Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
644418 | 6qet RC | 34349 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ASP 1 H1 ASP 1 19.218 -6.203 -2.132
2 H2 ASP 1 H2 ASP 1 18.083 -5.118 -2.758
3 H3 ASP 1 H3 ASP 1 17.637 -6.198 -1.536
4 HA ASP 1 HA ASP 1 19.608 -4.009 -1.269
5 HB2 ASP 1 HB2 ASP 1 17.960 -2.926 0.170
6 HB3 ASP 1 HB3 ASP 1 17.269 -3.206 -1.427
7 H THR 2 H THR 2 20.534 -3.801 0.762
8 HA THR 2 HA THR 2 20.411 -6.200 2.439
9 HB THR 2 HB THR 2 22.380 -3.919 2.667
10 HG1 THR 2 HG1 THR 2 23.646 -4.928 1.201
11 HG21 THR 2 HG21 THR 2 22.497 -6.808 3.550
12 HG22 THR 2 HG22 THR 2 22.256 -5.412 4.602
13 HG23 THR 2 HG23 THR 2 23.785 -5.621 3.748
14 H THR 3 H THR 3 19.429 -2.974 2.228
15 HA THR 3 HA THR 3 18.135 -3.094 4.800
16 HB THR 3 HB THR 3 20.301 -2.164 5.448
17 HG1 THR 3 HG1 THR 3 19.485 -0.059 6.212
18 HG21 THR 3 HG21 THR 3 19.751 -0.022 3.394
19 HG22 THR 3 HG22 THR 3 21.009 -1.257 3.303
20 HG23 THR 3 HG23 THR 3 21.080 -0.014 4.553
21 H SER 4 H SER 4 16.477 -1.459 4.997
22 HA SER 4 HA SER 4 15.248 -0.884 2.507
23 HB2 SER 4 HB2 SER 4 14.483 0.237 5.209
24 HB3 SER 4 HB3 SER 4 13.444 0.035 3.796
25 HG SER 4 HG SER 4 14.233 -2.329 4.131
26 H ASP 5 H ASP 5 16.490 0.495 1.302
27 HA ASP 5 HA ASP 5 16.278 3.295 2.120
28 HB2 ASP 5 HB2 ASP 5 18.610 2.548 2.630
29 HB3 ASP 5 HB3 ASP 5 18.808 2.122 0.933
30 H PHE 6 H PHE 6 14.698 3.670 0.676
31 HA PHE 6 HA PHE 6 15.247 4.168 -2.023
32 HB2 PHE 6 HB2 PHE 6 13.503 2.330 -2.814
33 HB3 PHE 6 HB3 PHE 6 15.217 1.957 -2.697
34 HD1 PHE 6 HD1 PHE 6 12.219 1.940 -0.447
35 HD2 PHE 6 HD2 PHE 6 15.746 -0.052 -1.754
36 HE1 PHE 6 HE1 PHE 6 11.718 0.059 1.062
37 HE2 PHE 6 HE2 PHE 6 15.250 -1.930 -0.250
38 HZ PHE 6 HZ PHE 6 13.232 -1.875 1.162
39 H HIS 7 H HIS 7 12.816 4.159 -3.196
40 HA HIS 7 HA HIS 7 11.322 5.944 -1.485
41 HB2 HIS 7 HB2 HIS 7 10.829 5.018 -4.317
42 HB3 HIS 7 HB3 HIS 7 9.797 6.156 -3.465
43 HD1 HIS 7 HD1 HIS 7 12.454 6.140 -5.808
44 HD2 HIS 7 HD2 HIS 7 11.518 8.457 -2.486
45 HE1 HIS 7 HE1 HIS 7 13.728 8.286 -6.102
46 HE2 HIS 7 HE2 HIS 7 13.298 9.586 -3.986
47 H THR 8 H THR 8 10.307 4.907 0.086
48 HA THR 8 HA THR 8 9.254 2.281 -0.271
49 HB THR 8 HB THR 8 8.350 2.868 2.149
50 HG1 THR 8 HG1 THR 8 9.516 4.508 3.116
51 HG21 THR 8 HG21 THR 8 11.266 2.489 1.475
52 HG22 THR 8 HG22 THR 8 10.066 1.216 1.696
53 HG23 THR 8 HG23 THR 8 10.548 2.220 3.062
54 H CYS 9 H CYS 9 6.987 2.139 1.145
55 HA CYS 9 HA CYS 9 5.087 3.345 -0.698
56 HB2 CYS 9 HB2 CYS 9 4.794 1.275 1.507
57 HB3 CYS 9 HB3 CYS 9 3.457 1.849 0.506
58 H GLN 10 H GLN 10 5.059 2.797 2.808
59 HA GLN 10 HA GLN 10 3.529 5.187 3.230
60 HB2 GLN 10 HB2 GLN 10 4.256 4.392 5.724
61 HB3 GLN 10 HB3 GLN 10 2.870 3.763 4.850
62 HG2 GLN 10 HG2 GLN 10 4.217 1.898 4.043
63 HG3 GLN 10 HG3 GLN 10 5.590 2.521 4.936
64 HE21 GLN 10 HE21 GLN 10 4.347 -0.029 5.124
65 HE22 GLN 10 HE22 GLN 10 3.781 -0.203 6.744
66 H ASP 11 H ASP 11 4.493 7.000 3.012
67 HA ASP 11 HA ASP 11 6.462 8.253 4.321
68 HB2 ASP 11 HB2 ASP 11 8.049 6.427 3.681
69 HB3 ASP 11 HB3 ASP 11 7.757 6.800 1.983
70 H LYS 12 H LYS 12 5.823 7.382 0.923
71 HA LYS 12 HA LYS 12 5.689 10.216 0.211
72 HB2 LYS 12 HB2 LYS 12 5.263 7.777 -1.522
73 HB3 LYS 12 HB3 LYS 12 5.477 9.420 -2.092
74 HG2 LYS 12 HG2 LYS 12 7.782 9.396 -1.252
75 HG3 LYS 12 HG3 LYS 12 7.557 7.728 -0.716
76 HD2 LYS 12 HD2 LYS 12 7.258 8.665 -3.567
77 HD3 LYS 12 HD3 LYS 12 8.709 7.914 -2.906
78 HE2 LYS 12 HE2 LYS 12 7.518 5.873 -2.464
79 HE3 LYS 12 HE3 LYS 12 5.988 6.613 -2.926
80 HZ1 LYS 12 HZ1 LYS 12 6.746 5.300 -4.731
81 HZ2 LYS 12 HZ2 LYS 12 8.283 6.003 -4.696
82 HZ3 LYS 12 HZ3 LYS 12 6.953 6.917 -5.177
83 H GLY 13 H GLY 13 3.684 7.352 0.445
84 HA2 GLY 13 HA2 GLY 13 1.301 9.047 0.082
85 HA3 GLY 13 HA3 GLY 13 1.422 7.459 -0.650
86 H GLY 14 H GLY 14 0.920 5.719 0.456
87 HA2 GLY 14 HA2 GLY 14 0.207 6.064 3.279
88 HA3 GLY 14 HA3 GLY 14 -0.865 5.245 2.159
89 H HIS 15 H HIS 15 -0.667 3.504 3.734
90 HA HIS 15 HA HIS 15 1.937 2.298 4.128
91 HB2 HIS 15 HB2 HIS 15 0.944 1.124 5.916
92 HB3 HIS 15 HB3 HIS 15 0.171 2.700 5.947
93 HD1 HIS 15 HD1 HIS 15 -0.737 -0.587 6.509
94 HD2 HIS 15 HD2 HIS 15 -2.325 2.372 4.049
95 HE1 HIS 15 HE1 HIS 15 -3.121 -1.260 6.093
96 HE2 HIS 15 HE2 HIS 15 -4.024 0.480 4.519
97 H CYS 16 H CYS 16 2.046 -0.100 4.134
98 HA CYS 16 HA CYS 16 1.404 -1.041 1.501
99 HB2 CYS 16 HB2 CYS 16 2.721 -2.445 3.835
100 HB3 CYS 16 HB3 CYS 16 2.687 -3.025 2.171
101 H VAL 17 H VAL 17 -0.201 -2.370 0.923
102 HA VAL 17 HA VAL 17 -1.740 -3.657 3.079
103 HB VAL 17 HB VAL 17 -3.782 -3.340 1.868
104 HG11 VAL 17 HG11 VAL 17 -3.988 -0.888 1.897
105 HG12 VAL 17 HG12 VAL 17 -2.233 -0.765 2.030
106 HG13 VAL 17 HG13 VAL 17 -3.164 -1.521 3.322
107 HG21 VAL 17 HG21 VAL 17 -2.945 -3.549 -0.403
108 HG22 VAL 17 HG22 VAL 17 -2.146 -1.982 -0.267
109 HG23 VAL 17 HG23 VAL 17 -3.907 -2.081 -0.228
110 H SER 18 H SER 18 -2.298 -5.690 2.821
111 HA SER 18 HA SER 18 -0.997 -7.304 0.918
112 HB2 SER 18 HB2 SER 18 -2.250 -9.108 1.935
113 HB3 SER 18 HB3 SER 18 -1.703 -8.029 3.195
114 HG SER 18 HG SER 18 -3.771 -7.130 3.278
115 HA PRO 19 HA PRO 19 -3.416 -6.940 -2.670
116 HB2 PRO 19 HB2 PRO 19 -3.613 -9.544 -3.529
117 HB3 PRO 19 HB3 PRO 19 -2.194 -8.515 -3.733
118 HG2 PRO 19 HG2 PRO 19 -2.757 -10.568 -1.631
119 HG3 PRO 19 HG3 PRO 19 -1.256 -10.267 -2.530
120 HD2 PRO 19 HD2 PRO 19 -1.549 -9.385 -0.031
121 HD3 PRO 19 HD3 PRO 19 -0.721 -8.398 -1.254
122 H LYS 20 H LYS 20 -5.066 -7.407 -0.178
123 HA LYS 20 HA LYS 20 -7.545 -7.914 -1.608
124 HB2 LYS 20 HB2 LYS 20 -6.683 -10.121 -0.600
125 HB3 LYS 20 HB3 LYS 20 -7.065 -9.410 0.961
126 HG2 LYS 20 HG2 LYS 20 -9.405 -9.043 0.054
127 HG3 LYS 20 HG3 LYS 20 -8.941 -10.098 -1.277
128 HD2 LYS 20 HD2 LYS 20 -10.066 -11.423 0.360
129 HD3 LYS 20 HD3 LYS 20 -8.355 -11.841 0.413
130 HE2 LYS 20 HE2 LYS 20 -9.291 -11.627 2.659
131 HE3 LYS 20 HE3 LYS 20 -8.054 -10.408 2.364
132 HZ1 LYS 20 HZ1 LYS 20 -10.992 -9.974 2.232
133 HZ2 LYS 20 HZ2 LYS 20 -9.816 -8.800 1.916
134 HZ3 LYS 20 HZ3 LYS 20 -9.962 -9.451 3.469
135 H ILE 21 H ILE 21 -6.379 -5.563 -0.508
136 HA ILE 21 HA ILE 21 -8.085 -5.055 1.848
137 HB ILE 21 HB ILE 21 -5.484 -3.713 1.095
138 HG12 ILE 21 HG12 ILE 21 -5.143 -5.998 1.899
139 HG13 ILE 21 HG13 ILE 21 -4.569 -4.833 3.086
140 HG21 ILE 21 HG21 ILE 21 -5.625 -2.625 3.290
141 HG22 ILE 21 HG22 ILE 21 -7.219 -3.339 3.531
142 HG23 ILE 21 HG23 ILE 21 -6.965 -2.166 2.239
143 HD11 ILE 21 HD11 ILE 21 -6.626 -5.158 4.375
144 HD12 ILE 21 HD12 ILE 21 -5.723 -6.657 4.168
145 HD13 ILE 21 HD13 ILE 21 -7.164 -6.353 3.197
146 H ARG 22 H ARG 22 -9.141 -3.058 2.001
147 HA ARG 22 HA ARG 22 -10.184 -1.987 -0.398
148 HB2 ARG 22 HB2 ARG 22 -11.454 -2.045 1.700
149 HB3 ARG 22 HB3 ARG 22 -10.298 -0.946 2.441
150 HG2 ARG 22 HG2 ARG 22 -10.921 0.685 0.589
151 HG3 ARG 22 HG3 ARG 22 -12.293 -0.378 0.280
152 HD2 ARG 22 HD2 ARG 22 -11.649 1.046 2.856
153 HD3 ARG 22 HD3 ARG 22 -12.966 1.415 1.746
154 HE ARG 22 HE ARG 22 -12.871 -1.218 3.035
155 HH11 ARG 22 HH11 ARG 22 -14.410 1.903 2.646
156 HH12 ARG 22 HH12 ARG 22 -15.852 1.440 3.491
157 HH21 ARG 22 HH21 ARG 22 -14.773 -1.828 4.156
158 HH22 ARG 22 HH22 ARG 22 -16.055 -0.676 4.351
159 H CYS 23 H CYS 23 -8.815 -0.899 -1.727
160 HA CYS 23 HA CYS 23 -6.969 1.055 -0.607
161 HB2 CYS 23 HB2 CYS 23 -7.415 0.130 -3.447
162 HB3 CYS 23 HB3 CYS 23 -6.170 1.255 -2.936
163 H LEU 24 H LEU 24 -7.725 3.053 -0.231
164 HA LEU 24 HA LEU 24 -9.898 4.193 -1.701
165 HB2 LEU 24 HB2 LEU 24 -8.012 5.123 0.392
166 HB3 LEU 24 HB3 LEU 24 -8.723 6.361 -0.623
167 HG LEU 24 HG LEU 24 -9.974 6.054 1.466
168 HD11 LEU 24 HD11 LEU 24 -11.134 6.814 -0.551
169 HD12 LEU 24 HD12 LEU 24 -12.189 5.866 0.496
170 HD13 LEU 24 HD13 LEU 24 -11.511 5.140 -0.960
171 HD21 LEU 24 HD21 LEU 24 -10.495 3.268 0.437
172 HD22 LEU 24 HD22 LEU 24 -11.269 4.009 1.837
173 HD23 LEU 24 HD23 LEU 24 -9.534 3.694 1.852
174 H GLU 25 H GLU 25 -6.391 4.591 -1.718
175 HA GLU 25 HA GLU 25 -6.536 5.284 -4.541
176 HB2 GLU 25 HB2 GLU 25 -6.571 7.459 -3.475
177 HB3 GLU 25 HB3 GLU 25 -5.207 7.028 -2.462
178 HG2 GLU 25 HG2 GLU 25 -3.788 6.882 -4.461
179 HG3 GLU 25 HG3 GLU 25 -5.165 7.363 -5.451
180 H GLU 26 H GLU 26 -5.217 3.867 -5.482
181 HA GLU 26 HA GLU 26 -3.098 2.614 -3.962
182 HB2 GLU 26 HB2 GLU 26 -3.876 2.247 -6.856
183 HB3 GLU 26 HB3 GLU 26 -2.762 1.235 -5.950
184 HG2 GLU 26 HG2 GLU 26 -4.576 0.562 -4.463
185 HG3 GLU 26 HG3 GLU 26 -5.694 1.572 -5.380
186 H GLN 27 H GLN 27 -0.957 3.011 -4.128
187 HA GLN 27 HA GLN 27 -0.049 4.754 -6.289
188 HB2 GLN 27 HB2 GLN 27 1.266 6.111 -4.769
189 HB3 GLN 27 HB3 GLN 27 -0.446 6.220 -4.376
190 HG2 GLN 27 HG2 GLN 27 0.181 5.867 -2.277
191 HG3 GLN 27 HG3 GLN 27 0.446 4.188 -2.753
192 HE21 GLN 27 HE21 GLN 27 1.942 7.274 -2.189
193 HE22 GLN 27 HE22 GLN 27 3.565 6.685 -2.065
194 H LEU 28 H LEU 28 2.450 4.985 -6.068
195 HA LEU 28 HA LEU 28 3.393 2.250 -6.172
196 HB2 LEU 28 HB2 LEU 28 4.926 2.945 -7.834
197 HB3 LEU 28 HB3 LEU 28 3.369 3.608 -8.256
198 HG LEU 28 HG LEU 28 5.553 5.199 -6.904
199 HD11 LEU 28 HD11 LEU 28 6.310 4.441 -9.082
200 HD12 LEU 28 HD12 LEU 28 5.984 6.175 -9.095
201 HD13 LEU 28 HD13 LEU 28 4.831 5.056 -9.822
202 HD21 LEU 28 HD21 LEU 28 2.948 5.970 -8.205
203 HD22 LEU 28 HD22 LEU 28 4.230 7.121 -7.832
204 HD23 LEU 28 HD23 LEU 28 3.444 6.232 -6.530
205 H GLY 29 H GLY 29 4.983 1.553 -4.926
206 HA2 GLY 29 HA2 GLY 29 7.126 3.179 -3.996
207 HA3 GLY 29 HA3 GLY 29 5.970 2.862 -2.707
208 H LEU 30 H LEU 30 8.005 1.759 -1.835
209 HA LEU 30 HA LEU 30 8.172 -0.957 -2.931
210 HB2 LEU 30 HB2 LEU 30 10.184 0.753 -1.560
211 HB3 LEU 30 HB3 LEU 30 10.311 -0.986 -1.413
212 HG LEU 30 HG LEU 30 10.110 -0.904 -4.038
213 HD11 LEU 30 HD11 LEU 30 11.057 1.847 -3.306
214 HD12 LEU 30 HD12 LEU 30 9.673 1.402 -4.305
215 HD13 LEU 30 HD13 LEU 30 11.313 1.113 -4.892
216 HD21 LEU 30 HD21 LEU 30 12.007 -1.796 -2.816
217 HD22 LEU 30 HD22 LEU 30 12.624 -0.165 -2.554
218 HD23 LEU 30 HD23 LEU 30 12.545 -0.826 -4.188
219 H CYS 31 H CYS 31 7.114 -2.410 -1.895
220 HA CYS 31 HA CYS 31 7.077 -2.362 1.055
221 HB2 CYS 31 HB2 CYS 31 5.065 -3.630 -0.821
222 HB3 CYS 31 HB3 CYS 31 5.018 -3.709 0.936
223 HA PRO 32 HA PRO 32 9.250 -6.169 0.151
224 HB2 PRO 32 HB2 PRO 32 10.382 -6.555 2.515
225 HB3 PRO 32 HB3 PRO 32 10.805 -5.124 1.567
226 HG2 PRO 32 HG2 PRO 32 9.034 -5.363 3.958
227 HG3 PRO 32 HG3 PRO 32 10.123 -4.036 3.495
228 HD2 PRO 32 HD2 PRO 32 7.321 -4.199 3.038
229 HD3 PRO 32 HD3 PRO 32 8.431 -2.979 2.387
230 H LEU 33 H LEU 33 7.575 -7.624 -0.206
231 HA LEU 33 HA LEU 33 7.177 -9.647 1.705
232 HB2 LEU 33 HB2 LEU 33 4.948 -7.655 1.390
233 HB3 LEU 33 HB3 LEU 33 4.587 -9.335 1.716
234 HG LEU 33 HG LEU 33 6.176 -7.478 3.487
235 HD11 LEU 33 HD11 LEU 33 3.470 -8.736 3.857
236 HD12 LEU 33 HD12 LEU 33 3.793 -7.032 3.540
237 HD13 LEU 33 HD13 LEU 33 4.330 -7.767 5.051
238 HD21 LEU 33 HD21 LEU 33 7.122 -9.633 3.707
239 HD22 LEU 33 HD22 LEU 33 5.529 -10.395 3.745
240 HD23 LEU 33 HD23 LEU 33 6.060 -9.387 5.095
241 H LYS 34 H LYS 34 4.450 -8.769 -0.237
242 HA LYS 34 HA LYS 34 5.298 -10.577 -2.383
243 HB2 LYS 34 HB2 LYS 34 2.600 -10.588 -1.017
244 HB3 LYS 34 HB3 LYS 34 3.089 -11.630 -2.349
245 HG2 LYS 34 HG2 LYS 34 4.859 -12.569 -0.842
246 HG3 LYS 34 HG3 LYS 34 4.116 -11.664 0.477
247 HD2 LYS 34 HD2 LYS 34 1.994 -12.836 0.054
248 HD3 LYS 34 HD3 LYS 34 2.778 -13.774 -1.213
249 HE2 LYS 34 HE2 LYS 34 2.693 -15.096 0.786
250 HE3 LYS 34 HE3 LYS 34 4.366 -14.637 0.481
251 HZ1 LYS 34 HZ1 LYS 34 2.548 -13.295 2.408
252 HZ2 LYS 34 HZ2 LYS 34 4.172 -12.909 2.141
253 HZ3 LYS 34 HZ3 LYS 34 3.758 -14.402 2.814
254 H ARG 35 H ARG 35 2.262 -10.228 -3.034
255 HA ARG 35 HA ARG 35 2.510 -8.091 -4.885
256 HB2 ARG 35 HB2 ARG 35 1.290 -10.089 -5.438
257 HB3 ARG 35 HB3 ARG 35 0.238 -9.890 -4.051
258 HG2 ARG 35 HG2 ARG 35 -0.815 -9.332 -6.203
259 HG3 ARG 35 HG3 ARG 35 -0.820 -8.018 -5.029
260 HD2 ARG 35 HD2 ARG 35 1.508 -7.978 -6.783
261 HD3 ARG 35 HD3 ARG 35 -0.019 -7.821 -7.651
262 HE ARG 35 HE ARG 35 -0.308 -6.070 -5.622
263 HH11 ARG 35 HH11 ARG 35 2.265 -6.545 -7.938
264 HH12 ARG 35 HH12 ARG 35 2.682 -4.863 -8.011
265 HH21 ARG 35 HH21 ARG 35 0.217 -3.852 -5.723
266 HH22 ARG 35 HH22 ARG 35 1.516 -3.328 -6.756
267 H TRP 36 H TRP 36 2.901 -7.213 -2.240
268 HA TRP 36 HA TRP 36 0.502 -6.045 -1.215
269 HB2 TRP 36 HB2 TRP 36 3.397 -5.952 -0.455
270 HB3 TRP 36 HB3 TRP 36 2.234 -4.862 0.302
271 HD1 TRP 36 HD1 TRP 36 2.200 -8.690 -0.452
272 HE1 TRP 36 HE1 TRP 36 1.351 -9.884 1.664
273 HE3 TRP 36 HE3 TRP 36 1.500 -4.617 2.532
274 HZ2 TRP 36 HZ2 TRP 36 0.478 -9.167 4.261
275 HZ3 TRP 36 HZ3 TRP 36 0.636 -4.958 4.782
276 HH2 TRP 36 HH2 TRP 36 0.147 -7.170 5.641
277 H THR 37 H THR 37 -0.409 -4.295 -1.836
278 HA THR 37 HA THR 37 0.908 -2.494 -3.695
279 HB THR 37 HB THR 37 -1.936 -2.938 -2.824
280 HG1 THR 37 HG1 THR 37 -2.173 -3.591 -4.919
281 HG21 THR 37 HG21 THR 37 -0.922 -0.650 -4.510
282 HG22 THR 37 HG22 THR 37 -1.787 -0.540 -2.972
283 HG23 THR 37 HG23 THR 37 -2.612 -1.145 -4.413
284 H CYS 38 H CYS 38 1.097 -0.239 -3.371
285 HA CYS 38 HA CYS 38 1.231 0.544 -0.561
286 HB2 CYS 38 HB2 CYS 38 1.957 2.177 -2.997
287 HB3 CYS 38 HB3 CYS 38 2.539 2.378 -1.346
288 H CYS 39 H CYS 39 -0.742 1.091 0.196
289 HA CYS 39 HA CYS 39 -2.521 2.488 -1.642
290 HB2 CYS 39 HB2 CYS 39 -2.936 0.553 0.562
291 HB3 CYS 39 HB3 CYS 39 -4.220 1.693 0.191
292 H LYS 40 H LYS 40 -2.893 4.491 -1.368
293 HA LYS 40 HA LYS 40 -2.166 5.898 1.019
294 HB2 LYS 40 HB2 LYS 40 -1.975 6.823 -1.303
295 HB3 LYS 40 HB3 LYS 40 -3.725 6.877 -1.374
296 HG2 LYS 40 HG2 LYS 40 -2.491 8.254 0.917
297 HG3 LYS 40 HG3 LYS 40 -2.188 8.955 -0.674
298 HD2 LYS 40 HD2 LYS 40 -4.641 8.947 -1.080
299 HD3 LYS 40 HD3 LYS 40 -4.874 8.384 0.577
300 HE2 LYS 40 HE2 LYS 40 -3.436 10.930 -0.148
301 HE3 LYS 40 HE3 LYS 40 -5.151 10.854 0.250
302 HZ1 LYS 40 HZ1 LYS 40 -4.630 10.070 2.428
303 HZ2 LYS 40 HZ2 LYS 40 -3.716 11.469 2.143
304 HZ3 LYS 40 HZ3 LYS 40 -2.981 9.951 2.059
305 H GLU 41 H GLU 41 -3.370 4.937 2.581
306 HA GLU 41 HA GLU 41 -4.998 4.898 4.120
307 HB2 GLU 41 HB2 GLU 41 -6.531 6.678 2.232
308 HB3 GLU 41 HB3 GLU 41 -7.023 6.250 3.861
309 HG2 GLU 41 HG2 GLU 41 -5.039 7.331 4.763
310 HG3 GLU 41 HG3 GLU 41 -4.530 7.755 3.129
311 H ILE 42 H ILE 42 -6.837 3.740 4.646
312 HA ILE 42 HA ILE 42 -8.070 2.186 2.487
313 HB ILE 42 HB ILE 42 -7.981 0.143 3.784
314 HG12 ILE 42 HG12 ILE 42 -7.934 1.290 6.044
315 HG13 ILE 42 HG13 ILE 42 -6.886 -0.109 5.880
316 HG21 ILE 42 HG21 ILE 42 -5.569 -0.321 3.664
317 HG22 ILE 42 HG22 ILE 42 -5.266 1.406 3.468
318 HG23 ILE 42 HG23 ILE 42 -6.175 0.525 2.240
319 HD11 ILE 42 HD11 ILE 42 -5.983 2.755 5.698
320 HD12 ILE 42 HD12 ILE 42 -4.954 1.326 5.660
321 HD13 ILE 42 HD13 ILE 42 -5.848 1.729 7.123
Start of MODEL 2
1 H1 ASP 1 H1 ASP 1 16.764 -6.669 -4.082
2 H2 ASP 1 H2 ASP 1 17.104 -6.929 -5.716
3 H3 ASP 1 H3 ASP 1 15.891 -5.841 -5.268
4 HA ASP 1 HA ASP 1 17.916 -4.714 -5.974
5 HB2 ASP 1 HB2 ASP 1 17.189 -4.436 -3.049
6 HB3 ASP 1 HB3 ASP 1 18.145 -3.266 -3.954
7 H THR 2 H THR 2 20.046 -3.938 -5.103
8 HA THR 2 HA THR 2 21.666 -6.203 -4.281
9 HB THR 2 HB THR 2 22.545 -3.366 -4.862
10 HG1 THR 2 HG1 THR 2 21.419 -4.478 -6.635
11 HG21 THR 2 HG21 THR 2 24.210 -4.694 -3.662
12 HG22 THR 2 HG22 THR 2 24.726 -4.406 -5.324
13 HG23 THR 2 HG23 THR 2 24.070 -5.976 -4.865
14 H THR 3 H THR 3 20.317 -3.315 -3.036
15 HA THR 3 HA THR 3 20.795 -4.060 -0.330
16 HB THR 3 HB THR 3 22.998 -3.033 -0.896
17 HG1 THR 3 HG1 THR 3 22.512 -2.806 1.223
18 HG21 THR 3 HG21 THR 3 21.361 -0.538 -1.356
19 HG22 THR 3 HG22 THR 3 22.278 -1.425 -2.575
20 HG23 THR 3 HG23 THR 3 23.121 -0.600 -1.264
21 H SER 4 H SER 4 19.804 -2.349 1.134
22 HA SER 4 HA SER 4 17.308 -1.561 0.044
23 HB2 SER 4 HB2 SER 4 18.550 -0.772 2.688
24 HB3 SER 4 HB3 SER 4 16.841 -0.669 2.262
25 HG SER 4 HG SER 4 17.710 -3.157 1.795
26 H ASP 5 H ASP 5 17.553 -0.102 -1.567
27 HA ASP 5 HA ASP 5 17.945 2.629 -0.714
28 HB2 ASP 5 HB2 ASP 5 20.227 1.954 -1.415
29 HB3 ASP 5 HB3 ASP 5 19.589 1.498 -2.992
30 H PHE 6 H PHE 6 15.924 3.193 -1.235
31 HA PHE 6 HA PHE 6 15.006 3.490 -3.848
32 HB2 PHE 6 HB2 PHE 6 13.101 1.710 -3.589
33 HB3 PHE 6 HB3 PHE 6 14.669 1.223 -4.213
34 HD1 PHE 6 HD1 PHE 6 14.814 -1.005 -3.644
35 HD2 PHE 6 HD2 PHE 6 13.682 1.805 -0.657
36 HE1 PHE 6 HE1 PHE 6 14.962 -2.768 -1.939
37 HE2 PHE 6 HE2 PHE 6 13.831 0.045 1.054
38 HZ PHE 6 HZ PHE 6 14.455 -2.254 0.414
39 H HIS 7 H HIS 7 12.437 3.657 -3.748
40 HA HIS 7 HA HIS 7 11.875 5.479 -1.560
41 HB2 HIS 7 HB2 HIS 7 10.450 4.768 -4.111
42 HB3 HIS 7 HB3 HIS 7 9.645 5.683 -2.848
43 HD1 HIS 7 HD1 HIS 7 11.425 6.206 -5.854
44 HD2 HIS 7 HD2 HIS 7 11.352 8.088 -2.147
45 HE1 HIS 7 HE1 HIS 7 12.334 8.516 -6.253
46 HE2 HIS 7 HE2 HIS 7 12.175 9.674 -4.021
47 H THR 8 H THR 8 10.933 4.813 0.254
48 HA THR 8 HA THR 8 9.750 2.247 0.494
49 HB THR 8 HB THR 8 8.928 3.284 2.744
50 HG1 THR 8 HG1 THR 8 10.888 4.993 2.990
51 HG21 THR 8 HG21 THR 8 11.077 2.774 3.737
52 HG22 THR 8 HG22 THR 8 11.879 2.968 2.178
53 HG23 THR 8 HG23 THR 8 10.754 1.632 2.429
54 H CYS 9 H CYS 9 7.499 2.286 1.777
55 HA CYS 9 HA CYS 9 5.653 3.431 -0.175
56 HB2 CYS 9 HB2 CYS 9 5.406 1.052 0.213
57 HB3 CYS 9 HB3 CYS 9 5.297 1.305 1.953
58 H GLN 10 H GLN 10 5.459 2.791 3.306
59 HA GLN 10 HA GLN 10 3.732 5.061 3.682
60 HB2 GLN 10 HB2 GLN 10 4.156 4.409 6.177
61 HB3 GLN 10 HB3 GLN 10 3.193 3.350 5.158
62 HG2 GLN 10 HG2 GLN 10 5.303 2.061 4.720
63 HG3 GLN 10 HG3 GLN 10 6.048 3.003 6.005
64 HE21 GLN 10 HE21 GLN 10 5.541 0.143 5.787
65 HE22 GLN 10 HE22 GLN 10 4.589 -0.278 7.164
66 H ASP 11 H ASP 11 4.602 6.936 3.456
67 HA ASP 11 HA ASP 11 6.297 8.336 4.982
68 HB2 ASP 11 HB2 ASP 11 8.072 6.630 4.537
69 HB3 ASP 11 HB3 ASP 11 7.972 7.002 2.822
70 H LYS 12 H LYS 12 6.078 7.463 1.523
71 HA LYS 12 HA LYS 12 5.847 10.295 0.834
72 HB2 LYS 12 HB2 LYS 12 5.921 7.862 -0.960
73 HB3 LYS 12 HB3 LYS 12 6.001 9.530 -1.491
74 HG2 LYS 12 HG2 LYS 12 8.163 8.633 -1.617
75 HG3 LYS 12 HG3 LYS 12 8.163 9.727 -0.244
76 HD2 LYS 12 HD2 LYS 12 8.010 7.857 1.262
77 HD3 LYS 12 HD3 LYS 12 7.855 6.732 -0.086
78 HE2 LYS 12 HE2 LYS 12 10.118 6.707 0.798
79 HE3 LYS 12 HE3 LYS 12 10.092 7.348 -0.844
80 HZ1 LYS 12 HZ1 LYS 12 10.182 9.001 1.625
81 HZ2 LYS 12 HZ2 LYS 12 10.264 9.571 0.030
82 HZ3 LYS 12 HZ3 LYS 12 11.525 8.633 0.655
83 H GLY 13 H GLY 13 3.995 7.315 0.824
84 HA2 GLY 13 HA2 GLY 13 1.687 8.834 -0.215
85 HA3 GLY 13 HA3 GLY 13 2.040 7.206 -0.750
86 H GLY 14 H GLY 14 1.506 5.500 0.485
87 HA2 GLY 14 HA2 GLY 14 0.014 6.070 2.947
88 HA3 GLY 14 HA3 GLY 14 -0.672 5.041 1.698
89 H HIS 15 H HIS 15 -0.713 3.541 3.608
90 HA HIS 15 HA HIS 15 1.865 2.349 4.235
91 HB2 HIS 15 HB2 HIS 15 0.751 1.186 5.968
92 HB3 HIS 15 HB3 HIS 15 0.034 2.787 5.962
93 HD1 HIS 15 HD1 HIS 15 -1.030 -0.397 6.577
94 HD2 HIS 15 HD2 HIS 15 -2.360 2.500 3.898
95 HE1 HIS 15 HE1 HIS 15 -3.385 -1.047 6.002
96 HE2 HIS 15 HE2 HIS 15 -4.125 0.640 4.289
97 H CYS 16 H CYS 16 2.029 -0.050 4.170
98 HA CYS 16 HA CYS 16 1.347 -0.953 1.530
99 HB2 CYS 16 HB2 CYS 16 2.756 -2.347 3.815
100 HB3 CYS 16 HB3 CYS 16 2.593 -2.995 2.186
101 H VAL 17 H VAL 17 -0.242 -2.283 0.942
102 HA VAL 17 HA VAL 17 -1.796 -3.559 3.093
103 HB VAL 17 HB VAL 17 -3.820 -3.268 1.856
104 HG11 VAL 17 HG11 VAL 17 -2.253 -0.705 1.987
105 HG12 VAL 17 HG12 VAL 17 -3.237 -1.418 3.266
106 HG13 VAL 17 HG13 VAL 17 -4.002 -0.807 1.798
107 HG21 VAL 17 HG21 VAL 17 -3.928 -2.083 -0.275
108 HG22 VAL 17 HG22 VAL 17 -2.936 -3.536 -0.401
109 HG23 VAL 17 HG23 VAL 17 -2.169 -1.952 -0.296
110 H SER 18 H SER 18 -2.485 -5.563 2.815
111 HA SER 18 HA SER 18 -1.084 -7.213 0.966
112 HB2 SER 18 HB2 SER 18 -2.232 -9.024 2.093
113 HB3 SER 18 HB3 SER 18 -1.631 -7.890 3.284
114 HG SER 18 HG SER 18 -4.004 -8.744 3.256
115 HA PRO 19 HA PRO 19 -3.819 -7.275 -2.465
116 HB2 PRO 19 HB2 PRO 19 -3.804 -9.931 -3.132
117 HB3 PRO 19 HB3 PRO 19 -2.492 -8.805 -3.496
118 HG2 PRO 19 HG2 PRO 19 -2.761 -10.715 -1.202
119 HG3 PRO 19 HG3 PRO 19 -1.356 -10.414 -2.246
120 HD2 PRO 19 HD2 PRO 19 -1.495 -9.315 0.172
121 HD3 PRO 19 HD3 PRO 19 -0.870 -8.385 -1.206
122 H LYS 20 H LYS 20 -5.132 -7.627 0.185
123 HA LYS 20 HA LYS 20 -7.628 -8.809 -0.788
124 HB2 LYS 20 HB2 LYS 20 -6.338 -10.486 0.601
125 HB3 LYS 20 HB3 LYS 20 -6.501 -9.388 1.961
126 HG2 LYS 20 HG2 LYS 20 -8.145 -11.134 2.119
127 HG3 LYS 20 HG3 LYS 20 -8.950 -9.597 1.804
128 HD2 LYS 20 HD2 LYS 20 -9.194 -10.171 -0.540
129 HD3 LYS 20 HD3 LYS 20 -8.299 -11.671 -0.290
130 HE2 LYS 20 HE2 LYS 20 -10.908 -10.972 1.051
131 HE3 LYS 20 HE3 LYS 20 -10.755 -11.990 -0.379
132 HZ1 LYS 20 HZ1 LYS 20 -10.943 -13.304 1.635
133 HZ2 LYS 20 HZ2 LYS 20 -9.569 -12.563 2.284
134 HZ3 LYS 20 HZ3 LYS 20 -9.432 -13.545 0.912
135 H ILE 21 H ILE 21 -6.218 -6.133 0.062
136 HA ILE 21 HA ILE 21 -8.159 -5.229 2.082
137 HB ILE 21 HB ILE 21 -5.561 -3.938 1.232
138 HG12 ILE 21 HG12 ILE 21 -5.154 -6.056 2.376
139 HG13 ILE 21 HG13 ILE 21 -4.695 -4.707 3.406
140 HG21 ILE 21 HG21 ILE 21 -5.838 -2.537 3.219
141 HG22 ILE 21 HG22 ILE 21 -7.397 -3.297 3.538
142 HG23 ILE 21 HG23 ILE 21 -7.172 -2.321 2.086
143 HD11 ILE 21 HD11 ILE 21 -6.797 -4.953 4.638
144 HD12 ILE 21 HD12 ILE 21 -5.814 -6.416 4.690
145 HD13 ILE 21 HD13 ILE 21 -7.218 -6.332 3.624
146 H ARG 22 H ARG 22 -9.397 -3.409 1.766
147 HA ARG 22 HA ARG 22 -9.940 -2.652 -0.952
148 HB2 ARG 22 HB2 ARG 22 -11.644 -3.012 0.907
149 HB3 ARG 22 HB3 ARG 22 -11.101 -1.482 1.576
150 HG2 ARG 22 HG2 ARG 22 -12.112 -1.701 -1.230
151 HG3 ARG 22 HG3 ARG 22 -13.200 -1.486 0.138
152 HD2 ARG 22 HD2 ARG 22 -11.004 0.365 -0.773
153 HD3 ARG 22 HD3 ARG 22 -12.740 0.668 -0.805
154 HE ARG 22 HE ARG 22 -11.000 0.683 1.555
155 HH11 ARG 22 HH11 ARG 22 -14.188 1.123 0.174
156 HH12 ARG 22 HH12 ARG 22 -14.791 2.007 1.540
157 HH21 ARG 22 HH21 ARG 22 -11.779 1.852 3.339
158 HH22 ARG 22 HH22 ARG 22 -13.431 2.407 3.342
159 H CYS 23 H CYS 23 -8.847 -1.118 -1.966
160 HA CYS 23 HA CYS 23 -7.357 0.889 -0.468
161 HB2 CYS 23 HB2 CYS 23 -7.404 0.250 -3.422
162 HB3 CYS 23 HB3 CYS 23 -6.292 1.353 -2.627
163 H LEU 24 H LEU 24 -7.868 3.024 -0.432
164 HA LEU 24 HA LEU 24 -10.186 3.962 -1.900
165 HB2 LEU 24 HB2 LEU 24 -8.359 5.158 0.142
166 HB3 LEU 24 HB3 LEU 24 -9.301 6.226 -0.875
167 HG LEU 24 HG LEU 24 -10.427 5.898 1.231
168 HD11 LEU 24 HD11 LEU 24 -11.799 6.131 -0.788
169 HD12 LEU 24 HD12 LEU 24 -12.590 5.159 0.451
170 HD13 LEU 24 HD13 LEU 24 -11.851 4.375 -0.943
171 HD21 LEU 24 HD21 LEU 24 -10.363 2.962 0.572
172 HD22 LEU 24 HD22 LEU 24 -11.241 3.694 1.916
173 HD23 LEU 24 HD23 LEU 24 -9.480 3.770 1.868
174 H GLU 25 H GLU 25 -6.731 4.739 -1.726
175 HA GLU 25 HA GLU 25 -6.828 5.355 -4.587
176 HB2 GLU 25 HB2 GLU 25 -6.949 7.486 -3.318
177 HB3 GLU 25 HB3 GLU 25 -5.435 7.077 -2.527
178 HG2 GLU 25 HG2 GLU 25 -5.085 8.653 -4.334
179 HG3 GLU 25 HG3 GLU 25 -4.288 7.116 -4.673
180 H GLU 26 H GLU 26 -5.396 4.090 -5.577
181 HA GLU 26 HA GLU 26 -3.331 2.766 -4.082
182 HB2 GLU 26 HB2 GLU 26 -4.008 2.736 -7.023
183 HB3 GLU 26 HB3 GLU 26 -2.734 1.767 -6.296
184 HG2 GLU 26 HG2 GLU 26 -4.388 0.642 -4.891
185 HG3 GLU 26 HG3 GLU 26 -5.664 1.611 -5.626
186 H GLN 27 H GLN 27 -1.133 2.974 -4.322
187 HA GLN 27 HA GLN 27 -0.074 5.209 -5.847
188 HB2 GLN 27 HB2 GLN 27 -0.131 6.579 -4.063
189 HB3 GLN 27 HB3 GLN 27 -0.682 5.286 -3.019
190 HG2 GLN 27 HG2 GLN 27 1.222 5.916 -1.962
191 HG3 GLN 27 HG3 GLN 27 1.842 4.634 -2.991
192 HE21 GLN 27 HE21 GLN 27 3.263 6.840 -1.813
193 HE22 GLN 27 HE22 GLN 27 3.963 7.736 -3.112
194 H LEU 28 H LEU 28 2.369 5.152 -5.774
195 HA LEU 28 HA LEU 28 3.174 2.342 -5.682
196 HB2 LEU 28 HB2 LEU 28 5.104 3.121 -7.130
197 HB3 LEU 28 HB3 LEU 28 3.516 3.052 -7.856
198 HG LEU 28 HG LEU 28 3.365 5.559 -7.463
199 HD11 LEU 28 HD11 LEU 28 5.463 6.768 -7.235
200 HD12 LEU 28 HD12 LEU 28 6.336 5.247 -7.047
201 HD13 LEU 28 HD13 LEU 28 5.176 5.755 -5.820
202 HD21 LEU 28 HD21 LEU 28 3.733 4.595 -9.633
203 HD22 LEU 28 HD22 LEU 28 5.452 4.408 -9.291
204 HD23 LEU 28 HD23 LEU 28 4.755 6.022 -9.447
205 H GLY 29 H GLY 29 5.032 1.679 -4.757
206 HA2 GLY 29 HA2 GLY 29 6.827 3.341 -3.343
207 HA3 GLY 29 HA3 GLY 29 5.572 2.761 -2.252
208 H LEU 30 H LEU 30 7.655 1.809 -1.301
209 HA LEU 30 HA LEU 30 8.130 -0.803 -2.536
210 HB2 LEU 30 HB2 LEU 30 10.201 0.176 -2.117
211 HB3 LEU 30 HB3 LEU 30 9.689 0.824 -0.572
212 HG LEU 30 HG LEU 30 9.421 -1.868 -0.181
213 HD11 LEU 30 HD11 LEU 30 11.494 -2.895 -0.941
214 HD12 LEU 30 HD12 LEU 30 11.906 -1.424 -1.825
215 HD13 LEU 30 HD13 LEU 30 10.500 -2.376 -2.303
216 HD21 LEU 30 HD21 LEU 30 11.767 -0.075 0.382
217 HD22 LEU 30 HD22 LEU 30 11.431 -1.607 1.195
218 HD23 LEU 30 HD23 LEU 30 10.314 -0.249 1.365
219 H CYS 31 H CYS 31 7.090 -2.440 -1.759
220 HA CYS 31 HA CYS 31 6.659 -2.591 1.145
221 HB2 CYS 31 HB2 CYS 31 4.815 -3.668 -0.998
222 HB3 CYS 31 HB3 CYS 31 4.601 -3.855 0.737
223 HA PRO 32 HA PRO 32 9.130 -6.118 -0.063
224 HB2 PRO 32 HB2 PRO 32 10.386 -6.503 2.243
225 HB3 PRO 32 HB3 PRO 32 10.703 -5.040 1.301
226 HG2 PRO 32 HG2 PRO 32 9.005 -5.402 3.741
227 HG3 PRO 32 HG3 PRO 32 10.080 -4.050 3.315
228 HD2 PRO 32 HD2 PRO 32 7.299 -4.135 2.937
229 HD3 PRO 32 HD3 PRO 32 8.409 -2.985 2.174
230 H LEU 33 H LEU 33 7.420 -7.629 -0.347
231 HA LEU 33 HA LEU 33 7.146 -9.618 1.673
232 HB2 LEU 33 HB2 LEU 33 4.868 -7.710 1.201
233 HB3 LEU 33 HB3 LEU 33 4.563 -9.361 1.701
234 HG LEU 33 HG LEU 33 6.252 -7.400 3.254
235 HD11 LEU 33 HD11 LEU 33 4.384 -7.250 4.801
236 HD12 LEU 33 HD12 LEU 33 3.411 -8.261 3.735
237 HD13 LEU 33 HD13 LEU 33 3.935 -6.664 3.200
238 HD21 LEU 33 HD21 LEU 33 6.878 -9.663 3.696
239 HD22 LEU 33 HD22 LEU 33 5.190 -10.134 3.903
240 HD23 LEU 33 HD23 LEU 33 5.955 -9.048 5.067
241 H LYS 34 H LYS 34 4.400 -8.965 -0.324
242 HA LYS 34 HA LYS 34 5.262 -11.089 -2.161
243 HB2 LYS 34 HB2 LYS 34 2.468 -10.479 -1.188
244 HB3 LYS 34 HB3 LYS 34 2.921 -11.775 -2.289
245 HG2 LYS 34 HG2 LYS 34 3.991 -11.540 0.505
246 HG3 LYS 34 HG3 LYS 34 2.542 -12.437 0.095
247 HD2 LYS 34 HD2 LYS 34 5.143 -12.993 -1.285
248 HD3 LYS 34 HD3 LYS 34 4.779 -13.710 0.281
249 HE2 LYS 34 HE2 LYS 34 4.174 -15.293 -1.397
250 HE3 LYS 34 HE3 LYS 34 2.687 -14.644 -0.715
251 HZ1 LYS 34 HZ1 LYS 34 2.348 -13.316 -2.626
252 HZ2 LYS 34 HZ2 LYS 34 2.722 -14.865 -3.182
253 HZ3 LYS 34 HZ3 LYS 34 3.892 -13.646 -3.235
254 H ARG 35 H ARG 35 2.251 -9.491 -2.536
255 HA ARG 35 HA ARG 35 3.271 -7.931 -4.777
256 HB2 ARG 35 HB2 ARG 35 1.168 -8.313 -5.938
257 HB3 ARG 35 HB3 ARG 35 1.994 -9.823 -5.588
258 HG2 ARG 35 HG2 ARG 35 0.512 -10.277 -3.768
259 HG3 ARG 35 HG3 ARG 35 -0.258 -8.698 -3.957
260 HD2 ARG 35 HD2 ARG 35 -0.190 -10.842 -6.059
261 HD3 ARG 35 HD3 ARG 35 -1.551 -10.549 -4.976
262 HE ARG 35 HE ARG 35 -1.021 -8.134 -6.205
263 HH11 ARG 35 HH11 ARG 35 -1.931 -11.359 -7.217
264 HH12 ARG 35 HH12 ARG 35 -2.772 -10.819 -8.634
265 HH21 ARG 35 HH21 ARG 35 -2.127 -7.418 -8.073
266 HH22 ARG 35 HH22 ARG 35 -2.881 -8.576 -9.124
267 H TRP 36 H TRP 36 3.152 -6.954 -2.193
268 HA TRP 36 HA TRP 36 0.582 -5.968 -1.484
269 HB2 TRP 36 HB2 TRP 36 3.357 -5.660 -0.396
270 HB3 TRP 36 HB3 TRP 36 2.049 -4.670 0.235
271 HD1 TRP 36 HD1 TRP 36 2.164 -8.496 -0.544
272 HE1 TRP 36 HE1 TRP 36 1.331 -9.732 1.535
273 HE3 TRP 36 HE3 TRP 36 1.457 -4.482 2.506
274 HZ2 TRP 36 HZ2 TRP 36 0.488 -9.068 4.163
275 HZ3 TRP 36 HZ3 TRP 36 0.632 -4.863 4.763
276 HH2 TRP 36 HH2 TRP 36 0.167 -7.099 5.585
277 H THR 37 H THR 37 -0.286 -4.019 -1.657
278 HA THR 37 HA THR 37 0.889 -2.246 -3.656
279 HB THR 37 HB THR 37 -1.910 -2.551 -2.559
280 HG1 THR 37 HG1 THR 37 -0.526 -3.402 -4.820
281 HG21 THR 37 HG21 THR 37 -0.896 -0.548 -4.580
282 HG22 THR 37 HG22 THR 37 -1.633 -0.200 -3.010
283 HG23 THR 37 HG23 THR 37 -2.600 -0.916 -4.303
284 H CYS 38 H CYS 38 1.220 -0.031 -3.304
285 HA CYS 38 HA CYS 38 1.327 0.788 -0.518
286 HB2 CYS 38 HB2 CYS 38 3.131 1.309 -2.245
287 HB3 CYS 38 HB3 CYS 38 1.992 2.451 -2.947
288 H CYS 39 H CYS 39 -0.843 0.987 0.061
289 HA CYS 39 HA CYS 39 -2.557 2.490 -1.727
290 HB2 CYS 39 HB2 CYS 39 -2.995 0.621 0.531
291 HB3 CYS 39 HB3 CYS 39 -4.274 1.743 0.099
292 H LYS 40 H LYS 40 -2.785 4.530 -1.518
293 HA LYS 40 HA LYS 40 -2.177 6.029 0.815
294 HB2 LYS 40 HB2 LYS 40 -2.035 6.964 -1.461
295 HB3 LYS 40 HB3 LYS 40 -3.767 6.765 -1.651
296 HG2 LYS 40 HG2 LYS 40 -3.290 9.064 -1.198
297 HG3 LYS 40 HG3 LYS 40 -4.114 8.369 0.200
298 HD2 LYS 40 HD2 LYS 40 -2.079 8.213 1.421
299 HD3 LYS 40 HD3 LYS 40 -1.124 8.608 -0.010
300 HE2 LYS 40 HE2 LYS 40 -1.352 10.497 1.581
301 HE3 LYS 40 HE3 LYS 40 -1.970 10.852 -0.029
302 HZ1 LYS 40 HZ1 LYS 40 -4.192 10.558 0.742
303 HZ2 LYS 40 HZ2 LYS 40 -3.415 11.629 1.794
304 HZ3 LYS 40 HZ3 LYS 40 -3.670 10.016 2.261
305 H GLU 41 H GLU 41 -3.384 4.979 2.417
306 HA GLU 41 HA GLU 41 -5.048 4.910 3.936
307 HB2 GLU 41 HB2 GLU 41 -6.090 6.992 2.112
308 HB3 GLU 41 HB3 GLU 41 -7.235 6.257 3.223
309 HG2 GLU 41 HG2 GLU 41 -6.361 8.254 4.207
310 HG3 GLU 41 HG3 GLU 41 -5.739 6.865 5.094
311 H ILE 42 H ILE 42 -6.847 3.714 4.416
312 HA ILE 42 HA ILE 42 -8.152 2.267 2.234
313 HB ILE 42 HB ILE 42 -7.894 0.133 3.289
314 HG12 ILE 42 HG12 ILE 42 -7.900 0.822 5.648
315 HG13 ILE 42 HG13 ILE 42 -6.555 -0.247 5.297
316 HG21 ILE 42 HG21 ILE 42 -6.146 0.736 1.770
317 HG22 ILE 42 HG22 ILE 42 -5.466 -0.206 3.097
318 HG23 ILE 42 HG23 ILE 42 -5.250 1.545 3.056
319 HD11 ILE 42 HD11 ILE 42 -5.800 1.461 6.766
320 HD12 ILE 42 HD12 ILE 42 -6.456 2.723 5.728
321 HD13 ILE 42 HD13 ILE 42 -5.083 1.761 5.184
Start of MODEL 3
1 H1 ASP 1 H1 ASP 1 19.522 -5.573 -5.645
2 H2 ASP 1 H2 ASP 1 17.975 -4.910 -5.774
3 H3 ASP 1 H3 ASP 1 18.298 -6.069 -4.587
4 HA ASP 1 HA ASP 1 19.419 -3.341 -4.734
5 HB2 ASP 1 HB2 ASP 1 18.152 -2.949 -2.672
6 HB3 ASP 1 HB3 ASP 1 17.075 -3.419 -3.983
7 H THR 2 H THR 2 21.254 -3.013 -3.679
8 HA THR 2 HA THR 2 22.530 -5.183 -2.250
9 HB THR 2 HB THR 2 23.540 -2.347 -2.480
10 HG1 THR 2 HG1 THR 2 23.616 -4.459 -4.392
11 HG21 THR 2 HG21 THR 2 25.740 -3.420 -2.395
12 HG22 THR 2 HG22 THR 2 24.969 -5.002 -2.293
13 HG23 THR 2 HG23 THR 2 24.777 -3.844 -0.979
14 H THR 3 H THR 3 20.566 -2.522 -1.592
15 HA THR 3 HA THR 3 20.308 -3.139 1.165
16 HB THR 3 HB THR 3 22.425 -1.829 1.269
17 HG1 THR 3 HG1 THR 3 20.743 0.007 2.417
18 HG21 THR 3 HG21 THR 3 22.077 -0.391 -0.676
19 HG22 THR 3 HG22 THR 3 22.392 0.571 0.768
20 HG23 THR 3 HG23 THR 3 20.748 0.420 0.150
21 H SER 4 H SER 4 18.538 -1.844 2.104
22 HA SER 4 HA SER 4 16.619 -1.124 0.130
23 HB2 SER 4 HB2 SER 4 16.455 -0.639 3.110
24 HB3 SER 4 HB3 SER 4 15.113 -0.722 1.964
25 HG SER 4 HG SER 4 15.168 -2.706 2.846
26 H ASP 5 H ASP 5 17.264 0.594 -1.024
27 HA ASP 5 HA ASP 5 17.119 3.176 0.329
28 HB2 ASP 5 HB2 ASP 5 19.536 2.678 0.111
29 HB3 ASP 5 HB3 ASP 5 19.323 2.428 -1.618
30 H PHE 6 H PHE 6 15.221 3.726 -0.580
31 HA PHE 6 HA PHE 6 14.956 4.336 -3.309
32 HB2 PHE 6 HB2 PHE 6 13.119 2.503 -3.677
33 HB3 PHE 6 HB3 PHE 6 14.810 2.104 -3.944
34 HD1 PHE 6 HD1 PHE 6 15.086 -0.114 -3.449
35 HD2 PHE 6 HD2 PHE 6 12.795 2.297 -0.792
36 HE1 PHE 6 HE1 PHE 6 14.902 -2.010 -1.894
37 HE2 PHE 6 HE2 PHE 6 12.608 0.402 0.769
38 HZ PHE 6 HZ PHE 6 13.661 -1.756 0.217
39 H HIS 7 H HIS 7 12.401 4.386 -3.797
40 HA HIS 7 HA HIS 7 11.338 6.055 -1.689
41 HB2 HIS 7 HB2 HIS 7 10.374 5.388 -4.467
42 HB3 HIS 7 HB3 HIS 7 9.419 6.337 -3.336
43 HD1 HIS 7 HD1 HIS 7 11.865 6.720 -5.943
44 HD2 HIS 7 HD2 HIS 7 10.912 8.737 -2.435
45 HE1 HIS 7 HE1 HIS 7 12.918 8.992 -6.164
46 HE2 HIS 7 HE2 HIS 7 12.424 10.156 -3.984
47 H THR 8 H THR 8 10.686 4.875 -0.023
48 HA THR 8 HA THR 8 9.439 2.354 -0.208
49 HB THR 8 HB THR 8 8.822 2.933 2.265
50 HG1 THR 8 HG1 THR 8 9.930 4.679 3.095
51 HG21 THR 8 HG21 THR 8 10.607 1.394 1.633
52 HG22 THR 8 HG22 THR 8 11.138 2.430 2.959
53 HG23 THR 8 HG23 THR 8 11.689 2.751 1.316
54 H CYS 9 H CYS 9 7.306 2.346 1.474
55 HA CYS 9 HA CYS 9 5.314 3.496 -0.327
56 HB2 CYS 9 HB2 CYS 9 5.123 1.349 1.810
57 HB3 CYS 9 HB3 CYS 9 3.733 1.962 0.913
58 H GLN 10 H GLN 10 5.382 2.881 3.178
59 HA GLN 10 HA GLN 10 3.651 5.145 3.595
60 HB2 GLN 10 HB2 GLN 10 4.073 4.539 6.065
61 HB3 GLN 10 HB3 GLN 10 3.174 3.402 5.075
62 HG2 GLN 10 HG2 GLN 10 5.401 2.224 4.708
63 HG3 GLN 10 HG3 GLN 10 6.000 3.204 6.044
64 HE21 GLN 10 HE21 GLN 10 5.649 0.316 5.815
65 HE22 GLN 10 HE22 GLN 10 4.591 -0.145 7.097
66 H ASP 11 H ASP 11 4.475 7.010 3.328
67 HA ASP 11 HA ASP 11 6.201 8.447 4.790
68 HB2 ASP 11 HB2 ASP 11 7.994 6.778 4.237
69 HB3 ASP 11 HB3 ASP 11 7.796 7.177 2.539
70 H LYS 12 H LYS 12 5.947 7.568 1.347
71 HA LYS 12 HA LYS 12 5.650 10.376 0.614
72 HB2 LYS 12 HB2 LYS 12 5.736 7.883 -1.091
73 HB3 LYS 12 HB3 LYS 12 5.711 9.523 -1.702
74 HG2 LYS 12 HG2 LYS 12 7.905 8.672 -1.872
75 HG3 LYS 12 HG3 LYS 12 7.913 9.900 -0.615
76 HD2 LYS 12 HD2 LYS 12 7.841 8.129 1.062
77 HD3 LYS 12 HD3 LYS 12 7.836 6.911 -0.211
78 HE2 LYS 12 HE2 LYS 12 10.068 7.163 0.704
79 HE3 LYS 12 HE3 LYS 12 10.027 7.728 -0.965
80 HZ1 LYS 12 HZ1 LYS 12 9.857 9.489 1.423
81 HZ2 LYS 12 HZ2 LYS 12 9.950 9.989 -0.195
82 HZ3 LYS 12 HZ3 LYS 12 11.270 9.215 0.524
83 H GLY 13 H GLY 13 3.826 7.388 0.716
84 HA2 GLY 13 HA2 GLY 13 1.456 8.869 -0.225
85 HA3 GLY 13 HA3 GLY 13 1.791 7.230 -0.744
86 H GLY 14 H GLY 14 1.633 5.558 0.725
87 HA2 GLY 14 HA2 GLY 14 0.365 6.044 3.279
88 HA3 GLY 14 HA3 GLY 14 -0.629 5.242 2.072
89 H HIS 15 H HIS 15 -0.643 3.480 3.686
90 HA HIS 15 HA HIS 15 1.925 2.215 4.233
91 HB2 HIS 15 HB2 HIS 15 0.823 1.050 5.966
92 HB3 HIS 15 HB3 HIS 15 0.131 2.663 5.996
93 HD1 HIS 15 HD1 HIS 15 -0.937 -0.596 6.467
94 HD2 HIS 15 HD2 HIS 15 -2.354 2.493 4.069
95 HE1 HIS 15 HE1 HIS 15 -3.332 -1.167 5.976
96 HE2 HIS 15 HE2 HIS 15 -4.205 0.777 4.642
97 H CYS 16 H CYS 16 2.013 -0.174 4.169
98 HA CYS 16 HA CYS 16 1.304 -1.052 1.528
99 HB2 CYS 16 HB2 CYS 16 2.669 -2.509 3.800
100 HB3 CYS 16 HB3 CYS 16 2.575 -3.068 2.130
101 H VAL 17 H VAL 17 -0.338 -2.335 0.957
102 HA VAL 17 HA VAL 17 -1.857 -3.634 3.117
103 HB VAL 17 HB VAL 17 -3.908 -3.368 1.797
104 HG11 VAL 17 HG11 VAL 17 -4.236 -0.970 2.149
105 HG12 VAL 17 HG12 VAL 17 -2.494 -0.764 2.342
106 HG13 VAL 17 HG13 VAL 17 -3.403 -1.727 3.507
107 HG21 VAL 17 HG21 VAL 17 -2.220 -1.688 -0.054
108 HG22 VAL 17 HG22 VAL 17 -3.976 -1.839 -0.123
109 HG23 VAL 17 HG23 VAL 17 -2.955 -3.243 -0.437
110 H SER 18 H SER 18 -2.403 -5.648 2.893
111 HA SER 18 HA SER 18 -1.083 -7.295 1.038
112 HB2 SER 18 HB2 SER 18 -2.368 -9.086 2.087
113 HB3 SER 18 HB3 SER 18 -1.728 -8.003 3.305
114 HG SER 18 HG SER 18 -3.746 -7.054 3.509
115 HA PRO 19 HA PRO 19 -3.520 -7.153 -2.552
116 HB2 PRO 19 HB2 PRO 19 -3.608 -9.758 -3.348
117 HB3 PRO 19 HB3 PRO 19 -2.188 -8.719 -3.508
118 HG2 PRO 19 HG2 PRO 19 -2.849 -10.691 -1.347
119 HG3 PRO 19 HG3 PRO 19 -1.326 -10.482 -2.234
120 HD2 PRO 19 HD2 PRO 19 -1.601 -9.458 0.196
121 HD3 PRO 19 HD3 PRO 19 -0.782 -8.533 -1.084
122 H LYS 20 H LYS 20 -5.155 -7.595 -0.051
123 HA LYS 20 HA LYS 20 -7.567 -8.458 -1.450
124 HB2 LYS 20 HB2 LYS 20 -6.530 -10.416 -0.168
125 HB3 LYS 20 HB3 LYS 20 -6.940 -9.538 1.295
126 HG2 LYS 20 HG2 LYS 20 -8.614 -11.213 0.805
127 HG3 LYS 20 HG3 LYS 20 -9.304 -9.598 0.674
128 HD2 LYS 20 HD2 LYS 20 -10.028 -11.116 -1.142
129 HD3 LYS 20 HD3 LYS 20 -9.179 -9.691 -1.735
130 HE2 LYS 20 HE2 LYS 20 -8.479 -11.731 -2.903
131 HE3 LYS 20 HE3 LYS 20 -7.149 -10.984 -2.025
132 HZ1 LYS 20 HZ1 LYS 20 -7.078 -13.327 -1.678
133 HZ2 LYS 20 HZ2 LYS 20 -8.701 -13.379 -1.211
134 HZ3 LYS 20 HZ3 LYS 20 -7.564 -12.614 -0.224
135 H ILE 21 H ILE 21 -6.199 -6.022 -0.139
136 HA ILE 21 HA ILE 21 -8.258 -5.312 1.829
137 HB ILE 21 HB ILE 21 -5.670 -3.898 1.162
138 HG12 ILE 21 HG12 ILE 21 -5.252 -6.062 2.206
139 HG13 ILE 21 HG13 ILE 21 -4.883 -4.764 3.334
140 HG21 ILE 21 HG21 ILE 21 -7.617 -3.415 3.413
141 HG22 ILE 21 HG22 ILE 21 -7.349 -2.362 2.025
142 HG23 ILE 21 HG23 ILE 21 -6.063 -2.610 3.206
143 HD11 ILE 21 HD11 ILE 21 -7.373 -6.452 3.333
144 HD12 ILE 21 HD12 ILE 21 -7.020 -5.141 4.457
145 HD13 ILE 21 HD13 ILE 21 -6.014 -6.589 4.447
146 H ARG 22 H ARG 22 -9.657 -3.644 1.530
147 HA ARG 22 HA ARG 22 -10.108 -2.652 -1.094
148 HB2 ARG 22 HB2 ARG 22 -11.872 -3.039 0.653
149 HB3 ARG 22 HB3 ARG 22 -11.248 -1.649 1.524
150 HG2 ARG 22 HG2 ARG 22 -12.052 -1.313 -1.314
151 HG3 ARG 22 HG3 ARG 22 -13.304 -1.440 -0.081
152 HD2 ARG 22 HD2 ARG 22 -11.027 0.537 -0.025
153 HD3 ARG 22 HD3 ARG 22 -12.649 0.898 -0.607
154 HE ARG 22 HE ARG 22 -12.104 0.055 2.169
155 HH11 ARG 22 HH11 ARG 22 -13.655 2.196 -0.138
156 HH12 ARG 22 HH12 ARG 22 -14.544 3.056 1.074
157 HH21 ARG 22 HH21 ARG 22 -13.268 1.201 3.760
158 HH22 ARG 22 HH22 ARG 22 -14.335 2.484 3.283
159 H CYS 23 H CYS 23 -8.879 -1.171 -2.021
160 HA CYS 23 HA CYS 23 -7.414 0.727 -0.338
161 HB2 CYS 23 HB2 CYS 23 -6.234 -0.780 -2.024
162 HB3 CYS 23 HB3 CYS 23 -6.992 0.197 -3.278
163 H LEU 24 H LEU 24 -7.769 2.874 -0.430
164 HA LEU 24 HA LEU 24 -9.981 3.835 -2.023
165 HB2 LEU 24 HB2 LEU 24 -8.306 4.975 0.166
166 HB3 LEU 24 HB3 LEU 24 -9.163 6.079 -0.890
167 HG LEU 24 HG LEU 24 -10.466 5.699 1.101
168 HD11 LEU 24 HD11 LEU 24 -11.699 4.222 -1.214
169 HD12 LEU 24 HD12 LEU 24 -11.661 5.974 -1.023
170 HD13 LEU 24 HD13 LEU 24 -12.555 4.981 0.127
171 HD21 LEU 24 HD21 LEU 24 -11.362 3.450 1.621
172 HD22 LEU 24 HD22 LEU 24 -9.619 3.577 1.825
173 HD23 LEU 24 HD23 LEU 24 -10.281 2.776 0.402
174 H GLU 25 H GLU 25 -6.533 4.747 -1.664
175 HA GLU 25 HA GLU 25 -6.576 5.311 -4.548
176 HB2 GLU 25 HB2 GLU 25 -6.711 7.447 -3.359
177 HB3 GLU 25 HB3 GLU 25 -5.278 7.037 -2.434
178 HG2 GLU 25 HG2 GLU 25 -3.921 7.103 -4.422
179 HG3 GLU 25 HG3 GLU 25 -5.349 7.366 -5.424
180 H GLU 26 H GLU 26 -5.231 3.924 -5.474
181 HA GLU 26 HA GLU 26 -3.217 2.539 -4.004
182 HB2 GLU 26 HB2 GLU 26 -3.744 2.642 -6.971
183 HB3 GLU 26 HB3 GLU 26 -2.622 1.542 -6.188
184 HG2 GLU 26 HG2 GLU 26 -4.456 0.520 -4.960
185 HG3 GLU 26 HG3 GLU 26 -5.592 1.640 -5.712
186 H GLN 27 H GLN 27 -1.053 2.765 -4.026
187 HA GLN 27 HA GLN 27 0.084 5.075 -5.438
188 HB2 GLN 27 HB2 GLN 27 -0.553 5.111 -2.773
189 HB3 GLN 27 HB3 GLN 27 1.111 4.553 -2.723
190 HG2 GLN 27 HG2 GLN 27 0.276 7.023 -4.207
191 HG3 GLN 27 HG3 GLN 27 0.731 7.037 -2.506
192 HE21 GLN 27 HE21 GLN 27 2.869 6.650 -1.935
193 HE22 GLN 27 HE22 GLN 27 4.157 6.744 -3.081
194 H LEU 28 H LEU 28 2.384 4.919 -5.751
195 HA LEU 28 HA LEU 28 3.288 2.144 -5.859
196 HB2 LEU 28 HB2 LEU 28 5.085 3.101 -7.368
197 HB3 LEU 28 HB3 LEU 28 3.447 3.109 -7.981
198 HG LEU 28 HG LEU 28 3.406 5.571 -7.120
199 HD11 LEU 28 HD11 LEU 28 6.371 5.108 -7.397
200 HD12 LEU 28 HD12 LEU 28 5.513 5.529 -5.916
201 HD13 LEU 28 HD13 LEU 28 5.586 6.680 -7.251
202 HD21 LEU 28 HD21 LEU 28 3.232 4.923 -9.448
203 HD22 LEU 28 HD22 LEU 28 4.982 4.726 -9.544
204 HD23 LEU 28 HD23 LEU 28 4.286 6.326 -9.279
205 H GLY 29 H GLY 29 5.082 1.415 -4.841
206 HA2 GLY 29 HA2 GLY 29 7.029 3.106 -3.643
207 HA3 GLY 29 HA3 GLY 29 5.861 2.558 -2.447
208 H LEU 30 H LEU 30 7.972 1.629 -1.614
209 HA LEU 30 HA LEU 30 8.429 -1.009 -2.825
210 HB2 LEU 30 HB2 LEU 30 10.173 0.831 -1.255
211 HB3 LEU 30 HB3 LEU 30 10.449 -0.888 -1.123
212 HG LEU 30 HG LEU 30 11.953 0.095 -2.746
213 HD11 LEU 30 HD11 LEU 30 11.209 -2.185 -3.132
214 HD12 LEU 30 HD12 LEU 30 11.488 -1.343 -4.654
215 HD13 LEU 30 HD13 LEU 30 9.842 -1.593 -4.076
216 HD21 LEU 30 HD21 LEU 30 10.531 2.000 -3.369
217 HD22 LEU 30 HD22 LEU 30 9.503 0.905 -4.295
218 HD23 LEU 30 HD23 LEU 30 11.184 1.148 -4.768
219 H CYS 31 H CYS 31 6.815 -2.187 -1.893
220 HA CYS 31 HA CYS 31 6.885 -2.439 1.038
221 HB2 CYS 31 HB2 CYS 31 4.894 -3.559 -0.951
222 HB3 CYS 31 HB3 CYS 31 4.799 -3.713 0.798
223 HA PRO 32 HA PRO 32 9.074 -6.176 -0.072
224 HB2 PRO 32 HB2 PRO 32 10.334 -6.574 2.226
225 HB3 PRO 32 HB3 PRO 32 10.691 -5.130 1.270
226 HG2 PRO 32 HG2 PRO 32 9.048 -5.410 3.747
227 HG3 PRO 32 HG3 PRO 32 10.101 -4.070 3.247
228 HD2 PRO 32 HD2 PRO 32 7.281 -4.245 2.934
229 HD3 PRO 32 HD3 PRO 32 8.351 -3.017 2.231
230 H LEU 33 H LEU 33 7.365 -7.646 -0.347
231 HA LEU 33 HA LEU 33 7.139 -9.640 1.671
232 HB2 LEU 33 HB2 LEU 33 4.810 -7.807 1.200
233 HB3 LEU 33 HB3 LEU 33 4.545 -9.476 1.662
234 HG LEU 33 HG LEU 33 6.117 -7.462 3.266
235 HD11 LEU 33 HD11 LEU 33 4.264 -7.530 4.834
236 HD12 LEU 33 HD12 LEU 33 3.373 -8.593 3.746
237 HD13 LEU 33 HD13 LEU 33 3.743 -6.940 3.257
238 HD21 LEU 33 HD21 LEU 33 5.916 -9.227 5.029
239 HD22 LEU 33 HD22 LEU 33 6.988 -9.610 3.685
240 HD23 LEU 33 HD23 LEU 33 5.374 -10.326 3.758
241 H LYS 34 H LYS 34 4.425 -9.042 -0.415
242 HA LYS 34 HA LYS 34 5.396 -11.126 -2.243
243 HB2 LYS 34 HB2 LYS 34 2.591 -10.751 -1.158
244 HB3 LYS 34 HB3 LYS 34 3.024 -11.879 -2.441
245 HG2 LYS 34 HG2 LYS 34 4.626 -12.934 -0.798
246 HG3 LYS 34 HG3 LYS 34 3.847 -11.959 0.445
247 HD2 LYS 34 HD2 LYS 34 1.711 -12.981 -0.027
248 HD3 LYS 34 HD3 LYS 34 2.403 -13.882 -1.377
249 HE2 LYS 34 HE2 LYS 34 2.183 -15.338 0.536
250 HE3 LYS 34 HE3 LYS 34 3.888 -15.053 0.207
251 HZ1 LYS 34 HZ1 LYS 34 3.900 -13.398 1.982
252 HZ2 LYS 34 HZ2 LYS 34 3.439 -14.918 2.558
253 HZ3 LYS 34 HZ3 LYS 34 2.273 -13.722 2.310
254 H ARG 35 H ARG 35 2.299 -9.639 -2.477
255 HA ARG 35 HA ARG 35 3.155 -8.081 -4.789
256 HB2 ARG 35 HB2 ARG 35 0.940 -8.542 -5.775
257 HB3 ARG 35 HB3 ARG 35 1.927 -9.981 -5.559
258 HG2 ARG 35 HG2 ARG 35 0.688 -10.632 -3.638
259 HG3 ARG 35 HG3 ARG 35 -0.214 -9.115 -3.655
260 HD2 ARG 35 HD2 ARG 35 -0.224 -11.083 -5.918
261 HD3 ARG 35 HD3 ARG 35 -1.419 -11.098 -4.622
262 HE ARG 35 HE ARG 35 -1.274 -8.514 -5.762
263 HH11 ARG 35 HH11 ARG 35 -2.393 -11.752 -6.503
264 HH12 ARG 35 HH12 ARG 35 -3.659 -11.214 -7.556
265 HH21 ARG 35 HH21 ARG 35 -2.946 -7.802 -7.143
266 HH22 ARG 35 HH22 ARG 35 -3.975 -8.959 -7.927
267 H TRP 36 H TRP 36 3.109 -7.105 -2.183
268 HA TRP 36 HA TRP 36 0.534 -6.150 -1.434
269 HB2 TRP 36 HB2 TRP 36 3.310 -5.849 -0.355
270 HB3 TRP 36 HB3 TRP 36 2.018 -4.832 0.266
271 HD1 TRP 36 HD1 TRP 36 2.067 -8.659 -0.485
272 HE1 TRP 36 HE1 TRP 36 1.215 -9.867 1.600
273 HE3 TRP 36 HE3 TRP 36 1.417 -4.614 2.545
274 HZ2 TRP 36 HZ2 TRP 36 0.381 -9.182 4.227
275 HZ3 TRP 36 HZ3 TRP 36 0.592 -4.976 4.807
276 HH2 TRP 36 HH2 TRP 36 0.091 -7.203 5.641
277 H THR 37 H THR 37 -0.418 -4.344 -1.836
278 HA THR 37 HA THR 37 0.797 -2.447 -3.657
279 HB THR 37 HB THR 37 -2.015 -2.738 -2.579
280 HG1 THR 37 HG1 THR 37 -0.682 -3.530 -4.934
281 HG21 THR 37 HG21 THR 37 -0.949 -0.810 -4.645
282 HG22 THR 37 HG22 THR 37 -1.659 -0.402 -3.080
283 HG23 THR 37 HG23 THR 37 -2.658 -1.117 -4.346
284 H CYS 38 H CYS 38 1.179 -0.261 -3.154
285 HA CYS 38 HA CYS 38 1.185 0.415 -0.330
286 HB2 CYS 38 HB2 CYS 38 1.927 2.166 -2.682
287 HB3 CYS 38 HB3 CYS 38 2.392 2.385 -0.997
288 H CYS 39 H CYS 39 -0.632 1.190 0.568
289 HA CYS 39 HA CYS 39 -2.639 2.292 -1.264
290 HB2 CYS 39 HB2 CYS 39 -3.064 0.315 0.391
291 HB3 CYS 39 HB3 CYS 39 -3.224 1.605 1.576
292 H LYS 40 H LYS 40 -2.860 4.359 -1.335
293 HA LYS 40 HA LYS 40 -1.935 6.084 0.779
294 HB2 LYS 40 HB2 LYS 40 -1.853 6.564 -1.740
295 HB3 LYS 40 HB3 LYS 40 -3.573 6.872 -1.627
296 HG2 LYS 40 HG2 LYS 40 -1.646 8.341 0.124
297 HG3 LYS 40 HG3 LYS 40 -1.927 8.849 -1.539
298 HD2 LYS 40 HD2 LYS 40 -4.413 8.838 -0.925
299 HD3 LYS 40 HD3 LYS 40 -3.867 8.763 0.752
300 HE2 LYS 40 HE2 LYS 40 -4.304 11.065 0.057
301 HE3 LYS 40 HE3 LYS 40 -2.601 10.823 0.441
302 HZ1 LYS 40 HZ1 LYS 40 -3.127 12.110 -1.655
303 HZ2 LYS 40 HZ2 LYS 40 -3.621 10.637 -2.336
304 HZ3 LYS 40 HZ3 LYS 40 -2.024 10.839 -1.815
305 H GLU 41 H GLU 41 -3.174 5.238 2.431
306 HA GLU 41 HA GLU 41 -4.735 5.463 4.019
307 HB2 GLU 41 HB2 GLU 41 -4.919 7.799 3.308
308 HB3 GLU 41 HB3 GLU 41 -6.109 7.348 2.098
309 HG2 GLU 41 HG2 GLU 41 -7.703 6.782 3.754
310 HG3 GLU 41 HG3 GLU 41 -6.501 6.893 5.039
311 H ILE 42 H ILE 42 -6.516 4.363 4.683
312 HA ILE 42 HA ILE 42 -8.038 2.946 2.614
313 HB ILE 42 HB ILE 42 -7.991 0.888 3.871
314 HG12 ILE 42 HG12 ILE 42 -7.787 1.858 6.159
315 HG13 ILE 42 HG13 ILE 42 -6.676 0.531 5.868
316 HG21 ILE 42 HG21 ILE 42 -6.260 1.229 2.232
317 HG22 ILE 42 HG22 ILE 42 -5.642 0.282 3.585
318 HG23 ILE 42 HG23 ILE 42 -5.229 1.992 3.442
319 HD11 ILE 42 HD11 ILE 42 -5.553 2.219 7.114
320 HD12 ILE 42 HD12 ILE 42 -6.025 3.461 5.958
321 HD13 ILE 42 HD13 ILE 42 -4.883 2.207 5.483
Start of MODEL 4
1 H1 ASP 1 H1 ASP 1 19.627 -4.252 -5.314
2 H2 ASP 1 H2 ASP 1 18.269 -3.286 -5.590
3 H3 ASP 1 H3 ASP 1 18.080 -4.852 -4.986
4 HA ASP 1 HA ASP 1 19.418 -2.619 -3.589
5 HB2 ASP 1 HB2 ASP 1 17.473 -2.747 -2.039
6 HB3 ASP 1 HB3 ASP 1 17.027 -2.235 -3.664
7 H THR 2 H THR 2 20.876 -3.295 -2.210
8 HA THR 2 HA THR 2 20.988 -6.052 -1.352
9 HB THR 2 HB THR 2 22.695 -3.769 -0.354
10 HG1 THR 2 HG1 THR 2 22.608 -5.003 -2.845
11 HG21 THR 2 HG21 THR 2 23.244 -6.726 -0.673
12 HG22 THR 2 HG22 THR 2 22.894 -5.906 0.847
13 HG23 THR 2 HG23 THR 2 24.371 -5.529 -0.037
14 H THR 3 H THR 3 20.095 -2.951 -0.167
15 HA THR 3 HA THR 3 18.783 -4.154 2.145
16 HB THR 3 HB THR 3 20.950 -3.310 2.983
17 HG1 THR 3 HG1 THR 3 19.727 -2.924 4.658
18 HG21 THR 3 HG21 THR 3 20.016 -0.631 1.950
19 HG22 THR 3 HG22 THR 3 21.363 -1.579 1.317
20 HG23 THR 3 HG23 THR 3 21.445 -0.908 2.948
21 H SER 4 H SER 4 17.081 -2.640 2.999
22 HA SER 4 HA SER 4 15.688 -1.525 0.786
23 HB2 SER 4 HB2 SER 4 15.016 -1.230 3.721
24 HB3 SER 4 HB3 SER 4 13.918 -1.037 2.353
25 HG SER 4 HG SER 4 14.893 -3.396 2.017
26 H ASP 5 H ASP 5 16.791 0.144 -0.066
27 HA ASP 5 HA ASP 5 16.616 2.662 1.406
28 HB2 ASP 5 HB2 ASP 5 18.955 1.921 1.664
29 HB3 ASP 5 HB3 ASP 5 19.095 1.742 -0.081
30 H PHE 6 H PHE 6 15.033 3.468 0.185
31 HA PHE 6 HA PHE 6 15.319 4.326 -2.455
32 HB2 PHE 6 HB2 PHE 6 13.511 2.646 -3.379
33 HB3 PHE 6 HB3 PHE 6 15.212 2.208 -3.402
34 HD1 PHE 6 HD1 PHE 6 12.777 2.121 -0.568
35 HD2 PHE 6 HD2 PHE 6 15.245 -0.088 -3.242
36 HE1 PHE 6 HE1 PHE 6 12.274 0.057 0.672
37 HE2 PHE 6 HE2 PHE 6 14.742 -2.152 -2.008
38 HZ PHE 6 HZ PHE 6 13.257 -2.082 -0.046
39 H HIS 7 H HIS 7 12.765 4.418 -3.381
40 HA HIS 7 HA HIS 7 11.497 6.031 -1.343
41 HB2 HIS 7 HB2 HIS 7 10.735 5.467 -4.210
42 HB3 HIS 7 HB3 HIS 7 9.821 6.523 -3.143
43 HD1 HIS 7 HD1 HIS 7 12.374 6.645 -5.632
44 HD2 HIS 7 HD2 HIS 7 11.611 8.716 -2.114
45 HE1 HIS 7 HE1 HIS 7 13.728 8.757 -5.781
46 HE2 HIS 7 HE2 HIS 7 13.360 9.926 -3.580
47 H THR 8 H THR 8 10.586 4.863 0.191
48 HA THR 8 HA THR 8 9.398 2.324 -0.270
49 HB THR 8 HB THR 8 8.632 2.776 2.220
50 HG1 THR 8 HG1 THR 8 10.877 4.391 2.394
51 HG21 THR 8 HG21 THR 8 11.527 2.423 1.424
52 HG22 THR 8 HG22 THR 8 10.321 1.139 1.539
53 HG23 THR 8 HG23 THR 8 10.830 2.004 2.990
54 H CYS 9 H CYS 9 7.174 2.172 1.261
55 HA CYS 9 HA CYS 9 5.257 3.483 -0.499
56 HB2 CYS 9 HB2 CYS 9 4.923 1.318 1.591
57 HB3 CYS 9 HB3 CYS 9 3.624 1.933 0.574
58 H GLN 10 H GLN 10 5.213 2.728 2.983
59 HA GLN 10 HA GLN 10 3.626 5.023 3.593
60 HB2 GLN 10 HB2 GLN 10 4.348 4.397 5.993
61 HB3 GLN 10 HB3 GLN 10 3.373 3.233 5.108
62 HG2 GLN 10 HG2 GLN 10 5.444 2.041 4.495
63 HG3 GLN 10 HG3 GLN 10 6.351 3.150 5.517
64 HE21 GLN 10 HE21 GLN 10 6.055 0.265 5.680
65 HE22 GLN 10 HE22 GLN 10 5.416 -0.070 7.246
66 H ASP 11 H ASP 11 4.482 6.916 3.224
67 HA ASP 11 HA ASP 11 6.526 8.258 4.371
68 HB2 ASP 11 HB2 ASP 11 8.019 6.400 3.543
69 HB3 ASP 11 HB3 ASP 11 7.618 6.882 1.900
70 H LYS 12 H LYS 12 5.519 7.374 1.076
71 HA LYS 12 HA LYS 12 5.345 10.245 0.407
72 HB2 LYS 12 HB2 LYS 12 5.169 7.959 -1.531
73 HB3 LYS 12 HB3 LYS 12 5.533 9.635 -1.881
74 HG2 LYS 12 HG2 LYS 12 7.712 9.399 -0.810
75 HG3 LYS 12 HG3 LYS 12 7.348 7.712 -0.433
76 HD2 LYS 12 HD2 LYS 12 7.389 8.846 -3.224
77 HD3 LYS 12 HD3 LYS 12 8.753 8.024 -2.470
78 HE2 LYS 12 HE2 LYS 12 7.638 5.969 -2.424
79 HE3 LYS 12 HE3 LYS 12 6.063 6.710 -2.664
80 HZ1 LYS 12 HZ1 LYS 12 6.764 5.653 -4.673
81 HZ2 LYS 12 HZ2 LYS 12 8.229 6.498 -4.677
82 HZ3 LYS 12 HZ3 LYS 12 6.773 7.327 -4.912
83 H GLY 13 H GLY 13 3.563 7.248 0.542
84 HA2 GLY 13 HA2 GLY 13 1.163 8.667 -0.418
85 HA3 GLY 13 HA3 GLY 13 1.541 7.034 -0.925
86 H GLY 14 H GLY 14 1.495 5.377 0.600
87 HA2 GLY 14 HA2 GLY 14 0.204 5.899 3.125
88 HA3 GLY 14 HA3 GLY 14 -0.753 4.997 1.963
89 H HIS 15 H HIS 15 -0.645 3.375 3.718
90 HA HIS 15 HA HIS 15 1.954 2.149 4.156
91 HB2 HIS 15 HB2 HIS 15 0.947 1.016 5.960
92 HB3 HIS 15 HB3 HIS 15 0.167 2.591 5.960
93 HD1 HIS 15 HD1 HIS 15 -0.662 -0.776 6.412
94 HD2 HIS 15 HD2 HIS 15 -2.374 2.319 4.213
95 HE1 HIS 15 HE1 HIS 15 -3.051 -1.457 6.051
96 HE2 HIS 15 HE2 HIS 15 -4.111 0.513 4.902
97 H CYS 16 H CYS 16 2.078 -0.241 4.101
98 HA CYS 16 HA CYS 16 1.294 -1.156 1.494
99 HB2 CYS 16 HB2 CYS 16 2.722 -2.599 3.737
100 HB3 CYS 16 HB3 CYS 16 2.603 -3.147 2.066
101 H VAL 17 H VAL 17 -0.382 -2.396 0.998
102 HA VAL 17 HA VAL 17 -1.843 -3.687 3.207
103 HB VAL 17 HB VAL 17 -3.908 -3.361 2.070
104 HG11 VAL 17 HG11 VAL 17 -3.275 -1.470 3.370
105 HG12 VAL 17 HG12 VAL 17 -4.025 -0.880 1.886
106 HG13 VAL 17 HG13 VAL 17 -2.271 -0.842 2.065
107 HG21 VAL 17 HG21 VAL 17 -3.177 -3.730 -0.218
108 HG22 VAL 17 HG22 VAL 17 -2.340 -2.177 -0.217
109 HG23 VAL 17 HG23 VAL 17 -4.099 -2.231 -0.099
110 H SER 18 H SER 18 -2.530 -5.726 2.941
111 HA SER 18 HA SER 18 -1.121 -7.349 1.092
112 HB2 SER 18 HB2 SER 18 -2.214 -9.171 2.166
113 HB3 SER 18 HB3 SER 18 -1.882 -7.993 3.417
114 HG SER 18 HG SER 18 -4.140 -9.056 3.079
115 HA PRO 19 HA PRO 19 -3.636 -7.168 -2.468
116 HB2 PRO 19 HB2 PRO 19 -3.626 -9.775 -3.314
117 HB3 PRO 19 HB3 PRO 19 -2.286 -8.643 -3.531
118 HG2 PRO 19 HG2 PRO 19 -2.687 -10.715 -1.407
119 HG3 PRO 19 HG3 PRO 19 -1.226 -10.330 -2.335
120 HD2 PRO 19 HD2 PRO 19 -1.523 -9.436 0.156
121 HD3 PRO 19 HD3 PRO 19 -0.795 -8.412 -1.100
122 H LYS 20 H LYS 20 -5.125 -7.752 0.082
123 HA LYS 20 HA LYS 20 -7.551 -8.768 -1.228
124 HB2 LYS 20 HB2 LYS 20 -6.652 -10.500 0.311
125 HB3 LYS 20 HB3 LYS 20 -6.732 -9.345 1.633
126 HG2 LYS 20 HG2 LYS 20 -8.623 -10.772 1.800
127 HG3 LYS 20 HG3 LYS 20 -9.195 -9.194 1.250
128 HD2 LYS 20 HD2 LYS 20 -8.949 -10.190 -1.120
129 HD3 LYS 20 HD3 LYS 20 -8.915 -11.749 -0.295
130 HE2 LYS 20 HE2 LYS 20 -11.169 -11.325 -0.939
131 HE3 LYS 20 HE3 LYS 20 -11.067 -11.111 0.808
132 HZ1 LYS 20 HZ1 LYS 20 -10.897 -8.707 0.436
133 HZ2 LYS 20 HZ2 LYS 20 -12.343 -9.340 -0.163
134 HZ3 LYS 20 HZ3 LYS 20 -11.091 -8.949 -1.227
135 H ILE 21 H ILE 21 -5.978 -6.281 0.264
136 HA ILE 21 HA ILE 21 -8.196 -5.278 1.851
137 HB ILE 21 HB ILE 21 -5.504 -4.020 1.319
138 HG12 ILE 21 HG12 ILE 21 -5.222 -6.182 2.414
139 HG13 ILE 21 HG13 ILE 21 -4.868 -4.880 3.544
140 HG21 ILE 21 HG21 ILE 21 -5.962 -2.692 3.326
141 HG22 ILE 21 HG22 ILE 21 -7.558 -3.435 3.447
142 HG23 ILE 21 HG23 ILE 21 -7.165 -2.410 2.067
143 HD11 ILE 21 HD11 ILE 21 -6.126 -6.632 4.627
144 HD12 ILE 21 HD12 ILE 21 -7.404 -6.490 3.424
145 HD13 ILE 21 HD13 ILE 21 -7.090 -5.159 4.536
146 H ARG 22 H ARG 22 -9.349 -3.457 1.434
147 HA ARG 22 HA ARG 22 -9.663 -2.682 -1.302
148 HB2 ARG 22 HB2 ARG 22 -11.601 -2.891 0.138
149 HB3 ARG 22 HB3 ARG 22 -10.943 -1.708 1.255
150 HG2 ARG 22 HG2 ARG 22 -11.013 -0.105 -0.761
151 HG3 ARG 22 HG3 ARG 22 -12.122 -1.292 -1.451
152 HD2 ARG 22 HD2 ARG 22 -13.391 0.409 -0.301
153 HD3 ARG 22 HD3 ARG 22 -13.522 -1.115 0.575
154 HE ARG 22 HE ARG 22 -11.458 0.089 1.812
155 HH11 ARG 22 HH11 ARG 22 -14.717 1.130 1.057
156 HH12 ARG 22 HH12 ARG 22 -14.788 2.268 2.363
157 HH21 ARG 22 HH21 ARG 22 -11.538 1.597 3.522
158 HH22 ARG 22 HH22 ARG 22 -12.979 2.537 3.757
159 H CYS 23 H CYS 23 -8.754 -1.003 -2.304
160 HA CYS 23 HA CYS 23 -7.133 0.860 -0.737
161 HB2 CYS 23 HB2 CYS 23 -7.202 0.327 -3.711
162 HB3 CYS 23 HB3 CYS 23 -6.095 1.416 -2.895
163 H LEU 24 H LEU 24 -7.665 2.948 -0.520
164 HA LEU 24 HA LEU 24 -9.967 4.005 -1.925
165 HB2 LEU 24 HB2 LEU 24 -8.310 4.827 0.375
166 HB3 LEU 24 HB3 LEU 24 -8.937 6.138 -0.603
167 HG LEU 24 HG LEU 24 -10.384 5.627 1.320
168 HD11 LEU 24 HD11 LEU 24 -12.487 5.519 0.095
169 HD12 LEU 24 HD12 LEU 24 -11.632 4.980 -1.347
170 HD13 LEU 24 HD13 LEU 24 -11.345 6.596 -0.704
171 HD21 LEU 24 HD21 LEU 24 -11.684 3.555 1.347
172 HD22 LEU 24 HD22 LEU 24 -9.956 3.240 1.503
173 HD23 LEU 24 HD23 LEU 24 -10.766 2.964 -0.039
174 H GLU 25 H GLU 25 -6.491 4.721 -1.679
175 HA GLU 25 HA GLU 25 -6.595 5.539 -4.485
176 HB2 GLU 25 HB2 GLU 25 -6.673 7.611 -3.162
177 HB3 GLU 25 HB3 GLU 25 -5.217 7.125 -2.311
178 HG2 GLU 25 HG2 GLU 25 -4.629 8.729 -3.972
179 HG3 GLU 25 HG3 GLU 25 -4.003 7.159 -4.467
180 H GLU 26 H GLU 26 -5.271 4.140 -5.482
181 HA GLU 26 HA GLU 26 -3.236 2.734 -4.057
182 HB2 GLU 26 HB2 GLU 26 -3.902 2.856 -6.990
183 HB3 GLU 26 HB3 GLU 26 -2.646 1.827 -6.319
184 HG2 GLU 26 HG2 GLU 26 -4.288 0.660 -4.969
185 HG3 GLU 26 HG3 GLU 26 -5.561 1.710 -5.584
186 H GLN 27 H GLN 27 -1.050 2.895 -4.202
187 HA GLN 27 HA GLN 27 0.088 5.250 -5.516
188 HB2 GLN 27 HB2 GLN 27 -0.612 5.268 -2.848
189 HB3 GLN 27 HB3 GLN 27 1.072 4.779 -2.783
190 HG2 GLN 27 HG2 GLN 27 0.120 7.210 -4.253
191 HG3 GLN 27 HG3 GLN 27 0.621 7.233 -2.571
192 HE21 GLN 27 HE21 GLN 27 2.787 6.923 -2.056
193 HE22 GLN 27 HE22 GLN 27 4.035 7.081 -3.247
194 H LEU 28 H LEU 28 2.456 5.117 -5.647
195 HA LEU 28 HA LEU 28 3.290 2.308 -5.758
196 HB2 LEU 28 HB2 LEU 28 5.013 3.233 -7.428
197 HB3 LEU 28 HB3 LEU 28 3.354 3.028 -7.945
198 HG LEU 28 HG LEU 28 3.091 5.541 -7.378
199 HD11 LEU 28 HD11 LEU 28 5.215 5.821 -6.207
200 HD12 LEU 28 HD12 LEU 28 5.120 6.862 -7.628
201 HD13 LEU 28 HD13 LEU 28 6.084 5.387 -7.679
202 HD21 LEU 28 HD21 LEU 28 3.863 6.146 -9.615
203 HD22 LEU 28 HD22 LEU 28 2.988 4.614 -9.619
204 HD23 LEU 28 HD23 LEU 28 4.749 4.625 -9.719
205 H GLY 29 H GLY 29 5.015 1.618 -4.731
206 HA2 GLY 29 HA2 GLY 29 7.194 3.247 -3.924
207 HA3 GLY 29 HA3 GLY 29 6.118 2.932 -2.567
208 H LEU 30 H LEU 30 8.156 1.841 -1.802
209 HA LEU 30 HA LEU 30 8.453 -0.830 -2.980
210 HB2 LEU 30 HB2 LEU 30 10.296 0.915 -1.411
211 HB3 LEU 30 HB3 LEU 30 10.519 -0.820 -1.373
212 HG LEU 30 HG LEU 30 11.999 0.196 -3.001
213 HD11 LEU 30 HD11 LEU 30 11.133 -2.041 -3.455
214 HD12 LEU 30 HD12 LEU 30 11.438 -1.143 -4.942
215 HD13 LEU 30 HD13 LEU 30 9.788 -1.338 -4.353
216 HD21 LEU 30 HD21 LEU 30 9.535 1.136 -4.448
217 HD22 LEU 30 HD22 LEU 30 11.215 1.400 -4.915
218 HD23 LEU 30 HD23 LEU 30 10.569 2.167 -3.459
219 H CYS 31 H CYS 31 6.971 -2.092 -2.038
220 HA CYS 31 HA CYS 31 7.008 -2.298 0.895
221 HB2 CYS 31 HB2 CYS 31 5.089 -3.453 -1.142
222 HB3 CYS 31 HB3 CYS 31 5.002 -3.741 0.591
223 HA PRO 32 HA PRO 32 9.169 -6.113 -0.002
224 HB2 PRO 32 HB2 PRO 32 10.327 -6.442 2.358
225 HB3 PRO 32 HB3 PRO 32 10.746 -5.034 1.374
226 HG2 PRO 32 HG2 PRO 32 9.049 -5.202 3.814
227 HG3 PRO 32 HG3 PRO 32 10.068 -3.864 3.248
228 HD2 PRO 32 HD2 PRO 32 7.238 -4.216 2.879
229 HD3 PRO 32 HD3 PRO 32 8.256 -2.898 2.259
230 H LEU 33 H LEU 33 7.410 -7.526 -0.283
231 HA LEU 33 HA LEU 33 7.062 -9.495 1.708
232 HB2 LEU 33 HB2 LEU 33 4.824 -7.521 1.325
233 HB3 LEU 33 HB3 LEU 33 4.481 -9.181 1.761
234 HG LEU 33 HG LEU 33 6.143 -7.250 3.377
235 HD11 LEU 33 HD11 LEU 33 4.322 -7.343 4.990
236 HD12 LEU 33 HD12 LEU 33 3.387 -8.338 3.874
237 HD13 LEU 33 HD13 LEU 33 3.795 -6.677 3.445
238 HD21 LEU 33 HD21 LEU 33 6.984 -9.434 3.721
239 HD22 LEU 33 HD22 LEU 33 5.356 -10.104 3.860
240 HD23 LEU 33 HD23 LEU 33 5.981 -9.030 5.113
241 H LYS 34 H LYS 34 4.358 -8.645 -0.323
242 HA LYS 34 HA LYS 34 5.176 -10.618 -2.320
243 HB2 LYS 34 HB2 LYS 34 2.484 -10.545 -0.953
244 HB3 LYS 34 HB3 LYS 34 2.985 -11.685 -2.200
245 HG2 LYS 34 HG2 LYS 34 4.746 -12.504 -0.631
246 HG3 LYS 34 HG3 LYS 34 4.036 -11.476 0.612
247 HD2 LYS 34 HD2 LYS 34 1.866 -12.660 0.227
248 HD3 LYS 34 HD3 LYS 34 2.733 -13.785 -0.817
249 HE2 LYS 34 HE2 LYS 34 3.285 -13.284 2.103
250 HE3 LYS 34 HE3 LYS 34 2.460 -14.687 1.434
251 HZ1 LYS 34 HZ1 LYS 34 4.520 -15.200 0.210
252 HZ2 LYS 34 HZ2 LYS 34 4.721 -15.246 1.883
253 HZ3 LYS 34 HZ3 LYS 34 5.297 -13.924 1.003
254 H ARG 35 H ARG 35 1.978 -10.071 -2.713
255 HA ARG 35 HA ARG 35 2.356 -8.124 -4.790
256 HB2 ARG 35 HB2 ARG 35 0.992 -10.106 -5.213
257 HB3 ARG 35 HB3 ARG 35 -0.080 -9.672 -3.887
258 HG2 ARG 35 HG2 ARG 35 -0.679 -7.628 -5.071
259 HG3 ARG 35 HG3 ARG 35 0.330 -8.130 -6.424
260 HD2 ARG 35 HD2 ARG 35 -1.071 -9.997 -6.879
261 HD3 ARG 35 HD3 ARG 35 -1.954 -9.778 -5.368
262 HE ARG 35 HE ARG 35 -2.374 -7.441 -6.645
263 HH11 ARG 35 HH11 ARG 35 -2.762 -10.780 -7.628
264 HH12 ARG 35 HH12 ARG 35 -4.053 -10.439 -8.734
265 HH21 ARG 35 HH21 ARG 35 -4.085 -6.986 -8.084
266 HH22 ARG 35 HH22 ARG 35 -4.816 -8.274 -8.985
267 H TRP 36 H TRP 36 2.788 -7.137 -2.169
268 HA TRP 36 HA TRP 36 0.382 -5.989 -1.135
269 HB2 TRP 36 HB2 TRP 36 3.272 -5.851 -0.362
270 HB3 TRP 36 HB3 TRP 36 2.083 -4.800 0.402
271 HD1 TRP 36 HD1 TRP 36 2.116 -8.617 -0.403
272 HE1 TRP 36 HE1 TRP 36 1.305 -9.855 1.702
273 HE3 TRP 36 HE3 TRP 36 1.396 -4.602 2.653
274 HZ2 TRP 36 HZ2 TRP 36 0.464 -9.192 4.331
275 HZ3 TRP 36 HZ3 TRP 36 0.585 -4.983 4.915
276 HH2 TRP 36 HH2 TRP 36 0.133 -7.222 5.748
277 H THR 37 H THR 37 -0.513 -4.170 -1.564
278 HA THR 37 HA THR 37 0.663 -2.376 -3.529
279 HB THR 37 HB THR 37 -2.090 -2.569 -2.295
280 HG1 THR 37 HG1 THR 37 -1.138 -4.073 -4.034
281 HG21 THR 37 HG21 THR 37 -1.062 -0.631 -4.368
282 HG22 THR 37 HG22 THR 37 -1.772 -0.250 -2.792
283 HG23 THR 37 HG23 THR 37 -2.774 -0.941 -4.073
284 H CYS 38 H CYS 38 1.087 -0.169 -3.164
285 HA CYS 38 HA CYS 38 1.270 0.634 -0.363
286 HB2 CYS 38 HB2 CYS 38 2.011 2.242 -2.818
287 HB3 CYS 38 HB3 CYS 38 2.593 2.460 -1.172
288 H CYS 39 H CYS 39 -0.891 0.908 0.198
289 HA CYS 39 HA CYS 39 -2.593 2.421 -1.587
290 HB2 CYS 39 HB2 CYS 39 -2.988 0.697 0.795
291 HB3 CYS 39 HB3 CYS 39 -4.258 1.826 0.356
292 H LYS 40 H LYS 40 -2.755 4.510 -1.449
293 HA LYS 40 HA LYS 40 -1.969 5.976 0.886
294 HB2 LYS 40 HB2 LYS 40 -1.884 6.720 -1.625
295 HB3 LYS 40 HB3 LYS 40 -3.564 7.162 -1.365
296 HG2 LYS 40 HG2 LYS 40 -1.323 8.162 0.370
297 HG3 LYS 40 HG3 LYS 40 -1.878 9.007 -1.075
298 HD2 LYS 40 HD2 LYS 40 -3.957 9.487 -0.138
299 HD3 LYS 40 HD3 LYS 40 -3.796 8.227 1.082
300 HE2 LYS 40 HE2 LYS 40 -2.087 10.707 0.978
301 HE3 LYS 40 HE3 LYS 40 -3.547 10.559 1.952
302 HZ1 LYS 40 HZ1 LYS 40 -2.514 8.701 3.133
303 HZ2 LYS 40 HZ2 LYS 40 -1.584 10.108 3.267
304 HZ3 LYS 40 HZ3 LYS 40 -1.103 8.880 2.208
305 H GLU 41 H GLU 41 -3.215 5.178 2.464
306 HA GLU 41 HA GLU 41 -4.886 5.066 3.934
307 HB2 GLU 41 HB2 GLU 41 -6.450 6.926 2.146
308 HB3 GLU 41 HB3 GLU 41 -6.785 6.532 3.821
309 HG2 GLU 41 HG2 GLU 41 -4.571 8.203 2.714
310 HG3 GLU 41 HG3 GLU 41 -5.807 8.646 3.882
311 H ILE 42 H ILE 42 -6.832 3.984 4.332
312 HA ILE 42 HA ILE 42 -7.999 2.568 2.058
313 HB ILE 42 HB ILE 42 -7.813 0.416 3.129
314 HG12 ILE 42 HG12 ILE 42 -7.896 1.196 5.493
315 HG13 ILE 42 HG13 ILE 42 -6.630 0.017 5.202
316 HG21 ILE 42 HG21 ILE 42 -5.384 0.063 3.044
317 HG22 ILE 42 HG22 ILE 42 -5.157 1.811 3.010
318 HG23 ILE 42 HG23 ILE 42 -5.997 1.004 1.686
319 HD11 ILE 42 HD11 ILE 42 -5.783 1.700 6.656
320 HD12 ILE 42 HD12 ILE 42 -6.304 2.979 5.567
321 HD13 ILE 42 HD13 ILE 42 -4.999 1.896 5.089
Start of MODEL 5
1 H1 ASP 1 H1 ASP 1 16.870 -4.437 -3.028
2 H2 ASP 1 H2 ASP 1 17.603 -5.556 -4.057
3 H3 ASP 1 H3 ASP 1 17.087 -4.065 -4.662
4 HA ASP 1 HA ASP 1 19.474 -4.095 -4.385
5 HB2 ASP 1 HB2 ASP 1 18.064 -2.000 -3.953
6 HB3 ASP 1 HB3 ASP 1 18.269 -2.342 -2.236
7 H THR 2 H THR 2 21.229 -3.831 -2.673
8 HA THR 2 HA THR 2 21.215 -6.024 -0.877
9 HB THR 2 HB THR 2 23.065 -3.635 -0.809
10 HG1 THR 2 HG1 THR 2 22.742 -5.612 -2.695
11 HG21 THR 2 HG21 THR 2 23.473 -6.515 0.015
12 HG22 THR 2 HG22 THR 2 23.253 -5.150 1.110
13 HG23 THR 2 HG23 THR 2 24.688 -5.238 0.087
14 H THR 3 H THR 3 20.534 -2.635 -0.602
15 HA THR 3 HA THR 3 19.594 -3.040 2.142
16 HB THR 3 HB THR 3 21.831 -2.039 2.304
17 HG1 THR 3 HG1 THR 3 20.208 -1.380 3.809
18 HG21 THR 3 HG21 THR 3 20.679 0.198 0.637
19 HG22 THR 3 HG22 THR 3 21.936 -0.938 0.140
20 HG23 THR 3 HG23 THR 3 22.252 0.219 1.434
21 H SER 4 H SER 4 17.897 -1.599 2.761
22 HA SER 4 HA SER 4 16.252 -0.873 0.541
23 HB2 SER 4 HB2 SER 4 15.774 -0.376 3.486
24 HB3 SER 4 HB3 SER 4 14.565 -0.337 2.199
25 HG SER 4 HG SER 4 15.830 -2.669 2.064
26 H ASP 5 H ASP 5 17.138 0.806 -0.557
27 HA ASP 5 HA ASP 5 16.859 3.412 0.752
28 HB2 ASP 5 HB2 ASP 5 19.297 2.797 0.703
29 HB3 ASP 5 HB3 ASP 5 19.189 2.720 -1.054
30 H PHE 6 H PHE 6 15.066 3.997 -0.323
31 HA PHE 6 HA PHE 6 15.045 4.683 -3.032
32 HB2 PHE 6 HB2 PHE 6 13.268 2.847 -3.648
33 HB3 PHE 6 HB3 PHE 6 14.981 2.485 -3.788
34 HD1 PHE 6 HD1 PHE 6 15.215 0.239 -3.398
35 HD2 PHE 6 HD2 PHE 6 12.744 2.518 -0.787
36 HE1 PHE 6 HE1 PHE 6 14.938 -1.727 -1.950
37 HE2 PHE 6 HE2 PHE 6 12.462 0.552 0.667
38 HZ PHE 6 HZ PHE 6 13.560 -1.576 0.085
39 H HIS 7 H HIS 7 12.450 4.580 -3.726
40 HA HIS 7 HA HIS 7 11.227 6.254 -1.707
41 HB2 HIS 7 HB2 HIS 7 10.396 5.471 -4.499
42 HB3 HIS 7 HB3 HIS 7 9.363 6.409 -3.431
43 HD1 HIS 7 HD1 HIS 7 11.795 6.845 -6.002
44 HD2 HIS 7 HD2 HIS 7 10.817 8.859 -2.500
45 HE1 HIS 7 HE1 HIS 7 12.800 9.138 -6.243
46 HE2 HIS 7 HE2 HIS 7 12.184 10.351 -4.119
47 H THR 8 H THR 8 10.557 5.081 -0.032
48 HA THR 8 HA THR 8 9.403 2.516 -0.214
49 HB THR 8 HB THR 8 8.703 3.051 2.206
50 HG1 THR 8 HG1 THR 8 9.859 4.899 3.048
51 HG21 THR 8 HG21 THR 8 11.013 2.820 3.012
52 HG22 THR 8 HG22 THR 8 11.611 3.234 1.406
53 HG23 THR 8 HG23 THR 8 10.693 1.748 1.648
54 H CYS 9 H CYS 9 7.210 2.421 1.320
55 HA CYS 9 HA CYS 9 5.236 3.599 -0.480
56 HB2 CYS 9 HB2 CYS 9 5.026 1.430 1.634
57 HB3 CYS 9 HB3 CYS 9 3.659 2.022 0.691
58 H GLN 10 H GLN 10 5.285 2.917 3.010
59 HA GLN 10 HA GLN 10 3.596 5.201 3.507
60 HB2 GLN 10 HB2 GLN 10 4.011 4.490 5.942
61 HB3 GLN 10 HB3 GLN 10 3.142 3.365 4.908
62 HG2 GLN 10 HG2 GLN 10 5.380 2.246 4.503
63 HG3 GLN 10 HG3 GLN 10 5.986 3.215 5.844
64 HE21 GLN 10 HE21 GLN 10 5.736 0.340 5.562
65 HE22 GLN 10 HE22 GLN 10 4.742 -0.193 6.870
66 H ASP 11 H ASP 11 4.511 7.081 3.275
67 HA ASP 11 HA ASP 11 6.228 8.450 4.773
68 HB2 ASP 11 HB2 ASP 11 7.950 6.628 4.277
69 HB3 ASP 11 HB3 ASP 11 7.951 7.195 2.612
70 H LYS 12 H LYS 12 6.030 7.535 1.333
71 HA LYS 12 HA LYS 12 5.752 10.344 0.580
72 HB2 LYS 12 HB2 LYS 12 5.916 7.847 -1.119
73 HB3 LYS 12 HB3 LYS 12 5.890 9.488 -1.736
74 HG2 LYS 12 HG2 LYS 12 8.102 8.665 -1.829
75 HG3 LYS 12 HG3 LYS 12 8.052 9.892 -0.570
76 HD2 LYS 12 HD2 LYS 12 7.921 8.109 1.101
77 HD3 LYS 12 HD3 LYS 12 7.993 6.898 -0.178
78 HE2 LYS 12 HE2 LYS 12 10.179 7.114 0.755
79 HE3 LYS 12 HE3 LYS 12 10.193 7.853 -0.845
80 HZ1 LYS 12 HZ1 LYS 12 11.358 9.207 0.785
81 HZ2 LYS 12 HZ2 LYS 12 9.955 9.321 1.731
82 HZ3 LYS 12 HZ3 LYS 12 10.003 10.025 0.190
83 H GLY 13 H GLY 13 3.992 7.328 0.686
84 HA2 GLY 13 HA2 GLY 13 1.609 8.725 -0.347
85 HA3 GLY 13 HA3 GLY 13 2.004 7.084 -0.809
86 H GLY 14 H GLY 14 1.859 5.439 0.715
87 HA2 GLY 14 HA2 GLY 14 0.512 5.956 3.198
88 HA3 GLY 14 HA3 GLY 14 -0.505 5.225 1.974
89 H HIS 15 H HIS 15 -0.686 3.501 3.531
90 HA HIS 15 HA HIS 15 1.755 2.093 4.260
91 HB2 HIS 15 HB2 HIS 15 0.474 1.022 5.937
92 HB3 HIS 15 HB3 HIS 15 -0.123 2.669 5.903
93 HD1 HIS 15 HD1 HIS 15 -1.400 -0.499 6.357
94 HD2 HIS 15 HD2 HIS 15 -2.488 2.633 3.839
95 HE1 HIS 15 HE1 HIS 15 -3.795 -0.927 5.735
96 HE2 HIS 15 HE2 HIS 15 -4.472 1.068 4.364
97 H CYS 16 H CYS 16 1.882 -0.218 4.110
98 HA CYS 16 HA CYS 16 1.149 -1.107 1.476
99 HB2 CYS 16 HB2 CYS 16 2.574 -2.574 3.708
100 HB3 CYS 16 HB3 CYS 16 2.484 -3.085 2.024
101 H VAL 17 H VAL 17 -0.484 -2.416 0.930
102 HA VAL 17 HA VAL 17 -1.953 -3.741 3.110
103 HB VAL 17 HB VAL 17 -4.038 -3.435 1.899
104 HG11 VAL 17 HG11 VAL 17 -2.543 -0.842 2.263
105 HG12 VAL 17 HG12 VAL 17 -3.443 -1.724 3.496
106 HG13 VAL 17 HG13 VAL 17 -4.294 -1.002 2.132
107 HG21 VAL 17 HG21 VAL 17 -2.426 -1.871 -0.118
108 HG22 VAL 17 HG22 VAL 17 -4.187 -2.001 -0.089
109 HG23 VAL 17 HG23 VAL 17 -3.200 -3.433 -0.387
110 H SER 18 H SER 18 -2.593 -5.765 2.818
111 HA SER 18 HA SER 18 -1.174 -7.335 0.933
112 HB2 SER 18 HB2 SER 18 -2.203 -9.203 2.034
113 HB3 SER 18 HB3 SER 18 -1.787 -8.031 3.265
114 HG SER 18 HG SER 18 -3.884 -7.509 3.516
115 HA PRO 19 HA PRO 19 -3.767 -7.351 -2.568
116 HB2 PRO 19 HB2 PRO 19 -3.681 -9.987 -3.324
117 HB3 PRO 19 HB3 PRO 19 -2.386 -8.819 -3.606
118 HG2 PRO 19 HG2 PRO 19 -2.681 -10.820 -1.395
119 HG3 PRO 19 HG3 PRO 19 -1.248 -10.431 -2.367
120 HD2 PRO 19 HD2 PRO 19 -1.519 -9.442 0.089
121 HD3 PRO 19 HD3 PRO 19 -0.866 -8.436 -1.221
122 H LYS 20 H LYS 20 -5.199 -7.905 0.030
123 HA LYS 20 HA LYS 20 -7.667 -8.792 -1.243
124 HB2 LYS 20 HB2 LYS 20 -6.640 -10.789 -0.111
125 HB3 LYS 20 HB3 LYS 20 -6.769 -9.928 1.415
126 HG2 LYS 20 HG2 LYS 20 -8.583 -11.518 1.154
127 HG3 LYS 20 HG3 LYS 20 -9.199 -9.865 1.184
128 HD2 LYS 20 HD2 LYS 20 -9.353 -9.895 -1.268
129 HD3 LYS 20 HD3 LYS 20 -8.762 -11.557 -1.278
130 HE2 LYS 20 HE2 LYS 20 -10.705 -12.229 0.072
131 HE3 LYS 20 HE3 LYS 20 -11.299 -10.572 0.020
132 HZ1 LYS 20 HZ1 LYS 20 -10.938 -12.383 -2.306
133 HZ2 LYS 20 HZ2 LYS 20 -11.421 -10.766 -2.407
134 HZ3 LYS 20 HZ3 LYS 20 -12.409 -11.894 -1.628
135 H ILE 21 H ILE 21 -6.223 -6.388 -0.023
136 HA ILE 21 HA ILE 21 -8.241 -5.570 1.953
137 HB ILE 21 HB ILE 21 -5.573 -4.310 1.293
138 HG12 ILE 21 HG12 ILE 21 -5.327 -6.491 2.400
139 HG13 ILE 21 HG13 ILE 21 -4.812 -5.175 3.448
140 HG21 ILE 21 HG21 ILE 21 -7.517 -3.682 3.511
141 HG22 ILE 21 HG22 ILE 21 -7.176 -2.672 2.107
142 HG23 ILE 21 HG23 ILE 21 -5.920 -2.962 3.309
143 HD11 ILE 21 HD11 ILE 21 -6.066 -6.845 4.677
144 HD12 ILE 21 HD12 ILE 21 -7.443 -6.622 3.599
145 HD13 ILE 21 HD13 ILE 21 -6.925 -5.305 4.651
146 H ARG 22 H ARG 22 -9.520 -3.788 1.592
147 HA ARG 22 HA ARG 22 -9.840 -2.781 -1.038
148 HB2 ARG 22 HB2 ARG 22 -11.416 -1.213 -0.088
149 HB3 ARG 22 HB3 ARG 22 -11.678 -2.813 0.593
150 HG2 ARG 22 HG2 ARG 22 -10.570 -2.188 2.617
151 HG3 ARG 22 HG3 ARG 22 -10.113 -0.629 1.939
152 HD2 ARG 22 HD2 ARG 22 -12.955 -1.532 2.230
153 HD3 ARG 22 HD3 ARG 22 -12.109 -0.610 3.473
154 HE ARG 22 HE ARG 22 -11.933 0.662 0.935
155 HH11 ARG 22 HH11 ARG 22 -14.079 0.170 3.660
156 HH12 ARG 22 HH12 ARG 22 -15.005 1.604 3.348
157 HH21 ARG 22 HH21 ARG 22 -13.168 2.528 0.509
158 HH22 ARG 22 HH22 ARG 22 -14.494 2.940 1.554
159 H CYS 23 H CYS 23 -9.086 -0.943 -1.964
160 HA CYS 23 HA CYS 23 -7.284 0.731 -0.358
161 HB2 CYS 23 HB2 CYS 23 -6.164 -0.825 -2.051
162 HB3 CYS 23 HB3 CYS 23 -6.911 0.174 -3.296
163 H LEU 24 H LEU 24 -7.672 2.862 -0.417
164 HA LEU 24 HA LEU 24 -9.864 3.824 -2.022
165 HB2 LEU 24 HB2 LEU 24 -8.198 4.945 0.173
166 HB3 LEU 24 HB3 LEU 24 -8.988 6.075 -0.911
167 HG LEU 24 HG LEU 24 -10.353 5.737 1.057
168 HD11 LEU 24 HD11 LEU 24 -11.578 4.324 -1.302
169 HD12 LEU 24 HD12 LEU 24 -11.474 6.071 -1.099
170 HD13 LEU 24 HD13 LEU 24 -12.438 5.109 0.019
171 HD21 LEU 24 HD21 LEU 24 -9.606 3.570 1.773
172 HD22 LEU 24 HD22 LEU 24 -10.270 2.816 0.328
173 HD23 LEU 24 HD23 LEU 24 -11.350 3.520 1.531
174 H GLU 25 H GLU 25 -6.423 4.750 -1.660
175 HA GLU 25 HA GLU 25 -6.479 5.338 -4.540
176 HB2 GLU 25 HB2 GLU 25 -6.574 7.436 -3.156
177 HB3 GLU 25 HB3 GLU 25 -4.995 7.009 -2.512
178 HG2 GLU 25 HG2 GLU 25 -4.035 7.112 -4.737
179 HG3 GLU 25 HG3 GLU 25 -5.620 7.478 -5.415
180 H GLU 26 H GLU 26 -5.089 4.034 -5.533
181 HA GLU 26 HA GLU 26 -3.081 2.643 -4.038
182 HB2 GLU 26 HB2 GLU 26 -3.669 2.680 -6.993
183 HB3 GLU 26 HB3 GLU 26 -2.452 1.661 -6.242
184 HG2 GLU 26 HG2 GLU 26 -4.236 0.644 -4.852
185 HG3 GLU 26 HG3 GLU 26 -5.419 1.579 -5.762
186 H GLN 27 H GLN 27 -1.008 2.988 -3.908
187 HA GLN 27 HA GLN 27 0.164 5.274 -5.342
188 HB2 GLN 27 HB2 GLN 27 -0.444 5.165 -2.643
189 HB3 GLN 27 HB3 GLN 27 1.245 4.692 -2.676
190 HG2 GLN 27 HG2 GLN 27 0.188 7.198 -3.948
191 HG3 GLN 27 HG3 GLN 27 0.826 7.116 -2.310
192 HE21 GLN 27 HE21 GLN 27 3.040 6.694 -2.013
193 HE22 GLN 27 HE22 GLN 27 4.183 6.951 -3.281
194 H LEU 28 H LEU 28 2.449 5.066 -5.749
195 HA LEU 28 HA LEU 28 3.307 2.283 -5.827
196 HB2 LEU 28 HB2 LEU 28 4.657 2.806 -7.610
197 HB3 LEU 28 HB3 LEU 28 3.291 3.854 -7.872
198 HG LEU 28 HG LEU 28 5.807 4.822 -6.530
199 HD11 LEU 28 HD11 LEU 28 6.497 5.676 -8.713
200 HD12 LEU 28 HD12 LEU 28 5.135 4.848 -9.465
201 HD13 LEU 28 HD13 LEU 28 6.419 3.915 -8.697
202 HD21 LEU 28 HD21 LEU 28 3.852 6.239 -6.248
203 HD22 LEU 28 HD22 LEU 28 3.576 6.234 -7.990
204 HD23 LEU 28 HD23 LEU 28 5.017 7.006 -7.329
205 H GLY 29 H GLY 29 5.057 1.547 -4.769
206 HA2 GLY 29 HA2 GLY 29 7.097 3.221 -3.704
207 HA3 GLY 29 HA3 GLY 29 5.953 2.750 -2.453
208 H LEU 30 H LEU 30 8.037 1.775 -1.645
209 HA LEU 30 HA LEU 30 8.464 -0.871 -2.841
210 HB2 LEU 30 HB2 LEU 30 10.221 0.959 -1.279
211 HB3 LEU 30 HB3 LEU 30 10.498 -0.762 -1.166
212 HG LEU 30 HG LEU 30 11.987 0.209 -2.798
213 HD11 LEU 30 HD11 LEU 30 9.826 -1.393 -4.150
214 HD12 LEU 30 HD12 LEU 30 11.178 -2.046 -3.224
215 HD13 LEU 30 HD13 LEU 30 11.477 -1.174 -4.728
216 HD21 LEU 30 HD21 LEU 30 11.230 1.339 -4.773
217 HD22 LEU 30 HD22 LEU 30 10.576 2.156 -3.349
218 HD23 LEU 30 HD23 LEU 30 9.545 1.097 -4.312
219 H CYS 31 H CYS 31 6.890 -2.070 -1.918
220 HA CYS 31 HA CYS 31 6.944 -2.348 1.005
221 HB2 CYS 31 HB2 CYS 31 4.993 -3.472 -1.021
222 HB3 CYS 31 HB3 CYS 31 4.893 -3.689 0.721
223 HA PRO 32 HA PRO 32 9.104 -6.126 -0.046
224 HB2 PRO 32 HB2 PRO 32 10.301 -6.522 2.282
225 HB3 PRO 32 HB3 PRO 32 10.688 -5.076 1.339
226 HG2 PRO 32 HG2 PRO 32 9.008 -5.354 3.788
227 HG3 PRO 32 HG3 PRO 32 10.037 -3.998 3.281
228 HD2 PRO 32 HD2 PRO 32 7.210 -4.277 2.917
229 HD3 PRO 32 HD3 PRO 32 8.252 -2.981 2.295
230 H LEU 33 H LEU 33 7.384 -7.559 -0.356
231 HA LEU 33 HA LEU 33 7.058 -9.612 1.541
232 HB2 LEU 33 HB2 LEU 33 4.803 -7.633 1.295
233 HB3 LEU 33 HB3 LEU 33 4.489 -9.310 1.680
234 HG LEU 33 HG LEU 33 6.174 -7.423 3.324
235 HD11 LEU 33 HD11 LEU 33 3.421 -8.523 3.819
236 HD12 LEU 33 HD12 LEU 33 3.835 -6.847 3.457
237 HD13 LEU 33 HD13 LEU 33 4.374 -7.583 4.967
238 HD21 LEU 33 HD21 LEU 33 7.019 -9.629 3.568
239 HD22 LEU 33 HD22 LEU 33 5.394 -10.294 3.744
240 HD23 LEU 33 HD23 LEU 33 6.065 -9.254 5.003
241 H LYS 34 H LYS 34 4.151 -9.010 -0.109
242 HA LYS 34 HA LYS 34 5.009 -10.686 -2.370
243 HB2 LYS 34 HB2 LYS 34 2.312 -10.648 -1.005
244 HB3 LYS 34 HB3 LYS 34 2.764 -11.661 -2.367
245 HG2 LYS 34 HG2 LYS 34 4.451 -12.764 -0.946
246 HG3 LYS 34 HG3 LYS 34 3.889 -11.795 0.418
247 HD2 LYS 34 HD2 LYS 34 1.659 -12.767 0.200
248 HD3 LYS 34 HD3 LYS 34 2.201 -13.719 -1.182
249 HE2 LYS 34 HE2 LYS 34 2.171 -15.089 0.812
250 HE3 LYS 34 HE3 LYS 34 3.828 -14.857 0.258
251 HZ1 LYS 34 HZ1 LYS 34 2.514 -13.416 2.494
252 HZ2 LYS 34 HZ2 LYS 34 4.082 -13.120 1.939
253 HZ3 LYS 34 HZ3 LYS 34 3.700 -14.612 2.633
254 H ARG 35 H ARG 35 1.933 -10.186 -2.975
255 HA ARG 35 HA ARG 35 2.341 -8.069 -4.851
256 HB2 ARG 35 HB2 ARG 35 -0.037 -9.718 -4.073
257 HB3 ARG 35 HB3 ARG 35 -0.174 -8.375 -5.192
258 HG2 ARG 35 HG2 ARG 35 1.680 -9.521 -6.512
259 HG3 ARG 35 HG3 ARG 35 1.327 -10.934 -5.511
260 HD2 ARG 35 HD2 ARG 35 0.088 -10.975 -7.636
261 HD3 ARG 35 HD3 ARG 35 -0.985 -10.905 -6.237
262 HE ARG 35 HE ARG 35 -0.481 -8.277 -7.115
263 HH11 ARG 35 HH11 ARG 35 -2.199 -11.179 -8.088
264 HH12 ARG 35 HH12 ARG 35 -3.344 -10.322 -9.069
265 HH21 ARG 35 HH21 ARG 35 -1.980 -7.156 -8.413
266 HH22 ARG 35 HH22 ARG 35 -3.215 -8.030 -9.262
267 H TRP 36 H TRP 36 2.747 -7.177 -2.211
268 HA TRP 36 HA TRP 36 0.360 -6.016 -1.180
269 HB2 TRP 36 HB2 TRP 36 3.262 -5.881 -0.438
270 HB3 TRP 36 HB3 TRP 36 2.079 -4.832 0.343
271 HD1 TRP 36 HD1 TRP 36 2.159 -8.652 -0.461
272 HE1 TRP 36 HE1 TRP 36 1.338 -9.894 1.637
273 HE3 TRP 36 HE3 TRP 36 1.343 -4.631 2.574
274 HZ2 TRP 36 HZ2 TRP 36 0.461 -9.231 4.256
275 HZ3 TRP 36 HZ3 TRP 36 0.518 -5.019 4.828
276 HH2 TRP 36 HH2 TRP 36 0.088 -7.261 5.665
277 H THR 37 H THR 37 -0.571 -4.293 -1.809
278 HA THR 37 HA THR 37 0.688 -2.479 -3.682
279 HB THR 37 HB THR 37 -2.125 -2.733 -2.594
280 HG1 THR 37 HG1 THR 37 -0.776 -3.864 -4.641
281 HG21 THR 37 HG21 THR 37 -1.676 -0.373 -3.095
282 HG22 THR 37 HG22 THR 37 -2.826 -1.070 -4.235
283 HG23 THR 37 HG23 THR 37 -1.147 -0.820 -4.718
284 H CYS 38 H CYS 38 1.043 -0.222 -3.232
285 HA CYS 38 HA CYS 38 1.193 0.405 -0.394
286 HB2 CYS 38 HB2 CYS 38 1.939 2.158 -2.743
287 HB3 CYS 38 HB3 CYS 38 2.465 2.328 -1.071
288 H CYS 39 H CYS 39 -0.792 0.876 0.410
289 HA CYS 39 HA CYS 39 -2.690 2.258 -1.300
290 HB2 CYS 39 HB2 CYS 39 -3.189 0.271 0.328
291 HB3 CYS 39 HB3 CYS 39 -3.268 1.550 1.534
292 H LYS 40 H LYS 40 -2.734 4.358 -1.333
293 HA LYS 40 HA LYS 40 -1.796 5.902 0.907
294 HB2 LYS 40 HB2 LYS 40 -1.448 6.707 -1.407
295 HB3 LYS 40 HB3 LYS 40 -3.191 6.868 -1.586
296 HG2 LYS 40 HG2 LYS 40 -3.308 8.618 -0.045
297 HG3 LYS 40 HG3 LYS 40 -1.707 8.264 0.608
298 HD2 LYS 40 HD2 LYS 40 -0.690 8.955 -1.484
299 HD3 LYS 40 HD3 LYS 40 -2.284 9.291 -2.163
300 HE2 LYS 40 HE2 LYS 40 -1.025 10.666 0.208
301 HE3 LYS 40 HE3 LYS 40 -1.208 11.344 -1.407
302 HZ1 LYS 40 HZ1 LYS 40 -3.602 11.238 -1.152
303 HZ2 LYS 40 HZ2 LYS 40 -2.920 12.136 0.105
304 HZ3 LYS 40 HZ3 LYS 40 -3.447 10.552 0.391
305 H GLU 41 H GLU 41 -3.028 5.402 2.559
306 HA GLU 41 HA GLU 41 -4.646 5.693 4.072
307 HB2 GLU 41 HB2 GLU 41 -5.953 7.410 1.961
308 HB3 GLU 41 HB3 GLU 41 -6.438 7.300 3.645
309 HG2 GLU 41 HG2 GLU 41 -4.625 8.472 4.403
310 HG3 GLU 41 HG3 GLU 41 -3.632 8.026 3.018
311 H ILE 42 H ILE 42 -6.693 4.917 4.682
312 HA ILE 42 HA ILE 42 -8.020 3.193 2.714
313 HB ILE 42 HB ILE 42 -8.249 1.511 4.642
314 HG12 ILE 42 HG12 ILE 42 -5.915 3.178 5.606
315 HG13 ILE 42 HG13 ILE 42 -7.434 2.905 6.447
316 HG21 ILE 42 HG21 ILE 42 -6.986 1.054 2.637
317 HG22 ILE 42 HG22 ILE 42 -6.119 0.437 4.044
318 HG23 ILE 42 HG23 ILE 42 -5.600 1.938 3.277
319 HD11 ILE 42 HD11 ILE 42 -5.265 0.892 5.921
320 HD12 ILE 42 HD12 ILE 42 -6.827 0.515 6.651
321 HD13 ILE 42 HD13 ILE 42 -5.709 1.607 7.469
Start of MODEL 6
1 H1 ASP 1 H1 ASP 1 20.863 3.891 1.501
2 H2 ASP 1 H2 ASP 1 21.721 5.348 1.554
3 H3 ASP 1 H3 ASP 1 20.626 5.058 0.296
4 HA ASP 1 HA ASP 1 19.744 6.595 1.967
5 HB2 ASP 1 HB2 ASP 1 18.398 4.804 0.575
6 HB3 ASP 1 HB3 ASP 1 18.168 4.042 2.154
7 H THR 2 H THR 2 21.735 4.445 3.299
8 HA THR 2 HA THR 2 22.304 3.817 5.424
9 HB THR 2 HB THR 2 19.924 5.382 6.446
10 HG1 THR 2 HG1 THR 2 20.918 7.099 5.706
11 HG21 THR 2 HG21 THR 2 22.605 4.711 7.683
12 HG22 THR 2 HG22 THR 2 21.054 3.986 8.108
13 HG23 THR 2 HG23 THR 2 21.348 5.693 8.437
14 H THR 3 H THR 3 20.067 2.743 3.676
15 HA THR 3 HA THR 3 19.106 0.575 5.150
16 HB THR 3 HB THR 3 17.706 2.204 6.280
17 HG1 THR 3 HG1 THR 3 16.270 0.675 6.225
18 HG21 THR 3 HG21 THR 3 17.653 3.992 4.697
19 HG22 THR 3 HG22 THR 3 15.992 3.485 5.031
20 HG23 THR 3 HG23 THR 3 16.781 2.986 3.535
21 H SER 4 H SER 4 17.020 -0.280 3.705
22 HA SER 4 HA SER 4 18.019 -0.792 1.155
23 HB2 SER 4 HB2 SER 4 15.121 -0.743 2.036
24 HB3 SER 4 HB3 SER 4 15.754 -1.571 0.613
25 HG SER 4 HG SER 4 17.213 -2.540 2.426
26 H ASP 5 H ASP 5 18.664 0.866 0.016
27 HA ASP 5 HA ASP 5 17.547 3.422 -0.008
28 HB2 ASP 5 HB2 ASP 5 19.924 2.881 -0.498
29 HB3 ASP 5 HB3 ASP 5 19.422 2.213 -2.045
30 H PHE 6 H PHE 6 15.467 3.531 -0.587
31 HA PHE 6 HA PHE 6 14.938 4.018 -3.278
32 HB2 PHE 6 HB2 PHE 6 13.242 2.186 -3.646
33 HB3 PHE 6 HB3 PHE 6 14.934 1.702 -3.658
34 HD1 PHE 6 HD1 PHE 6 14.905 -0.514 -3.094
35 HD2 PHE 6 HD2 PHE 6 12.700 2.237 -0.714
36 HE1 PHE 6 HE1 PHE 6 14.458 -2.294 -1.462
37 HE2 PHE 6 HE2 PHE 6 12.250 0.458 0.926
38 HZ PHE 6 HZ PHE 6 13.135 -1.809 0.553
39 H HIS 7 H HIS 7 12.369 4.129 -3.561
40 HA HIS 7 HA HIS 7 11.537 5.772 -1.301
41 HB2 HIS 7 HB2 HIS 7 10.340 5.487 -4.060
42 HB3 HIS 7 HB3 HIS 7 9.731 6.560 -2.811
43 HD1 HIS 7 HD1 HIS 7 11.660 6.783 -5.718
44 HD2 HIS 7 HD2 HIS 7 12.125 8.239 -1.852
45 HE1 HIS 7 HE1 HIS 7 13.289 8.689 -5.908
46 HE2 HIS 7 HE2 HIS 7 13.422 9.660 -3.586
47 H THR 8 H THR 8 10.544 4.759 0.250
48 HA THR 8 HA THR 8 9.292 2.244 -0.097
49 HB THR 8 HB THR 8 8.534 2.723 2.339
50 HG1 THR 8 HG1 THR 8 9.639 4.418 3.331
51 HG21 THR 8 HG21 THR 8 10.775 2.201 3.187
52 HG22 THR 8 HG22 THR 8 11.467 2.636 1.625
53 HG23 THR 8 HG23 THR 8 10.390 1.246 1.756
54 H CYS 9 H CYS 9 7.047 2.209 1.399
55 HA CYS 9 HA CYS 9 5.172 3.464 -0.444
56 HB2 CYS 9 HB2 CYS 9 4.828 1.362 1.710
57 HB3 CYS 9 HB3 CYS 9 3.515 1.967 0.699
58 H GLN 10 H GLN 10 5.209 2.879 3.059
59 HA GLN 10 HA GLN 10 3.542 5.164 3.540
60 HB2 GLN 10 HB2 GLN 10 4.067 4.578 5.976
61 HB3 GLN 10 HB3 GLN 10 3.194 3.377 5.037
62 HG2 GLN 10 HG2 GLN 10 5.372 2.247 4.622
63 HG3 GLN 10 HG3 GLN 10 6.104 3.357 5.776
64 HE21 GLN 10 HE21 GLN 10 4.068 0.626 5.326
65 HE22 GLN 10 HE22 GLN 10 3.911 0.199 6.989
66 H ASP 11 H ASP 11 4.357 7.060 3.279
67 HA ASP 11 HA ASP 11 6.308 8.408 4.584
68 HB2 ASP 11 HB2 ASP 11 7.931 6.690 3.697
69 HB3 ASP 11 HB3 ASP 11 7.536 7.219 2.063
70 H LYS 12 H LYS 12 5.181 7.616 1.361
71 HA LYS 12 HA LYS 12 5.015 10.491 0.724
72 HB2 LYS 12 HB2 LYS 12 5.248 8.282 -1.303
73 HB3 LYS 12 HB3 LYS 12 5.579 9.995 -1.522
74 HG2 LYS 12 HG2 LYS 12 7.451 9.657 0.185
75 HG3 LYS 12 HG3 LYS 12 7.213 7.930 -0.092
76 HD2 LYS 12 HD2 LYS 12 7.776 8.126 -2.379
77 HD3 LYS 12 HD3 LYS 12 7.760 9.896 -2.295
78 HE2 LYS 12 HE2 LYS 12 9.704 7.993 -1.013
79 HE3 LYS 12 HE3 LYS 12 10.038 9.226 -2.227
80 HZ1 LYS 12 HZ1 LYS 12 10.756 10.035 -0.118
81 HZ2 LYS 12 HZ2 LYS 12 9.276 9.667 0.615
82 HZ3 LYS 12 HZ3 LYS 12 9.371 10.906 -0.540
83 H GLY 13 H GLY 13 3.412 7.403 0.654
84 HA2 GLY 13 HA2 GLY 13 1.001 8.726 -0.398
85 HA3 GLY 13 HA3 GLY 13 1.450 7.103 -0.876
86 H GLY 14 H GLY 14 1.682 5.555 0.926
87 HA2 GLY 14 HA2 GLY 14 0.293 5.980 3.350
88 HA3 GLY 14 HA3 GLY 14 -0.749 5.197 2.174
89 H HIS 15 H HIS 15 -0.764 3.461 3.762
90 HA HIS 15 HA HIS 15 1.734 2.125 4.357
91 HB2 HIS 15 HB2 HIS 15 0.480 0.890 5.969
92 HB3 HIS 15 HB3 HIS 15 -0.155 2.524 6.034
93 HD1 HIS 15 HD1 HIS 15 -1.419 -0.637 6.373
94 HD2 HIS 15 HD2 HIS 15 -2.453 2.514 3.856
95 HE1 HIS 15 HE1 HIS 15 -3.804 -1.053 5.705
96 HE2 HIS 15 HE2 HIS 15 -4.440 0.927 4.298
97 H CYS 16 H CYS 16 1.881 -0.217 4.152
98 HA CYS 16 HA CYS 16 1.222 -1.039 1.480
99 HB2 CYS 16 HB2 CYS 16 2.599 -2.526 3.727
100 HB3 CYS 16 HB3 CYS 16 2.549 -3.029 2.038
101 H VAL 17 H VAL 17 -0.377 -2.370 0.862
102 HA VAL 17 HA VAL 17 -1.933 -3.669 2.998
103 HB VAL 17 HB VAL 17 -3.949 -3.415 1.638
104 HG11 VAL 17 HG11 VAL 17 -3.494 -1.737 3.306
105 HG12 VAL 17 HG12 VAL 17 -4.243 -0.985 1.898
106 HG13 VAL 17 HG13 VAL 17 -2.507 -0.822 2.166
107 HG21 VAL 17 HG21 VAL 17 -3.967 -1.925 -0.322
108 HG22 VAL 17 HG22 VAL 17 -2.973 -3.357 -0.585
109 HG23 VAL 17 HG23 VAL 17 -2.211 -1.806 -0.232
110 H SER 18 H SER 18 -2.490 -5.691 2.794
111 HA SER 18 HA SER 18 -1.120 -7.343 0.944
112 HB2 SER 18 HB2 SER 18 -2.239 -9.169 2.083
113 HB3 SER 18 HB3 SER 18 -1.649 -8.021 3.269
114 HG SER 18 HG SER 18 -3.607 -7.857 3.956
115 HA PRO 19 HA PRO 19 -3.707 -7.501 -2.547
116 HB2 PRO 19 HB2 PRO 19 -3.899 -10.213 -3.012
117 HB3 PRO 19 HB3 PRO 19 -2.537 -9.191 -3.476
118 HG2 PRO 19 HG2 PRO 19 -2.863 -10.927 -1.058
119 HG3 PRO 19 HG3 PRO 19 -1.451 -10.730 -2.114
120 HD2 PRO 19 HD2 PRO 19 -1.543 -9.505 0.237
121 HD3 PRO 19 HD3 PRO 19 -0.893 -8.663 -1.186
122 H LYS 20 H LYS 20 -5.163 -7.875 0.190
123 HA LYS 20 HA LYS 20 -7.732 -8.408 -1.039
124 HB2 LYS 20 HB2 LYS 20 -6.876 -10.628 -0.146
125 HB3 LYS 20 HB3 LYS 20 -6.977 -9.926 1.463
126 HG2 LYS 20 HG2 LYS 20 -9.392 -9.531 1.093
127 HG3 LYS 20 HG3 LYS 20 -9.254 -10.363 -0.458
128 HD2 LYS 20 HD2 LYS 20 -8.492 -12.382 0.717
129 HD3 LYS 20 HD3 LYS 20 -8.677 -11.543 2.259
130 HE2 LYS 20 HE2 LYS 20 -10.878 -12.105 0.276
131 HE3 LYS 20 HE3 LYS 20 -10.599 -12.980 1.779
132 HZ1 LYS 20 HZ1 LYS 20 -11.226 -10.078 1.603
133 HZ2 LYS 20 HZ2 LYS 20 -11.062 -10.987 3.021
134 HZ3 LYS 20 HZ3 LYS 20 -12.348 -11.288 1.967
135 H ILE 21 H ILE 21 -6.635 -6.031 -0.188
136 HA ILE 21 HA ILE 21 -8.180 -5.418 2.256
137 HB ILE 21 HB ILE 21 -5.653 -4.074 1.282
138 HG12 ILE 21 HG12 ILE 21 -5.273 -6.327 2.225
139 HG13 ILE 21 HG13 ILE 21 -4.555 -5.059 3.208
140 HG21 ILE 21 HG21 ILE 21 -5.696 -2.842 3.397
141 HG22 ILE 21 HG22 ILE 21 -7.243 -3.588 3.796
142 HG23 ILE 21 HG23 ILE 21 -7.121 -2.498 2.415
143 HD11 ILE 21 HD11 ILE 21 -7.127 -6.512 3.777
144 HD12 ILE 21 HD12 ILE 21 -6.451 -5.212 4.757
145 HD13 ILE 21 HD13 ILE 21 -5.585 -6.741 4.600
146 H ARG 22 H ARG 22 -9.303 -3.434 2.302
147 HA ARG 22 HA ARG 22 -10.260 -2.389 -0.162
148 HB2 ARG 22 HB2 ARG 22 -11.664 -2.308 1.804
149 HB3 ARG 22 HB3 ARG 22 -10.457 -1.381 2.682
150 HG2 ARG 22 HG2 ARG 22 -10.771 0.425 0.941
151 HG3 ARG 22 HG3 ARG 22 -12.185 -0.480 0.400
152 HD2 ARG 22 HD2 ARG 22 -12.919 1.209 1.925
153 HD3 ARG 22 HD3 ARG 22 -13.074 -0.352 2.719
154 HE ARG 22 HE ARG 22 -10.944 1.616 3.265
155 HH11 ARG 22 HH11 ARG 22 -12.963 -1.066 4.279
156 HH12 ARG 22 HH12 ARG 22 -12.444 -0.991 5.929
157 HH21 ARG 22 HH21 ARG 22 -10.283 1.737 5.419
158 HH22 ARG 22 HH22 ARG 22 -10.906 0.604 6.584
159 H CYS 23 H CYS 23 -8.841 -1.314 -1.472
160 HA CYS 23 HA CYS 23 -7.075 0.659 -0.228
161 HB2 CYS 23 HB2 CYS 23 -6.324 -1.076 -2.032
162 HB3 CYS 23 HB3 CYS 23 -7.090 0.041 -3.160
163 H LEU 24 H LEU 24 -7.419 2.786 -0.399
164 HA LEU 24 HA LEU 24 -9.773 3.695 -1.828
165 HB2 LEU 24 HB2 LEU 24 -8.071 4.740 0.314
166 HB3 LEU 24 HB3 LEU 24 -8.591 5.955 -0.838
167 HG LEU 24 HG LEU 24 -10.940 5.327 -0.431
168 HD11 LEU 24 HD11 LEU 24 -9.809 3.518 1.697
169 HD12 LEU 24 HD12 LEU 24 -10.590 2.993 0.207
170 HD13 LEU 24 HD13 LEU 24 -11.515 3.868 1.427
171 HD21 LEU 24 HD21 LEU 24 -9.930 7.146 0.821
172 HD22 LEU 24 HD22 LEU 24 -9.373 6.008 2.049
173 HD23 LEU 24 HD23 LEU 24 -11.099 6.275 1.813
174 H GLU 25 H GLU 25 -6.344 4.686 -1.716
175 HA GLU 25 HA GLU 25 -6.539 5.085 -4.620
176 HB2 GLU 25 HB2 GLU 25 -6.663 7.286 -3.506
177 HB3 GLU 25 HB3 GLU 25 -5.139 6.951 -2.697
178 HG2 GLU 25 HG2 GLU 25 -4.023 6.826 -4.877
179 HG3 GLU 25 HG3 GLU 25 -5.552 7.205 -5.667
180 H GLU 26 H GLU 26 -5.075 3.919 -5.644
181 HA GLU 26 HA GLU 26 -3.068 2.501 -4.208
182 HB2 GLU 26 HB2 GLU 26 -3.534 2.796 -7.175
183 HB3 GLU 26 HB3 GLU 26 -2.333 1.731 -6.460
184 HG2 GLU 26 HG2 GLU 26 -4.109 0.513 -5.302
185 HG3 GLU 26 HG3 GLU 26 -5.308 1.567 -6.043
186 H GLN 27 H GLN 27 -0.931 2.776 -4.130
187 HA GLN 27 HA GLN 27 0.210 5.225 -5.270
188 HB2 GLN 27 HB2 GLN 27 0.067 6.058 -3.178
189 HB3 GLN 27 HB3 GLN 27 -0.194 4.483 -2.456
190 HG2 GLN 27 HG2 GLN 27 1.769 5.153 -1.488
191 HG3 GLN 27 HG3 GLN 27 2.345 4.176 -2.831
192 HE21 GLN 27 HE21 GLN 27 3.716 6.241 -1.391
193 HE22 GLN 27 HE22 GLN 27 4.154 7.438 -2.558
194 H LEU 28 H LEU 28 2.482 5.162 -5.544
195 HA LEU 28 HA LEU 28 3.482 2.458 -5.979
196 HB2 LEU 28 HB2 LEU 28 4.879 3.326 -7.640
197 HB3 LEU 28 HB3 LEU 28 3.352 4.134 -7.870
198 HG LEU 28 HG LEU 28 5.687 5.395 -6.429
199 HD11 LEU 28 HD11 LEU 28 4.880 5.675 -9.318
200 HD12 LEU 28 HD12 LEU 28 6.322 4.854 -8.720
201 HD13 LEU 28 HD13 LEU 28 6.142 6.595 -8.498
202 HD21 LEU 28 HD21 LEU 28 3.160 6.543 -7.619
203 HD22 LEU 28 HD22 LEU 28 4.494 7.490 -6.959
204 HD23 LEU 28 HD23 LEU 28 3.563 6.430 -5.905
205 H GLY 29 H GLY 29 5.035 1.665 -4.739
206 HA2 GLY 29 HA2 GLY 29 7.218 3.192 -3.786
207 HA3 GLY 29 HA3 GLY 29 6.073 2.915 -2.479
208 H LEU 30 H LEU 30 8.021 1.752 -1.624
209 HA LEU 30 HA LEU 30 8.329 -0.908 -2.820
210 HB2 LEU 30 HB2 LEU 30 10.159 0.850 -1.267
211 HB3 LEU 30 HB3 LEU 30 10.380 -0.880 -1.152
212 HG LEU 30 HG LEU 30 11.879 0.033 -2.807
213 HD11 LEU 30 HD11 LEU 30 11.309 -1.331 -4.720
214 HD12 LEU 30 HD12 LEU 30 9.642 -1.455 -4.165
215 HD13 LEU 30 HD13 LEU 30 10.940 -2.191 -3.226
216 HD21 LEU 30 HD21 LEU 30 11.147 1.219 -4.750
217 HD22 LEU 30 HD22 LEU 30 10.508 2.033 -3.314
218 HD23 LEU 30 HD23 LEU 30 9.454 1.011 -4.294
219 H CYS 31 H CYS 31 6.712 -2.067 -1.905
220 HA CYS 31 HA CYS 31 6.797 -2.384 1.016
221 HB2 CYS 31 HB2 CYS 31 4.795 -3.489 -0.966
222 HB3 CYS 31 HB3 CYS 31 4.704 -3.623 0.784
223 HA PRO 32 HA PRO 32 9.004 -6.079 -0.180
224 HB2 PRO 32 HB2 PRO 32 10.245 -6.550 2.114
225 HB3 PRO 32 HB3 PRO 32 10.605 -5.071 1.214
226 HG2 PRO 32 HG2 PRO 32 8.922 -5.450 3.653
227 HG3 PRO 32 HG3 PRO 32 9.996 -4.098 3.232
228 HD2 PRO 32 HD2 PRO 32 7.191 -4.220 2.869
229 HD3 PRO 32 HD3 PRO 32 8.282 -2.991 2.205
230 H LEU 33 H LEU 33 7.314 -7.532 -0.525
231 HA LEU 33 HA LEU 33 7.148 -9.657 1.336
232 HB2 LEU 33 HB2 LEU 33 4.775 -7.836 1.095
233 HB3 LEU 33 HB3 LEU 33 4.542 -9.546 1.386
234 HG LEU 33 HG LEU 33 6.069 -7.642 3.162
235 HD11 LEU 33 HD11 LEU 33 3.674 -7.299 3.285
236 HD12 LEU 33 HD12 LEU 33 4.284 -8.038 4.765
237 HD13 LEU 33 HD13 LEU 33 3.429 -9.021 3.576
238 HD21 LEU 33 HD21 LEU 33 6.034 -9.613 4.725
239 HD22 LEU 33 HD22 LEU 33 7.123 -9.728 3.344
240 HD23 LEU 33 HD23 LEU 33 5.582 -10.596 3.329
241 H LYS 34 H LYS 34 4.287 -9.129 -0.521
242 HA LYS 34 HA LYS 34 5.344 -10.954 -2.570
243 HB2 LYS 34 HB2 LYS 34 2.530 -10.804 -1.460
244 HB3 LYS 34 HB3 LYS 34 3.035 -11.839 -2.794
245 HG2 LYS 34 HG2 LYS 34 4.679 -12.900 -1.223
246 HG3 LYS 34 HG3 LYS 34 3.909 -11.995 0.078
247 HD2 LYS 34 HD2 LYS 34 2.782 -13.995 0.205
248 HD3 LYS 34 HD3 LYS 34 1.722 -13.079 -0.862
249 HE2 LYS 34 HE2 LYS 34 3.844 -15.008 -1.797
250 HE3 LYS 34 HE3 LYS 34 2.141 -15.413 -1.611
251 HZ1 LYS 34 HZ1 LYS 34 3.329 -13.474 -3.514
252 HZ2 LYS 34 HZ2 LYS 34 1.669 -13.610 -3.241
253 HZ3 LYS 34 HZ3 LYS 34 2.529 -14.918 -3.879
254 H ARG 35 H ARG 35 2.187 -9.562 -2.649
255 HA ARG 35 HA ARG 35 2.946 -7.919 -4.936
256 HB2 ARG 35 HB2 ARG 35 0.712 -8.376 -5.871
257 HB3 ARG 35 HB3 ARG 35 1.705 -9.817 -5.710
258 HG2 ARG 35 HG2 ARG 35 0.512 -10.515 -3.779
259 HG3 ARG 35 HG3 ARG 35 -0.389 -8.999 -3.731
260 HD2 ARG 35 HD2 ARG 35 -0.460 -10.897 -6.052
261 HD3 ARG 35 HD3 ARG 35 -1.618 -10.958 -4.723
262 HE ARG 35 HE ARG 35 -1.420 -8.353 -5.918
263 HH11 ARG 35 HH11 ARG 35 -2.911 -11.512 -6.206
264 HH12 ARG 35 HH12 ARG 35 -4.277 -10.928 -7.100
265 HH21 ARG 35 HH21 ARG 35 -3.207 -7.582 -7.107
266 HH22 ARG 35 HH22 ARG 35 -4.448 -8.686 -7.608
267 H TRP 36 H TRP 36 2.987 -7.034 -2.315
268 HA TRP 36 HA TRP 36 0.459 -6.049 -1.456
269 HB2 TRP 36 HB2 TRP 36 3.284 -5.796 -0.488
270 HB3 TRP 36 HB3 TRP 36 2.025 -4.772 0.197
271 HD1 TRP 36 HD1 TRP 36 2.106 -8.594 -0.587
272 HE1 TRP 36 HE1 TRP 36 1.280 -9.833 1.489
273 HE3 TRP 36 HE3 TRP 36 1.362 -4.579 2.466
274 HZ2 TRP 36 HZ2 TRP 36 0.420 -9.178 4.117
275 HZ3 TRP 36 HZ3 TRP 36 0.534 -4.971 4.721
276 HH2 TRP 36 HH2 TRP 36 0.075 -7.215 5.538
277 H THR 37 H THR 37 -0.489 -4.245 -1.897
278 HA THR 37 HA THR 37 0.760 -2.379 -3.727
279 HB THR 37 HB THR 37 -2.062 -2.720 -2.704
280 HG1 THR 37 HG1 THR 37 -0.683 -3.300 -5.102
281 HG21 THR 37 HG21 THR 37 -1.080 -0.686 -4.714
282 HG22 THR 37 HG22 THR 37 -1.667 -0.328 -3.089
283 HG23 THR 37 HG23 THR 37 -2.766 -1.001 -4.294
284 H CYS 38 H CYS 38 1.222 -0.218 -3.233
285 HA CYS 38 HA CYS 38 1.250 0.468 -0.422
286 HB2 CYS 38 HB2 CYS 38 1.934 2.227 -2.785
287 HB3 CYS 38 HB3 CYS 38 2.447 2.433 -1.113
288 H CYS 39 H CYS 39 -0.622 1.150 0.478
289 HA CYS 39 HA CYS 39 -2.608 2.286 -1.343
290 HB2 CYS 39 HB2 CYS 39 -3.018 0.337 0.368
291 HB3 CYS 39 HB3 CYS 39 -3.214 1.671 1.499
292 H LYS 40 H LYS 40 -2.709 4.356 -1.476
293 HA LYS 40 HA LYS 40 -1.747 6.113 0.576
294 HB2 LYS 40 HB2 LYS 40 -1.669 6.621 -1.884
295 HB3 LYS 40 HB3 LYS 40 -3.416 6.785 -1.859
296 HG2 LYS 40 HG2 LYS 40 -1.728 8.439 -0.032
297 HG3 LYS 40 HG3 LYS 40 -1.907 8.889 -1.727
298 HD2 LYS 40 HD2 LYS 40 -4.368 8.892 -1.417
299 HD3 LYS 40 HD3 LYS 40 -4.122 8.550 0.297
300 HE2 LYS 40 HE2 LYS 40 -2.839 10.634 0.507
301 HE3 LYS 40 HE3 LYS 40 -3.141 10.979 -1.195
302 HZ1 LYS 40 HZ1 LYS 40 -4.674 12.170 0.223
303 HZ2 LYS 40 HZ2 LYS 40 -5.209 10.723 0.924
304 HZ3 LYS 40 HZ3 LYS 40 -5.512 11.037 -0.715
305 H GLU 41 H GLU 41 -2.874 5.565 2.347
306 HA GLU 41 HA GLU 41 -4.445 5.649 3.933
307 HB2 GLU 41 HB2 GLU 41 -5.915 7.455 2.018
308 HB3 GLU 41 HB3 GLU 41 -6.307 7.215 3.713
309 HG2 GLU 41 HG2 GLU 41 -4.067 8.079 4.310
310 HG3 GLU 41 HG3 GLU 41 -3.791 8.430 2.605
311 H ILE 42 H ILE 42 -6.667 5.014 4.495
312 HA ILE 42 HA ILE 42 -7.935 3.278 2.514
313 HB ILE 42 HB ILE 42 -8.185 1.525 4.356
314 HG12 ILE 42 HG12 ILE 42 -5.847 3.102 5.469
315 HG13 ILE 42 HG13 ILE 42 -7.421 2.904 6.228
316 HG21 ILE 42 HG21 ILE 42 -5.462 1.996 3.149
317 HG22 ILE 42 HG22 ILE 42 -6.823 1.187 2.373
318 HG23 ILE 42 HG23 ILE 42 -6.057 0.463 3.787
319 HD11 ILE 42 HD11 ILE 42 -5.331 0.790 5.780
320 HD12 ILE 42 HD12 ILE 42 -6.955 0.471 6.397
321 HD13 ILE 42 HD13 ILE 42 -5.844 1.487 7.316
Start of MODEL 7
1 H1 ASP 1 H1 ASP 1 16.231 -6.046 -7.456
2 H2 ASP 1 H2 ASP 1 14.594 -6.052 -7.040
3 H3 ASP 1 H3 ASP 1 15.717 -6.834 -6.052
4 HA ASP 1 HA ASP 1 15.542 -3.923 -6.551
5 HB2 ASP 1 HB2 ASP 1 15.033 -5.511 -4.021
6 HB3 ASP 1 HB3 ASP 1 14.932 -3.761 -4.184
7 H THR 2 H THR 2 17.444 -6.613 -5.588
8 HA THR 2 HA THR 2 19.645 -6.815 -5.121
9 HB THR 2 HB THR 2 19.860 -3.812 -5.320
10 HG1 THR 2 HG1 THR 2 20.867 -5.004 -7.460
11 HG21 THR 2 HG21 THR 2 22.230 -4.265 -5.781
12 HG22 THR 2 HG22 THR 2 21.947 -5.988 -5.543
13 HG23 THR 2 HG23 THR 2 21.760 -4.870 -4.193
14 H THR 3 H THR 3 18.446 -3.910 -3.535
15 HA THR 3 HA THR 3 18.519 -5.108 -0.952
16 HB THR 3 HB THR 3 20.945 -4.574 -1.276
17 HG1 THR 3 HG1 THR 3 20.777 -4.405 0.817
18 HG21 THR 3 HG21 THR 3 21.632 -2.200 -1.202
19 HG22 THR 3 HG22 THR 3 19.942 -1.728 -1.385
20 HG23 THR 3 HG23 THR 3 20.757 -2.608 -2.678
21 H SER 4 H SER 4 18.099 -3.233 0.741
22 HA SER 4 HA SER 4 15.823 -1.845 -0.325
23 HB2 SER 4 HB2 SER 4 15.576 -1.125 2.124
24 HB3 SER 4 HB3 SER 4 15.419 -2.843 1.766
25 HG SER 4 HG SER 4 17.904 -1.702 2.499
26 H ASP 5 H ASP 5 16.534 -0.241 -1.603
27 HA ASP 5 HA ASP 5 17.141 2.215 -0.232
28 HB2 ASP 5 HB2 ASP 5 19.419 1.437 -0.664
29 HB3 ASP 5 HB3 ASP 5 19.021 1.126 -2.350
30 H PHE 6 H PHE 6 15.237 3.037 -0.946
31 HA PHE 6 HA PHE 6 14.839 3.845 -3.615
32 HB2 PHE 6 HB2 PHE 6 12.756 2.257 -3.877
33 HB3 PHE 6 HB3 PHE 6 14.358 1.680 -4.323
34 HD1 PHE 6 HD1 PHE 6 12.215 1.844 -1.254
35 HD2 PHE 6 HD2 PHE 6 14.909 -0.429 -3.643
36 HE1 PHE 6 HE1 PHE 6 11.978 -0.057 0.290
37 HE2 PHE 6 HE2 PHE 6 14.673 -2.332 -2.103
38 HZ PHE 6 HZ PHE 6 13.207 -2.148 -0.132
39 H HIS 7 H HIS 7 12.173 4.101 -3.812
40 HA HIS 7 HA HIS 7 11.462 5.668 -1.462
41 HB2 HIS 7 HB2 HIS 7 9.985 5.354 -4.085
42 HB3 HIS 7 HB3 HIS 7 9.554 6.461 -2.797
43 HD1 HIS 7 HD1 HIS 7 11.186 6.506 -5.926
44 HD2 HIS 7 HD2 HIS 7 11.949 8.227 -2.216
45 HE1 HIS 7 HE1 HIS 7 12.753 8.421 -6.383
46 HE2 HIS 7 HE2 HIS 7 13.142 9.499 -4.140
47 H THR 8 H THR 8 10.674 4.515 0.141
48 HA THR 8 HA THR 8 9.292 2.069 -0.240
49 HB THR 8 HB THR 8 8.733 2.493 2.289
50 HG1 THR 8 HG1 THR 8 9.900 4.066 3.241
51 HG21 THR 8 HG21 THR 8 10.349 0.852 1.376
52 HG22 THR 8 HG22 THR 8 10.889 1.571 2.894
53 HG23 THR 8 HG23 THR 8 11.583 2.113 1.367
54 H CYS 9 H CYS 9 7.194 2.052 1.440
55 HA CYS 9 HA CYS 9 5.253 3.448 -0.208
56 HB2 CYS 9 HB2 CYS 9 4.886 1.088 0.107
57 HB3 CYS 9 HB3 CYS 9 5.007 1.252 1.861
58 H GLN 10 H GLN 10 5.332 2.678 3.248
59 HA GLN 10 HA GLN 10 3.808 5.007 3.899
60 HB2 GLN 10 HB2 GLN 10 4.590 4.256 6.301
61 HB3 GLN 10 HB3 GLN 10 3.397 3.313 5.416
62 HG2 GLN 10 HG2 GLN 10 5.279 1.893 4.599
63 HG3 GLN 10 HG3 GLN 10 6.320 2.733 5.743
64 HE21 GLN 10 HE21 GLN 10 5.614 -0.065 5.595
65 HE22 GLN 10 HE22 GLN 10 4.870 -0.465 7.100
66 H ASP 11 H ASP 11 4.695 6.866 3.631
67 HA ASP 11 HA ASP 11 6.794 8.073 4.870
68 HB2 ASP 11 HB2 ASP 11 8.244 6.306 3.756
69 HB3 ASP 11 HB3 ASP 11 7.779 6.987 2.197
70 H LYS 12 H LYS 12 5.354 7.485 1.711
71 HA LYS 12 HA LYS 12 5.300 10.402 1.247
72 HB2 LYS 12 HB2 LYS 12 5.335 8.349 -0.944
73 HB3 LYS 12 HB3 LYS 12 5.771 10.053 -1.028
74 HG2 LYS 12 HG2 LYS 12 7.715 9.518 0.465
75 HG3 LYS 12 HG3 LYS 12 7.316 7.813 0.242
76 HD2 LYS 12 HD2 LYS 12 7.700 7.938 -2.089
77 HD3 LYS 12 HD3 LYS 12 7.878 9.700 -2.022
78 HE2 LYS 12 HE2 LYS 12 9.682 7.637 -0.780
79 HE3 LYS 12 HE3 LYS 12 10.059 8.705 -2.129
80 HZ1 LYS 12 HZ1 LYS 12 11.041 9.552 -0.126
81 HZ2 LYS 12 HZ2 LYS 12 9.555 9.526 0.683
82 HZ3 LYS 12 HZ3 LYS 12 9.802 10.598 -0.608
83 H GLY 13 H GLY 13 3.557 7.376 0.964
84 HA2 GLY 13 HA2 GLY 13 1.215 8.903 0.023
85 HA3 GLY 13 HA3 GLY 13 1.623 7.334 -0.637
86 H GLY 14 H GLY 14 1.521 5.525 0.740
87 HA2 GLY 14 HA2 GLY 14 -0.409 5.827 2.946
88 HA3 GLY 14 HA3 GLY 14 -0.693 4.691 1.638
89 H HIS 15 H HIS 15 -0.799 3.326 3.620
90 HA HIS 15 HA HIS 15 1.832 2.352 4.432
91 HB2 HIS 15 HB2 HIS 15 0.678 1.165 6.164
92 HB3 HIS 15 HB3 HIS 15 0.009 2.784 6.132
93 HD1 HIS 15 HD1 HIS 15 -1.153 -0.377 6.750
94 HD2 HIS 15 HD2 HIS 15 -2.367 2.575 4.074
95 HE1 HIS 15 HE1 HIS 15 -3.541 -0.917 6.192
96 HE2 HIS 15 HE2 HIS 15 -4.205 0.787 4.464
97 H CYS 16 H CYS 16 2.067 -0.073 4.452
98 HA CYS 16 HA CYS 16 1.519 -1.004 1.794
99 HB2 CYS 16 HB2 CYS 16 2.892 -2.310 4.147
100 HB3 CYS 16 HB3 CYS 16 2.799 -3.012 2.536
101 H VAL 17 H VAL 17 -0.133 -2.208 1.156
102 HA VAL 17 HA VAL 17 -1.730 -3.537 3.242
103 HB VAL 17 HB VAL 17 -3.726 -3.197 1.957
104 HG11 VAL 17 HG11 VAL 17 -3.917 -0.759 2.018
105 HG12 VAL 17 HG12 VAL 17 -2.165 -0.634 2.175
106 HG13 VAL 17 HG13 VAL 17 -3.112 -1.400 3.449
107 HG21 VAL 17 HG21 VAL 17 -2.010 -1.829 -0.114
108 HG22 VAL 17 HG22 VAL 17 -3.772 -1.920 -0.134
109 HG23 VAL 17 HG23 VAL 17 -2.811 -3.391 -0.294
110 H SER 18 H SER 18 -2.448 -5.522 2.927
111 HA SER 18 HA SER 18 -0.987 -7.146 1.088
112 HB2 SER 18 HB2 SER 18 -2.206 -8.981 2.234
113 HB3 SER 18 HB3 SER 18 -1.361 -7.920 3.340
114 HG SER 18 HG SER 18 -3.956 -8.522 3.294
115 HA PRO 19 HA PRO 19 -3.589 -7.251 -2.364
116 HB2 PRO 19 HB2 PRO 19 -3.592 -9.907 -3.039
117 HB3 PRO 19 HB3 PRO 19 -2.256 -8.791 -3.347
118 HG2 PRO 19 HG2 PRO 19 -2.630 -10.714 -1.081
119 HG3 PRO 19 HG3 PRO 19 -1.180 -10.405 -2.054
120 HD2 PRO 19 HD2 PRO 19 -1.432 -9.333 0.366
121 HD3 PRO 19 HD3 PRO 19 -0.738 -8.391 -0.973
122 H LYS 20 H LYS 20 -5.101 -7.667 0.218
123 HA LYS 20 HA LYS 20 -7.557 -8.448 -1.146
124 HB2 LYS 20 HB2 LYS 20 -6.724 -10.476 0.071
125 HB3 LYS 20 HB3 LYS 20 -6.843 -9.572 1.571
126 HG2 LYS 20 HG2 LYS 20 -8.745 -11.056 1.272
127 HG3 LYS 20 HG3 LYS 20 -9.247 -9.367 1.288
128 HD2 LYS 20 HD2 LYS 20 -10.450 -10.513 -0.447
129 HD3 LYS 20 HD3 LYS 20 -9.293 -9.416 -1.198
130 HE2 LYS 20 HE2 LYS 20 -7.757 -11.301 -1.551
131 HE3 LYS 20 HE3 LYS 20 -8.940 -12.388 -0.823
132 HZ1 LYS 20 HZ1 LYS 20 -10.495 -11.760 -2.602
133 HZ2 LYS 20 HZ2 LYS 20 -9.096 -12.494 -3.202
134 HZ3 LYS 20 HZ3 LYS 20 -9.286 -10.820 -3.320
135 H ILE 21 H ILE 21 -5.942 -6.166 0.333
136 HA ILE 21 HA ILE 21 -7.999 -5.216 2.170
137 HB ILE 21 HB ILE 21 -5.379 -3.933 1.379
138 HG12 ILE 21 HG12 ILE 21 -5.017 -6.073 2.513
139 HG13 ILE 21 HG13 ILE 21 -4.537 -4.731 3.546
140 HG21 ILE 21 HG21 ILE 21 -5.684 -2.548 3.377
141 HG22 ILE 21 HG22 ILE 21 -7.256 -3.298 3.653
142 HG23 ILE 21 HG23 ILE 21 -6.990 -2.312 2.216
143 HD11 ILE 21 HD11 ILE 21 -6.650 -4.943 4.768
144 HD12 ILE 21 HD12 ILE 21 -5.687 -6.418 4.827
145 HD13 ILE 21 HD13 ILE 21 -7.083 -6.320 3.755
146 H ARG 22 H ARG 22 -9.308 -3.483 1.802
147 HA ARG 22 HA ARG 22 -9.903 -2.744 -0.857
148 HB2 ARG 22 HB2 ARG 22 -11.592 -2.751 0.919
149 HB3 ARG 22 HB3 ARG 22 -10.736 -1.460 1.752
150 HG2 ARG 22 HG2 ARG 22 -11.088 -0.043 -0.272
151 HG3 ARG 22 HG3 ARG 22 -12.132 -1.316 -0.904
152 HD2 ARG 22 HD2 ARG 22 -13.541 0.289 0.129
153 HD3 ARG 22 HD3 ARG 22 -13.482 -1.111 1.196
154 HE ARG 22 HE ARG 22 -11.500 0.668 2.025
155 HH11 ARG 22 HH11 ARG 22 -14.989 0.532 1.814
156 HH12 ARG 22 HH12 ARG 22 -15.239 1.604 3.156
157 HH21 ARG 22 HH21 ARG 22 -11.809 2.095 3.767
158 HH22 ARG 22 HH22 ARG 22 -13.429 2.494 4.272
159 H CYS 23 H CYS 23 -8.746 -1.426 -2.081
160 HA CYS 23 HA CYS 23 -6.992 0.550 -0.897
161 HB2 CYS 23 HB2 CYS 23 -6.623 -0.998 -3.019
162 HB3 CYS 23 HB3 CYS 23 -7.427 0.337 -3.842
163 H LEU 24 H LEU 24 -7.329 2.721 -0.877
164 HA LEU 24 HA LEU 24 -9.814 3.721 -2.067
165 HB2 LEU 24 HB2 LEU 24 -8.318 4.349 0.325
166 HB3 LEU 24 HB3 LEU 24 -8.581 5.790 -0.636
167 HG LEU 24 HG LEU 24 -10.333 5.502 1.046
168 HD11 LEU 24 HD11 LEU 24 -10.873 6.620 -1.057
169 HD12 LEU 24 HD12 LEU 24 -12.261 5.740 -0.420
170 HD13 LEU 24 HD13 LEU 24 -11.337 5.074 -1.764
171 HD21 LEU 24 HD21 LEU 24 -10.301 3.076 1.217
172 HD22 LEU 24 HD22 LEU 24 -10.958 2.940 -0.414
173 HD23 LEU 24 HD23 LEU 24 -11.929 3.659 0.871
174 H GLU 25 H GLU 25 -6.374 4.587 -1.789
175 HA GLU 25 HA GLU 25 -6.514 5.605 -4.539
176 HB2 GLU 25 HB2 GLU 25 -6.574 7.545 -3.084
177 HB3 GLU 25 HB3 GLU 25 -5.205 6.946 -2.166
178 HG2 GLU 25 HG2 GLU 25 -4.440 8.693 -3.579
179 HG3 GLU 25 HG3 GLU 25 -3.816 7.173 -4.217
180 H GLU 26 H GLU 26 -5.363 4.008 -5.550
181 HA GLU 26 HA GLU 26 -3.200 2.622 -4.375
182 HB2 GLU 26 HB2 GLU 26 -3.957 2.964 -7.269
183 HB3 GLU 26 HB3 GLU 26 -2.659 1.925 -6.709
184 HG2 GLU 26 HG2 GLU 26 -4.185 0.533 -5.526
185 HG3 GLU 26 HG3 GLU 26 -5.523 1.631 -5.851
186 H GLN 27 H GLN 27 -1.184 3.146 -4.104
187 HA GLN 27 HA GLN 27 -0.088 5.461 -5.539
188 HB2 GLN 27 HB2 GLN 27 -0.335 6.502 -3.551
189 HB3 GLN 27 HB3 GLN 27 -0.533 4.997 -2.671
190 HG2 GLN 27 HG2 GLN 27 1.387 5.793 -1.759
191 HG3 GLN 27 HG3 GLN 27 2.033 4.789 -3.051
192 HE21 GLN 27 HE21 GLN 27 3.416 6.859 -1.844
193 HE22 GLN 27 HE22 GLN 27 3.720 8.064 -3.039
194 H LEU 28 H LEU 28 2.255 5.488 -5.664
195 HA LEU 28 HA LEU 28 3.297 2.803 -5.915
196 HB2 LEU 28 HB2 LEU 28 4.896 3.629 -7.392
197 HB3 LEU 28 HB3 LEU 28 3.428 4.461 -7.800
198 HG LEU 28 HG LEU 28 5.106 6.051 -8.045
199 HD11 LEU 28 HD11 LEU 28 3.260 6.987 -6.840
200 HD12 LEU 28 HD12 LEU 28 4.773 7.734 -6.330
201 HD13 LEU 28 HD13 LEU 28 3.996 6.527 -5.306
202 HD21 LEU 28 HD21 LEU 28 6.947 4.905 -7.054
203 HD22 LEU 28 HD22 LEU 28 6.274 5.130 -5.440
204 HD23 LEU 28 HD23 LEU 28 6.842 6.525 -6.361
205 H GLY 29 H GLY 29 4.559 1.921 -4.507
206 HA2 GLY 29 HA2 GLY 29 6.683 3.275 -3.216
207 HA3 GLY 29 HA3 GLY 29 5.352 3.028 -2.093
208 H LEU 30 H LEU 30 8.005 1.816 -2.017
209 HA LEU 30 HA LEU 30 7.583 -0.885 -2.946
210 HB2 LEU 30 HB2 LEU 30 9.894 0.622 -1.870
211 HB3 LEU 30 HB3 LEU 30 9.922 -1.124 -1.736
212 HG LEU 30 HG LEU 30 9.215 -0.899 -4.318
213 HD11 LEU 30 HD11 LEU 30 10.848 1.548 -3.719
214 HD12 LEU 30 HD12 LEU 30 9.217 1.483 -4.383
215 HD13 LEU 30 HD13 LEU 30 10.581 0.891 -5.334
216 HD21 LEU 30 HD21 LEU 30 11.578 -1.266 -4.872
217 HD22 LEU 30 HD22 LEU 30 11.049 -2.235 -3.496
218 HD23 LEU 30 HD23 LEU 30 12.022 -0.788 -3.232
219 H CYS 31 H CYS 31 6.596 -2.338 -1.865
220 HA CYS 31 HA CYS 31 6.890 -2.442 1.066
221 HB2 CYS 31 HB2 CYS 31 4.672 -3.590 -0.643
222 HB3 CYS 31 HB3 CYS 31 4.772 -3.659 1.113
223 HA PRO 32 HA PRO 32 8.943 -6.194 -0.173
224 HB2 PRO 32 HB2 PRO 32 10.244 -6.689 2.077
225 HB3 PRO 32 HB3 PRO 32 10.605 -5.216 1.168
226 HG2 PRO 32 HG2 PRO 32 8.950 -5.569 3.637
227 HG3 PRO 32 HG3 PRO 32 10.088 -4.265 3.230
228 HD2 PRO 32 HD2 PRO 32 7.298 -4.183 2.911
229 HD3 PRO 32 HD3 PRO 32 8.458 -3.071 2.165
230 H LEU 33 H LEU 33 7.232 -7.620 -0.466
231 HA LEU 33 HA LEU 33 7.108 -9.779 1.325
232 HB2 LEU 33 HB2 LEU 33 4.788 -7.878 1.388
233 HB3 LEU 33 HB3 LEU 33 4.503 -9.595 1.573
234 HG LEU 33 HG LEU 33 6.167 -7.839 3.374
235 HD11 LEU 33 HD11 LEU 33 4.518 -8.422 5.068
236 HD12 LEU 33 HD12 LEU 33 3.596 -9.322 3.863
237 HD13 LEU 33 HD13 LEU 33 3.786 -7.575 3.707
238 HD21 LEU 33 HD21 LEU 33 5.775 -10.810 3.335
239 HD22 LEU 33 HD22 LEU 33 6.294 -9.928 4.772
240 HD23 LEU 33 HD23 LEU 33 7.288 -9.897 3.315
241 H LYS 34 H LYS 34 4.139 -9.019 -0.263
242 HA LYS 34 HA LYS 34 4.929 -10.639 -2.581
243 HB2 LYS 34 HB2 LYS 34 2.319 -10.781 -1.061
244 HB3 LYS 34 HB3 LYS 34 2.701 -11.690 -2.519
245 HG2 LYS 34 HG2 LYS 34 4.580 -12.753 -1.268
246 HG3 LYS 34 HG3 LYS 34 3.992 -11.953 0.186
247 HD2 LYS 34 HD2 LYS 34 3.170 -14.228 0.118
248 HD3 LYS 34 HD3 LYS 34 1.828 -13.104 -0.083
249 HE2 LYS 34 HE2 LYS 34 1.679 -15.028 -1.609
250 HE3 LYS 34 HE3 LYS 34 1.811 -13.499 -2.472
251 HZ1 LYS 34 HZ1 LYS 34 4.151 -13.936 -2.832
252 HZ2 LYS 34 HZ2 LYS 34 3.218 -15.201 -3.445
253 HZ3 LYS 34 HZ3 LYS 34 4.043 -15.394 -1.983
254 H ARG 35 H ARG 35 1.714 -10.070 -2.757
255 HA ARG 35 HA ARG 35 1.990 -8.065 -4.786
256 HB2 ARG 35 HB2 ARG 35 -0.340 -9.592 -3.661
257 HB3 ARG 35 HB3 ARG 35 -0.553 -8.329 -4.859
258 HG2 ARG 35 HG2 ARG 35 1.096 -10.818 -5.190
259 HG3 ARG 35 HG3 ARG 35 -0.508 -10.542 -5.874
260 HD2 ARG 35 HD2 ARG 35 2.051 -9.093 -6.531
261 HD3 ARG 35 HD3 ARG 35 1.104 -10.133 -7.591
262 HE ARG 35 HE ARG 35 -0.455 -7.942 -6.688
263 HH11 ARG 35 HH11 ARG 35 2.102 -8.768 -8.930
264 HH12 ARG 35 HH12 ARG 35 1.742 -7.460 -10.012
265 HH21 ARG 35 HH21 ARG 35 -0.917 -6.215 -8.080
266 HH22 ARG 35 HH22 ARG 35 0.040 -5.987 -9.511
267 H TRP 36 H TRP 36 2.680 -7.151 -2.158
268 HA TRP 36 HA TRP 36 0.449 -5.762 -1.047
269 HB2 TRP 36 HB2 TRP 36 3.388 -5.825 -0.423
270 HB3 TRP 36 HB3 TRP 36 2.292 -4.715 0.400
271 HD1 TRP 36 HD1 TRP 36 2.211 -8.551 -0.353
272 HE1 TRP 36 HE1 TRP 36 1.437 -9.747 1.785
273 HE3 TRP 36 HE3 TRP 36 1.537 -4.480 2.654
274 HZ2 TRP 36 HZ2 TRP 36 0.633 -9.047 4.404
275 HZ3 TRP 36 HZ3 TRP 36 0.748 -4.835 4.932
276 HH2 TRP 36 HH2 TRP 36 0.311 -7.061 5.800
277 H THR 37 H THR 37 -0.325 -3.926 -1.624
278 HA THR 37 HA THR 37 1.092 -2.257 -3.569
279 HB THR 37 HB THR 37 -1.788 -2.693 -2.836
280 HG1 THR 37 HG1 THR 37 -1.243 -3.957 -4.495
281 HG21 THR 37 HG21 THR 37 -0.758 -0.340 -4.428
282 HG22 THR 37 HG22 THR 37 -1.646 -0.280 -2.900
283 HG23 THR 37 HG23 THR 37 -2.443 -0.857 -4.366
284 H CYS 38 H CYS 38 1.253 0.072 -3.265
285 HA CYS 38 HA CYS 38 1.216 0.836 -0.461
286 HB2 CYS 38 HB2 CYS 38 3.079 1.537 -2.048
287 HB3 CYS 38 HB3 CYS 38 1.911 2.609 -2.816
288 H CYS 39 H CYS 39 -0.968 0.861 0.009
289 HA CYS 39 HA CYS 39 -2.724 2.390 -1.688
290 HB2 CYS 39 HB2 CYS 39 -3.033 0.583 0.624
291 HB3 CYS 39 HB3 CYS 39 -4.314 1.749 0.328
292 H LYS 40 H LYS 40 -2.647 4.452 -1.575
293 HA LYS 40 HA LYS 40 -1.955 5.929 0.772
294 HB2 LYS 40 HB2 LYS 40 -1.680 6.670 -1.657
295 HB3 LYS 40 HB3 LYS 40 -3.407 6.963 -1.671
296 HG2 LYS 40 HG2 LYS 40 -1.682 8.262 0.391
297 HG3 LYS 40 HG3 LYS 40 -1.765 8.912 -1.244
298 HD2 LYS 40 HD2 LYS 40 -4.250 9.014 -0.995
299 HD3 LYS 40 HD3 LYS 40 -4.045 8.554 0.696
300 HE2 LYS 40 HE2 LYS 40 -2.670 10.539 1.071
301 HE3 LYS 40 HE3 LYS 40 -2.854 10.991 -0.622
302 HZ1 LYS 40 HZ1 LYS 40 -5.050 10.779 1.367
303 HZ2 LYS 40 HZ2 LYS 40 -5.233 11.207 -0.261
304 HZ3 LYS 40 HZ3 LYS 40 -4.372 12.220 0.783
305 H GLU 41 H GLU 41 -3.265 5.164 2.337
306 HA GLU 41 HA GLU 41 -4.986 5.126 3.763
307 HB2 GLU 41 HB2 GLU 41 -6.291 7.014 1.811
308 HB3 GLU 41 HB3 GLU 41 -6.964 6.548 3.363
309 HG2 GLU 41 HG2 GLU 41 -5.131 7.543 4.536
310 HG3 GLU 41 HG3 GLU 41 -4.302 7.887 3.019
311 H ILE 42 H ILE 42 -7.040 4.149 4.096
312 HA ILE 42 HA ILE 42 -8.040 2.540 1.871
313 HB ILE 42 HB ILE 42 -7.992 0.491 3.166
314 HG12 ILE 42 HG12 ILE 42 -8.133 1.555 5.428
315 HG13 ILE 42 HG13 ILE 42 -6.947 0.268 5.320
316 HG21 ILE 42 HG21 ILE 42 -6.104 0.900 1.741
317 HG22 ILE 42 HG22 ILE 42 -5.576 0.064 3.201
318 HG23 ILE 42 HG23 ILE 42 -5.287 1.795 3.022
319 HD11 ILE 42 HD11 ILE 42 -6.378 3.220 5.320
320 HD12 ILE 42 HD12 ILE 42 -5.165 1.953 5.164
321 HD13 ILE 42 HD13 ILE 42 -6.106 2.095 6.647
Start of MODEL 8
1 H1 ASP 1 H1 ASP 1 18.792 -3.390 -5.435
2 H2 ASP 1 H2 ASP 1 18.350 -4.877 -4.758
3 H3 ASP 1 H3 ASP 1 19.974 -4.547 -5.088
4 HA ASP 1 HA ASP 1 20.002 -2.804 -3.457
5 HB2 ASP 1 HB2 ASP 1 18.046 -2.598 -1.908
6 HB3 ASP 1 HB3 ASP 1 17.724 -2.048 -3.547
7 H THR 2 H THR 2 21.386 -3.632 -2.101
8 HA THR 2 HA THR 2 21.201 -6.294 -1.061
9 HB THR 2 HB THR 2 23.019 -4.106 -0.052
10 HG1 THR 2 HG1 THR 2 24.343 -4.457 -1.767
11 HG21 THR 2 HG21 THR 2 23.352 -7.105 -0.258
12 HG22 THR 2 HG22 THR 2 23.022 -6.199 1.218
13 HG23 THR 2 HG23 THR 2 24.554 -5.977 0.373
14 H THR 3 H THR 3 20.333 -3.129 -0.095
15 HA THR 3 HA THR 3 19.006 -4.149 2.291
16 HB THR 3 HB THR 3 21.169 -3.310 3.104
17 HG1 THR 3 HG1 THR 3 19.605 -1.229 3.991
18 HG21 THR 3 HG21 THR 3 21.694 -1.719 1.347
19 HG22 THR 3 HG22 THR 3 21.731 -0.921 2.921
20 HG23 THR 3 HG23 THR 3 20.349 -0.691 1.848
21 H SER 4 H SER 4 17.232 -2.805 2.937
22 HA SER 4 HA SER 4 15.975 -1.602 0.684
23 HB2 SER 4 HB2 SER 4 15.077 -1.754 3.567
24 HB3 SER 4 HB3 SER 4 14.064 -1.281 2.202
25 HG SER 4 HG SER 4 13.926 -3.542 2.882
26 H ASP 5 H ASP 5 17.022 0.224 0.082
27 HA ASP 5 HA ASP 5 16.390 2.559 1.717
28 HB2 ASP 5 HB2 ASP 5 18.769 2.074 2.176
29 HB3 ASP 5 HB3 ASP 5 19.106 2.124 0.447
30 H PHE 6 H PHE 6 14.900 3.402 0.423
31 HA PHE 6 HA PHE 6 15.396 4.402 -2.153
32 HB2 PHE 6 HB2 PHE 6 13.661 2.735 -3.247
33 HB3 PHE 6 HB3 PHE 6 15.366 2.325 -3.179
34 HD1 PHE 6 HD1 PHE 6 15.540 0.053 -2.988
35 HD2 PHE 6 HD2 PHE 6 12.659 2.088 -0.606
36 HE1 PHE 6 HE1 PHE 6 15.010 -2.053 -1.837
37 HE2 PHE 6 HE2 PHE 6 12.126 -0.018 0.548
38 HZ PHE 6 HZ PHE 6 13.304 -2.091 -0.067
39 H HIS 7 H HIS 7 12.871 4.451 -3.247
40 HA HIS 7 HA HIS 7 11.465 6.059 -1.309
41 HB2 HIS 7 HB2 HIS 7 10.785 5.355 -4.169
42 HB3 HIS 7 HB3 HIS 7 9.860 6.468 -3.174
43 HD1 HIS 7 HD1 HIS 7 12.577 6.363 -5.548
44 HD2 HIS 7 HD2 HIS 7 11.515 8.787 -2.337
45 HE1 HIS 7 HE1 HIS 7 13.898 8.484 -5.834
46 HE2 HIS 7 HE2 HIS 7 13.129 9.989 -3.967
47 H THR 8 H THR 8 10.546 4.875 0.226
48 HA THR 8 HA THR 8 9.372 2.324 -0.291
49 HB THR 8 HB THR 8 8.625 2.696 2.207
50 HG1 THR 8 HG1 THR 8 10.851 4.346 2.404
51 HG21 THR 8 HG21 THR 8 10.337 1.106 1.475
52 HG22 THR 8 HG22 THR 8 10.835 1.932 2.951
53 HG23 THR 8 HG23 THR 8 11.522 2.410 1.399
54 H CYS 9 H CYS 9 7.136 2.192 1.264
55 HA CYS 9 HA CYS 9 5.243 3.531 -0.493
56 HB2 CYS 9 HB2 CYS 9 4.891 1.385 1.615
57 HB3 CYS 9 HB3 CYS 9 3.587 2.020 0.619
58 H GLN 10 H GLN 10 5.256 2.833 3.005
59 HA GLN 10 HA GLN 10 3.723 5.203 3.532
60 HB2 GLN 10 HB2 GLN 10 4.233 4.535 5.964
61 HB3 GLN 10 HB3 GLN 10 3.247 3.440 5.011
62 HG2 GLN 10 HG2 GLN 10 5.482 2.239 4.517
63 HG3 GLN 10 HG3 GLN 10 6.077 3.127 5.916
64 HE21 GLN 10 HE21 GLN 10 5.730 0.265 5.542
65 HE22 GLN 10 HE22 GLN 10 4.655 -0.262 6.788
66 H ASP 11 H ASP 11 4.661 7.063 3.279
67 HA ASP 11 HA ASP 11 6.751 8.269 4.475
68 HB2 ASP 11 HB2 ASP 11 8.220 6.400 3.686
69 HB3 ASP 11 HB3 ASP 11 7.816 6.819 2.024
70 H LYS 12 H LYS 12 5.773 7.474 1.150
71 HA LYS 12 HA LYS 12 5.650 10.355 0.540
72 HB2 LYS 12 HB2 LYS 12 5.289 8.138 -1.449
73 HB3 LYS 12 HB3 LYS 12 5.755 9.797 -1.752
74 HG2 LYS 12 HG2 LYS 12 7.944 9.379 -0.773
75 HG3 LYS 12 HG3 LYS 12 7.478 7.711 -0.426
76 HD2 LYS 12 HD2 LYS 12 7.486 8.905 -3.194
77 HD3 LYS 12 HD3 LYS 12 8.838 8.006 -2.512
78 HE2 LYS 12 HE2 LYS 12 7.647 6.002 -2.479
79 HE3 LYS 12 HE3 LYS 12 6.090 6.809 -2.604
80 HZ1 LYS 12 HZ1 LYS 12 6.686 7.460 -4.879
81 HZ2 LYS 12 HZ2 LYS 12 6.636 5.781 -4.685
82 HZ3 LYS 12 HZ3 LYS 12 8.123 6.582 -4.752
83 H GLY 13 H GLY 13 3.763 7.418 0.677
84 HA2 GLY 13 HA2 GLY 13 1.368 8.963 -0.068
85 HA3 GLY 13 HA3 GLY 13 1.645 7.345 -0.677
86 H GLY 14 H GLY 14 1.589 5.610 0.756
87 HA2 GLY 14 HA2 GLY 14 0.435 6.024 3.374
88 HA3 GLY 14 HA3 GLY 14 -0.622 5.269 2.189
89 H HIS 15 H HIS 15 -0.598 3.468 3.743
90 HA HIS 15 HA HIS 15 1.977 2.189 4.216
91 HB2 HIS 15 HB2 HIS 15 0.870 0.962 5.931
92 HB3 HIS 15 HB3 HIS 15 0.261 2.604 6.039
93 HD1 HIS 15 HD1 HIS 15 -0.997 -0.535 6.550
94 HD2 HIS 15 HD2 HIS 15 -2.245 2.549 4.046
95 HE1 HIS 15 HE1 HIS 15 -3.408 -1.010 6.028
96 HE2 HIS 15 HE2 HIS 15 -4.136 0.851 4.509
97 H CYS 16 H CYS 16 2.078 -0.201 4.101
98 HA CYS 16 HA CYS 16 1.284 -1.035 1.466
99 HB2 CYS 16 HB2 CYS 16 2.758 -2.513 3.656
100 HB3 CYS 16 HB3 CYS 16 2.577 -3.068 1.993
101 H VAL 17 H VAL 17 -0.332 -2.382 0.931
102 HA VAL 17 HA VAL 17 -1.818 -3.637 3.138
103 HB VAL 17 HB VAL 17 -3.892 -3.359 1.859
104 HG11 VAL 17 HG11 VAL 17 -3.349 -1.709 3.538
105 HG12 VAL 17 HG12 VAL 17 -4.170 -0.939 2.180
106 HG13 VAL 17 HG13 VAL 17 -2.424 -0.775 2.364
107 HG21 VAL 17 HG21 VAL 17 -2.217 -1.727 -0.049
108 HG22 VAL 17 HG22 VAL 17 -3.977 -1.846 -0.079
109 HG23 VAL 17 HG23 VAL 17 -2.990 -3.273 -0.397
110 H SER 18 H SER 18 -2.475 -5.642 2.901
111 HA SER 18 HA SER 18 -1.083 -7.304 1.094
112 HB2 SER 18 HB2 SER 18 -2.302 -9.099 2.197
113 HB3 SER 18 HB3 SER 18 -1.712 -7.960 3.385
114 HG SER 18 HG SER 18 -4.186 -8.768 3.065
115 HA PRO 19 HA PRO 19 -3.462 -7.317 -2.524
116 HB2 PRO 19 HB2 PRO 19 -3.521 -9.960 -3.224
117 HB3 PRO 19 HB3 PRO 19 -2.111 -8.912 -3.405
118 HG2 PRO 19 HG2 PRO 19 -2.778 -10.811 -1.182
119 HG3 PRO 19 HG3 PRO 19 -1.245 -10.607 -2.052
120 HD2 PRO 19 HD2 PRO 19 -1.569 -9.502 0.334
121 HD3 PRO 19 HD3 PRO 19 -0.754 -8.605 -0.966
122 H LYS 20 H LYS 20 -5.132 -7.749 -0.004
123 HA LYS 20 HA LYS 20 -7.530 -8.528 -1.473
124 HB2 LYS 20 HB2 LYS 20 -6.578 -10.514 -0.128
125 HB3 LYS 20 HB3 LYS 20 -7.086 -9.622 1.300
126 HG2 LYS 20 HG2 LYS 20 -9.391 -9.630 0.488
127 HG3 LYS 20 HG3 LYS 20 -8.882 -10.529 -0.944
128 HD2 LYS 20 HD2 LYS 20 -8.066 -12.337 0.559
129 HD3 LYS 20 HD3 LYS 20 -8.742 -11.449 1.923
130 HE2 LYS 20 HE2 LYS 20 -10.275 -12.535 -0.436
131 HE3 LYS 20 HE3 LYS 20 -10.261 -13.204 1.194
132 HZ1 LYS 20 HZ1 LYS 20 -11.223 -11.091 1.980
133 HZ2 LYS 20 HZ2 LYS 20 -12.228 -11.898 0.886
134 HZ3 LYS 20 HZ3 LYS 20 -11.334 -10.559 0.377
135 H ILE 21 H ILE 21 -6.063 -6.183 -0.026
136 HA ILE 21 HA ILE 21 -8.190 -5.350 1.803
137 HB ILE 21 HB ILE 21 -5.557 -3.997 1.185
138 HG12 ILE 21 HG12 ILE 21 -5.198 -6.148 2.278
139 HG13 ILE 21 HG13 ILE 21 -4.838 -4.832 3.388
140 HG21 ILE 21 HG21 ILE 21 -5.995 -2.668 3.187
141 HG22 ILE 21 HG22 ILE 21 -7.558 -3.461 3.374
142 HG23 ILE 21 HG23 ILE 21 -7.252 -2.434 1.973
143 HD11 ILE 21 HD11 ILE 21 -7.012 -5.156 4.460
144 HD12 ILE 21 HD12 ILE 21 -6.019 -6.612 4.514
145 HD13 ILE 21 HD13 ILE 21 -7.346 -6.493 3.360
146 H ARG 22 H ARG 22 -9.620 -3.799 1.328
147 HA ARG 22 HA ARG 22 -9.905 -2.839 -1.323
148 HB2 ARG 22 HB2 ARG 22 -11.810 -3.277 0.157
149 HB3 ARG 22 HB3 ARG 22 -11.265 -2.023 1.254
150 HG2 ARG 22 HG2 ARG 22 -11.824 -1.298 -1.563
151 HG3 ARG 22 HG3 ARG 22 -13.181 -1.596 -0.477
152 HD2 ARG 22 HD2 ARG 22 -10.957 0.405 -0.082
153 HD3 ARG 22 HD3 ARG 22 -12.630 0.765 -0.501
154 HE ARG 22 HE ARG 22 -11.891 -0.515 2.052
155 HH11 ARG 22 HH11 ARG 22 -13.639 1.930 0.248
156 HH12 ARG 22 HH12 ARG 22 -14.419 2.582 1.652
157 HH21 ARG 22 HH21 ARG 22 -12.915 0.347 3.894
158 HH22 ARG 22 HH22 ARG 22 -14.002 1.687 3.725
159 H CYS 23 H CYS 23 -8.754 -1.255 -2.210
160 HA CYS 23 HA CYS 23 -7.435 0.687 -0.446
161 HB2 CYS 23 HB2 CYS 23 -6.120 -0.757 -2.099
162 HB3 CYS 23 HB3 CYS 23 -6.857 0.217 -3.369
163 H LEU 24 H LEU 24 -7.713 2.873 -0.696
164 HA LEU 24 HA LEU 24 -9.967 3.682 -2.360
165 HB2 LEU 24 HB2 LEU 24 -8.551 4.935 -0.042
166 HB3 LEU 24 HB3 LEU 24 -9.504 5.934 -1.118
167 HG LEU 24 HG LEU 24 -10.812 5.327 0.827
168 HD11 LEU 24 HD11 LEU 24 -11.773 3.817 -1.593
169 HD12 LEU 24 HD12 LEU 24 -11.963 5.548 -1.323
170 HD13 LEU 24 HD13 LEU 24 -12.762 4.396 -0.254
171 HD21 LEU 24 HD21 LEU 24 -9.717 3.287 1.486
172 HD22 LEU 24 HD22 LEU 24 -10.267 2.477 0.022
173 HD23 LEU 24 HD23 LEU 24 -11.435 2.976 1.245
174 H GLU 25 H GLU 25 -6.613 4.783 -1.718
175 HA GLU 25 HA GLU 25 -6.535 5.502 -4.572
176 HB2 GLU 25 HB2 GLU 25 -6.674 7.557 -3.234
177 HB3 GLU 25 HB3 GLU 25 -5.273 7.055 -2.304
178 HG2 GLU 25 HG2 GLU 25 -3.874 7.208 -4.277
179 HG3 GLU 25 HG3 GLU 25 -5.277 7.624 -5.261
180 H GLU 26 H GLU 26 -5.275 3.983 -5.458
181 HA GLU 26 HA GLU 26 -3.279 2.588 -4.026
182 HB2 GLU 26 HB2 GLU 26 -3.853 2.771 -6.975
183 HB3 GLU 26 HB3 GLU 26 -2.574 1.766 -6.311
184 HG2 GLU 26 HG2 GLU 26 -4.274 0.592 -4.945
185 HG3 GLU 26 HG3 GLU 26 -5.522 1.529 -5.764
186 H GLN 27 H GLN 27 -1.183 2.817 -3.885
187 HA GLN 27 HA GLN 27 0.039 5.222 -5.038
188 HB2 GLN 27 HB2 GLN 27 -0.198 5.927 -2.880
189 HB3 GLN 27 HB3 GLN 27 -0.221 4.302 -2.227
190 HG2 GLN 27 HG2 GLN 27 1.695 5.332 -1.374
191 HG3 GLN 27 HG3 GLN 27 2.259 4.242 -2.630
192 HE21 GLN 27 HE21 GLN 27 3.575 6.533 -1.510
193 HE22 GLN 27 HE22 GLN 27 3.880 7.609 -2.827
194 H LEU 28 H LEU 28 2.330 5.118 -5.268
195 HA LEU 28 HA LEU 28 3.242 2.371 -5.731
196 HB2 LEU 28 HB2 LEU 28 4.827 3.586 -7.406
197 HB3 LEU 28 HB3 LEU 28 3.178 3.210 -7.855
198 HG LEU 28 HG LEU 28 2.674 5.643 -7.061
199 HD11 LEU 28 HD11 LEU 28 5.620 5.849 -7.662
200 HD12 LEU 28 HD12 LEU 28 4.870 6.083 -6.082
201 HD13 LEU 28 HD13 LEU 28 4.513 7.198 -7.402
202 HD21 LEU 28 HD21 LEU 28 2.430 4.855 -9.340
203 HD22 LEU 28 HD22 LEU 28 4.162 5.048 -9.610
204 HD23 LEU 28 HD23 LEU 28 3.154 6.463 -9.316
205 H GLY 29 H GLY 29 4.914 1.681 -4.684
206 HA2 GLY 29 HA2 GLY 29 7.154 3.259 -3.943
207 HA3 GLY 29 HA3 GLY 29 6.105 2.977 -2.559
208 H LEU 30 H LEU 30 8.109 1.831 -1.826
209 HA LEU 30 HA LEU 30 8.364 -0.826 -3.037
210 HB2 LEU 30 HB2 LEU 30 10.206 0.852 -1.401
211 HB3 LEU 30 HB3 LEU 30 10.375 -0.889 -1.341
212 HG LEU 30 HG LEU 30 11.939 0.056 -2.925
213 HD11 LEU 30 HD11 LEU 30 9.717 -1.401 -4.343
214 HD12 LEU 30 HD12 LEU 30 11.009 -2.149 -3.403
215 HD13 LEU 30 HD13 LEU 30 11.389 -1.267 -4.881
216 HD21 LEU 30 HD21 LEU 30 9.563 1.084 -4.458
217 HD22 LEU 30 HD22 LEU 30 11.268 1.275 -4.872
218 HD23 LEU 30 HD23 LEU 30 10.608 2.078 -3.443
219 H CYS 31 H CYS 31 6.778 -2.023 -2.173
220 HA CYS 31 HA CYS 31 6.754 -2.320 0.751
221 HB2 CYS 31 HB2 CYS 31 4.830 -3.392 -1.320
222 HB3 CYS 31 HB3 CYS 31 4.701 -3.647 0.412
223 HA PRO 32 HA PRO 32 8.977 -6.030 -0.325
224 HB2 PRO 32 HB2 PRO 32 10.292 -6.324 1.958
225 HB3 PRO 32 HB3 PRO 32 10.624 -4.926 0.929
226 HG2 PRO 32 HG2 PRO 32 9.063 -5.087 3.464
227 HG3 PRO 32 HG3 PRO 32 10.074 -3.763 2.852
228 HD2 PRO 32 HD2 PRO 32 7.241 -4.014 2.642
229 HD3 PRO 32 HD3 PRO 32 8.268 -2.785 1.876
230 H LEU 33 H LEU 33 7.246 -7.463 -0.498
231 HA LEU 33 HA LEU 33 7.135 -9.468 1.489
232 HB2 LEU 33 HB2 LEU 33 4.755 -7.641 1.234
233 HB3 LEU 33 HB3 LEU 33 4.556 -9.313 1.705
234 HG LEU 33 HG LEU 33 6.166 -7.246 3.206
235 HD11 LEU 33 HD11 LEU 33 3.778 -6.856 3.390
236 HD12 LEU 33 HD12 LEU 33 4.450 -7.433 4.915
237 HD13 LEU 33 HD13 LEU 33 3.534 -8.531 3.884
238 HD21 LEU 33 HD21 LEU 33 6.237 -9.002 4.966
239 HD22 LEU 33 HD22 LEU 33 7.177 -9.366 3.521
240 HD23 LEU 33 HD23 LEU 33 5.611 -10.140 3.773
241 H LYS 34 H LYS 34 4.208 -8.938 -0.227
242 HA LYS 34 HA LYS 34 5.091 -10.701 -2.397
243 HB2 LYS 34 HB2 LYS 34 2.485 -10.838 -0.869
244 HB3 LYS 34 HB3 LYS 34 2.904 -11.836 -2.258
245 HG2 LYS 34 HG2 LYS 34 4.808 -12.750 -0.964
246 HG3 LYS 34 HG3 LYS 34 4.250 -11.835 0.433
247 HD2 LYS 34 HD2 LYS 34 2.180 -13.051 0.481
248 HD3 LYS 34 HD3 LYS 34 2.579 -13.872 -1.028
249 HE2 LYS 34 HE2 LYS 34 4.135 -14.130 1.542
250 HE3 LYS 34 HE3 LYS 34 2.929 -15.284 0.977
251 HZ1 LYS 34 HZ1 LYS 34 5.148 -16.021 0.422
252 HZ2 LYS 34 HZ2 LYS 34 5.460 -14.586 -0.414
253 HZ3 LYS 34 HZ3 LYS 34 4.295 -15.664 -0.992
254 H ARG 35 H ARG 35 1.841 -10.261 -2.610
255 HA ARG 35 HA ARG 35 2.068 -8.323 -4.724
256 HB2 ARG 35 HB2 ARG 35 -0.063 -10.130 -3.711
257 HB3 ARG 35 HB3 ARG 35 -0.537 -8.732 -4.670
258 HG2 ARG 35 HG2 ARG 35 1.453 -10.805 -5.524
259 HG3 ARG 35 HG3 ARG 35 -0.249 -10.776 -6.002
260 HD2 ARG 35 HD2 ARG 35 1.916 -8.793 -6.674
261 HD3 ARG 35 HD3 ARG 35 0.932 -9.751 -7.779
262 HE ARG 35 HE ARG 35 -0.952 -8.296 -6.609
263 HH11 ARG 35 HH11 ARG 35 2.180 -7.288 -7.802
264 HH12 ARG 35 HH12 ARG 35 1.653 -5.685 -8.194
265 HH21 ARG 35 HH21 ARG 35 -1.646 -6.197 -7.120
266 HH22 ARG 35 HH22 ARG 35 -0.532 -5.062 -7.816
267 H TRP 36 H TRP 36 2.650 -7.326 -2.151
268 HA TRP 36 HA TRP 36 0.341 -6.039 -1.077
269 HB2 TRP 36 HB2 TRP 36 3.269 -6.005 -0.432
270 HB3 TRP 36 HB3 TRP 36 2.146 -4.898 0.358
271 HD1 TRP 36 HD1 TRP 36 2.093 -8.752 -0.337
272 HE1 TRP 36 HE1 TRP 36 1.298 -9.897 1.833
273 HE3 TRP 36 HE3 TRP 36 1.442 -4.612 2.585
274 HZ2 TRP 36 HZ2 TRP 36 0.492 -9.131 4.438
275 HZ3 TRP 36 HZ3 TRP 36 0.652 -4.907 4.867
276 HH2 TRP 36 HH2 TRP 36 0.191 -7.106 5.786
277 H THR 37 H THR 37 -0.548 -4.339 -1.823
278 HA THR 37 HA THR 37 0.810 -2.552 -3.661
279 HB THR 37 HB THR 37 -2.049 -2.756 -2.689
280 HG1 THR 37 HG1 THR 37 -0.618 -3.737 -4.843
281 HG21 THR 37 HG21 THR 37 -2.579 -1.100 -4.492
282 HG22 THR 37 HG22 THR 37 -0.848 -0.783 -4.631
283 HG23 THR 37 HG23 THR 37 -1.694 -0.430 -3.121
284 H CYS 38 H CYS 38 1.161 -0.300 -3.227
285 HA CYS 38 HA CYS 38 1.196 0.382 -0.401
286 HB2 CYS 38 HB2 CYS 38 1.881 2.220 -2.711
287 HB3 CYS 38 HB3 CYS 38 2.420 2.321 -1.041
288 H CYS 39 H CYS 39 -0.554 1.268 0.555
289 HA CYS 39 HA CYS 39 -2.618 2.296 -1.267
290 HB2 CYS 39 HB2 CYS 39 -2.998 0.320 0.411
291 HB3 CYS 39 HB3 CYS 39 -3.180 1.623 1.578
292 H LYS 40 H LYS 40 -2.845 4.369 -1.340
293 HA LYS 40 HA LYS 40 -1.902 6.070 0.788
294 HB2 LYS 40 HB2 LYS 40 -1.806 6.610 -1.712
295 HB3 LYS 40 HB3 LYS 40 -3.531 6.905 -1.613
296 HG2 LYS 40 HG2 LYS 40 -1.574 8.346 0.141
297 HG3 LYS 40 HG3 LYS 40 -1.976 8.908 -1.481
298 HD2 LYS 40 HD2 LYS 40 -4.396 8.872 -0.759
299 HD3 LYS 40 HD3 LYS 40 -3.813 8.614 0.887
300 HE2 LYS 40 HE2 LYS 40 -4.285 10.987 0.387
301 HE3 LYS 40 HE3 LYS 40 -2.604 10.697 0.832
302 HZ1 LYS 40 HZ1 LYS 40 -3.488 10.794 -1.991
303 HZ2 LYS 40 HZ2 LYS 40 -1.914 10.928 -1.378
304 HZ3 LYS 40 HZ3 LYS 40 -3.018 12.183 -1.146
305 H GLU 41 H GLU 41 -3.113 5.321 2.455
306 HA GLU 41 HA GLU 41 -4.698 5.458 4.020
307 HB2 GLU 41 HB2 GLU 41 -4.885 7.817 3.291
308 HB3 GLU 41 HB3 GLU 41 -6.143 7.349 2.158
309 HG2 GLU 41 HG2 GLU 41 -7.105 8.306 4.162
310 HG3 GLU 41 HG3 GLU 41 -7.540 6.605 4.014
311 H ILE 42 H ILE 42 -6.638 4.522 4.638
312 HA ILE 42 HA ILE 42 -8.028 3.068 2.511
313 HB ILE 42 HB ILE 42 -8.190 1.067 3.926
314 HG12 ILE 42 HG12 ILE 42 -7.811 2.196 6.149
315 HG13 ILE 42 HG13 ILE 42 -6.874 0.732 5.908
316 HG21 ILE 42 HG21 ILE 42 -5.858 0.324 3.633
317 HG22 ILE 42 HG22 ILE 42 -5.397 1.999 3.316
318 HG23 ILE 42 HG23 ILE 42 -6.507 1.167 2.226
319 HD11 ILE 42 HD11 ILE 42 -4.920 2.156 5.338
320 HD12 ILE 42 HD12 ILE 42 -5.507 2.352 6.987
321 HD13 ILE 42 HD13 ILE 42 -5.885 3.566 5.769
Start of MODEL 9
1 H1 ASP 1 H1 ASP 1 15.150 -5.848 -3.791
2 H2 ASP 1 H2 ASP 1 15.210 -6.535 -2.246
3 H3 ASP 1 H3 ASP 1 16.309 -7.027 -3.433
4 HA ASP 1 HA ASP 1 17.286 -4.833 -3.483
5 HB2 ASP 1 HB2 ASP 1 16.676 -3.208 -1.726
6 HB3 ASP 1 HB3 ASP 1 15.325 -3.542 -2.801
7 H THR 2 H THR 2 19.252 -5.077 -2.692
8 HA THR 2 HA THR 2 19.762 -6.911 -0.535
9 HB THR 2 HB THR 2 21.752 -5.061 -1.858
10 HG1 THR 2 HG1 THR 2 20.298 -6.939 -3.026
11 HG21 THR 2 HG21 THR 2 22.072 -7.763 -0.536
12 HG22 THR 2 HG22 THR 2 22.536 -6.212 0.165
13 HG23 THR 2 HG23 THR 2 23.362 -6.811 -1.273
14 H THR 3 H THR 3 19.652 -3.513 -1.054
15 HA THR 3 HA THR 3 19.588 -3.083 1.828
16 HB THR 3 HB THR 3 21.849 -2.427 1.259
17 HG1 THR 3 HG1 THR 3 21.630 -0.663 2.405
18 HG21 THR 3 HG21 THR 3 20.607 -0.682 -0.868
19 HG22 THR 3 HG22 THR 3 21.588 -2.122 -1.145
20 HG23 THR 3 HG23 THR 3 22.313 -0.688 -0.416
21 H SER 4 H SER 4 18.023 -1.644 2.417
22 HA SER 4 HA SER 4 16.191 -0.925 0.326
23 HB2 SER 4 HB2 SER 4 15.980 -0.466 3.306
24 HB3 SER 4 HB3 SER 4 14.672 -0.315 2.128
25 HG SER 4 HG SER 4 15.409 -2.650 1.632
26 H ASP 5 H ASP 5 17.030 0.696 -0.832
27 HA ASP 5 HA ASP 5 16.997 3.321 0.444
28 HB2 ASP 5 HB2 ASP 5 19.382 2.626 0.340
29 HB3 ASP 5 HB3 ASP 5 19.219 2.389 -1.396
30 H PHE 6 H PHE 6 15.192 3.984 -0.564
31 HA PHE 6 HA PHE 6 15.026 4.585 -3.286
32 HB2 PHE 6 HB2 PHE 6 13.183 2.783 -3.755
33 HB3 PHE 6 HB3 PHE 6 14.877 2.353 -3.948
34 HD1 PHE 6 HD1 PHE 6 12.749 2.579 -0.877
35 HD2 PHE 6 HD2 PHE 6 15.066 0.120 -3.466
36 HE1 PHE 6 HE1 PHE 6 12.460 0.684 0.666
37 HE2 PHE 6 HE2 PHE 6 14.777 -1.774 -1.927
38 HZ PHE 6 HZ PHE 6 13.474 -1.494 0.139
39 H HIS 7 H HIS 7 12.412 4.561 -3.831
40 HA HIS 7 HA HIS 7 11.284 6.218 -1.742
41 HB2 HIS 7 HB2 HIS 7 10.385 5.519 -4.530
42 HB3 HIS 7 HB3 HIS 7 9.359 6.405 -3.410
43 HD1 HIS 7 HD1 HIS 7 11.408 7.105 -6.122
44 HD2 HIS 7 HD2 HIS 7 11.132 8.703 -2.297
45 HE1 HIS 7 HE1 HIS 7 12.430 9.396 -6.277
46 HE2 HIS 7 HE2 HIS 7 12.418 10.266 -3.913
47 H THR 8 H THR 8 10.626 5.041 -0.067
48 HA THR 8 HA THR 8 9.433 2.491 -0.254
49 HB THR 8 HB THR 8 8.770 3.054 2.200
50 HG1 THR 8 HG1 THR 8 10.341 4.791 2.915
51 HG21 THR 8 HG21 THR 8 10.634 1.597 1.614
52 HG22 THR 8 HG22 THR 8 11.087 2.656 2.949
53 HG23 THR 8 HG23 THR 8 11.661 2.999 1.318
54 H CYS 9 H CYS 9 7.271 2.402 1.335
55 HA CYS 9 HA CYS 9 5.265 3.600 -0.410
56 HB2 CYS 9 HB2 CYS 9 5.080 1.435 1.706
57 HB3 CYS 9 HB3 CYS 9 3.709 2.022 0.763
58 H GLN 10 H GLN 10 5.338 2.900 3.087
59 HA GLN 10 HA GLN 10 3.639 5.186 3.567
60 HB2 GLN 10 HB2 GLN 10 4.041 4.474 6.014
61 HB3 GLN 10 HB3 GLN 10 3.140 3.380 4.977
62 HG2 GLN 10 HG2 GLN 10 5.337 2.194 4.566
63 HG3 GLN 10 HG3 GLN 10 5.982 3.146 5.901
64 HE21 GLN 10 HE21 GLN 10 5.605 0.268 5.613
65 HE22 GLN 10 HE22 GLN 10 4.604 -0.218 6.932
66 H ASP 11 H ASP 11 4.555 7.059 3.348
67 HA ASP 11 HA ASP 11 6.317 8.402 4.838
68 HB2 ASP 11 HB2 ASP 11 7.983 6.546 4.324
69 HB3 ASP 11 HB3 ASP 11 7.956 7.077 2.649
70 H LYS 12 H LYS 12 6.091 7.500 1.396
71 HA LYS 12 HA LYS 12 5.873 10.309 0.642
72 HB2 LYS 12 HB2 LYS 12 5.985 7.800 -1.041
73 HB3 LYS 12 HB3 LYS 12 5.983 9.434 -1.671
74 HG2 LYS 12 HG2 LYS 12 8.185 8.608 -1.762
75 HG3 LYS 12 HG3 LYS 12 8.146 9.817 -0.486
76 HD2 LYS 12 HD2 LYS 12 7.978 7.999 1.153
77 HD3 LYS 12 HD3 LYS 12 8.077 6.817 -0.153
78 HE2 LYS 12 HE2 LYS 12 10.242 7.039 0.848
79 HE3 LYS 12 HE3 LYS 12 10.285 7.766 -0.756
80 HZ1 LYS 12 HZ1 LYS 12 10.083 9.944 0.255
81 HZ2 LYS 12 HZ2 LYS 12 11.417 9.131 0.898
82 HZ3 LYS 12 HZ3 LYS 12 9.987 9.256 1.801
83 H GLY 13 H GLY 13 4.021 7.345 0.741
84 HA2 GLY 13 HA2 GLY 13 1.678 8.829 -0.265
85 HA3 GLY 13 HA3 GLY 13 2.015 7.182 -0.751
86 H GLY 14 H GLY 14 1.765 5.518 0.724
87 HA2 GLY 14 HA2 GLY 14 0.417 6.062 3.229
88 HA3 GLY 14 HA3 GLY 14 -0.557 5.286 1.991
89 H HIS 15 H HIS 15 -0.697 3.544 3.622
90 HA HIS 15 HA HIS 15 1.797 2.216 4.321
91 HB2 HIS 15 HB2 HIS 15 0.540 1.060 5.974
92 HB3 HIS 15 HB3 HIS 15 -0.093 2.697 5.975
93 HD1 HIS 15 HD1 HIS 15 -1.309 -0.515 6.325
94 HD2 HIS 15 HD2 HIS 15 -2.429 2.675 3.906
95 HE1 HIS 15 HE1 HIS 15 -3.684 -0.965 5.663
96 HE2 HIS 15 HE2 HIS 15 -4.396 1.086 4.400
97 H CYS 16 H CYS 16 1.948 -0.135 4.199
98 HA CYS 16 HA CYS 16 1.263 -1.031 1.554
99 HB2 CYS 16 HB2 CYS 16 2.686 -2.445 3.818
100 HB3 CYS 16 HB3 CYS 16 2.563 -3.037 2.164
101 H VAL 17 H VAL 17 -0.327 -2.359 0.973
102 HA VAL 17 HA VAL 17 -1.897 -3.625 3.116
103 HB VAL 17 HB VAL 17 -3.927 -3.316 1.796
104 HG11 VAL 17 HG11 VAL 17 -3.390 -1.616 3.430
105 HG12 VAL 17 HG12 VAL 17 -4.180 -0.889 2.032
106 HG13 VAL 17 HG13 VAL 17 -2.435 -0.735 2.238
107 HG21 VAL 17 HG21 VAL 17 -3.962 -1.882 -0.188
108 HG22 VAL 17 HG22 VAL 17 -2.963 -3.314 -0.440
109 HG23 VAL 17 HG23 VAL 17 -2.204 -1.754 -0.123
110 H SER 18 H SER 18 -2.490 -5.642 2.876
111 HA SER 18 HA SER 18 -1.103 -7.257 1.010
112 HB2 SER 18 HB2 SER 18 -2.360 -9.088 2.111
113 HB3 SER 18 HB3 SER 18 -1.561 -8.038 3.258
114 HG SER 18 HG SER 18 -4.313 -8.090 2.579
115 HA PRO 19 HA PRO 19 -3.385 -7.503 -2.683
116 HB2 PRO 19 HB2 PRO 19 -3.981 -10.316 -1.826
117 HB3 PRO 19 HB3 PRO 19 -3.540 -9.708 -3.428
118 HG2 PRO 19 HG2 PRO 19 -1.707 -10.815 -1.854
119 HG3 PRO 19 HG3 PRO 19 -1.321 -9.396 -2.846
120 HD2 PRO 19 HD2 PRO 19 -1.649 -9.607 0.081
121 HD3 PRO 19 HD3 PRO 19 -0.767 -8.406 -0.880
122 H LYS 20 H LYS 20 -5.080 -9.074 0.040
123 HA LYS 20 HA LYS 20 -7.639 -8.543 -1.265
124 HB2 LYS 20 HB2 LYS 20 -7.036 -10.806 -0.283
125 HB3 LYS 20 HB3 LYS 20 -7.180 -10.062 1.299
126 HG2 LYS 20 HG2 LYS 20 -9.210 -11.257 0.721
127 HG3 LYS 20 HG3 LYS 20 -9.519 -9.524 0.841
128 HD2 LYS 20 HD2 LYS 20 -9.412 -9.332 -1.595
129 HD3 LYS 20 HD3 LYS 20 -9.082 -11.061 -1.718
130 HE2 LYS 20 HE2 LYS 20 -11.413 -10.663 -2.171
131 HE3 LYS 20 HE3 LYS 20 -11.257 -11.512 -0.637
132 HZ1 LYS 20 HZ1 LYS 20 -11.538 -9.391 0.509
133 HZ2 LYS 20 HZ2 LYS 20 -12.869 -9.740 -0.475
134 HZ3 LYS 20 HZ3 LYS 20 -11.726 -8.599 -0.974
135 H ILE 21 H ILE 21 -6.372 -6.237 -0.353
136 HA ILE 21 HA ILE 21 -8.165 -5.460 1.859
137 HB ILE 21 HB ILE 21 -5.509 -4.243 1.084
138 HG12 ILE 21 HG12 ILE 21 -5.310 -6.383 2.276
139 HG13 ILE 21 HG13 ILE 21 -4.733 -5.041 3.253
140 HG21 ILE 21 HG21 ILE 21 -7.386 -3.469 3.312
141 HG22 ILE 21 HG22 ILE 21 -7.075 -2.535 1.850
142 HG23 ILE 21 HG23 ILE 21 -5.786 -2.786 3.027
143 HD11 ILE 21 HD11 ILE 21 -5.990 -6.588 4.609
144 HD12 ILE 21 HD12 ILE 21 -7.377 -6.449 3.531
145 HD13 ILE 21 HD13 ILE 21 -6.861 -5.059 4.486
146 H ARG 22 H ARG 22 -9.504 -3.739 1.546
147 HA ARG 22 HA ARG 22 -9.961 -2.813 -1.106
148 HB2 ARG 22 HB2 ARG 22 -11.786 -3.116 0.487
149 HB3 ARG 22 HB3 ARG 22 -11.075 -1.918 1.557
150 HG2 ARG 22 HG2 ARG 22 -11.622 -0.996 -1.166
151 HG3 ARG 22 HG3 ARG 22 -13.038 -1.409 -0.202
152 HD2 ARG 22 HD2 ARG 22 -10.849 0.519 0.572
153 HD3 ARG 22 HD3 ARG 22 -12.484 0.946 0.059
154 HE ARG 22 HE ARG 22 -12.106 -0.725 2.439
155 HH11 ARG 22 HH11 ARG 22 -13.162 2.284 0.997
156 HH12 ARG 22 HH12 ARG 22 -13.939 2.844 2.441
157 HH21 ARG 22 HH21 ARG 22 -13.123 0.011 4.334
158 HH22 ARG 22 HH22 ARG 22 -13.914 1.554 4.339
159 H CYS 23 H CYS 23 -8.846 -1.270 -2.089
160 HA CYS 23 HA CYS 23 -7.293 0.601 -0.451
161 HB2 CYS 23 HB2 CYS 23 -6.202 -0.889 -2.228
162 HB3 CYS 23 HB3 CYS 23 -6.989 0.151 -3.412
163 H LEU 24 H LEU 24 -7.509 2.769 -0.627
164 HA LEU 24 HA LEU 24 -9.825 3.766 -2.078
165 HB2 LEU 24 HB2 LEU 24 -8.105 4.783 0.119
166 HB3 LEU 24 HB3 LEU 24 -8.906 5.964 -0.900
167 HG LEU 24 HG LEU 24 -11.085 4.978 -0.338
168 HD11 LEU 24 HD11 LEU 24 -9.503 3.181 1.489
169 HD12 LEU 24 HD12 LEU 24 -10.398 2.681 0.058
170 HD13 LEU 24 HD13 LEU 24 -11.259 3.323 1.457
171 HD21 LEU 24 HD21 LEU 24 -10.205 6.822 0.984
172 HD22 LEU 24 HD22 LEU 24 -9.409 5.678 2.065
173 HD23 LEU 24 HD23 LEU 24 -11.169 5.731 1.976
174 H GLU 25 H GLU 25 -6.394 4.710 -1.734
175 HA GLU 25 HA GLU 25 -6.433 5.392 -4.594
176 HB2 GLU 25 HB2 GLU 25 -6.589 7.466 -3.231
177 HB3 GLU 25 HB3 GLU 25 -5.085 7.029 -2.438
178 HG2 GLU 25 HG2 GLU 25 -4.587 8.645 -4.102
179 HG3 GLU 25 HG3 GLU 25 -3.969 7.092 -4.661
180 H GLU 26 H GLU 26 -5.132 3.910 -5.480
181 HA GLU 26 HA GLU 26 -3.085 2.599 -4.018
182 HB2 GLU 26 HB2 GLU 26 -3.582 2.673 -6.989
183 HB3 GLU 26 HB3 GLU 26 -2.439 1.615 -6.184
184 HG2 GLU 26 HG2 GLU 26 -4.280 0.584 -4.938
185 HG3 GLU 26 HG3 GLU 26 -5.420 1.617 -5.798
186 H GLN 27 H GLN 27 -0.996 2.939 -3.893
187 HA GLN 27 HA GLN 27 0.164 5.221 -5.340
188 HB2 GLN 27 HB2 GLN 27 -0.432 5.188 -2.661
189 HB3 GLN 27 HB3 GLN 27 1.230 4.623 -2.658
190 HG2 GLN 27 HG2 GLN 27 0.353 7.145 -4.027
191 HG3 GLN 27 HG3 GLN 27 0.895 7.088 -2.354
192 HE21 GLN 27 HE21 GLN 27 3.057 6.595 -1.912
193 HE22 GLN 27 HE22 GLN 27 4.287 6.758 -3.110
194 H LEU 28 H LEU 28 2.438 5.027 -5.722
195 HA LEU 28 HA LEU 28 3.300 2.235 -5.814
196 HB2 LEU 28 HB2 LEU 28 5.066 3.257 -7.427
197 HB3 LEU 28 HB3 LEU 28 3.432 2.961 -7.979
198 HG LEU 28 HG LEU 28 2.987 5.431 -7.446
199 HD11 LEU 28 HD11 LEU 28 4.947 5.890 -6.115
200 HD12 LEU 28 HD12 LEU 28 4.963 6.884 -7.571
201 HD13 LEU 28 HD13 LEU 28 5.997 5.460 -7.465
202 HD21 LEU 28 HD21 LEU 28 4.867 4.657 -9.667
203 HD22 LEU 28 HD22 LEU 28 3.902 6.132 -9.612
204 HD23 LEU 28 HD23 LEU 28 3.107 4.561 -9.700
205 H GLY 29 H GLY 29 5.091 1.528 -4.837
206 HA2 GLY 29 HA2 GLY 29 7.130 3.207 -3.792
207 HA3 GLY 29 HA3 GLY 29 5.984 2.763 -2.533
208 H LEU 30 H LEU 30 8.066 1.783 -1.711
209 HA LEU 30 HA LEU 30 8.490 -0.870 -2.892
210 HB2 LEU 30 HB2 LEU 30 10.242 0.969 -1.339
211 HB3 LEU 30 HB3 LEU 30 10.519 -0.750 -1.206
212 HG LEU 30 HG LEU 30 12.007 0.219 -2.848
213 HD11 LEU 30 HD11 LEU 30 9.872 -1.432 -4.183
214 HD12 LEU 30 HD12 LEU 30 11.207 -2.058 -3.217
215 HD13 LEU 30 HD13 LEU 30 11.533 -1.222 -4.735
216 HD21 LEU 30 HD21 LEU 30 10.544 2.130 -3.436
217 HD22 LEU 30 HD22 LEU 30 9.559 1.027 -4.401
218 HD23 LEU 30 HD23 LEU 30 11.246 1.311 -4.835
219 H CYS 31 H CYS 31 6.905 -2.057 -1.968
220 HA CYS 31 HA CYS 31 6.958 -2.318 0.957
221 HB2 CYS 31 HB2 CYS 31 4.990 -3.403 -1.073
222 HB3 CYS 31 HB3 CYS 31 4.897 -3.667 0.663
223 HA PRO 32 HA PRO 32 9.078 -6.123 -0.062
224 HB2 PRO 32 HB2 PRO 32 10.214 -6.560 2.303
225 HB3 PRO 32 HB3 PRO 32 10.692 -5.160 1.337
226 HG2 PRO 32 HG2 PRO 32 8.996 -5.291 3.776
227 HG3 PRO 32 HG3 PRO 32 10.068 -3.988 3.223
228 HD2 PRO 32 HD2 PRO 32 7.234 -4.194 2.878
229 HD3 PRO 32 HD3 PRO 32 8.305 -2.938 2.233
230 H LEU 33 H LEU 33 7.363 -7.492 -0.409
231 HA LEU 33 HA LEU 33 6.859 -9.595 1.343
232 HB2 LEU 33 HB2 LEU 33 4.733 -7.447 1.294
233 HB3 LEU 33 HB3 LEU 33 4.324 -9.116 1.580
234 HG LEU 33 HG LEU 33 6.067 -7.378 3.312
235 HD11 LEU 33 HD11 LEU 33 3.396 -8.653 3.828
236 HD12 LEU 33 HD12 LEU 33 3.703 -6.937 3.560
237 HD13 LEU 33 HD13 LEU 33 4.349 -7.736 4.995
238 HD21 LEU 33 HD21 LEU 33 7.024 -9.551 3.359
239 HD22 LEU 33 HD22 LEU 33 5.439 -10.311 3.524
240 HD23 LEU 33 HD23 LEU 33 6.096 -9.342 4.844
241 H LYS 34 H LYS 34 4.098 -10.051 0.257
242 HA LYS 34 HA LYS 34 4.898 -11.019 -2.316
243 HB2 LYS 34 HB2 LYS 34 2.218 -11.045 -0.931
244 HB3 LYS 34 HB3 LYS 34 2.562 -11.855 -2.452
245 HG2 LYS 34 HG2 LYS 34 4.264 -13.228 -1.320
246 HG3 LYS 34 HG3 LYS 34 3.832 -12.461 0.207
247 HD2 LYS 34 HD2 LYS 34 1.971 -14.069 -1.541
248 HD3 LYS 34 HD3 LYS 34 2.741 -14.645 -0.062
249 HE2 LYS 34 HE2 LYS 34 1.574 -12.906 1.210
250 HE3 LYS 34 HE3 LYS 34 0.798 -12.344 -0.267
251 HZ1 LYS 34 HZ1 LYS 34 -0.261 -14.515 -0.472
252 HZ2 LYS 34 HZ2 LYS 34 -0.672 -13.764 0.984
253 HZ3 LYS 34 HZ3 LYS 34 0.459 -15.017 0.972
254 H ARG 35 H ARG 35 1.803 -10.363 -2.866
255 HA ARG 35 HA ARG 35 2.421 -8.352 -4.813
256 HB2 ARG 35 HB2 ARG 35 -0.100 -9.869 -4.176
257 HB3 ARG 35 HB3 ARG 35 0.003 -8.674 -5.457
258 HG2 ARG 35 HG2 ARG 35 1.947 -10.928 -5.385
259 HG3 ARG 35 HG3 ARG 35 0.310 -11.202 -5.980
260 HD2 ARG 35 HD2 ARG 35 1.919 -10.670 -7.777
261 HD3 ARG 35 HD3 ARG 35 0.592 -9.520 -7.679
262 HE ARG 35 HE ARG 35 2.119 -7.944 -6.676
263 HH11 ARG 35 HH11 ARG 35 3.581 -10.771 -8.130
264 HH12 ARG 35 HH12 ARG 35 5.125 -10.017 -8.353
265 HH21 ARG 35 HH21 ARG 35 4.155 -6.941 -6.980
266 HH22 ARG 35 HH22 ARG 35 5.454 -7.839 -7.701
267 H TRP 36 H TRP 36 2.696 -7.355 -2.214
268 HA TRP 36 HA TRP 36 0.290 -6.148 -1.275
269 HB2 TRP 36 HB2 TRP 36 3.182 -5.979 -0.494
270 HB3 TRP 36 HB3 TRP 36 1.990 -4.902 0.228
271 HD1 TRP 36 HD1 TRP 36 2.010 -8.747 -0.423
272 HE1 TRP 36 HE1 TRP 36 1.243 -9.898 1.745
273 HE3 TRP 36 HE3 TRP 36 1.362 -4.611 2.502
274 HZ2 TRP 36 HZ2 TRP 36 0.458 -9.139 4.360
275 HZ3 TRP 36 HZ3 TRP 36 0.590 -4.913 4.794
276 HH2 TRP 36 HH2 TRP 36 0.154 -7.121 5.713
277 H THR 37 H THR 37 -0.534 -4.258 -1.629
278 HA THR 37 HA THR 37 0.687 -2.482 -3.604
279 HB THR 37 HB THR 37 -2.101 -2.583 -2.416
280 HG1 THR 37 HG1 THR 37 -0.982 -3.540 -4.848
281 HG21 THR 37 HG21 THR 37 -1.590 -0.318 -3.118
282 HG22 THR 37 HG22 THR 37 -2.735 -1.054 -4.241
283 HG23 THR 37 HG23 THR 37 -1.036 -0.906 -4.684
284 H CYS 38 H CYS 38 1.022 -0.228 -3.178
285 HA CYS 38 HA CYS 38 1.184 0.442 -0.339
286 HB2 CYS 38 HB2 CYS 38 1.956 2.145 -2.718
287 HB3 CYS 38 HB3 CYS 38 2.453 2.362 -1.044
288 H CYS 39 H CYS 39 -0.716 1.122 0.519
289 HA CYS 39 HA CYS 39 -2.629 2.372 -1.317
290 HB2 CYS 39 HB2 CYS 39 -3.122 0.348 0.279
291 HB3 CYS 39 HB3 CYS 39 -3.321 1.618 1.476
292 H LYS 40 H LYS 40 -2.809 4.477 -1.310
293 HA LYS 40 HA LYS 40 -1.993 6.028 0.984
294 HB2 LYS 40 HB2 LYS 40 -1.904 6.676 -1.576
295 HB3 LYS 40 HB3 LYS 40 -3.549 7.223 -1.274
296 HG2 LYS 40 HG2 LYS 40 -1.162 8.123 0.328
297 HG3 LYS 40 HG3 LYS 40 -1.805 8.995 -1.063
298 HD2 LYS 40 HD2 LYS 40 -3.817 9.481 0.036
299 HD3 LYS 40 HD3 LYS 40 -3.528 8.258 1.269
300 HE2 LYS 40 HE2 LYS 40 -1.817 10.711 0.942
301 HE3 LYS 40 HE3 LYS 40 -3.220 10.650 2.006
302 HZ1 LYS 40 HZ1 LYS 40 -0.788 8.950 2.206
303 HZ2 LYS 40 HZ2 LYS 40 -2.158 8.795 3.194
304 HZ3 LYS 40 HZ3 LYS 40 -1.224 10.208 3.250
305 H GLU 41 H GLU 41 -3.217 5.434 2.608
306 HA GLU 41 HA GLU 41 -4.843 5.497 4.118
307 HB2 GLU 41 HB2 GLU 41 -6.435 7.129 2.143
308 HB3 GLU 41 HB3 GLU 41 -6.813 6.889 3.838
309 HG2 GLU 41 HG2 GLU 41 -4.662 8.532 2.607
310 HG3 GLU 41 HG3 GLU 41 -5.849 8.973 3.823
311 H ILE 42 H ILE 42 -6.972 4.696 4.647
312 HA ILE 42 HA ILE 42 -8.110 2.823 2.717
313 HB ILE 42 HB ILE 42 -8.160 1.100 4.615
314 HG12 ILE 42 HG12 ILE 42 -5.925 2.899 5.578
315 HG13 ILE 42 HG13 ILE 42 -7.432 2.565 6.418
316 HG21 ILE 42 HG21 ILE 42 -6.895 0.770 2.591
317 HG22 ILE 42 HG22 ILE 42 -5.957 0.212 3.977
318 HG23 ILE 42 HG23 ILE 42 -5.576 1.759 3.220
319 HD11 ILE 42 HD11 ILE 42 -5.190 0.633 5.889
320 HD12 ILE 42 HD12 ILE 42 -6.732 0.206 6.635
321 HD13 ILE 42 HD13 ILE 42 -5.645 1.341 7.437
Start of MODEL 10
1 H1 ASP 1 H1 ASP 1 17.501 -7.014 -1.198
2 H2 ASP 1 H2 ASP 1 18.782 -7.089 -2.295
3 H3 ASP 1 H3 ASP 1 17.385 -6.223 -2.688
4 HA ASP 1 HA ASP 1 19.183 -4.746 -2.075
5 HB2 ASP 1 HB2 ASP 1 17.969 -3.474 -0.321
6 HB3 ASP 1 HB3 ASP 1 16.914 -3.998 -1.629
7 H THR 2 H THR 2 20.812 -4.165 -0.715
8 HA THR 2 HA THR 2 21.656 -6.144 1.231
9 HB THR 2 HB THR 2 23.039 -3.583 0.404
10 HG1 THR 2 HG1 THR 2 23.226 -6.230 -0.655
11 HG21 THR 2 HG21 THR 2 25.070 -4.706 1.189
12 HG22 THR 2 HG22 THR 2 24.111 -6.101 1.681
13 HG23 THR 2 HG23 THR 2 23.887 -4.550 2.488
14 H THR 3 H THR 3 20.134 -3.104 1.103
15 HA THR 3 HA THR 3 19.665 -3.056 3.922
16 HB THR 3 HB THR 3 21.930 -2.037 3.827
17 HG1 THR 3 HG1 THR 3 20.702 -1.264 5.486
18 HG21 THR 3 HG21 THR 3 20.597 0.081 2.138
19 HG22 THR 3 HG22 THR 3 21.826 -1.061 1.595
20 HG23 THR 3 HG23 THR 3 22.232 0.167 2.793
21 H SER 4 H SER 4 18.121 -1.306 4.460
22 HA SER 4 HA SER 4 16.316 -0.945 2.268
23 HB2 SER 4 HB2 SER 4 15.486 -1.503 4.517
24 HB3 SER 4 HB3 SER 4 16.095 0.033 5.123
25 HG SER 4 HG SER 4 14.327 0.912 4.438
26 H ASP 5 H ASP 5 17.227 0.412 0.853
27 HA ASP 5 HA ASP 5 16.914 3.221 1.518
28 HB2 ASP 5 HB2 ASP 5 19.288 3.042 1.783
29 HB3 ASP 5 HB3 ASP 5 19.441 2.045 0.342
30 H PHE 6 H PHE 6 15.174 3.401 0.284
31 HA PHE 6 HA PHE 6 15.306 3.591 -2.501
32 HB2 PHE 6 HB2 PHE 6 13.585 1.624 -2.837
33 HB3 PHE 6 HB3 PHE 6 15.311 1.297 -2.859
34 HD1 PHE 6 HD1 PHE 6 15.829 -0.702 -1.892
35 HD2 PHE 6 HD2 PHE 6 12.728 1.639 -0.157
36 HE1 PHE 6 HE1 PHE 6 15.529 -2.403 -0.146
37 HE2 PHE 6 HE2 PHE 6 12.425 -0.059 1.591
38 HZ PHE 6 HZ PHE 6 13.818 -2.091 1.597
39 H HIS 7 H HIS 7 12.784 3.466 -3.309
40 HA HIS 7 HA HIS 7 11.523 5.393 -1.538
41 HB2 HIS 7 HB2 HIS 7 10.891 4.450 -4.332
42 HB3 HIS 7 HB3 HIS 7 9.800 5.500 -3.431
43 HD1 HIS 7 HD1 HIS 7 11.847 5.971 -6.061
44 HD2 HIS 7 HD2 HIS 7 11.915 7.647 -2.255
45 HE1 HIS 7 HE1 HIS 7 13.109 8.131 -6.298
46 HE2 HIS 7 HE2 HIS 7 12.955 9.214 -4.032
47 H THR 8 H THR 8 10.715 4.332 0.163
48 HA THR 8 HA THR 8 9.366 1.842 -0.017
49 HB THR 8 HB THR 8 8.632 2.485 2.368
50 HG1 THR 8 HG1 THR 8 9.582 4.263 3.252
51 HG21 THR 8 HG21 THR 8 11.571 2.349 1.683
52 HG22 THR 8 HG22 THR 8 10.489 0.970 1.884
53 HG23 THR 8 HG23 THR 8 10.865 2.004 3.262
54 H CYS 9 H CYS 9 7.111 1.912 1.327
55 HA CYS 9 HA CYS 9 5.339 3.392 -0.451
56 HB2 CYS 9 HB2 CYS 9 4.831 1.239 1.618
57 HB3 CYS 9 HB3 CYS 9 3.553 2.019 0.689
58 H GLN 10 H GLN 10 5.190 2.683 3.037
59 HA GLN 10 HA GLN 10 3.732 5.108 3.500
60 HB2 GLN 10 HB2 GLN 10 4.101 4.394 5.958
61 HB3 GLN 10 HB3 GLN 10 3.083 3.389 4.944
62 HG2 GLN 10 HG2 GLN 10 5.216 2.021 4.521
63 HG3 GLN 10 HG3 GLN 10 5.856 2.864 5.930
64 HE21 GLN 10 HE21 GLN 10 5.283 0.036 5.538
65 HE22 GLN 10 HE22 GLN 10 4.162 -0.402 6.779
66 H ASP 11 H ASP 11 4.781 6.895 3.260
67 HA ASP 11 HA ASP 11 6.690 8.077 4.737
68 HB2 ASP 11 HB2 ASP 11 8.202 6.145 4.089
69 HB3 ASP 11 HB3 ASP 11 8.103 6.702 2.422
70 H LYS 12 H LYS 12 6.226 7.314 1.274
71 HA LYS 12 HA LYS 12 6.101 10.176 0.663
72 HB2 LYS 12 HB2 LYS 12 5.952 7.772 -1.165
73 HB3 LYS 12 HB3 LYS 12 6.033 9.443 -1.685
74 HG2 LYS 12 HG2 LYS 12 8.144 8.460 -1.987
75 HG3 LYS 12 HG3 LYS 12 8.290 9.587 -0.647
76 HD2 LYS 12 HD2 LYS 12 8.164 7.712 0.904
77 HD3 LYS 12 HD3 LYS 12 7.988 6.592 -0.446
78 HE2 LYS 12 HE2 LYS 12 10.273 6.562 0.274
79 HE3 LYS 12 HE3 LYS 12 10.188 7.362 -1.293
80 HZ1 LYS 12 HZ1 LYS 12 10.307 9.498 -0.179
81 HZ2 LYS 12 HZ2 LYS 12 11.637 8.543 0.247
82 HZ3 LYS 12 HZ3 LYS 12 10.350 8.739 1.335
83 H GLY 13 H GLY 13 4.149 7.272 0.668
84 HA2 GLY 13 HA2 GLY 13 1.805 8.911 -0.048
85 HA3 GLY 13 HA3 GLY 13 2.048 7.305 -0.708
86 H GLY 14 H GLY 14 1.234 5.644 0.308
87 HA2 GLY 14 HA2 GLY 14 0.189 6.081 3.020
88 HA3 GLY 14 HA3 GLY 14 -0.713 5.214 1.788
89 H HIS 15 H HIS 15 -0.765 3.539 3.463
90 HA HIS 15 HA HIS 15 1.781 2.313 4.166
91 HB2 HIS 15 HB2 HIS 15 0.566 1.157 5.865
92 HB3 HIS 15 HB3 HIS 15 -0.007 2.814 5.871
93 HD1 HIS 15 HD1 HIS 15 -1.362 -0.262 6.461
94 HD2 HIS 15 HD2 HIS 15 -2.407 2.731 3.772
95 HE1 HIS 15 HE1 HIS 15 -3.775 -0.675 5.894
96 HE2 HIS 15 HE2 HIS 15 -4.343 1.065 4.170
97 H CYS 16 H CYS 16 1.995 -0.030 4.110
98 HA CYS 16 HA CYS 16 1.306 -1.025 1.514
99 HB2 CYS 16 HB2 CYS 16 2.712 -2.374 3.832
100 HB3 CYS 16 HB3 CYS 16 2.622 -2.994 2.185
101 H VAL 17 H VAL 17 -0.407 -2.186 0.997
102 HA VAL 17 HA VAL 17 -1.848 -3.578 3.160
103 HB VAL 17 HB VAL 17 -3.921 -3.288 1.925
104 HG11 VAL 17 HG11 VAL 17 -4.210 -0.874 2.178
105 HG12 VAL 17 HG12 VAL 17 -2.460 -0.675 2.275
106 HG13 VAL 17 HG13 VAL 17 -3.317 -1.571 3.529
107 HG21 VAL 17 HG21 VAL 17 -2.295 -1.712 -0.072
108 HG22 VAL 17 HG22 VAL 17 -4.054 -1.856 -0.064
109 HG23 VAL 17 HG23 VAL 17 -3.053 -3.281 -0.352
110 H SER 18 H SER 18 -2.379 -5.613 2.901
111 HA SER 18 HA SER 18 -0.936 -7.172 1.045
112 HB2 SER 18 HB2 SER 18 -2.066 -9.050 2.101
113 HB3 SER 18 HB3 SER 18 -1.516 -7.920 3.321
114 HG SER 18 HG SER 18 -3.520 -7.411 3.810
115 HA PRO 19 HA PRO 19 -3.496 -7.299 -2.506
116 HB2 PRO 19 HB2 PRO 19 -3.298 -9.921 -3.258
117 HB3 PRO 19 HB3 PRO 19 -2.024 -8.721 -3.503
118 HG2 PRO 19 HG2 PRO 19 -2.334 -10.720 -1.289
119 HG3 PRO 19 HG3 PRO 19 -0.887 -10.320 -2.236
120 HD2 PRO 19 HD2 PRO 19 -1.223 -9.307 0.202
121 HD3 PRO 19 HD3 PRO 19 -0.561 -8.308 -1.109
122 H LYS 20 H LYS 20 -4.922 -7.770 0.033
123 HA LYS 20 HA LYS 20 -7.303 -9.013 -1.123
124 HB2 LYS 20 HB2 LYS 20 -6.138 -10.727 0.266
125 HB3 LYS 20 HB3 LYS 20 -6.268 -9.655 1.650
126 HG2 LYS 20 HG2 LYS 20 -8.681 -9.807 1.585
127 HG3 LYS 20 HG3 LYS 20 -8.600 -10.800 0.129
128 HD2 LYS 20 HD2 LYS 20 -7.354 -11.570 2.763
129 HD3 LYS 20 HD3 LYS 20 -8.962 -12.079 2.250
130 HE2 LYS 20 HE2 LYS 20 -6.397 -12.651 0.764
131 HE3 LYS 20 HE3 LYS 20 -7.236 -13.789 1.814
132 HZ1 LYS 20 HZ1 LYS 20 -9.145 -13.687 0.338
133 HZ2 LYS 20 HZ2 LYS 20 -7.768 -14.176 -0.505
134 HZ3 LYS 20 HZ3 LYS 20 -8.341 -12.596 -0.673
135 H ILE 21 H ILE 21 -5.857 -6.432 0.203
136 HA ILE 21 HA ILE 21 -8.057 -5.552 1.911
137 HB ILE 21 HB ILE 21 -5.439 -4.190 1.266
138 HG12 ILE 21 HG12 ILE 21 -5.081 -6.264 2.509
139 HG13 ILE 21 HG13 ILE 21 -4.744 -4.868 3.526
140 HG21 ILE 21 HG21 ILE 21 -7.160 -2.597 1.911
141 HG22 ILE 21 HG22 ILE 21 -5.944 -2.742 3.180
142 HG23 ILE 21 HG23 ILE 21 -7.507 -3.538 3.362
143 HD11 ILE 21 HD11 ILE 21 -6.927 -5.124 4.589
144 HD12 ILE 21 HD12 ILE 21 -5.934 -6.572 4.757
145 HD13 ILE 21 HD13 ILE 21 -7.246 -6.535 3.580
146 H ARG 22 H ARG 22 -9.527 -4.070 1.300
147 HA ARG 22 HA ARG 22 -9.682 -3.153 -1.379
148 HB2 ARG 22 HB2 ARG 22 -11.638 -3.563 0.133
149 HB3 ARG 22 HB3 ARG 22 -11.169 -2.142 1.053
150 HG2 ARG 22 HG2 ARG 22 -11.619 -1.865 -1.864
151 HG3 ARG 22 HG3 ARG 22 -13.013 -2.019 -0.798
152 HD2 ARG 22 HD2 ARG 22 -10.818 0.026 -0.477
153 HD3 ARG 22 HD3 ARG 22 -12.370 0.333 -1.260
154 HE ARG 22 HE ARG 22 -12.204 -0.535 1.551
155 HH11 ARG 22 HH11 ARG 22 -13.331 1.700 -0.896
156 HH12 ARG 22 HH12 ARG 22 -14.322 2.599 0.205
157 HH21 ARG 22 HH21 ARG 22 -13.494 0.661 3.003
158 HH22 ARG 22 HH22 ARG 22 -14.401 2.021 2.423
159 H CYS 23 H CYS 23 -8.814 -1.392 -2.273
160 HA CYS 23 HA CYS 23 -7.340 0.434 -0.516
161 HB2 CYS 23 HB2 CYS 23 -6.212 -0.848 -2.435
162 HB3 CYS 23 HB3 CYS 23 -7.081 0.244 -3.510
163 H LEU 24 H LEU 24 -7.507 2.675 -0.760
164 HA LEU 24 HA LEU 24 -9.954 3.588 -2.079
165 HB2 LEU 24 HB2 LEU 24 -8.298 4.597 0.164
166 HB3 LEU 24 HB3 LEU 24 -9.077 5.802 -0.844
167 HG LEU 24 HG LEU 24 -10.396 5.222 1.165
168 HD11 LEU 24 HD11 LEU 24 -12.529 4.920 0.033
169 HD12 LEU 24 HD12 LEU 24 -11.693 4.410 -1.431
170 HD13 LEU 24 HD13 LEU 24 -11.508 6.060 -0.841
171 HD21 LEU 24 HD21 LEU 24 -9.758 2.876 1.361
172 HD22 LEU 24 HD22 LEU 24 -10.629 2.507 -0.123
173 HD23 LEU 24 HD23 LEU 24 -11.508 3.057 1.303
174 H GLU 25 H GLU 25 -6.591 4.767 -1.704
175 HA GLU 25 HA GLU 25 -6.691 5.425 -4.572
176 HB2 GLU 25 HB2 GLU 25 -6.856 7.487 -3.230
177 HB3 GLU 25 HB3 GLU 25 -5.357 7.072 -2.415
178 HG2 GLU 25 HG2 GLU 25 -4.144 7.250 -4.511
179 HG3 GLU 25 HG3 GLU 25 -5.648 7.606 -5.360
180 H GLU 26 H GLU 26 -5.402 3.986 -5.521
181 HA GLU 26 HA GLU 26 -3.280 2.696 -4.128
182 HB2 GLU 26 HB2 GLU 26 -3.989 2.700 -7.062
183 HB3 GLU 26 HB3 GLU 26 -2.731 1.707 -6.340
184 HG2 GLU 26 HG2 GLU 26 -4.398 0.598 -4.944
185 HG3 GLU 26 HG3 GLU 26 -5.662 1.586 -5.677
186 H GLN 27 H GLN 27 -1.281 3.259 -3.913
187 HA GLN 27 HA GLN 27 -0.153 5.363 -5.624
188 HB2 GLN 27 HB2 GLN 27 -0.149 6.628 -3.765
189 HB3 GLN 27 HB3 GLN 27 -0.601 5.270 -2.754
190 HG2 GLN 27 HG2 GLN 27 1.377 5.881 -1.819
191 HG3 GLN 27 HG3 GLN 27 1.924 4.663 -2.961
192 HE21 GLN 27 HE21 GLN 27 3.379 6.862 -1.780
193 HE22 GLN 27 HE22 GLN 27 3.955 7.826 -3.090
194 H LEU 28 H LEU 28 2.237 5.265 -5.754
195 HA LEU 28 HA LEU 28 3.041 2.453 -5.774
196 HB2 LEU 28 HB2 LEU 28 4.859 3.326 -7.366
197 HB3 LEU 28 HB3 LEU 28 3.224 3.123 -7.952
198 HG LEU 28 HG LEU 28 2.908 5.611 -7.579
199 HD11 LEU 28 HD11 LEU 28 5.913 5.536 -7.362
200 HD12 LEU 28 HD12 LEU 28 4.793 6.004 -6.082
201 HD13 LEU 28 HD13 LEU 28 4.924 6.984 -7.543
202 HD21 LEU 28 HD21 LEU 28 4.099 6.157 -9.664
203 HD22 LEU 28 HD22 LEU 28 3.182 4.652 -9.756
204 HD23 LEU 28 HD23 LEU 28 4.933 4.606 -9.553
205 H GLY 29 H GLY 29 4.954 1.778 -5.023
206 HA2 GLY 29 HA2 GLY 29 6.884 3.373 -3.728
207 HA3 GLY 29 HA3 GLY 29 5.699 2.820 -2.550
208 H LEU 30 H LEU 30 7.721 1.738 -1.711
209 HA LEU 30 HA LEU 30 7.987 -0.857 -3.033
210 HB2 LEU 30 HB2 LEU 30 10.008 0.548 -2.977
211 HB3 LEU 30 HB3 LEU 30 9.980 0.477 -1.240
212 HG LEU 30 HG LEU 30 9.988 -2.093 -2.721
213 HD11 LEU 30 HD11 LEU 30 12.436 -2.035 -2.836
214 HD12 LEU 30 HD12 LEU 30 12.412 -0.343 -2.343
215 HD13 LEU 30 HD13 LEU 30 11.698 -0.824 -3.883
216 HD21 LEU 30 HD21 LEU 30 11.294 -1.086 -0.211
217 HD22 LEU 30 HD22 LEU 30 11.246 -2.766 -0.761
218 HD23 LEU 30 HD23 LEU 30 9.753 -1.937 -0.300
219 H CYS 31 H CYS 31 6.856 -2.256 -2.080
220 HA CYS 31 HA CYS 31 6.872 -2.416 0.862
221 HB2 CYS 31 HB2 CYS 31 4.807 -3.507 -1.064
222 HB3 CYS 31 HB3 CYS 31 4.783 -3.708 0.684
223 HA PRO 32 HA PRO 32 9.019 -6.142 -0.272
224 HB2 PRO 32 HB2 PRO 32 10.230 -6.598 2.038
225 HB3 PRO 32 HB3 PRO 32 10.613 -5.138 1.118
226 HG2 PRO 32 HG2 PRO 32 8.904 -5.457 3.549
227 HG3 PRO 32 HG3 PRO 32 10.003 -4.129 3.118
228 HD2 PRO 32 HD2 PRO 32 7.200 -4.200 2.732
229 HD3 PRO 32 HD3 PRO 32 8.330 -3.013 2.049
230 H LEU 33 H LEU 33 7.251 -7.582 -0.601
231 HA LEU 33 HA LEU 33 7.133 -9.704 1.255
232 HB2 LEU 33 HB2 LEU 33 4.790 -7.839 1.210
233 HB3 LEU 33 HB3 LEU 33 4.522 -9.555 1.435
234 HG LEU 33 HG LEU 33 6.140 -7.739 3.220
235 HD11 LEU 33 HD11 LEU 33 3.748 -7.485 3.507
236 HD12 LEU 33 HD12 LEU 33 4.469 -8.285 4.903
237 HD13 LEU 33 HD13 LEU 33 3.575 -9.229 3.710
238 HD21 LEU 33 HD21 LEU 33 6.282 -9.772 4.678
239 HD22 LEU 33 HD22 LEU 33 7.267 -9.802 3.220
240 HD23 LEU 33 HD23 LEU 33 5.755 -10.712 3.280
241 H LYS 34 H LYS 34 4.324 -8.801 -0.689
242 HA LYS 34 HA LYS 34 5.148 -10.734 -2.724
243 HB2 LYS 34 HB2 LYS 34 2.515 -10.720 -1.253
244 HB3 LYS 34 HB3 LYS 34 2.859 -11.710 -2.668
245 HG2 LYS 34 HG2 LYS 34 4.799 -12.659 -1.319
246 HG3 LYS 34 HG3 LYS 34 4.046 -11.897 0.078
247 HD2 LYS 34 HD2 LYS 34 2.019 -13.172 -0.269
248 HD3 LYS 34 HD3 LYS 34 2.683 -13.881 -1.741
249 HE2 LYS 34 HE2 LYS 34 4.449 -14.946 -0.428
250 HE3 LYS 34 HE3 LYS 34 3.789 -14.234 1.042
251 HZ1 LYS 34 HZ1 LYS 34 2.371 -16.157 -0.721
252 HZ2 LYS 34 HZ2 LYS 34 1.761 -15.489 0.708
253 HZ3 LYS 34 HZ3 LYS 34 3.091 -16.532 0.761
254 H ARG 35 H ARG 35 1.969 -9.317 -2.286
255 HA ARG 35 HA ARG 35 2.346 -7.759 -4.735
256 HB2 ARG 35 HB2 ARG 35 0.098 -9.501 -3.861
257 HB3 ARG 35 HB3 ARG 35 -0.272 -8.075 -4.816
258 HG2 ARG 35 HG2 ARG 35 1.488 -8.953 -6.448
259 HG3 ARG 35 HG3 ARG 35 1.324 -10.478 -5.572
260 HD2 ARG 35 HD2 ARG 35 -0.149 -10.289 -7.583
261 HD3 ARG 35 HD3 ARG 35 -1.011 -10.599 -6.076
262 HE ARG 35 HE ARG 35 -0.820 -7.799 -6.703
263 HH11 ARG 35 HH11 ARG 35 -2.642 -10.731 -7.298
264 HH12 ARG 35 HH12 ARG 35 -4.100 -9.890 -7.724
265 HH21 ARG 35 HH21 ARG 35 -2.751 -6.695 -7.239
266 HH22 ARG 35 HH22 ARG 35 -4.165 -7.602 -7.675
267 H TRP 36 H TRP 36 2.838 -6.784 -2.145
268 HA TRP 36 HA TRP 36 0.458 -5.652 -1.060
269 HB2 TRP 36 HB2 TRP 36 3.368 -5.519 -0.354
270 HB3 TRP 36 HB3 TRP 36 2.180 -4.510 0.474
271 HD1 TRP 36 HD1 TRP 36 2.315 -8.314 -0.440
272 HE1 TRP 36 HE1 TRP 36 1.530 -9.621 1.634
273 HE3 TRP 36 HE3 TRP 36 1.428 -4.391 2.697
274 HZ2 TRP 36 HZ2 TRP 36 0.647 -9.045 4.262
275 HZ3 TRP 36 HZ3 TRP 36 0.614 -4.852 4.942
276 HH2 TRP 36 HH2 TRP 36 0.234 -7.119 5.715
277 H THR 37 H THR 37 -0.486 -3.904 -1.596
278 HA THR 37 HA THR 37 0.726 -2.089 -3.514
279 HB THR 37 HB THR 37 -2.086 -2.208 -2.395
280 HG1 THR 37 HG1 THR 37 -1.232 -3.998 -3.787
281 HG21 THR 37 HG21 THR 37 -1.585 0.020 -3.211
282 HG22 THR 37 HG22 THR 37 -2.680 -0.793 -4.331
283 HG23 THR 37 HG23 THR 37 -0.967 -0.646 -4.724
284 H CYS 38 H CYS 38 1.069 0.116 -3.126
285 HA CYS 38 HA CYS 38 1.227 0.884 -0.333
286 HB2 CYS 38 HB2 CYS 38 1.847 2.588 -2.746
287 HB3 CYS 38 HB3 CYS 38 2.487 2.743 -1.110
288 H CYS 39 H CYS 39 -0.905 1.086 0.314
289 HA CYS 39 HA CYS 39 -2.775 2.473 -1.396
290 HB2 CYS 39 HB2 CYS 39 -3.196 0.447 0.220
291 HB3 CYS 39 HB3 CYS 39 -3.414 1.724 1.406
292 H LYS 40 H LYS 40 -2.799 4.581 -1.431
293 HA LYS 40 HA LYS 40 -2.047 6.203 0.798
294 HB2 LYS 40 HB2 LYS 40 -1.850 7.091 -1.472
295 HB3 LYS 40 HB3 LYS 40 -3.584 6.928 -1.705
296 HG2 LYS 40 HG2 LYS 40 -3.011 9.233 -1.260
297 HG3 LYS 40 HG3 LYS 40 -3.969 8.582 0.070
298 HD2 LYS 40 HD2 LYS 40 -1.866 8.180 1.324
299 HD3 LYS 40 HD3 LYS 40 -0.976 8.960 0.016
300 HE2 LYS 40 HE2 LYS 40 -3.112 10.238 1.719
301 HE3 LYS 40 HE3 LYS 40 -1.376 10.500 1.871
302 HZ1 LYS 40 HZ1 LYS 40 -1.395 11.382 -0.412
303 HZ2 LYS 40 HZ2 LYS 40 -2.349 12.292 0.649
304 HZ3 LYS 40 HZ3 LYS 40 -3.081 11.232 -0.445
305 H GLU 41 H GLU 41 -3.215 5.501 2.504
306 HA GLU 41 HA GLU 41 -4.853 5.477 4.036
307 HB2 GLU 41 HB2 GLU 41 -6.358 7.277 2.139
308 HB3 GLU 41 HB3 GLU 41 -6.733 6.995 3.831
309 HG2 GLU 41 HG2 GLU 41 -4.229 8.291 2.783
310 HG3 GLU 41 HG3 GLU 41 -5.597 9.121 3.524
311 H ILE 42 H ILE 42 -6.963 4.615 4.526
312 HA ILE 42 HA ILE 42 -8.215 3.167 2.329
313 HB ILE 42 HB ILE 42 -8.579 1.185 3.768
314 HG12 ILE 42 HG12 ILE 42 -8.175 2.324 5.973
315 HG13 ILE 42 HG13 ILE 42 -7.336 0.796 5.783
316 HG21 ILE 42 HG21 ILE 42 -6.865 1.117 2.101
317 HG22 ILE 42 HG22 ILE 42 -6.306 0.263 3.540
318 HG23 ILE 42 HG23 ILE 42 -5.714 1.888 3.192
319 HD11 ILE 42 HD11 ILE 42 -5.258 2.003 5.325
320 HD12 ILE 42 HD12 ILE 42 -5.939 2.428 6.894
321 HD13 ILE 42 HD13 ILE 42 -6.110 3.532 5.532