2HG2 ILE 25 1.062 0.068 0.839
167 HG23 ILE 25 3HG2 ILE 25 0.497 1.684 0.469
168 HD11 ILE 25 3HD1 ILE 25 -0.140 -3.295 -0.441
169 HD12 ILE 25 1HD1 ILE 25 1.063 -2.255 -1.236
170 HD13 ILE 25 2HD1 ILE 25 0.740 -2.110 0.514
171 H LYS 26 H LYS 26 -2.076 2.510 0.748
172 HA LYS 26 HA LYS 26 -4.398 1.077 1.654
173 HB2 LYS 26 1HB LYS 26 -3.396 3.909 2.116
174 HB3 LYS 26 2HB LYS 26 -4.954 3.365 2.750
175 HG2 LYS 26 1HG LYS 26 -3.882 1.500 3.941
176 HG3 LYS 26 2HG LYS 26 -2.290 2.012 3.351
177 HD2 LYS 26 1HD LYS 26 -2.472 4.135 4.566
178 HD3 LYS 26 2HD LYS 26 -4.154 3.793 4.985
179 HE2 LYS 26 1HE LYS 26 -2.837 3.377 6.932
180 HE3 LYS 26 2HE LYS 26 -3.436 1.828 6.330
181 HZ1 LYS 26 3HZ LYS 26 -0.709 2.910 5.828
182 HZ2 LYS 26 1HZ LYS 26 -1.232 1.446 5.348
183 HZ3 LYS 26 2HZ LYS 26 -1.060 1.761 6.942
184 H SER 27 H SER 27 -4.201 3.901 -0.559
185 HA SER 27 HA SER 27 -7.016 4.119 -1.014
186 HB2 SER 27 1HB SER 27 -4.720 4.744 -2.915
187 HB3 SER 27 2HB SER 27 -6.409 5.228 -3.135
188 HG SER 27 HG SER 27 -4.586 6.021 -1.107
189 H HIS 28 H HIS 28 -4.555 2.110 -2.737
190 HA HIS 28 HA HIS 28 -6.376 0.936 -4.587
191 HB2 HIS 28 1HB HIS 28 -3.990 0.796 -4.920
192 HB3 HIS 28 2HB HIS 28 -3.759 -0.054 -3.397
193 HD1 HIS 28 1HD HIS 28 -5.584 -0.742 -6.764
194 HD2 HIS 28 2HD HIS 28 -3.738 -2.641 -3.498
195 HE1 HIS 28 1HE HIS 28 -5.587 -3.216 -7.317
196 H ILE 29 H ILE 29 -5.325 -0.300 -1.371
197 HA ILE 29 HA ILE 29 -6.928 -2.650 -1.394
198 HB ILE 29 HB ILE 29 -5.891 -0.947 0.895
199 HG12 ILE 29 1HG1 ILE 29 -4.976 -3.663 -0.183
200 HG13 ILE 29 2HG1 ILE 29 -4.215 -2.134 -0.603
201 HG21 ILE 29 1HG2 ILE 29 -7.849 -2.177 1.729
202 HG22 ILE 29 2HG2 ILE 29 -7.225 -3.692 1.042
203 HG23 ILE 29 3HG2 ILE 29 -6.394 -2.881 2.389
204 HD11 ILE 29 3HD1 ILE 29 -3.677 -1.751 1.813
205 HD12 ILE 29 1HD1 ILE 29 -4.249 -3.405 2.151
206 HD13 ILE 29 2HD1 ILE 29 -2.875 -3.152 1.075
207 H LYS 30 H LYS 30 -7.786 0.661 -0.293
208 HA LYS 30 HA LYS 30 -10.434 -0.094 0.592
209 HB2 LYS 30 1HB LYS 30 -9.137 2.582 -0.042
210 HB3 LYS 30 2HB LYS 30 -10.804 2.436 0.530
211 HG2 LYS 30 1HG LYS 30 -10.081 1.301 2.571
212 HG3 LYS 30 2HG LYS 30 -8.393 1.333 2.043
213 HD2 LYS 30 1HD LYS 30 -8.430 3.815 2.043
214 HD3 LYS 30 2HD LYS 30 -10.129 3.785 2.570
215 HE2 LYS 30 1HE LYS 30 -9.443 2.514 4.613
216 HE3 LYS 30 2HE LYS 30 -7.755 2.616 4.097
217 HZ1 LYS 30 3HZ LYS 30 -7.938 5.054 4.249
218 HZ2 LYS 30 1HZ LYS 30 -8.303 4.371 5.686
219 HZ3 LYS 30 2HZ LYS 30 -9.494 4.945 4.732
220 H THR 31 H THR 31 -9.298 1.033 -2.600
221 HA THR 31 HA THR 31 -12.035 1.333 -3.597
222 HB THR 31 HB THR 31 -10.834 1.824 -5.730
223 HG1 THR 31 1HG THR 31 -8.504 2.001 -4.199
224 HG21 THR 31 3HG2 THR 31 -11.490 3.669 -4.284
225 HG22 THR 31 1HG2 THR 31 -9.911 4.002 -5.014
226 HG23 THR 31 2HG2 THR 31 -10.016 3.486 -3.315
227 H ASN 32 H ASN 32 -9.396 -1.017 -4.012
228 HA ASN 32 HA ASN 32 -11.002 -2.514 -6.030
229 HB2 ASN 32 1HB ASN 32 -8.061 -2.581 -5.237
230 HB3 ASN 32 2HB ASN 32 -8.802 -3.743 -6.320
231 HD21 ASN 32 1HD2 ASN 32 -8.480 -0.113 -6.010
232 HD22 ASN 32 2HD2 ASN 32 -8.349 0.080 -7.746
233 H HIS 33 H HIS 33 -9.952 -2.839 -2.690
234 HA HIS 33 HA HIS 33 -11.084 -5.599 -2.593
235 HB2 HIS 33 1HB HIS 33 -8.599 -4.686 -1.115
236 HB3 HIS 33 2HB HIS 33 -9.246 -6.316 -1.237
237 HD1 HIS 33 1HD HIS 33 -9.445 -6.855 -4.255
238 HD2 HIS 33 2HD HIS 33 -6.441 -4.519 -2.488
239 HE1 HIS 33 1HE HIS 33 -7.522 -6.845 -5.910
240 HA PRO 34 HA PRO 34 -12.641 -2.435 0.649
241 HB2 PRO 34 1HB PRO 34 -15.333 -2.507 0.103
242 HB3 PRO 34 2HB PRO 34 -14.166 -1.402 -0.695
243 HG2 PRO 34 1HG PRO 34 -15.205 -4.074 -1.704
244 HG3 PRO 34 2HG PRO 34 -15.130 -2.510 -2.586
245 HD2 PRO 34 1HD PRO 34 -13.186 -4.340 -2.911
246 HD3 PRO 34 2HD PRO 34 -12.769 -2.608 -2.745
247 H GLU 35 H GLU 35 -13.885 -5.649 -0.253
248 HA GLU 35 HA GLU 35 -15.073 -6.115 2.407
249 HB2 GLU 35 1HB GLU 35 -15.714 -8.263 1.597
250 HB3 GLU 35 2HB GLU 35 -16.197 -7.029 0.449
251 HG2 GLU 35 1HG GLU 35 -13.673 -8.701 0.080
252 HG3 GLU 35 2HG GLU 35 -15.254 -9.246 -0.444
253 H VAL 36 H VAL 36 -11.994 -5.951 1.403
254 HA VAL 36 HA VAL 36 -10.930 -8.016 3.274
255 HB VAL 36 HB VAL 36 -9.225 -6.916 1.069
256 HG11 VAL 36 1HG1 VAL 36 -8.339 -8.575 2.683
257 HG12 VAL 36 2HG1 VAL 36 -9.621 -9.715 2.221
258 HG13 VAL 36 3HG1 VAL 36 -8.377 -9.238 1.046
259 HG21 VAL 36 3HG2 VAL 36 -11.367 -9.008 0.507
260 HG22 VAL 36 1HG2 VAL 36 -11.249 -7.396 -0.239
261 HG23 VAL 36 2HG2 VAL 36 -10.007 -8.605 -0.562
262 H SER 37 H SER 37 -11.435 -4.777 3.012
263 HA SER 37 HA SER 37 -8.922 -3.602 3.866
264 HB2 SER 37 1HB SER 37 -11.779 -2.560 3.854
265 HB3 SER 37 2HB SER 37 -10.351 -1.588 4.256
266 HG SER 37 HG SER 37 -10.508 -3.074 1.832
Start of MODEL 8
1 H1 GLY 1 1H GLY 1 24.387 -1.831 -7.329
2 H2 GLY 1 2H GLY 1 23.090 -1.782 -8.326
3 H3 GLY 1 3H GLY 1 23.405 -3.136 -7.461
4 HA2 GLY 1 1HA GLY 1 21.569 -1.937 -6.474
5 HA3 GLY 1 2HA GLY 1 22.969 -2.011 -5.388
6 H SER 2 H SER 2 20.845 -0.061 -5.314
7 HA SER 2 HA SER 2 21.679 2.441 -6.472
8 HB2 SER 2 1HB SER 2 19.791 1.908 -4.151
9 HB3 SER 2 2HB SER 2 19.935 3.424 -5.063
10 HG SER 2 HG SER 2 18.206 2.101 -5.823
11 H SER 3 H SER 3 22.534 4.281 -5.517
12 HA SER 3 HA SER 3 23.808 4.093 -2.824
13 HB2 SER 3 1HB SER 3 25.195 4.985 -5.384
14 HB3 SER 3 2HB SER 3 25.849 5.160 -3.747
15 HG SER 3 HG SER 3 26.631 3.275 -4.814
16 H GLY 4 H GLY 4 24.061 6.037 -1.745
17 HA2 GLY 4 1HA GLY 4 23.883 8.268 -1.229
18 HA3 GLY 4 2HA GLY 4 23.640 8.631 -2.934
19 H SER 5 H SER 5 21.221 6.503 -2.346
20 HA SER 5 HA SER 5 19.258 8.404 -1.165
21 HB2 SER 5 1HB SER 5 18.969 7.039 -3.872
22 HB3 SER 5 2HB SER 5 17.678 7.903 -3.019
23 HG SER 5 HG SER 5 18.734 9.219 -4.583
24 H SER 6 H SER 6 17.398 7.456 -0.335
25 HA SER 6 HA SER 6 17.220 4.482 -0.164
26 HB2 SER 6 1HB SER 6 17.135 6.399 2.199
27 HB3 SER 6 2HB SER 6 16.786 4.662 2.261
28 HG SER 6 HG SER 6 18.950 5.148 2.876
29 H GLY 7 H GLY 7 15.144 3.672 0.420
30 HA2 GLY 7 1HA GLY 7 12.827 5.214 0.981
31 HA3 GLY 7 2HA GLY 7 12.909 4.967 -0.764
32 H ARG 8 H ARG 8 10.766 3.956 0.104
33 HA ARG 8 HA ARG 8 11.103 1.006 0.139
34 HB2 ARG 8 1HB ARG 8 10.888 1.713 2.506
35 HB3 ARG 8 2HB ARG 8 9.369 2.537 2.135
36 HG2 ARG 8 1HG ARG 8 8.299 0.401 1.571
37 HG3 ARG 8 2HG ARG 8 9.843 -0.455 1.763
38 HD2 ARG 8 1HD ARG 8 9.864 0.191 4.175
39 HD3 ARG 8 2HD ARG 8 8.333 1.033 3.949
40 HE ARG 8 HE ARG 8 7.179 -0.997 3.785
41 HH11 ARG 8 2HH1 ARG 8 10.604 -1.732 3.987
42 HH12 ARG 8 1HH1 ARG 8 10.311 -3.423 4.286
43 HH21 ARG 8 2HH2 ARG 8 6.886 -3.157 4.194
44 HH22 ARG 8 1HH2 ARG 8 8.263 -4.199 4.398
45 H SER 9 H SER 9 9.489 -0.123 -0.808
46 HA SER 9 HA SER 9 7.085 1.282 -1.881
47 HB2 SER 9 1HB SER 9 8.724 -0.831 -3.324
48 HB3 SER 9 2HB SER 9 7.161 -0.185 -3.862
49 HG SER 9 HG SER 9 8.977 0.867 -4.849
50 H TYR 10 H TYR 10 5.256 -0.097 -2.193
51 HA TYR 10 HA TYR 10 5.088 -2.348 -0.215
52 HB2 TYR 10 1HB TYR 10 3.029 -0.174 -0.746
53 HB3 TYR 10 2HB TYR 10 2.976 -1.414 0.497
54 HD1 TYR 10 1HD TYR 10 4.625 1.744 -0.583
55 HD2 TYR 10 2HD TYR 10 4.118 -1.105 2.619
56 HE1 TYR 10 1HE TYR 10 5.767 3.305 0.990
57 HE2 TYR 10 2HE TYR 10 5.194 0.489 4.204
58 HH TYR 10 HH TYR 10 6.189 2.541 4.464
59 H SER 11 H SER 11 3.967 -4.168 -0.919
60 HA SER 11 HA SER 11 2.635 -4.020 -3.584
61 HB2 SER 11 1HB SER 11 3.241 -6.378 -3.880
62 HB3 SER 11 2HB SER 11 4.631 -5.286 -3.772
63 HG SER 11 HG SER 11 4.923 -7.180 -2.503
64 H CYS 12 H CYS 12 0.708 -4.907 -3.960
65 HA CYS 12 HA CYS 12 -1.181 -4.885 -1.948
66 HB2 CYS 12 1HB CYS 12 -1.653 -4.454 -4.262
67 HB3 CYS 12 2HB CYS 12 -1.275 -6.130 -4.697
68 HA PRO 13 HA PRO 13 -0.755 -9.041 -0.218
69 HB2 PRO 13 1HB PRO 13 -2.769 -8.986 1.625
70 HB3 PRO 13 2HB PRO 13 -1.257 -8.048 1.811
71 HG2 PRO 13 1HG PRO 13 -3.927 -7.077 0.744
72 HG3 PRO 13 2HG PRO 13 -2.887 -6.311 1.986
73 HD2 PRO 13 1HD PRO 13 -2.837 -5.556 -0.638
74 HD3 PRO 13 2HD PRO 13 -1.360 -5.545 0.370
75 H VAL 14 H VAL 14 -3.328 -7.920 -2.183
76 HA VAL 14 HA VAL 14 -4.649 -10.617 -2.251
77 HB VAL 14 HB VAL 14 -5.808 -7.933 -3.040
78 HG11 VAL 14 1HG1 VAL 14 -7.090 -10.690 -2.801
79 HG12 VAL 14 2HG1 VAL 14 -7.974 -9.170 -3.053
80 HG13 VAL 14 3HG1 VAL 14 -6.870 -9.751 -4.296
81 HG21 VAL 14 3HG2 VAL 14 -7.261 -8.221 -1.035
82 HG22 VAL 14 1HG2 VAL 14 -6.298 -9.640 -0.562
83 HG23 VAL 14 2HG2 VAL 14 -5.565 -8.020 -0.608
84 H CYS 15 H CYS 15 -3.293 -8.037 -4.337
85 HA CYS 15 HA CYS 15 -3.310 -9.952 -6.597
86 HB2 CYS 15 1HB CYS 15 -4.356 -8.533 -8.056
87 HB3 CYS 15 2HB CYS 15 -5.398 -8.661 -6.643
88 H GLU 16 H GLU 16 -1.268 -8.761 -4.920
89 HA GLU 16 HA GLU 16 0.938 -8.344 -4.949
90 HB2 GLU 16 1HB GLU 16 0.735 -9.663 -7.669
91 HB3 GLU 16 2HB GLU 16 2.208 -9.492 -6.712
92 HG2 GLU 16 1HG GLU 16 1.154 -10.801 -4.866
93 HG3 GLU 16 2HG GLU 16 -0.263 -11.070 -5.883
94 H LYS 17 H LYS 17 -0.687 -6.363 -7.139
95 HA LYS 17 HA LYS 17 1.474 -5.062 -8.477
96 HB2 LYS 17 1HB LYS 17 -1.326 -4.219 -7.693
97 HB3 LYS 17 2HB LYS 17 -0.231 -3.065 -8.459
98 HG2 LYS 17 1HG LYS 17 0.035 -4.368 -10.420
99 HG3 LYS 17 2HG LYS 17 -0.709 -5.794 -9.710
100 HD2 LYS 17 1HD LYS 17 -2.194 -3.170 -10.205
101 HD3 LYS 17 2HD LYS 17 -2.159 -4.511 -11.361
102 HE2 LYS 17 1HE LYS 17 -3.264 -4.588 -8.527
103 HE3 LYS 17 2HE LYS 17 -4.224 -4.482 -10.003
104 HZ1 LYS 17 3HZ LYS 17 -2.458 -6.784 -9.327
105 HZ2 LYS 17 1HZ LYS 17 -3.513 -6.700 -10.598
106 HZ3 LYS 17 2HZ LYS 17 -4.033 -6.717 -9.023
107 H SER 18 H SER 18 2.642 -3.211 -8.125
108 HA SER 18 HA SER 18 3.188 -2.677 -5.254
109 HB2 SER 18 1HB SER 18 5.004 -2.450 -7.662
110 HB3 SER 18 2HB SER 18 5.452 -2.064 -5.988
111 HG SER 18 HG SER 18 6.020 -4.224 -6.620
112 H PHE 19 H PHE 19 3.576 -0.730 -4.414
113 HA PHE 19 HA PHE 19 2.919 1.749 -5.944
114 HB2 PHE 19 1HB PHE 19 1.850 0.886 -3.229
115 HB3 PHE 19 2HB PHE 19 1.487 2.398 -4.045
116 HD1 PHE 19 2HD PHE 19 0.144 2.391 -6.191
117 HD2 PHE 19 1HD PHE 19 0.693 -1.170 -3.817
118 HE1 PHE 19 2HE PHE 19 -1.656 1.253 -7.472
119 HE2 PHE 19 1HE PHE 19 -1.113 -2.296 -5.097
120 HZ PHE 19 HZ PHE 19 -2.256 -1.100 -6.948
121 H SER 20 H SER 20 3.928 3.645 -5.212
122 HA SER 20 HA SER 20 6.449 3.182 -3.819
123 HB2 SER 20 1HB SER 20 6.956 5.485 -4.606
124 HB3 SER 20 2HB SER 20 6.484 4.363 -5.892
125 HG SER 20 HG SER 20 5.419 6.399 -6.072
126 H GLU 21 H GLU 21 3.433 4.182 -2.645
127 HA GLU 21 HA GLU 21 4.664 5.254 -0.171
128 HB2 GLU 21 1HB GLU 21 2.408 6.688 -1.625
129 HB3 GLU 21 2HB GLU 21 3.062 7.098 -0.041
130 HG2 GLU 21 1HG GLU 21 5.289 7.538 -1.126
131 HG3 GLU 21 2HG GLU 21 4.517 7.318 -2.706
132 H ASP 22 H ASP 22 3.343 5.058 1.696
133 HA ASP 22 HA ASP 22 1.715 2.737 1.783
134 HB2 ASP 22 1HB ASP 22 1.406 3.229 4.089
135 HB3 ASP 22 2HB ASP 22 3.065 3.620 3.660
136 H ARG 23 H ARG 23 0.808 6.165 1.490
137 HA ARG 23 HA ARG 23 -2.042 5.769 1.781
138 HB2 ARG 23 1HB ARG 23 -2.279 8.009 0.899
139 HB3 ARG 23 2HB ARG 23 -0.995 7.950 2.106
140 HG2 ARG 23 1HG ARG 23 0.714 7.944 0.299
141 HG3 ARG 23 2HG ARG 23 -0.573 7.991 -0.921
142 HD2 ARG 23 1HD ARG 23 -1.346 10.154 -0.070
143 HD3 ARG 23 2HD ARG 23 -0.112 10.115 1.209
144 HE ARG 23 HE ARG 23 1.292 9.784 -1.206
145 HH11 ARG 23 2HH1 ARG 23 -0.658 12.401 0.110
146 HH12 ARG 23 1HH1 ARG 23 0.259 13.593 -0.775
147 HH21 ARG 23 2HH2 ARG 23 2.364 11.214 -2.168
148 HH22 ARG 23 1HH2 ARG 23 1.981 12.939 -2.089
149 H LEU 24 H LEU 24 0.085 5.276 -0.961
150 HA LEU 24 HA LEU 24 -2.086 5.284 -2.933
151 HB2 LEU 24 1HB LEU 24 0.824 4.418 -3.094
152 HB3 LEU 24 2HB LEU 24 -0.289 4.416 -4.458
153 HG LEU 24 HG LEU 24 0.511 6.902 -2.882
154 HD11 LEU 24 1HD1 LEU 24 1.393 5.930 -5.632
155 HD12 LEU 24 2HD1 LEU 24 2.391 5.936 -4.161
156 HD13 LEU 24 3HD1 LEU 24 1.851 7.465 -4.858
157 HD21 LEU 24 3HD2 LEU 24 -1.686 7.210 -3.918
158 HD22 LEU 24 1HD2 LEU 24 -1.071 6.590 -5.468
159 HD23 LEU 24 2HD2 LEU 24 -0.471 8.128 -4.808
160 H ILE 25 H ILE 25 -0.185 2.724 -1.241
161 HA ILE 25 HA ILE 25 -1.761 0.621 -2.454
162 HB ILE 25 HB ILE 25 0.456 0.167 -1.580
163 HG12 ILE 25 1HG1 ILE 25 -1.677 -1.468 -0.148
164 HG13 ILE 25 2HG1 ILE 25 -1.340 -1.580 -1.878
165 HG21 ILE 25 1HG2 ILE 25 -0.744 0.436 1.211
166 HG22 ILE 25 2HG2 ILE 25 0.908 -0.064 0.816
167 HG23 ILE 25 3HG2 ILE 25 0.400 1.574 0.449
168 HD11 ILE 25 3HD1 ILE 25 0.970 -2.288 -1.399
169 HD12 ILE 25 1HD1 ILE 25 0.631 -2.232 0.351
170 HD13 ILE 25 2HD1 ILE 25 -0.240 -3.370 -0.672
171 H LYS 26 H LYS 26 -2.163 2.442 0.651
172 HA LYS 26 HA LYS 26 -4.513 0.976 1.453
173 HB2 LYS 26 1HB LYS 26 -3.450 3.737 2.103
174 HB3 LYS 26 2HB LYS 26 -5.023 3.196 2.705
175 HG2 LYS 26 1HG LYS 26 -4.051 1.243 3.774
176 HG3 LYS 26 2HG LYS 26 -2.444 1.626 3.153
177 HD2 LYS 26 1HD LYS 26 -4.009 3.465 5.026
178 HD3 LYS 26 2HD LYS 26 -2.870 2.222 5.578
179 HE2 LYS 26 1HE LYS 26 -1.076 3.255 4.206
180 HE3 LYS 26 2HE LYS 26 -2.179 4.541 3.721
181 HZ1 LYS 26 3HZ LYS 26 -1.383 3.996 6.530
182 HZ2 LYS 26 1HZ LYS 26 -2.299 5.258 6.023
183 HZ3 LYS 26 2HZ LYS 26 -0.717 5.143 5.576
184 H SER 27 H SER 27 -4.232 3.874 -0.640
185 HA SER 27 HA SER 27 -7.019 4.157 -1.177
186 HB2 SER 27 1HB SER 27 -5.289 5.816 -1.780
187 HB3 SER 27 2HB SER 27 -4.667 4.715 -3.026
188 HG SER 27 HG SER 27 -6.166 6.289 -3.841
189 H HIS 28 H HIS 28 -4.548 2.144 -2.891
190 HA HIS 28 HA HIS 28 -6.314 0.985 -4.790
191 HB2 HIS 28 1HB HIS 28 -3.931 0.799 -5.058
192 HB3 HIS 28 2HB HIS 28 -3.744 -0.014 -3.513
193 HD1 HIS 28 1HD HIS 28 -5.081 -0.772 -7.045
194 HD2 HIS 28 2HD HIS 28 -4.023 -2.626 -3.424
195 HE1 HIS 28 1HE HIS 28 -5.052 -3.258 -7.533
196 H ILE 29 H ILE 29 -5.396 -0.258 -1.550
197 HA ILE 29 HA ILE 29 -7.040 -2.589 -1.616
198 HB ILE 29 HB ILE 29 -5.949 -0.918 0.677
199 HG12 ILE 29 1HG1 ILE 29 -5.154 -3.671 -0.405
200 HG13 ILE 29 2HG1 ILE 29 -4.331 -2.173 -0.819
201 HG21 ILE 29 1HG2 ILE 29 -7.379 -3.607 0.841
202 HG22 ILE 29 2HG2 ILE 29 -6.526 -2.817 2.184
203 HG23 ILE 29 3HG2 ILE 29 -7.963 -2.072 1.523
204 HD11 ILE 29 3HD1 ILE 29 -3.756 -1.835 1.593
205 HD12 ILE 29 1HD1 ILE 29 -4.414 -3.458 1.929
206 HD13 ILE 29 2HD1 ILE 29 -3.033 -3.273 0.845
207 H LYS 30 H LYS 30 -7.839 0.739 -0.539
208 HA LYS 30 HA LYS 30 -10.518 -0.007 0.322
209 HB2 LYS 30 1HB LYS 30 -9.129 2.654 -0.132
210 HB3 LYS 30 2HB LYS 30 -10.807 2.532 0.418
211 HG2 LYS 30 1HG LYS 30 -10.177 1.286 2.396
212 HG3 LYS 30 2HG LYS 30 -8.490 1.183 1.875
213 HD2 LYS 30 1HD LYS 30 -8.301 3.655 1.970
214 HD3 LYS 30 2HD LYS 30 -9.966 3.770 2.555
215 HE2 LYS 30 1HE LYS 30 -7.728 2.226 3.955
216 HE3 LYS 30 2HE LYS 30 -8.158 3.896 4.330
217 HZ1 LYS 30 3HZ LYS 30 -9.260 2.382 5.847
218 HZ2 LYS 30 1HZ LYS 30 -9.988 1.564 4.642
219 HZ3 LYS 30 2HZ LYS 30 -10.391 3.121 4.936
220 H THR 31 H THR 31 -9.293 0.867 -2.849
221 HA THR 31 HA THR 31 -12.027 1.262 -3.896
222 HB THR 31 HB THR 31 -10.752 1.714 -6.007
223 HG1 THR 31 1HG THR 31 -8.518 2.024 -4.353
224 HG21 THR 31 3HG2 THR 31 -11.559 3.560 -4.611
225 HG22 THR 31 1HG2 THR 31 -9.983 3.953 -5.320
226 HG23 THR 31 2HG2 THR 31 -10.094 3.475 -3.611
227 H ASN 32 H ASN 32 -9.486 -1.206 -3.966
228 HA ASN 32 HA ASN 32 -11.048 -2.772 -5.986
229 HB2 ASN 32 1HB ASN 32 -8.126 -2.929 -5.131
230 HB3 ASN 32 2HB ASN 32 -8.905 -4.004 -6.281
231 HD21 ASN 32 1HD2 ASN 32 -8.045 -0.570 -5.754
232 HD22 ASN 32 2HD2 ASN 32 -8.039 -0.179 -7.467
233 H HIS 33 H HIS 33 -9.922 -2.954 -2.639
234 HA HIS 33 HA HIS 33 -11.108 -5.674 -2.365
235 HB2 HIS 33 1HB HIS 33 -8.521 -4.833 -1.037
236 HB3 HIS 33 2HB HIS 33 -9.200 -6.451 -1.171
237 HD1 HIS 33 1HD HIS 33 -9.458 -6.916 -4.211
238 HD2 HIS 33 2HD HIS 33 -6.424 -4.610 -2.451
239 HE1 HIS 33 1HE HIS 33 -7.581 -6.830 -5.919
240 HA PRO 34 HA PRO 34 -12.032 -2.231 0.888
241 HB2 PRO 34 1HB PRO 34 -14.774 -1.986 0.653
242 HB3 PRO 34 2HB PRO 34 -13.587 -1.057 -0.309
243 HG2 PRO 34 1HG PRO 34 -15.018 -3.623 -1.085
244 HG3 PRO 34 2HG PRO 34 -14.872 -2.107 -2.039
245 HD2 PRO 34 1HD PRO 34 -13.196 -4.159 -2.499
246 HD3 PRO 34 2HD PRO 34 -12.567 -2.482 -2.447
247 H GLU 35 H GLU 35 -13.474 -5.380 0.369
248 HA GLU 35 HA GLU 35 -14.832 -5.747 2.833
249 HB2 GLU 35 1HB GLU 35 -14.680 -8.120 2.353
250 HB3 GLU 35 2HB GLU 35 -15.091 -7.212 0.900
251 HG2 GLU 35 1HG GLU 35 -12.720 -7.376 0.130
252 HG3 GLU 35 2HG GLU 35 -12.315 -8.291 1.583
253 H VAL 36 H VAL 36 -11.393 -5.530 2.336
254 HA VAL 36 HA VAL 36 -10.800 -6.835 4.932
255 HB VAL 36 HB VAL 36 -9.486 -7.141 2.727
256 HG11 VAL 36 1HG1 VAL 36 -7.981 -4.700 3.745
257 HG12 VAL 36 2HG1 VAL 36 -7.639 -5.688 2.312
258 HG13 VAL 36 3HG1 VAL 36 -9.086 -4.668 2.361
259 HG21 VAL 36 3HG2 VAL 36 -7.962 -6.647 5.308
260 HG22 VAL 36 1HG2 VAL 36 -8.841 -8.132 4.876
261 HG23 VAL 36 2HG2 VAL 36 -7.437 -7.623 3.923
262 H SER 37 H SER 37 -11.704 -3.751 3.978
263 HA SER 37 HA SER 37 -9.938 -2.147 5.664
264 HB2 SER 37 1HB SER 37 -10.980 -1.385 3.505
265 HB3 SER 37 2HB SER 37 -12.548 -1.341 4.334
266 HG SER 37 HG SER 37 -11.682 0.180 5.792
Start of MODEL 9
1 H1 GLY 1 1H GLY 1 21.941 -7.269 -11.839
2 H2 GLY 1 2H GLY 1 21.278 -5.912 -11.202
3 H3 GLY 1 3H GLY 1 20.707 -6.517 -12.613
4 HA2 GLY 1 1HA GLY 1 19.913 -8.509 -11.514
5 HA3 GLY 1 2HA GLY 1 20.517 -7.841 -9.987
6 H SER 2 H SER 2 18.286 -8.111 -9.250
7 HA SER 2 HA SER 2 16.071 -6.710 -10.379
8 HB2 SER 2 1HB SER 2 16.469 -7.676 -7.524
9 HB3 SER 2 2HB SER 2 14.925 -7.253 -8.289
10 HG SER 2 HG SER 2 15.327 -9.518 -8.338
11 H SER 3 H SER 3 14.896 -4.904 -9.639
12 HA SER 3 HA SER 3 16.473 -2.653 -8.659
13 HB2 SER 3 1HB SER 3 14.373 -1.387 -9.035
14 HB3 SER 3 2HB SER 3 14.925 -2.286 -10.454
15 HG SER 3 HG SER 3 12.667 -2.534 -10.091
16 H GLY 4 H GLY 4 15.690 -1.210 -6.947
17 HA2 GLY 4 1HA GLY 4 13.895 -1.975 -4.873
18 HA3 GLY 4 2HA GLY 4 15.532 -2.442 -4.405
19 H SER 5 H SER 5 14.537 -0.764 -2.722
20 HA SER 5 HA SER 5 15.980 1.779 -3.130
21 HB2 SER 5 1HB SER 5 13.752 2.314 -3.980
22 HB3 SER 5 2HB SER 5 13.000 1.664 -2.511
23 HG SER 5 HG SER 5 13.318 4.012 -2.585
24 H SER 6 H SER 6 16.696 2.707 -1.235
25 HA SER 6 HA SER 6 16.638 1.221 1.266
26 HB2 SER 6 1HB SER 6 17.844 3.213 2.134
27 HB3 SER 6 2HB SER 6 18.589 2.508 0.689
28 HG SER 6 HG SER 6 18.437 4.805 0.565
29 H GLY 7 H GLY 7 14.637 3.712 -0.170
30 HA2 GLY 7 1HA GLY 7 13.181 4.395 2.295
31 HA3 GLY 7 2HA GLY 7 12.793 4.875 0.640
32 H ARG 8 H ARG 8 13.162 1.749 0.191
33 HA ARG 8 HA ARG 8 11.872 -0.014 -0.299
34 HB2 ARG 8 1HB ARG 8 10.396 0.663 2.275
35 HB3 ARG 8 2HB ARG 8 10.274 -0.856 1.416
36 HG2 ARG 8 1HG ARG 8 12.853 0.220 2.647
37 HG3 ARG 8 2HG ARG 8 11.773 -0.973 3.371
38 HD2 ARG 8 1HD ARG 8 12.146 -2.485 1.427
39 HD3 ARG 8 2HD ARG 8 13.290 -1.332 0.751
40 HE ARG 8 HE ARG 8 13.615 -2.881 3.292
41 HH11 ARG 8 2HH1 ARG 8 15.223 -0.999 0.776
42 HH12 ARG 8 1HH1 ARG 8 16.799 -1.539 1.305
43 HH21 ARG 8 2HH2 ARG 8 15.651 -3.439 3.915
44 HH22 ARG 8 1HH2 ARG 8 17.030 -2.827 3.051
45 H SER 9 H SER 9 9.818 -0.938 -0.824
46 HA SER 9 HA SER 9 7.743 0.985 -1.770
47 HB2 SER 9 1HB SER 9 8.844 -1.362 -3.361
48 HB3 SER 9 2HB SER 9 7.493 -0.315 -3.833
49 HG SER 9 HG SER 9 9.480 0.322 -4.808
50 H TYR 10 H TYR 10 5.663 -0.061 -2.180
51 HA TYR 10 HA TYR 10 5.107 -2.253 -0.221
52 HB2 TYR 10 1HB TYR 10 3.280 -0.032 -1.194
53 HB3 TYR 10 2HB TYR 10 2.932 -1.219 0.055
54 HD1 TYR 10 1HD TYR 10 3.976 -1.061 2.294
55 HD2 TYR 10 2HD TYR 10 4.790 1.867 -0.769
56 HE1 TYR 10 1HE TYR 10 5.025 0.435 3.993
57 HE2 TYR 10 2HE TYR 10 5.878 3.335 0.923
58 HH TYR 10 HH TYR 10 6.435 3.614 3.129
59 H SER 11 H SER 11 3.527 -3.865 -0.786
60 HA SER 11 HA SER 11 2.565 -3.880 -3.578
61 HB2 SER 11 1HB SER 11 3.133 -6.252 -3.873
62 HB3 SER 11 2HB SER 11 4.549 -5.199 -3.740
63 HG SER 11 HG SER 11 4.779 -7.098 -2.475
64 H CYS 12 H CYS 12 0.624 -4.746 -3.952
65 HA CYS 12 HA CYS 12 -1.285 -4.641 -1.978
66 HB2 CYS 12 1HB CYS 12 -1.745 -4.320 -4.301
67 HB3 CYS 12 2HB CYS 12 -1.321 -5.997 -4.675
68 HA PRO 13 HA PRO 13 -0.967 -8.683 0.002
69 HB2 PRO 13 1HB PRO 13 -3.120 -8.561 1.685
70 HB3 PRO 13 2HB PRO 13 -1.633 -7.599 1.930
71 HG2 PRO 13 1HG PRO 13 -4.221 -6.716 0.613
72 HG3 PRO 13 2HG PRO 13 -3.288 -5.875 1.891
73 HD2 PRO 13 1HD PRO 13 -3.031 -5.241 -0.747
74 HD3 PRO 13 2HD PRO 13 -1.630 -5.198 0.363
75 H VAL 14 H VAL 14 -3.442 -7.750 -2.191
76 HA VAL 14 HA VAL 14 -4.666 -10.495 -2.175
77 HB VAL 14 HB VAL 14 -5.899 -7.891 -3.106
78 HG11 VAL 14 1HG1 VAL 14 -7.074 -10.693 -2.846
79 HG12 VAL 14 2HG1 VAL 14 -8.013 -9.221 -3.166
80 HG13 VAL 14 3HG1 VAL 14 -6.839 -9.780 -4.355
81 HG21 VAL 14 3HG2 VAL 14 -5.755 -7.907 -0.663
82 HG22 VAL 14 1HG2 VAL 14 -7.420 -8.195 -1.156
83 HG23 VAL 14 2HG2 VAL 14 -6.420 -9.556 -0.606
84 H CYS 15 H CYS 15 -3.335 -7.972 -4.341
85 HA CYS 15 HA CYS 15 -3.229 -10.010 -6.503
86 HB2 CYS 15 1HB CYS 15 -4.084 -8.586 -8.099
87 HB3 CYS 15 2HB CYS 15 -5.247 -8.655 -6.780
88 H GLU 16 H GLU 16 -1.296 -8.458 -4.699
89 HA GLU 16 HA GLU 16 0.898 -7.980 -4.648
90 HB2 GLU 16 1HB GLU 16 0.997 -9.753 -7.101
91 HB3 GLU 16 2HB GLU 16 2.358 -9.342 -6.057
92 HG2 GLU 16 1HG GLU 16 1.181 -10.379 -4.119
93 HG3 GLU 16 2HG GLU 16 -0.119 -10.891 -5.199
94 H LYS 17 H LYS 17 -0.749 -6.256 -6.805
95 HA LYS 17 HA LYS 17 1.244 -5.045 -8.463
96 HB2 LYS 17 1HB LYS 17 -1.363 -3.976 -7.319
97 HB3 LYS 17 2HB LYS 17 -0.371 -3.066 -8.472
98 HG2 LYS 17 1HG LYS 17 -0.612 -4.736 -10.185
99 HG3 LYS 17 2HG LYS 17 -1.291 -5.891 -9.041
100 HD2 LYS 17 1HD LYS 17 -3.248 -4.233 -8.726
101 HD3 LYS 17 2HD LYS 17 -2.584 -3.343 -10.098
102 HE2 LYS 17 1HE LYS 17 -4.365 -4.810 -10.856
103 HE3 LYS 17 2HE LYS 17 -2.828 -5.367 -11.528
104 HZ1 LYS 17 3HZ LYS 17 -4.256 -7.169 -10.570
105 HZ2 LYS 17 1HZ LYS 17 -4.051 -6.522 -9.067
106 HZ3 LYS 17 2HZ LYS 17 -2.774 -7.114 -9.877
107 H SER 18 H SER 18 2.519 -3.290 -8.270
108 HA SER 18 HA SER 18 3.438 -2.763 -5.521
109 HB2 SER 18 1HB SER 18 5.514 -1.966 -6.598
110 HB3 SER 18 2HB SER 18 5.092 -3.647 -6.961
111 HG SER 18 HG SER 18 5.743 -2.492 -8.842
112 H PHE 19 H PHE 19 3.894 -0.821 -4.623
113 HA PHE 19 HA PHE 19 2.938 1.695 -5.899
114 HB2 PHE 19 1HB PHE 19 2.081 0.632 -3.181
115 HB3 PHE 19 2HB PHE 19 1.693 2.218 -3.822
116 HD1 PHE 19 2HD PHE 19 0.228 2.419 -5.892
117 HD2 PHE 19 1HD PHE 19 0.785 -1.316 -3.805
118 HE1 PHE 19 2HE PHE 19 -1.748 1.469 -7.059
119 HE2 PHE 19 1HE PHE 19 -1.181 -2.260 -4.982
120 HZ PHE 19 HZ PHE 19 -2.433 -0.882 -6.630
121 H SER 20 H SER 20 3.975 3.537 -5.239
122 HA SER 20 HA SER 20 6.559 3.192 -3.971
123 HB2 SER 20 1HB SER 20 5.208 5.725 -4.963
124 HB3 SER 20 2HB SER 20 6.934 5.505 -4.616
125 HG SER 20 HG SER 20 6.468 5.281 -6.857
126 H GLU 21 H GLU 21 3.491 4.173 -2.691
127 HA GLU 21 HA GLU 21 4.724 5.146 -0.168
128 HB2 GLU 21 1HB GLU 21 2.601 6.692 -1.707
129 HB3 GLU 21 2HB GLU 21 3.224 7.084 -0.106
130 HG2 GLU 21 1HG GLU 21 5.505 7.396 -1.116
131 HG3 GLU 21 2HG GLU 21 4.784 7.178 -2.719
132 H ASP 22 H ASP 22 3.339 5.040 1.662
133 HA ASP 22 HA ASP 22 1.567 2.853 1.795
134 HB2 ASP 22 1HB ASP 22 2.759 3.742 3.716
135 HB3 ASP 22 2HB ASP 22 1.865 5.262 3.615
136 H ARG 23 H ARG 23 0.782 6.342 1.411
137 HA ARG 23 HA ARG 23 -2.055 6.070 1.544
138 HB2 ARG 23 1HB ARG 23 -2.177 8.256 0.503
139 HB3 ARG 23 2HB ARG 23 -0.924 8.225 1.740
140 HG2 ARG 23 1HG ARG 23 0.822 8.032 -0.022
141 HG3 ARG 23 2HG ARG 23 -0.438 8.046 -1.273
142 HD2 ARG 23 1HD ARG 23 -1.144 10.284 -0.597
143 HD3 ARG 23 2HD ARG 23 0.044 10.290 0.723
144 HE ARG 23 HE ARG 23 1.570 9.774 -1.549
145 HH11 ARG 23 2HH1 ARG 23 -0.507 12.481 -0.685
146 HH12 ARG 23 1HH1 ARG 23 0.442 13.581 -1.650
147 HH21 ARG 23 2HH2 ARG 23 2.672 11.107 -2.616
148 HH22 ARG 23 1HH2 ARG 23 2.253 12.819 -2.766
149 H LEU 24 H LEU 24 0.085 5.306 -1.118
150 HA LEU 24 HA LEU 24 -2.049 5.285 -3.135
151 HB2 LEU 24 1HB LEU 24 0.815 4.268 -3.221
152 HB3 LEU 24 2HB LEU 24 -0.278 4.352 -4.600
153 HG LEU 24 HG LEU 24 0.707 6.763 -3.013
154 HD11 LEU 24 1HD1 LEU 24 1.519 5.729 -5.759
155 HD12 LEU 24 2HD1 LEU 24 2.509 5.660 -4.281
156 HD13 LEU 24 3HD1 LEU 24 2.088 7.227 -4.985
157 HD21 LEU 24 3HD2 LEU 24 -0.884 6.591 -5.607
158 HD22 LEU 24 1HD2 LEU 24 -0.178 8.073 -4.924
159 HD23 LEU 24 2HD2 LEU 24 -1.464 7.235 -4.052
160 H ILE 25 H ILE 25 -0.199 2.761 -1.328
161 HA ILE 25 HA ILE 25 -1.806 0.630 -2.458
162 HB ILE 25 HB ILE 25 0.417 0.170 -1.616
163 HG12 ILE 25 1HG1 ILE 25 -1.724 -1.355 -0.075
164 HG13 ILE 25 2HG1 ILE 25 -1.366 -1.577 -1.790
165 HG21 ILE 25 1HG2 ILE 25 0.938 0.049 0.775
166 HG22 ILE 25 2HG2 ILE 25 0.454 1.673 0.335
167 HG23 ILE 25 3HG2 ILE 25 -0.693 0.606 1.191
168 HD11 ILE 25 3HD1 ILE 25 -0.316 -3.308 -0.470
169 HD12 ILE 25 1HD1 ILE 25 0.937 -2.283 -1.213
170 HD13 ILE 25 2HD1 ILE 25 0.541 -2.132 0.522
171 H LYS 26 H LYS 26 -2.139 2.562 0.576
172 HA LYS 26 HA LYS 26 -4.447 1.120 1.529
173 HB2 LYS 26 1HB LYS 26 -3.546 3.998 1.947
174 HB3 LYS 26 2HB LYS 26 -4.926 3.287 2.774
175 HG2 LYS 26 1HG LYS 26 -2.082 2.205 2.979
176 HG3 LYS 26 2HG LYS 26 -2.831 3.319 4.125
177 HD2 LYS 26 1HD LYS 26 -4.629 1.569 4.511
178 HD3 LYS 26 2HD LYS 26 -3.671 0.444 3.538
179 HE2 LYS 26 1HE LYS 26 -2.753 1.851 6.089
180 HE3 LYS 26 2HE LYS 26 -3.316 0.181 5.983
181 HZ1 LYS 26 3HZ LYS 26 -1.411 -0.247 4.465
182 HZ2 LYS 26 1HZ LYS 26 -0.927 0.223 5.952
183 HZ3 LYS 26 2HZ LYS 26 -0.849 1.278 4.722
184 H SER 27 H SER 27 -4.251 3.954 -0.671
185 HA SER 27 HA SER 27 -7.046 4.194 -1.154
186 HB2 SER 27 1HB SER 27 -5.357 5.839 -1.875
187 HB3 SER 27 2HB SER 27 -4.744 4.690 -3.081
188 HG SER 27 HG SER 27 -6.278 6.207 -3.938
189 H HIS 28 H HIS 28 -4.616 2.126 -2.874
190 HA HIS 28 HA HIS 28 -6.454 0.892 -4.647
191 HB2 HIS 28 1HB HIS 28 -4.052 0.759 -4.949
192 HB3 HIS 28 2HB HIS 28 -3.855 -0.125 -3.442
193 HD1 HIS 28 1HD HIS 28 -5.658 -0.714 -6.839
194 HD2 HIS 28 2HD HIS 28 -3.816 -2.703 -3.624
195 HE1 HIS 28 1HE HIS 28 -5.633 -3.168 -7.475
196 H ILE 29 H ILE 29 -5.439 -0.214 -1.379
197 HA ILE 29 HA ILE 29 -7.058 -2.561 -1.313
198 HB ILE 29 HB ILE 29 -5.993 -0.771 0.896
199 HG12 ILE 29 1HG1 ILE 29 -5.162 -3.566 -0.038
200 HG13 ILE 29 2HG1 ILE 29 -4.373 -2.081 -0.555
201 HG21 ILE 29 1HG2 ILE 29 -7.982 -1.891 1.803
202 HG22 ILE 29 2HG2 ILE 29 -7.413 -3.462 1.190
203 HG23 ILE 29 3HG2 ILE 29 -6.546 -2.614 2.489
204 HD11 ILE 29 3HD1 ILE 29 -3.037 -3.051 1.167
205 HD12 ILE 29 1HD1 ILE 29 -3.773 -1.574 1.815
206 HD13 ILE 29 2HD1 ILE 29 -4.405 -3.177 2.276
207 H LYS 30 H LYS 30 -7.911 0.810 -0.365
208 HA LYS 30 HA LYS 30 -10.591 0.027 0.482
209 HB2 LYS 30 1HB LYS 30 -9.375 2.751 -0.134
210 HB3 LYS 30 2HB LYS 30 -11.002 2.526 0.492
211 HG2 LYS 30 1HG LYS 30 -8.407 1.803 1.905
212 HG3 LYS 30 2HG LYS 30 -9.499 3.122 2.293
213 HD2 LYS 30 1HD LYS 30 -10.016 0.143 2.634
214 HD3 LYS 30 2HD LYS 30 -9.725 1.333 3.901
215 HE2 LYS 30 1HE LYS 30 -11.835 2.523 3.229
216 HE3 LYS 30 2HE LYS 30 -12.144 1.245 2.044
217 HZ1 LYS 30 3HZ LYS 30 -12.141 -0.357 3.919
218 HZ2 LYS 30 1HZ LYS 30 -13.322 0.766 4.089
219 HZ3 LYS 30 2HZ LYS 30 -11.961 0.867 4.984
220 H THR 31 H THR 31 -9.355 1.061 -2.680
221 HA THR 31 HA THR 31 -12.063 1.383 -3.754
222 HB THR 31 HB THR 31 -10.797 1.754 -5.877
223 HG1 THR 31 1HG THR 31 -8.515 1.966 -4.286
224 HG21 THR 31 3HG2 THR 31 -10.013 3.510 -3.519
225 HG22 THR 31 1HG2 THR 31 -11.465 3.671 -4.527
226 HG23 THR 31 2HG2 THR 31 -9.864 3.949 -5.236
227 H ASN 32 H ASN 32 -9.487 -1.059 -3.972
228 HA ASN 32 HA ASN 32 -11.125 -2.629 -5.920
229 HB2 ASN 32 1HB ASN 32 -8.153 -2.612 -5.259
230 HB3 ASN 32 2HB ASN 32 -8.919 -3.821 -6.267
231 HD21 ASN 32 1HD2 ASN 32 -8.568 -0.193 -6.084
232 HD22 ASN 32 2HD2 ASN 32 -8.550 -0.047 -7.832
233 H HIS 33 H HIS 33 -9.894 -2.850 -2.616
234 HA HIS 33 HA HIS 33 -10.977 -5.620 -2.410
235 HB2 HIS 33 1HB HIS 33 -8.367 -4.718 -1.164
236 HB3 HIS 33 2HB HIS 33 -9.029 -6.349 -1.234
237 HD1 HIS 33 1HD HIS 33 -9.414 -6.984 -4.174
238 HD2 HIS 33 2HD HIS 33 -6.403 -4.428 -2.759
239 HE1 HIS 33 1HE HIS 33 -7.641 -6.940 -5.994
240 HA PRO 34 HA PRO 34 -11.995 -2.671 1.190
241 HB2 PRO 34 1HB PRO 34 -14.676 -2.267 0.930
242 HB3 PRO 34 2HB PRO 34 -13.424 -1.269 0.123
243 HG2 PRO 34 1HG PRO 34 -14.971 -3.619 -1.041
244 HG3 PRO 34 2HG PRO 34 -14.740 -1.989 -1.760
245 HD2 PRO 34 1HD PRO 34 -13.142 -4.063 -2.467
246 HD3 PRO 34 2HD PRO 34 -12.468 -2.419 -2.239
247 H GLU 35 H GLU 35 -13.594 -5.607 -0.001
248 HA GLU 35 HA GLU 35 -15.078 -6.234 2.355
249 HB2 GLU 35 1HB GLU 35 -15.447 -8.354 1.376
250 HB3 GLU 35 2HB GLU 35 -15.514 -7.160 0.099
251 HG2 GLU 35 1HG GLU 35 -13.179 -9.040 0.695
252 HG3 GLU 35 2HG GLU 35 -14.386 -9.266 -0.560
253 H VAL 36 H VAL 36 -11.731 -6.324 1.931
254 HA VAL 36 HA VAL 36 -11.305 -8.075 4.321
255 HB VAL 36 HB VAL 36 -10.485 -9.028 2.258
256 HG11 VAL 36 1HG1 VAL 36 -8.845 -6.490 1.950
257 HG12 VAL 36 2HG1 VAL 36 -8.533 -7.999 1.057
258 HG13 VAL 36 3HG1 VAL 36 -10.072 -7.161 0.855
259 HG21 VAL 36 3HG2 VAL 36 -9.212 -9.430 4.372
260 HG22 VAL 36 1HG2 VAL 36 -8.276 -9.631 2.879
261 HG23 VAL 36 2HG2 VAL 36 -8.060 -8.171 3.858
262 H SER 37 H SER 37 -11.310 -4.889 3.345
263 HA SER 37 HA SER 37 -8.918 -3.910 4.636
264 HB2 SER 37 1HB SER 37 -9.618 -1.739 4.061
265 HB3 SER 37 2HB SER 37 -10.007 -2.804 2.701
266 HG SER 37 HG SER 37 -12.197 -2.913 3.654
Start of MODEL 10
1 H1 GLY 1 1H GLY 1 13.615 -2.441 -4.726
2 H2 GLY 1 2H GLY 1 14.504 -1.575 -5.797
3 H3 GLY 1 3H GLY 1 14.805 -1.443 -4.192
4 HA2 GLY 1 1HA GLY 1 16.488 -2.797 -5.273
5 HA3 GLY 1 2HA GLY 1 15.555 -3.732 -4.085
6 H SER 2 H SER 2 16.985 -4.840 -6.252
7 HA SER 2 HA SER 2 16.939 -6.328 -7.910
8 HB2 SER 2 1HB SER 2 14.186 -6.995 -6.853
9 HB3 SER 2 2HB SER 2 15.178 -8.011 -7.914
10 HG SER 2 HG SER 2 15.426 -8.563 -5.693
11 H SER 3 H SER 3 13.497 -5.321 -8.224
12 HA SER 3 HA SER 3 13.690 -5.363 -11.150
13 HB2 SER 3 1HB SER 3 11.397 -4.537 -9.335
14 HB3 SER 3 2HB SER 3 11.304 -4.836 -11.081
15 HG SER 3 HG SER 3 10.647 -6.666 -9.858
16 H GLY 4 H GLY 4 14.270 -2.972 -8.777
17 HA2 GLY 4 1HA GLY 4 14.894 -0.944 -10.722
18 HA3 GLY 4 2HA GLY 4 13.418 -0.534 -9.839
19 H SER 5 H SER 5 15.602 1.114 -9.664
20 HA SER 5 HA SER 5 17.386 0.449 -7.488
21 HB2 SER 5 1HB SER 5 18.287 2.723 -7.906
22 HB3 SER 5 2HB SER 5 18.175 1.723 -9.365
23 HG SER 5 HG SER 5 17.378 3.862 -9.700
24 H SER 6 H SER 6 14.223 1.682 -7.365
25 HA SER 6 HA SER 6 14.325 3.639 -5.364
26 HB2 SER 6 1HB SER 6 12.126 1.587 -5.824
27 HB3 SER 6 2HB SER 6 11.961 3.143 -4.985
28 HG SER 6 HG SER 6 11.294 3.269 -7.184
29 H GLY 7 H GLY 7 14.500 3.686 -3.197
30 HA2 GLY 7 1HA GLY 7 15.235 1.263 -1.716
31 HA3 GLY 7 2HA GLY 7 15.283 2.929 -1.146
32 H ARG 8 H ARG 8 12.242 2.720 -2.284
33 HA ARG 8 HA ARG 8 10.977 1.554 0.161
34 HB2 ARG 8 1HB ARG 8 11.404 3.950 0.555
35 HB3 ARG 8 2HB ARG 8 10.564 4.365 -0.944
36 HG2 ARG 8 1HG ARG 8 8.450 3.448 -0.006
37 HG3 ARG 8 2HG ARG 8 9.299 3.039 1.502
38 HD2 ARG 8 1HD ARG 8 9.843 5.424 1.850
39 HD3 ARG 8 2HD ARG 8 9.088 5.829 0.298
40 HE ARG 8 HE ARG 8 7.414 4.498 2.374
41 HH11 ARG 8 2HH1 ARG 8 8.102 7.521 0.714
42 HH12 ARG 8 1HH1 ARG 8 6.499 8.148 1.042
43 HH21 ARG 8 2HH2 ARG 8 5.564 5.455 2.963
44 HH22 ARG 8 1HH2 ARG 8 5.202 7.098 2.452
45 H SER 9 H SER 9 9.509 0.158 -0.447
46 HA SER 9 HA SER 9 7.661 0.673 -2.714
47 HB2 SER 9 1HB SER 9 9.256 -1.902 -2.391
48 HB3 SER 9 2HB SER 9 7.965 -1.614 -3.570
49 HG SER 9 HG SER 9 10.038 -1.312 -4.489
50 H TYR 10 H TYR 10 5.700 -0.374 -2.579
51 HA TYR 10 HA TYR 10 5.088 -2.126 -0.237
52 HB2 TYR 10 1HB TYR 10 3.321 0.090 -1.347
53 HB3 TYR 10 2HB TYR 10 2.925 -1.008 -0.036
54 HD1 TYR 10 2HD TYR 10 5.197 1.785 -1.040
55 HD2 TYR 10 1HD TYR 10 3.537 -0.484 2.232
56 HE1 TYR 10 2HE TYR 10 6.171 3.398 0.576
57 HE2 TYR 10 1HE TYR 10 4.456 1.175 3.844
58 HH TYR 10 HH TYR 10 5.695 3.088 4.111
59 H SER 11 H SER 11 3.515 -3.768 -0.697
60 HA SER 11 HA SER 11 2.621 -4.035 -3.534
61 HB2 SER 11 1HB SER 11 3.984 -6.211 -1.921
62 HB3 SER 11 2HB SER 11 3.219 -6.417 -3.508
63 HG SER 11 HG SER 11 5.500 -6.084 -3.649
64 H CYS 12 H CYS 12 0.609 -4.726 -3.814
65 HA CYS 12 HA CYS 12 -1.284 -4.723 -1.806
66 HB2 CYS 12 1HB CYS 12 -1.709 -4.312 -4.153
67 HB3 CYS 12 2HB CYS 12 -1.373 -6.011 -4.539
68 HA PRO 13 HA PRO 13 -0.944 -8.900 -0.092
69 HB2 PRO 13 1HB PRO 13 -3.073 -8.884 1.621
70 HB3 PRO 13 2HB PRO 13 -1.580 -7.944 1.915
71 HG2 PRO 13 1HG PRO 13 -4.182 -6.967 0.697
72 HG3 PRO 13 2HG PRO 13 -3.228 -6.216 2.015
73 HD2 PRO 13 1HD PRO 13 -3.011 -5.415 -0.585
74 HD3 PRO 13 2HD PRO 13 -1.598 -5.426 0.511
75 H VAL 14 H VAL 14 -3.459 -7.768 -2.160
76 HA VAL 14 HA VAL 14 -4.753 -10.474 -2.300
77 HB VAL 14 HB VAL 14 -5.854 -7.839 -3.285
78 HG11 VAL 14 1HG1 VAL 14 -8.016 -9.070 -3.318
79 HG12 VAL 14 2HG1 VAL 14 -6.850 -9.764 -4.442
80 HG13 VAL 14 3HG1 VAL 14 -7.159 -10.564 -2.884
81 HG21 VAL 14 3HG2 VAL 14 -6.451 -9.337 -0.702
82 HG22 VAL 14 1HG2 VAL 14 -5.735 -7.714 -0.856
83 HG23 VAL 14 2HG2 VAL 14 -7.404 -7.981 -1.347
84 H CYS 15 H CYS 15 -3.327 -7.918 -4.378
85 HA CYS 15 HA CYS 15 -3.291 -9.887 -6.613
86 HB2 CYS 15 1HB CYS 15 -3.837 -8.232 -8.181
87 HB3 CYS 15 2HB CYS 15 -5.119 -8.385 -6.987
88 H GLU 16 H GLU 16 -1.246 -8.576 -4.650
89 HA GLU 16 HA GLU 16 0.975 -8.163 -4.552
90 HB2 GLU 16 1HB GLU 16 1.107 -9.843 -7.071
91 HB3 GLU 16 2HB GLU 16 2.451 -9.466 -5.989
92 HG2 GLU 16 1HG GLU 16 1.249 -10.587 -4.113
93 HG3 GLU 16 2HG GLU 16 -0.034 -11.056 -5.231
94 H LYS 17 H LYS 17 -0.713 -6.411 -6.457
95 HA LYS 17 HA LYS 17 0.988 -5.128 -8.334
96 HB2 LYS 17 1HB LYS 17 -1.537 -5.233 -8.074
97 HB3 LYS 17 2HB LYS 17 -1.411 -3.986 -6.840
98 HG2 LYS 17 1HG LYS 17 -0.479 -2.424 -8.482
99 HG3 LYS 17 2HG LYS 17 -0.488 -3.670 -9.741
100 HD2 LYS 17 1HD LYS 17 -3.044 -2.872 -8.279
101 HD3 LYS 17 2HD LYS 17 -2.425 -1.923 -9.616
102 HE2 LYS 17 1HE LYS 17 -4.139 -3.371 -10.437
103 HE3 LYS 17 2HE LYS 17 -2.595 -3.810 -11.157
104 HZ1 LYS 17 3HZ LYS 17 -2.505 -5.744 -9.756
105 HZ2 LYS 17 1HZ LYS 17 -3.982 -5.728 -10.432
106 HZ3 LYS 17 2HZ LYS 17 -3.793 -5.310 -8.862
107 H SER 18 H SER 18 2.381 -3.403 -8.194
108 HA SER 18 HA SER 18 3.298 -2.770 -5.478
109 HB2 SER 18 1HB SER 18 5.383 -2.056 -6.589
110 HB3 SER 18 2HB SER 18 4.930 -3.744 -6.872
111 HG SER 18 HG SER 18 5.598 -2.690 -8.806
112 H PHE 19 H PHE 19 3.767 -0.818 -4.653
113 HA PHE 19 HA PHE 19 2.901 1.683 -6.018
114 HB2 PHE 19 1HB PHE 19 1.986 0.742 -3.272
115 HB3 PHE 19 2HB PHE 19 1.641 2.313 -3.979
116 HD1 PHE 19 2HD PHE 19 0.170 2.496 -6.020
117 HD2 PHE 19 1HD PHE 19 0.684 -1.218 -3.883
118 HE1 PHE 19 2HE PHE 19 -1.788 1.536 -7.208
119 HE2 PHE 19 1HE PHE 19 -1.274 -2.168 -5.071
120 HZ PHE 19 HZ PHE 19 -2.490 -0.805 -6.761
121 H SER 20 H SER 20 3.785 3.600 -5.148
122 HA SER 20 HA SER 20 6.446 3.250 -4.017
123 HB2 SER 20 1HB SER 20 4.999 5.797 -4.816
124 HB3 SER 20 2HB SER 20 6.739 5.602 -4.534
125 HG SER 20 HG SER 20 6.207 5.499 -6.771
126 H GLU 21 H GLU 21 3.374 4.201 -2.629
127 HA GLU 21 HA GLU 21 4.693 4.901 -0.065
128 HB2 GLU 21 1HB GLU 21 2.606 6.678 -1.373
129 HB3 GLU 21 2HB GLU 21 3.253 6.832 0.258
130 HG2 GLU 21 1HG GLU 21 5.587 6.976 -0.967
131 HG3 GLU 21 2HG GLU 21 4.611 7.417 -2.370
132 H ASP 22 H ASP 22 3.396 4.737 1.781
133 HA ASP 22 HA ASP 22 1.560 2.639 1.985
134 HB2 ASP 22 1HB ASP 22 2.879 3.578 3.828
135 HB3 ASP 22 2HB ASP 22 1.949 5.074 3.760
136 H ARG 23 H ARG 23 0.873 6.140 1.611
137 HA ARG 23 HA ARG 23 -1.986 5.926 1.773
138 HB2 ARG 23 1HB ARG 23 -2.052 8.170 0.847
139 HB3 ARG 23 2HB ARG 23 -0.824 8.042 2.105
140 HG2 ARG 23 1HG ARG 23 0.956 7.919 0.375
141 HG3 ARG 23 2HG ARG 23 -0.273 8.024 -0.902
142 HD2 ARG 23 1HD ARG 23 -0.961 10.230 -0.109
143 HD3 ARG 23 2HD ARG 23 0.204 10.147 1.225
144 HE ARG 23 HE ARG 23 1.970 9.886 -0.687
145 HH11 ARG 23 2HH1 ARG 23 -0.798 12.042 -1.006
146 HH12 ARG 23 1HH1 ARG 23 0.066 13.054 -2.133
147 HH21 ARG 23 2HH2 ARG 23 2.928 11.105 -1.997
148 HH22 ARG 23 1HH2 ARG 23 2.184 12.544 -2.708
149 H LEU 24 H LEU 24 0.162 5.272 -0.919
150 HA LEU 24 HA LEU 24 -1.978 5.402 -2.935
151 HB2 LEU 24 1HB LEU 24 0.888 4.392 -3.093
152 HB3 LEU 24 2HB LEU 24 -0.212 4.536 -4.459
153 HG LEU 24 HG LEU 24 0.769 6.872 -2.761
154 HD11 LEU 24 1HD1 LEU 24 2.564 5.854 -4.099
155 HD12 LEU 24 2HD1 LEU 24 2.124 7.446 -4.728
156 HD13 LEU 24 3HD1 LEU 24 1.560 5.979 -5.561
157 HD21 LEU 24 3HD2 LEU 24 -0.847 6.823 -5.343
158 HD22 LEU 24 1HD2 LEU 24 -0.139 8.273 -4.598
159 HD23 LEU 24 2HD2 LEU 24 -1.412 7.390 -3.754
160 H ILE 25 H ILE 25 -0.127 2.783 -1.282
161 HA ILE 25 HA ILE 25 -1.712 0.699 -2.504
162 HB ILE 25 HB ILE 25 0.468 0.193 -1.616
163 HG12 ILE 25 1HG1 ILE 25 -1.702 -1.316 -0.108
164 HG13 ILE 25 2HG1 ILE 25 -1.334 -1.539 -1.822
165 HG21 ILE 25 1HG2 ILE 25 0.961 0.059 0.773
166 HG22 ILE 25 2HG2 ILE 25 0.471 1.685 0.351
167 HG23 ILE 25 3HG2 ILE 25 -0.676 0.598 1.180
168 HD11 ILE 25 3HD1 ILE 25 -0.304 -3.281 -0.479
169 HD12 ILE 25 1HD1 ILE 25 0.952 -2.271 -1.235
170 HD13 ILE 25 2HD1 ILE 25 0.564 -2.105 0.498
171 H LYS 26 H LYS 26 -2.131 2.477 0.639
172 HA LYS 26 HA LYS 26 -4.497 1.006 1.364
173 HB2 LYS 26 1HB LYS 26 -3.516 3.792 2.089
174 HB3 LYS 26 2HB LYS 26 -5.006 3.131 2.739
175 HG2 LYS 26 1HG LYS 26 -2.279 1.795 3.042
176 HG3 LYS 26 2HG LYS 26 -2.992 2.874 4.234
177 HD2 LYS 26 1HD LYS 26 -4.188 0.200 3.358
178 HD3 LYS 26 2HD LYS 26 -3.233 0.486 4.811
179 HE2 LYS 26 1HE LYS 26 -4.914 2.119 5.621
180 HE3 LYS 26 2HE LYS 26 -5.903 1.821 4.185
181 HZ1 LYS 26 3HZ LYS 26 -6.613 0.502 6.128
182 HZ2 LYS 26 1HZ LYS 26 -5.181 -0.279 6.158
183 HZ3 LYS 26 2HZ LYS 26 -6.199 -0.463 4.883
184 H SER 27 H SER 27 -4.188 3.969 -0.638
185 HA SER 27 HA SER 27 -6.985 4.277 -1.141
186 HB2 SER 27 1HB SER 27 -4.630 4.911 -2.964
187 HB3 SER 27 2HB SER 27 -6.303 5.431 -3.220
188 HG SER 27 HG SER 27 -4.522 6.145 -1.132
189 H HIS 28 H HIS 28 -4.556 2.219 -2.845
190 HA HIS 28 HA HIS 28 -6.381 1.165 -4.776
191 HB2 HIS 28 1HB HIS 28 -4.038 0.912 -5.140
192 HB3 HIS 28 2HB HIS 28 -3.786 0.121 -3.592
193 HD1 HIS 28 1HD HIS 28 -5.681 -0.686 -6.886
194 HD2 HIS 28 2HD HIS 28 -3.839 -2.474 -3.557
195 HE1 HIS 28 1HE HIS 28 -5.761 -3.183 -7.314
196 H ILE 29 H ILE 29 -5.386 -0.250 -1.610
197 HA ILE 29 HA ILE 29 -7.090 -2.525 -1.834
198 HB ILE 29 HB ILE 29 -6.083 -1.160 0.690
199 HG12 ILE 29 1HG1 ILE 29 -4.941 -3.584 -0.806
200 HG13 ILE 29 2HG1 ILE 29 -4.269 -1.972 -0.924
201 HG21 ILE 29 1HG2 ILE 29 -8.019 -2.790 1.051
202 HG22 ILE 29 2HG2 ILE 29 -7.013 -4.046 0.311
203 HG23 ILE 29 3HG2 ILE 29 -6.527 -3.270 1.831
204 HD11 ILE 29 3HD1 ILE 29 -3.843 -1.971 1.543
205 HD12 ILE 29 1HD1 ILE 29 -4.345 -3.681 1.583
206 HD13 ILE 29 2HD1 ILE 29 -2.941 -3.196 0.633
207 H LYS 30 H LYS 30 -7.782 0.728 -0.488
208 HA LYS 30 HA LYS 30 -10.427 0.113 0.485
209 HB2 LYS 30 1HB LYS 30 -9.056 2.703 -0.336
210 HB3 LYS 30 2HB LYS 30 -10.720 2.654 0.260
211 HG2 LYS 30 1HG LYS 30 -10.044 1.714 2.386
212 HG3 LYS 30 2HG LYS 30 -8.385 1.497 1.834
213 HD2 LYS 30 1HD LYS 30 -8.482 3.423 3.276
214 HD3 LYS 30 2HD LYS 30 -8.124 3.962 1.627
215 HE2 LYS 30 1HE LYS 30 -10.505 4.598 1.313
216 HE3 LYS 30 2HE LYS 30 -10.887 4.000 2.933
217 HZ1 LYS 30 3HZ LYS 30 -9.404 5.710 3.842
218 HZ2 LYS 30 1HZ LYS 30 -10.560 6.406 2.928
219 HZ3 LYS 30 2HZ LYS 30 -9.044 6.261 2.343
220 H THR 31 H THR 31 -9.354 1.090 -2.780
221 HA THR 31 HA THR 31 -12.124 1.388 -3.709
222 HB THR 31 HB THR 31 -10.959 1.940 -5.852
223 HG1 THR 31 1HG THR 31 -8.622 2.212 -4.350
224 HG21 THR 31 3HG2 THR 31 -11.671 3.732 -4.347
225 HG22 THR 31 1HG2 THR 31 -10.128 4.142 -5.113
226 HG23 THR 31 2HG2 THR 31 -10.163 3.593 -3.422
227 H ASN 32 H ASN 32 -9.531 -1.006 -4.010
228 HA ASN 32 HA ASN 32 -11.080 -2.486 -6.090
229 HB2 ASN 32 1HB ASN 32 -8.161 -2.576 -5.227
230 HB3 ASN 32 2HB ASN 32 -8.885 -3.701 -6.359
231 HD21 ASN 32 1HD2 ASN 32 -8.420 -0.128 -5.924
232 HD22 ASN 32 2HD2 ASN 32 -8.328 0.152 -7.651
233 H HIS 33 H HIS 33 -10.092 -2.842 -2.721
234 HA HIS 33 HA HIS 33 -11.164 -5.631 -2.687
235 HB2 HIS 33 1HB HIS 33 -8.659 -4.711 -1.256
236 HB3 HIS 33 2HB HIS 33 -9.291 -6.349 -1.377
237 HD1 HIS 33 1HD HIS 33 -9.552 -6.736 -4.476
238 HD2 HIS 33 2HD HIS 33 -6.472 -4.611 -2.578
239 HE1 HIS 33 1HE HIS 33 -7.620 -6.715 -6.120
240 HA PRO 34 HA PRO 34 -13.107 -2.537 0.247
241 HB2 PRO 34 1HB PRO 34 -15.435 -4.391 -0.278
242 HB3 PRO 34 2HB PRO 34 -15.451 -2.609 -0.044
243 HG2 PRO 34 1HG PRO 34 -15.582 -3.604 -2.541
244 HG3 PRO 34 2HG PRO 34 -14.428 -2.267 -2.206
245 HD2 PRO 34 1HD PRO 34 -13.862 -5.243 -2.362
246 HD3 PRO 34 2HD PRO 34 -12.988 -3.882 -3.108
247 H GLU 35 H GLU 35 -13.266 -6.085 0.523
248 HA GLU 35 HA GLU 35 -14.072 -6.044 3.329
249 HB2 GLU 35 1HB GLU 35 -13.890 -8.434 3.240
250 HB3 GLU 35 2HB GLU 35 -14.743 -7.841 1.818
251 HG2 GLU 35 1HG GLU 35 -12.626 -8.082 0.483
252 HG3 GLU 35 2HG GLU 35 -11.829 -8.741 1.913
253 H VAL 36 H VAL 36 -11.177 -5.238 1.948
254 HA VAL 36 HA VAL 36 -9.464 -6.407 4.091
255 HB VAL 36 HB VAL 36 -8.619 -5.317 1.394
256 HG11 VAL 36 1HG1 VAL 36 -6.620 -6.736 1.748
257 HG12 VAL 36 2HG1 VAL 36 -6.767 -5.517 3.012
258 HG13 VAL 36 3HG1 VAL 36 -7.232 -7.199 3.352
259 HG21 VAL 36 3HG2 VAL 36 -9.352 -8.168 2.162
260 HG22 VAL 36 1HG2 VAL 36 -10.112 -7.158 0.905
261 HG23 VAL 36 2HG2 VAL 36 -8.459 -7.723 0.695
262 H SER 37 H SER 37 -10.561 -3.351 2.803
263 HA SER 37 HA SER 37 -9.520 -1.966 5.166
264 HB2 SER 37 1HB SER 37 -8.690 -1.100 2.373
265 HB3 SER 37 2HB SER 37 -8.709 -0.008 3.768
266 HG SER 37 HG SER 37 -7.483 -2.514 4.068
Start of MODEL 11
1 H1 GLY 1 1H GLY 1 17.217 -3.689 -5.959
2 H2 GLY 1 2H GLY 1 17.796 -2.403 -6.790
3 H3 GLY 1 3H GLY 1 16.192 -2.519 -6.480
4 HA2 GLY 1 1HA GLY 1 17.200 -0.896 -5.015
5 HA3 GLY 1 2HA GLY 1 16.547 -2.280 -4.120
6 H SER 2 H SER 2 18.784 -0.354 -3.502
7 HA SER 2 HA SER 2 21.299 -1.661 -3.817
8 HB2 SER 2 1HB SER 2 20.506 0.474 -1.805
9 HB3 SER 2 2HB SER 2 22.150 0.072 -2.335
10 HG SER 2 HG SER 2 21.299 1.881 -3.469
11 H SER 3 H SER 3 18.867 -2.101 -1.333
12 HA SER 3 HA SER 3 20.474 -4.219 -0.079
13 HB2 SER 3 1HB SER 3 20.092 -3.366 2.209
14 HB3 SER 3 2HB SER 3 21.143 -2.313 1.254
15 HG SER 3 HG SER 3 19.588 -1.103 2.395
16 H GLY 4 H GLY 4 19.267 -5.686 1.196
17 HA2 GLY 4 1HA GLY 4 16.502 -6.092 0.349
18 HA3 GLY 4 2HA GLY 4 17.447 -7.124 1.417
19 H SER 5 H SER 5 14.737 -6.478 1.807
20 HA SER 5 HA SER 5 13.202 -5.743 3.310
21 HB2 SER 5 1HB SER 5 15.487 -6.194 5.251
22 HB3 SER 5 2HB SER 5 13.758 -6.167 5.647
23 HG SER 5 HG SER 5 14.553 -8.305 5.331
24 H SER 6 H SER 6 14.324 -3.536 2.030
25 HA SER 6 HA SER 6 13.970 -1.366 4.026
26 HB2 SER 6 1HB SER 6 16.431 -1.988 3.782
27 HB3 SER 6 2HB SER 6 16.325 -1.417 2.106
28 HG SER 6 HG SER 6 17.037 0.209 3.599
29 H GLY 7 H GLY 7 14.095 0.812 2.815
30 HA2 GLY 7 1HA GLY 7 13.482 2.220 1.044
31 HA3 GLY 7 2HA GLY 7 13.002 0.838 0.074
32 H ARG 8 H ARG 8 11.409 2.701 -0.275
33 HA ARG 8 HA ARG 8 9.173 2.836 1.688
34 HB2 ARG 8 1HB ARG 8 10.480 4.854 1.089
35 HB3 ARG 8 2HB ARG 8 10.002 4.660 -0.594
36 HG2 ARG 8 1HG ARG 8 8.830 6.468 0.503
37 HG3 ARG 8 2HG ARG 8 7.711 5.247 -0.061
38 HD2 ARG 8 1HD ARG 8 7.466 4.376 2.231
39 HD3 ARG 8 2HD ARG 8 8.639 5.570 2.819
40 HE ARG 8 HE ARG 8 6.935 7.257 1.696
41 HH11 ARG 8 1HH1 ARG 8 5.952 4.484 3.704
42 HH12 ARG 8 2HH1 ARG 8 4.425 5.306 4.038
43 HH21 ARG 8 1HH2 ARG 8 4.895 8.017 2.137
44 HH22 ARG 8 2HH2 ARG 8 3.884 7.075 3.257
45 H SER 9 H SER 9 9.714 0.926 -0.886
46 HA SER 9 HA SER 9 7.147 1.222 -2.269
47 HB2 SER 9 1HB SER 9 9.220 -0.985 -2.466
48 HB3 SER 9 2HB SER 9 7.827 -0.745 -3.540
49 HG SER 9 HG SER 9 9.770 0.161 -4.395
50 H TYR 10 H TYR 10 5.402 -0.139 -2.225
51 HA TYR 10 HA TYR 10 5.230 -2.320 -0.190
52 HB2 TYR 10 1HB TYR 10 3.106 -0.196 -0.671
53 HB3 TYR 10 2HB TYR 10 3.018 -1.530 0.469
54 HD1 TYR 10 1HD TYR 10 4.368 -1.501 2.574
55 HD2 TYR 10 2HD TYR 10 4.396 1.815 -0.184
56 HE1 TYR 10 1HE TYR 10 5.450 -0.069 4.303
57 HE2 TYR 10 2HE TYR 10 5.512 3.230 1.535
58 HH TYR 10 HH TYR 10 6.349 1.990 4.782
59 H SER 11 H SER 11 3.600 -3.958 -0.722
60 HA SER 11 HA SER 11 2.559 -3.873 -3.520
61 HB2 SER 11 1HB SER 11 4.058 -6.201 -2.282
62 HB3 SER 11 2HB SER 11 3.213 -6.223 -3.843
63 HG SER 11 HG SER 11 5.483 -5.797 -4.034
64 H CYS 12 H CYS 12 0.654 -4.806 -3.921
65 HA CYS 12 HA CYS 12 -1.257 -4.835 -1.947
66 HB2 CYS 12 1HB CYS 12 -1.673 -4.436 -4.287
67 HB3 CYS 12 2HB CYS 12 -1.296 -6.123 -4.679
68 HA PRO 13 HA PRO 13 -0.818 -8.994 -0.212
69 HB2 PRO 13 1HB PRO 13 -2.815 -8.927 1.646
70 HB3 PRO 13 2HB PRO 13 -1.299 -7.992 1.819
71 HG2 PRO 13 1HG PRO 13 -3.976 -7.016 0.779
72 HG3 PRO 13 2HG PRO 13 -2.921 -6.251 2.006
73 HD2 PRO 13 1HD PRO 13 -2.901 -5.508 -0.629
74 HD3 PRO 13 2HD PRO 13 -1.418 -5.481 0.373
75 H VAL 14 H VAL 14 -3.395 -7.847 -2.161
76 HA VAL 14 HA VAL 14 -4.763 -10.522 -2.196
77 HB VAL 14 HB VAL 14 -5.870 -7.821 -3.007
78 HG11 VAL 14 1HG1 VAL 14 -7.210 -10.548 -2.741
79 HG12 VAL 14 2HG1 VAL 14 -8.062 -9.010 -3.001
80 HG13 VAL 14 3HG1 VAL 14 -6.976 -9.626 -4.245
81 HG21 VAL 14 3HG2 VAL 14 -7.321 -8.072 -0.991
82 HG22 VAL 14 1HG2 VAL 14 -6.377 -9.501 -0.514
83 HG23 VAL 14 2HG2 VAL 14 -5.620 -7.892 -0.577
84 H CYS 15 H CYS 15 -3.348 -8.011 -4.323
85 HA CYS 15 HA CYS 15 -3.394 -9.972 -6.546
86 HB2 CYS 15 1HB CYS 15 -4.386 -8.554 -8.048
87 HB3 CYS 15 2HB CYS 15 -5.449 -8.629 -6.646
88 H GLU 16 H GLU 16 -1.341 -8.759 -4.867
89 HA GLU 16 HA GLU 16 0.872 -8.373 -4.888
90 HB2 GLU 16 1HB GLU 16 0.681 -9.774 -7.567
91 HB3 GLU 16 2HB GLU 16 2.144 -9.591 -6.599
92 HG2 GLU 16 1HG GLU 16 1.052 -10.828 -4.724
93 HG3 GLU 16 2HG GLU 16 -0.356 -11.112 -5.752
94 H LYS 17 H LYS 17 -0.721 -6.425 -7.112
95 HA LYS 17 HA LYS 17 1.456 -5.175 -8.478
96 HB2 LYS 17 1HB LYS 17 -1.338 -4.299 -7.716
97 HB3 LYS 17 2HB LYS 17 -0.228 -3.149 -8.466
98 HG2 LYS 17 1HG LYS 17 0.053 -4.448 -10.427
99 HG3 LYS 17 2HG LYS 17 -0.710 -5.871 -9.731
100 HD2 LYS 17 1HD LYS 17 -2.167 -3.233 -10.228
101 HD3 LYS 17 2HD LYS 17 -2.132 -4.569 -11.392
102 HE2 LYS 17 1HE LYS 17 -3.274 -4.636 -8.574
103 HE3 LYS 17 2HE LYS 17 -4.210 -4.539 -10.064
104 HZ1 LYS 17 3HZ LYS 17 -2.457 -6.837 -9.354
105 HZ2 LYS 17 1HZ LYS 17 -3.506 -6.765 -10.628
106 HZ3 LYS 17 2HZ LYS 17 -4.032 -6.767 -9.055
107 H SER 18 H SER 18 2.715 -3.402 -8.129
108 HA SER 18 HA SER 18 3.216 -2.785 -5.285
109 HB2 SER 18 1HB SER 18 5.459 -2.129 -6.027
110 HB3 SER 18 2HB SER 18 5.046 -3.808 -6.406
111 HG SER 18 HG SER 18 6.042 -2.743 -8.185
112 H PHE 19 H PHE 19 3.707 -0.794 -4.511
113 HA PHE 19 HA PHE 19 2.860 1.641 -6.000
114 HB2 PHE 19 1HB PHE 19 1.871 0.735 -3.268
115 HB3 PHE 19 2HB PHE 19 1.507 2.281 -4.020
116 HD1 PHE 19 2HD PHE 19 0.105 2.388 -6.106
117 HD2 PHE 19 1HD PHE 19 0.680 -1.296 -3.932
118 HE1 PHE 19 2HE PHE 19 -1.726 1.327 -7.411
119 HE2 PHE 19 1HE PHE 19 -1.154 -2.345 -5.240
120 HZ PHE 19 HZ PHE 19 -2.324 -1.048 -7.002
121 H SER 20 H SER 20 3.773 3.582 -5.239
122 HA SER 20 HA SER 20 6.411 3.153 -4.078
123 HB2 SER 20 1HB SER 20 6.827 5.459 -4.901
124 HB3 SER 20 2HB SER 20 6.260 4.329 -6.141
125 HG SER 20 HG SER 20 5.170 6.355 -6.237
126 H GLU 21 H GLU 21 3.500 4.193 -2.643
127 HA GLU 21 HA GLU 21 4.911 4.885 -0.180
128 HB2 GLU 21 1HB GLU 21 3.109 6.922 -1.568
129 HB3 GLU 21 2HB GLU 21 3.424 6.931 0.161
130 HG2 GLU 21 1HG GLU 21 5.952 6.945 -0.479
131 HG3 GLU 21 2HG GLU 21 5.394 7.422 -2.092
132 H ASP 22 H ASP 22 3.455 4.927 1.720
133 HA ASP 22 HA ASP 22 1.780 2.665 1.600
134 HB2 ASP 22 1HB ASP 22 1.442 2.890 3.912
135 HB3 ASP 22 2HB ASP 22 3.096 3.372 3.575
136 H ARG 23 H ARG 23 0.836 6.109 1.562
137 HA ARG 23 HA ARG 23 -1.992 5.594 1.860
138 HB2 ARG 23 1HB ARG 23 -2.364 7.864 1.202
139 HB3 ARG 23 2HB ARG 23 -0.990 7.791 2.304
140 HG2 ARG 23 1HG ARG 23 0.553 7.942 0.330
141 HG3 ARG 23 2HG ARG 23 -0.851 8.105 -0.734
142 HD2 ARG 23 1HD ARG 23 -1.532 10.169 0.369
143 HD3 ARG 23 2HD ARG 23 -0.250 10.015 1.570
144 HE ARG 23 HE ARG 23 0.000 10.965 -1.186
145 HH11 ARG 23 2HH1 ARG 23 1.838 9.733 1.529
146 HH12 ARG 23 1HH1 ARG 23 3.375 9.972 0.725
147 HH21 ARG 23 2HH2 ARG 23 2.010 11.348 -2.110
148 HH22 ARG 23 1HH2 ARG 23 3.448 10.782 -1.284
149 H LEU 24 H LEU 24 0.105 5.222 -0.883
150 HA LEU 24 HA LEU 24 -2.051 5.324 -2.870
151 HB2 LEU 24 1HB LEU 24 0.804 4.316 -3.126
152 HB3 LEU 24 2HB LEU 24 -0.315 4.624 -4.449
153 HG LEU 24 HG LEU 24 0.826 6.727 -2.550
154 HD11 LEU 24 1HD1 LEU 24 1.374 6.172 -5.492
155 HD12 LEU 24 2HD1 LEU 24 2.467 5.813 -4.139
156 HD13 LEU 24 3HD1 LEU 24 2.065 7.490 -4.522
157 HD21 LEU 24 3HD2 LEU 24 -0.972 7.051 -4.993
158 HD22 LEU 24 1HD2 LEU 24 -0.154 8.374 -4.133
159 HD23 LEU 24 2HD2 LEU 24 -1.400 7.435 -3.309
160 H ILE 25 H ILE 25 -0.178 2.687 -1.267
161 HA ILE 25 HA ILE 25 -1.789 0.617 -2.505
162 HB ILE 25 HB ILE 25 0.410 0.086 -1.667
163 HG12 ILE 25 1HG1 ILE 25 -1.749 -1.453 -0.165
164 HG13 ILE 25 2HG1 ILE 25 -1.390 -1.636 -1.886
165 HG21 ILE 25 1HG2 ILE 25 0.472 1.529 0.318
166 HG22 ILE 25 2HG2 ILE 25 -0.698 0.463 1.147
167 HG23 ILE 25 3HG2 ILE 25 0.922 -0.110 0.722
168 HD11 ILE 25 3HD1 ILE 25 0.914 -2.357 -1.319
169 HD12 ILE 25 1HD1 ILE 25 0.513 -2.256 0.416
170 HD13 ILE 25 2HD1 ILE 25 -0.338 -3.403 -0.606
171 H LYS 26 H LYS 26 -2.127 2.414 0.621
172 HA LYS 26 HA LYS 26 -4.485 0.987 1.451
173 HB2 LYS 26 1HB LYS 26 -3.508 3.811 2.019
174 HB3 LYS 26 2HB LYS 26 -4.960 3.146 2.756
175 HG2 LYS 26 1HG LYS 26 -2.218 1.837 3.027
176 HG3 LYS 26 2HG LYS 26 -2.870 3.018 4.165
177 HD2 LYS 26 1HD LYS 26 -4.805 1.507 4.612
178 HD3 LYS 26 2HD LYS 26 -4.097 0.296 3.518
179 HE2 LYS 26 1HE LYS 26 -2.053 0.215 4.915
180 HE3 LYS 26 2HE LYS 26 -2.736 1.432 6.001
181 HZ1 LYS 26 3HZ LYS 26 -3.891 -1.270 5.535
182 HZ2 LYS 26 1HZ LYS 26 -4.522 -0.141 6.538
183 HZ3 LYS 26 2HZ LYS 26 -3.073 -0.809 6.869
184 H SER 27 H SER 27 -4.196 3.859 -0.676
185 HA SER 27 HA SER 27 -7.006 4.148 -1.161
186 HB2 SER 27 1HB SER 27 -4.663 4.774 -3.003
187 HB3 SER 27 2HB SER 27 -6.341 5.289 -3.247
188 HG SER 27 HG SER 27 -4.567 6.002 -1.143
189 H HIS 28 H HIS 28 -4.556 2.124 -2.885
190 HA HIS 28 HA HIS 28 -6.348 0.999 -4.789
191 HB2 HIS 28 1HB HIS 28 -3.966 0.812 -5.060
192 HB3 HIS 28 2HB HIS 28 -3.779 -0.022 -3.530
193 HD1 HIS 28 1HD HIS 28 -5.138 -0.731 -7.067
194 HD2 HIS 28 2HD HIS 28 -4.020 -2.623 -3.484
195 HE1 HIS 28 1HE HIS 28 -5.055 -3.210 -7.597
196 H ILE 29 H ILE 29 -5.434 -0.234 -1.545
197 HA ILE 29 HA ILE 29 -7.123 -2.539 -1.583
198 HB ILE 29 HB ILE 29 -6.017 -0.880 0.710
199 HG12 ILE 29 1HG1 ILE 29 -5.219 -3.626 -0.385
200 HG13 ILE 29 2HG1 ILE 29 -4.382 -2.127 -0.769
201 HG21 ILE 29 1HG2 ILE 29 -8.043 -2.035 1.533
202 HG22 ILE 29 2HG2 ILE 29 -7.457 -3.569 0.856
203 HG23 ILE 29 3HG2 ILE 29 -6.614 -2.782 2.205
204 HD11 ILE 29 3HD1 ILE 29 -3.111 -3.246 0.898
205 HD12 ILE 29 1HD1 ILE 29 -3.842 -1.818 1.654
206 HD13 ILE 29 2HD1 ILE 29 -4.507 -3.445 1.959
207 H LYS 30 H LYS 30 -7.853 0.821 -0.528
208 HA LYS 30 HA LYS 30 -10.544 0.202 0.347
209 HB2 LYS 30 1HB LYS 30 -9.113 2.786 -0.377
210 HB3 LYS 30 2HB LYS 30 -10.806 2.752 0.131
211 HG2 LYS 30 1HG LYS 30 -10.242 1.728 2.262
212 HG3 LYS 30 2HG LYS 30 -8.539 1.590 1.808
213 HD2 LYS 30 1HD LYS 30 -8.372 4.064 1.650
214 HD3 LYS 30 2HD LYS 30 -10.087 4.204 2.103
215 HE2 LYS 30 1HE LYS 30 -9.592 3.029 4.251
216 HE3 LYS 30 2HE LYS 30 -7.883 2.949 3.805
217 HZ1 LYS 30 3HZ LYS 30 -7.849 5.395 3.789
218 HZ2 LYS 30 1HZ LYS 30 -8.333 4.850 5.249
219 HZ3 LYS 30 2HZ LYS 30 -9.429 5.459 4.207
220 H THR 31 H THR 31 -9.304 1.087 -2.868
221 HA THR 31 HA THR 31 -12.020 1.395 -3.936
222 HB THR 31 HB THR 31 -10.749 1.829 -6.052
223 HG1 THR 31 1HG THR 31 -8.500 2.112 -4.409
224 HG21 THR 31 3HG2 THR 31 -11.523 3.686 -4.655
225 HG22 THR 31 1HG2 THR 31 -9.944 4.057 -5.368
226 HG23 THR 31 2HG2 THR 31 -10.058 3.582 -3.658
227 H ASN 32 H ASN 32 -9.549 -1.133 -3.943
228 HA ASN 32 HA ASN 32 -11.143 -2.684 -5.957
229 HB2 ASN 32 1HB ASN 32 -8.210 -2.885 -5.152
230 HB3 ASN 32 2HB ASN 32 -9.027 -3.930 -6.302
231 HD21 ASN 32 1HD2 ASN 32 -8.059 -0.542 -5.749
232 HD22 ASN 32 2HD2 ASN 32 -8.084 -0.117 -7.453
233 H HIS 33 H HIS 33 -9.979 -2.858 -2.617
234 HA HIS 33 HA HIS 33 -11.100 -5.607 -2.361
235 HB2 HIS 33 1HB HIS 33 -8.489 -4.744 -1.101
236 HB3 HIS 33 2HB HIS 33 -9.146 -6.369 -1.238
237 HD1 HIS 33 1HD HIS 33 -9.492 -6.782 -4.283
238 HD2 HIS 33 2HD HIS 33 -6.408 -4.538 -2.527
239 HE1 HIS 33 1HE HIS 33 -7.619 -6.725 -5.999
240 HA PRO 34 HA PRO 34 -11.799 -2.468 1.262
241 HB2 PRO 34 1HB PRO 34 -14.509 -1.954 1.128
242 HB3 PRO 34 2HB PRO 34 -13.255 -0.995 0.290
243 HG2 PRO 34 1HG PRO 34 -14.916 -3.277 -0.835
244 HG3 PRO 34 2HG PRO 34 -14.638 -1.654 -1.551
245 HD2 PRO 34 1HD PRO 34 -13.169 -3.771 -2.345
246 HD3 PRO 34 2HD PRO 34 -12.389 -2.176 -2.087
247 H GLU 35 H GLU 35 -13.532 -5.339 0.234
248 HA GLU 35 HA GLU 35 -14.706 -6.071 2.753
249 HB2 GLU 35 1HB GLU 35 -15.016 -8.248 1.733
250 HB3 GLU 35 2HB GLU 35 -15.447 -6.968 0.602
251 HG2 GLU 35 1HG GLU 35 -13.246 -7.248 -0.549
252 HG3 GLU 35 2HG GLU 35 -12.823 -8.533 0.580
253 H VAL 36 H VAL 36 -11.368 -6.061 1.842
254 HA VAL 36 HA VAL 36 -10.608 -8.277 3.600
255 HB VAL 36 HB VAL 36 -9.503 -7.460 1.371
256 HG11 VAL 36 1HG1 VAL 36 -8.917 -5.153 2.258
257 HG12 VAL 36 2HG1 VAL 36 -7.740 -5.933 3.328
258 HG13 VAL 36 3HG1 VAL 36 -7.569 -6.073 1.568
259 HG21 VAL 36 3HG2 VAL 36 -7.416 -8.540 1.993
260 HG22 VAL 36 1HG2 VAL 36 -7.824 -8.403 3.717
261 HG23 VAL 36 2HG2 VAL 36 -8.807 -9.423 2.641
262 H SER 37 H SER 37 -11.353 -5.034 4.159
263 HA SER 37 HA SER 37 -9.478 -4.495 6.357
264 HB2 SER 37 1HB SER 37 -11.913 -2.989 5.334
265 HB3 SER 37 2HB SER 37 -10.872 -2.446 6.662
266 HG SER 37 HG SER 37 -9.976 -3.048 4.012
Start of MODEL 12
1 H1 GLY 1 1H GLY 1 21.865 0.831 -3.540
2 H2 GLY 1 2H GLY 1 21.461 -0.207 -2.332
3 H3 GLY 1 3H GLY 1 20.540 -0.125 -3.682
4 HA2 GLY 1 1HA GLY 1 22.299 -1.012 -5.044
5 HA3 GLY 1 2HA GLY 1 23.337 -1.051 -3.609
6 H SER 2 H SER 2 23.254 -3.388 -4.748
7 HA SER 2 HA SER 2 21.038 -5.084 -4.336
8 HB2 SER 2 1HB SER 2 23.978 -5.858 -4.421
9 HB3 SER 2 2HB SER 2 22.592 -6.911 -4.762
10 HG SER 2 HG SER 2 23.533 -6.070 -6.685
11 H SER 3 H SER 3 23.555 -4.195 -2.034
12 HA SER 3 HA SER 3 22.813 -6.308 -0.119
13 HB2 SER 3 1HB SER 3 24.866 -4.086 0.114
14 HB3 SER 3 2HB SER 3 24.692 -5.486 1.188
15 HG SER 3 HG SER 3 26.319 -5.816 -0.399
16 H GLY 4 H GLY 4 21.586 -3.185 -0.710
17 HA2 GLY 4 1HA GLY 4 19.760 -3.081 1.344
18 HA3 GLY 4 2HA GLY 4 21.184 -2.315 2.047
19 H SER 5 H SER 5 18.788 -0.992 1.780
20 HA SER 5 HA SER 5 19.468 1.304 0.049
21 HB2 SER 5 1HB SER 5 17.215 1.356 -0.947
22 HB3 SER 5 2HB SER 5 18.088 -0.115 -1.403
23 HG SER 5 HG SER 5 15.902 -0.520 -0.754
24 H SER 6 H SER 6 18.230 3.230 0.541
25 HA SER 6 HA SER 6 17.323 3.407 3.354
26 HB2 SER 6 1HB SER 6 17.461 5.847 2.936
27 HB3 SER 6 2HB SER 6 18.987 4.988 2.658
28 HG SER 6 HG SER 6 18.505 6.478 0.968
29 H GLY 7 H GLY 7 15.992 3.769 0.083
30 HA2 GLY 7 1HA GLY 7 13.376 4.747 0.951
31 HA3 GLY 7 2HA GLY 7 13.827 4.224 -0.669
32 H ARG 8 H ARG 8 11.359 3.581 0.515
33 HA ARG 8 HA ARG 8 11.477 0.611 0.442
34 HB2 ARG 8 1HB ARG 8 9.986 2.192 2.593
35 HB3 ARG 8 2HB ARG 8 9.651 0.520 2.177
36 HG2 ARG 8 1HG ARG 8 11.009 0.181 3.959
37 HG3 ARG 8 2HG ARG 8 12.191 0.092 2.657
38 HD2 ARG 8 1HD ARG 8 12.753 2.540 3.143
39 HD3 ARG 8 2HD ARG 8 11.600 2.483 4.463
40 HE ARG 8 HE ARG 8 13.140 1.369 5.764
41 HH11 ARG 8 2HH1 ARG 8 14.324 1.068 2.442
42 HH12 ARG 8 1HH1 ARG 8 15.920 0.636 3.001
43 HH21 ARG 8 2HH2 ARG 8 15.198 0.713 6.329
44 HH22 ARG 8 1HH2 ARG 8 16.360 0.363 5.078
45 H SER 9 H SER 9 9.699 -0.397 -0.368
46 HA SER 9 HA SER 9 7.508 1.226 -1.571
47 HB2 SER 9 1HB SER 9 7.582 -0.207 -3.563
48 HB3 SER 9 2HB SER 9 9.083 0.706 -3.349
49 HG SER 9 HG SER 9 9.487 -1.497 -3.866
50 H TYR 10 H TYR 10 5.672 -0.224 -2.282
51 HA TYR 10 HA TYR 10 5.072 -2.290 -0.199
52 HB2 TYR 10 1HB TYR 10 3.213 -0.091 -1.177
53 HB3 TYR 10 2HB TYR 10 2.906 -1.260 0.099
54 HD1 TYR 10 2HD TYR 10 4.744 1.824 -0.824
55 HD2 TYR 10 1HD TYR 10 3.855 -0.968 2.345
56 HE1 TYR 10 2HE TYR 10 5.790 3.365 0.827
57 HE2 TYR 10 1HE TYR 10 4.849 0.609 4.004
58 HH TYR 10 HH TYR 10 6.312 3.732 3.030
59 H SER 11 H SER 11 3.550 -3.916 -0.825
60 HA SER 11 HA SER 11 2.578 -3.885 -3.633
61 HB2 SER 11 1HB SER 11 4.085 -6.196 -2.376
62 HB3 SER 11 2HB SER 11 3.133 -6.301 -3.869
63 HG SER 11 HG SER 11 5.416 -5.903 -4.192
64 H CYS 12 H CYS 12 0.616 -4.709 -3.957
65 HA CYS 12 HA CYS 12 -1.258 -4.733 -1.953
66 HB2 CYS 12 1HB CYS 12 -1.726 -4.339 -4.278
67 HB3 CYS 12 2HB CYS 12 -1.317 -6.016 -4.686
68 HA PRO 13 HA PRO 13 -0.777 -8.882 -0.211
69 HB2 PRO 13 1HB PRO 13 -2.758 -8.834 1.666
70 HB3 PRO 13 2HB PRO 13 -1.249 -7.887 1.822
71 HG2 PRO 13 1HG PRO 13 -3.946 -6.937 0.812
72 HG3 PRO 13 2HG PRO 13 -2.882 -6.157 2.022
73 HD2 PRO 13 1HD PRO 13 -2.903 -5.423 -0.617
74 HD3 PRO 13 2HD PRO 13 -1.408 -5.377 0.367
75 H VAL 14 H VAL 14 -3.363 -7.792 -2.167
76 HA VAL 14 HA VAL 14 -4.715 -10.473 -2.146
77 HB VAL 14 HB VAL 14 -5.881 -7.851 -3.101
78 HG11 VAL 14 1HG1 VAL 14 -8.040 -9.064 -2.853
79 HG12 VAL 14 2HG1 VAL 14 -6.996 -9.826 -4.053
80 HG13 VAL 14 3HG1 VAL 14 -7.151 -10.543 -2.433
81 HG21 VAL 14 3HG2 VAL 14 -5.535 -7.585 -0.721
82 HG22 VAL 14 1HG2 VAL 14 -7.238 -7.927 -0.987
83 HG23 VAL 14 2HG2 VAL 14 -6.168 -9.216 -0.395
84 H CYS 15 H CYS 15 -3.326 -8.001 -4.333
85 HA CYS 15 HA CYS 15 -3.370 -10.021 -6.511
86 HB2 CYS 15 1HB CYS 15 -4.260 -8.575 -8.069
87 HB3 CYS 15 2HB CYS 15 -5.372 -8.618 -6.704
88 H GLU 16 H GLU 16 -1.331 -8.518 -4.783
89 HA GLU 16 HA GLU 16 0.868 -8.114 -4.829
90 HB2 GLU 16 1HB GLU 16 0.476 -10.429 -5.962
91 HB3 GLU 16 2HB GLU 16 1.119 -9.645 -7.405
92 HG2 GLU 16 1HG GLU 16 3.220 -9.126 -6.146
93 HG3 GLU 16 2HG GLU 16 2.509 -9.814 -4.688
94 H LYS 17 H LYS 17 -0.828 -6.238 -6.760
95 HA LYS 17 HA LYS 17 1.164 -5.045 -8.489
96 HB2 LYS 17 1HB LYS 17 -1.451 -3.998 -7.346
97 HB3 LYS 17 2HB LYS 17 -0.459 -3.075 -8.488
98 HG2 LYS 17 1HG LYS 17 -0.695 -4.717 -10.220
99 HG3 LYS 17 2HG LYS 17 -1.342 -5.903 -9.093
100 HD2 LYS 17 1HD LYS 17 -3.325 -4.262 -8.740
101 HD3 LYS 17 2HD LYS 17 -2.697 -3.387 -10.137
102 HE2 LYS 17 1HE LYS 17 -4.458 -4.895 -10.851
103 HE3 LYS 17 2HE LYS 17 -2.920 -5.455 -11.519
104 HZ1 LYS 17 3HZ LYS 17 -2.832 -7.150 -9.812
105 HZ2 LYS 17 1HZ LYS 17 -4.313 -7.248 -10.507
106 HZ3 LYS 17 2HZ LYS 17 -4.120 -6.554 -9.023
107 H SER 18 H SER 18 2.484 -3.351 -8.246
108 HA SER 18 HA SER 18 3.293 -2.791 -5.455
109 HB2 SER 18 1HB SER 18 4.841 -2.366 -8.018
110 HB3 SER 18 2HB SER 18 5.455 -2.145 -6.370
111 HG SER 18 HG SER 18 5.028 -4.367 -5.982
112 H PHE 19 H PHE 19 3.802 -0.849 -4.605
113 HA PHE 19 HA PHE 19 2.992 1.673 -5.964
114 HB2 PHE 19 1HB PHE 19 2.086 0.738 -3.212
115 HB3 PHE 19 2HB PHE 19 1.754 2.310 -3.920
116 HD1 PHE 19 2HD PHE 19 0.221 2.524 -5.894
117 HD2 PHE 19 1HD PHE 19 0.802 -1.237 -3.862
118 HE1 PHE 19 2HE PHE 19 -1.769 1.588 -7.050
119 HE2 PHE 19 1HE PHE 19 -1.182 -2.167 -5.024
120 HZ PHE 19 HZ PHE 19 -2.448 -0.769 -6.643
121 H SER 20 H SER 20 4.020 3.543 -5.194
122 HA SER 20 HA SER 20 6.622 3.076 -3.940
123 HB2 SER 20 1HB SER 20 7.008 5.449 -4.607
124 HB3 SER 20 2HB SER 20 6.553 4.374 -5.940
125 HG SER 20 HG SER 20 5.390 6.362 -5.984
126 H GLU 21 H GLU 21 3.561 4.314 -2.814
127 HA GLU 21 HA GLU 21 4.806 5.199 -0.260
128 HB2 GLU 21 1HB GLU 21 2.945 6.892 -1.969
129 HB3 GLU 21 2HB GLU 21 3.326 7.215 -0.279
130 HG2 GLU 21 1HG GLU 21 5.778 7.309 -0.913
131 HG3 GLU 21 2HG GLU 21 5.294 7.200 -2.611
132 H ASP 22 H ASP 22 3.483 5.228 1.543
133 HA ASP 22 HA ASP 22 1.864 2.967 1.822
134 HB2 ASP 22 1HB ASP 22 3.193 3.992 3.593
135 HB3 ASP 22 2HB ASP 22 2.200 5.447 3.551
136 H ARG 23 H ARG 23 0.784 6.357 1.391
137 HA ARG 23 HA ARG 23 -2.023 5.774 1.796
138 HB2 ARG 23 1HB ARG 23 -2.475 7.978 1.007
139 HB3 ARG 23 2HB ARG 23 -1.036 8.045 2.022
140 HG2 ARG 23 1HG ARG 23 0.378 8.053 -0.057
141 HG3 ARG 23 2HG ARG 23 -1.097 8.074 -1.034
142 HD2 ARG 23 1HD ARG 23 -1.774 10.218 -0.055
143 HD3 ARG 23 2HD ARG 23 -0.345 10.234 0.981
144 HE ARG 23 HE ARG 23 -0.485 10.846 -1.883
145 HH11 ARG 23 2HH1 ARG 23 1.737 10.043 0.705
146 HH12 ARG 23 1HH1 ARG 23 3.147 10.225 -0.321
147 HH21 ARG 23 2HH2 ARG 23 1.373 11.094 -3.122
148 HH22 ARG 23 1HH2 ARG 23 2.918 10.640 -2.436
149 H LEU 24 H LEU 24 0.041 5.280 -0.971
150 HA LEU 24 HA LEU 24 -2.146 5.307 -2.924
151 HB2 LEU 24 1HB LEU 24 0.716 4.321 -3.201
152 HB3 LEU 24 2HB LEU 24 -0.427 4.571 -4.513
153 HG LEU 24 HG LEU 24 0.697 6.760 -2.707
154 HD11 LEU 24 1HD1 LEU 24 1.930 7.457 -4.708
155 HD12 LEU 24 2HD1 LEU 24 1.249 6.097 -5.628
156 HD13 LEU 24 3HD1 LEU 24 2.354 5.798 -4.269
157 HD21 LEU 24 3HD2 LEU 24 -1.539 7.396 -3.495
158 HD22 LEU 24 1HD2 LEU 24 -1.100 6.956 -5.161
159 HD23 LEU 24 2HD2 LEU 24 -0.306 8.324 -4.352
160 H ILE 25 H ILE 25 -0.208 2.735 -1.309
161 HA ILE 25 HA ILE 25 -1.779 0.610 -2.485
162 HB ILE 25 HB ILE 25 0.447 0.184 -1.606
163 HG12 ILE 25 1HG1 ILE 25 -1.703 -1.422 -0.157
164 HG13 ILE 25 2HG1 ILE 25 -1.300 -1.594 -1.867
165 HG21 ILE 25 1HG2 ILE 25 -0.727 0.498 1.188
166 HG22 ILE 25 2HG2 ILE 25 0.926 0.017 0.782
167 HG23 ILE 25 3HG2 ILE 25 0.396 1.641 0.400
168 HD11 ILE 25 3HD1 ILE 25 0.998 -2.281 -1.259
169 HD12 ILE 25 1HD1 ILE 25 0.569 -2.171 0.470
170 HD13 ILE 25 2HD1 ILE 25 -0.247 -3.341 -0.560
171 H LYS 26 H LYS 26 -2.149 2.457 0.596
172 HA LYS 26 HA LYS 26 -4.468 1.007 1.487
173 HB2 LYS 26 1HB LYS 26 -3.435 3.809 2.032
174 HB3 LYS 26 2HB LYS 26 -4.924 3.193 2.765
175 HG2 LYS 26 1HG LYS 26 -3.765 1.344 3.812
176 HG3 LYS 26 2HG LYS 26 -2.250 1.746 2.989
177 HD2 LYS 26 1HD LYS 26 -2.120 3.883 4.184
178 HD3 LYS 26 2HD LYS 26 -3.669 3.555 4.997
179 HE2 LYS 26 1HE LYS 26 -2.745 1.618 6.137
180 HE3 LYS 26 2HE LYS 26 -1.259 1.701 5.175
181 HZ1 LYS 26 3HZ LYS 26 -2.095 3.802 7.095
182 HZ2 LYS 26 1HZ LYS 26 -0.713 3.781 6.196
183 HZ3 LYS 26 2HZ LYS 26 -0.943 2.670 7.376
184 H SER 27 H SER 27 -4.236 3.843 -0.680
185 HA SER 27 HA SER 27 -7.052 4.138 -1.121
186 HB2 SER 27 1HB SER 27 -4.738 4.720 -3.012
187 HB3 SER 27 2HB SER 27 -6.418 5.230 -3.243
188 HG SER 27 HG SER 27 -4.626 5.980 -1.167
189 H HIS 28 H HIS 28 -4.627 2.098 -2.867
190 HA HIS 28 HA HIS 28 -6.465 0.948 -4.719
191 HB2 HIS 28 1HB HIS 28 -4.084 0.791 -5.039
192 HB3 HIS 28 2HB HIS 28 -3.858 -0.060 -3.519
193 HD1 HIS 28 1HD HIS 28 -5.665 -0.754 -6.894
194 HD2 HIS 28 2HD HIS 28 -3.809 -2.641 -3.626
195 HE1 HIS 28 1HE HIS 28 -5.627 -3.225 -7.459
196 H ILE 29 H ILE 29 -5.465 -0.240 -1.477
197 HA ILE 29 HA ILE 29 -7.133 -2.561 -1.456
198 HB ILE 29 HB ILE 29 -6.053 -0.850 0.810
199 HG12 ILE 29 1HG1 ILE 29 -5.209 -3.600 -0.238
200 HG13 ILE 29 2HG1 ILE 29 -4.412 -2.092 -0.669
201 HG21 ILE 29 1HG2 ILE 29 -6.616 -2.735 2.333
202 HG22 ILE 29 2HG2 ILE 29 -8.063 -2.039 1.640
203 HG23 ILE 29 3HG2 ILE 29 -7.435 -3.572 0.998
204 HD11 ILE 29 3HD1 ILE 29 -4.479 -3.335 2.097
205 HD12 ILE 29 1HD1 ILE 29 -3.098 -3.150 1.014
206 HD13 ILE 29 2HD1 ILE 29 -3.843 -1.709 1.734
207 H LYS 30 H LYS 30 -7.917 0.844 -0.458
208 HA LYS 30 HA LYS 30 -10.549 0.277 0.430
209 HB2 LYS 30 1HB LYS 30 -9.212 2.193 1.086
210 HB3 LYS 30 2HB LYS 30 -9.065 2.733 -0.581
211 HG2 LYS 30 1HG LYS 30 -10.542 4.119 0.576
212 HG3 LYS 30 2HG LYS 30 -11.434 3.250 -0.680
213 HD2 LYS 30 1HD LYS 30 -12.360 1.707 1.056
214 HD3 LYS 30 2HD LYS 30 -11.435 2.569 2.306
215 HE2 LYS 30 1HE LYS 30 -12.659 4.664 1.749
216 HE3 LYS 30 2HE LYS 30 -13.576 3.800 0.509
217 HZ1 LYS 30 3HZ LYS 30 -14.823 3.956 2.587
218 HZ2 LYS 30 1HZ LYS 30 -13.650 3.185 3.418
219 HZ3 LYS 30 2HZ LYS 30 -14.501 2.388 2.270
220 H THR 31 H THR 31 -9.375 1.149 -2.900
221 HA THR 31 HA THR 31 -12.111 1.310 -3.889
222 HB THR 31 HB THR 31 -10.958 1.696 -6.049
223 HG1 THR 31 1HG THR 31 -8.674 2.121 -5.836
224 HG21 THR 31 3HG2 THR 31 -10.018 3.888 -5.484
225 HG22 THR 31 1HG2 THR 31 -9.954 3.441 -3.766
226 HG23 THR 31 2HG2 THR 31 -11.518 3.597 -4.590
227 H ASN 32 H ASN 32 -9.511 -1.108 -4.067
228 HA ASN 32 HA ASN 32 -11.153 -2.754 -5.949
229 HB2 ASN 32 1HB ASN 32 -8.191 -2.760 -5.235
230 HB3 ASN 32 2HB ASN 32 -8.963 -4.001 -6.203
231 HD21 ASN 32 1HD2 ASN 32 -8.571 -0.386 -6.170
232 HD22 ASN 32 2HD2 ASN 32 -8.513 -0.307 -7.923
233 H HIS 33 H HIS 33 -9.951 -2.859 -2.626
234 HA HIS 33 HA HIS 33 -10.997 -5.638 -2.330
235 HB2 HIS 33 1HB HIS 33 -8.406 -4.641 -1.122
236 HB3 HIS 33 2HB HIS 33 -9.021 -6.288 -1.159
237 HD1 HIS 33 1HD HIS 33 -9.439 -6.904 -4.142
238 HD2 HIS 33 2HD HIS 33 -6.387 -4.431 -2.660
239 HE1 HIS 33 1HE HIS 33 -7.640 -6.888 -5.931
240 HA PRO 34 HA PRO 34 -12.042 -2.431 1.090
241 HB2 PRO 34 1HB PRO 34 -14.774 -2.198 0.850
242 HB3 PRO 34 2HB PRO 34 -13.597 -1.207 -0.065
243 HG2 PRO 34 1HG PRO 34 -15.012 -3.738 -0.977
244 HG3 PRO 34 2HG PRO 34 -14.878 -2.170 -1.844
245 HD2 PRO 34 1HD PRO 34 -13.184 -4.194 -2.406
246 HD3 PRO 34 2HD PRO 34 -12.584 -2.510 -2.296
247 H GLU 35 H GLU 35 -13.657 -5.474 0.251
248 HA GLU 35 HA GLU 35 -14.550 -5.975 3.008
249 HB2 GLU 35 1HB GLU 35 -15.523 -7.994 2.136
250 HB3 GLU 35 2HB GLU 35 -15.944 -6.622 1.117
251 HG2 GLU 35 1HG GLU 35 -14.167 -7.309 -0.515
252 HG3 GLU 35 2HG GLU 35 -13.803 -8.706 0.499
253 H VAL 36 H VAL 36 -11.555 -5.999 1.803
254 HA VAL 36 HA VAL 36 -10.643 -8.479 3.183
255 HB VAL 36 HB VAL 36 -9.019 -7.262 0.975
256 HG11 VAL 36 1HG1 VAL 36 -9.626 -10.137 1.813
257 HG12 VAL 36 2HG1 VAL 36 -8.471 -9.643 0.560
258 HG13 VAL 36 3HG1 VAL 36 -8.168 -9.227 2.247
259 HG21 VAL 36 3HG2 VAL 36 -11.429 -9.043 0.435
260 HG22 VAL 36 1HG2 VAL 36 -11.226 -7.368 -0.123
261 HG23 VAL 36 2HG2 VAL 36 -10.161 -8.630 -0.738
262 H SER 37 H SER 37 -10.930 -5.619 4.176
263 HA SER 37 HA SER 37 -8.264 -4.614 4.719
264 HB2 SER 37 1HB SER 37 -9.455 -3.023 6.197
265 HB3 SER 37 2HB SER 37 -10.080 -3.065 4.540
266 HG SER 37 HG SER 37 -11.789 -3.119 6.102
Start of MODEL 13
1 H1 GLY 1 1H GLY 1 19.619 -7.091 -13.116
2 H2 GLY 1 2H GLY 1 18.992 -6.290 -14.398
3 H3 GLY 1 3H GLY 1 18.414 -7.771 -13.994
4 HA2 GLY 1 1HA GLY 1 16.852 -6.084 -13.306
5 HA3 GLY 1 2HA GLY 1 17.544 -6.936 -11.913
6 H SER 2 H SER 2 16.911 -5.035 -10.684
7 HA SER 2 HA SER 2 19.030 -2.977 -10.570
8 HB2 SER 2 1HB SER 2 17.397 -1.143 -10.466
9 HB3 SER 2 2HB SER 2 17.359 -1.966 -12.029
10 HG SER 2 HG SER 2 15.250 -1.584 -11.208
11 H SER 3 H SER 3 18.874 -1.634 -8.613
12 HA SER 3 HA SER 3 17.620 -2.983 -6.260
13 HB2 SER 3 1HB SER 3 20.517 -2.081 -6.476
14 HB3 SER 3 2HB SER 3 19.723 -2.683 -5.011
15 HG SER 3 HG SER 3 20.914 -4.321 -6.105
16 H GLY 4 H GLY 4 17.343 -1.670 -4.400
17 HA2 GLY 4 1HA GLY 4 18.050 1.094 -4.211
18 HA3 GLY 4 2HA GLY 4 16.389 0.954 -4.792
19 H SER 5 H SER 5 16.705 2.236 -2.502
20 HA SER 5 HA SER 5 15.345 0.545 -0.506
21 HB2 SER 5 1HB SER 5 17.768 0.193 -0.036
22 HB3 SER 5 2HB SER 5 17.964 1.938 0.192
23 HG SER 5 HG SER 5 17.635 0.782 2.172
24 H SER 6 H SER 6 16.786 3.785 -1.164
25 HA SER 6 HA SER 6 15.521 5.295 0.749
26 HB2 SER 6 1HB SER 6 16.105 6.164 -2.106
27 HB3 SER 6 2HB SER 6 15.911 7.224 -0.695
28 HG SER 6 HG SER 6 18.123 6.786 -1.152
29 H GLY 7 H GLY 7 13.565 6.094 1.164
30 HA2 GLY 7 1HA GLY 7 11.373 6.787 0.921
31 HA3 GLY 7 2HA GLY 7 11.472 6.511 -0.817
32 H ARG 8 H ARG 8 12.426 3.617 0.231
33 HA ARG 8 HA ARG 8 11.574 1.539 0.274
34 HB2 ARG 8 1HB ARG 8 9.314 2.725 1.922
35 HB3 ARG 8 2HB ARG 8 9.753 1.023 1.824
36 HG2 ARG 8 1HG ARG 8 12.007 1.542 2.753
37 HG3 ARG 8 2HG ARG 8 11.518 3.228 2.976
38 HD2 ARG 8 1HD ARG 8 10.160 0.813 4.242
39 HD3 ARG 8 2HD ARG 8 11.332 1.872 5.043
40 HE ARG 8 HE ARG 8 9.228 3.497 4.034
41 HH11 ARG 8 2HH1 ARG 8 9.650 1.110 6.562
42 HH12 ARG 8 1HH1 ARG 8 8.389 1.799 7.549
43 HH21 ARG 8 2HH2 ARG 8 7.652 4.337 5.344
44 HH22 ARG 8 1HH2 ARG 8 7.296 3.587 6.874
45 H SER 9 H SER 9 9.613 0.090 -0.086
46 HA SER 9 HA SER 9 7.674 1.101 -2.062
47 HB2 SER 9 1HB SER 9 8.063 -0.765 -3.598
48 HB3 SER 9 2HB SER 9 9.482 0.283 -3.467
49 HG SER 9 HG SER 9 10.047 -1.943 -3.366
50 H TYR 10 H TYR 10 5.918 -0.389 -2.454
51 HA TYR 10 HA TYR 10 5.282 -2.243 -0.199
52 HB2 TYR 10 1HB TYR 10 3.448 -0.101 -1.343
53 HB3 TYR 10 2HB TYR 10 3.098 -1.192 -0.012
54 HD1 TYR 10 2HD TYR 10 4.987 1.821 -1.059
55 HD2 TYR 10 1HD TYR 10 3.971 -0.769 2.239
56 HE1 TYR 10 2HE TYR 10 5.954 3.475 0.541
57 HE2 TYR 10 1HE TYR 10 4.890 0.905 3.835
58 HH TYR 10 HH TYR 10 5.911 2.924 4.082
59 H SER 11 H SER 11 3.640 -3.858 -0.740
60 HA SER 11 HA SER 11 2.698 -3.906 -3.532
61 HB2 SER 11 1HB SER 11 3.221 -6.282 -3.832
62 HB3 SER 11 2HB SER 11 4.663 -5.265 -3.688
63 HG SER 11 HG SER 11 4.846 -7.170 -2.428
64 H CYS 12 H CYS 12 0.748 -4.778 -3.900
65 HA CYS 12 HA CYS 12 -1.137 -4.671 -1.856
66 HB2 CYS 12 1HB CYS 12 -1.595 -4.213 -4.168
67 HB3 CYS 12 2HB CYS 12 -1.284 -5.905 -4.608
68 HA PRO 13 HA PRO 13 -0.822 -8.852 -0.169
69 HB2 PRO 13 1HB PRO 13 -2.811 -8.759 1.701
70 HB3 PRO 13 2HB PRO 13 -1.265 -7.878 1.877
71 HG2 PRO 13 1HG PRO 13 -3.918 -6.799 0.883
72 HG3 PRO 13 2HG PRO 13 -2.818 -6.083 2.100
73 HD2 PRO 13 1HD PRO 13 -2.820 -5.316 -0.532
74 HD3 PRO 13 2HD PRO 13 -1.325 -5.334 0.451
75 H VAL 14 H VAL 14 -3.357 -7.654 -2.126
76 HA VAL 14 HA VAL 14 -4.808 -10.283 -2.128
77 HB VAL 14 HB VAL 14 -5.868 -7.599 -3.027
78 HG11 VAL 14 1HG1 VAL 14 -8.077 -8.712 -2.817
79 HG12 VAL 14 2HG1 VAL 14 -7.070 -9.493 -4.032
80 HG13 VAL 14 3HG1 VAL 14 -7.263 -10.242 -2.431
81 HG21 VAL 14 3HG2 VAL 14 -7.222 -7.683 -0.901
82 HG22 VAL 14 1HG2 VAL 14 -6.195 -9.027 -0.358
83 HG23 VAL 14 2HG2 VAL 14 -5.505 -7.412 -0.645
84 H CYS 15 H CYS 15 -3.331 -7.857 -4.306
85 HA CYS 15 HA CYS 15 -3.476 -9.872 -6.494
86 HB2 CYS 15 1HB CYS 15 -4.085 -8.264 -8.095
87 HB3 CYS 15 2HB CYS 15 -5.302 -8.308 -6.820
88 H GLU 16 H GLU 16 -1.362 -8.335 -4.668
89 HA GLU 16 HA GLU 16 0.851 -8.027 -4.679
90 HB2 GLU 16 1HB GLU 16 0.441 -10.434 -5.612
91 HB3 GLU 16 2HB GLU 16 1.174 -9.793 -7.084
92 HG2 GLU 16 1HG GLU 16 3.210 -9.177 -5.752
93 HG3 GLU 16 2HG GLU 16 2.414 -9.753 -4.290
94 H LYS 17 H LYS 17 -0.754 -6.258 -6.745
95 HA LYS 17 HA LYS 17 1.247 -5.184 -8.504
96 HB2 LYS 17 1HB LYS 17 -1.146 -4.653 -8.757
97 HB3 LYS 17 2HB LYS 17 -1.144 -3.813 -7.193
98 HG2 LYS 17 1HG LYS 17 0.524 -2.210 -8.057
99 HG3 LYS 17 2HG LYS 17 0.535 -3.032 -9.625
100 HD2 LYS 17 1HD LYS 17 -1.821 -2.375 -9.958
101 HD3 LYS 17 2HD LYS 17 -1.860 -1.623 -8.357
102 HE2 LYS 17 1HE LYS 17 -0.060 -0.817 -10.694
103 HE3 LYS 17 2HE LYS 17 -1.510 0.041 -10.173
104 HZ1 LYS 17 3HZ LYS 17 0.971 -0.266 -8.537
105 HZ2 LYS 17 1HZ LYS 17 -0.384 0.490 -8.039
106 HZ3 LYS 17 2HZ LYS 17 0.477 1.097 -9.289
107 H SER 18 H SER 18 2.871 -3.749 -8.227
108 HA SER 18 HA SER 18 3.759 -3.045 -5.542
109 HB2 SER 18 1HB SER 18 4.944 -2.332 -8.241
110 HB3 SER 18 2HB SER 18 5.714 -2.098 -6.659
111 HG SER 18 HG SER 18 6.384 -4.052 -7.688
112 H PHE 19 H PHE 19 4.095 -1.041 -4.685
113 HA PHE 19 HA PHE 19 3.093 1.423 -6.007
114 HB2 PHE 19 1HB PHE 19 2.220 0.332 -3.306
115 HB3 PHE 19 2HB PHE 19 2.032 2.016 -3.758
116 HD1 PHE 19 2HD PHE 19 0.445 2.736 -5.465
117 HD2 PHE 19 1HD PHE 19 0.782 -1.412 -4.334
118 HE1 PHE 19 2HE PHE 19 -1.731 2.262 -6.565
119 HE2 PHE 19 1HE PHE 19 -1.369 -1.895 -5.477
120 HZ PHE 19 HZ PHE 19 -2.613 -0.060 -6.609
121 H SER 20 H SER 20 4.015 3.338 -5.222
122 HA SER 20 HA SER 20 6.640 3.012 -3.904
123 HB2 SER 20 1HB SER 20 5.405 5.431 -5.257
124 HB3 SER 20 2HB SER 20 7.091 5.250 -4.737
125 HG SER 20 HG SER 20 6.819 4.790 -6.975
126 H GLU 21 H GLU 21 3.507 4.013 -2.869
127 HA GLU 21 HA GLU 21 4.627 5.334 -0.445
128 HB2 GLU 21 1HB GLU 21 2.502 6.529 -2.255
129 HB3 GLU 21 2HB GLU 21 2.906 7.115 -0.643
130 HG2 GLU 21 1HG GLU 21 5.199 7.649 -1.390
131 HG3 GLU 21 2HG GLU 21 4.826 7.043 -3.008
132 H ASP 22 H ASP 22 3.460 5.115 1.385
133 HA ASP 22 HA ASP 22 1.766 2.914 1.772
134 HB2 ASP 22 1HB ASP 22 3.185 3.947 3.474
135 HB3 ASP 22 2HB ASP 22 2.225 5.423 3.427
136 H ARG 23 H ARG 23 0.863 6.343 1.313
137 HA ARG 23 HA ARG 23 -1.970 5.958 1.752
138 HB2 ARG 23 1HB ARG 23 -2.233 8.201 0.805
139 HB3 ARG 23 2HB ARG 23 -0.972 8.137 2.036
140 HG2 ARG 23 1HG ARG 23 0.774 8.124 0.276
141 HG3 ARG 23 2HG ARG 23 -0.477 8.158 -0.982
142 HD2 ARG 23 1HD ARG 23 -1.251 10.333 -0.237
143 HD3 ARG 23 2HD ARG 23 -0.139 10.304 1.150
144 HE ARG 23 HE ARG 23 1.601 9.976 -0.927
145 HH11 ARG 23 2HH1 ARG 23 -0.811 12.497 -0.451
146 HH12 ARG 23 1HH1 ARG 23 0.116 13.627 -1.403
147 HH21 ARG 23 1HH2 ARG 23 2.636 11.326 -2.026
148 HH22 ARG 23 2HH2 ARG 23 2.086 12.984 -2.307
149 H LEU 24 H LEU 24 0.005 5.488 -1.117
150 HA LEU 24 HA LEU 24 -2.284 5.493 -2.952
151 HB2 LEU 24 1HB LEU 24 0.590 4.568 -3.346
152 HB3 LEU 24 2HB LEU 24 -0.633 4.676 -4.609
153 HG LEU 24 HG LEU 24 0.442 7.049 -3.029
154 HD11 LEU 24 1HD1 LEU 24 0.905 6.193 -5.918
155 HD12 LEU 24 2HD1 LEU 24 2.084 6.037 -4.598
156 HD13 LEU 24 3HD1 LEU 24 1.562 7.643 -5.125
157 HD21 LEU 24 3HD2 LEU 24 -0.708 8.411 -4.761
158 HD22 LEU 24 1HD2 LEU 24 -1.844 7.514 -3.754
159 HD23 LEU 24 2HD2 LEU 24 -1.472 6.937 -5.397
160 H ILE 25 H ILE 25 -0.242 2.934 -1.440
161 HA ILE 25 HA ILE 25 -1.826 0.810 -2.574
162 HB ILE 25 HB ILE 25 0.442 0.436 -1.797
163 HG12 ILE 25 1HG1 ILE 25 -1.601 -1.278 -0.326
164 HG13 ILE 25 2HG1 ILE 25 -1.241 -1.394 -2.052
165 HG21 ILE 25 1HG2 ILE 25 1.031 0.232 0.554
166 HG22 ILE 25 2HG2 ILE 25 0.394 1.834 0.258
167 HG23 ILE 25 3HG2 ILE 25 -0.631 0.605 1.048
168 HD11 ILE 25 3HD1 ILE 25 1.084 -2.035 -1.536
169 HD12 ILE 25 1HD1 ILE 25 0.728 -1.942 0.212
170 HD13 ILE 25 2HD1 ILE 25 -0.103 -3.125 -0.782
171 H LYS 26 H LYS 26 -2.134 2.592 0.561
172 HA LYS 26 HA LYS 26 -4.393 1.067 1.485
173 HB2 LYS 26 1HB LYS 26 -3.408 3.880 2.063
174 HB3 LYS 26 2HB LYS 26 -4.888 3.241 2.793
175 HG2 LYS 26 1HG LYS 26 -3.717 1.393 3.817
176 HG3 LYS 26 2HG LYS 26 -2.207 1.805 2.988
177 HD2 LYS 26 1HD LYS 26 -2.076 3.934 4.195
178 HD3 LYS 26 2HD LYS 26 -3.619 3.600 5.016
179 HE2 LYS 26 1HE LYS 26 -2.687 1.673 6.154
180 HE3 LYS 26 2HE LYS 26 -1.214 1.740 5.173
181 HZ1 LYS 26 3HZ LYS 26 -2.009 3.855 7.095
182 HZ2 LYS 26 1HZ LYS 26 -0.641 3.822 6.175
183 HZ3 LYS 26 2HZ LYS 26 -0.857 2.718 7.362
184 H SER 27 H SER 27 -4.319 3.996 -0.588
185 HA SER 27 HA SER 27 -7.143 4.204 -0.948
186 HB2 SER 27 1HB SER 27 -5.476 5.921 -1.610
187 HB3 SER 27 2HB SER 27 -4.945 4.875 -2.943
188 HG SER 27 HG SER 27 -6.535 6.443 -3.576
189 H HIS 28 H HIS 28 -4.719 2.318 -2.839
190 HA HIS 28 HA HIS 28 -6.525 1.147 -4.675
191 HB2 HIS 28 1HB HIS 28 -4.170 1.056 -5.059
192 HB3 HIS 28 2HB HIS 28 -3.859 0.247 -3.535
193 HD1 HIS 28 1HD HIS 28 -5.327 -0.582 -7.003
194 HD2 HIS 28 2HD HIS 28 -3.951 -2.374 -3.457
195 HE1 HIS 28 1HE HIS 28 -5.217 -3.065 -7.486
196 H ILE 29 H ILE 29 -5.424 -0.172 -1.519
197 HA ILE 29 HA ILE 29 -7.038 -2.534 -1.591
198 HB ILE 29 HB ILE 29 -5.903 -0.938 0.734
199 HG12 ILE 29 1HG1 ILE 29 -4.994 -3.582 -0.513
200 HG13 ILE 29 2HG1 ILE 29 -4.266 -2.023 -0.876
201 HG21 ILE 29 1HG2 ILE 29 -6.331 -2.926 2.154
202 HG22 ILE 29 2HG2 ILE 29 -7.833 -2.261 1.559
203 HG23 ILE 29 3HG2 ILE 29 -7.163 -3.722 0.802
204 HD11 ILE 29 3HD1 ILE 29 -3.654 -1.758 1.538
205 HD12 ILE 29 1HD1 ILE 29 -4.191 -3.439 1.805
206 HD13 ILE 29 2HD1 ILE 29 -2.858 -3.102 0.700
207 H LYS 30 H LYS 30 -7.830 0.778 -0.352
208 HA LYS 30 HA LYS 30 -10.341 0.097 0.748
209 HB2 LYS 30 1HB LYS 30 -8.926 2.034 1.325
210 HB3 LYS 30 2HB LYS 30 -9.172 2.719 -0.294
211 HG2 LYS 30 1HG LYS 30 -11.547 2.920 0.127
212 HG3 LYS 30 2HG LYS 30 -11.369 2.089 1.684
213 HD2 LYS 30 1HD LYS 30 -11.624 4.469 2.079
214 HD3 LYS 30 2HD LYS 30 -9.981 3.981 2.523
215 HE2 LYS 30 1HE LYS 30 -9.128 4.856 0.364
216 HE3 LYS 30 2HE LYS 30 -10.774 5.274 -0.131
217 HZ1 LYS 30 3HZ LYS 30 -10.867 6.842 1.730
218 HZ2 LYS 30 1HZ LYS 30 -9.603 7.203 0.767
219 HZ3 LYS 30 2HZ LYS 30 -9.350 6.456 2.197
220 H THR 31 H THR 31 -9.482 1.164 -2.556
221 HA THR 31 HA THR 31 -12.350 1.232 -3.267
222 HB THR 31 HB THR 31 -10.713 3.036 -3.853
223 HG1 THR 31 1HG THR 31 -11.803 3.415 -5.766
224 HG21 THR 31 3HG2 THR 31 -10.043 1.256 -6.224
225 HG22 THR 31 1HG2 THR 31 -8.935 1.535 -4.857
226 HG23 THR 31 2HG2 THR 31 -9.441 2.889 -5.875
227 H ASN 32 H ASN 32 -9.638 -0.959 -3.888
228 HA ASN 32 HA ASN 32 -11.315 -2.485 -5.840
229 HB2 ASN 32 1HB ASN 32 -8.367 -2.770 -5.142
230 HB3 ASN 32 2HB ASN 32 -9.237 -3.683 -6.362
231 HD21 ASN 32 1HD2 ASN 32 -7.774 -0.636 -5.607
232 HD22 ASN 32 2HD2 ASN 32 -7.979 0.073 -7.220
233 H HIS 33 H HIS 33 -10.027 -2.806 -2.554
234 HA HIS 33 HA HIS 33 -11.013 -5.617 -2.451
235 HB2 HIS 33 1HB HIS 33 -8.475 -4.608 -1.151
236 HB3 HIS 33 2HB HIS 33 -9.020 -6.269 -1.310
237 HD1 HIS 33 1HD HIS 33 -9.470 -6.494 -4.426
238 HD2 HIS 33 2HD HIS 33 -6.307 -4.497 -2.519
239 HE1 HIS 33 1HE HIS 33 -7.576 -6.432 -6.115
240 HA PRO 34 HA PRO 34 -11.994 -2.930 1.442
241 HB2 PRO 34 1HB PRO 34 -14.659 -2.328 1.201
242 HB3 PRO 34 2HB PRO 34 -13.338 -1.305 0.558
243 HG2 PRO 34 1HG PRO 34 -15.003 -3.365 -0.929
244 HG3 PRO 34 2HG PRO 34 -14.630 -1.680 -1.422
245 HD2 PRO 34 1HD PRO 34 -13.191 -3.772 -2.369
246 HD3 PRO 34 2HD PRO 34 -12.396 -2.225 -1.939
247 H GLU 35 H GLU 35 -13.944 -5.448 -0.140
248 HA GLU 35 HA GLU 35 -15.099 -6.462 2.339
249 HB2 GLU 35 1HB GLU 35 -16.026 -8.209 0.954
250 HB3 GLU 35 2HB GLU 35 -16.262 -6.639 0.195
251 HG2 GLU 35 1HG GLU 35 -14.323 -7.092 -1.321
252 HG3 GLU 35 2HG GLU 35 -14.115 -8.672 -0.567
253 H VAL 36 H VAL 36 -11.979 -6.592 1.250
254 HA VAL 36 HA VAL 36 -11.404 -9.368 2.140
255 HB VAL 36 HB VAL 36 -9.475 -7.553 0.684
256 HG11 VAL 36 1HG1 VAL 36 -8.561 -9.659 1.545
257 HG12 VAL 36 2HG1 VAL 36 -9.870 -10.575 0.765
258 HG13 VAL 36 3HG1 VAL 36 -8.659 -9.728 -0.214
259 HG21 VAL 36 3HG2 VAL 36 -11.482 -7.514 -0.748
260 HG22 VAL 36 1HG2 VAL 36 -10.251 -8.544 -1.469
261 HG23 VAL 36 2HG2 VAL 36 -11.628 -9.280 -0.621
262 H SER 37 H SER 37 -10.924 -6.061 3.067
263 HA SER 37 HA SER 37 -8.628 -6.189 4.729
264 HB2 SER 37 1HB SER 37 -11.129 -4.472 5.004
265 HB3 SER 37 2HB SER 37 -9.568 -4.164 5.787
266 HG SER 37 HG SER 37 -8.626 -3.995 3.687
Start of MODEL 14
1 H1 GLY 1 1H GLY 1 26.149 0.925 -6.415
2 H2 GLY 1 2H GLY 1 26.307 0.373 -7.949
3 H3 GLY 1 3H GLY 1 24.841 0.354 -7.217
4 HA2 GLY 1 1HA GLY 1 26.356 2.780 -7.931
5 HA3 GLY 1 2HA GLY 1 24.954 2.152 -8.819
6 H SER 2 H SER 2 25.434 4.740 -7.328
7 HA SER 2 HA SER 2 23.580 4.653 -5.048
8 HB2 SER 2 1HB SER 2 24.277 7.016 -4.778
9 HB3 SER 2 2HB SER 2 25.633 5.879 -4.814
10 HG SER 2 HG SER 2 26.004 7.733 -6.136
11 H SER 3 H SER 3 23.117 5.097 -8.372
12 HA SER 3 HA SER 3 21.282 7.253 -8.474
13 HB2 SER 3 1HB SER 3 21.439 4.839 -10.315
14 HB3 SER 3 2HB SER 3 20.721 6.410 -10.698
15 HG SER 3 HG SER 3 22.783 7.352 -10.526
16 H GLY 4 H GLY 4 19.050 7.359 -8.744
17 HA2 GLY 4 1HA GLY 4 16.825 6.732 -8.692
18 HA3 GLY 4 2HA GLY 4 17.281 5.052 -8.464
19 H SER 5 H SER 5 15.136 5.930 -7.196
20 HA SER 5 HA SER 5 15.855 6.166 -4.301
21 HB2 SER 5 1HB SER 5 13.913 7.663 -4.049
22 HB3 SER 5 2HB SER 5 15.134 8.322 -5.147
23 HG SER 5 HG SER 5 13.005 8.530 -5.995
24 H SER 6 H SER 6 14.673 3.967 -6.339
25 HA SER 6 HA SER 6 12.141 3.260 -5.110
26 HB2 SER 6 1HB SER 6 12.173 1.444 -6.824
27 HB3 SER 6 2HB SER 6 12.366 3.077 -7.472
28 HG SER 6 HG SER 6 13.874 1.572 -8.376
29 H GLY 7 H GLY 7 14.697 2.997 -3.444
30 HA2 GLY 7 1HA GLY 7 15.284 0.242 -2.986
31 HA3 GLY 7 2HA GLY 7 15.616 1.582 -1.886
32 H ARG 8 H ARG 8 12.550 2.101 -1.891
33 HA ARG 8 HA ARG 8 11.549 -0.226 -0.299
34 HB2 ARG 8 1HB ARG 8 11.207 2.724 0.384
35 HB3 ARG 8 2HB ARG 8 10.319 1.420 1.154
36 HG2 ARG 8 1HG ARG 8 13.352 1.757 1.317
37 HG3 ARG 8 2HG ARG 8 12.189 2.358 2.490
38 HD2 ARG 8 1HD ARG 8 12.978 0.377 3.438
39 HD3 ARG 8 2HD ARG 8 11.373 -0.030 2.809
40 HE ARG 8 HE ARG 8 13.434 -0.585 0.858
41 HH11 ARG 8 2HH1 ARG 8 12.167 -2.002 3.806
42 HH12 ARG 8 1HH1 ARG 8 12.665 -3.606 3.335
43 HH21 ARG 8 2HH2 ARG 8 14.003 -2.577 0.320
44 HH22 ARG 8 1HH2 ARG 8 13.703 -3.927 1.388
45 H SER 9 H SER 9 9.627 -0.917 -0.824
46 HA SER 9 HA SER 9 7.680 0.738 -2.333
47 HB2 SER 9 1HB SER 9 8.574 -2.033 -3.226
48 HB3 SER 9 2HB SER 9 7.245 -1.087 -3.923
49 HG SER 9 HG SER 9 9.190 -0.886 -5.131
50 H TYR 10 H TYR 10 5.542 -0.183 -2.357
51 HA TYR 10 HA TYR 10 4.915 -2.051 -0.099
52 HB2 TYR 10 1HB TYR 10 3.224 0.194 -1.261
53 HB3 TYR 10 2HB TYR 10 2.776 -0.885 0.049
54 HD1 TYR 10 2HD TYR 10 5.091 1.875 -0.932
55 HD2 TYR 10 1HD TYR 10 3.435 -0.429 2.318
56 HE1 TYR 10 2HE TYR 10 6.106 3.454 0.698
57 HE2 TYR 10 1HE TYR 10 4.410 1.186 3.950
58 HH TYR 10 HH TYR 10 6.379 3.996 2.912
59 H SER 11 H SER 11 3.654 -3.838 -0.593
60 HA SER 11 HA SER 11 2.779 -4.169 -3.443
61 HB2 SER 11 1HB SER 11 3.979 -6.265 -1.613
62 HB3 SER 11 2HB SER 11 3.370 -6.530 -3.259
63 HG SER 11 HG SER 11 5.655 -6.206 -3.194
64 H CYS 12 H CYS 12 0.760 -4.772 -3.816
65 HA CYS 12 HA CYS 12 -1.249 -4.684 -1.933
66 HB2 CYS 12 1HB CYS 12 -1.597 -4.327 -4.275
67 HB3 CYS 12 2HB CYS 12 -1.165 -6.005 -4.643
68 HA PRO 13 HA PRO 13 -1.012 -8.769 -0.031
69 HB2 PRO 13 1HB PRO 13 -3.189 -8.653 1.619
70 HB3 PRO 13 2HB PRO 13 -1.699 -7.706 1.902
71 HG2 PRO 13 1HG PRO 13 -4.260 -6.781 0.562
72 HG3 PRO 13 2HG PRO 13 -3.337 -5.967 1.865
73 HD2 PRO 13 1HD PRO 13 -3.045 -5.306 -0.768
74 HD3 PRO 13 2HD PRO 13 -1.661 -5.272 0.366
75 H VAL 14 H VAL 14 -3.434 -7.783 -2.259
76 HA VAL 14 HA VAL 14 -4.698 -10.513 -2.283
77 HB VAL 14 HB VAL 14 -5.915 -7.860 -3.080
78 HG11 VAL 14 1HG1 VAL 14 -6.897 -9.660 -4.428
79 HG12 VAL 14 2HG1 VAL 14 -7.130 -10.656 -2.973
80 HG13 VAL 14 3HG1 VAL 14 -8.050 -9.153 -3.196
81 HG21 VAL 14 3HG2 VAL 14 -5.744 -8.039 -0.640
82 HG22 VAL 14 1HG2 VAL 14 -7.417 -8.256 -1.133
83 HG23 VAL 14 2HG2 VAL 14 -6.444 -9.672 -0.684
84 H CYS 15 H CYS 15 -3.336 -7.973 -4.405
85 HA CYS 15 HA CYS 15 -3.282 -9.981 -6.598
86 HB2 CYS 15 1HB CYS 15 -4.082 -8.510 -8.188
87 HB3 CYS 15 2HB CYS 15 -5.264 -8.582 -6.886
88 H GLU 16 H GLU 16 -1.327 -8.476 -4.760
89 HA GLU 16 HA GLU 16 0.881 -8.042 -4.705
90 HB2 GLU 16 1HB GLU 16 0.955 -9.821 -7.154
91 HB3 GLU 16 2HB GLU 16 2.314 -9.445 -6.092
92 HG2 GLU 16 1HG GLU 16 1.089 -10.459 -4.172
93 HG3 GLU 16 2HG GLU 16 -0.211 -10.936 -5.267
94 H LYS 17 H LYS 17 -0.728 -6.222 -6.717
95 HA LYS 17 HA LYS 17 1.270 -5.041 -8.422
96 HB2 LYS 17 1HB LYS 17 -1.302 -3.943 -7.222
97 HB3 LYS 17 2HB LYS 17 -0.303 -3.031 -8.367
98 HG2 LYS 17 1HG LYS 17 -0.587 -4.690 -10.101
99 HG3 LYS 17 2HG LYS 17 -1.334 -5.814 -8.969
100 HD2 LYS 17 1HD LYS 17 -3.213 -4.098 -8.657
101 HD3 LYS 17 2HD LYS 17 -2.487 -3.180 -9.977
102 HE2 LYS 17 1HE LYS 17 -4.324 -4.541 -10.814
103 HE3 LYS 17 2HE LYS 17 -2.801 -5.107 -11.508
104 HZ1 LYS 17 3HZ LYS 17 -4.064 -6.365 -9.121
105 HZ2 LYS 17 1HZ LYS 17 -2.811 -6.949 -9.975
106 HZ3 LYS 17 2HZ LYS 17 -4.299 -6.911 -10.659
107 H SER 18 H SER 18 2.462 -3.200 -8.228
108 HA SER 18 HA SER 18 3.471 -2.718 -5.472
109 HB2 SER 18 1HB SER 18 5.005 -3.647 -7.178
110 HB3 SER 18 2HB SER 18 4.855 -2.121 -8.084
111 HG SER 18 HG SER 18 6.684 -2.166 -6.676
112 H PHE 19 H PHE 19 3.900 -0.781 -4.654
113 HA PHE 19 HA PHE 19 2.972 1.737 -5.947
114 HB2 PHE 19 1HB PHE 19 2.074 0.757 -3.208
115 HB3 PHE 19 2HB PHE 19 1.686 2.313 -3.921
116 HD1 PHE 19 2HD PHE 19 0.155 2.451 -5.912
117 HD2 PHE 19 1HD PHE 19 0.885 -1.266 -3.847
118 HE1 PHE 19 2HE PHE 19 -1.784 1.421 -7.075
119 HE2 PHE 19 1HE PHE 19 -1.047 -2.290 -5.020
120 HZ PHE 19 HZ PHE 19 -2.363 -0.960 -6.658
121 H SER 20 H SER 20 3.929 3.637 -5.111
122 HA SER 20 HA SER 20 6.525 3.196 -3.814
123 HB2 SER 20 1HB SER 20 6.919 5.559 -4.487
124 HB3 SER 20 2HB SER 20 6.501 4.474 -5.825
125 HG SER 20 HG SER 20 5.337 6.456 -5.919
126 H GLU 21 H GLU 21 3.433 4.221 -2.680
127 HA GLU 21 HA GLU 21 4.634 5.212 -0.144
128 HB2 GLU 21 1HB GLU 21 2.459 6.690 -1.666
129 HB3 GLU 21 2HB GLU 21 3.072 7.091 -0.063
130 HG2 GLU 21 1HG GLU 21 5.346 7.456 -1.077
131 HG3 GLU 21 2HG GLU 21 4.617 7.257 -2.678
132 H ASP 22 H ASP 22 3.366 5.034 1.681
133 HA ASP 22 HA ASP 22 1.653 2.833 1.979
134 HB2 ASP 22 1HB ASP 22 2.974 3.868 3.758
135 HB3 ASP 22 2HB ASP 22 2.024 5.347 3.652
136 H ARG 23 H ARG 23 0.785 6.263 1.455
137 HA ARG 23 HA ARG 23 -2.067 5.899 1.725
138 HB2 ARG 23 1HB ARG 23 -2.275 8.120 0.781
139 HB3 ARG 23 2HB ARG 23 -1.002 8.080 2.000
140 HG2 ARG 23 1HG ARG 23 0.720 7.999 0.201
141 HG3 ARG 23 2HG ARG 23 -0.562 8.039 -1.026
142 HD2 ARG 23 1HD ARG 23 -1.297 10.234 -0.248
143 HD3 ARG 23 2HD ARG 23 -0.089 10.205 1.056
144 HE ARG 23 HE ARG 23 1.380 9.796 -1.293
145 HH11 ARG 23 2HH1 ARG 23 -0.623 12.463 -0.171
146 HH12 ARG 23 1HH1 ARG 23 0.318 13.616 -1.081
147 HH21 ARG 23 2HH2 ARG 23 2.476 11.185 -2.290
148 HH22 ARG 23 1HH2 ARG 23 2.083 12.910 -2.304
149 H LEU 24 H LEU 24 0.065 5.267 -0.978
150 HA LEU 24 HA LEU 24 -2.098 5.319 -2.969
151 HB2 LEU 24 1HB LEU 24 0.800 4.418 -3.142
152 HB3 LEU 24 2HB LEU 24 -0.318 4.468 -4.500
153 HG LEU 24 HG LEU 24 0.543 6.905 -2.879
154 HD11 LEU 24 1HD1 LEU 24 2.386 5.930 -4.199
155 HD12 LEU 24 2HD1 LEU 24 1.870 7.485 -4.857
156 HD13 LEU 24 3HD1 LEU 24 1.373 5.977 -5.659
157 HD21 LEU 24 3HD2 LEU 24 -1.661 7.278 -3.879
158 HD22 LEU 24 1HD2 LEU 24 -1.076 6.682 -5.452
159 HD23 LEU 24 2HD2 LEU 24 -0.438 8.193 -4.761
160 H ILE 25 H ILE 25 -0.190 2.758 -1.297
161 HA ILE 25 HA ILE 25 -1.755 0.633 -2.477
162 HB ILE 25 HB ILE 25 0.441 0.193 -1.537
163 HG12 ILE 25 1HG1 ILE 25 -1.751 -1.367 -0.104
164 HG13 ILE 25 2HG1 ILE 25 -1.332 -1.565 -1.808
165 HG21 ILE 25 1HG2 ILE 25 0.835 0.057 0.884
166 HG22 ILE 25 2HG2 ILE 25 0.358 1.682 0.440
167 HG23 ILE 25 3HG2 ILE 25 -0.817 0.585 1.216
168 HD11 ILE 25 3HD1 ILE 25 0.517 -2.125 0.551
169 HD12 ILE 25 1HD1 ILE 25 -0.316 -3.304 -0.458
170 HD13 ILE 25 2HD1 ILE 25 0.943 -2.273 -1.174
171 H LYS 26 H LYS 26 -2.202 2.536 0.567
172 HA LYS 26 HA LYS 26 -4.572 1.113 1.378
173 HB2 LYS 26 1HB LYS 26 -3.518 3.896 1.970
174 HB3 LYS 26 2HB LYS 26 -5.061 3.320 2.619
175 HG2 LYS 26 1HG LYS 26 -4.018 1.447 3.734
176 HG3 LYS 26 2HG LYS 26 -2.450 1.794 2.990
177 HD2 LYS 26 1HD LYS 26 -2.314 3.934 4.181
178 HD3 LYS 26 2HD LYS 26 -3.910 3.657 4.918
179 HE2 LYS 26 1HE LYS 26 -3.101 1.705 6.115
180 HE3 LYS 26 2HE LYS 26 -1.574 1.726 5.218
181 HZ1 LYS 26 3HZ LYS 26 -1.314 2.703 7.421
182 HZ2 LYS 26 1HZ LYS 26 -2.418 3.870 7.087
183 HZ3 LYS 26 2HZ LYS 26 -1.002 3.797 6.245
184 H SER 27 H SER 27 -4.238 3.942 -0.801
185 HA SER 27 HA SER 27 -7.038 4.250 -1.321
186 HB2 SER 27 1HB SER 27 -4.673 4.785 -3.162
187 HB3 SER 27 2HB SER 27 -6.340 5.314 -3.439
188 HG SER 27 HG SER 27 -4.585 6.068 -1.330
189 H HIS 28 H HIS 28 -4.606 2.125 -2.932
190 HA HIS 28 HA HIS 28 -6.427 0.960 -4.802
191 HB2 HIS 28 1HB HIS 28 -4.036 0.799 -5.086
192 HB3 HIS 28 2HB HIS 28 -3.843 -0.047 -3.559
193 HD1 HIS 28 1HD HIS 28 -5.681 -0.733 -6.923
194 HD2 HIS 28 2HD HIS 28 -3.723 -2.618 -3.713
195 HE1 HIS 28 1HE HIS 28 -5.613 -3.198 -7.512
196 H ILE 29 H ILE 29 -5.455 -0.175 -1.532
197 HA ILE 29 HA ILE 29 -7.122 -2.487 -1.474
198 HB ILE 29 HB ILE 29 -6.011 -0.717 0.728
199 HG12 ILE 29 1HG1 ILE 29 -5.276 -3.538 -0.206
200 HG13 ILE 29 2HG1 ILE 29 -4.425 -2.076 -0.697
201 HG21 ILE 29 1HG2 ILE 29 -7.534 -3.341 1.030
202 HG22 ILE 29 2HG2 ILE 29 -6.625 -2.539 2.329
203 HG23 ILE 29 3HG2 ILE 29 -8.036 -1.754 1.655
204 HD11 ILE 29 3HD1 ILE 29 -3.141 -3.106 1.021
205 HD12 ILE 29 1HD1 ILE 29 -3.846 -1.628 1.699
206 HD13 ILE 29 2HD1 ILE 29 -4.523 -3.225 2.110
207 H LYS 30 H LYS 30 -7.893 0.894 -0.529
208 HA LYS 30 HA LYS 30 -10.567 0.281 0.382
209 HB2 LYS 30 1HB LYS 30 -9.173 2.855 -0.441
210 HB3 LYS 30 2HB LYS 30 -10.859 2.820 0.091
211 HG2 LYS 30 1HG LYS 30 -10.256 1.868 2.245
212 HG3 LYS 30 2HG LYS 30 -8.557 1.733 1.772
213 HD2 LYS 30 1HD LYS 30 -8.420 4.202 1.535
214 HD3 LYS 30 2HD LYS 30 -10.130 4.339 2.007
215 HE2 LYS 30 1HE LYS 30 -9.591 3.233 4.184
216 HE3 LYS 30 2HE LYS 30 -7.889 3.161 3.716
217 HZ1 LYS 30 3HZ LYS 30 -8.344 5.099 5.109
218 HZ2 LYS 30 1HZ LYS 30 -9.461 5.662 4.065
219 HZ3 LYS 30 2HZ LYS 30 -7.887 5.606 3.626
220 H THR 31 H THR 31 -9.370 1.043 -2.877
221 HA THR 31 HA THR 31 -12.096 1.326 -3.934
222 HB THR 31 HB THR 31 -10.829 1.607 -6.085
223 HG1 THR 31 1HG THR 31 -8.563 1.990 -4.502
224 HG21 THR 31 3HG2 THR 31 -11.564 3.567 -4.824
225 HG22 THR 31 1HG2 THR 31 -9.970 3.859 -5.543
226 HG23 THR 31 2HG2 THR 31 -10.112 3.496 -3.807
227 H ASN 32 H ASN 32 -9.560 -1.157 -3.947
228 HA ASN 32 HA ASN 32 -11.192 -2.816 -5.836
229 HB2 ASN 32 1HB ASN 32 -8.215 -2.768 -5.197
230 HB3 ASN 32 2HB ASN 32 -8.993 -3.995 -6.178
231 HD21 ASN 32 1HD2 ASN 32 -8.531 -0.393 -6.072
232 HD22 ASN 32 2HD2 ASN 32 -8.569 -0.265 -7.818
233 H HIS 33 H HIS 33 -9.899 -2.892 -2.542
234 HA HIS 33 HA HIS 33 -10.821 -5.711 -2.243
235 HB2 HIS 33 1HB HIS 33 -8.226 -4.588 -1.151
236 HB3 HIS 33 2HB HIS 33 -8.748 -6.262 -1.131
237 HD1 HIS 33 1HD HIS 33 -9.358 -6.853 -4.133
238 HD2 HIS 33 2HD HIS 33 -6.232 -4.427 -2.732
239 HE1 HIS 33 1HE HIS 33 -7.617 -6.846 -5.980
240 HA PRO 34 HA PRO 34 -11.468 -2.747 1.525
241 HB2 PRO 34 1HB PRO 34 -14.079 -1.929 1.420
242 HB3 PRO 34 2HB PRO 34 -12.743 -1.089 0.574
243 HG2 PRO 34 1HG PRO 34 -14.664 -3.152 -0.567
244 HG3 PRO 34 2HG PRO 34 -14.248 -1.540 -1.240
245 HD2 PRO 34 1HD PRO 34 -12.999 -3.774 -2.119
246 HD3 PRO 34 2HD PRO 34 -12.091 -2.253 -1.866
247 H GLU 35 H GLU 35 -13.624 -5.255 0.274
248 HA GLU 35 HA GLU 35 -14.472 -6.076 2.994
249 HB2 GLU 35 1HB GLU 35 -16.007 -7.557 1.881
250 HB3 GLU 35 2HB GLU 35 -16.150 -5.930 1.224
251 HG2 GLU 35 1HG GLU 35 -14.778 -6.607 -0.751
252 HG3 GLU 35 2HG GLU 35 -14.646 -8.239 -0.093
253 H VAL 36 H VAL 36 -11.712 -6.544 1.353
254 HA VAL 36 HA VAL 36 -11.465 -9.476 1.873
255 HB VAL 36 HB VAL 36 -9.717 -7.877 0.006
256 HG11 VAL 36 1HG1 VAL 36 -9.425 -10.063 -1.102
257 HG12 VAL 36 2HG1 VAL 36 -8.947 -10.139 0.595
258 HG13 VAL 36 3HG1 VAL 36 -10.511 -10.816 0.087
259 HG21 VAL 36 3HG2 VAL 36 -11.140 -8.615 -1.892
260 HG22 VAL 36 1HG2 VAL 36 -12.357 -9.197 -0.734
261 HG23 VAL 36 2HG2 VAL 36 -11.974 -7.464 -0.851
262 H SER 37 H SER 37 -9.811 -6.389 2.266
263 HA SER 37 HA SER 37 -7.522 -7.591 3.724
264 HB2 SER 37 1HB SER 37 -8.119 -4.730 2.910
265 HB3 SER 37 2HB SER 37 -6.660 -5.265 3.772
266 HG SER 37 HG SER 37 -7.546 -6.329 1.273
Start of MODEL 15
1 H1 GLY 1 1H GLY 1 17.129 -10.205 0.973
2 H2 GLY 1 2H GLY 1 18.707 -9.771 1.038
3 H3 GLY 1 3H GLY 1 18.186 -10.789 -0.133
4 HA2 GLY 1 1HA GLY 1 16.835 -9.069 -1.129
5 HA3 GLY 1 2HA GLY 1 17.375 -7.966 0.151
6 H SER 2 H SER 2 17.696 -7.784 -2.805
7 HA SER 2 HA SER 2 20.491 -8.308 -3.435
8 HB2 SER 2 1HB SER 2 19.909 -7.324 -5.598
9 HB3 SER 2 2HB SER 2 18.693 -8.512 -5.096
10 HG SER 2 HG SER 2 17.690 -6.613 -5.854
11 H SER 3 H SER 3 18.841 -5.602 -2.038
12 HA SER 3 HA SER 3 19.278 -3.418 -1.699
13 HB2 SER 3 1HB SER 3 22.211 -4.181 -1.807
14 HB3 SER 3 2HB SER 3 21.529 -2.692 -1.134
15 HG SER 3 HG SER 3 21.037 -5.354 -0.231
16 H GLY 4 H GLY 4 18.970 -4.346 -4.493
17 HA2 GLY 4 1HA GLY 4 20.655 -2.785 -6.227
18 HA3 GLY 4 2HA GLY 4 19.166 -3.624 -6.659
19 H SER 5 H SER 5 18.067 -1.695 -4.287
20 HA SER 5 HA SER 5 17.871 0.849 -5.783
21 HB2 SER 5 1HB SER 5 15.415 0.868 -5.604
22 HB3 SER 5 2HB SER 5 16.001 -0.435 -6.643
23 HG SER 5 HG SER 5 14.369 -1.156 -5.201
24 H SER 6 H SER 6 16.976 2.601 -4.564
25 HA SER 6 HA SER 6 17.546 2.457 -1.656
26 HB2 SER 6 1HB SER 6 17.675 4.913 -1.815
27 HB3 SER 6 2HB SER 6 18.810 4.094 -2.898
28 HG SER 6 HG SER 6 17.700 5.816 -3.945
29 H GLY 7 H GLY 7 16.202 3.842 -0.217
30 HA2 GLY 7 1HA GLY 7 14.187 4.515 0.713
31 HA3 GLY 7 2HA GLY 7 13.483 4.530 -0.901
32 H ARG 8 H ARG 8 11.561 3.581 -0.351
33 HA ARG 8 HA ARG 8 11.546 0.669 0.206
34 HB2 ARG 8 1HB ARG 8 9.811 0.870 1.911
35 HB3 ARG 8 2HB ARG 8 11.293 1.675 2.417
36 HG2 ARG 8 1HG ARG 8 10.331 3.883 1.947
37 HG3 ARG 8 2HG ARG 8 8.905 3.145 1.205
38 HD2 ARG 8 1HD ARG 8 8.301 3.883 3.388
39 HD3 ARG 8 2HD ARG 8 8.298 2.109 3.363
40 HE ARG 8 HE ARG 8 10.841 3.086 4.291
41 HH11 ARG 8 2HH1 ARG 8 7.536 2.767 5.409
42 HH12 ARG 8 1HH1 ARG 8 8.009 2.726 7.088
43 HH21 ARG 8 2HH2 ARG 8 11.380 3.015 6.455
44 HH22 ARG 8 1HH2 ARG 8 10.135 2.862 7.657
45 H SER 9 H SER 9 9.536 -0.374 -0.231
46 HA SER 9 HA SER 9 7.481 1.066 -1.776
47 HB2 SER 9 1HB SER 9 7.465 -0.599 -3.576
48 HB3 SER 9 2HB SER 9 8.997 0.283 -3.518
49 HG SER 9 HG SER 9 9.325 -1.974 -3.771
50 H TYR 10 H TYR 10 5.579 -0.306 -2.183
51 HA TYR 10 HA TYR 10 5.058 -2.365 -0.076
52 HB2 TYR 10 1HB TYR 10 3.153 -0.174 -0.984
53 HB3 TYR 10 2HB TYR 10 2.871 -1.371 0.269
54 HD1 TYR 10 1HD TYR 10 3.928 -1.159 2.498
55 HD2 TYR 10 2HD TYR 10 4.569 1.792 -0.583
56 HE1 TYR 10 1HE TYR 10 4.829 0.429 4.199
57 HE2 TYR 10 2HE TYR 10 5.501 3.360 1.113
58 HH TYR 10 HH TYR 10 5.899 3.736 3.336
59 H SER 11 H SER 11 3.446 -3.976 -0.687
60 HA SER 11 HA SER 11 2.489 -3.875 -3.479
61 HB2 SER 11 1HB SER 11 3.064 -6.222 -3.887
62 HB3 SER 11 2HB SER 11 4.483 -5.183 -3.677
63 HG SER 11 HG SER 11 4.685 -7.147 -2.508
64 H CYS 12 H CYS 12 0.585 -4.798 -3.936
65 HA CYS 12 HA CYS 12 -1.369 -4.727 -1.997
66 HB2 CYS 12 1HB CYS 12 -1.776 -4.345 -4.326
67 HB3 CYS 12 2HB CYS 12 -1.348 -6.016 -4.728
68 HA PRO 13 HA PRO 13 -1.127 -8.824 -0.120
69 HB2 PRO 13 1HB PRO 13 -3.335 -8.742 1.492
70 HB3 PRO 13 2HB PRO 13 -1.859 -7.784 1.810
71 HG2 PRO 13 1HG PRO 13 -4.398 -6.870 0.419
72 HG3 PRO 13 2HG PRO 13 -3.519 -6.063 1.755
73 HD2 PRO 13 1HD PRO 13 -3.158 -5.357 -0.849
74 HD3 PRO 13 2HD PRO 13 -1.797 -5.350 0.310
75 H VAL 14 H VAL 14 -3.552 -7.833 -2.358
76 HA VAL 14 HA VAL 14 -4.767 -10.586 -2.441
77 HB VAL 14 HB VAL 14 -5.992 -7.950 -3.286
78 HG11 VAL 14 1HG1 VAL 14 -8.098 -9.279 -3.482
79 HG12 VAL 14 2HG1 VAL 14 -6.890 -9.765 -4.669
80 HG13 VAL 14 3HG1 VAL 14 -7.162 -10.766 -3.222
81 HG21 VAL 14 3HG2 VAL 14 -6.571 -9.763 -0.904
82 HG22 VAL 14 1HG2 VAL 14 -5.914 -8.112 -0.845
83 HG23 VAL 14 2HG2 VAL 14 -7.565 -8.376 -1.401
84 H CYS 15 H CYS 15 -3.452 -7.980 -4.522
85 HA CYS 15 HA CYS 15 -3.335 -9.949 -6.750
86 HB2 CYS 15 1HB CYS 15 -4.144 -8.449 -8.301
87 HB3 CYS 15 2HB CYS 15 -5.324 -8.560 -7.000
88 H GLU 16 H GLU 16 -1.407 -8.481 -4.860
89 HA GLU 16 HA GLU 16 0.795 -8.040 -4.764
90 HB2 GLU 16 1HB GLU 16 0.904 -9.785 -7.236
91 HB3 GLU 16 2HB GLU 16 2.250 -9.423 -6.151
92 HG2 GLU 16 1HG GLU 16 0.999 -10.458 -4.259
93 HG3 GLU 16 2HG GLU 16 -0.285 -10.923 -5.378
94 H LYS 17 H LYS 17 -0.778 -6.202 -6.813
95 HA LYS 17 HA LYS 17 1.246 -5.020 -8.472
96 HB2 LYS 17 1HB LYS 17 -1.330 -3.909 -7.297
97 HB3 LYS 17 2HB LYS 17 -0.314 -2.999 -8.426
98 HG2 LYS 17 1HG LYS 17 -0.600 -4.623 -10.180
99 HG3 LYS 17 2HG LYS 17 -1.330 -5.776 -9.064
100 HD2 LYS 17 1HD LYS 17 -3.228 -4.076 -8.720
101 HD3 LYS 17 2HD LYS 17 -2.520 -3.147 -10.042
102 HE2 LYS 17 1HE LYS 17 -4.342 -4.517 -10.881
103 HE3 LYS 17 2HE LYS 17 -2.819 -5.083 -11.572
104 HZ1 LYS 17 3HZ LYS 17 -4.306 -6.890 -10.718
105 HZ2 LYS 17 1HZ LYS 17 -4.088 -6.330 -9.183
106 HZ3 LYS 17 2HZ LYS 17 -2.825 -6.914 -10.020
107 H SER 18 H SER 18 2.541 -3.290 -8.239
108 HA SER 18 HA SER 18 3.496 -2.828 -5.475
109 HB2 SER 18 1HB SER 18 4.844 -2.253 -8.125
110 HB3 SER 18 2HB SER 18 5.569 -2.058 -6.518
111 HG SER 18 HG SER 18 6.093 -4.087 -7.496
112 H PHE 19 H PHE 19 3.858 -0.904 -4.517
113 HA PHE 19 HA PHE 19 3.043 1.642 -5.839
114 HB2 PHE 19 1HB PHE 19 2.111 0.659 -3.115
115 HB3 PHE 19 2HB PHE 19 1.757 2.231 -3.817
116 HD1 PHE 19 2HD PHE 19 0.279 2.408 -5.854
117 HD2 PHE 19 1HD PHE 19 0.852 -1.319 -3.758
118 HE1 PHE 19 2HE PHE 19 -1.680 1.439 -7.034
119 HE2 PHE 19 1HE PHE 19 -1.100 -2.282 -4.945
120 HZ PHE 19 HZ PHE 19 -2.350 -0.917 -6.607
121 H SER 20 H SER 20 4.111 3.470 -5.127
122 HA SER 20 HA SER 20 6.630 3.028 -3.703
123 HB2 SER 20 1HB SER 20 5.487 5.559 -4.929
124 HB3 SER 20 2HB SER 20 7.163 5.296 -4.406
125 HG SER 20 HG SER 20 6.899 4.967 -6.669
126 H GLU 21 H GLU 21 3.523 4.078 -2.666
127 HA GLU 21 HA GLU 21 4.626 5.278 -0.173
128 HB2 GLU 21 1HB GLU 21 2.532 6.572 -1.954
129 HB3 GLU 21 2HB GLU 21 2.964 7.105 -0.331
130 HG2 GLU 21 1HG GLU 21 5.265 7.600 -1.077
131 HG3 GLU 21 2HG GLU 21 4.869 7.046 -2.711
132 H ASP 22 H ASP 22 3.326 5.148 1.627
133 HA ASP 22 HA ASP 22 1.663 2.891 1.936
134 HB2 ASP 22 1HB ASP 22 2.969 3.940 3.714
135 HB3 ASP 22 2HB ASP 22 2.013 5.417 3.598
136 H ARG 23 H ARG 23 0.754 6.304 1.413
137 HA ARG 23 HA ARG 23 -2.097 5.907 1.653
138 HB2 ARG 23 1HB ARG 23 -2.302 8.130 0.648
139 HB3 ARG 23 2HB ARG 23 -1.132 8.098 1.965
140 HG2 ARG 23 1HG ARG 23 0.735 8.081 0.349
141 HG3 ARG 23 2HG ARG 23 -0.411 8.050 -1.006
142 HD2 ARG 23 1HD ARG 23 -1.284 10.229 -0.393
143 HD3 ARG 23 2HD ARG 23 -0.288 10.264 1.078
144 HE ARG 23 HE ARG 23 1.653 9.952 -0.764
145 HH11 ARG 23 2HH1 ARG 23 -0.957 12.315 -0.839
146 HH12 ARG 23 1HH1 ARG 23 0.000 13.408 -1.805
147 HH21 ARG 23 1HH2 ARG 23 2.716 11.254 -1.905
148 HH22 ARG 23 2HH2 ARG 23 2.094 12.827 -2.417
149 H LEU 24 H LEU 24 0.069 5.302 -1.038
150 HA LEU 24 HA LEU 24 -2.084 5.313 -3.041
151 HB2 LEU 24 1HB LEU 24 0.809 4.383 -3.171
152 HB3 LEU 24 2HB LEU 24 -0.304 4.377 -4.533
153 HG LEU 24 HG LEU 24 0.559 6.882 -3.026
154 HD11 LEU 24 1HD1 LEU 24 2.403 5.820 -4.305
155 HD12 LEU 24 2HD1 LEU 24 1.901 7.357 -5.024
156 HD13 LEU 24 3HD1 LEU 24 1.386 5.824 -5.763
157 HD21 LEU 24 3HD2 LEU 24 -0.408 8.078 -4.978
158 HD22 LEU 24 1HD2 LEU 24 -1.637 7.217 -4.052
159 HD23 LEU 24 2HD2 LEU 24 -1.052 6.539 -5.590
160 H ILE 25 H ILE 25 -0.203 2.757 -1.316
161 HA ILE 25 HA ILE 25 -1.790 0.644 -2.491
162 HB ILE 25 HB ILE 25 0.406 0.177 -1.580
163 HG12 ILE 25 1HG1 ILE 25 -1.792 -1.360 -0.133
164 HG13 ILE 25 2HG1 ILE 25 -1.386 -1.556 -1.841
165 HG21 ILE 25 1HG2 ILE 25 0.855 0.025 0.816
166 HG22 ILE 25 2HG2 ILE 25 0.365 1.659 0.410
167 HG23 ILE 25 3HG2 ILE 25 -0.793 0.553 1.198
168 HD11 ILE 25 3HD1 ILE 25 0.891 -2.294 -1.212
169 HD12 ILE 25 1HD1 ILE 25 0.449 -2.167 0.511
170 HD13 ILE 25 2HD1 ILE 25 -0.391 -3.318 -0.526
171 H LYS 26 H LYS 26 -2.205 2.537 0.564
172 HA LYS 26 HA LYS 26 -4.572 1.125 1.395
173 HB2 LYS 26 1HB LYS 26 -3.523 3.921 1.947
174 HB3 LYS 26 2HB LYS 26 -5.061 3.347 2.610
175 HG2 LYS 26 1HG LYS 26 -4.003 1.493 3.745
176 HG3 LYS 26 2HG LYS 26 -2.439 1.841 2.992
177 HD2 LYS 26 1HD LYS 26 -2.311 3.995 4.153
178 HD3 LYS 26 2HD LYS 26 -3.903 3.726 4.895
179 HE2 LYS 26 1HE LYS 26 -3.092 1.794 6.121
180 HE3 LYS 26 2HE LYS 26 -1.564 1.805 5.226
181 HZ1 LYS 26 3HZ LYS 26 -0.998 3.894 6.220
182 HZ2 LYS 26 1HZ LYS 26 -1.307 2.818 7.413
183 HZ3 LYS 26 2HZ LYS 26 -2.414 3.977 7.060
184 H SER 27 H SER 27 -4.254 3.954 -0.794
185 HA SER 27 HA SER 27 -7.056 4.241 -1.314
186 HB2 SER 27 1HB SER 27 -4.695 4.792 -3.159
187 HB3 SER 27 2HB SER 27 -6.368 5.309 -3.432
188 HG SER 27 HG SER 27 -4.601 6.083 -1.348
189 H HIS 28 H HIS 28 -4.608 2.131 -2.931
190 HA HIS 28 HA HIS 28 -6.424 0.979 -4.810
191 HB2 HIS 28 1HB HIS 28 -4.030 0.794 -5.088
192 HB3 HIS 28 2HB HIS 28 -3.851 -0.064 -3.565
193 HD1 HIS 28 1HD HIS 28 -5.624 -0.696 -6.968
194 HD2 HIS 28 2HD HIS 28 -3.864 -2.653 -3.689
195 HE1 HIS 28 1HE HIS 28 -5.649 -3.162 -7.549
196 H ILE 29 H ILE 29 -5.463 -0.210 -1.550
197 HA ILE 29 HA ILE 29 -7.144 -2.513 -1.560
198 HB ILE 29 HB ILE 29 -6.070 -0.819 0.723
199 HG12 ILE 29 1HG1 ILE 29 -5.243 -3.570 -0.343
200 HG13 ILE 29 2HG1 ILE 29 -4.419 -2.071 -0.743
201 HG21 ILE 29 1HG2 ILE 29 -8.087 -1.982 1.542
202 HG22 ILE 29 2HG2 ILE 29 -7.503 -3.507 0.845
203 HG23 ILE 29 3HG2 ILE 29 -6.664 -2.745 2.214
204 HD11 ILE 29 3HD1 ILE 29 -3.895 -1.726 1.682
205 HD12 ILE 29 1HD1 ILE 29 -4.540 -3.358 2.002
206 HD13 ILE 29 2HD1 ILE 29 -3.142 -3.152 0.944
207 H LYS 30 H LYS 30 -7.894 0.849 -0.529
208 HA LYS 30 HA LYS 30 -10.566 0.240 0.373
209 HB2 LYS 30 1HB LYS 30 -9.164 2.817 -0.428
210 HB3 LYS 30 2HB LYS 30 -10.847 2.784 0.113
211 HG2 LYS 30 1HG LYS 30 -10.243 1.814 2.253
212 HG3 LYS 30 2HG LYS 30 -8.548 1.660 1.771
213 HD2 LYS 30 1HD LYS 30 -8.377 4.130 1.559
214 HD3 LYS 30 2HD LYS 30 -10.083 4.283 2.043
215 HE2 LYS 30 1HE LYS 30 -9.542 3.139 4.201
216 HE3 LYS 30 2HE LYS 30 -7.844 3.055 3.720
217 HZ1 LYS 30 3HZ LYS 30 -8.269 4.980 5.144
218 HZ2 LYS 30 1HZ LYS 30 -9.387 5.569 4.116
219 HZ3 LYS 30 2HZ LYS 30 -7.818 5.503 3.664
220 H THR 31 H THR 31 -9.382 1.087 -2.877
221 HA THR 31 HA THR 31 -12.110 1.373 -3.919
222 HB THR 31 HB THR 31 -10.863 1.728 -6.063
223 HG1 THR 31 1HG THR 31 -8.574 2.035 -4.493
224 HG21 THR 31 3HG2 THR 31 -10.104 3.541 -3.734
225 HG22 THR 31 1HG2 THR 31 -11.568 3.650 -4.731
226 HG23 THR 31 2HG2 THR 31 -9.983 3.956 -5.460
227 H ASN 32 H ASN 32 -9.539 -1.075 -4.045
228 HA ASN 32 HA ASN 32 -11.139 -2.672 -6.004
229 HB2 ASN 32 1HB ASN 32 -8.181 -2.668 -5.281
230 HB3 ASN 32 2HB ASN 32 -8.939 -3.875 -6.298
231 HD21 ASN 32 1HD2 ASN 32 -8.538 -0.259 -6.129
232 HD22 ASN 32 2HD2 ASN 32 -8.501 -0.116 -7.875
233 H HIS 33 H HIS 33 -9.959 -2.870 -2.665
234 HA HIS 33 HA HIS 33 -11.055 -5.641 -2.466
235 HB2 HIS 33 1HB HIS 33 -8.424 -4.781 -1.232
236 HB3 HIS 33 2HB HIS 33 -9.103 -6.403 -1.340
237 HD1 HIS 33 1HD HIS 33 -9.488 -6.946 -4.314
238 HD2 HIS 33 2HD HIS 33 -6.450 -4.479 -2.797
239 HE1 HIS 33 1HE HIS 33 -7.703 -6.868 -6.117
240 HA PRO 34 HA PRO 34 -12.425 -2.443 0.738
241 HB2 PRO 34 1HB PRO 34 -15.036 -3.877 0.277
242 HB3 PRO 34 2HB PRO 34 -14.756 -2.135 0.611
243 HG2 PRO 34 1HG PRO 34 -15.236 -2.929 -1.918
244 HG3 PRO 34 2HG PRO 34 -13.865 -1.805 -1.614
245 HD2 PRO 34 1HD PRO 34 -13.785 -4.822 -1.951
246 HD3 PRO 34 2HD PRO 34 -12.789 -3.569 -2.732
247 H GLU 35 H GLU 35 -13.153 -5.926 0.690
248 HA GLU 35 HA GLU 35 -13.945 -6.161 3.445
249 HB2 GLU 35 1HB GLU 35 -13.816 -8.547 3.074
250 HB3 GLU 35 2HB GLU 35 -14.593 -7.755 1.706
251 HG2 GLU 35 1HG GLU 35 -12.448 -7.898 0.420
252 HG3 GLU 35 2HG GLU 35 -11.695 -8.716 1.790
253 H VAL 36 H VAL 36 -10.890 -5.540 2.190
254 HA VAL 36 HA VAL 36 -9.330 -7.016 4.216
255 HB VAL 36 HB VAL 36 -8.410 -5.194 1.973
256 HG11 VAL 36 1HG1 VAL 36 -6.308 -6.510 2.097
257 HG12 VAL 36 2HG1 VAL 36 -6.616 -5.612 3.578
258 HG13 VAL 36 3HG1 VAL 36 -6.940 -7.362 3.526
259 HG21 VAL 36 3HG2 VAL 36 -8.836 -8.212 1.952
260 HG22 VAL 36 1HG2 VAL 36 -9.720 -7.015 0.978
261 HG23 VAL 36 2HG2 VAL 36 -8.004 -7.282 0.685
262 H SER 37 H SER 37 -10.575 -3.805 3.718
263 HA SER 37 HA SER 37 -8.747 -2.204 5.186
264 HB2 SER 37 1HB SER 37 -11.737 -1.870 4.753
265 HB3 SER 37 2HB SER 37 -10.631 -0.611 5.340
266 HG SER 37 HG SER 37 -10.982 -0.536 3.032
Start of MODEL 16
1 H1 GLY 1 1H GLY 1 10.139 -7.190 -17.647
2 H2 GLY 1 2H GLY 1 8.853 -6.476 -18.365
3 H3 GLY 1 3H GLY 1 8.757 -8.040 -17.882
4 HA2 GLY 1 1HA GLY 1 7.546 -6.649 -16.346
5 HA3 GLY 1 2HA GLY 1 8.947 -7.410 -15.569
6 H SER 2 H SER 2 8.546 -5.577 -14.039
7 HA SER 2 HA SER 2 10.368 -3.341 -14.633
8 HB2 SER 2 1HB SER 2 8.063 -2.590 -15.345
9 HB3 SER 2 2HB SER 2 7.535 -2.796 -13.664
10 HG SER 2 HG SER 2 8.210 -0.634 -14.169
11 H SER 3 H SER 3 10.970 -2.150 -12.720
12 HA SER 3 HA SER 3 10.513 -3.467 -10.085
13 HB2 SER 3 1HB SER 3 13.254 -2.865 -11.267
14 HB3 SER 3 2HB SER 3 12.936 -3.387 -9.603
15 HG SER 3 HG SER 3 13.528 -5.135 -10.985
16 H GLY 4 H GLY 4 10.691 -2.109 -8.313
17 HA2 GLY 4 1HA GLY 4 10.338 0.731 -8.732
18 HA3 GLY 4 2HA GLY 4 10.463 -0.096 -7.181
19 H SER 5 H SER 5 11.731 2.417 -8.492
20 HA SER 5 HA SER 5 14.620 1.890 -8.228
21 HB2 SER 5 1HB SER 5 14.813 4.255 -8.954
22 HB3 SER 5 2HB SER 5 13.896 3.236 -10.078
23 HG SER 5 HG SER 5 12.859 5.257 -9.680
24 H SER 6 H SER 6 12.071 3.195 -6.233
25 HA SER 6 HA SER 6 13.715 4.759 -4.452
26 HB2 SER 6 1HB SER 6 10.942 3.575 -4.052
27 HB3 SER 6 2HB SER 6 11.707 4.798 -3.019
28 HG SER 6 HG SER 6 10.339 5.760 -4.579
29 H GLY 7 H GLY 7 14.222 4.362 -2.245
30 HA2 GLY 7 1HA GLY 7 15.284 1.764 -1.627
31 HA3 GLY 7 2HA GLY 7 15.196 3.157 -0.548
32 H ARG 8 H ARG 8 12.094 2.885 -1.282
33 HA ARG 8 HA ARG 8 11.340 0.548 0.369
34 HB2 ARG 8 1HB ARG 8 9.729 1.841 1.679
35 HB3 ARG 8 2HB ARG 8 11.382 2.387 1.955
36 HG2 ARG 8 1HG ARG 8 10.965 4.299 0.353
37 HG3 ARG 8 2HG ARG 8 9.272 3.783 0.247
38 HD2 ARG 8 1HD ARG 8 9.007 4.149 2.683
39 HD3 ARG 8 2HD ARG 8 10.716 4.570 2.814
40 HE ARG 8 HE ARG 8 10.335 6.651 1.832
41 HH11 ARG 8 2HH1 ARG 8 7.237 4.910 1.814
42 HH12 ARG 8 1HH1 ARG 8 6.472 6.314 1.042
43 HH21 ARG 8 2HH2 ARG 8 9.088 8.350 0.980
44 HH22 ARG 8 1HH2 ARG 8 7.373 8.037 0.697
45 H SER 9 H SER 9 9.396 -0.365 -0.122
46 HA SER 9 HA SER 9 7.655 0.718 -2.237
47 HB2 SER 9 1HB SER 9 9.522 -0.473 -3.424
48 HB3 SER 9 2HB SER 9 9.068 -1.959 -2.571
49 HG SER 9 HG SER 9 8.114 -1.788 -4.666
50 H TYR 10 H TYR 10 5.659 -0.435 -2.408
51 HA TYR 10 HA TYR 10 4.972 -2.260 -0.133
52 HB2 TYR 10 1HB TYR 10 3.192 -0.015 -1.129
53 HB3 TYR 10 2HB TYR 10 2.969 -1.035 0.284
54 HD1 TYR 10 1HD TYR 10 4.229 -0.586 2.377
55 HD2 TYR 10 2HD TYR 10 4.770 1.856 -1.135
56 HE1 TYR 10 1HE TYR 10 5.445 1.107 3.739
57 HE2 TYR 10 2HE TYR 10 6.032 3.521 0.217
58 HH TYR 10 HH TYR 10 6.565 3.105 3.731
59 H SER 11 H SER 11 3.611 -3.966 -0.683
60 HA SER 11 HA SER 11 2.584 -4.064 -3.497
61 HB2 SER 11 1HB SER 11 3.914 -6.310 -1.960
62 HB3 SER 11 2HB SER 11 3.137 -6.451 -3.550
63 HG SER 11 HG SER 11 5.424 -6.134 -3.689
64 H CYS 12 H CYS 12 0.594 -4.735 -3.829
65 HA CYS 12 HA CYS 12 -1.341 -4.604 -1.896
66 HB2 CYS 12 1HB CYS 12 -1.717 -4.244 -4.230
67 HB3 CYS 12 2HB CYS 12 -1.347 -5.932 -4.609
68 HA PRO 13 HA PRO 13 -1.251 -8.666 0.057
69 HB2 PRO 13 1HB PRO 13 -3.504 -8.503 1.612
70 HB3 PRO 13 2HB PRO 13 -2.002 -7.595 1.956
71 HG2 PRO 13 1HG PRO 13 -4.480 -6.603 0.509
72 HG3 PRO 13 2HG PRO 13 -3.588 -5.814 1.847
73 HD2 PRO 13 1HD PRO 13 -3.166 -5.156 -0.762
74 HD3 PRO 13 2HD PRO 13 -1.823 -5.181 0.420
75 H VAL 14 H VAL 14 -3.605 -7.667 -2.255
76 HA VAL 14 HA VAL 14 -4.871 -10.397 -2.301
77 HB VAL 14 HB VAL 14 -6.078 -7.731 -3.072
78 HG11 VAL 14 1HG1 VAL 14 -7.296 -10.528 -3.059
79 HG12 VAL 14 2HG1 VAL 14 -8.213 -9.018 -3.243
80 HG13 VAL 14 3HG1 VAL 14 -7.049 -9.486 -4.480
81 HG21 VAL 14 3HG2 VAL 14 -6.614 -9.612 -0.728
82 HG22 VAL 14 1HG2 VAL 14 -5.936 -7.973 -0.637
83 HG23 VAL 14 2HG2 VAL 14 -7.607 -8.201 -1.142
84 H CYS 15 H CYS 15 -3.421 -7.897 -4.404
85 HA CYS 15 HA CYS 15 -3.357 -9.943 -6.571
86 HB2 CYS 15 1HB CYS 15 -3.886 -8.375 -8.235
87 HB3 CYS 15 2HB CYS 15 -5.187 -8.421 -7.047
88 H GLU 16 H GLU 16 -1.421 -8.331 -4.618
89 HA GLU 16 HA GLU 16 0.777 -7.896 -4.478
90 HB2 GLU 16 1HB GLU 16 1.037 -9.878 -6.749
91 HB3 GLU 16 2HB GLU 16 2.320 -9.365 -5.654
92 HG2 GLU 16 1HG GLU 16 1.023 -10.242 -3.717
93 HG3 GLU 16 2HG GLU 16 -0.207 -10.852 -4.830
94 H LYS 17 H LYS 17 -0.775 -6.332 -6.777
95 HA LYS 17 HA LYS 17 1.318 -5.168 -8.371
96 HB2 LYS 17 1HB LYS 17 -1.402 -4.146 -7.477
97 HB3 LYS 17 2HB LYS 17 -0.322 -3.194 -8.506
98 HG2 LYS 17 1HG LYS 17 -0.284 -4.916 -10.217
99 HG3 LYS 17 2HG LYS 17 -1.199 -6.019 -9.187
100 HD2 LYS 17 1HD LYS 17 -3.131 -4.418 -9.237
101 HD3 LYS 17 2HD LYS 17 -2.206 -3.380 -10.346
102 HE2 LYS 17 1HE LYS 17 -2.058 -5.256 -11.969
103 HE3 LYS 17 2HE LYS 17 -2.951 -6.298 -10.853
104 HZ1 LYS 17 3HZ LYS 17 -4.412 -5.346 -12.542
105 HZ2 LYS 17 1HZ LYS 17 -4.034 -3.824 -12.095
106 HZ3 LYS 17 2HZ LYS 17 -4.854 -4.803 -11.070
107 H SER 18 H SER 18 2.519 -3.369 -8.157
108 HA SER 18 HA SER 18 3.257 -2.771 -5.357
109 HB2 SER 18 1HB SER 18 5.464 -2.175 -6.269
110 HB3 SER 18 2HB SER 18 4.967 -3.844 -6.588
111 HG SER 18 HG SER 18 5.862 -2.842 -8.453
112 H PHE 19 H PHE 19 3.817 -0.822 -4.567
113 HA PHE 19 HA PHE 19 3.072 1.677 -6.008
114 HB2 PHE 19 1HB PHE 19 2.136 0.838 -3.232
115 HB3 PHE 19 2HB PHE 19 1.821 2.388 -3.997
116 HD1 PHE 19 2HD PHE 19 0.262 2.567 -5.936
117 HD2 PHE 19 1HD PHE 19 0.873 -1.167 -3.863
118 HE1 PHE 19 2HE PHE 19 -1.739 1.614 -7.057
119 HE2 PHE 19 1HE PHE 19 -1.118 -2.119 -4.996
120 HZ PHE 19 HZ PHE 19 -2.408 -0.739 -6.617
121 H SER 20 H SER 20 4.100 3.554 -5.254
122 HA SER 20 HA SER 20 6.662 3.128 -3.886
123 HB2 SER 20 1HB SER 20 7.083 5.464 -4.634
124 HB3 SER 20 2HB SER 20 6.660 4.354 -5.948
125 HG SER 20 HG SER 20 5.513 6.346 -6.090
126 H GLU 21 H GLU 21 3.555 4.205 -2.881
127 HA GLU 21 HA GLU 21 4.655 5.420 -0.391
128 HB2 GLU 21 1HB GLU 21 2.611 6.611 -2.284
129 HB3 GLU 21 2HB GLU 21 2.775 7.149 -0.624
130 HG2 GLU 21 1HG GLU 21 5.142 7.233 -2.537
131 HG3 GLU 21 2HG GLU 21 3.922 8.489 -2.498
132 H ASP 22 H ASP 22 3.454 5.207 1.427
133 HA ASP 22 HA ASP 22 1.824 2.943 1.775
134 HB2 ASP 22 1HB ASP 22 3.200 3.973 3.503
135 HB3 ASP 22 2HB ASP 22 2.233 5.446 3.454
136 H ARG 23 H ARG 23 0.834 6.345 1.305
137 HA ARG 23 HA ARG 23 -1.992 5.870 1.718
138 HB2 ARG 23 1HB ARG 23 -2.335 8.108 0.871
139 HB3 ARG 23 2HB ARG 23 -0.987 8.075 2.006
140 HG2 ARG 23 1HG ARG 23 0.595 8.034 0.038
141 HG3 ARG 23 2HG ARG 23 -0.794 8.226 -1.041
142 HD2 ARG 23 1HD ARG 23 -1.345 10.378 -0.052
143 HD3 ARG 23 2HD ARG 23 -0.112 10.189 1.196
144 HE ARG 23 HE ARG 23 0.291 11.004 -1.586
145 HH11 ARG 23 2HH1 ARG 23 1.998 9.770 1.255
146 HH12 ARG 23 1HH1 ARG 23 3.553 10.000 0.452
147 HH21 ARG 23 2HH2 ARG 23 2.394 11.339 -2.393
148 HH22 ARG 23 1HH2 ARG 23 3.745 10.790 -1.405
149 H LEU 24 H LEU 24 0.036 5.393 -1.098
150 HA LEU 24 HA LEU 24 -2.210 5.368 -2.988
151 HB2 LEU 24 1HB LEU 24 0.685 4.487 -3.295
152 HB3 LEU 24 2HB LEU 24 -0.503 4.531 -4.592
153 HG LEU 24 HG LEU 24 0.483 6.962 -3.040
154 HD11 LEU 24 1HD1 LEU 24 1.626 7.541 -5.131
155 HD12 LEU 24 2HD1 LEU 24 1.013 6.062 -5.906
156 HD13 LEU 24 3HD1 LEU 24 2.173 5.956 -4.565
157 HD21 LEU 24 3HD2 LEU 24 -1.796 7.374 -3.814
158 HD22 LEU 24 1HD2 LEU 24 -1.388 6.764 -5.436
159 HD23 LEU 24 2HD2 LEU 24 -0.660 8.266 -4.825
160 H ILE 25 H ILE 25 -0.202 2.840 -1.376
161 HA ILE 25 HA ILE 25 -1.778 0.697 -2.503
162 HB ILE 25 HB ILE 25 0.453 0.272 -1.670
163 HG12 ILE 25 1HG1 ILE 25 -1.651 -1.298 -0.122
164 HG13 ILE 25 2HG1 ILE 25 -1.319 -1.500 -1.846
165 HG21 ILE 25 1HG2 ILE 25 0.980 0.140 0.719
166 HG22 ILE 25 2HG2 ILE 25 0.468 1.762 0.303
167 HG23 ILE 25 3HG2 ILE 25 -0.656 0.659 1.144
168 HD11 ILE 25 3HD1 ILE 25 0.645 -2.045 0.420
169 HD12 ILE 25 1HD1 ILE 25 -0.234 -3.229 -0.543
170 HD13 ILE 25 2HD1 ILE 25 0.987 -2.198 -1.325
171 H LYS 26 H LYS 26 -2.134 2.557 0.581
172 HA LYS 26 HA LYS 26 -4.425 1.071 1.491
173 HB2 LYS 26 1HB LYS 26 -3.428 3.887 2.028
174 HB3 LYS 26 2HB LYS 26 -4.917 3.265 2.755
175 HG2 LYS 26 1HG LYS 26 -3.761 1.435 3.826
176 HG3 LYS 26 2HG LYS 26 -2.245 1.820 2.998
177 HD2 LYS 26 1HD LYS 26 -2.103 3.970 4.166
178 HD3 LYS 26 2HD LYS 26 -3.652 3.662 4.985
179 HE2 LYS 26 1HE LYS 26 -2.739 1.742 6.157
180 HE3 LYS 26 2HE LYS 26 -1.259 1.790 5.185
181 HZ1 LYS 26 3HZ LYS 26 -0.918 2.795 7.366
182 HZ2 LYS 26 1HZ LYS 26 -2.057 3.937 7.068
183 HZ3 LYS 26 2HZ LYS 26 -0.680 3.879 6.164
184 H SER 27 H SER 27 -4.282 3.968 -0.620
185 HA SER 27 HA SER 27 -7.080 4.202 -1.075
186 HB2 SER 27 1HB SER 27 -5.388 5.868 -1.767
187 HB3 SER 27 2HB SER 27 -4.804 4.754 -3.019
188 HG SER 27 HG SER 27 -6.348 6.300 -3.800
189 H HIS 28 H HIS 28 -4.648 2.211 -2.876
190 HA HIS 28 HA HIS 28 -6.482 1.005 -4.672
191 HB2 HIS 28 1HB HIS 28 -4.095 0.915 -5.020
192 HB3 HIS 28 2HB HIS 28 -3.843 0.032 -3.521
193 HD1 HIS 28 1HD HIS 28 -5.668 -0.591 -6.897
194 HD2 HIS 28 2HD HIS 28 -3.745 -2.547 -3.708
195 HE1 HIS 28 1HE HIS 28 -5.575 -3.039 -7.549
196 H ILE 29 H ILE 29 -5.389 -0.218 -1.469
197 HA ILE 29 HA ILE 29 -6.936 -2.598 -1.431
198 HB ILE 29 HB ILE 29 -5.925 -0.786 0.789
199 HG12 ILE 29 1HG1 ILE 29 -5.036 -3.569 -0.125
200 HG13 ILE 29 2HG1 ILE 29 -4.276 -2.075 -0.661
201 HG21 ILE 29 1HG2 ILE 29 -6.431 -2.644 2.384
202 HG22 ILE 29 2HG2 ILE 29 -7.889 -1.954 1.709
203 HG23 ILE 29 3HG2 ILE 29 -7.279 -3.500 1.079
204 HD11 ILE 29 3HD1 ILE 29 -4.285 -3.144 2.182
205 HD12 ILE 29 1HD1 ILE 29 -2.921 -2.988 1.074
206 HD13 ILE 29 2HD1 ILE 29 -3.697 -1.528 1.713
207 H LYS 30 H LYS 30 -7.885 0.708 -0.390
208 HA LYS 30 HA LYS 30 -10.519 -0.191 0.487
209 HB2 LYS 30 1HB LYS 30 -9.331 2.579 0.077
210 HB3 LYS 30 2HB LYS 30 -10.920 2.289 0.782
211 HG2 LYS 30 1HG LYS 30 -8.332 1.175 1.958
212 HG3 LYS 30 2HG LYS 30 -9.069 2.701 2.440
213 HD2 LYS 30 1HD LYS 30 -11.080 1.537 3.225
214 HD3 LYS 30 2HD LYS 30 -10.428 -0.023 2.679
215 HE2 LYS 30 1HE LYS 30 -8.523 0.180 4.197
216 HE3 LYS 30 2HE LYS 30 -9.060 1.783 4.717
217 HZ1 LYS 30 3HZ LYS 30 -11.007 0.775 5.709
218 HZ2 LYS 30 1HZ LYS 30 -9.694 -0.058 6.237
219 HZ3 LYS 30 2HZ LYS 30 -10.650 -0.705 5.097
220 H THR 31 H THR 31 -9.378 1.038 -2.626
221 HA THR 31 HA THR 31 -12.116 1.415 -3.616
222 HB THR 31 HB THR 31 -10.903 1.901 -5.744
223 HG1 THR 31 1HG THR 31 -8.585 2.049 -4.197
224 HG21 THR 31 3HG2 THR 31 -11.552 3.745 -4.294
225 HG22 THR 31 1HG2 THR 31 -9.967 4.071 -5.019
226 HG23 THR 31 2HG2 THR 31 -10.080 3.549 -3.322
227 H ASN 32 H ASN 32 -9.504 -0.968 -4.032
228 HA ASN 32 HA ASN 32 -11.148 -2.444 -6.041
229 HB2 ASN 32 1HB ASN 32 -8.183 -2.491 -5.346
230 HB3 ASN 32 2HB ASN 32 -8.949 -3.644 -6.419
231 HD21 ASN 32 1HD2 ASN 32 -8.605 -0.026 -6.067
232 HD22 ASN 32 2HD2 ASN 32 -8.548 0.196 -7.805
233 H HIS 33 H HIS 33 -9.914 -2.854 -2.749
234 HA HIS 33 HA HIS 33 -11.024 -5.622 -2.693
235 HB2 HIS 33 1HB HIS 33 -8.398 -4.829 -1.413
236 HB3 HIS 33 2HB HIS 33 -9.064 -6.445 -1.620
237 HD1 HIS 33 1HD HIS 33 -9.422 -6.829 -4.622
238 HD2 HIS 33 2HD HIS 33 -6.407 -4.454 -2.920
239 HE1 HIS 33 1HE HIS 33 -7.579 -6.705 -6.367
240 HA PRO 34 HA PRO 34 -11.796 -2.746 1.114
241 HB2 PRO 34 1HB PRO 34 -14.542 -2.433 1.038
242 HB3 PRO 34 2HB PRO 34 -13.365 -1.334 0.261
243 HG2 PRO 34 1HG PRO 34 -14.884 -3.645 -0.998
244 HG3 PRO 34 2HG PRO 34 -14.709 -1.968 -1.617
245 HD2 PRO 34 1HD PRO 34 -13.121 -3.939 -2.542
246 HD3 PRO 34 2HD PRO 34 -12.433 -2.322 -2.186
247 H GLU 35 H GLU 35 -13.311 -5.714 0.030
248 HA GLU 35 HA GLU 35 -14.406 -6.614 2.518
249 HB2 GLU 35 1HB GLU 35 -14.372 -8.818 1.512
250 HB3 GLU 35 2HB GLU 35 -14.956 -7.617 0.363
251 HG2 GLU 35 1HG GLU 35 -12.712 -7.587 -0.737
252 HG3 GLU 35 2HG GLU 35 -12.141 -8.802 0.407
253 H VAL 36 H VAL 36 -11.060 -6.247 1.618
254 HA VAL 36 HA VAL 36 -10.120 -8.212 3.611
255 HB VAL 36 HB VAL 36 -9.155 -7.729 1.225
256 HG11 VAL 36 1HG1 VAL 36 -7.317 -6.229 1.076
257 HG12 VAL 36 2HG1 VAL 36 -8.657 -5.280 1.742
258 HG13 VAL 36 3HG1 VAL 36 -7.364 -5.849 2.808
259 HG21 VAL 36 3HG2 VAL 36 -8.299 -9.426 2.761
260 HG22 VAL 36 1HG2 VAL 36 -6.985 -8.597 1.911
261 HG23 VAL 36 2HG2 VAL 36 -7.329 -8.198 3.605
262 H SER 37 H SER 37 -10.893 -4.883 3.634
263 HA SER 37 HA SER 37 -9.656 -4.473 6.288
264 HB2 SER 37 1HB SER 37 -7.938 -3.769 4.611
265 HB3 SER 37 2HB SER 37 -9.093 -2.595 3.962
266 HG SER 37 HG SER 37 -7.947 -2.703 6.587
Start of MODEL 17
1 H1 GLY 1 1H GLY 1 21.228 -10.124 -1.714
2 H2 GLY 1 2H GLY 1 22.836 -10.051 -2.018
3 H3 GLY 1 3H GLY 1 21.788 -10.421 -3.221
4 HA2 GLY 1 1HA GLY 1 21.941 -7.829 -1.826
5 HA3 GLY 1 2HA GLY 1 22.557 -8.150 -3.457
6 H SER 2 H SER 2 20.825 -6.110 -3.181
7 HA SER 2 HA SER 2 18.477 -6.980 -4.743
8 HB2 SER 2 1HB SER 2 17.685 -7.094 -2.410
9 HB3 SER 2 2HB SER 2 18.199 -5.416 -2.144
10 HG SER 2 HG SER 2 15.919 -5.751 -2.694
11 H SER 3 H SER 3 17.537 -5.332 -5.969
12 HA SER 3 HA SER 3 19.100 -2.869 -6.435
13 HB2 SER 3 1HB SER 3 17.504 -2.550 -8.302
14 HB3 SER 3 2HB SER 3 18.357 -4.100 -8.371
15 HG SER 3 HG SER 3 16.099 -4.331 -8.765
16 H GLY 4 H GLY 4 16.572 -3.783 -4.360
17 HA2 GLY 4 1HA GLY 4 14.861 -1.487 -4.464
18 HA3 GLY 4 2HA GLY 4 14.954 -2.685 -3.174
19 H SER 5 H SER 5 18.046 -1.528 -3.288
20 HA SER 5 HA SER 5 17.880 -0.120 -0.850
21 HB2 SER 5 1HB SER 5 20.098 -0.036 -2.930
22 HB3 SER 5 2HB SER 5 20.248 0.395 -1.215
23 HG SER 5 HG SER 5 20.933 -1.767 -1.652
24 H SER 6 H SER 6 17.358 1.171 -4.043
25 HA SER 6 HA SER 6 18.165 3.882 -3.547
26 HB2 SER 6 1HB SER 6 16.231 2.778 -5.615
27 HB3 SER 6 2HB SER 6 17.007 4.374 -5.647
28 HG SER 6 HG SER 6 18.129 2.832 -6.936
29 H GLY 7 H GLY 7 15.226 2.221 -2.629
30 HA2 GLY 7 1HA GLY 7 14.219 4.206 -0.976
31 HA3 GLY 7 2HA GLY 7 13.467 4.535 -2.538
32 H ARG 8 H ARG 8 11.967 3.897 -0.278
33 HA ARG 8 HA ARG 8 11.349 1.088 -0.041
34 HB2 ARG 8 1HB ARG 8 9.602 3.452 0.751
35 HB3 ARG 8 2HB ARG 8 9.424 1.779 1.281
36 HG2 ARG 8 1HG ARG 8 11.805 1.998 2.268
37 HG3 ARG 8 2HG ARG 8 11.621 3.739 2.018
38 HD2 ARG 8 1HD ARG 8 9.945 1.897 3.761
39 HD3 ARG 8 2HD ARG 8 10.988 3.201 4.307
40 HE ARG 8 HE ARG 8 8.237 3.382 3.323
41 HH11 ARG 8 2HH1 ARG 8 11.099 5.357 3.816
42 HH12 ARG 8 1HH1 ARG 8 10.169 6.832 3.805
43 HH21 ARG 8 2HH2 ARG 8 7.151 5.224 3.335
44 HH22 ARG 8 1HH2 ARG 8 7.963 6.761 3.539
45 H SER 9 H SER 9 9.570 -0.080 -0.627
46 HA SER 9 HA SER 9 7.591 1.045 -2.512
47 HB2 SER 9 1HB SER 9 7.643 -0.950 -3.923
48 HB3 SER 9 2HB SER 9 9.185 -0.082 -3.964
49 HG SER 9 HG SER 9 9.489 -2.343 -3.737
50 H TYR 10 H TYR 10 5.618 -0.106 -2.584
51 HA TYR 10 HA TYR 10 4.982 -1.799 -0.197
52 HB2 TYR 10 1HB TYR 10 3.370 0.497 -1.388
53 HB3 TYR 10 2HB TYR 10 2.846 -0.563 -0.090
54 HD1 TYR 10 2HD TYR 10 5.355 2.058 -1.004
55 HD2 TYR 10 1HD TYR 10 3.482 -0.150 2.193
56 HE1 TYR 10 2HE TYR 10 6.445 3.554 0.668
57 HE2 TYR 10 1HE TYR 10 4.531 1.371 3.856
58 HH TYR 10 HH TYR 10 5.863 3.182 4.188
59 H SER 11 H SER 11 3.429 -3.454 -0.576
60 HA SER 11 HA SER 11 2.502 -3.802 -3.377
61 HB2 SER 11 1HB SER 11 3.205 -6.151 -3.358
62 HB3 SER 11 2HB SER 11 4.565 -5.022 -3.260
63 HG SER 11 HG SER 11 4.779 -6.754 -1.767
64 H CYS 12 H CYS 12 0.707 -4.962 -3.758
65 HA CYS 12 HA CYS 12 -1.281 -4.782 -1.760
66 HB2 CYS 12 1HB CYS 12 -1.661 -4.337 -4.095
67 HB3 CYS 12 2HB CYS 12 -1.271 -6.012 -4.523
68 HA PRO 13 HA PRO 13 -0.878 -8.986 -0.112
69 HB2 PRO 13 1HB PRO 13 -2.847 -8.943 1.767
70 HB3 PRO 13 2HB PRO 13 -1.329 -8.014 1.941
71 HG2 PRO 13 1HG PRO 13 -4.017 -7.015 0.961
72 HG3 PRO 13 2HG PRO 13 -2.936 -6.269 2.177
73 HD2 PRO 13 1HD PRO 13 -2.971 -5.506 -0.464
74 HD3 PRO 13 2HD PRO 13 -1.483 -5.454 0.529
75 H VAL 14 H VAL 14 -3.411 -7.775 -2.055
76 HA VAL 14 HA VAL 14 -4.906 -10.373 -2.052
77 HB VAL 14 HB VAL 14 -5.914 -7.719 -3.080
78 HG11 VAL 14 1HG1 VAL 14 -8.132 -8.772 -2.769
79 HG12 VAL 14 2HG1 VAL 14 -7.144 -9.686 -3.907
80 HG13 VAL 14 3HG1 VAL 14 -7.345 -10.276 -2.241
81 HG21 VAL 14 3HG2 VAL 14 -5.525 -7.322 -0.740
82 HG22 VAL 14 1HG2 VAL 14 -7.245 -7.617 -0.937
83 HG23 VAL 14 2HG2 VAL 14 -6.204 -8.907 -0.293
84 H CYS 15 H CYS 15 -3.394 -7.978 -4.238
85 HA CYS 15 HA CYS 15 -3.492 -10.002 -6.412
86 HB2 CYS 15 1HB CYS 15 -4.288 -8.518 -7.982
87 HB3 CYS 15 2HB CYS 15 -5.415 -8.482 -6.631
88 H GLU 16 H GLU 16 -1.427 -8.546 -4.638
89 HA GLU 16 HA GLU 16 0.798 -8.212 -4.638
90 HB2 GLU 16 1HB GLU 16 0.743 -9.966 -7.104
91 HB3 GLU 16 2HB GLU 16 2.145 -9.640 -6.081
92 HG2 GLU 16 1HG GLU 16 0.945 -10.630 -4.129
93 HG3 GLU 16 2HG GLU 16 -0.400 -11.058 -5.190
94 H LYS 17 H LYS 17 -0.807 -6.371 -6.703
95 HA LYS 17 HA LYS 17 1.257 -5.247 -8.374
96 HB2 LYS 17 1HB LYS 17 -1.350 -4.104 -7.306
97 HB3 LYS 17 2HB LYS 17 -0.311 -3.240 -8.454
98 HG2 LYS 17 1HG LYS 17 -0.560 -4.944 -10.139
99 HG3 LYS 17 2HG LYS 17 -1.312 -6.045 -8.988
100 HD2 LYS 17 1HD LYS 17 -3.196 -4.275 -8.754
101 HD3 LYS 17 2HD LYS 17 -2.478 -3.491 -10.162
102 HE2 LYS 17 1HE LYS 17 -4.317 -4.914 -10.862
103 HE3 LYS 17 2HE LYS 17 -2.803 -5.583 -11.482
104 HZ1 LYS 17 3HZ LYS 17 -4.330 -7.253 -10.433
105 HZ2 LYS 17 1HZ LYS 17 -4.092 -6.531 -8.968
106 HZ3 LYS 17 2HZ LYS 17 -2.847 -7.231 -9.736
107 H SER 18 H SER 18 2.469 -3.422 -8.189
108 HA SER 18 HA SER 18 3.258 -2.741 -5.408
109 HB2 SER 18 1HB SER 18 5.476 -2.230 -6.344
110 HB3 SER 18 2HB SER 18 4.970 -3.913 -6.556
111 HG SER 18 HG SER 18 5.888 -3.040 -8.475
112 H PHE 19 H PHE 19 3.713 -0.748 -4.712
113 HA PHE 19 HA PHE 19 3.091 1.648 -6.361
114 HB2 PHE 19 1HB PHE 19 1.780 0.878 -3.719
115 HB3 PHE 19 2HB PHE 19 1.685 2.471 -4.448
116 HD1 PHE 19 1HD PHE 19 0.615 -1.063 -4.805
117 HD2 PHE 19 2HD PHE 19 0.270 2.932 -6.378
118 HE1 PHE 19 1HE PHE 19 -1.351 -1.768 -6.147
119 HE2 PHE 19 2HE PHE 19 -1.687 2.226 -7.733
120 HZ PHE 19 HZ PHE 19 -2.488 -0.127 -7.635
121 H SER 20 H SER 20 3.871 3.627 -5.469
122 HA SER 20 HA SER 20 6.477 3.285 -4.267
123 HB2 SER 20 1HB SER 20 5.040 5.832 -5.080
124 HB3 SER 20 2HB SER 20 6.777 5.641 -4.784
125 HG SER 20 HG SER 20 6.269 5.525 -7.022
126 H GLU 21 H GLU 21 3.420 4.111 -2.815
127 HA GLU 21 HA GLU 21 4.762 5.012 -0.317
128 HB2 GLU 21 1HB GLU 21 2.518 6.587 -1.616
129 HB3 GLU 21 2HB GLU 21 3.349 6.947 -0.104
130 HG2 GLU 21 1HG GLU 21 5.459 7.336 -1.381
131 HG3 GLU 21 2HG GLU 21 4.558 7.112 -2.889
132 H ASP 22 H ASP 22 3.477 4.894 1.580
133 HA ASP 22 HA ASP 22 1.494 2.872 1.730
134 HB2 ASP 22 1HB ASP 22 2.900 3.593 3.615
135 HB3 ASP 22 2HB ASP 22 2.118 5.173 3.620
136 H ARG 23 H ARG 23 1.195 6.403 1.381
137 HA ARG 23 HA ARG 23 -1.683 6.543 1.519
138 HB2 ARG 23 1HB ARG 23 -1.454 8.779 0.589
139 HB3 ARG 23 2HB ARG 23 -0.314 8.515 1.904
140 HG2 ARG 23 1HG ARG 23 1.537 8.266 0.367
141 HG3 ARG 23 2HG ARG 23 0.469 8.274 -1.041
142 HD2 ARG 23 1HD ARG 23 0.733 10.607 0.901
143 HD3 ARG 23 2HD ARG 23 1.719 10.448 -0.543
144 HE ARG 23 HE ARG 23 -1.101 11.204 -0.407
145 HH11 ARG 23 2HH1 ARG 23 1.409 10.044 -2.629
146 HH12 ARG 23 1HH1 ARG 23 0.517 10.628 -4.011
147 HH21 ARG 23 2HH2 ARG 23 -2.140 11.875 -2.237
148 HH22 ARG 23 1HH2 ARG 23 -1.422 11.613 -3.798
149 H LEU 24 H LEU 24 0.187 5.099 -0.866
150 HA LEU 24 HA LEU 24 -1.992 5.345 -2.905
151 HB2 LEU 24 1HB LEU 24 0.833 4.268 -3.174
152 HB3 LEU 24 2HB LEU 24 -0.376 4.318 -4.452
153 HG LEU 24 HG LEU 24 0.798 6.773 -3.071
154 HD11 LEU 24 1HD1 LEU 24 1.330 5.600 -5.830
155 HD12 LEU 24 2HD1 LEU 24 2.450 5.573 -4.447
156 HD13 LEU 24 3HD1 LEU 24 1.999 7.116 -5.183
157 HD21 LEU 24 3HD2 LEU 24 -1.439 7.267 -3.912
158 HD22 LEU 24 1HD2 LEU 24 -1.040 6.530 -5.485
159 HD23 LEU 24 2HD2 LEU 24 -0.229 8.020 -4.952
160 H ILE 25 H ILE 25 -0.042 2.855 -1.101
161 HA ILE 25 HA ILE 25 -1.552 0.730 -2.198
162 HB ILE 25 HB ILE 25 0.752 0.658 -1.101
163 HG12 ILE 25 1HG1 ILE 25 0.458 -1.662 -0.209
164 HG13 ILE 25 2HG1 ILE 25 -1.290 -1.502 -0.430
165 HG21 ILE 25 1HG2 ILE 25 -0.057 1.653 1.116
166 HG22 ILE 25 2HG2 ILE 25 -0.792 0.087 1.471
167 HG23 ILE 25 3HG2 ILE 25 0.962 0.218 1.247
168 HD11 ILE 25 3HD1 ILE 25 -0.892 -1.123 -2.879
169 HD12 ILE 25 1HD1 ILE 25 0.861 -1.304 -2.574
170 HD13 ILE 25 2HD1 ILE 25 -0.258 -2.659 -2.320
171 H LYS 26 H LYS 26 -2.119 2.554 0.827
172 HA LYS 26 HA LYS 26 -4.314 0.891 1.724
173 HB2 LYS 26 1HB LYS 26 -3.636 3.816 2.271
174 HB3 LYS 26 2HB LYS 26 -4.913 2.927 3.097
175 HG2 LYS 26 1HG LYS 26 -1.948 2.210 3.183
176 HG3 LYS 26 2HG LYS 26 -2.844 3.083 4.429
177 HD2 LYS 26 1HD LYS 26 -4.368 1.069 4.639
178 HD3 LYS 26 2HD LYS 26 -3.267 0.181 3.576
179 HE2 LYS 26 1HE LYS 26 -2.491 1.487 6.225
180 HE3 LYS 26 2HE LYS 26 -2.914 -0.215 6.028
181 HZ1 LYS 26 3HZ LYS 26 -0.532 0.049 5.977
182 HZ2 LYS 26 1HZ LYS 26 -0.574 1.143 4.778
183 HZ3 LYS 26 2HZ LYS 26 -1.005 -0.418 4.487
184 H SER 27 H SER 27 -4.242 3.778 -0.365
185 HA SER 27 HA SER 27 -7.066 3.918 -0.822
186 HB2 SER 27 1HB SER 27 -4.741 4.802 -2.573
187 HB3 SER 27 2HB SER 27 -6.442 5.263 -2.804
188 HG SER 27 HG SER 27 -5.008 6.730 -1.512
189 H HIS 28 H HIS 28 -4.475 2.142 -2.607
190 HA HIS 28 HA HIS 28 -6.153 1.030 -4.607
191 HB2 HIS 28 1HB HIS 28 -3.747 0.905 -4.818
192 HB3 HIS 28 2HB HIS 28 -3.590 0.017 -3.308
193 HD1 HIS 28 1HD HIS 28 -4.879 -0.576 -6.901
194 HD2 HIS 28 2HD HIS 28 -3.857 -2.609 -3.370
195 HE1 HIS 28 1HE HIS 28 -4.997 -3.041 -7.472
196 H ILE 29 H ILE 29 -5.279 -0.339 -1.408
197 HA ILE 29 HA ILE 29 -6.910 -2.682 -1.645
198 HB ILE 29 HB ILE 29 -5.860 -1.180 0.778
199 HG12 ILE 29 1HG1 ILE 29 -4.911 -3.827 -0.428
200 HG13 ILE 29 2HG1 ILE 29 -4.223 -2.282 -0.898
201 HG21 ILE 29 1HG2 ILE 29 -6.330 -3.250 2.088
202 HG22 ILE 29 2HG2 ILE 29 -7.809 -2.523 1.492
203 HG23 ILE 29 3HG2 ILE 29 -7.144 -3.955 0.677
204 HD11 ILE 29 3HD1 ILE 29 -3.587 -1.843 1.485
205 HD12 ILE 29 1HD1 ILE 29 -4.105 -3.502 1.880
206 HD13 ILE 29 2HD1 ILE 29 -2.777 -3.233 0.742
207 H LYS 30 H LYS 30 -7.715 0.602 -0.364
208 HA LYS 30 HA LYS 30 -10.279 -0.067 0.610
209 HB2 LYS 30 1HB LYS 30 -8.856 1.843 1.263
210 HB3 LYS 30 2HB LYS 30 -9.060 2.571 -0.345
211 HG2 LYS 30 1HG LYS 30 -11.459 2.710 0.019
212 HG3 LYS 30 2HG LYS 30 -11.285 1.940 1.608
213 HD2 LYS 30 1HD LYS 30 -10.094 4.636 0.794
214 HD3 LYS 30 2HD LYS 30 -11.589 4.423 1.717
215 HE2 LYS 30 1HE LYS 30 -10.305 3.243 3.506
216 HE3 LYS 30 2HE LYS 30 -8.809 3.535 2.609
217 HZ1 LYS 30 3HZ LYS 30 -10.599 5.657 3.673
218 HZ2 LYS 30 1HZ LYS 30 -9.219 5.931 2.840
219 HZ3 LYS 30 2HZ LYS 30 -9.161 5.228 4.310
220 H THR 31 H THR 31 -9.274 1.146 -2.612
221 HA THR 31 HA THR 31 -12.091 1.260 -3.446
222 HB THR 31 HB THR 31 -10.346 3.004 -3.971
223 HG1 THR 31 1HG THR 31 -12.309 3.075 -4.957
224 HG21 THR 31 3HG2 THR 31 -9.677 1.196 -6.320
225 HG22 THR 31 1HG2 THR 31 -8.605 1.426 -4.915
226 HG23 THR 31 2HG2 THR 31 -9.021 2.802 -5.949
227 H ASN 32 H ASN 32 -9.431 -1.014 -3.995
228 HA ASN 32 HA ASN 32 -11.074 -2.454 -6.034
229 HB2 ASN 32 1HB ASN 32 -8.182 -2.862 -5.184
230 HB3 ASN 32 2HB ASN 32 -9.023 -3.742 -6.451
231 HD21 ASN 32 1HD2 ASN 32 -7.455 -0.769 -5.629
232 HD22 ASN 32 2HD2 ASN 32 -7.570 -0.048 -7.244
233 H HIS 33 H HIS 33 -9.975 -2.871 -2.690
234 HA HIS 33 HA HIS 33 -11.108 -5.632 -2.663
235 HB2 HIS 33 1HB HIS 33 -8.581 -4.786 -1.233
236 HB3 HIS 33 2HB HIS 33 -9.202 -6.412 -1.477
237 HD1 HIS 33 1HD HIS 33 -9.475 -6.610 -4.575
238 HD2 HIS 33 2HD HIS 33 -6.394 -4.607 -2.544
239 HE1 HIS 33 1HE HIS 33 -7.532 -6.502 -6.204
240 HA PRO 34 HA PRO 34 -12.261 -2.728 1.012
241 HB2 PRO 34 1HB PRO 34 -14.977 -2.426 0.661
242 HB3 PRO 34 2HB PRO 34 -13.742 -1.347 -0.053
243 HG2 PRO 34 1HG PRO 34 -15.143 -3.707 -1.355
244 HG3 PRO 34 2HG PRO 34 -14.921 -2.050 -2.013
245 HD2 PRO 34 1HD PRO 34 -13.247 -4.046 -2.719
246 HD3 PRO 34 2HD PRO 34 -12.613 -2.405 -2.379
247 H GLU 35 H GLU 35 -14.001 -5.569 -0.256
248 HA GLU 35 HA GLU 35 -15.079 -6.348 2.344
249 HB2 GLU 35 1HB GLU 35 -15.944 -8.278 1.191
250 HB3 GLU 35 2HB GLU 35 -16.263 -6.820 0.258
251 HG2 GLU 35 1HG GLU 35 -14.324 -7.363 -1.232
252 HG3 GLU 35 2HG GLU 35 -14.044 -8.838 -0.306
253 H VAL 36 H VAL 36 -11.971 -6.410 1.264
254 HA VAL 36 HA VAL 36 -11.235 -9.033 2.466
255 HB VAL 36 HB VAL 36 -9.442 -7.384 0.684
256 HG11 VAL 36 1HG1 VAL 36 -8.434 -9.344 1.761
257 HG12 VAL 36 2HG1 VAL 36 -9.755 -10.378 1.170
258 HG13 VAL 36 3HG1 VAL 36 -8.610 -9.641 0.033
259 HG21 VAL 36 3HG2 VAL 36 -10.279 -8.674 -1.283
260 HG22 VAL 36 1HG2 VAL 36 -11.604 -9.306 -0.283
261 HG23 VAL 36 2HG2 VAL 36 -11.499 -7.570 -0.656
262 H SER 37 H SER 37 -10.964 -5.639 2.993
263 HA SER 37 HA SER 37 -8.577 -5.321 4.445
264 HB2 SER 37 1HB SER 37 -11.270 -3.966 4.857
265 HB3 SER 37 2HB SER 37 -9.713 -3.393 5.485
266 HG SER 37 HG SER 37 -10.261 -2.384 3.475
Start of MODEL 18
1 H1 GLY 1 1H GLY 1 24.770 -14.774 1.922
2 H2 GLY 1 2H GLY 1 23.154 -14.824 1.657
3 H3 GLY 1 3H GLY 1 23.743 -14.032 2.961
4 HA2 GLY 1 1HA GLY 1 24.831 -12.399 1.564
5 HA3 GLY 1 2HA GLY 1 24.190 -13.258 0.151
6 H SER 2 H SER 2 23.513 -10.806 0.011
7 HA SER 2 HA SER 2 20.624 -10.689 0.610
8 HB2 SER 2 1HB SER 2 21.647 -9.606 2.568
9 HB3 SER 2 2HB SER 2 22.558 -8.514 1.506
10 HG SER 2 HG SER 2 20.544 -7.658 2.385
11 H SER 3 H SER 3 19.470 -9.310 -0.743
12 HA SER 3 HA SER 3 20.737 -8.454 -3.267
13 HB2 SER 3 1HB SER 3 18.414 -7.980 -3.947
14 HB3 SER 3 2HB SER 3 18.618 -9.640 -3.365
15 HG SER 3 HG SER 3 16.753 -8.658 -2.465
16 H GLY 4 H GLY 4 20.194 -7.027 -0.219
17 HA2 GLY 4 1HA GLY 4 20.584 -4.876 0.513
18 HA3 GLY 4 2HA GLY 4 20.956 -4.379 -1.138
19 H SER 5 H SER 5 17.831 -5.866 -0.629
20 HA SER 5 HA SER 5 16.379 -3.490 -1.402
21 HB2 SER 5 1HB SER 5 14.396 -4.894 -1.141
22 HB3 SER 5 2HB SER 5 15.662 -5.727 -2.057
23 HG SER 5 HG SER 5 14.737 -7.099 -0.480
24 H SER 6 H SER 6 14.471 -2.665 -0.189
25 HA SER 6 HA SER 6 14.821 -2.544 2.764
26 HB2 SER 6 1HB SER 6 14.673 -0.135 2.758
27 HB3 SER 6 2HB SER 6 16.025 -0.638 1.731
28 HG SER 6 HG SER 6 14.888 0.888 0.593
29 H GLY 7 H GLY 7 13.005 -1.623 3.913
30 HA2 GLY 7 1HA GLY 7 10.481 -2.727 3.022
31 HA3 GLY 7 2HA GLY 7 10.810 -1.901 4.544
32 H ARG 8 H ARG 8 11.711 0.109 1.941
33 HA ARG 8 HA ARG 8 9.477 1.933 2.506
34 HB2 ARG 8 1HB ARG 8 11.925 2.232 0.722
35 HB3 ARG 8 2HB ARG 8 10.742 3.506 1.063
36 HG2 ARG 8 1HG ARG 8 11.240 3.279 3.512
37 HG3 ARG 8 2HG ARG 8 12.539 2.142 3.123
38 HD2 ARG 8 1HD ARG 8 12.352 5.019 2.125
39 HD3 ARG 8 2HD ARG 8 13.307 4.507 3.506
40 HE ARG 8 HE ARG 8 13.899 4.071 0.650
41 HH11 ARG 8 2HH1 ARG 8 14.859 3.185 3.906
42 HH12 ARG 8 1HH1 ARG 8 16.436 2.655 3.389
43 HH21 ARG 8 2HH2 ARG 8 15.924 3.395 0.071
44 HH22 ARG 8 1HH2 ARG 8 17.014 2.770 1.272
45 H SER 9 H SER 9 9.891 -0.478 0.168
46 HA SER 9 HA SER 9 7.907 0.739 -1.702
47 HB2 SER 9 1HB SER 9 9.484 -1.846 -1.912
48 HB3 SER 9 2HB SER 9 8.339 -1.224 -3.116
49 HG SER 9 HG SER 9 10.527 -0.671 -3.603
50 H TYR 10 H TYR 10 5.913 -0.223 -2.133
51 HA TYR 10 HA TYR 10 4.888 -2.155 -0.085
52 HB2 TYR 10 1HB TYR 10 3.412 0.129 -1.436
53 HB3 TYR 10 2HB TYR 10 2.771 -0.964 -0.224
54 HD1 TYR 10 2HD TYR 10 5.124 1.851 -0.832
55 HD2 TYR 10 1HD TYR 10 3.239 -0.637 2.148
56 HE1 TYR 10 2HE TYR 10 5.983 3.351 0.953
57 HE2 TYR 10 1HE TYR 10 4.060 0.899 3.935
58 HH TYR 10 HH TYR 10 6.078 3.772 3.206
59 H SER 11 H SER 11 3.381 -3.743 -0.795
60 HA SER 11 HA SER 11 2.581 -3.773 -3.622
61 HB2 SER 11 1HB SER 11 3.232 -6.135 -3.936
62 HB3 SER 11 2HB SER 11 4.609 -5.033 -3.776
63 HG SER 11 HG SER 11 4.883 -6.942 -2.529
64 H CYS 12 H CYS 12 0.692 -4.785 -4.074
65 HA CYS 12 HA CYS 12 -1.240 -4.772 -2.095
66 HB2 CYS 12 1HB CYS 12 -1.665 -4.408 -4.445
67 HB3 CYS 12 2HB CYS 12 -1.272 -6.098 -4.811
68 HA PRO 13 HA PRO 13 -0.739 -8.915 -0.326
69 HB2 PRO 13 1HB PRO 13 -2.740 -8.868 1.528
70 HB3 PRO 13 2HB PRO 13 -1.240 -7.911 1.697
71 HG2 PRO 13 1HG PRO 13 -3.929 -6.979 0.645
72 HG3 PRO 13 2HG PRO 13 -2.887 -6.192 1.871
73 HD2 PRO 13 1HD PRO 13 -2.872 -5.462 -0.766
74 HD3 PRO 13 2HD PRO 13 -1.390 -5.414 0.237
75 H VAL 14 H VAL 14 -3.322 -7.835 -2.299
76 HA VAL 14 HA VAL 14 -4.623 -10.546 -2.333
77 HB VAL 14 HB VAL 14 -5.827 -7.878 -3.116
78 HG11 VAL 14 1HG1 VAL 14 -7.070 -10.648 -2.830
79 HG12 VAL 14 2HG1 VAL 14 -7.979 -9.144 -3.077
80 HG13 VAL 14 3HG1 VAL 14 -6.891 -9.720 -4.337
81 HG21 VAL 14 3HG2 VAL 14 -6.254 -9.569 -0.617
82 HG22 VAL 14 1HG2 VAL 14 -5.543 -7.940 -0.689
83 HG23 VAL 14 2HG2 VAL 14 -7.242 -8.166 -1.087
84 H CYS 15 H CYS 15 -3.310 -7.963 -4.439
85 HA CYS 15 HA CYS 15 -3.326 -9.884 -6.689
86 HB2 CYS 15 1HB CYS 15 -4.387 -8.496 -8.166
87 HB3 CYS 15 2HB CYS 15 -5.433 -8.652 -6.760
88 H GLU 16 H GLU 16 -1.271 -8.828 -5.068
89 HA GLU 16 HA GLU 16 0.943 -8.521 -5.120
90 HB2 GLU 16 1HB GLU 16 0.505 -10.450 -6.641
91 HB3 GLU 16 2HB GLU 16 0.727 -9.371 -8.020
92 HG2 GLU 16 1HG GLU 16 3.059 -8.979 -7.381
93 HG3 GLU 16 2HG GLU 16 2.829 -9.863 -5.867
94 H LYS 17 H LYS 17 -0.625 -6.423 -7.397
95 HA LYS 17 HA LYS 17 1.489 -5.063 -8.590
96 HB2 LYS 17 1HB LYS 17 -1.278 -4.188 -7.735
97 HB3 LYS 17 2HB LYS 17 -0.182 -3.032 -8.499
98 HG2 LYS 17 1HG LYS 17 0.032 -4.306 -10.489
99 HG3 LYS 17 2HG LYS 17 -0.739 -5.727 -9.794
100 HD2 LYS 17 1HD LYS 17 -2.162 -3.053 -10.198
101 HD3 LYS 17 2HD LYS 17 -2.177 -4.357 -11.395
102 HE2 LYS 17 1HE LYS 17 -3.244 -4.496 -8.550
103 HE3 LYS 17 2HE LYS 17 -4.221 -4.315 -10.009
104 HZ1 LYS 17 3HZ LYS 17 -4.096 -6.585 -9.123
105 HZ2 LYS 17 1HZ LYS 17 -2.520 -6.686 -9.411
106 HZ3 LYS 17 2HZ LYS 17 -3.557 -6.532 -10.691
107 H SER 18 H SER 18 2.841 -3.441 -8.223
108 HA SER 18 HA SER 18 3.471 -2.865 -5.418
109 HB2 SER 18 1HB SER 18 5.043 -2.262 -7.935
110 HB3 SER 18 2HB SER 18 5.613 -2.064 -6.265
111 HG SER 18 HG SER 18 6.270 -4.072 -7.203
112 H PHE 19 H PHE 19 3.873 -0.875 -4.523
113 HA PHE 19 HA PHE 19 3.018 1.599 -5.931
114 HB2 PHE 19 1HB PHE 19 1.978 0.678 -3.225
115 HB3 PHE 19 2HB PHE 19 1.662 2.239 -3.964
116 HD1 PHE 19 2HD PHE 19 0.343 2.357 -6.140
117 HD2 PHE 19 1HD PHE 19 0.674 -1.269 -3.825
118 HE1 PHE 19 2HE PHE 19 -1.560 1.373 -7.400
119 HE2 PHE 19 1HE PHE 19 -1.225 -2.245 -5.093
120 HZ PHE 19 HZ PHE 19 -2.323 -0.936 -6.893
121 H SER 20 H SER 20 3.937 3.487 -5.176
122 HA SER 20 HA SER 20 6.515 3.155 -3.854
123 HB2 SER 20 1HB SER 20 5.220 5.642 -5.022
124 HB3 SER 20 2HB SER 20 6.930 5.433 -4.598
125 HG SER 20 HG SER 20 6.550 5.097 -6.840
126 H GLU 21 H GLU 21 3.447 3.984 -2.616
127 HA GLU 21 HA GLU 21 4.597 5.220 -0.173
128 HB2 GLU 21 1HB GLU 21 2.292 6.455 -1.718
129 HB3 GLU 21 2HB GLU 21 2.967 7.026 -0.194
130 HG2 GLU 21 1HG GLU 21 5.118 7.534 -1.352
131 HG3 GLU 21 2HG GLU 21 4.378 7.070 -2.896
132 H ASP 22 H ASP 22 3.220 5.115 1.664
133 HA ASP 22 HA ASP 22 1.541 2.828 1.871
134 HB2 ASP 22 1HB ASP 22 1.141 3.531 4.114
135 HB3 ASP 22 2HB ASP 22 2.828 3.826 3.735
136 H ARG 23 H ARG 23 0.742 6.262 1.325
137 HA ARG 23 HA ARG 23 -2.123 5.932 1.544
138 HB2 ARG 23 1HB ARG 23 -2.287 8.141 0.525
139 HB3 ARG 23 2HB ARG 23 -1.125 8.096 1.849
140 HG2 ARG 23 1HG ARG 23 0.748 8.029 0.216
141 HG3 ARG 23 2HG ARG 23 -0.415 8.093 -1.124
142 HD2 ARG 23 1HD ARG 23 -1.192 10.289 -0.419
143 HD3 ARG 23 2HD ARG 23 -0.212 10.200 1.063
144 HE ARG 23 HE ARG 23 1.413 9.890 -1.328
145 HH11 ARG 23 2HH2 ARG 23 -0.178 12.466 0.442
146 HH12 ARG 23 1HH2 ARG 23 1.079 13.611 0.056
147 HH21 ARG 23 2HH1 ARG 23 3.054 11.275 -1.555
148 HH22 ARG 23 1HH1 ARG 23 2.852 12.965 -1.130
149 H LEU 24 H LEU 24 0.068 5.431 -1.173
150 HA LEU 24 HA LEU 24 -2.030 5.303 -3.184
151 HB2 LEU 24 1HB LEU 24 0.838 4.293 -3.137
152 HB3 LEU 24 2HB LEU 24 -0.213 4.183 -4.544
153 HG LEU 24 HG LEU 24 0.582 6.809 -3.219
154 HD11 LEU 24 1HD1 LEU 24 2.520 5.648 -4.226
155 HD12 LEU 24 2HD1 LEU 24 2.079 7.090 -5.148
156 HD13 LEU 24 3HD1 LEU 24 1.628 5.480 -5.757
157 HD21 LEU 24 3HD2 LEU 24 -1.525 7.025 -4.456
158 HD22 LEU 24 1HD2 LEU 24 -0.805 6.219 -5.869
159 HD23 LEU 24 2HD2 LEU 24 -0.219 7.813 -5.343
160 H ILE 25 H ILE 25 -0.260 2.768 -1.314
161 HA ILE 25 HA ILE 25 -1.886 0.669 -2.452
162 HB ILE 25 HB ILE 25 0.334 0.215 -1.583
163 HG12 ILE 25 1HG1 ILE 25 -1.821 -1.368 -0.126
164 HG13 ILE 25 2HG1 ILE 25 -1.462 -1.525 -1.847
165 HG21 ILE 25 1HG2 ILE 25 0.303 1.663 0.421
166 HG22 ILE 25 2HG2 ILE 25 -0.849 0.555 1.209
167 HG23 ILE 25 3HG2 ILE 25 0.796 0.028 0.815
168 HD11 ILE 25 3HD1 ILE 25 -0.407 -3.303 -0.599
169 HD12 ILE 25 1HD1 ILE 25 0.839 -2.250 -1.306
170 HD13 ILE 25 2HD1 ILE 25 0.454 -2.161 0.434
171 H LYS 26 H LYS 26 -2.281 2.620 0.566
172 HA LYS 26 HA LYS 26 -4.615 1.180 1.452
173 HB2 LYS 26 1HB LYS 26 -3.567 3.973 1.975
174 HB3 LYS 26 2HB LYS 26 -5.148 3.465 2.582
175 HG2 LYS 26 1HG LYS 26 -4.195 1.561 3.754
176 HG3 LYS 26 2HG LYS 26 -2.580 1.917 3.140
177 HD2 LYS 26 1HD LYS 26 -4.182 3.834 4.902
178 HD3 LYS 26 2HD LYS 26 -3.037 2.630 5.525
179 HE2 LYS 26 1HE LYS 26 -1.236 3.616 4.127
180 HE3 LYS 26 2HE LYS 26 -2.346 4.866 3.568
181 HZ1 LYS 26 3HZ LYS 26 -2.499 5.694 5.828
182 HZ2 LYS 26 1HZ LYS 26 -0.911 5.565 5.414
183 HZ3 LYS 26 2HZ LYS 26 -1.588 4.463 6.411
184 H SER 27 H SER 27 -4.421 4.037 -0.757
185 HA SER 27 HA SER 27 -7.227 4.144 -1.276
186 HB2 SER 27 1HB SER 27 -4.839 4.885 -3.001
187 HB3 SER 27 2HB SER 27 -6.525 5.166 -3.480
188 HG SER 27 HG SER 27 -5.577 6.985 -2.406
189 H HIS 28 H HIS 28 -4.680 2.148 -2.901
190 HA HIS 28 HA HIS 28 -6.436 0.927 -4.784
191 HB2 HIS 28 1HB HIS 28 -4.027 0.815 -5.022
192 HB3 HIS 28 2HB HIS 28 -3.856 -0.041 -3.497
193 HD1 HIS 28 1HD HIS 28 -5.193 -0.693 -7.060
194 HD2 HIS 28 2HD HIS 28 -4.075 -2.650 -3.512
195 HE1 HIS 28 1HE HIS 28 -5.120 -3.162 -7.632
196 H ILE 29 H ILE 29 -5.486 -0.230 -1.512
197 HA ILE 29 HA ILE 29 -7.125 -2.573 -1.537
198 HB ILE 29 HB ILE 29 -6.036 -0.876 0.735
199 HG12 ILE 29 1HG1 ILE 29 -5.227 -3.632 -0.332
200 HG13 ILE 29 2HG1 ILE 29 -4.415 -2.129 -0.752
201 HG21 ILE 29 1HG2 ILE 29 -8.047 -2.037 1.587
202 HG22 ILE 29 2HG2 ILE 29 -7.447 -3.581 0.944
203 HG23 ILE 29 3HG2 ILE 29 -6.603 -2.748 2.266
204 HD11 ILE 29 3HD1 ILE 29 -4.488 -3.403 2.003
205 HD12 ILE 29 1HD1 ILE 29 -3.108 -3.220 0.918
206 HD13 ILE 29 2HD1 ILE 29 -3.838 -1.779 1.658
207 H LYS 30 H LYS 30 -7.925 0.782 -0.513
208 HA LYS 30 HA LYS 30 -10.580 -0.006 0.378
209 HB2 LYS 30 1HB LYS 30 -9.275 2.694 -0.099
210 HB3 LYS 30 2HB LYS 30 -10.931 2.507 0.504
211 HG2 LYS 30 1HG LYS 30 -10.153 1.194 2.420
212 HG3 LYS 30 2HG LYS 30 -8.481 1.286 1.859
213 HD2 LYS 30 1HD LYS 30 -8.610 3.795 2.026
214 HD3 LYS 30 2HD LYS 30 -10.215 3.632 2.748
215 HE2 LYS 30 1HE LYS 30 -7.597 2.506 3.853
216 HE3 LYS 30 2HE LYS 30 -8.433 3.945 4.442
217 HZ1 LYS 30 3HZ LYS 30 -9.446 1.153 4.583
218 HZ2 LYS 30 1HZ LYS 30 -10.334 2.471 5.017
219 HZ3 LYS 30 2HZ LYS 30 -8.977 2.080 5.838
220 H THR 31 H THR 31 -9.423 0.905 -2.811
221 HA THR 31 HA THR 31 -12.166 1.246 -3.832
222 HB THR 31 HB THR 31 -10.932 1.571 -5.987
223 HG1 THR 31 1HG THR 31 -8.644 1.904 -4.419
224 HG21 THR 31 3HG2 THR 31 -10.069 3.817 -5.427
225 HG22 THR 31 1HG2 THR 31 -10.183 3.429 -3.695
226 HG23 THR 31 2HG2 THR 31 -11.650 3.511 -4.688
227 H ASN 32 H ASN 32 -9.559 -1.170 -4.010
228 HA ASN 32 HA ASN 32 -11.194 -2.813 -5.897
229 HB2 ASN 32 1HB ASN 32 -8.233 -2.838 -5.176
230 HB3 ASN 32 2HB ASN 32 -9.011 -4.029 -6.200
231 HD21 ASN 32 1HD2 ASN 32 -8.486 -0.441 -6.013
232 HD22 ASN 32 2HD2 ASN 32 -8.459 -0.279 -7.757
233 H HIS 33 H HIS 33 -9.975 -2.915 -2.591
234 HA HIS 33 HA HIS 33 -11.033 -5.679 -2.231
235 HB2 HIS 33 1HB HIS 33 -8.422 -4.693 -1.051
236 HB3 HIS 33 2HB HIS 33 -9.038 -6.340 -1.098
237 HD1 HIS 33 1HD HIS 33 -9.455 -6.890 -4.113
238 HD2 HIS 33 2HD HIS 33 -6.389 -4.483 -2.554
239 HE1 HIS 33 1HE HIS 33 -7.654 -6.827 -5.902
240 HA PRO 34 HA PRO 34 -12.071 -2.218 0.918
241 HB2 PRO 34 1HB PRO 34 -14.832 -2.310 0.857
242 HB3 PRO 34 2HB PRO 34 -13.813 -1.295 -0.213
243 HG2 PRO 34 1HG PRO 34 -15.016 -4.018 -0.805
244 HG3 PRO 34 2HG PRO 34 -15.055 -2.542 -1.828
245 HD2 PRO 34 1HD PRO 34 -13.218 -4.464 -2.275
246 HD3 PRO 34 2HD PRO 34 -12.753 -2.735 -2.352
247 H GLU 35 H GLU 35 -13.701 -5.397 0.635
248 HA GLU 35 HA GLU 35 -14.319 -5.610 3.458
249 HB2 GLU 35 1HB GLU 35 -14.992 -7.870 2.945
250 HB3 GLU 35 2HB GLU 35 -15.610 -6.757 1.729
251 HG2 GLU 35 1HG GLU 35 -13.751 -7.435 0.187
252 HG3 GLU 35 2HG GLU 35 -13.187 -8.582 1.403
253 H VAL 36 H VAL 36 -11.370 -5.612 2.010
254 HA VAL 36 HA VAL 36 -10.067 -7.495 3.913
255 HB VAL 36 HB VAL 36 -8.711 -6.480 1.423
256 HG11 VAL 36 1HG1 VAL 36 -8.679 -9.159 2.880
257 HG12 VAL 36 2HG1 VAL 36 -7.674 -8.722 1.483
258 HG13 VAL 36 3HG1 VAL 36 -7.445 -7.891 3.020
259 HG21 VAL 36 3HG2 VAL 36 -10.845 -7.252 0.480
260 HG22 VAL 36 1HG2 VAL 36 -9.577 -8.423 0.123
261 HG23 VAL 36 2HG2 VAL 36 -10.740 -8.756 1.424
262 H SER 37 H SER 37 -10.655 -4.251 3.510
263 HA SER 37 HA SER 37 -8.114 -3.052 4.224
264 HB2 SER 37 1HB SER 37 -10.057 -1.895 3.070
265 HB3 SER 37 2HB SER 37 -10.899 -1.910 4.633
266 HG SER 37 HG SER 37 -8.714 -0.972 5.378
Start of MODEL 19
1 H1 GLY 1 1H GLY 1 11.551 15.976 4.309
2 H2 GLY 1 2H GLY 1 10.189 15.070 4.348
3 H3 GLY 1 3H GLY 1 10.255 16.409 3.406
4 HA2 GLY 1 1HA GLY 1 10.455 14.454 2.032
5 HA3 GLY 1 2HA GLY 1 11.943 15.418 2.005
6 H SER 2 H SER 2 13.234 13.627 1.468
7 HA SER 2 HA SER 2 13.999 11.874 3.729
8 HB2 SER 2 1HB SER 2 13.870 9.852 2.447
9 HB3 SER 2 2HB SER 2 12.289 10.636 2.367
10 HG SER 2 HG SER 2 12.899 9.960 0.302
11 H SER 3 H SER 3 15.981 10.479 2.984
12 HA SER 3 HA SER 3 18.112 12.241 2.139
13 HB2 SER 3 1HB SER 3 19.501 10.238 2.430
14 HB3 SER 3 2HB SER 3 18.391 10.441 3.797
15 HG SER 3 HG SER 3 18.340 8.302 3.131
16 H GLY 4 H GLY 4 15.921 10.293 0.327
17 HA2 GLY 4 1HA GLY 4 15.806 9.776 -1.936
18 HA3 GLY 4 2HA GLY 4 17.385 10.525 -2.201
19 H SER 5 H SER 5 18.393 8.698 0.147
20 HA SER 5 HA SER 5 19.072 6.328 -1.479
21 HB2 SER 5 1HB SER 5 19.953 7.172 1.306
22 HB3 SER 5 2HB SER 5 20.597 5.806 0.373
23 HG SER 5 HG SER 5 21.900 7.691 0.163
24 H SER 6 H SER 6 16.960 7.143 1.206
25 HA SER 6 HA SER 6 16.425 4.370 1.973
26 HB2 SER 6 1HB SER 6 16.465 6.413 3.500
27 HB3 SER 6 2HB SER 6 14.876 6.819 2.842
28 HG SER 6 HG SER 6 14.731 5.586 4.749
29 H GLY 7 H GLY 7 16.000 4.440 -0.675
30 HA2 GLY 7 1HA GLY 7 13.261 4.996 -1.498
31 HA3 GLY 7 2HA GLY 7 14.489 4.129 -2.420
32 H ARG 8 H ARG 8 11.533 3.764 -1.146
33 HA ARG 8 HA ARG 8 11.712 0.825 -0.615
34 HB2 ARG 8 1HB ARG 8 10.403 2.921 1.178
35 HB3 ARG 8 2HB ARG 8 10.223 1.174 1.380
36 HG2 ARG 8 1HG ARG 8 12.607 0.910 1.847
37 HG3 ARG 8 2HG ARG 8 12.907 2.608 1.477
38 HD2 ARG 8 1HD ARG 8 11.303 3.202 3.363
39 HD3 ARG 8 2HD ARG 8 11.422 1.514 3.871
40 HE ARG 8 HE ARG 8 13.568 3.597 3.840
41 HH11 ARG 8 2HH1 ARG 8 12.874 0.240 4.624
42 HH12 ARG 8 1HH1 ARG 8 14.406 0.044 5.432
43 HH21 ARG 8 2HH2 ARG 8 15.423 3.286 4.816
44 HH22 ARG 8 1HH2 ARG 8 15.833 1.752 5.561
45 H SER 9 H SER 9 9.692 -0.284 -0.727
46 HA SER 9 HA SER 9 7.433 1.079 -2.081
47 HB2 SER 9 1HB SER 9 7.309 -0.670 -3.802
48 HB3 SER 9 2HB SER 9 8.812 0.258 -3.904
49 HG SER 9 HG SER 9 9.189 -1.999 -4.092
50 H TYR 10 H TYR 10 5.539 -0.292 -2.301
51 HA TYR 10 HA TYR 10 5.150 -2.309 -0.128
52 HB2 TYR 10 1HB TYR 10 3.186 -0.136 -0.953
53 HB3 TYR 10 2HB TYR 10 3.001 -1.301 0.349
54 HD1 TYR 10 2HD TYR 10 4.742 1.790 -0.744
55 HD2 TYR 10 1HD TYR 10 4.049 -0.943 2.524
56 HE1 TYR 10 2HE TYR 10 5.805 3.402 0.838
57 HE2 TYR 10 1HE TYR 10 5.062 0.692 4.105
58 HH TYR 10 HH TYR 10 6.076 2.734 4.346
59 H SER 11 H SER 11 3.586 -3.967 -0.658
60 HA SER 11 HA SER 11 2.515 -3.950 -3.446
61 HB2 SER 11 1HB SER 11 4.006 -6.246 -2.150
62 HB3 SER 11 2HB SER 11 3.065 -6.358 -3.650
63 HG SER 11 HG SER 11 5.362 -5.968 -3.940
64 H CYS 12 H CYS 12 0.548 -4.724 -3.748
65 HA CYS 12 HA CYS 12 -1.300 -4.762 -1.694
66 HB2 CYS 12 1HB CYS 12 -1.771 -4.227 -3.990
67 HB3 CYS 12 2HB CYS 12 -1.422 -5.891 -4.495
68 HA PRO 13 HA PRO 13 -0.977 -8.994 -0.144
69 HB2 PRO 13 1HB PRO 13 -3.054 -9.022 1.627
70 HB3 PRO 13 2HB PRO 13 -1.554 -8.088 1.904
71 HG2 PRO 13 1HG PRO 13 -4.189 -7.081 0.784
72 HG3 PRO 13 2HG PRO 13 -3.200 -6.365 2.096
73 HD2 PRO 13 1HD PRO 13 -3.053 -5.499 -0.493
74 HD3 PRO 13 2HD PRO 13 -1.614 -5.531 0.570
75 H VAL 14 H VAL 14 -3.563 -7.792 -2.095
76 HA VAL 14 HA VAL 14 -4.885 -10.483 -2.248
77 HB VAL 14 HB VAL 14 -5.951 -7.800 -3.150
78 HG11 VAL 14 1HG1 VAL 14 -6.994 -9.642 -4.393
79 HG12 VAL 14 2HG1 VAL 14 -7.303 -10.519 -2.876
80 HG13 VAL 14 3HG1 VAL 14 -8.138 -8.990 -3.223
81 HG21 VAL 14 3HG2 VAL 14 -7.497 -8.021 -1.204
82 HG22 VAL 14 1HG2 VAL 14 -6.555 -9.417 -0.639
83 HG23 VAL 14 2HG2 VAL 14 -5.819 -7.800 -0.717
84 H CYS 15 H CYS 15 -3.447 -7.946 -4.329
85 HA CYS 15 HA CYS 15 -3.464 -9.898 -6.585
86 HB2 CYS 15 1HB CYS 15 -4.100 -8.235 -8.116
87 HB3 CYS 15 2HB CYS 15 -5.317 -8.344 -6.847
88 H GLU 16 H GLU 16 -1.421 -8.325 -4.661
89 HA GLU 16 HA GLU 16 0.765 -7.862 -4.641
90 HB2 GLU 16 1HB GLU 16 0.546 -10.296 -5.558
91 HB3 GLU 16 2HB GLU 16 1.238 -9.618 -7.032
92 HG2 GLU 16 1HG GLU 16 3.214 -8.836 -5.692
93 HG3 GLU 16 2HG GLU 16 2.453 -9.455 -4.230
94 H LYS 17 H LYS 17 -0.929 -6.172 -6.599
95 HA LYS 17 HA LYS 17 0.970 -4.945 -8.390
96 HB2 LYS 17 1HB LYS 17 -1.509 -4.698 -8.506
97 HB3 LYS 17 2HB LYS 17 -1.476 -3.716 -7.041
98 HG2 LYS 17 1HG LYS 17 -0.147 -1.999 -8.138
99 HG3 LYS 17 2HG LYS 17 0.086 -3.007 -9.569
100 HD2 LYS 17 1HD LYS 17 -2.630 -1.985 -8.627
101 HD3 LYS 17 2HD LYS 17 -1.608 -1.170 -9.823
102 HE2 LYS 17 1HE LYS 17 -1.651 -3.250 -11.230
103 HE3 LYS 17 2HE LYS 17 -2.778 -3.979 -10.079
104 HZ1 LYS 17 3HZ LYS 17 -4.345 -2.172 -10.582
105 HZ2 LYS 17 1HZ LYS 17 -3.949 -2.969 -11.948
106 HZ3 LYS 17 2HZ LYS 17 -3.297 -1.506 -11.646
107 H SER 18 H SER 18 2.461 -3.350 -8.081
108 HA SER 18 HA SER 18 3.205 -2.787 -5.272
109 HB2 SER 18 1HB SER 18 4.872 -2.543 -7.784
110 HB3 SER 18 2HB SER 18 5.436 -2.308 -6.119
111 HG SER 18 HG SER 18 4.898 -4.487 -5.685
112 H PHE 19 H PHE 19 3.791 -0.833 -4.486
113 HA PHE 19 HA PHE 19 3.111 1.661 -5.974
114 HB2 PHE 19 1HB PHE 19 2.110 0.825 -3.222
115 HB3 PHE 19 2HB PHE 19 1.839 2.390 -3.972
116 HD1 PHE 19 2HD PHE 19 0.332 2.632 -5.935
117 HD2 PHE 19 1HD PHE 19 0.818 -1.153 -3.923
118 HE1 PHE 19 2HE PHE 19 -1.681 1.755 -7.094
119 HE2 PHE 19 1HE PHE 19 -1.181 -2.035 -5.108
120 HZ PHE 19 HZ PHE 19 -2.422 -0.581 -6.697
121 H SER 20 H SER 20 4.155 3.531 -5.246
122 HA SER 20 HA SER 20 6.714 3.064 -3.925
123 HB2 SER 20 1HB SER 20 5.545 5.622 -5.066
124 HB3 SER 20 2HB SER 20 7.242 5.326 -4.641
125 HG SER 20 HG SER 20 6.850 5.027 -6.888
126 H GLU 21 H GLU 21 3.670 4.248 -2.761
127 HA GLU 21 HA GLU 21 4.907 5.229 -0.244
128 HB2 GLU 21 1HB GLU 21 2.920 6.824 -1.899
129 HB3 GLU 21 2HB GLU 21 3.435 7.223 -0.272
130 HG2 GLU 21 1HG GLU 21 5.228 7.191 -2.729
131 HG3 GLU 21 2HG GLU 21 4.503 8.608 -1.994
132 H ASP 22 H ASP 22 3.508 5.241 1.562
133 HA ASP 22 HA ASP 22 1.883 2.963 1.689
134 HB2 ASP 22 1HB ASP 22 1.577 3.465 3.954
135 HB3 ASP 22 2HB ASP 22 3.179 4.069 3.551
136 H ARG 23 H ARG 23 0.853 6.356 1.371
137 HA ARG 23 HA ARG 23 -1.957 5.803 1.652
138 HB2 ARG 23 1HB ARG 23 -2.372 8.050 1.061
139 HB3 ARG 23 2HB ARG 23 -1.008 7.999 2.150
140 HG2 ARG 23 1HG ARG 23 -0.929 8.462 -0.867
141 HG3 ARG 23 2HG ARG 23 -0.808 9.693 0.381
142 HD2 ARG 23 1HD ARG 23 1.208 7.550 -0.304
143 HD3 ARG 23 2HD ARG 23 1.370 9.286 -0.505
144 HE ARG 23 HE ARG 23 1.812 7.741 1.969
145 HH11 ARG 23 2HH1 ARG 23 1.249 11.041 0.885
146 HH12 ARG 23 1HH1 ARG 23 1.824 11.667 2.406
147 HH21 ARG 23 2HH2 ARG 23 2.404 8.507 3.717
148 HH22 ARG 23 1HH2 ARG 23 2.503 10.243 4.024
149 H LEU 24 H LEU 24 0.130 5.386 -1.065
150 HA LEU 24 HA LEU 24 -2.018 5.449 -3.071
151 HB2 LEU 24 1HB LEU 24 0.829 4.389 -3.231
152 HB3 LEU 24 2HB LEU 24 -0.277 4.573 -4.586
153 HG LEU 24 HG LEU 24 0.801 6.867 -2.890
154 HD11 LEU 24 1HD1 LEU 24 2.537 5.782 -4.272
155 HD12 LEU 24 2HD1 LEU 24 2.150 7.402 -4.869
156 HD13 LEU 24 3HD1 LEU 24 1.512 5.972 -5.714
157 HD21 LEU 24 3HD2 LEU 24 -0.092 8.307 -4.704
158 HD22 LEU 24 1HD2 LEU 24 -1.378 7.458 -3.845
159 HD23 LEU 24 2HD2 LEU 24 -0.856 6.885 -5.449
160 H ILE 25 H ILE 25 -0.141 2.873 -1.375
161 HA ILE 25 HA ILE 25 -1.768 0.766 -2.504
162 HB ILE 25 HB ILE 25 0.455 0.277 -1.733
163 HG12 ILE 25 1HG1 ILE 25 -1.621 -1.226 -0.097
164 HG13 ILE 25 2HG1 ILE 25 -1.346 -1.460 -1.827
165 HG21 ILE 25 1HG2 ILE 25 -0.538 0.744 1.107
166 HG22 ILE 25 2HG2 ILE 25 1.057 0.140 0.644
167 HG23 ILE 25 3HG2 ILE 25 0.614 1.772 0.207
168 HD11 ILE 25 3HD1 ILE 25 0.653 -2.028 0.402
169 HD12 ILE 25 1HD1 ILE 25 -0.237 -3.197 -0.562
170 HD13 ILE 25 2HD1 ILE 25 0.986 -2.169 -1.346
171 H LYS 26 H LYS 26 -2.018 2.593 0.608
172 HA LYS 26 HA LYS 26 -4.308 1.212 1.620
173 HB2 LYS 26 1HB LYS 26 -3.375 4.090 1.901
174 HB3 LYS 26 2HB LYS 26 -4.788 3.468 2.752
175 HG2 LYS 26 1HG LYS 26 -3.515 1.881 4.000
176 HG3 LYS 26 2HG LYS 26 -2.074 2.119 3.008
177 HD2 LYS 26 1HD LYS 26 -1.904 4.471 3.809
178 HD3 LYS 26 2HD LYS 26 -3.331 4.217 4.835
179 HE2 LYS 26 1HE LYS 26 -2.154 2.461 6.087
180 HE3 LYS 26 2HE LYS 26 -0.761 2.580 5.004
181 HZ1 LYS 26 3HZ LYS 26 -1.703 4.798 6.742
182 HZ2 LYS 26 1HZ LYS 26 -0.371 4.829 5.780
183 HZ3 LYS 26 2HZ LYS 26 -0.426 3.835 7.074
184 H SER 27 H SER 27 -4.200 4.017 -0.623
185 HA SER 27 HA SER 27 -7.030 4.204 -1.012
186 HB2 SER 27 1HB SER 27 -4.778 4.911 -2.938
187 HB3 SER 27 2HB SER 27 -6.482 5.368 -3.118
188 HG SER 27 HG SER 27 -4.616 6.176 -1.146
189 H HIS 28 H HIS 28 -4.560 2.298 -2.854
190 HA HIS 28 HA HIS 28 -6.365 1.179 -4.731
191 HB2 HIS 28 1HB HIS 28 -4.013 0.970 -5.112
192 HB3 HIS 28 2HB HIS 28 -3.743 0.181 -3.564
193 HD1 HIS 28 1HD HIS 28 -5.505 -0.651 -6.918
194 HD2 HIS 28 2HD HIS 28 -3.887 -2.431 -3.473
195 HE1 HIS 28 1HE HIS 28 -5.601 -3.150 -7.325
196 H ILE 29 H ILE 29 -5.305 -0.244 -1.592
197 HA ILE 29 HA ILE 29 -6.907 -2.584 -1.848
198 HB ILE 29 HB ILE 29 -5.901 -1.197 0.665
199 HG12 ILE 29 1HG1 ILE 29 -4.762 -3.588 -0.877
200 HG13 ILE 29 2HG1 ILE 29 -4.102 -1.962 -0.949
201 HG21 ILE 29 1HG2 ILE 29 -7.792 -2.788 1.141
202 HG22 ILE 29 2HG2 ILE 29 -6.883 -4.073 0.321
203 HG23 ILE 29 3HG2 ILE 29 -6.279 -3.331 1.820
204 HD11 ILE 29 3HD1 ILE 29 -2.741 -3.218 0.544
205 HD12 ILE 29 1HD1 ILE 29 -3.654 -2.044 1.513
206 HD13 ILE 29 2HD1 ILE 29 -4.125 -3.763 1.491
207 H LYS 30 H LYS 30 -7.765 0.644 -0.450
208 HA LYS 30 HA LYS 30 -10.307 -0.211 0.523
209 HB2 LYS 30 1HB LYS 30 -8.837 1.656 1.346
210 HB3 LYS 30 2HB LYS 30 -9.238 2.581 -0.119
211 HG2 LYS 30 1HG LYS 30 -11.572 2.528 0.465
212 HG3 LYS 30 2HG LYS 30 -11.258 1.452 1.837
213 HD2 LYS 30 1HD LYS 30 -9.802 3.332 2.823
214 HD3 LYS 30 2HD LYS 30 -10.443 4.365 1.537
215 HE2 LYS 30 1HE LYS 30 -11.858 4.814 3.363
216 HE3 LYS 30 2HE LYS 30 -12.791 3.701 2.359
217 HZ1 LYS 30 3HZ LYS 30 -11.277 2.997 4.821
218 HZ2 LYS 30 1HZ LYS 30 -12.012 1.876 3.895
219 HZ3 LYS 30 2HZ LYS 30 -12.897 3.016 4.663
220 H THR 31 H THR 31 -9.307 1.129 -2.632
221 HA THR 31 HA THR 31 -12.081 1.403 -3.536
222 HB THR 31 HB THR 31 -10.956 2.046 -5.669
223 HG1 THR 31 1HG THR 31 -8.596 2.212 -4.174
224 HG21 THR 31 3HG2 THR 31 -10.113 3.607 -3.194
225 HG22 THR 31 1HG2 THR 31 -11.642 3.773 -4.079
226 HG23 THR 31 2HG2 THR 31 -10.117 4.220 -4.864
227 H ASN 32 H ASN 32 -9.514 -1.009 -3.897
228 HA ASN 32 HA ASN 32 -11.080 -2.399 -6.028
229 HB2 ASN 32 1HB ASN 32 -8.168 -2.616 -5.164
230 HB3 ASN 32 2HB ASN 32 -8.931 -3.651 -6.356
231 HD21 ASN 32 1HD2 ASN 32 -8.253 -0.172 -5.712
232 HD22 ASN 32 2HD2 ASN 32 -8.203 0.244 -7.416
233 H HIS 33 H HIS 33 -10.136 -2.882 -2.660
234 HA HIS 33 HA HIS 33 -11.218 -5.665 -2.758
235 HB2 HIS 33 1HB HIS 33 -8.769 -4.796 -1.202
236 HB3 HIS 33 2HB HIS 33 -9.400 -6.427 -1.412
237 HD1 HIS 33 1HD HIS 33 -9.597 -6.667 -4.532
238 HD2 HIS 33 2HD HIS 33 -6.538 -4.668 -2.472
239 HE1 HIS 33 1HE HIS 33 -7.640 -6.569 -6.141
240 HA PRO 34 HA PRO 34 -13.456 -2.826 0.202
241 HB2 PRO 34 1HB PRO 34 -15.572 -4.859 -0.522
242 HB3 PRO 34 2HB PRO 34 -15.775 -3.102 -0.199
243 HG2 PRO 34 1HG PRO 34 -15.697 -3.967 -2.748
244 HG3 PRO 34 2HG PRO 34 -14.696 -2.547 -2.289
245 HD2 PRO 34 1HD PRO 34 -13.834 -5.436 -2.594
246 HD3 PRO 34 2HD PRO 34 -13.059 -3.944 -3.182
247 H GLU 35 H GLU 35 -13.231 -6.365 0.330
248 HA GLU 35 HA GLU 35 -14.266 -6.592 3.044
249 HB2 GLU 35 1HB GLU 35 -13.690 -8.920 2.878
250 HB3 GLU 35 2HB GLU 35 -14.501 -8.391 1.408
251 HG2 GLU 35 1HG GLU 35 -12.267 -8.220 0.268
252 HG3 GLU 35 2HG GLU 35 -11.499 -8.824 1.740
253 H VAL 36 H VAL 36 -11.419 -5.283 1.976
254 HA VAL 36 HA VAL 36 -9.758 -6.268 4.246
255 HB VAL 36 HB VAL 36 -8.795 -4.934 1.707
256 HG11 VAL 36 1HG1 VAL 36 -7.411 -6.757 3.725
257 HG12 VAL 36 2HG1 VAL 36 -6.672 -6.072 2.262
258 HG13 VAL 36 3HG1 VAL 36 -7.172 -5.002 3.574
259 HG21 VAL 36 3HG2 VAL 36 -9.969 -6.930 0.960
260 HG22 VAL 36 1HG2 VAL 36 -8.230 -7.213 0.880
261 HG23 VAL 36 2HG2 VAL 36 -9.174 -7.910 2.216
262 H SER 37 H SER 37 -10.694 -3.320 2.542
263 HA SER 37 HA SER 37 -10.160 -1.634 4.925
264 HB2 SER 37 1HB SER 37 -8.993 -1.043 2.174
265 HB3 SER 37 2HB SER 37 -8.996 0.073 3.547
266 HG SER 37 HG SER 37 -7.814 -1.604 4.725
Start of MODEL 20
1 H1 GLY 1 1H GLY 1 21.272 4.036 -2.631
2 H2 GLY 1 2H GLY 1 22.853 3.608 -2.635
3 H3 GLY 1 3H GLY 1 22.133 4.079 -1.239
4 HA2 GLY 1 1HA GLY 1 21.463 1.645 -2.764
5 HA3 GLY 1 2HA GLY 1 22.422 1.683 -1.272
6 H SER 2 H SER 2 19.844 0.316 -1.837
7 HA SER 2 HA SER 2 17.623 1.726 -0.769
8 HB2 SER 2 1HB SER 2 16.563 -0.518 -0.663
9 HB3 SER 2 2HB SER 2 17.338 -0.169 -2.217
10 HG SER 2 HG SER 2 17.848 -2.278 -1.447
11 H SER 3 H SER 3 20.164 0.030 0.962
12 HA SER 3 HA SER 3 18.891 -0.306 3.480
13 HB2 SER 3 1HB SER 3 21.818 0.300 2.916
14 HB3 SER 3 2HB SER 3 21.153 -0.441 4.384
15 HG SER 3 HG SER 3 21.976 -2.014 2.929
16 H GLY 4 H GLY 4 19.801 2.666 1.932
17 HA2 GLY 4 1HA GLY 4 20.259 4.312 4.250
18 HA3 GLY 4 2HA GLY 4 19.835 4.849 2.623
19 H SER 5 H SER 5 17.354 2.851 3.234
20 HA SER 5 HA SER 5 15.165 3.099 3.716
21 HB2 SER 5 1HB SER 5 16.154 4.557 6.177
22 HB3 SER 5 2HB SER 5 14.555 3.830 5.950
23 HG SER 5 HG SER 5 17.066 2.476 5.937
24 H SER 6 H SER 6 16.259 5.198 1.997
25 HA SER 6 HA SER 6 14.800 7.652 2.496
26 HB2 SER 6 1HB SER 6 16.178 6.670 -0.029
27 HB3 SER 6 2HB SER 6 15.633 8.328 0.303
28 HG SER 6 HG SER 6 17.862 8.059 0.761
29 H GLY 7 H GLY 7 12.778 6.268 2.857
30 HA2 GLY 7 1HA GLY 7 10.542 5.969 2.180
31 HA3 GLY 7 2HA GLY 7 10.969 6.326 0.507
32 H ARG 8 H ARG 8 9.303 4.257 0.893
33 HA ARG 8 HA ARG 8 10.882 1.839 0.206
34 HB2 ARG 8 1HB ARG 8 10.028 2.114 2.816
35 HB3 ARG 8 2HB ARG 8 8.581 1.443 2.099
36 HG2 ARG 8 1HG ARG 8 9.605 -0.505 2.703
37 HG3 ARG 8 2HG ARG 8 10.312 -0.359 1.101
38 HD2 ARG 8 1HD ARG 8 11.567 0.326 3.789
39 HD3 ARG 8 2HD ARG 8 12.039 -0.958 2.668
40 HE ARG 8 HE ARG 8 12.228 1.869 1.742
41 HH11 ARG 8 2HH1 ARG 8 14.151 -0.830 2.954
42 HH12 ARG 8 1HH1 ARG 8 15.622 -0.064 2.380
43 HH21 ARG 8 2HH2 ARG 8 14.060 2.653 1.037
44 HH22 ARG 8 1HH2 ARG 8 15.581 1.789 1.322
45 H SER 9 H SER 9 9.717 0.204 -0.859
46 HA SER 9 HA SER 9 7.225 1.082 -2.247
47 HB2 SER 9 1HB SER 9 9.172 0.428 -3.651
48 HB3 SER 9 2HB SER 9 9.098 -1.199 -2.949
49 HG SER 9 HG SER 9 7.951 -1.010 -4.949
50 H TYR 10 H TYR 10 5.429 -0.245 -2.293
51 HA TYR 10 HA TYR 10 5.212 -2.374 -0.198
52 HB2 TYR 10 1HB TYR 10 3.150 -0.239 -0.843
53 HB3 TYR 10 2HB TYR 10 3.065 -1.451 0.428
54 HD1 TYR 10 1HD TYR 10 4.655 -1.317 2.406
55 HD2 TYR 10 2HD TYR 10 4.318 1.838 -0.519
56 HE1 TYR 10 1HE TYR 10 5.780 0.264 3.973
57 HE2 TYR 10 2HE TYR 10 5.457 3.406 1.040
58 HH TYR 10 HH TYR 10 6.412 3.684 3.108
59 H SER 11 H SER 11 3.759 -4.060 -0.609
60 HA SER 11 HA SER 11 2.809 -4.322 -3.440
61 HB2 SER 11 1HB SER 11 3.894 -6.478 -1.606
62 HB3 SER 11 2HB SER 11 3.266 -6.717 -3.247
63 HG SER 11 HG SER 11 5.562 -6.532 -3.203
64 H CYS 12 H CYS 12 0.753 -4.842 -3.793
65 HA CYS 12 HA CYS 12 -1.253 -4.697 -1.904
66 HB2 CYS 12 1HB CYS 12 -1.596 -4.368 -4.255
67 HB3 CYS 12 2HB CYS 12 -1.205 -6.062 -4.594
68 HA PRO 13 HA PRO 13 -1.053 -8.777 0.021
69 HB2 PRO 13 1HB PRO 13 -3.196 -8.608 1.715
70 HB3 PRO 13 2HB PRO 13 -1.676 -7.703 1.965
71 HG2 PRO 13 1HG PRO 13 -4.245 -6.704 0.707
72 HG3 PRO 13 2HG PRO 13 -3.243 -5.913 1.959
73 HD2 PRO 13 1HD PRO 13 -3.048 -5.294 -0.701
74 HD3 PRO 13 2HD PRO 13 -1.631 -5.252 0.389
75 H VAL 14 H VAL 14 -3.409 -7.789 -2.234
76 HA VAL 14 HA VAL 14 -4.768 -10.475 -2.200
77 HB VAL 14 HB VAL 14 -5.939 -7.822 -3.067
78 HG11 VAL 14 1HG1 VAL 14 -7.224 -10.565 -2.709
79 HG12 VAL 14 2HG1 VAL 14 -8.100 -9.052 -3.032
80 HG13 VAL 14 3HG1 VAL 14 -7.000 -9.700 -4.248
81 HG21 VAL 14 3HG2 VAL 14 -6.364 -9.446 -0.522
82 HG22 VAL 14 1HG2 VAL 14 -5.696 -7.804 -0.645
83 HG23 VAL 14 2HG2 VAL 14 -7.388 -8.083 -1.032
84 H CYS 15 H CYS 15 -3.402 -7.969 -4.365
85 HA CYS 15 HA CYS 15 -3.387 -9.996 -6.543
86 HB2 CYS 15 1HB CYS 15 -4.178 -8.528 -8.136
87 HB3 CYS 15 2HB CYS 15 -5.344 -8.543 -6.816
88 H GLU 16 H GLU 16 -1.408 -8.478 -4.720
89 HA GLU 16 HA GLU 16 0.799 -8.031 -4.674
90 HB2 GLU 16 1HB GLU 16 0.860 -9.917 -7.043
91 HB3 GLU 16 2HB GLU 16 2.233 -9.490 -6.014
92 HG2 GLU 16 1HG GLU 16 1.018 -10.395 -4.030
93 HG3 GLU 16 2HG GLU 16 -0.283 -10.939 -5.094
94 H LYS 17 H LYS 17 -0.776 -6.202 -6.619
95 HA LYS 17 HA LYS 17 1.240 -5.081 -8.373
96 HB2 LYS 17 1HB LYS 17 -1.339 -3.957 -7.222
97 HB3 LYS 17 2HB LYS 17 -0.325 -3.069 -8.371
98 HG2 LYS 17 1HG LYS 17 -0.595 -4.753 -10.080
99 HG3 LYS 17 2HG LYS 17 -1.354 -5.861 -8.940
100 HD2 LYS 17 1HD LYS 17 -3.239 -4.139 -8.680
101 HD3 LYS 17 2HD LYS 17 -2.501 -3.252 -10.014
102 HE2 LYS 17 1HE LYS 17 -4.328 -4.643 -10.834
103 HE3 LYS 17 2HE LYS 17 -2.794 -5.215 -11.501
104 HZ1 LYS 17 3HZ LYS 17 -2.808 -7.022 -9.923
105 HZ2 LYS 17 1HZ LYS 17 -4.289 -7.010 -10.621
106 HZ3 LYS 17 2HZ LYS 17 -4.071 -6.423 -9.096
107 H SER 18 H SER 18 2.398 -3.198 -8.195
108 HA SER 18 HA SER 18 3.497 -2.775 -5.469
109 HB2 SER 18 1HB SER 18 4.729 -2.114 -8.156
110 HB3 SER 18 2HB SER 18 5.521 -2.034 -6.572
111 HG SER 18 HG SER 18 5.981 -3.992 -7.717
112 H PHE 19 H PHE 19 3.771 -0.835 -4.496
113 HA PHE 19 HA PHE 19 2.959 1.690 -5.877
114 HB2 PHE 19 1HB PHE 19 2.042 0.789 -3.126
115 HB3 PHE 19 2HB PHE 19 1.645 2.313 -3.903
116 HD1 PHE 19 2HD PHE 19 0.077 2.386 -5.846
117 HD2 PHE 19 1HD PHE 19 0.920 -1.295 -3.761
118 HE1 PHE 19 2HE PHE 19 -1.839 1.294 -6.990
119 HE2 PHE 19 1HE PHE 19 -0.987 -2.379 -4.912
120 HZ PHE 19 HZ PHE 19 -2.346 -1.100 -6.555
121 H SER 20 H SER 20 4.298 3.366 -5.490
122 HA SER 20 HA SER 20 6.631 3.017 -3.798
123 HB2 SER 20 1HB SER 20 5.749 5.441 -5.400
124 HB3 SER 20 2HB SER 20 7.372 5.122 -4.759
125 HG SER 20 HG SER 20 7.184 4.544 -6.979
126 H GLU 21 H GLU 21 3.615 3.942 -2.862
127 HA GLU 21 HA GLU 21 4.526 5.655 -0.599
128 HB2 GLU 21 1HB GLU 21 2.326 6.231 -2.604
129 HB3 GLU 21 2HB GLU 21 2.369 6.998 -1.031
130 HG2 GLU 21 1HG GLU 21 4.708 7.268 -2.956
131 HG3 GLU 21 2HG GLU 21 3.270 8.264 -3.092
132 H ASP 22 H ASP 22 3.387 5.285 1.298
133 HA ASP 22 HA ASP 22 1.851 2.880 1.528
134 HB2 ASP 22 1HB ASP 22 1.712 3.349 3.828
135 HB3 ASP 22 2HB ASP 22 3.316 3.837 3.299
136 H ARG 23 H ARG 23 0.910 6.291 1.282
137 HA ARG 23 HA ARG 23 -1.917 5.905 1.697
138 HB2 ARG 23 1HB ARG 23 -2.152 8.146 0.650
139 HB3 ARG 23 2HB ARG 23 -1.004 8.083 1.986
140 HG2 ARG 23 1HG ARG 23 0.892 8.084 0.431
141 HG3 ARG 23 2HG ARG 23 -0.207 8.061 -0.963
142 HD2 ARG 23 1HD ARG 23 -1.061 10.249 -0.404
143 HD3 ARG 23 2HD ARG 23 -0.192 10.258 1.145
144 HE ARG 23 HE ARG 23 1.884 9.949 -0.578
145 HH11 ARG 23 1HH1 ARG 23 -0.662 12.376 -0.650
146 HH12 ARG 23 2HH1 ARG 23 0.395 13.530 -1.420
147 HH21 ARG 23 2HH2 ARG 23 3.080 11.337 -1.462
148 HH22 ARG 23 1HH2 ARG 23 2.528 12.961 -1.893
149 H LEU 24 H LEU 24 0.054 5.371 -1.170
150 HA LEU 24 HA LEU 24 -2.290 5.288 -2.946
151 HB2 LEU 24 1HB LEU 24 0.618 4.548 -3.413
152 HB3 LEU 24 2HB LEU 24 -0.647 4.465 -4.635
153 HG LEU 24 HG LEU 24 0.292 7.010 -3.246
154 HD11 LEU 24 1HD1 LEU 24 0.596 6.056 -6.127
155 HD12 LEU 24 2HD1 LEU 24 1.884 6.035 -4.907
156 HD13 LEU 24 3HD1 LEU 24 1.205 7.580 -5.444
157 HD21 LEU 24 3HD2 LEU 24 -1.082 8.179 -4.967
158 HD22 LEU 24 1HD2 LEU 24 -2.058 7.286 -3.804
159 HD23 LEU 24 2HD2 LEU 24 -1.789 6.616 -5.434
160 H ILE 25 H ILE 25 -0.183 2.802 -1.375
161 HA ILE 25 HA ILE 25 -1.784 0.647 -2.457
162 HB ILE 25 HB ILE 25 0.461 0.216 -1.647
163 HG12 ILE 25 1HG1 ILE 25 -1.645 -1.350 -0.105
164 HG13 ILE 25 2HG1 ILE 25 -1.301 -1.553 -1.826
165 HG21 ILE 25 1HG2 ILE 25 0.479 1.701 0.320
166 HG22 ILE 25 2HG2 ILE 25 -0.619 0.586 1.178
167 HG23 ILE 25 3HG2 ILE 25 1.020 0.085 0.722
168 HD11 ILE 25 3HD1 ILE 25 1.012 -2.246 -1.280
169 HD12 ILE 25 1HD1 ILE 25 0.640 -2.102 0.459
170 HD13 ILE 25 2HD1 ILE 25 -0.221 -3.281 -0.524
171 H LYS 26 H LYS 26 -2.062 2.533 0.624
172 HA LYS 26 HA LYS 26 -4.370 1.098 1.568
173 HB2 LYS 26 1HB LYS 26 -3.399 3.946 2.020
174 HB3 LYS 26 2HB LYS 26 -4.840 3.309 2.802
175 HG2 LYS 26 1HG LYS 26 -2.088 2.025 3.076
176 HG3 LYS 26 2HG LYS 26 -2.749 3.221 4.192
177 HD2 LYS 26 1HD LYS 26 -4.715 1.667 4.577
178 HD3 LYS 26 2HD LYS 26 -3.864 0.430 3.644
179 HE2 LYS 26 1HE LYS 26 -2.818 1.794 6.168
180 HE3 LYS 26 2HE LYS 26 -3.604 0.216 6.125
181 HZ1 LYS 26 3HZ LYS 26 -1.041 0.872 4.770
182 HZ2 LYS 26 1HZ LYS 26 -1.786 -0.587 4.709
183 HZ3 LYS 26 2HZ LYS 26 -1.203 -0.022 6.123
184 H SER 27 H SER 27 -4.191 3.912 -0.651
185 HA SER 27 HA SER 27 -7.023 4.138 -1.038
186 HB2 SER 27 1HB SER 27 -4.763 4.783 -2.973
187 HB3 SER 27 2HB SER 27 -6.461 5.258 -3.163
188 HG SER 27 HG SER 27 -4.628 6.043 -1.137
189 H HIS 28 H HIS 28 -4.593 2.137 -2.822
190 HA HIS 28 HA HIS 28 -6.447 0.970 -4.650
191 HB2 HIS 28 1HB HIS 28 -4.056 0.843 -5.001
192 HB3 HIS 28 2HB HIS 28 -3.818 -0.026 -3.491
193 HD1 HIS 28 1HD HIS 28 -5.628 -0.670 -6.873
194 HD2 HIS 28 2HD HIS 28 -3.746 -2.608 -3.652
195 HE1 HIS 28 1HE HIS 28 -5.550 -3.125 -7.500
196 H ILE 29 H ILE 29 -5.363 -0.214 -1.430
197 HA ILE 29 HA ILE 29 -7.046 -2.526 -1.375
198 HB ILE 29 HB ILE 29 -5.903 -0.832 0.874
199 HG12 ILE 29 1HG1 ILE 29 -5.070 -3.579 -0.201
200 HG13 ILE 29 2HG1 ILE 29 -4.282 -2.074 -0.654
201 HG21 ILE 29 1HG2 ILE 29 -6.439 -2.763 2.369
202 HG22 ILE 29 2HG2 ILE 29 -7.893 -2.035 1.722
203 HG23 ILE 29 3HG2 ILE 29 -7.291 -3.551 1.021
204 HD11 ILE 29 3HD1 ILE 29 -2.937 -3.107 1.015
205 HD12 ILE 29 1HD1 ILE 29 -3.687 -1.675 1.746
206 HD13 ILE 29 2HD1 ILE 29 -4.300 -3.307 2.119
207 H LYS 30 H LYS 30 -7.751 0.870 -0.321
208 HA LYS 30 HA LYS 30 -10.399 0.207 0.631
209 HB2 LYS 30 1HB LYS 30 -9.048 2.817 -0.131
210 HB3 LYS 30 2HB LYS 30 -10.722 2.747 0.437
211 HG2 LYS 30 1HG LYS 30 -10.080 1.780 2.558
212 HG3 LYS 30 2HG LYS 30 -8.424 1.534 2.027
213 HD2 LYS 30 1HD LYS 30 -8.504 3.461 3.500
214 HD3 LYS 30 2HD LYS 30 -8.052 3.952 1.872
215 HE2 LYS 30 1HE LYS 30 -9.563 5.595 2.730
216 HE3 LYS 30 2HE LYS 30 -10.399 4.715 1.452
217 HZ1 LYS 30 3HZ LYS 30 -11.803 5.025 3.420
218 HZ2 LYS 30 1HZ LYS 30 -10.743 4.234 4.371
219 HZ3 LYS 30 2HZ LYS 30 -11.546 3.431 3.194
220 H THR 31 H THR 31 -9.319 1.135 -2.629
221 HA THR 31 HA THR 31 -12.070 1.454 -3.587
222 HB THR 31 HB THR 31 -10.889 1.835 -5.760
223 HG1 THR 31 1HG THR 31 -8.543 2.041 -4.255
224 HG21 THR 31 3HG2 THR 31 -10.022 3.583 -3.422
225 HG22 THR 31 1HG2 THR 31 -11.508 3.745 -4.380
226 HG23 THR 31 2HG2 THR 31 -9.932 4.031 -5.140
227 H ASN 32 H ASN 32 -9.443 -0.907 -4.038
228 HA ASN 32 HA ASN 32 -11.170 -2.519 -5.866
229 HB2 ASN 32 1HB ASN 32 -8.172 -2.538 -5.310
230 HB3 ASN 32 2HB ASN 32 -9.000 -3.714 -6.311
231 HD21 ASN 32 1HD2 ASN 32 -8.595 -0.092 -6.085
232 HD22 ASN 32 2HD2 ASN 32 -8.597 0.076 -7.830
233 H HIS 33 H HIS 33 -9.651 -2.700 -2.658
234 HA HIS 33 HA HIS 33 -11.091 -5.254 -2.124
235 HB2 HIS 33 1HB HIS 33 -8.232 -5.000 -1.151
236 HB3 HIS 33 2HB HIS 33 -9.163 -6.456 -1.483
237 HD1 HIS 33 1HD HIS 33 -9.497 -6.604 -4.483
238 HD2 HIS 33 2HD HIS 33 -6.251 -4.677 -2.646
239 HE1 HIS 33 1HE HIS 33 -7.649 -6.549 -6.231
240 HA PRO 34 HA PRO 34 -12.097 -3.502 1.552
241 HB2 PRO 34 1HB PRO 34 -14.637 -2.793 1.078
242 HB3 PRO 34 2HB PRO 34 -13.324 -1.602 0.818
243 HG2 PRO 34 1HG PRO 34 -14.797 -3.248 -1.241
244 HG3 PRO 34 2HG PRO 34 -14.293 -1.529 -1.327
245 HD2 PRO 34 1HD PRO 34 -12.906 -3.771 -2.316
246 HD3 PRO 34 2HD PRO 34 -12.195 -2.127 -2.069
247 H GLU 35 H GLU 35 -14.470 -4.570 1.632
248 HA GLU 35 HA GLU 35 -15.050 -6.582 2.773
249 HB2 GLU 35 1HB GLU 35 -16.244 -8.042 1.375
250 HB3 GLU 35 2HB GLU 35 -16.472 -6.392 0.821
251 HG2 GLU 35 1HG GLU 35 -15.008 -6.773 -1.093
252 HG3 GLU 35 2HG GLU 35 -14.555 -8.366 -0.481
253 H VAL 36 H VAL 36 -12.081 -6.840 1.157
254 HA VAL 36 HA VAL 36 -11.461 -9.497 2.324
255 HB VAL 36 HB VAL 36 -9.525 -7.871 0.665
256 HG11 VAL 36 1HG1 VAL 36 -8.733 -9.948 1.774
257 HG12 VAL 36 2HG1 VAL 36 -10.022 -10.867 0.958
258 HG13 VAL 36 3HG1 VAL 36 -8.722 -10.109 0.014
259 HG21 VAL 36 3HG2 VAL 36 -11.782 -9.562 -0.469
260 HG22 VAL 36 1HG2 VAL 36 -11.402 -7.862 -0.821
261 HG23 VAL 36 2HG2 VAL 36 -10.312 -9.119 -1.370
262 H SER 37 H SER 37 -10.530 -6.100 2.558
263 HA SER 37 HA SER 37 -9.058 -6.588 5.097
264 HB2 SER 37 1HB SER 37 -7.473 -6.599 3.107
265 HB3 SER 37 2HB SER 37 -7.931 -4.912 2.830
266 HG SER 37 HG SER 37 -6.691 -6.049 5.155