NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
540477 |
2leo   |
17719 | cing | 1-original | 9 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 SER 20 1HT SER 20 14.504 1.214 10.954
2 H2 SER 20 2HT SER 20 15.706 1.617 9.828
3 H3 SER 20 3HT SER 20 14.497 0.498 9.432
4 HA SER 20 HA SER 20 14.106 2.625 8.424
5 HB2 SER 20 2HB SER 20 12.136 1.805 10.566
6 HB3 SER 20 1HB SER 20 11.765 2.737 9.110
7 HG SER 20 HG SER 20 11.358 0.799 8.393
8 H GLU 21 H GLU 21 14.424 4.764 8.615
9 HA GLU 21 HA GLU 21 14.893 5.804 11.289
10 HB2 GLU 21 2HB GLU 21 15.688 6.852 8.562
11 HB3 GLU 21 1HB GLU 21 15.895 7.770 10.038
12 HG2 GLU 21 2HG GLU 21 17.979 6.743 9.366
13 HG3 GLU 21 1HG GLU 21 17.424 6.057 10.888
14 H ALA 22 H ALA 22 13.278 6.733 12.194
15 HA ALA 22 HA ALA 22 11.802 8.810 10.893
16 HB1 ALA 22 1HB ALA 22 10.486 6.844 10.213
17 HB2 ALA 22 2HB ALA 22 9.587 7.836 11.361
18 HB3 ALA 22 3HB ALA 22 10.356 6.347 11.900
19 H ALA 23 H ALA 23 10.872 10.178 12.435
20 HA ALA 23 HA ALA 23 11.987 9.959 15.073
21 HB1 ALA 23 1HB ALA 23 11.694 12.165 14.016
22 HB2 ALA 23 2HB ALA 23 10.769 12.063 15.514
23 HB3 ALA 23 3HB ALA 23 9.949 11.911 13.963
24 H SER 24 H SER 24 8.844 9.755 13.578
25 HA SER 24 HA SER 24 7.766 8.483 15.979
26 HB2 SER 24 2HB SER 24 6.315 9.699 13.616
27 HB3 SER 24 1HB SER 24 5.584 9.119 15.113
28 HG SER 24 HG SER 24 7.329 10.812 15.929
29 H LEU 25 H LEU 25 8.128 6.335 15.699
30 HA LEU 25 HA LEU 25 8.295 5.113 13.125
31 HB2 LEU 25 2HB LEU 25 8.101 3.916 15.900
32 HB3 LEU 25 1HB LEU 25 8.226 2.945 14.455
33 HG LEU 25 HG LEU 25 10.358 3.026 15.505
34 HD11 LEU 25 1HD1 LEU 25 10.356 4.769 13.073
35 HD12 LEU 25 2HD1 LEU 25 10.435 3.010 13.118
36 HD13 LEU 25 3HD1 LEU 25 11.771 3.974 13.752
37 HD21 LEU 25 3HD2 LEU 25 10.150 5.034 16.841
38 HD22 LEU 25 1HD2 LEU 25 10.177 6.034 15.386
39 HD23 LEU 25 2HD2 LEU 25 11.608 5.123 15.854
40 H SER 26 H SER 26 6.584 4.958 11.892
41 HA SER 26 HA SER 26 4.046 4.343 13.205
42 HB2 SER 26 2HB SER 26 4.417 6.063 10.750
43 HB3 SER 26 1HB SER 26 2.951 5.822 11.708
44 HG SER 26 HG SER 26 5.338 7.138 12.467
45 HA PRO 27 HA PRO 27 4.505 1.154 9.972
46 HB2 PRO 27 2HB PRO 27 3.954 -0.901 11.874
47 HB3 PRO 27 1HB PRO 27 5.516 -0.530 11.144
48 HG2 PRO 27 2HG PRO 27 4.915 -0.192 13.839
49 HG3 PRO 27 1HG PRO 27 6.230 0.622 12.983
50 HD2 PRO 27 2HD PRO 27 3.496 1.632 13.646
51 HD3 PRO 27 1HD PRO 27 5.059 2.481 13.715
52 H LYS 28 H LYS 28 2.577 1.922 9.150
53 HA LYS 28 HA LYS 28 0.100 0.963 10.376
54 HB2 LYS 28 2HB LYS 28 0.599 3.088 8.292
55 HB3 LYS 28 1HB LYS 28 -0.990 2.486 8.718
56 HG2 LYS 28 2HG LYS 28 0.892 3.821 10.640
57 HG3 LYS 28 1HG LYS 28 -0.428 4.622 9.781
58 HD2 LYS 28 2HD LYS 28 -1.993 2.963 10.824
59 HD3 LYS 28 1HD LYS 28 -0.636 2.392 11.791
60 HE2 LYS 28 2HE LYS 28 -1.714 5.208 11.788
61 HE3 LYS 28 1HE LYS 28 -2.059 3.992 13.008
62 HZ1 LYS 28 3HZ LYS 28 0.374 3.944 13.480
63 HZ2 LYS 28 1HZ LYS 28 -0.366 5.428 13.789
64 HZ3 LYS 28 2HZ LYS 28 0.545 5.269 12.411
65 H LYS 29 H LYS 29 -1.270 -0.337 9.283
66 HA LYS 29 HA LYS 29 -0.587 -1.075 6.555
67 HB2 LYS 29 2HB LYS 29 -1.269 -3.040 8.773
68 HB3 LYS 29 1HB LYS 29 -1.072 -3.438 7.076
69 HG2 LYS 29 2HG LYS 29 1.283 -2.852 7.172
70 HG3 LYS 29 1HG LYS 29 1.110 -2.332 8.846
71 HD2 LYS 29 2HD LYS 29 0.477 -4.643 9.456
72 HD3 LYS 29 1HD LYS 29 0.733 -5.130 7.782
73 HE2 LYS 29 2HE LYS 29 3.082 -4.481 7.935
74 HE3 LYS 29 1HE LYS 29 2.830 -3.920 9.586
75 HZ1 LYS 29 3HZ LYS 29 2.254 -6.217 10.202
76 HZ2 LYS 29 1HZ LYS 29 3.815 -6.103 9.584
77 HZ3 LYS 29 2HZ LYS 29 2.579 -6.717 8.628
78 H VAL 30 H VAL 30 -2.310 -0.473 5.463
79 HA VAL 30 HA VAL 30 -4.904 -0.225 6.689
80 HB VAL 30 HB VAL 30 -3.961 1.290 4.868
81 HG11 VAL 30 1HG1 VAL 30 -4.211 0.606 2.522
82 HG12 VAL 30 2HG1 VAL 30 -4.545 -1.038 3.075
83 HG13 VAL 30 3HG1 VAL 30 -2.978 -0.299 3.406
84 HG21 VAL 30 3HG2 VAL 30 -6.658 0.067 4.264
85 HG22 VAL 30 1HG2 VAL 30 -6.087 1.633 3.696
86 HG23 VAL 30 2HG2 VAL 30 -6.347 1.363 5.420
87 H ASP 31 H ASP 31 -6.843 -1.401 5.388
88 HA ASP 31 HA ASP 31 -6.127 -4.164 5.564
89 HB2 ASP 31 2HB ASP 31 -8.389 -3.265 6.257
90 HB3 ASP 31 1HB ASP 31 -8.768 -3.146 4.536
91 H CYS 32 H CYS 32 -4.922 -4.865 4.087
92 HA CYS 32 HA CYS 32 -5.586 -4.391 1.284
93 HB2 CYS 32 2HB CYS 32 -3.274 -3.899 2.116
94 HB3 CYS 32 1HB CYS 32 -3.116 -5.579 2.586
95 H SER 33 H SER 33 -6.103 -6.487 3.815
96 HA SER 33 HA SER 33 -5.584 -9.023 2.802
97 HB2 SER 33 2HB SER 33 -7.654 -8.157 4.791
98 HB3 SER 33 1HB SER 33 -6.929 -9.762 4.636
99 HG SER 33 HG SER 33 -5.674 -8.947 6.103
100 H ILE 34 H ILE 34 -8.558 -7.037 2.777
101 HA ILE 34 HA ILE 34 -10.144 -9.041 1.581
102 HB ILE 34 HB ILE 34 -11.736 -7.240 0.979
103 HG12 ILE 34 2HG1 ILE 34 -9.671 -5.383 2.198
104 HG13 ILE 34 1HG1 ILE 34 -10.065 -5.479 0.486
105 HG21 ILE 34 1HG2 ILE 34 -12.254 -6.570 3.289
106 HG22 ILE 34 2HG2 ILE 34 -10.656 -7.116 3.793
107 HG23 ILE 34 3HG2 ILE 34 -11.830 -8.280 3.177
108 HD11 ILE 34 3HD1 ILE 34 -11.976 -4.693 2.662
109 HD12 ILE 34 1HD1 ILE 34 -12.304 -4.699 0.934
110 HD13 ILE 34 2HD1 ILE 34 -11.121 -3.567 1.604
111 H TYR 35 H TYR 35 -7.811 -6.927 0.210
112 HA TYR 35 HA TYR 35 -8.875 -7.355 -2.461
113 HB2 TYR 35 2HB TYR 35 -6.529 -5.677 -1.551
114 HB3 TYR 35 1HB TYR 35 -7.116 -5.788 -3.203
115 HD1 TYR 35 2HD TYR 35 -9.614 -5.140 -3.564
116 HD2 TYR 35 1HD TYR 35 -7.341 -4.001 -0.157
117 HE1 TYR 35 2HE TYR 35 -11.197 -3.320 -3.125
118 HE2 TYR 35 1HE TYR 35 -8.921 -2.176 0.293
119 HH TYR 35 HH TYR 35 -10.576 -0.872 -0.749
120 H LYS 36 H LYS 36 -6.497 -8.339 -0.298
121 HA LYS 36 HA LYS 36 -4.630 -9.645 -1.965
122 HB2 LYS 36 2HB LYS 36 -4.291 -8.906 0.380
123 HB3 LYS 36 1HB LYS 36 -5.445 -10.109 0.906
124 HG2 LYS 36 2HG LYS 36 -3.969 -11.864 0.225
125 HG3 LYS 36 1HG LYS 36 -2.844 -10.657 -0.432
126 HD2 LYS 36 2HD LYS 36 -2.513 -9.709 1.776
127 HD3 LYS 36 1HD LYS 36 -3.683 -10.835 2.460
128 HE2 LYS 36 2HE LYS 36 -1.121 -11.626 1.100
129 HE3 LYS 36 1HE LYS 36 -1.310 -11.474 2.848
130 HZ1 LYS 36 3HZ LYS 36 -2.963 -13.230 2.761
131 HZ2 LYS 36 1HZ LYS 36 -1.499 -13.737 2.127
132 HZ3 LYS 36 2HZ LYS 36 -2.770 -13.389 1.085
133 H LYS 37 H LYS 37 -7.763 -10.280 -1.035
134 HA LYS 37 HA LYS 37 -7.892 -13.127 -1.269
135 HB2 LYS 37 2HB LYS 37 -9.510 -11.768 0.023
136 HB3 LYS 37 1HB LYS 37 -10.017 -10.991 -1.465
137 HG2 LYS 37 2HG LYS 37 -10.868 -13.151 -2.278
138 HG3 LYS 37 1HG LYS 37 -10.388 -13.898 -0.756
139 HD2 LYS 37 2HD LYS 37 -12.769 -13.367 -0.722
140 HD3 LYS 37 1HD LYS 37 -11.901 -12.386 0.454
141 HE2 LYS 37 2HE LYS 37 -11.946 -10.473 -1.048
142 HE3 LYS 37 1HE LYS 37 -12.688 -11.454 -2.311
143 HZ1 LYS 37 3HZ LYS 37 -14.292 -10.069 -1.175
144 HZ2 LYS 37 1HZ LYS 37 -13.930 -10.779 0.310
145 HZ3 LYS 37 2HZ LYS 37 -14.641 -11.678 -0.937
146 H TYR 38 H TYR 38 -7.632 -10.520 -3.488
147 HA TYR 38 HA TYR 38 -8.739 -12.083 -5.721
148 HB2 TYR 38 2HB TYR 38 -7.896 -9.180 -5.626
149 HB3 TYR 38 1HB TYR 38 -8.683 -9.971 -6.973
150 HD1 TYR 38 2HD TYR 38 -11.089 -11.032 -6.265
151 HD2 TYR 38 1HD TYR 38 -9.096 -7.826 -4.339
152 HE1 TYR 38 2HE TYR 38 -13.247 -10.211 -5.405
153 HE2 TYR 38 1HE TYR 38 -11.233 -6.993 -3.468
154 HH TYR 38 HH TYR 38 -13.604 -7.135 -4.159
155 HA PRO 39 HA PRO 39 -4.528 -12.596 -7.276
156 HB2 PRO 39 2HB PRO 39 -4.913 -12.019 -9.949
157 HB3 PRO 39 1HB PRO 39 -5.292 -13.589 -9.228
158 HG2 PRO 39 2HG PRO 39 -7.098 -11.283 -9.825
159 HG3 PRO 39 1HG PRO 39 -7.371 -13.017 -10.090
160 HD2 PRO 39 2HD PRO 39 -8.465 -11.749 -8.020
161 HD3 PRO 39 1HD PRO 39 -7.847 -13.403 -7.847
162 H VAL 40 H VAL 40 -2.833 -11.249 -7.516
163 HA VAL 40 HA VAL 40 -3.111 -8.570 -6.829
164 HB VAL 40 HB VAL 40 -0.683 -9.910 -8.057
165 HG11 VAL 40 1HG1 VAL 40 -0.476 -7.481 -8.150
166 HG12 VAL 40 2HG1 VAL 40 0.628 -8.160 -6.954
167 HG13 VAL 40 3HG1 VAL 40 -0.863 -7.373 -6.434
168 HG21 VAL 40 3HG2 VAL 40 0.056 -10.181 -5.727
169 HG22 VAL 40 1HG2 VAL 40 -1.449 -11.048 -6.044
170 HG23 VAL 40 2HG2 VAL 40 -1.478 -9.517 -5.174
171 H VAL 41 H VAL 41 -2.959 -9.952 -10.044
172 HA VAL 41 HA VAL 41 -2.456 -7.376 -11.236
173 HB VAL 41 HB VAL 41 -1.682 -9.521 -12.297
174 HG11 VAL 41 1HG1 VAL 41 -3.658 -10.904 -11.958
175 HG12 VAL 41 2HG1 VAL 41 -3.211 -10.841 -13.662
176 HG13 VAL 41 3HG1 VAL 41 -4.567 -9.885 -13.071
177 HG21 VAL 41 3HG2 VAL 41 -3.409 -7.759 -14.029
178 HG22 VAL 41 1HG2 VAL 41 -2.144 -8.842 -14.609
179 HG23 VAL 41 2HG2 VAL 41 -1.726 -7.468 -13.586
180 H ALA 42 H ALA 42 -5.293 -9.142 -10.289
181 HA ALA 42 HA ALA 42 -6.896 -7.077 -11.591
182 HB1 ALA 42 1HB ALA 42 -8.662 -8.685 -12.070
183 HB2 ALA 42 2HB ALA 42 -7.681 -9.982 -11.388
184 HB3 ALA 42 3HB ALA 42 -7.157 -9.163 -12.856
185 H ILE 43 H ILE 43 -7.115 -5.896 -9.795
186 HA ILE 43 HA ILE 43 -8.609 -7.136 -7.612
187 HB ILE 43 HB ILE 43 -6.506 -4.949 -7.436
188 HG12 ILE 43 2HG1 ILE 43 -6.586 -7.720 -6.222
189 HG13 ILE 43 1HG1 ILE 43 -5.595 -7.236 -7.591
190 HG21 ILE 43 1HG2 ILE 43 -8.236 -6.061 -5.240
191 HG22 ILE 43 2HG2 ILE 43 -8.384 -4.460 -5.963
192 HG23 ILE 43 3HG2 ILE 43 -6.936 -4.879 -5.046
193 HD11 ILE 43 3HD1 ILE 43 -4.309 -7.368 -5.531
194 HD12 ILE 43 1HD1 ILE 43 -5.372 -6.177 -4.784
195 HD13 ILE 43 2HD1 ILE 43 -4.358 -5.715 -6.152
196 HA PRO 44 HA PRO 44 -11.474 -4.032 -9.202
197 HB2 PRO 44 2HB PRO 44 -13.219 -5.036 -7.066
198 HB3 PRO 44 1HB PRO 44 -13.476 -5.038 -8.809
199 HG2 PRO 44 2HG PRO 44 -12.997 -7.305 -7.445
200 HG3 PRO 44 1HG PRO 44 -12.431 -7.061 -9.106
201 HD2 PRO 44 2HD PRO 44 -10.922 -6.869 -6.542
202 HD3 PRO 44 1HD PRO 44 -10.443 -7.562 -8.111
203 H CYS 45 H CYS 45 -11.745 -1.986 -8.540
204 HA CYS 45 HA CYS 45 -11.162 -1.374 -5.737
205 HB2 CYS 45 2HB CYS 45 -10.444 0.149 -8.246
206 HB3 CYS 45 1HB CYS 45 -10.260 0.823 -6.638
207 HA PRO 46 HA PRO 46 -15.096 0.691 -5.666
208 HB2 PRO 46 2HB PRO 46 -14.549 2.609 -3.789
209 HB3 PRO 46 1HB PRO 46 -14.926 0.935 -3.386
210 HG2 PRO 46 2HG PRO 46 -12.274 2.295 -3.565
211 HG3 PRO 46 1HG PRO 46 -12.847 1.108 -2.377
212 HD2 PRO 46 2HD PRO 46 -11.210 0.450 -4.413
213 HD3 PRO 46 1HD PRO 46 -12.430 -0.671 -3.773
214 H ILE 47 H ILE 47 -16.028 2.709 -6.225
215 HA ILE 47 HA ILE 47 -14.375 4.251 -8.018
216 HB ILE 47 HB ILE 47 -16.545 5.445 -8.614
217 HG12 ILE 47 2HG1 ILE 47 -18.656 4.134 -8.070
218 HG13 ILE 47 1HG1 ILE 47 -17.740 3.268 -6.860
219 HG21 ILE 47 1HG2 ILE 47 -15.621 3.722 -10.001
220 HG22 ILE 47 2HG2 ILE 47 -17.378 3.564 -9.953
221 HG23 ILE 47 3HG2 ILE 47 -16.367 2.477 -9.003
222 HD11 ILE 47 3HD1 ILE 47 -19.100 5.002 -5.859
223 HD12 ILE 47 1HD1 ILE 47 -18.329 6.218 -6.876
224 HD13 ILE 47 2HD1 ILE 47 -17.387 5.376 -5.649
225 H THR 48 H THR 48 -14.423 4.431 -4.997
226 HA THR 48 HA THR 48 -14.854 7.270 -4.585
227 HB THR 48 HB THR 48 -13.962 5.116 -2.643
228 HG1 THR 48 1HG THR 48 -16.549 6.105 -3.275
229 HG21 THR 48 3HG2 THR 48 -15.329 7.787 -2.188
230 HG22 THR 48 1HG2 THR 48 -13.613 7.477 -1.929
231 HG23 THR 48 2HG2 THR 48 -14.816 6.651 -0.940
232 H TYR 49 H TYR 49 -13.144 8.676 -4.376
233 HA TYR 49 HA TYR 49 -10.451 7.567 -4.686
234 HB2 TYR 49 2HB TYR 49 -11.198 9.165 -6.435
235 HB3 TYR 49 1HB TYR 49 -11.486 10.370 -5.190
236 HD1 TYR 49 1HD TYR 49 -9.601 11.546 -4.138
237 HD2 TYR 49 2HD TYR 49 -8.951 8.626 -7.165
238 HE1 TYR 49 1HE TYR 49 -7.297 12.358 -4.415
239 HE2 TYR 49 2HE TYR 49 -6.645 9.430 -7.445
240 HH TYR 49 HH TYR 49 -5.135 11.526 -5.245
241 H LEU 50 H LEU 50 -9.351 7.496 -2.885
242 HA LEU 50 HA LEU 50 -9.701 9.577 -0.889
243 HB2 LEU 50 2HB LEU 50 -9.556 6.604 -0.353
244 HB3 LEU 50 1HB LEU 50 -9.439 7.840 0.878
245 HG LEU 50 HG LEU 50 -11.868 7.332 -0.833
246 HD11 LEU 50 1HD1 LEU 50 -11.424 5.494 0.685
247 HD12 LEU 50 2HD1 LEU 50 -12.840 6.411 1.207
248 HD13 LEU 50 3HD1 LEU 50 -11.292 6.626 2.032
249 HD21 LEU 50 3HD2 LEU 50 -11.714 9.656 -0.091
250 HD22 LEU 50 1HD2 LEU 50 -11.461 9.118 1.571
251 HD23 LEU 50 2HD2 LEU 50 -13.000 8.812 0.773
252 HA PRO 51 HA PRO 51 -5.427 9.271 -2.188
253 HB2 PRO 51 2HB PRO 51 -4.614 11.470 -0.702
254 HB3 PRO 51 1HB PRO 51 -5.184 11.535 -2.369
255 HG2 PRO 51 2HG PRO 51 -6.584 12.218 0.141
256 HG3 PRO 51 1HG PRO 51 -6.807 12.867 -1.488
257 HD2 PRO 51 2HD PRO 51 -8.499 11.074 -0.267
258 HD3 PRO 51 1HD PRO 51 -8.382 11.247 -2.020
259 H VAL 52 H VAL 52 -4.105 7.954 -1.298
260 HA VAL 52 HA VAL 52 -3.690 8.075 1.593
261 HB VAL 52 HB VAL 52 -3.304 5.628 1.642
262 HG11 VAL 52 1HG1 VAL 52 -6.043 6.396 0.644
263 HG12 VAL 52 2HG1 VAL 52 -5.483 6.432 2.317
264 HG13 VAL 52 3HG1 VAL 52 -5.651 4.892 1.474
265 HG21 VAL 52 3HG2 VAL 52 -2.711 5.239 -0.663
266 HG22 VAL 52 1HG2 VAL 52 -4.340 5.667 -1.194
267 HG23 VAL 52 2HG2 VAL 52 -4.080 4.215 -0.226
268 H CYS 53 H CYS 53 -1.588 7.450 2.258
269 HA CYS 53 HA CYS 53 0.362 7.795 0.105
270 HB2 CYS 53 2HB CYS 53 0.241 9.781 1.479
271 HB3 CYS 53 1HB CYS 53 0.475 8.843 2.940
272 H GLY 54 H GLY 54 1.826 6.297 -0.092
273 HA2 GLY 54 2HA GLY 54 1.877 4.128 1.826
274 HA3 GLY 54 1HA GLY 54 2.633 4.150 0.237
275 H SER 55 H SER 55 3.974 3.225 2.442
276 HA SER 55 HA SER 55 5.625 5.096 3.770
277 HB2 SER 55 2HB SER 55 6.982 3.054 4.273
278 HB3 SER 55 1HB SER 55 5.265 2.880 4.645
279 HG SER 55 HG SER 55 6.824 1.661 2.736
280 H ASP 56 H ASP 56 5.614 3.968 0.638
281 HA ASP 56 HA ASP 56 8.434 4.317 0.037
282 HB2 ASP 56 2HB ASP 56 6.838 2.608 -1.028
283 HB3 ASP 56 1HB ASP 56 6.140 3.963 -1.902
284 H TYR 57 H TYR 57 5.962 6.332 0.690
285 HA TYR 57 HA TYR 57 5.519 8.478 0.505
286 HB2 TYR 57 2HB TYR 57 8.233 8.650 -0.827
287 HB3 TYR 57 1HB TYR 57 7.239 10.061 -0.482
288 HD1 TYR 57 2HD TYR 57 6.431 10.269 2.007
289 HD2 TYR 57 1HD TYR 57 9.783 7.966 0.763
290 HE1 TYR 57 2HE TYR 57 7.335 10.372 4.287
291 HE2 TYR 57 1HE TYR 57 10.696 8.059 3.046
292 HH TYR 57 HH TYR 57 8.925 8.916 5.702
293 H ILE 58 H ILE 58 4.602 6.657 -1.387
294 HA ILE 58 HA ILE 58 4.209 8.405 -3.712
295 HB ILE 58 HB ILE 58 3.725 5.415 -3.493
296 HG12 ILE 58 2HG1 ILE 58 6.126 5.917 -3.496
297 HG13 ILE 58 1HG1 ILE 58 5.646 5.153 -5.006
298 HG21 ILE 58 1HG2 ILE 58 3.379 5.480 -5.925
299 HG22 ILE 58 2HG2 ILE 58 3.549 7.233 -5.891
300 HG23 ILE 58 3HG2 ILE 58 2.195 6.465 -5.063
301 HD11 ILE 58 3HD1 ILE 58 7.221 6.933 -5.408
302 HD12 ILE 58 1HD1 ILE 58 6.175 8.089 -4.581
303 HD13 ILE 58 2HD1 ILE 58 5.653 7.353 -6.095
304 H THR 59 H THR 59 2.240 9.302 -3.904
305 HA THR 59 HA THR 59 0.136 8.599 -2.062
306 HB THR 59 HB THR 59 0.105 10.610 -4.341
307 HG1 THR 59 1HG THR 59 1.703 10.837 -2.508
308 HG21 THR 59 3HG2 THR 59 -1.714 11.657 -3.022
309 HG22 THR 59 1HG2 THR 59 -1.645 10.305 -1.891
310 HG23 THR 59 2HG2 THR 59 -2.131 10.029 -3.564
311 H TYR 60 H TYR 60 -1.615 7.425 -2.550
312 HA TYR 60 HA TYR 60 -1.925 6.450 -5.302
313 HB2 TYR 60 2HB TYR 60 -2.368 5.040 -2.679
314 HB3 TYR 60 1HB TYR 60 -2.981 4.402 -4.211
315 HD1 TYR 60 1HD TYR 60 0.016 5.099 -2.210
316 HD2 TYR 60 2HD TYR 60 -1.465 3.467 -5.828
317 HE1 TYR 60 1HE TYR 60 2.199 4.080 -2.625
318 HE2 TYR 60 2HE TYR 60 0.719 2.426 -6.268
319 HH TYR 60 HH TYR 60 3.050 2.781 -5.651
320 H GLY 61 H GLY 61 -4.079 5.946 -5.980
321 HA2 GLY 61 2HA GLY 61 -5.858 8.066 -5.465
322 HA3 GLY 61 1HA GLY 61 -6.217 6.647 -6.437
323 H ASN 62 H ASN 62 -5.724 4.847 -4.128
324 HA ASN 62 HA ASN 62 -7.245 5.534 -1.935
325 HB2 ASN 62 2HB ASN 62 -9.235 4.069 -2.174
326 HB3 ASN 62 1HB ASN 62 -9.262 5.375 -3.339
327 HD21 ASN 62 1HD2 ASN 62 -10.715 4.281 -4.606
328 HD22 ASN 62 2HD2 ASN 62 -10.308 2.937 -5.601
329 H GLU 63 H GLU 63 -7.945 3.374 -0.780
330 HA GLU 63 HA GLU 63 -5.487 2.149 -0.273
331 HB2 GLU 63 2HB GLU 63 -7.058 0.530 1.148
332 HB3 GLU 63 1HB GLU 63 -6.627 2.144 1.673
333 HG2 GLU 63 2HG GLU 63 -8.977 1.653 2.057
334 HG3 GLU 63 1HG GLU 63 -8.783 2.994 0.950
335 H CYS 64 H CYS 64 -8.190 1.071 -2.152
336 HA CYS 64 HA CYS 64 -7.354 -1.550 -2.631
337 HB2 CYS 64 2HB CYS 64 -9.518 -0.794 -3.416
338 HB3 CYS 64 1HB CYS 64 -8.758 0.356 -4.515
339 H HIS 65 H HIS 65 -6.527 1.407 -4.393
340 HA HIS 65 HA HIS 65 -4.818 0.051 -6.208
341 HB2 HIS 65 2HB HIS 65 -4.938 2.999 -5.548
342 HB3 HIS 65 1HB HIS 65 -3.890 2.325 -6.789
343 HD1 HIS 65 1HD HIS 65 -5.204 1.092 -8.840
344 HD2 HIS 65 2HD HIS 65 -7.451 3.525 -6.348
345 HE1 HIS 65 1HE HIS 65 -7.362 1.489 -10.050
346 HE2 HIS 65 2HE HIS 65 -8.611 3.124 -8.602
347 H LEU 66 H LEU 66 -4.245 1.663 -3.158
348 HA LEU 66 HA LEU 66 -1.452 1.467 -3.117
349 HB2 LEU 66 2HB LEU 66 -2.616 2.784 -1.471
350 HB3 LEU 66 1HB LEU 66 -3.496 1.384 -0.901
351 HG LEU 66 HG LEU 66 -1.396 0.449 0.009
352 HD11 LEU 66 1HD1 LEU 66 0.204 1.472 -1.495
353 HD12 LEU 66 2HD1 LEU 66 0.590 1.850 0.184
354 HD13 LEU 66 3HD1 LEU 66 -0.174 3.064 -0.841
355 HD21 LEU 66 3HD2 LEU 66 -2.861 1.783 1.417
356 HD22 LEU 66 1HD2 LEU 66 -2.013 3.247 0.926
357 HD23 LEU 66 2HD2 LEU 66 -1.169 2.013 1.864
358 H CYS 67 H CYS 67 -3.965 -0.764 -2.018
359 HA CYS 67 HA CYS 67 -2.300 -2.755 -1.036
360 HB2 CYS 67 2HB CYS 67 -4.655 -2.674 -0.489
361 HB3 CYS 67 1HB CYS 67 -5.088 -2.952 -2.170
362 H THR 68 H THR 68 -3.571 -2.298 -4.338
363 HA THR 68 HA THR 68 -2.716 -4.726 -5.420
364 HB THR 68 HB THR 68 -2.754 -2.043 -6.815
365 HG1 THR 68 1HG THR 68 -4.746 -3.514 -5.750
366 HG21 THR 68 3HG2 THR 68 -1.656 -3.806 -8.121
367 HG22 THR 68 1HG2 THR 68 -3.202 -3.371 -8.851
368 HG23 THR 68 2HG2 THR 68 -3.059 -4.853 -7.905
369 H GLU 69 H GLU 69 -0.974 -1.619 -5.216
370 HA GLU 69 HA GLU 69 1.433 -2.660 -6.309
371 HB2 GLU 69 2HB GLU 69 0.513 -0.093 -5.241
372 HB3 GLU 69 1HB GLU 69 2.203 -0.433 -4.912
373 HG2 GLU 69 2HG GLU 69 1.904 0.868 -6.957
374 HG3 GLU 69 1HG GLU 69 2.662 -0.680 -7.254
375 H SER 70 H SER 70 0.185 -2.297 -3.051
376 HA SER 70 HA SER 70 2.556 -2.722 -1.639
377 HB2 SER 70 2HB SER 70 0.280 -1.919 -0.738
378 HB3 SER 70 1HB SER 70 -0.183 -3.618 -0.710
379 HG SER 70 HG SER 70 1.963 -2.389 0.619
380 H LEU 71 H LEU 71 0.123 -4.990 -2.850
381 HA LEU 71 HA LEU 71 1.460 -7.321 -1.877
382 HB2 LEU 71 2HB LEU 71 -0.599 -7.010 -4.053
383 HB3 LEU 71 1HB LEU 71 -0.064 -8.540 -3.389
384 HG LEU 71 HG LEU 71 -1.510 -6.393 -1.840
385 HD11 LEU 71 1HD1 LEU 71 -2.506 -9.025 -2.926
386 HD12 LEU 71 2HD1 LEU 71 -2.920 -7.425 -3.542
387 HD13 LEU 71 3HD1 LEU 71 -3.412 -7.897 -1.916
388 HD21 LEU 71 3HD2 LEU 71 -0.733 -9.217 -1.096
389 HD22 LEU 71 1HD2 LEU 71 -1.740 -8.140 -0.127
390 HD23 LEU 71 2HD2 LEU 71 -0.054 -7.732 -0.422
391 H LYS 72 H LYS 72 1.379 -5.594 -4.919
392 HA LYS 72 HA LYS 72 2.748 -7.445 -6.514
393 HB2 LYS 72 2HB LYS 72 1.427 -5.545 -7.311
394 HB3 LYS 72 1HB LYS 72 2.674 -4.447 -6.747
395 HG2 LYS 72 2HG LYS 72 4.253 -5.432 -8.339
396 HG3 LYS 72 1HG LYS 72 2.989 -6.522 -8.915
397 HD2 LYS 72 2HD LYS 72 2.884 -3.504 -9.021
398 HD3 LYS 72 1HD LYS 72 3.253 -4.566 -10.379
399 HE2 LYS 72 2HE LYS 72 1.022 -5.557 -10.227
400 HE3 LYS 72 1HE LYS 72 0.658 -4.560 -8.826
401 HZ1 LYS 72 3HZ LYS 72 -0.256 -3.633 -10.885
402 HZ2 LYS 72 1HZ LYS 72 1.317 -3.471 -11.494
403 HZ3 LYS 72 2HZ LYS 72 0.816 -2.623 -10.104
404 H SER 73 H SER 73 3.977 -4.658 -4.676
405 HA SER 73 HA SER 73 6.697 -5.425 -5.338
406 HB2 SER 73 2HB SER 73 5.656 -3.094 -3.722
407 HB3 SER 73 1HB SER 73 7.293 -3.295 -4.340
408 HG SER 73 HG SER 73 5.437 -2.059 -5.550
409 H ASN 74 H ASN 74 4.594 -6.549 -3.257
410 HA ASN 74 HA ASN 74 4.462 -7.429 -1.235
411 HB2 ASN 74 2HB ASN 74 7.220 -8.354 -2.007
412 HB3 ASN 74 1HB ASN 74 6.390 -8.924 -0.565
413 HD21 ASN 74 1HD2 ASN 74 6.589 -9.098 -3.994
414 HD22 ASN 74 2HD2 ASN 74 5.432 -10.362 -4.192
415 H GLY 75 H GLY 75 4.265 -5.367 -0.311
416 HA2 GLY 75 2HA GLY 75 4.406 -4.257 1.662
417 HA3 GLY 75 1HA GLY 75 5.640 -5.346 2.216
418 H ARG 76 H ARG 76 6.723 -4.033 -0.679
419 HA ARG 76 HA ARG 76 8.663 -2.303 0.337
420 HB2 ARG 76 2HB ARG 76 8.792 -2.998 -2.002
421 HB3 ARG 76 1HB ARG 76 7.234 -2.265 -2.333
422 HG2 ARG 76 2HG ARG 76 8.201 -0.040 -1.835
423 HG3 ARG 76 1HG ARG 76 9.767 -0.824 -1.641
424 HD2 ARG 76 2HD ARG 76 9.948 -1.292 -3.912
425 HD3 ARG 76 1HD ARG 76 8.205 -1.173 -4.175
426 HE ARG 76 HE ARG 76 9.077 1.308 -3.305
427 HH11 ARG 76 1HH1 ARG 76 9.896 -0.656 -6.144
428 HH12 ARG 76 2HH1 ARG 76 9.820 0.673 -7.215
429 HH21 ARG 76 1HH2 ARG 76 8.929 3.064 -4.790
430 HH22 ARG 76 2HH2 ARG 76 9.306 2.816 -6.441
431 H VAL 77 H VAL 77 5.514 -1.598 -0.999
432 HA VAL 77 HA VAL 77 5.586 0.950 0.354
433 HB VAL 77 HB VAL 77 5.319 1.183 -2.055
434 HG11 VAL 77 1HG1 VAL 77 2.862 -0.527 -1.832
435 HG12 VAL 77 2HG1 VAL 77 4.371 -0.949 -2.645
436 HG13 VAL 77 3HG1 VAL 77 3.368 0.366 -3.264
437 HG21 VAL 77 3HG2 VAL 77 3.240 2.444 -2.163
438 HG22 VAL 77 1HG2 VAL 77 4.187 2.825 -0.719
439 HG23 VAL 77 2HG2 VAL 77 2.763 1.777 -0.597
440 H GLN 78 H GLN 78 4.766 0.689 2.270
441 HA GLN 78 HA GLN 78 2.343 -0.930 2.576
442 HB2 GLN 78 2HB GLN 78 4.631 -1.087 4.018
443 HB3 GLN 78 1HB GLN 78 3.807 0.179 4.918
444 HG2 GLN 78 2HG GLN 78 3.082 -1.669 6.058
445 HG3 GLN 78 1HG GLN 78 1.806 -1.519 4.856
446 HE21 GLN 78 1HE2 GLN 78 1.822 -3.037 3.007
447 HE22 GLN 78 2HE2 GLN 78 2.673 -4.506 3.194
448 H PHE 79 H PHE 79 1.116 0.290 4.647
449 HA PHE 79 HA PHE 79 0.386 2.830 3.482
450 HB2 PHE 79 2HB PHE 79 -1.336 1.219 4.279
451 HB3 PHE 79 1HB PHE 79 -0.702 1.364 5.905
452 HD1 PHE 79 1HD PHE 79 -1.651 3.869 3.286
453 HD2 PHE 79 2HD PHE 79 -2.217 2.419 7.240
454 HE1 PHE 79 1HE PHE 79 -3.266 5.673 3.720
455 HE2 PHE 79 2HE PHE 79 -3.817 4.228 7.683
456 HZ PHE 79 HZ PHE 79 -4.346 5.854 5.916
457 H LEU 80 H LEU 80 1.080 4.773 4.202
458 HA LEU 80 HA LEU 80 2.803 4.769 6.585
459 HB2 LEU 80 2HB LEU 80 3.757 5.533 4.425
460 HB3 LEU 80 1HB LEU 80 2.556 6.800 4.368
461 HG LEU 80 HG LEU 80 3.537 7.772 6.439
462 HD11 LEU 80 1HD1 LEU 80 5.687 5.720 5.984
463 HD12 LEU 80 2HD1 LEU 80 4.577 5.774 7.358
464 HD13 LEU 80 3HD1 LEU 80 5.766 7.058 7.125
465 HD21 LEU 80 3HD2 LEU 80 4.132 8.627 4.236
466 HD22 LEU 80 1HD2 LEU 80 5.431 7.442 4.116
467 HD23 LEU 80 2HD2 LEU 80 5.503 8.709 5.339
468 H HIS 81 H HIS 81 0.468 6.847 4.900
469 HA HIS 81 HA HIS 81 -0.994 7.319 7.270
470 HB2 HIS 81 2HB HIS 81 -0.744 9.759 7.369
471 HB3 HIS 81 1HB HIS 81 0.799 8.985 7.666
472 HD1 HIS 81 1HD HIS 81 -1.019 11.056 5.032
473 HD2 HIS 81 2HD HIS 81 2.822 9.725 5.926
474 HE1 HIS 81 1HE HIS 81 0.522 12.299 3.479
475 HE2 HIS 81 2HE HIS 81 2.804 11.721 4.294
476 H ASP 82 H ASP 82 -2.850 8.669 6.793
477 HA ASP 82 HA ASP 82 -3.808 8.099 4.141
478 HB2 ASP 82 2HB ASP 82 -5.941 8.867 4.928
479 HB3 ASP 82 1HB ASP 82 -5.240 7.883 6.201
480 H GLY 83 H GLY 83 -4.707 9.771 2.778
481 HA2 GLY 83 2HA GLY 83 -4.871 11.890 1.970
482 HA3 GLY 83 1HA GLY 83 -3.865 12.488 3.297
483 H SER 84 H SER 84 -3.376 13.375 0.806
484 HA SER 84 HA SER 84 -1.502 11.973 -0.702
485 HB2 SER 84 2HB SER 84 -1.778 14.955 -0.272
486 HB3 SER 84 1HB SER 84 -1.018 14.168 -1.665
487 HG SER 84 HG SER 84 -3.017 13.417 -2.305
488 H CYS 85 H CYS 85 0.799 11.999 -0.653
489 HA CYS 85 HA CYS 85 1.949 11.865 1.880
490 HB2 CYS 85 2HB CYS 85 3.328 12.076 -0.796
491 HB3 CYS 85 1HB CYS 85 4.079 11.627 0.737
Start of MODEL 2
1 H1 SER 20 1HT SER 20 -1.956 -14.094 23.148
2 H2 SER 20 2HT SER 20 -2.424 -15.251 22.026
3 H3 SER 20 3HT SER 20 -2.826 -13.613 21.797
4 HA SER 20 HA SER 20 -1.010 -14.306 20.385
5 HB2 SER 20 2HB SER 20 -0.220 -12.340 22.561
6 HB3 SER 20 1HB SER 20 0.331 -12.358 20.889
7 HG SER 20 HG SER 20 -1.724 -11.072 21.821
8 H GLU 21 H GLU 21 1.519 -14.481 20.561
9 HA GLU 21 HA GLU 21 2.039 -16.765 22.244
10 HB2 GLU 21 2HB GLU 21 4.169 -16.968 21.058
11 HB3 GLU 21 1HB GLU 21 2.882 -16.733 19.898
12 HG2 GLU 21 2HG GLU 21 4.860 -14.629 20.803
13 HG3 GLU 21 1HG GLU 21 4.904 -15.501 19.272
14 H ALA 22 H ALA 22 3.070 -13.467 21.932
15 HA ALA 22 HA ALA 22 3.669 -13.307 24.738
16 HB1 ALA 22 1HB ALA 22 5.841 -12.833 22.687
17 HB2 ALA 22 2HB ALA 22 5.817 -14.137 23.875
18 HB3 ALA 22 3HB ALA 22 5.967 -12.460 24.406
19 H ALA 23 H ALA 23 4.242 -11.731 21.647
20 HA ALA 23 HA ALA 23 2.487 -9.562 22.318
21 HB1 ALA 23 1HB ALA 23 5.438 -9.029 21.888
22 HB2 ALA 23 2HB ALA 23 4.572 -8.838 23.408
23 HB3 ALA 23 3HB ALA 23 4.181 -7.803 22.037
24 H SER 24 H SER 24 1.335 -9.984 20.502
25 HA SER 24 HA SER 24 2.703 -10.202 17.940
26 HB2 SER 24 2HB SER 24 -0.250 -10.369 18.568
27 HB3 SER 24 1HB SER 24 0.550 -10.886 17.079
28 HG SER 24 HG SER 24 1.784 -12.192 18.974
29 H LEU 25 H LEU 25 0.448 -8.212 19.734
30 HA LEU 25 HA LEU 25 -0.323 -6.157 19.616
31 HB2 LEU 25 2HB LEU 25 2.024 -5.668 17.791
32 HB3 LEU 25 1HB LEU 25 0.883 -4.410 18.184
33 HG LEU 25 HG LEU 25 1.514 -4.807 20.621
34 HD11 LEU 25 1HD1 LEU 25 3.705 -5.776 21.052
35 HD12 LEU 25 2HD1 LEU 25 3.813 -6.278 19.366
36 HD13 LEU 25 3HD1 LEU 25 2.570 -6.965 20.411
37 HD21 LEU 25 3HD2 LEU 25 3.598 -3.772 18.715
38 HD22 LEU 25 1HD2 LEU 25 3.522 -3.432 20.442
39 HD23 LEU 25 2HD2 LEU 25 2.236 -2.861 19.377
40 H SER 26 H SER 26 -1.526 -4.631 18.401
41 HA SER 26 HA SER 26 -2.794 -5.844 16.108
42 HB2 SER 26 2HB SER 26 -4.099 -4.829 18.041
43 HB3 SER 26 1HB SER 26 -3.464 -3.258 17.551
44 HG SER 26 HG SER 26 -5.417 -3.440 16.600
45 HA PRO 27 HA PRO 27 -0.072 -3.104 13.793
46 HB2 PRO 27 2HB PRO 27 -0.484 -4.286 11.355
47 HB3 PRO 27 1HB PRO 27 0.702 -4.852 12.529
48 HG2 PRO 27 2HG PRO 27 -1.866 -6.044 11.749
49 HG3 PRO 27 1HG PRO 27 -0.480 -6.789 12.556
50 HD2 PRO 27 2HD PRO 27 -2.934 -5.930 13.739
51 HD3 PRO 27 1HD PRO 27 -1.505 -6.585 14.556
52 H LYS 28 H LYS 28 -1.163 -1.194 13.779
53 HA LYS 28 HA LYS 28 -3.596 -1.006 12.273
54 HB2 LYS 28 2HB LYS 28 -2.078 1.133 13.777
55 HB3 LYS 28 1HB LYS 28 -3.625 1.376 12.976
56 HG2 LYS 28 2HG LYS 28 -4.632 -0.341 14.417
57 HG3 LYS 28 1HG LYS 28 -3.089 -0.525 15.244
58 HD2 LYS 28 2HD LYS 28 -3.204 1.800 15.967
59 HD3 LYS 28 1HD LYS 28 -4.750 1.990 15.130
60 HE2 LYS 28 2HE LYS 28 -5.714 0.229 16.535
61 HE3 LYS 28 1HE LYS 28 -4.178 0.068 17.385
62 HZ1 LYS 28 3HZ LYS 28 -5.786 1.389 18.564
63 HZ2 LYS 28 1HZ LYS 28 -5.867 2.500 17.310
64 HZ3 LYS 28 2HZ LYS 28 -4.426 2.323 18.192
65 H LYS 29 H LYS 29 -3.299 -1.266 10.282
66 HA LYS 29 HA LYS 29 -1.732 0.602 8.730
67 HB2 LYS 29 2HB LYS 29 -0.349 -1.440 9.198
68 HB3 LYS 29 1HB LYS 29 -1.615 -2.432 8.513
69 HG2 LYS 29 2HG LYS 29 -1.259 -1.363 6.327
70 HG3 LYS 29 1HG LYS 29 0.035 -0.387 7.018
71 HD2 LYS 29 2HD LYS 29 -0.013 -3.403 6.894
72 HD3 LYS 29 1HD LYS 29 0.896 -2.353 5.811
73 HE2 LYS 29 2HE LYS 29 2.220 -1.527 7.694
74 HE3 LYS 29 1HE LYS 29 1.276 -2.516 8.807
75 HZ1 LYS 29 3HZ LYS 29 2.122 -4.483 7.765
76 HZ2 LYS 29 1HZ LYS 29 3.415 -3.512 8.217
77 HZ3 LYS 29 2HZ LYS 29 2.940 -3.595 6.596
78 H VAL 30 H VAL 30 -2.523 0.233 6.405
79 HA VAL 30 HA VAL 30 -5.342 0.280 6.351
80 HB VAL 30 HB VAL 30 -3.659 1.402 4.788
81 HG11 VAL 30 1HG1 VAL 30 -3.728 -1.255 3.389
82 HG12 VAL 30 2HG1 VAL 30 -2.337 -0.516 4.174
83 HG13 VAL 30 3HG1 VAL 30 -3.038 0.231 2.735
84 HG21 VAL 30 3HG2 VAL 30 -6.052 1.515 4.451
85 HG22 VAL 30 1HG2 VAL 30 -6.003 0.005 3.544
86 HG23 VAL 30 2HG2 VAL 30 -5.184 1.447 2.922
87 H ASP 31 H ASP 31 -6.816 -1.284 5.320
88 HA ASP 31 HA ASP 31 -5.831 -3.971 5.706
89 HB2 ASP 31 2HB ASP 31 -8.024 -3.426 6.676
90 HB3 ASP 31 1HB ASP 31 -8.658 -3.116 5.061
91 H CYS 32 H CYS 32 -4.846 -4.859 4.201
92 HA CYS 32 HA CYS 32 -5.574 -4.385 1.411
93 HB2 CYS 32 2HB CYS 32 -3.231 -3.976 2.218
94 HB3 CYS 32 1HB CYS 32 -3.131 -5.655 2.692
95 H SER 33 H SER 33 -6.377 -6.355 3.879
96 HA SER 33 HA SER 33 -5.851 -8.975 3.061
97 HB2 SER 33 2HB SER 33 -8.148 -8.090 4.779
98 HB3 SER 33 1HB SER 33 -7.236 -9.603 4.856
99 HG SER 33 HG SER 33 -6.792 -7.230 5.991
100 H ILE 34 H ILE 34 -8.731 -6.915 2.650
101 HA ILE 34 HA ILE 34 -10.205 -8.996 1.384
102 HB ILE 34 HB ILE 34 -11.835 -7.242 0.724
103 HG12 ILE 34 2HG1 ILE 34 -9.984 -5.374 2.234
104 HG13 ILE 34 1HG1 ILE 34 -10.206 -5.374 0.490
105 HG21 ILE 34 1HG2 ILE 34 -10.975 -7.311 3.601
106 HG22 ILE 34 2HG2 ILE 34 -12.071 -8.432 2.796
107 HG23 ILE 34 3HG2 ILE 34 -12.544 -6.747 3.026
108 HD11 ILE 34 3HD1 ILE 34 -12.343 -4.799 2.528
109 HD12 ILE 34 1HD1 ILE 34 -12.539 -4.749 0.777
110 HD13 ILE 34 2HD1 ILE 34 -11.468 -3.593 1.577
111 H TYR 35 H TYR 35 -7.942 -6.719 0.155
112 HA TYR 35 HA TYR 35 -8.948 -7.052 -2.519
113 HB2 TYR 35 2HB TYR 35 -6.529 -5.544 -1.530
114 HB3 TYR 35 1HB TYR 35 -7.042 -5.605 -3.212
115 HD1 TYR 35 2HD TYR 35 -9.423 -4.766 -3.739
116 HD2 TYR 35 1HD TYR 35 -7.401 -3.895 -0.101
117 HE1 TYR 35 2HE TYR 35 -10.926 -2.859 -3.371
118 HE2 TYR 35 1HE TYR 35 -8.904 -1.993 0.283
119 HH TYR 35 HH TYR 35 -10.326 -0.421 -1.149
120 H LYS 36 H LYS 36 -6.915 -8.687 -0.474
121 HA LYS 36 HA LYS 36 -5.168 -9.925 -2.331
122 HB2 LYS 36 2HB LYS 36 -6.146 -10.748 0.389
123 HB3 LYS 36 1HB LYS 36 -4.991 -11.697 -0.529
124 HG2 LYS 36 2HG LYS 36 -3.423 -9.846 -0.514
125 HG3 LYS 36 1HG LYS 36 -4.594 -8.833 0.329
126 HD2 LYS 36 2HD LYS 36 -2.934 -9.710 1.878
127 HD3 LYS 36 1HD LYS 36 -4.523 -10.373 2.238
128 HE2 LYS 36 2HE LYS 36 -2.866 -12.108 2.405
129 HE3 LYS 36 1HE LYS 36 -3.918 -12.438 1.043
130 HZ1 LYS 36 3HZ LYS 36 -2.202 -11.720 -0.471
131 HZ2 LYS 36 1HZ LYS 36 -1.571 -12.832 0.601
132 HZ3 LYS 36 2HZ LYS 36 -1.201 -11.211 0.799
133 H LYS 37 H LYS 37 -8.462 -10.213 -1.779
134 HA LYS 37 HA LYS 37 -8.832 -12.913 -2.649
135 HB2 LYS 37 2HB LYS 37 -10.769 -10.613 -2.457
136 HB3 LYS 37 1HB LYS 37 -11.209 -12.284 -2.792
137 HG2 LYS 37 2HG LYS 37 -10.386 -12.958 -0.613
138 HG3 LYS 37 1HG LYS 37 -9.860 -11.306 -0.287
139 HD2 LYS 37 2HD LYS 37 -11.985 -11.778 0.821
140 HD3 LYS 37 1HD LYS 37 -12.181 -10.545 -0.423
141 HE2 LYS 37 2HE LYS 37 -13.107 -12.182 -1.949
142 HE3 LYS 37 1HE LYS 37 -12.813 -13.475 -0.786
143 HZ1 LYS 37 3HZ LYS 37 -14.372 -12.410 0.707
144 HZ2 LYS 37 1HZ LYS 37 -15.119 -12.740 -0.767
145 HZ3 LYS 37 2HZ LYS 37 -14.640 -11.171 -0.394
146 H TYR 38 H TYR 38 -7.819 -10.232 -4.241
147 HA TYR 38 HA TYR 38 -9.001 -11.088 -6.779
148 HB2 TYR 38 2HB TYR 38 -7.781 -8.397 -6.094
149 HB3 TYR 38 1HB TYR 38 -8.593 -8.830 -7.585
150 HD1 TYR 38 2HD TYR 38 -11.100 -9.716 -7.187
151 HD2 TYR 38 1HD TYR 38 -8.948 -7.151 -4.586
152 HE1 TYR 38 2HE TYR 38 -13.224 -8.871 -6.271
153 HE2 TYR 38 1HE TYR 38 -11.059 -6.301 -3.654
154 HH TYR 38 HH TYR 38 -13.978 -7.833 -4.188
155 HA PRO 39 HA PRO 39 -4.835 -12.176 -8.022
156 HB2 PRO 39 2HB PRO 39 -4.852 -11.149 -10.599
157 HB3 PRO 39 1HB PRO 39 -5.503 -12.730 -10.154
158 HG2 PRO 39 2HG PRO 39 -6.929 -10.139 -10.548
159 HG3 PRO 39 1HG PRO 39 -7.415 -11.770 -11.045
160 HD2 PRO 39 2HD PRO 39 -8.490 -10.604 -8.901
161 HD3 PRO 39 1HD PRO 39 -8.121 -12.339 -8.907
162 H VAL 40 H VAL 40 -3.007 -11.141 -7.624
163 HA VAL 40 HA VAL 40 -2.867 -8.527 -6.770
164 HB VAL 40 HB VAL 40 -0.610 -10.325 -7.684
165 HG11 VAL 40 1HG1 VAL 40 0.859 -8.918 -6.302
166 HG12 VAL 40 2HG1 VAL 40 -0.479 -7.811 -6.020
167 HG13 VAL 40 3HG1 VAL 40 0.167 -8.013 -7.648
168 HG21 VAL 40 3HG2 VAL 40 -1.966 -11.217 -5.869
169 HG22 VAL 40 1HG2 VAL 40 -1.717 -9.738 -4.949
170 HG23 VAL 40 2HG2 VAL 40 -0.347 -10.783 -5.310
171 H VAL 41 H VAL 41 -2.306 -9.695 -10.040
172 HA VAL 41 HA VAL 41 -1.129 -7.168 -10.788
173 HB VAL 41 HB VAL 41 -0.465 -9.305 -11.894
174 HG11 VAL 41 1HG1 VAL 41 -3.148 -9.168 -13.247
175 HG12 VAL 41 2HG1 VAL 41 -2.620 -10.385 -12.094
176 HG13 VAL 41 3HG1 VAL 41 -1.840 -10.275 -13.672
177 HG21 VAL 41 3HG2 VAL 41 -0.335 -8.409 -14.195
178 HG22 VAL 41 1HG2 VAL 41 0.074 -7.202 -12.974
179 HG23 VAL 41 2HG2 VAL 41 -1.508 -7.169 -13.753
180 H ALA 42 H ALA 42 -4.343 -8.491 -10.718
181 HA ALA 42 HA ALA 42 -5.290 -6.032 -11.967
182 HB1 ALA 42 1HB ALA 42 -7.089 -7.227 -13.065
183 HB2 ALA 42 2HB ALA 42 -6.488 -8.758 -12.423
184 HB3 ALA 42 3HB ALA 42 -5.525 -7.855 -13.589
185 H ILE 43 H ILE 43 -5.818 -5.055 -10.015
186 HA ILE 43 HA ILE 43 -7.806 -6.526 -8.482
187 HB ILE 43 HB ILE 43 -5.922 -4.354 -7.486
188 HG12 ILE 43 2HG1 ILE 43 -6.110 -7.318 -6.874
189 HG13 ILE 43 1HG1 ILE 43 -4.830 -6.517 -7.768
190 HG21 ILE 43 1HG2 ILE 43 -6.891 -4.756 -5.266
191 HG22 ILE 43 2HG2 ILE 43 -8.068 -5.856 -5.984
192 HG23 ILE 43 3HG2 ILE 43 -8.095 -4.142 -6.401
193 HD11 ILE 43 3HD1 ILE 43 -4.251 -5.273 -5.723
194 HD12 ILE 43 1HD1 ILE 43 -4.076 -7.023 -5.538
195 HD13 ILE 43 2HD1 ILE 43 -5.474 -6.193 -4.851
196 HA PRO 44 HA PRO 44 -10.584 -3.369 -10.004
197 HB2 PRO 44 2HB PRO 44 -12.809 -4.370 -8.774
198 HB3 PRO 44 1HB PRO 44 -12.169 -5.011 -10.292
199 HG2 PRO 44 2HG PRO 44 -11.872 -6.057 -7.520
200 HG3 PRO 44 1HG PRO 44 -12.107 -6.940 -9.038
201 HD2 PRO 44 2HD PRO 44 -9.707 -6.692 -7.804
202 HD3 PRO 44 1HD PRO 44 -9.880 -6.879 -9.561
203 H CYS 45 H CYS 45 -11.212 -1.502 -9.138
204 HA CYS 45 HA CYS 45 -10.942 -1.227 -6.231
205 HB2 CYS 45 2HB CYS 45 -9.967 0.645 -8.385
206 HB3 CYS 45 1HB CYS 45 -9.967 1.023 -6.668
207 HA PRO 46 HA PRO 46 -14.877 0.851 -6.367
208 HB2 PRO 46 2HB PRO 46 -14.560 2.518 -4.232
209 HB3 PRO 46 1HB PRO 46 -14.925 0.801 -4.056
210 HG2 PRO 46 2HG PRO 46 -12.303 2.227 -3.844
211 HG3 PRO 46 1HG PRO 46 -12.942 0.922 -2.825
212 HD2 PRO 46 2HD PRO 46 -11.120 0.485 -4.758
213 HD3 PRO 46 1HD PRO 46 -12.362 -0.714 -4.362
214 H ILE 47 H ILE 47 -15.738 3.013 -6.680
215 HA ILE 47 HA ILE 47 -13.822 4.678 -8.083
216 HB ILE 47 HB ILE 47 -15.705 6.122 -8.746
217 HG12 ILE 47 2HG1 ILE 47 -17.484 4.172 -7.266
218 HG13 ILE 47 1HG1 ILE 47 -17.076 5.786 -6.678
219 HG21 ILE 47 1HG2 ILE 47 -16.884 4.504 -10.176
220 HG22 ILE 47 2HG2 ILE 47 -16.224 3.191 -9.206
221 HG23 ILE 47 3HG2 ILE 47 -15.140 4.222 -10.140
222 HD11 ILE 47 3HD1 ILE 47 -19.283 5.706 -7.682
223 HD12 ILE 47 1HD1 ILE 47 -18.593 5.132 -9.198
224 HD13 ILE 47 2HD1 ILE 47 -18.211 6.753 -8.612
225 H THR 48 H THR 48 -15.040 4.415 -4.999
226 HA THR 48 HA THR 48 -15.082 7.037 -4.071
227 HB THR 48 HB THR 48 -14.056 4.689 -2.469
228 HG1 THR 48 1HG THR 48 -16.668 5.197 -3.483
229 HG21 THR 48 3HG2 THR 48 -15.904 6.998 -1.814
230 HG22 THR 48 1HG2 THR 48 -14.196 6.902 -1.382
231 HG23 THR 48 2HG2 THR 48 -15.347 5.765 -0.684
232 H TYR 49 H TYR 49 -13.440 8.442 -3.816
233 HA TYR 49 HA TYR 49 -10.694 7.526 -4.261
234 HB2 TYR 49 2HB TYR 49 -11.750 9.357 -5.670
235 HB3 TYR 49 1HB TYR 49 -11.750 10.356 -4.227
236 HD1 TYR 49 1HD TYR 49 -9.670 8.768 -6.789
237 HD2 TYR 49 2HD TYR 49 -9.677 11.360 -3.417
238 HE1 TYR 49 1HE TYR 49 -7.414 9.524 -7.377
239 HE2 TYR 49 2HE TYR 49 -7.403 12.123 -3.991
240 HH TYR 49 HH TYR 49 -5.517 11.514 -5.259
241 H LEU 50 H LEU 50 -9.638 7.123 -2.459
242 HA LEU 50 HA LEU 50 -9.984 8.901 -0.154
243 HB2 LEU 50 2HB LEU 50 -9.223 5.964 -0.038
244 HB3 LEU 50 1HB LEU 50 -9.330 7.041 1.327
245 HG LEU 50 HG LEU 50 -11.847 7.188 0.744
246 HD11 LEU 50 1HD1 LEU 50 -11.126 4.675 -0.739
247 HD12 LEU 50 2HD1 LEU 50 -11.739 6.168 -1.450
248 HD13 LEU 50 3HD1 LEU 50 -12.759 5.226 -0.365
249 HD21 LEU 50 3HD2 LEU 50 -12.304 5.166 2.028
250 HD22 LEU 50 1HD2 LEU 50 -10.967 6.083 2.723
251 HD23 LEU 50 2HD2 LEU 50 -10.643 4.626 1.777
252 HA PRO 51 HA PRO 51 -5.748 9.365 -1.714
253 HB2 PRO 51 2HB PRO 51 -5.132 11.464 -0.030
254 HB3 PRO 51 1HB PRO 51 -5.880 11.669 -1.613
255 HG2 PRO 51 2HG PRO 51 -7.139 11.660 1.096
256 HG3 PRO 51 1HG PRO 51 -7.522 12.663 -0.310
257 HD2 PRO 51 2HD PRO 51 -9.027 10.558 0.405
258 HD3 PRO 51 1HD PRO 51 -8.805 11.004 -1.298
259 H VAL 52 H VAL 52 -4.405 7.894 -0.976
260 HA VAL 52 HA VAL 52 -3.729 7.967 1.855
261 HB VAL 52 HB VAL 52 -3.353 5.523 1.880
262 HG11 VAL 52 1HG1 VAL 52 -5.687 4.777 1.925
263 HG12 VAL 52 2HG1 VAL 52 -6.166 6.257 1.099
264 HG13 VAL 52 3HG1 VAL 52 -5.467 6.340 2.715
265 HG21 VAL 52 3HG2 VAL 52 -2.947 5.119 -0.466
266 HG22 VAL 52 1HG2 VAL 52 -4.616 5.540 -0.862
267 HG23 VAL 52 2HG2 VAL 52 -4.270 4.095 0.092
268 H CYS 53 H CYS 53 -1.608 7.616 2.324
269 HA CYS 53 HA CYS 53 0.113 7.993 0.005
270 HB2 CYS 53 2HB CYS 53 0.101 9.899 1.458
271 HB3 CYS 53 1HB CYS 53 0.470 8.958 2.873
272 H GLY 54 H GLY 54 1.536 6.516 -0.446
273 HA2 GLY 54 2HA GLY 54 1.855 4.288 1.382
274 HA3 GLY 54 1HA GLY 54 2.417 4.360 -0.288
275 H SER 55 H SER 55 3.962 3.478 1.875
276 HA SER 55 HA SER 55 5.745 5.253 3.013
277 HB2 SER 55 2HB SER 55 6.464 2.514 1.978
278 HB3 SER 55 1HB SER 55 7.147 3.363 3.369
279 HG SER 55 HG SER 55 5.347 2.988 4.519
280 H ASP 56 H ASP 56 5.538 4.273 -0.277
281 HA ASP 56 HA ASP 56 8.251 5.096 -0.940
282 HB2 ASP 56 2HB ASP 56 7.111 3.059 -1.950
283 HB3 ASP 56 1HB ASP 56 6.067 4.171 -2.816
284 H TYR 57 H TYR 57 5.746 6.774 -0.131
285 HA TYR 57 HA TYR 57 5.052 8.861 -0.316
286 HB2 TYR 57 2HB TYR 57 7.610 9.226 -1.862
287 HB3 TYR 57 1HB TYR 57 6.566 10.562 -1.379
288 HD1 TYR 57 2HD TYR 57 6.033 10.736 1.128
289 HD2 TYR 57 1HD TYR 57 9.266 8.474 -0.433
290 HE1 TYR 57 2HE TYR 57 7.110 10.781 3.324
291 HE2 TYR 57 1HE TYR 57 10.357 8.505 1.763
292 HH TYR 57 HH TYR 57 10.335 9.876 3.802
293 H ILE 58 H ILE 58 4.210 6.954 -2.194
294 HA ILE 58 HA ILE 58 3.465 8.664 -4.449
295 HB ILE 58 HB ILE 58 3.021 5.679 -4.073
296 HG12 ILE 58 2HG1 ILE 58 5.422 6.130 -4.315
297 HG13 ILE 58 1HG1 ILE 58 4.782 5.347 -5.758
298 HG21 ILE 58 1HG2 ILE 58 1.356 6.681 -5.535
299 HG22 ILE 58 2HG2 ILE 58 2.454 5.663 -6.468
300 HG23 ILE 58 3HG2 ILE 58 2.629 7.416 -6.510
301 HD11 ILE 58 3HD1 ILE 58 6.363 7.091 -6.350
302 HD12 ILE 58 1HD1 ILE 58 5.410 8.285 -5.467
303 HD13 ILE 58 2HD1 ILE 58 4.742 7.513 -6.902
304 H THR 59 H THR 59 1.509 9.550 -4.349
305 HA THR 59 HA THR 59 -0.304 8.783 -2.249
306 HB THR 59 HB THR 59 -0.556 10.896 -4.417
307 HG1 THR 59 1HG THR 59 0.945 11.613 -3.047
308 HG21 THR 59 3HG2 THR 59 -2.408 11.795 -3.036
309 HG22 THR 59 1HG2 THR 59 -2.280 10.392 -1.975
310 HG23 THR 59 2HG2 THR 59 -2.774 10.184 -3.654
311 H TYR 60 H TYR 60 -1.856 7.397 -2.491
312 HA TYR 60 HA TYR 60 -2.466 6.469 -5.179
313 HB2 TYR 60 2HB TYR 60 -2.807 5.152 -2.491
314 HB3 TYR 60 1HB TYR 60 -3.375 4.448 -4.010
315 HD1 TYR 60 1HD TYR 60 -1.733 3.677 -5.680
316 HD2 TYR 60 2HD TYR 60 -0.489 5.126 -1.891
317 HE1 TYR 60 1HE TYR 60 0.483 2.671 -6.030
318 HE2 TYR 60 2HE TYR 60 1.726 4.128 -2.227
319 HH TYR 60 HH TYR 60 2.767 2.892 -5.243
320 H GLY 61 H GLY 61 -4.533 6.349 -5.860
321 HA2 GLY 61 2HA GLY 61 -6.298 8.336 -4.957
322 HA3 GLY 61 1HA GLY 61 -6.660 7.110 -6.155
323 H ASN 62 H ASN 62 -5.946 5.083 -3.976
324 HA ASN 62 HA ASN 62 -7.638 5.383 -1.825
325 HB2 ASN 62 2HB ASN 62 -9.365 3.629 -2.328
326 HB3 ASN 62 1HB ASN 62 -9.547 5.075 -3.293
327 HD21 ASN 62 1HD2 ASN 62 -10.705 4.073 -4.832
328 HD22 ASN 62 2HD2 ASN 62 -10.060 2.963 -5.972
329 H GLU 63 H GLU 63 -8.033 3.068 -0.846
330 HA GLU 63 HA GLU 63 -5.348 2.247 -0.397
331 HB2 GLU 63 2HB GLU 63 -6.155 0.785 1.289
332 HB3 GLU 63 1HB GLU 63 -7.017 2.305 1.429
333 HG2 GLU 63 2HG GLU 63 -8.037 -0.263 0.246
334 HG3 GLU 63 1HG GLU 63 -8.461 0.368 1.835
335 H CYS 64 H CYS 64 -7.987 1.042 -2.219
336 HA CYS 64 HA CYS 64 -7.178 -1.516 -2.799
337 HB2 CYS 64 2HB CYS 64 -9.272 -0.641 -3.622
338 HB3 CYS 64 1HB CYS 64 -8.429 0.523 -4.644
339 H HIS 65 H HIS 65 -6.248 1.461 -4.508
340 HA HIS 65 HA HIS 65 -4.427 0.171 -6.249
341 HB2 HIS 65 2HB HIS 65 -4.515 3.075 -5.414
342 HB3 HIS 65 1HB HIS 65 -3.449 2.460 -6.662
343 HD1 HIS 65 1HD HIS 65 -5.192 0.905 -8.508
344 HD2 HIS 65 2HD HIS 65 -6.560 4.305 -6.550
345 HE1 HIS 65 1HE HIS 65 -7.124 1.737 -9.867
346 HE2 HIS 65 2HE HIS 65 -8.102 3.597 -8.459
347 H LEU 66 H LEU 66 -4.023 1.618 -3.088
348 HA LEU 66 HA LEU 66 -1.211 1.460 -2.919
349 HB2 LEU 66 2HB LEU 66 -2.529 2.760 -1.327
350 HB3 LEU 66 1HB LEU 66 -3.367 1.322 -0.822
351 HG LEU 66 HG LEU 66 -1.353 0.457 0.263
352 HD11 LEU 66 1HD1 LEU 66 0.651 1.814 0.482
353 HD12 LEU 66 2HD1 LEU 66 -0.037 3.020 -0.605
354 HD13 LEU 66 3HD1 LEU 66 0.340 1.406 -1.204
355 HD21 LEU 66 3HD2 LEU 66 -1.233 2.045 2.068
356 HD22 LEU 66 1HD2 LEU 66 -2.893 1.912 1.495
357 HD23 LEU 66 2HD2 LEU 66 -1.910 3.309 1.044
358 H CYS 67 H CYS 67 -3.759 -0.757 -1.859
359 HA CYS 67 HA CYS 67 -2.160 -2.778 -0.830
360 HB2 CYS 67 2HB CYS 67 -4.528 -2.652 -0.365
361 HB3 CYS 67 1HB CYS 67 -4.905 -2.881 -2.068
362 H THR 68 H THR 68 -3.285 -2.231 -4.154
363 HA THR 68 HA THR 68 -2.499 -4.643 -5.308
364 HB THR 68 HB THR 68 -2.339 -1.899 -6.589
365 HG1 THR 68 1HG THR 68 -4.465 -3.296 -5.644
366 HG21 THR 68 3HG2 THR 68 -2.840 -3.116 -8.670
367 HG22 THR 68 1HG2 THR 68 -2.846 -4.640 -7.780
368 HG23 THR 68 2HG2 THR 68 -1.354 -3.713 -7.930
369 H GLU 69 H GLU 69 -0.627 -1.624 -4.915
370 HA GLU 69 HA GLU 69 1.687 -2.731 -6.079
371 HB2 GLU 69 2HB GLU 69 1.392 -0.299 -4.339
372 HB3 GLU 69 1HB GLU 69 2.768 -0.677 -5.358
373 HG2 GLU 69 2HG GLU 69 -0.010 0.100 -6.179
374 HG3 GLU 69 1HG GLU 69 1.513 0.940 -6.479
375 H SER 70 H SER 70 0.528 -2.304 -2.786
376 HA SER 70 HA SER 70 2.798 -2.977 -1.380
377 HB2 SER 70 2HB SER 70 -0.057 -3.172 -0.966
378 HB3 SER 70 1HB SER 70 0.976 -3.784 0.361
379 HG SER 70 HG SER 70 1.894 -1.540 0.068
380 H LEU 71 H LEU 71 0.277 -5.117 -2.675
381 HA LEU 71 HA LEU 71 1.494 -7.522 -1.718
382 HB2 LEU 71 2HB LEU 71 -0.538 -7.011 -3.864
383 HB3 LEU 71 1HB LEU 71 -0.095 -8.617 -3.315
384 HG LEU 71 HG LEU 71 -1.445 -6.474 -1.675
385 HD11 LEU 71 1HD1 LEU 71 -2.498 -9.056 -2.814
386 HD12 LEU 71 2HD1 LEU 71 -2.880 -7.430 -3.390
387 HD13 LEU 71 3HD1 LEU 71 -3.387 -7.935 -1.778
388 HD21 LEU 71 3HD2 LEU 71 -0.759 -9.334 -0.973
389 HD22 LEU 71 1HD2 LEU 71 -1.711 -8.232 0.014
390 HD23 LEU 71 2HD2 LEU 71 -0.013 -7.890 -0.284
391 H LYS 72 H LYS 72 1.448 -5.785 -4.744
392 HA LYS 72 HA LYS 72 2.713 -7.570 -6.454
393 HB2 LYS 72 2HB LYS 72 1.529 -5.553 -7.093
394 HB3 LYS 72 1HB LYS 72 2.802 -4.570 -6.396
395 HG2 LYS 72 2HG LYS 72 4.373 -5.505 -8.059
396 HG3 LYS 72 1HG LYS 72 3.019 -6.378 -8.783
397 HD2 LYS 72 2HD LYS 72 3.159 -3.381 -8.466
398 HD3 LYS 72 1HD LYS 72 3.526 -4.278 -9.940
399 HE2 LYS 72 2HE LYS 72 1.250 -5.057 -10.095
400 HE3 LYS 72 1HE LYS 72 0.857 -4.359 -8.528
401 HZ1 LYS 72 3HZ LYS 72 0.124 -3.063 -10.452
402 HZ2 LYS 72 1HZ LYS 72 1.719 -2.737 -10.861
403 HZ3 LYS 72 2HZ LYS 72 1.042 -2.196 -9.378
404 H SER 73 H SER 73 4.133 -5.021 -4.437
405 HA SER 73 HA SER 73 6.790 -6.005 -5.140
406 HB2 SER 73 2HB SER 73 5.935 -3.474 -3.717
407 HB3 SER 73 1HB SER 73 7.591 -3.880 -4.165
408 HG SER 73 HG SER 73 5.412 -3.162 -5.812
409 H ASN 74 H ASN 74 4.701 -7.072 -3.142
410 HA ASN 74 HA ASN 74 4.491 -7.936 -1.097
411 HB2 ASN 74 2HB ASN 74 5.898 -9.603 -2.219
412 HB3 ASN 74 1HB ASN 74 7.339 -8.804 -1.594
413 HD21 ASN 74 1HD2 ASN 74 8.044 -10.503 -0.371
414 HD22 ASN 74 2HD2 ASN 74 7.236 -11.070 1.038
415 H GLY 75 H GLY 75 4.281 -5.925 -0.092
416 HA2 GLY 75 2HA GLY 75 4.491 -4.814 1.876
417 HA3 GLY 75 1HA GLY 75 5.745 -5.949 2.339
418 H ARG 76 H ARG 76 6.389 -4.366 -0.616
419 HA ARG 76 HA ARG 76 8.521 -2.871 0.548
420 HB2 ARG 76 2HB ARG 76 8.627 -3.639 -1.819
421 HB3 ARG 76 1HB ARG 76 7.301 -2.546 -2.208
422 HG2 ARG 76 2HG ARG 76 8.700 -0.661 -1.411
423 HG3 ARG 76 1HG ARG 76 10.038 -1.794 -1.252
424 HD2 ARG 76 2HD ARG 76 9.990 -2.218 -3.638
425 HD3 ARG 76 1HD ARG 76 8.560 -1.189 -3.805
426 HE ARG 76 HE ARG 76 11.248 -0.300 -3.064
427 HH11 ARG 76 1HH1 ARG 76 8.154 0.423 -4.644
428 HH12 ARG 76 2HH1 ARG 76 8.376 2.118 -4.621
429 HH21 ARG 76 1HH2 ARG 76 11.561 2.010 -3.093
430 HH22 ARG 76 2HH2 ARG 76 10.328 3.052 -3.686
431 H VAL 77 H VAL 77 5.626 -1.769 -1.210
432 HA VAL 77 HA VAL 77 5.769 0.724 0.266
433 HB VAL 77 HB VAL 77 5.198 0.692 -2.253
434 HG11 VAL 77 1HG1 VAL 77 2.980 0.241 -2.964
435 HG12 VAL 77 2HG1 VAL 77 2.610 -0.442 -1.383
436 HG13 VAL 77 3HG1 VAL 77 3.834 -1.196 -2.408
437 HG21 VAL 77 3HG2 VAL 77 4.737 2.658 -0.895
438 HG22 VAL 77 1HG2 VAL 77 3.182 1.970 -0.421
439 HG23 VAL 77 2HG2 VAL 77 3.474 2.412 -2.103
440 H GLN 78 H GLN 78 4.548 1.139 1.953
441 HA GLN 78 HA GLN 78 2.342 -0.676 2.510
442 HB2 GLN 78 2HB GLN 78 4.402 0.426 4.441
443 HB3 GLN 78 1HB GLN 78 2.943 -0.425 4.918
444 HG2 GLN 78 2HG GLN 78 5.075 -1.644 3.180
445 HG3 GLN 78 1HG GLN 78 5.051 -1.768 4.937
446 HE21 GLN 78 1HE2 GLN 78 3.435 -2.693 1.998
447 HE22 GLN 78 2HE2 GLN 78 2.552 -4.016 2.686
448 H PHE 79 H PHE 79 0.979 0.383 4.155
449 HA PHE 79 HA PHE 79 0.175 2.987 3.407
450 HB2 PHE 79 2HB PHE 79 -1.354 1.335 4.371
451 HB3 PHE 79 1HB PHE 79 -0.446 1.350 5.871
452 HD1 PHE 79 2HD PHE 79 -2.403 3.563 3.621
453 HD2 PHE 79 1HD PHE 79 -1.115 2.729 7.586
454 HE1 PHE 79 2HE PHE 79 -3.891 5.320 4.471
455 HE2 PHE 79 1HE PHE 79 -2.602 4.482 8.446
456 HZ PHE 79 HZ PHE 79 -3.988 5.778 6.888
457 H LEU 80 H LEU 80 1.372 4.745 3.789
458 HA LEU 80 HA LEU 80 3.217 4.835 6.029
459 HB2 LEU 80 2HB LEU 80 3.812 5.684 3.755
460 HB3 LEU 80 1HB LEU 80 2.581 6.909 3.926
461 HG LEU 80 HG LEU 80 3.853 7.829 5.880
462 HD11 LEU 80 1HD1 LEU 80 5.105 5.847 6.480
463 HD12 LEU 80 2HD1 LEU 80 6.179 7.203 6.145
464 HD13 LEU 80 3HD1 LEU 80 5.991 5.920 4.955
465 HD21 LEU 80 3HD2 LEU 80 5.292 7.709 3.234
466 HD22 LEU 80 1HD2 LEU 80 5.569 8.902 4.506
467 HD23 LEU 80 2HD2 LEU 80 4.010 8.836 3.688
468 H HIS 81 H HIS 81 0.564 6.829 4.739
469 HA HIS 81 HA HIS 81 -0.607 7.134 7.289
470 HB2 HIS 81 2HB HIS 81 -0.522 9.624 7.407
471 HB3 HIS 81 1HB HIS 81 1.048 8.880 7.653
472 HD1 HIS 81 1HD HIS 81 -0.888 10.996 5.131
473 HD2 HIS 81 2HD HIS 81 2.992 9.660 5.852
474 HE1 HIS 81 1HE HIS 81 0.610 12.197 3.473
475 HE2 HIS 81 2HE HIS 81 2.909 11.600 4.181
476 H ASP 82 H ASP 82 -2.577 8.419 7.185
477 HA ASP 82 HA ASP 82 -4.053 7.980 4.796
478 HB2 ASP 82 2HB ASP 82 -4.646 9.483 7.359
479 HB3 ASP 82 1HB ASP 82 -5.788 9.365 6.035
480 H GLY 83 H GLY 83 -4.752 9.570 3.328
481 HA2 GLY 83 2HA GLY 83 -5.032 11.748 2.606
482 HA3 GLY 83 1HA GLY 83 -3.868 12.290 3.813
483 H SER 84 H SER 84 -3.650 13.221 1.316
484 HA SER 84 HA SER 84 -2.018 11.764 -0.420
485 HB2 SER 84 2HB SER 84 -2.260 14.755 -0.052
486 HB3 SER 84 1HB SER 84 -1.669 13.921 -1.494
487 HG SER 84 HG SER 84 -4.181 14.505 -0.754
488 H CYS 85 H CYS 85 0.256 11.915 -0.769
489 HA CYS 85 HA CYS 85 1.795 12.029 1.569
490 HB2 CYS 85 2HB CYS 85 2.736 12.041 -1.316
491 HB3 CYS 85 1HB CYS 85 3.710 11.770 0.140
Start of MODEL 3
1 H1 SER 20 1HT SER 20 -4.516 12.346 21.414
2 H2 SER 20 2HT SER 20 -4.904 13.943 21.118
3 H3 SER 20 3HT SER 20 -3.495 13.567 21.970
4 HA SER 20 HA SER 20 -3.009 14.190 19.694
5 HB2 SER 20 2HB SER 20 -1.539 12.553 20.771
6 HB3 SER 20 1HB SER 20 -2.620 11.242 20.307
7 HG SER 20 HG SER 20 -1.286 11.136 18.711
8 H GLU 21 H GLU 21 -4.283 14.628 18.010
9 HA GLU 21 HA GLU 21 -6.334 12.806 17.291
10 HB2 GLU 21 2HB GLU 21 -6.844 14.532 15.462
11 HB3 GLU 21 1HB GLU 21 -7.080 15.007 17.132
12 HG2 GLU 21 2HG GLU 21 -6.114 16.843 16.000
13 HG3 GLU 21 1HG GLU 21 -4.870 16.157 17.028
14 H ALA 22 H ALA 22 -6.738 12.345 14.901
15 HA ALA 22 HA ALA 22 -6.241 11.221 13.067
16 HB1 ALA 22 1HB ALA 22 -4.069 11.314 11.987
17 HB2 ALA 22 2HB ALA 22 -3.330 11.945 13.459
18 HB3 ALA 22 3HB ALA 22 -4.501 12.920 12.574
19 H ALA 23 H ALA 23 -4.396 10.596 15.871
20 HA ALA 23 HA ALA 23 -4.040 8.772 17.105
21 HB1 ALA 23 1HB ALA 23 -5.650 7.184 15.110
22 HB2 ALA 23 2HB ALA 23 -6.332 8.074 16.467
23 HB3 ALA 23 3HB ALA 23 -5.253 6.709 16.764
24 H SER 24 H SER 24 -2.214 7.799 17.380
25 HA SER 24 HA SER 24 -1.048 6.179 15.271
26 HB2 SER 24 2HB SER 24 0.436 8.406 16.716
27 HB3 SER 24 1HB SER 24 1.143 7.275 15.558
28 HG SER 24 HG SER 24 -1.073 8.480 14.608
29 H LEU 25 H LEU 25 -2.449 5.604 17.684
30 HA LEU 25 HA LEU 25 -0.578 4.961 19.814
31 HB2 LEU 25 2HB LEU 25 -3.469 4.104 19.464
32 HB3 LEU 25 1HB LEU 25 -2.523 3.893 20.910
33 HG LEU 25 HG LEU 25 -4.017 5.620 21.370
34 HD11 LEU 25 1HD1 LEU 25 -2.675 7.603 21.748
35 HD12 LEU 25 2HD1 LEU 25 -1.418 6.920 20.717
36 HD13 LEU 25 3HD1 LEU 25 -1.871 6.106 22.214
37 HD21 LEU 25 3HD2 LEU 25 -3.252 6.971 18.786
38 HD22 LEU 25 1HD2 LEU 25 -4.335 7.641 20.005
39 HD23 LEU 25 2HD2 LEU 25 -4.784 6.173 19.140
40 H SER 26 H SER 26 -1.893 3.585 17.021
41 HA SER 26 HA SER 26 -0.555 1.027 17.477
42 HB2 SER 26 2HB SER 26 -3.202 1.539 16.091
43 HB3 SER 26 1HB SER 26 -2.425 -0.026 16.298
44 HG SER 26 HG SER 26 -2.557 0.782 18.678
45 HA PRO 27 HA PRO 27 1.070 2.297 13.472
46 HB2 PRO 27 2HB PRO 27 1.450 -0.535 12.804
47 HB3 PRO 27 1HB PRO 27 2.674 0.714 13.036
48 HG2 PRO 27 2HG PRO 27 2.308 -1.321 14.788
49 HG3 PRO 27 1HG PRO 27 2.884 0.281 15.279
50 HD2 PRO 27 2HD PRO 27 0.148 -0.909 15.546
51 HD3 PRO 27 1HD PRO 27 1.051 0.146 16.650
52 H LYS 28 H LYS 28 -1.023 2.903 12.852
53 HA LYS 28 HA LYS 28 -2.958 1.133 11.922
54 HB2 LYS 28 2HB LYS 28 -4.016 3.137 10.863
55 HB3 LYS 28 1HB LYS 28 -3.652 3.307 12.571
56 HG2 LYS 28 2HG LYS 28 -1.661 4.615 12.010
57 HG3 LYS 28 1HG LYS 28 -2.064 4.471 10.295
58 HD2 LYS 28 2HD LYS 28 -4.198 5.589 10.711
59 HD3 LYS 28 1HD LYS 28 -3.786 5.739 12.418
60 HE2 LYS 28 2HE LYS 28 -1.869 7.117 11.851
61 HE3 LYS 28 1HE LYS 28 -2.242 6.958 10.131
62 HZ1 LYS 28 3HZ LYS 28 -3.043 9.033 11.002
63 HZ2 LYS 28 1HZ LYS 28 -3.979 8.246 12.174
64 HZ3 LYS 28 2HZ LYS 28 -4.335 8.055 10.532
65 H LYS 29 H LYS 29 -3.467 0.341 9.952
66 HA LYS 29 HA LYS 29 -1.631 0.919 7.793
67 HB2 LYS 29 2HB LYS 29 -0.961 -1.058 9.480
68 HB3 LYS 29 1HB LYS 29 -2.085 -1.944 8.477
69 HG2 LYS 29 2HG LYS 29 0.186 -2.258 7.697
70 HG3 LYS 29 1HG LYS 29 -0.784 -1.401 6.497
71 HD2 LYS 29 2HD LYS 29 1.450 -0.403 6.693
72 HD3 LYS 29 1HD LYS 29 0.226 0.743 7.198
73 HE2 LYS 29 2HE LYS 29 0.725 0.081 9.581
74 HE3 LYS 29 1HE LYS 29 2.075 -0.862 8.943
75 HZ1 LYS 29 3HZ LYS 29 1.713 2.076 8.680
76 HZ2 LYS 29 1HZ LYS 29 2.957 1.195 7.979
77 HZ3 LYS 29 2HZ LYS 29 2.837 1.299 9.645
78 H VAL 30 H VAL 30 -2.436 0.027 5.787
79 HA VAL 30 HA VAL 30 -5.255 0.310 5.569
80 HB VAL 30 HB VAL 30 -3.671 1.077 3.813
81 HG11 VAL 30 1HG1 VAL 30 -3.230 -1.844 3.234
82 HG12 VAL 30 2HG1 VAL 30 -2.047 -0.719 3.890
83 HG13 VAL 30 3HG1 VAL 30 -2.648 -0.500 2.248
84 HG21 VAL 30 3HG2 VAL 30 -5.663 -0.974 2.864
85 HG22 VAL 30 1HG2 VAL 30 -4.921 0.267 1.853
86 HG23 VAL 30 2HG2 VAL 30 -5.978 0.732 3.185
87 H ASP 31 H ASP 31 -6.800 -1.265 5.127
88 HA ASP 31 HA ASP 31 -6.069 -3.976 5.800
89 HB2 ASP 31 2HB ASP 31 -8.327 -2.947 6.407
90 HB3 ASP 31 1HB ASP 31 -8.735 -3.042 4.699
91 H CYS 32 H CYS 32 -4.811 -4.720 4.293
92 HA CYS 32 HA CYS 32 -5.528 -4.420 1.496
93 HB2 CYS 32 2HB CYS 32 -3.191 -3.985 2.296
94 HB3 CYS 32 1HB CYS 32 -3.079 -5.658 2.793
95 H SER 33 H SER 33 -5.823 -6.570 4.130
96 HA SER 33 HA SER 33 -5.700 -9.017 2.833
97 HB2 SER 33 2HB SER 33 -7.099 -9.763 4.872
98 HB3 SER 33 1HB SER 33 -5.476 -9.122 5.115
99 HG SER 33 HG SER 33 -7.557 -7.224 5.214
100 H ILE 34 H ILE 34 -8.350 -6.748 2.984
101 HA ILE 34 HA ILE 34 -10.225 -8.642 1.963
102 HB ILE 34 HB ILE 34 -11.709 -6.671 1.528
103 HG12 ILE 34 2HG1 ILE 34 -9.433 -5.114 2.787
104 HG13 ILE 34 1HG1 ILE 34 -9.930 -5.007 1.101
105 HG21 ILE 34 1HG2 ILE 34 -11.813 -7.891 3.610
106 HG22 ILE 34 2HG2 ILE 34 -12.087 -6.169 3.888
107 HG23 ILE 34 3HG2 ILE 34 -10.523 -6.889 4.280
108 HD11 ILE 34 3HD1 ILE 34 -12.091 -4.112 1.806
109 HD12 ILE 34 1HD1 ILE 34 -10.752 -3.128 2.398
110 HD13 ILE 34 2HD1 ILE 34 -11.592 -4.226 3.491
111 H TYR 35 H TYR 35 -7.821 -6.691 0.492
112 HA TYR 35 HA TYR 35 -9.079 -6.994 -2.136
113 HB2 TYR 35 2HB TYR 35 -6.639 -5.414 -1.287
114 HB3 TYR 35 1HB TYR 35 -7.231 -5.515 -2.937
115 HD1 TYR 35 1HD TYR 35 -9.394 -4.450 -3.527
116 HD2 TYR 35 2HD TYR 35 -7.649 -3.973 0.317
117 HE1 TYR 35 1HE TYR 35 -10.859 -2.525 -3.108
118 HE2 TYR 35 2HE TYR 35 -9.110 -2.047 0.747
119 HH TYR 35 HH TYR 35 -10.543 -0.569 -0.185
120 H LYS 36 H LYS 36 -6.719 -8.216 -0.090
121 HA LYS 36 HA LYS 36 -4.858 -9.311 -1.872
122 HB2 LYS 36 2HB LYS 36 -4.659 -8.907 0.638
123 HB3 LYS 36 1HB LYS 36 -5.561 -10.399 0.847
124 HG2 LYS 36 2HG LYS 36 -3.813 -11.628 -0.301
125 HG3 LYS 36 1HG LYS 36 -2.934 -10.115 -0.560
126 HD2 LYS 36 2HD LYS 36 -2.827 -9.822 1.907
127 HD3 LYS 36 1HD LYS 36 -3.562 -11.413 2.094
128 HE2 LYS 36 2HE LYS 36 -0.928 -10.805 0.750
129 HE3 LYS 36 1HE LYS 36 -1.130 -11.529 2.335
130 HZ1 LYS 36 3HZ LYS 36 -1.995 -12.728 -0.239
131 HZ2 LYS 36 1HZ LYS 36 -2.185 -13.457 1.263
132 HZ3 LYS 36 2HZ LYS 36 -0.649 -13.170 0.631
133 H LYS 37 H LYS 37 -8.036 -10.191 -1.176
134 HA LYS 37 HA LYS 37 -7.695 -12.972 -1.855
135 HB2 LYS 37 2HB LYS 37 -10.220 -11.373 -1.446
136 HB3 LYS 37 1HB LYS 37 -10.147 -13.114 -1.665
137 HG2 LYS 37 2HG LYS 37 -8.746 -13.238 0.401
138 HG3 LYS 37 1HG LYS 37 -9.045 -11.515 0.634
139 HD2 LYS 37 2HD LYS 37 -11.482 -12.000 0.619
140 HD3 LYS 37 1HD LYS 37 -11.099 -13.716 0.549
141 HE2 LYS 37 2HE LYS 37 -11.563 -13.098 2.835
142 HE3 LYS 37 1HE LYS 37 -9.855 -13.500 2.667
143 HZ1 LYS 37 3HZ LYS 37 -10.240 -11.508 4.005
144 HZ2 LYS 37 1HZ LYS 37 -10.974 -10.751 2.707
145 HZ3 LYS 37 2HZ LYS 37 -9.325 -11.131 2.649
146 H TYR 38 H TYR 38 -7.737 -10.185 -3.627
147 HA TYR 38 HA TYR 38 -8.936 -11.465 -5.968
148 HB2 TYR 38 2HB TYR 38 -7.992 -8.608 -5.524
149 HB3 TYR 38 1HB TYR 38 -8.701 -9.198 -7.017
150 HD1 TYR 38 2HD TYR 38 -11.136 -10.344 -6.582
151 HD2 TYR 38 1HD TYR 38 -9.313 -7.381 -4.142
152 HE1 TYR 38 2HE TYR 38 -13.354 -9.654 -5.760
153 HE2 TYR 38 1HE TYR 38 -11.517 -6.681 -3.321
154 HH TYR 38 HH TYR 38 -14.258 -8.511 -3.660
155 HA PRO 39 HA PRO 39 -4.888 -12.392 -7.733
156 HB2 PRO 39 2HB PRO 39 -5.202 -11.222 -10.255
157 HB3 PRO 39 1HB PRO 39 -5.691 -12.865 -9.825
158 HG2 PRO 39 2HG PRO 39 -7.329 -10.371 -9.964
159 HG3 PRO 39 1HG PRO 39 -7.759 -12.017 -10.463
160 HD2 PRO 39 2HD PRO 39 -8.687 -10.989 -8.199
161 HD3 PRO 39 1HD PRO 39 -8.171 -12.689 -8.270
162 H VAL 40 H VAL 40 -2.882 -11.327 -7.608
163 HA VAL 40 HA VAL 40 -2.769 -8.775 -6.631
164 HB VAL 40 HB VAL 40 -0.339 -8.906 -7.022
165 HG11 VAL 40 1HG1 VAL 40 -1.296 -9.732 -4.973
166 HG12 VAL 40 2HG1 VAL 40 0.037 -10.777 -5.460
167 HG13 VAL 40 3HG1 VAL 40 -1.631 -11.289 -5.725
168 HG21 VAL 40 3HG2 VAL 40 -0.973 -11.601 -8.214
169 HG22 VAL 40 1HG2 VAL 40 0.642 -11.030 -7.802
170 HG23 VAL 40 2HG2 VAL 40 -0.284 -10.219 -9.067
171 H VAL 41 H VAL 41 -2.798 -9.688 -9.973
172 HA VAL 41 HA VAL 41 -1.866 -7.016 -10.654
173 HB VAL 41 HB VAL 41 -1.964 -7.679 -13.025
174 HG11 VAL 41 1HG1 VAL 41 0.086 -8.015 -11.793
175 HG12 VAL 41 2HG1 VAL 41 -0.134 -9.304 -12.975
176 HG13 VAL 41 3HG1 VAL 41 -0.464 -9.607 -11.271
177 HG21 VAL 41 3HG2 VAL 41 -3.809 -9.278 -12.941
178 HG22 VAL 41 1HG2 VAL 41 -2.826 -10.382 -11.980
179 HG23 VAL 41 2HG2 VAL 41 -2.381 -10.030 -13.651
180 H ALA 42 H ALA 42 -4.852 -8.691 -10.311
181 HA ALA 42 HA ALA 42 -6.175 -6.397 -11.533
182 HB1 ALA 42 1HB ALA 42 -7.941 -7.846 -12.383
183 HB2 ALA 42 2HB ALA 42 -7.094 -9.261 -11.760
184 HB3 ALA 42 3HB ALA 42 -6.377 -8.304 -13.050
185 H ILE 43 H ILE 43 -6.534 -5.420 -9.645
186 HA ILE 43 HA ILE 43 -8.411 -6.772 -7.857
187 HB ILE 43 HB ILE 43 -6.385 -4.612 -7.130
188 HG12 ILE 43 2HG1 ILE 43 -6.480 -7.544 -6.356
189 HG13 ILE 43 1HG1 ILE 43 -5.328 -6.807 -7.455
190 HG21 ILE 43 1HG2 ILE 43 -8.347 -6.075 -5.373
191 HG22 ILE 43 2HG2 ILE 43 -8.466 -4.391 -5.887
192 HG23 ILE 43 3HG2 ILE 43 -7.140 -4.897 -4.843
193 HD11 ILE 43 3HD1 ILE 43 -4.439 -5.473 -5.610
194 HD12 ILE 43 1HD1 ILE 43 -4.325 -7.206 -5.297
195 HD13 ILE 43 2HD1 ILE 43 -5.581 -6.246 -4.511
196 HA PRO 44 HA PRO 44 -10.848 -3.512 -9.707
197 HB2 PRO 44 2HB PRO 44 -13.165 -4.034 -8.338
198 HB3 PRO 44 1HB PRO 44 -12.662 -4.919 -9.782
199 HG2 PRO 44 2HG PRO 44 -12.449 -5.699 -6.913
200 HG3 PRO 44 1HG PRO 44 -12.809 -6.704 -8.326
201 HD2 PRO 44 2HD PRO 44 -10.380 -6.630 -7.115
202 HD3 PRO 44 1HD PRO 44 -10.586 -6.992 -8.838
203 H CYS 45 H CYS 45 -11.065 -1.460 -9.108
204 HA CYS 45 HA CYS 45 -10.800 -0.870 -6.256
205 HB2 CYS 45 2HB CYS 45 -9.856 0.735 -8.638
206 HB3 CYS 45 1HB CYS 45 -9.679 1.210 -6.954
207 HA PRO 46 HA PRO 46 -14.700 1.270 -6.582
208 HB2 PRO 46 2HB PRO 46 -14.315 3.023 -4.491
209 HB3 PRO 46 1HB PRO 46 -14.859 1.358 -4.284
210 HG2 PRO 46 2HG PRO 46 -12.135 2.532 -3.948
211 HG3 PRO 46 1HG PRO 46 -12.940 1.277 -2.988
212 HD2 PRO 46 2HD PRO 46 -11.047 0.721 -4.826
213 HD3 PRO 46 1HD PRO 46 -12.389 -0.389 -4.484
214 H ILE 47 H ILE 47 -15.464 3.425 -7.060
215 HA ILE 47 HA ILE 47 -13.498 4.871 -8.616
216 HB ILE 47 HB ILE 47 -15.401 6.257 -9.405
217 HG12 ILE 47 2HG1 ILE 47 -17.096 4.394 -7.722
218 HG13 ILE 47 1HG1 ILE 47 -16.789 6.087 -7.347
219 HG21 ILE 47 1HG2 ILE 47 -15.801 3.282 -9.617
220 HG22 ILE 47 2HG2 ILE 47 -14.760 4.273 -10.637
221 HG23 ILE 47 3HG2 ILE 47 -16.509 4.484 -10.692
222 HD11 ILE 47 3HD1 ILE 47 -17.953 6.717 -9.413
223 HD12 ILE 47 1HD1 ILE 47 -18.983 5.773 -8.333
224 HD13 ILE 47 2HD1 ILE 47 -18.250 5.015 -9.750
225 H THR 48 H THR 48 -14.779 5.034 -5.530
226 HA THR 48 HA THR 48 -14.698 7.817 -5.116
227 HB THR 48 HB THR 48 -14.281 5.687 -3.011
228 HG1 THR 48 1HG THR 48 -16.652 5.846 -2.902
229 HG21 THR 48 3HG2 THR 48 -15.489 7.312 -1.598
230 HG22 THR 48 1HG2 THR 48 -15.642 8.395 -2.979
231 HG23 THR 48 2HG2 THR 48 -14.052 8.041 -2.310
232 H TYR 49 H TYR 49 -13.014 9.072 -4.630
233 HA TYR 49 HA TYR 49 -10.356 7.905 -4.709
234 HB2 TYR 49 2HB TYR 49 -11.027 9.748 -6.285
235 HB3 TYR 49 1HB TYR 49 -11.253 10.790 -4.894
236 HD1 TYR 49 2HD TYR 49 -9.302 11.651 -3.667
237 HD2 TYR 49 1HD TYR 49 -8.829 9.191 -7.096
238 HE1 TYR 49 2HE TYR 49 -6.945 12.349 -3.839
239 HE2 TYR 49 1HE TYR 49 -6.486 9.888 -7.286
240 HH TYR 49 HH TYR 49 -5.073 11.677 -6.625
241 H LEU 50 H LEU 50 -9.552 7.483 -2.797
242 HA LEU 50 HA LEU 50 -9.976 9.381 -0.608
243 HB2 LEU 50 2HB LEU 50 -9.573 6.384 -0.259
244 HB3 LEU 50 1HB LEU 50 -9.735 7.549 1.026
245 HG LEU 50 HG LEU 50 -12.125 7.915 0.080
246 HD11 LEU 50 1HD1 LEU 50 -13.097 5.953 -0.991
247 HD12 LEU 50 2HD1 LEU 50 -11.498 5.217 -1.094
248 HD13 LEU 50 3HD1 LEU 50 -11.848 6.696 -1.990
249 HD21 LEU 50 3HD2 LEU 50 -11.358 5.361 1.485
250 HD22 LEU 50 1HD2 LEU 50 -12.975 6.065 1.441
251 HD23 LEU 50 2HD2 LEU 50 -11.662 6.924 2.244
252 HA PRO 51 HA PRO 51 -5.637 9.358 -1.895
253 HB2 PRO 51 2HB PRO 51 -4.915 11.423 -0.191
254 HB3 PRO 51 1HB PRO 51 -5.465 11.657 -1.846
255 HG2 PRO 51 2HG PRO 51 -6.940 11.937 0.715
256 HG3 PRO 51 1HG PRO 51 -7.110 12.854 -0.789
257 HD2 PRO 51 2HD PRO 51 -8.879 10.960 -0.029
258 HD3 PRO 51 1HD PRO 51 -8.512 11.276 -1.736
259 H VAL 52 H VAL 52 -4.272 7.995 -1.093
260 HA VAL 52 HA VAL 52 -3.809 7.984 1.782
261 HB VAL 52 HB VAL 52 -3.411 5.529 1.761
262 HG11 VAL 52 1HG1 VAL 52 -6.186 6.302 0.887
263 HG12 VAL 52 2HG1 VAL 52 -5.561 6.320 2.538
264 HG13 VAL 52 3HG1 VAL 52 -5.748 4.789 1.682
265 HG21 VAL 52 3HG2 VAL 52 -4.271 4.163 -0.115
266 HG22 VAL 52 1HG2 VAL 52 -2.905 5.189 -0.561
267 HG23 VAL 52 2HG2 VAL 52 -4.547 5.647 -1.028
268 H CYS 53 H CYS 53 -1.684 7.493 2.383
269 HA CYS 53 HA CYS 53 0.196 7.832 0.174
270 HB2 CYS 53 2HB CYS 53 0.060 9.826 1.561
271 HB3 CYS 53 1HB CYS 53 0.381 8.919 3.007
272 H GLY 54 H GLY 54 1.733 6.377 -0.011
273 HA2 GLY 54 2HA GLY 54 1.877 4.268 2.001
274 HA3 GLY 54 1HA GLY 54 2.522 4.198 0.365
275 H SER 55 H SER 55 4.076 3.393 2.441
276 HA SER 55 HA SER 55 5.770 5.402 3.474
277 HB2 SER 55 2HB SER 55 7.226 3.390 3.994
278 HB3 SER 55 1HB SER 55 5.575 3.311 4.616
279 HG SER 55 HG SER 55 6.771 1.580 3.122
280 H ASP 56 H ASP 56 5.423 4.166 0.448
281 HA ASP 56 HA ASP 56 8.158 4.395 -0.510
282 HB2 ASP 56 2HB ASP 56 6.358 2.735 -1.304
283 HB3 ASP 56 1HB ASP 56 5.608 4.094 -2.118
284 H TYR 57 H TYR 57 5.718 6.405 0.372
285 HA TYR 57 HA TYR 57 5.209 8.504 0.276
286 HB2 TYR 57 2HB TYR 57 7.920 8.770 -0.989
287 HB3 TYR 57 1HB TYR 57 6.901 10.171 -0.670
288 HD1 TYR 57 2HD TYR 57 6.272 10.744 1.644
289 HD2 TYR 57 1HD TYR 57 9.042 7.637 0.797
290 HE1 TYR 57 2HE TYR 57 7.022 10.785 3.981
291 HE2 TYR 57 1HE TYR 57 9.790 7.661 3.122
292 HH TYR 57 HH TYR 57 8.091 9.202 5.572
293 H ILE 58 H ILE 58 4.408 6.768 -1.758
294 HA ILE 58 HA ILE 58 3.822 8.645 -3.918
295 HB ILE 58 HB ILE 58 3.280 5.661 -3.752
296 HG12 ILE 58 2HG1 ILE 58 5.672 6.091 -3.859
297 HG13 ILE 58 1HG1 ILE 58 5.117 5.383 -5.368
298 HG21 ILE 58 1HG2 ILE 58 1.701 6.794 -5.207
299 HG22 ILE 58 2HG2 ILE 58 2.808 5.808 -6.163
300 HG23 ILE 58 3HG2 ILE 58 3.026 7.558 -6.089
301 HD11 ILE 58 3HD1 ILE 58 5.763 8.285 -4.877
302 HD12 ILE 58 1HD1 ILE 58 5.148 7.619 -6.392
303 HD13 ILE 58 2HD1 ILE 58 6.729 7.125 -5.786
304 H THR 59 H THR 59 1.812 9.455 -4.039
305 HA THR 59 HA THR 59 -0.101 8.706 -2.017
306 HB THR 59 HB THR 59 -0.302 10.810 -4.189
307 HG1 THR 59 1HG THR 59 1.331 10.698 -2.235
308 HG21 THR 59 3HG2 THR 59 -1.819 10.394 -1.597
309 HG22 THR 59 1HG2 THR 59 -2.459 10.182 -3.222
310 HG23 THR 59 2HG2 THR 59 -2.009 11.793 -2.663
311 H TYR 60 H TYR 60 -1.767 7.452 -2.415
312 HA TYR 60 HA TYR 60 -2.182 6.534 -5.158
313 HB2 TYR 60 2HB TYR 60 -2.772 5.173 -2.532
314 HB3 TYR 60 1HB TYR 60 -3.147 4.490 -4.119
315 HD1 TYR 60 1HD TYR 60 -1.340 3.666 -5.553
316 HD2 TYR 60 2HD TYR 60 -0.518 5.258 -1.703
317 HE1 TYR 60 1HE TYR 60 0.930 2.731 -5.652
318 HE2 TYR 60 2HE TYR 60 1.746 4.327 -1.792
319 HH TYR 60 HH TYR 60 3.103 3.151 -4.654
320 H GLY 61 H GLY 61 -4.223 6.370 -5.947
321 HA2 GLY 61 2HA GLY 61 -6.011 8.401 -5.241
322 HA3 GLY 61 1HA GLY 61 -6.351 7.086 -6.365
323 H ASN 62 H ASN 62 -5.818 5.101 -4.297
324 HA ASN 62 HA ASN 62 -7.279 5.530 -2.021
325 HB2 ASN 62 2HB ASN 62 -9.282 4.113 -2.334
326 HB3 ASN 62 1HB ASN 62 -9.320 5.509 -3.390
327 HD21 ASN 62 1HD2 ASN 62 -10.698 4.683 -4.839
328 HD22 ASN 62 2HD2 ASN 62 -10.365 3.353 -5.872
329 H GLU 63 H GLU 63 -7.827 3.448 -0.980
330 HA GLU 63 HA GLU 63 -5.455 2.154 -0.421
331 HB2 GLU 63 2HB GLU 63 -6.948 0.534 0.808
332 HB3 GLU 63 1HB GLU 63 -7.047 2.234 1.241
333 HG2 GLU 63 2HG GLU 63 -9.065 2.472 -0.093
334 HG3 GLU 63 1HG GLU 63 -8.950 0.778 -0.574
335 H CYS 64 H CYS 64 -7.881 1.235 -2.741
336 HA CYS 64 HA CYS 64 -7.184 -1.472 -3.040
337 HB2 CYS 64 2HB CYS 64 -9.239 -0.687 -3.990
338 HB3 CYS 64 1HB CYS 64 -8.389 0.503 -4.971
339 H HIS 65 H HIS 65 -6.018 1.457 -4.594
340 HA HIS 65 HA HIS 65 -4.281 0.074 -6.395
341 HB2 HIS 65 2HB HIS 65 -4.297 2.983 -5.555
342 HB3 HIS 65 1HB HIS 65 -3.297 2.348 -6.848
343 HD1 HIS 65 1HD HIS 65 -4.660 1.438 -9.006
344 HD2 HIS 65 2HD HIS 65 -6.833 3.617 -6.231
345 HE1 HIS 65 1HE HIS 65 -6.772 2.078 -10.174
346 HE2 HIS 65 2HE HIS 65 -7.969 3.569 -8.545
347 H LEU 66 H LEU 66 -3.936 1.596 -3.273
348 HA LEU 66 HA LEU 66 -1.161 1.343 -2.959
349 HB2 LEU 66 2HB LEU 66 -2.431 2.727 -1.475
350 HB3 LEU 66 1HB LEU 66 -3.425 1.378 -0.981
351 HG LEU 66 HG LEU 66 -1.526 0.397 0.226
352 HD11 LEU 66 1HD1 LEU 66 0.305 1.229 -1.135
353 HD12 LEU 66 2HD1 LEU 66 0.525 1.665 0.560
354 HD13 LEU 66 3HD1 LEU 66 -0.028 2.875 -0.598
355 HD21 LEU 66 3HD2 LEU 66 -3.026 1.885 1.399
356 HD22 LEU 66 1HD2 LEU 66 -2.057 3.276 0.909
357 HD23 LEU 66 2HD2 LEU 66 -1.375 2.065 1.992
358 H CYS 67 H CYS 67 -3.796 -0.838 -1.974
359 HA CYS 67 HA CYS 67 -2.134 -2.831 -0.917
360 HB2 CYS 67 2HB CYS 67 -4.489 -2.733 -0.352
361 HB3 CYS 67 1HB CYS 67 -4.943 -2.998 -2.033
362 H THR 68 H THR 68 -3.419 -2.373 -4.205
363 HA THR 68 HA THR 68 -2.503 -4.780 -5.334
364 HB THR 68 HB THR 68 -2.713 -2.075 -6.726
365 HG1 THR 68 1HG THR 68 -4.713 -2.841 -5.700
366 HG21 THR 68 3HG2 THR 68 -3.027 -3.399 -8.776
367 HG22 THR 68 1HG2 THR 68 -2.800 -4.883 -7.849
368 HG23 THR 68 2HG2 THR 68 -1.469 -3.743 -8.025
369 H GLU 69 H GLU 69 -0.974 -1.571 -5.146
370 HA GLU 69 HA GLU 69 1.398 -2.191 -6.487
371 HB2 GLU 69 2HB GLU 69 0.453 0.080 -5.998
372 HB3 GLU 69 1HB GLU 69 0.943 -0.129 -4.332
373 HG2 GLU 69 2HG GLU 69 2.523 1.252 -5.494
374 HG3 GLU 69 1HG GLU 69 3.278 -0.271 -5.045
375 H SER 70 H SER 70 0.427 -2.388 -3.118
376 HA SER 70 HA SER 70 2.945 -2.879 -2.000
377 HB2 SER 70 2HB SER 70 0.881 -2.133 -0.761
378 HB3 SER 70 1HB SER 70 0.264 -3.772 -0.925
379 HG SER 70 HG SER 70 2.377 -2.784 0.586
380 H LEU 71 H LEU 71 0.266 -5.153 -2.714
381 HA LEU 71 HA LEU 71 1.583 -7.505 -1.996
382 HB2 LEU 71 2HB LEU 71 -0.586 -7.107 -4.044
383 HB3 LEU 71 1HB LEU 71 -0.093 -8.653 -3.385
384 HG LEU 71 HG LEU 71 -1.320 -6.396 -1.803
385 HD11 LEU 71 1HD1 LEU 71 -2.893 -7.411 -3.361
386 HD12 LEU 71 2HD1 LEU 71 -3.280 -7.823 -1.692
387 HD13 LEU 71 3HD1 LEU 71 -2.488 -9.010 -2.732
388 HD21 LEU 71 3HD2 LEU 71 0.171 -7.751 -0.435
389 HD22 LEU 71 1HD2 LEU 71 -0.606 -9.223 -1.019
390 HD23 LEU 71 2HD2 LEU 71 -1.508 -8.086 -0.020
391 H LYS 72 H LYS 72 1.274 -5.955 -5.125
392 HA LYS 72 HA LYS 72 2.550 -7.806 -6.771
393 HB2 LYS 72 2HB LYS 72 1.313 -5.881 -7.588
394 HB3 LYS 72 1HB LYS 72 2.506 -4.807 -6.876
395 HG2 LYS 72 2HG LYS 72 4.196 -5.862 -8.434
396 HG3 LYS 72 1HG LYS 72 2.835 -6.638 -9.246
397 HD2 LYS 72 2HD LYS 72 3.461 -4.580 -10.405
398 HD3 LYS 72 1HD LYS 72 1.855 -4.414 -9.683
399 HE2 LYS 72 2HE LYS 72 2.797 -3.156 -7.821
400 HE3 LYS 72 1HE LYS 72 4.425 -3.398 -8.441
401 HZ1 LYS 72 3HZ LYS 72 2.262 -1.887 -9.786
402 HZ2 LYS 72 1HZ LYS 72 3.865 -2.032 -10.327
403 HZ3 LYS 72 2HZ LYS 72 3.510 -1.223 -8.883
404 H SER 73 H SER 73 3.878 -5.413 -4.599
405 HA SER 73 HA SER 73 6.574 -5.874 -5.646
406 HB2 SER 73 2HB SER 73 5.597 -3.701 -3.813
407 HB3 SER 73 1HB SER 73 7.125 -3.762 -4.691
408 HG SER 73 HG SER 73 4.560 -3.201 -5.573
409 H ASN 74 H ASN 74 4.873 -7.473 -3.533
410 HA ASN 74 HA ASN 74 5.284 -8.760 -1.708
411 HB2 ASN 74 2HB ASN 74 8.154 -7.993 -2.275
412 HB3 ASN 74 1HB ASN 74 7.706 -9.088 -0.975
413 HD21 ASN 74 1HD2 ASN 74 8.118 -8.702 -4.381
414 HD22 ASN 74 2HD2 ASN 74 7.857 -10.361 -4.790
415 H GLY 75 H GLY 75 4.770 -5.877 -1.402
416 HA2 GLY 75 2HA GLY 75 4.235 -4.732 0.555
417 HA3 GLY 75 1HA GLY 75 5.344 -5.760 1.443
418 H ARG 76 H ARG 76 6.347 -4.179 -1.464
419 HA ARG 76 HA ARG 76 8.576 -2.803 -0.460
420 HB2 ARG 76 2HB ARG 76 7.992 -3.176 -2.879
421 HB3 ARG 76 1HB ARG 76 6.818 -1.879 -2.745
422 HG2 ARG 76 2HG ARG 76 8.783 -0.411 -2.049
423 HG3 ARG 76 1HG ARG 76 9.811 -1.722 -2.634
424 HD2 ARG 76 2HD ARG 76 9.643 -0.384 -4.506
425 HD3 ARG 76 1HD ARG 76 8.349 -1.544 -4.789
426 HE ARG 76 HE ARG 76 7.936 1.157 -3.670
427 HH11 ARG 76 1HH1 ARG 76 6.780 -1.439 -5.879
428 HH12 ARG 76 2HH1 ARG 76 5.488 -0.521 -6.478
429 HH21 ARG 76 1HH2 ARG 76 6.157 2.401 -4.585
430 HH22 ARG 76 2HH2 ARG 76 5.114 1.701 -5.720
431 H VAL 77 H VAL 77 5.376 -1.635 -1.217
432 HA VAL 77 HA VAL 77 5.800 0.724 0.428
433 HB VAL 77 HB VAL 77 5.078 1.192 -1.870
434 HG11 VAL 77 1HG1 VAL 77 3.948 -0.853 -2.419
435 HG12 VAL 77 2HG1 VAL 77 2.882 0.525 -2.705
436 HG13 VAL 77 3HG1 VAL 77 2.661 -0.480 -1.272
437 HG21 VAL 77 3HG2 VAL 77 4.301 2.713 -0.143
438 HG22 VAL 77 1HG2 VAL 77 2.881 1.702 0.121
439 HG23 VAL 77 2HG2 VAL 77 3.084 2.546 -1.411
440 H GLN 78 H GLN 78 4.754 0.990 2.250
441 HA GLN 78 HA GLN 78 2.596 -0.851 3.001
442 HB2 GLN 78 2HB GLN 78 4.653 0.618 4.662
443 HB3 GLN 78 1HB GLN 78 3.289 -0.251 5.341
444 HG2 GLN 78 2HG GLN 78 5.427 -1.523 3.660
445 HG3 GLN 78 1HG GLN 78 5.466 -1.455 5.422
446 HE21 GLN 78 1HE2 GLN 78 3.922 -2.840 2.650
447 HE22 GLN 78 2HE2 GLN 78 3.092 -4.094 3.509
448 H PHE 79 H PHE 79 0.945 0.235 4.300
449 HA PHE 79 HA PHE 79 0.327 2.861 3.406
450 HB2 PHE 79 2HB PHE 79 -1.450 1.356 4.041
451 HB3 PHE 79 1HB PHE 79 -0.810 1.172 5.654
452 HD1 PHE 79 2HD PHE 79 -2.678 3.337 3.375
453 HD2 PHE 79 1HD PHE 79 -1.209 2.879 7.340
454 HE1 PHE 79 2HE PHE 79 -4.176 5.121 4.142
455 HE2 PHE 79 1HE PHE 79 -2.708 4.656 8.109
456 HZ PHE 79 HZ PHE 79 -4.189 5.779 6.520
457 H LEU 80 H LEU 80 1.144 4.708 4.113
458 HA LEU 80 HA LEU 80 2.780 4.676 6.526
459 HB2 LEU 80 2HB LEU 80 3.646 5.553 4.343
460 HB3 LEU 80 1HB LEU 80 2.452 6.820 4.410
461 HG LEU 80 HG LEU 80 3.547 7.597 6.546
462 HD11 LEU 80 1HD1 LEU 80 5.823 6.850 6.966
463 HD12 LEU 80 2HD1 LEU 80 5.684 5.683 5.658
464 HD13 LEU 80 3HD1 LEU 80 4.686 5.506 7.105
465 HD21 LEU 80 3HD2 LEU 80 5.213 7.563 4.031
466 HD22 LEU 80 1HD2 LEU 80 5.392 8.694 5.373
467 HD23 LEU 80 2HD2 LEU 80 3.916 8.695 4.408
468 H HIS 81 H HIS 81 0.418 6.816 4.946
469 HA HIS 81 HA HIS 81 -1.158 7.043 7.294
470 HB2 HIS 81 2HB HIS 81 -0.996 9.523 7.495
471 HB3 HIS 81 1HB HIS 81 0.526 8.751 7.890
472 HD1 HIS 81 1HD HIS 81 -1.089 10.871 5.158
473 HD2 HIS 81 2HD HIS 81 2.669 9.557 6.362
474 HE1 HIS 81 1HE HIS 81 0.581 12.091 3.706
475 HE2 HIS 81 2HE HIS 81 2.769 11.552 4.747
476 H ASP 82 H ASP 82 -3.171 8.210 6.724
477 HA ASP 82 HA ASP 82 -3.601 7.874 3.897
478 HB2 ASP 82 2HB ASP 82 -5.946 8.118 4.280
479 HB3 ASP 82 1HB ASP 82 -5.366 7.203 5.656
480 H GLY 83 H GLY 83 -4.834 9.674 2.788
481 HA2 GLY 83 2HA GLY 83 -5.024 11.896 2.304
482 HA3 GLY 83 1HA GLY 83 -3.936 12.297 3.642
483 H SER 84 H SER 84 -3.469 13.473 1.292
484 HA SER 84 HA SER 84 -1.767 12.064 -0.427
485 HB2 SER 84 2HB SER 84 -2.042 15.013 0.110
486 HB3 SER 84 1HB SER 84 -1.370 14.284 -1.364
487 HG SER 84 HG SER 84 -3.827 14.952 -0.961
488 H CYS 85 H CYS 85 0.509 12.101 -0.542
489 HA CYS 85 HA CYS 85 1.840 11.991 1.904
490 HB2 CYS 85 2HB CYS 85 2.992 12.134 -0.890
491 HB3 CYS 85 1HB CYS 85 3.867 11.698 0.580
Start of MODEL 4
1 H1 SER 20 1HT SER 20 -12.480 9.997 11.115
2 H2 SER 20 2HT SER 20 -12.163 9.753 12.760
3 H3 SER 20 3HT SER 20 -13.000 8.579 11.883
4 HA SER 20 HA SER 20 -11.091 8.160 10.556
5 HB2 SER 20 2HB SER 20 -9.826 10.267 12.313
6 HB3 SER 20 1HB SER 20 -8.983 9.347 11.072
7 HG SER 20 HG SER 20 -10.132 10.402 9.493
8 H GLU 21 H GLU 21 -9.671 6.497 11.251
9 HA GLU 21 HA GLU 21 -10.018 5.710 14.052
10 HB2 GLU 21 2HB GLU 21 -9.109 4.157 11.628
11 HB3 GLU 21 1HB GLU 21 -9.207 3.496 13.253
12 HG2 GLU 21 2HG GLU 21 -11.590 3.747 13.273
13 HG3 GLU 21 1HG GLU 21 -11.552 4.605 11.736
14 H ALA 22 H ALA 22 -8.408 6.798 15.157
15 HA ALA 22 HA ALA 22 -5.702 6.041 14.745
16 HB1 ALA 22 1HB ALA 22 -5.882 7.738 12.978
17 HB2 ALA 22 2HB ALA 22 -4.859 8.327 14.288
18 HB3 ALA 22 3HB ALA 22 -6.521 8.894 14.143
19 H ALA 23 H ALA 23 -4.399 7.810 16.166
20 HA ALA 23 HA ALA 23 -3.922 8.813 18.099
21 HB1 ALA 23 1HB ALA 23 -5.606 9.903 19.451
22 HB2 ALA 23 2HB ALA 23 -6.885 9.031 18.601
23 HB3 ALA 23 3HB ALA 23 -5.899 10.216 17.742
24 H SER 24 H SER 24 -6.731 6.865 18.885
25 HA SER 24 HA SER 24 -5.509 5.957 21.331
26 HB2 SER 24 2HB SER 24 -7.690 4.597 21.424
27 HB3 SER 24 1HB SER 24 -7.858 6.348 21.429
28 HG SER 24 HG SER 24 -8.561 6.318 19.402
29 H LEU 25 H LEU 25 -6.387 3.236 21.363
30 HA LEU 25 HA LEU 25 -4.244 2.057 19.883
31 HB2 LEU 25 2HB LEU 25 -5.179 1.330 22.212
32 HB3 LEU 25 1HB LEU 25 -6.420 0.514 21.306
33 HG LEU 25 HG LEU 25 -3.463 -0.115 21.101
34 HD11 LEU 25 1HD1 LEU 25 -5.639 -1.536 22.613
35 HD12 LEU 25 2HD1 LEU 25 -4.287 -0.636 23.305
36 HD13 LEU 25 3HD1 LEU 25 -3.989 -2.116 22.396
37 HD21 LEU 25 3HD2 LEU 25 -4.202 -2.186 20.001
38 HD22 LEU 25 1HD2 LEU 25 -4.704 -0.767 19.082
39 HD23 LEU 25 2HD2 LEU 25 -5.873 -1.631 20.075
40 H SER 26 H SER 26 -4.945 2.795 17.904
41 HA SER 26 HA SER 26 -6.221 0.796 16.317
42 HB2 SER 26 2HB SER 26 -7.383 3.611 16.375
43 HB3 SER 26 1HB SER 26 -7.795 2.373 15.192
44 HG SER 26 HG SER 26 -8.028 1.658 17.843
45 HA PRO 27 HA PRO 27 -2.916 3.054 14.134
46 HB2 PRO 27 2HB PRO 27 -1.420 0.682 13.760
47 HB3 PRO 27 1HB PRO 27 -1.074 1.937 14.945
48 HG2 PRO 27 2HG PRO 27 -1.888 -0.689 15.518
49 HG3 PRO 27 1HG PRO 27 -1.861 0.664 16.654
50 HD2 PRO 27 2HD PRO 27 -4.147 -0.483 15.120
51 HD3 PRO 27 1HD PRO 27 -4.127 0.247 16.743
52 H LYS 28 H LYS 28 -4.745 3.093 12.642
53 HA LYS 28 HA LYS 28 -5.373 0.791 11.142
54 HB2 LYS 28 2HB LYS 28 -7.043 2.553 11.575
55 HB3 LYS 28 1HB LYS 28 -6.132 3.644 10.540
56 HG2 LYS 28 2HG LYS 28 -6.551 2.268 8.614
57 HG3 LYS 28 1HG LYS 28 -7.326 1.040 9.608
58 HD2 LYS 28 2HD LYS 28 -9.074 2.651 10.200
59 HD3 LYS 28 1HD LYS 28 -8.309 3.852 9.149
60 HE2 LYS 28 2HE LYS 28 -8.688 2.437 7.224
61 HE3 LYS 28 1HE LYS 28 -9.327 1.157 8.256
62 HZ1 LYS 28 3HZ LYS 28 -11.111 2.614 8.900
63 HZ2 LYS 28 1HZ LYS 28 -11.116 2.399 7.223
64 HZ3 LYS 28 2HZ LYS 28 -10.540 3.843 7.917
65 H LYS 29 H LYS 29 -4.931 0.185 9.188
66 HA LYS 29 HA LYS 29 -3.067 1.702 7.571
67 HB2 LYS 29 2HB LYS 29 -1.644 -0.178 7.182
68 HB3 LYS 29 1HB LYS 29 -1.835 -0.095 8.919
69 HG2 LYS 29 2HG LYS 29 -3.328 -1.987 7.101
70 HG3 LYS 29 1HG LYS 29 -1.865 -2.395 7.982
71 HD2 LYS 29 2HD LYS 29 -3.077 -2.014 10.105
72 HD3 LYS 29 1HD LYS 29 -4.531 -1.631 9.184
73 HE2 LYS 29 2HE LYS 29 -4.570 -3.953 9.981
74 HE3 LYS 29 1HE LYS 29 -4.543 -3.870 8.221
75 HZ1 LYS 29 3HZ LYS 29 -3.037 -5.565 9.042
76 HZ2 LYS 29 1HZ LYS 29 -2.204 -4.435 9.971
77 HZ3 LYS 29 2HZ LYS 29 -2.161 -4.344 8.282
78 H VAL 30 H VAL 30 -3.016 0.386 5.361
79 HA VAL 30 HA VAL 30 -5.675 0.320 4.401
80 HB VAL 30 HB VAL 30 -3.887 0.919 2.843
81 HG11 VAL 30 1HG1 VAL 30 -2.809 -1.885 3.197
82 HG12 VAL 30 2HG1 VAL 30 -2.060 -0.440 3.852
83 HG13 VAL 30 3HG1 VAL 30 -2.167 -0.662 2.102
84 HG21 VAL 30 3HG2 VAL 30 -5.870 -0.312 1.999
85 HG22 VAL 30 1HG2 VAL 30 -4.929 -1.786 2.040
86 HG23 VAL 30 2HG2 VAL 30 -4.450 -0.475 0.954
87 H ASP 31 H ASP 31 -7.104 -1.397 4.332
88 HA ASP 31 HA ASP 31 -5.984 -3.846 5.302
89 HB2 ASP 31 2HB ASP 31 -8.305 -3.184 6.069
90 HB3 ASP 31 1HB ASP 31 -8.857 -3.513 4.420
91 H CYS 32 H CYS 32 -4.769 -4.613 3.890
92 HA CYS 32 HA CYS 32 -5.531 -4.687 1.103
93 HB2 CYS 32 2HB CYS 32 -3.201 -4.126 1.999
94 HB3 CYS 32 1HB CYS 32 -3.060 -5.827 2.405
95 H SER 33 H SER 33 -5.867 -6.523 3.887
96 HA SER 33 HA SER 33 -5.671 -9.134 2.984
97 HB2 SER 33 2HB SER 33 -7.407 -7.962 5.146
98 HB3 SER 33 1HB SER 33 -6.992 -9.673 4.976
99 HG SER 33 HG SER 33 -5.063 -9.305 5.695
100 H ILE 34 H ILE 34 -8.446 -6.870 2.977
101 HA ILE 34 HA ILE 34 -10.221 -8.762 1.904
102 HB ILE 34 HB ILE 34 -11.655 -6.847 1.172
103 HG12 ILE 34 2HG1 ILE 34 -9.489 -5.160 2.446
104 HG13 ILE 34 1HG1 ILE 34 -9.875 -5.210 0.733
105 HG21 ILE 34 1HG2 ILE 34 -11.939 -7.868 3.350
106 HG22 ILE 34 2HG2 ILE 34 -12.272 -6.136 3.407
107 HG23 ILE 34 3HG2 ILE 34 -10.745 -6.756 4.028
108 HD11 ILE 34 3HD1 ILE 34 -11.685 -4.222 2.927
109 HD12 ILE 34 1HD1 ILE 34 -12.090 -4.276 1.212
110 HD13 ILE 34 2HD1 ILE 34 -10.794 -3.222 1.782
111 H TYR 35 H TYR 35 -7.654 -7.153 0.350
112 HA TYR 35 HA TYR 35 -8.972 -7.553 -2.204
113 HB2 TYR 35 2HB TYR 35 -6.471 -5.983 -1.577
114 HB3 TYR 35 1HB TYR 35 -7.112 -6.236 -3.199
115 HD1 TYR 35 1HD TYR 35 -9.387 -5.337 -3.756
116 HD2 TYR 35 2HD TYR 35 -7.353 -4.261 -0.186
117 HE1 TYR 35 1HE TYR 35 -10.854 -3.393 -3.519
118 HE2 TYR 35 2HE TYR 35 -8.822 -2.303 0.068
119 HH TYR 35 HH TYR 35 -10.284 -0.899 -1.177
120 H LYS 36 H LYS 36 -6.972 -9.190 -0.200
121 HA LYS 36 HA LYS 36 -5.136 -10.508 -1.855
122 HB2 LYS 36 2HB LYS 36 -6.647 -11.482 0.564
123 HB3 LYS 36 1HB LYS 36 -5.409 -12.435 -0.222
124 HG2 LYS 36 2HG LYS 36 -4.848 -9.675 0.815
125 HG3 LYS 36 1HG LYS 36 -4.771 -11.091 1.857
126 HD2 LYS 36 2HD LYS 36 -3.110 -12.091 0.300
127 HD3 LYS 36 1HD LYS 36 -3.136 -10.595 -0.639
128 HE2 LYS 36 2HE LYS 36 -2.311 -9.342 1.261
129 HE3 LYS 36 1HE LYS 36 -2.431 -10.771 2.284
130 HZ1 LYS 36 3HZ LYS 36 -0.154 -10.309 1.541
131 HZ2 LYS 36 1HZ LYS 36 -0.601 -10.543 -0.062
132 HZ3 LYS 36 2HZ LYS 36 -0.680 -11.813 1.052
133 H LYS 37 H LYS 37 -8.568 -10.821 -1.738
134 HA LYS 37 HA LYS 37 -8.685 -13.396 -3.004
135 HB2 LYS 37 2HB LYS 37 -11.125 -13.015 -3.174
136 HB3 LYS 37 1HB LYS 37 -10.510 -12.809 -1.547
137 HG2 LYS 37 2HG LYS 37 -10.686 -10.407 -1.735
138 HG3 LYS 37 1HG LYS 37 -11.142 -10.541 -3.437
139 HD2 LYS 37 2HD LYS 37 -13.166 -11.760 -2.807
140 HD3 LYS 37 1HD LYS 37 -12.697 -11.675 -1.112
141 HE2 LYS 37 2HE LYS 37 -13.220 -9.261 -2.846
142 HE3 LYS 37 1HE LYS 37 -14.445 -10.010 -1.826
143 HZ1 LYS 37 3HZ LYS 37 -11.901 -8.775 -0.880
144 HZ2 LYS 37 1HZ LYS 37 -13.044 -9.509 0.115
145 HZ3 LYS 37 2HZ LYS 37 -13.438 -8.128 -0.720
146 H TYR 38 H TYR 38 -7.639 -10.655 -4.268
147 HA TYR 38 HA TYR 38 -8.729 -11.254 -6.930
148 HB2 TYR 38 2HB TYR 38 -7.587 -8.612 -5.939
149 HB3 TYR 38 1HB TYR 38 -8.236 -8.926 -7.534
150 HD1 TYR 38 1HD TYR 38 -10.752 -9.492 -7.675
151 HD2 TYR 38 2HD TYR 38 -8.925 -7.773 -4.255
152 HE1 TYR 38 1HE TYR 38 -12.944 -8.652 -6.933
153 HE2 TYR 38 2HE TYR 38 -11.105 -6.933 -3.494
154 HH TYR 38 HH TYR 38 -13.296 -6.315 -4.572
155 HA PRO 39 HA PRO 39 -4.469 -12.233 -7.927
156 HB2 PRO 39 2HB PRO 39 -4.318 -11.081 -10.466
157 HB3 PRO 39 1HB PRO 39 -4.908 -12.712 -10.140
158 HG2 PRO 39 2HG PRO 39 -6.428 -10.195 -10.596
159 HG3 PRO 39 1HG PRO 39 -6.814 -11.851 -11.105
160 HD2 PRO 39 2HD PRO 39 -8.054 -10.657 -9.031
161 HD3 PRO 39 1HD PRO 39 -7.712 -12.400 -9.048
162 H VAL 40 H VAL 40 -2.556 -11.128 -7.450
163 HA VAL 40 HA VAL 40 -2.783 -8.612 -6.387
164 HB VAL 40 HB VAL 40 -0.450 -8.677 -5.965
165 HG11 VAL 40 1HG1 VAL 40 -1.626 -11.424 -5.708
166 HG12 VAL 40 2HG1 VAL 40 -1.854 -10.085 -4.595
167 HG13 VAL 40 3HG1 VAL 40 -0.254 -10.806 -4.789
168 HG21 VAL 40 3HG2 VAL 40 -0.271 -11.035 -7.814
169 HG22 VAL 40 1HG2 VAL 40 1.042 -10.400 -6.826
170 HG23 VAL 40 2HG2 VAL 40 0.374 -9.424 -8.141
171 H VAL 41 H VAL 41 -2.001 -9.432 -9.675
172 HA VAL 41 HA VAL 41 -1.001 -6.737 -10.097
173 HB VAL 41 HB VAL 41 -0.620 -7.346 -12.450
174 HG11 VAL 41 1HG1 VAL 41 1.129 -9.034 -12.077
175 HG12 VAL 41 2HG1 VAL 41 0.457 -9.341 -10.474
176 HG13 VAL 41 3HG1 VAL 41 1.138 -7.761 -10.857
177 HG21 VAL 41 3HG2 VAL 41 -2.475 -8.901 -12.792
178 HG22 VAL 41 1HG2 VAL 41 -1.736 -10.053 -11.684
179 HG23 VAL 41 2HG2 VAL 41 -0.946 -9.670 -13.213
180 H ALA 42 H ALA 42 -3.998 -8.410 -10.405
181 HA ALA 42 HA ALA 42 -5.086 -6.049 -11.725
182 HB1 ALA 42 1HB ALA 42 -6.668 -7.446 -12.955
183 HB2 ALA 42 2HB ALA 42 -5.936 -8.896 -12.270
184 HB3 ALA 42 3HB ALA 42 -5.005 -7.867 -13.362
185 H ILE 43 H ILE 43 -5.839 -5.145 -9.858
186 HA ILE 43 HA ILE 43 -7.890 -6.698 -8.464
187 HB ILE 43 HB ILE 43 -6.158 -4.463 -7.344
188 HG12 ILE 43 2HG1 ILE 43 -6.139 -7.441 -6.775
189 HG13 ILE 43 1HG1 ILE 43 -4.892 -6.540 -7.618
190 HG21 ILE 43 1HG2 ILE 43 -7.216 -4.996 -5.190
191 HG22 ILE 43 2HG2 ILE 43 -8.258 -6.169 -6.002
192 HG23 ILE 43 3HG2 ILE 43 -8.396 -4.454 -6.384
193 HD11 ILE 43 3HD1 ILE 43 -4.180 -7.000 -5.370
194 HD12 ILE 43 1HD1 ILE 43 -5.650 -6.269 -4.720
195 HD13 ILE 43 2HD1 ILE 43 -4.474 -5.265 -5.552
196 HA PRO 44 HA PRO 44 -10.365 -3.368 -10.269
197 HB2 PRO 44 2HB PRO 44 -12.553 -4.641 -8.745
198 HB3 PRO 44 1HB PRO 44 -12.429 -4.354 -10.483
199 HG2 PRO 44 2HG PRO 44 -12.235 -6.824 -9.437
200 HG3 PRO 44 1HG PRO 44 -11.313 -6.331 -10.870
201 HD2 PRO 44 2HD PRO 44 -10.410 -6.600 -8.031
202 HD3 PRO 44 1HD PRO 44 -9.571 -7.029 -9.538
203 H CYS 45 H CYS 45 -10.740 -1.455 -9.375
204 HA CYS 45 HA CYS 45 -10.773 -1.295 -6.449
205 HB2 CYS 45 2HB CYS 45 -9.443 0.452 -8.503
206 HB3 CYS 45 1HB CYS 45 -9.612 0.958 -6.837
207 HA PRO 46 HA PRO 46 -14.579 0.904 -6.718
208 HB2 PRO 46 2HB PRO 46 -14.296 2.579 -4.568
209 HB3 PRO 46 1HB PRO 46 -14.709 0.870 -4.417
210 HG2 PRO 46 2HG PRO 46 -12.063 2.219 -4.088
211 HG3 PRO 46 1HG PRO 46 -12.791 0.927 -3.117
212 HD2 PRO 46 2HD PRO 46 -10.905 0.447 -4.973
213 HD3 PRO 46 1HD PRO 46 -12.206 -0.711 -4.633
214 H ILE 47 H ILE 47 -15.416 3.066 -7.065
215 HA ILE 47 HA ILE 47 -13.513 4.730 -8.477
216 HB ILE 47 HB ILE 47 -15.465 6.128 -9.117
217 HG12 ILE 47 2HG1 ILE 47 -17.098 4.093 -7.579
218 HG13 ILE 47 1HG1 ILE 47 -16.829 5.753 -7.062
219 HG21 ILE 47 1HG2 ILE 47 -15.823 3.175 -9.561
220 HG22 ILE 47 2HG2 ILE 47 -14.805 4.262 -10.502
221 HG23 ILE 47 3HG2 ILE 47 -16.562 4.450 -10.531
222 HD11 ILE 47 3HD1 ILE 47 -18.044 6.536 -9.044
223 HD12 ILE 47 1HD1 ILE 47 -19.031 5.460 -8.054
224 HD13 ILE 47 2HD1 ILE 47 -18.295 4.865 -9.542
225 H THR 48 H THR 48 -14.567 4.431 -5.392
226 HA THR 48 HA THR 48 -14.699 7.036 -4.410
227 HB THR 48 HB THR 48 -13.526 4.678 -2.949
228 HG1 THR 48 1HG THR 48 -16.250 5.162 -3.684
229 HG21 THR 48 3HG2 THR 48 -13.652 6.841 -1.773
230 HG22 THR 48 1HG2 THR 48 -14.739 5.655 -1.050
231 HG23 THR 48 2HG2 THR 48 -15.381 6.916 -2.105
232 H TYR 49 H TYR 49 -13.083 8.465 -4.625
233 HA TYR 49 HA TYR 49 -10.349 7.558 -4.838
234 HB2 TYR 49 2HB TYR 49 -11.350 9.359 -6.327
235 HB3 TYR 49 1HB TYR 49 -11.421 10.385 -4.902
236 HD1 TYR 49 1HD TYR 49 -9.343 11.206 -3.856
237 HD2 TYR 49 2HD TYR 49 -9.279 8.921 -7.432
238 HE1 TYR 49 1HE TYR 49 -7.030 11.921 -4.261
239 HE2 TYR 49 2HE TYR 49 -6.966 9.630 -7.852
240 HH TYR 49 HH TYR 49 -5.536 11.500 -7.253
241 H LEU 50 H LEU 50 -9.156 7.436 -3.107
242 HA LEU 50 HA LEU 50 -9.744 9.097 -0.774
243 HB2 LEU 50 2HB LEU 50 -9.156 6.125 -0.725
244 HB3 LEU 50 1HB LEU 50 -9.271 7.148 0.685
245 HG LEU 50 HG LEU 50 -11.560 6.567 -1.195
246 HD11 LEU 50 1HD1 LEU 50 -10.854 4.564 -0.021
247 HD12 LEU 50 2HD1 LEU 50 -12.401 5.136 0.598
248 HD13 LEU 50 3HD1 LEU 50 -10.920 5.424 1.517
249 HD21 LEU 50 3HD2 LEU 50 -11.480 7.910 1.512
250 HD22 LEU 50 1HD2 LEU 50 -12.935 7.523 0.600
251 HD23 LEU 50 2HD2 LEU 50 -11.793 8.705 -0.030
252 HA PRO 51 HA PRO 51 -5.414 9.463 -2.050
253 HB2 PRO 51 2HB PRO 51 -4.922 11.633 -0.383
254 HB3 PRO 51 1HB PRO 51 -5.414 11.758 -2.067
255 HG2 PRO 51 2HG PRO 51 -6.983 12.117 0.400
256 HG3 PRO 51 1HG PRO 51 -7.233 12.820 -1.203
257 HD2 PRO 51 2HD PRO 51 -8.742 10.784 -0.134
258 HD3 PRO 51 1HD PRO 51 -8.580 11.090 -1.869
259 H VAL 52 H VAL 52 -4.103 8.102 -1.196
260 HA VAL 52 HA VAL 52 -3.612 8.219 1.682
261 HB VAL 52 HB VAL 52 -3.251 5.763 1.755
262 HG11 VAL 52 1HG1 VAL 52 -5.597 5.058 1.730
263 HG12 VAL 52 2HG1 VAL 52 -6.022 6.530 0.858
264 HG13 VAL 52 3HG1 VAL 52 -5.388 6.632 2.500
265 HG21 VAL 52 3HG2 VAL 52 -4.408 5.779 -1.035
266 HG22 VAL 52 1HG2 VAL 52 -4.117 4.333 -0.062
267 HG23 VAL 52 2HG2 VAL 52 -2.761 5.338 -0.570
268 H CYS 53 H CYS 53 -1.497 7.628 2.281
269 HA CYS 53 HA CYS 53 0.372 7.924 0.057
270 HB2 CYS 53 2HB CYS 53 0.356 9.875 1.490
271 HB3 CYS 53 1HB CYS 53 0.630 8.930 2.924
272 H GLY 54 H GLY 54 1.704 6.343 -0.277
273 HA2 GLY 54 2HA GLY 54 1.773 4.132 1.601
274 HA3 GLY 54 1HA GLY 54 2.398 4.138 -0.043
275 H SER 55 H SER 55 3.777 3.118 2.111
276 HA SER 55 HA SER 55 5.623 4.563 3.492
277 HB2 SER 55 2HB SER 55 6.224 1.982 2.073
278 HB3 SER 55 1HB SER 55 6.935 2.571 3.567
279 HG SER 55 HG SER 55 5.392 1.482 4.473
280 H ASP 56 H ASP 56 5.577 4.024 0.080
281 HA ASP 56 HA ASP 56 8.408 4.573 -0.323
282 HB2 ASP 56 2HB ASP 56 7.027 2.807 -1.582
283 HB3 ASP 56 1HB ASP 56 6.306 4.152 -2.451
284 H TYR 57 H TYR 57 5.977 6.496 0.425
285 HA TYR 57 HA TYR 57 5.526 8.678 0.321
286 HB2 TYR 57 2HB TYR 57 8.128 8.835 -1.229
287 HB3 TYR 57 1HB TYR 57 7.183 10.259 -0.803
288 HD1 TYR 57 2HD TYR 57 9.322 7.561 0.476
289 HD2 TYR 57 1HD TYR 57 7.101 11.042 1.485
290 HE1 TYR 57 2HE TYR 57 10.456 7.645 2.655
291 HE2 TYR 57 1HE TYR 57 8.225 11.138 3.666
292 HH TYR 57 HH TYR 57 9.379 9.683 5.175
293 H ILE 58 H ILE 58 4.509 6.846 -1.488
294 HA ILE 58 HA ILE 58 3.961 8.501 -3.852
295 HB ILE 58 HB ILE 58 3.524 5.521 -3.460
296 HG12 ILE 58 2HG1 ILE 58 5.898 6.098 -3.746
297 HG13 ILE 58 1HG1 ILE 58 5.287 5.230 -5.147
298 HG21 ILE 58 1HG2 ILE 58 2.902 5.450 -5.825
299 HG22 ILE 58 2HG2 ILE 58 3.044 7.205 -5.920
300 HG23 ILE 58 3HG2 ILE 58 1.802 6.476 -4.903
301 HD11 ILE 58 3HD1 ILE 58 6.741 7.072 -5.803
302 HD12 ILE 58 1HD1 ILE 58 5.698 8.205 -4.955
303 HD13 ILE 58 2HD1 ILE 58 5.093 7.338 -6.367
304 H THR 59 H THR 59 2.089 9.492 -3.871
305 HA THR 59 HA THR 59 -0.012 8.823 -2.044
306 HB THR 59 HB THR 59 0.076 10.822 -4.331
307 HG1 THR 59 1HG THR 59 1.542 11.512 -2.848
308 HG21 THR 59 3HG2 THR 59 -2.218 10.274 -3.729
309 HG22 THR 59 1HG2 THR 59 -1.841 11.892 -3.146
310 HG23 THR 59 2HG2 THR 59 -1.871 10.527 -2.023
311 H TYR 60 H TYR 60 -1.600 7.466 -2.498
312 HA TYR 60 HA TYR 60 -1.910 6.503 -5.247
313 HB2 TYR 60 2HB TYR 60 -2.525 5.206 -2.601
314 HB3 TYR 60 1HB TYR 60 -3.052 4.524 -4.142
315 HD1 TYR 60 1HD TYR 60 -0.199 5.184 -1.941
316 HD2 TYR 60 2HD TYR 60 -1.428 3.506 -5.647
317 HE1 TYR 60 1HE TYR 60 1.967 4.046 -2.141
318 HE2 TYR 60 2HE TYR 60 0.739 2.364 -5.854
319 HH TYR 60 HH TYR 60 3.030 2.583 -5.010
320 H GLY 61 H GLY 61 -4.062 6.072 -5.997
321 HA2 GLY 61 2HA GLY 61 -5.773 8.256 -5.406
322 HA3 GLY 61 1HA GLY 61 -6.114 6.953 -6.548
323 H ASN 62 H ASN 62 -5.611 5.066 -4.187
324 HA ASN 62 HA ASN 62 -7.390 5.615 -2.168
325 HB2 ASN 62 2HB ASN 62 -9.219 3.972 -2.609
326 HB3 ASN 62 1HB ASN 62 -9.237 5.315 -3.732
327 HD21 ASN 62 1HD2 ASN 62 -10.405 4.217 -5.207
328 HD22 ASN 62 2HD2 ASN 62 -9.797 2.931 -6.182
329 H GLU 63 H GLU 63 -7.981 3.489 -1.016
330 HA GLU 63 HA GLU 63 -5.477 2.426 -0.380
331 HB2 GLU 63 2HB GLU 63 -6.991 0.861 1.091
332 HB3 GLU 63 1HB GLU 63 -6.706 2.541 1.523
333 HG2 GLU 63 2HG GLU 63 -9.015 1.996 1.864
334 HG3 GLU 63 1HG GLU 63 -8.919 3.073 0.484
335 H CYS 64 H CYS 64 -8.112 1.142 -2.251
336 HA CYS 64 HA CYS 64 -7.260 -1.443 -2.618
337 HB2 CYS 64 2HB CYS 64 -9.363 -0.673 -3.504
338 HB3 CYS 64 1HB CYS 64 -8.543 0.445 -4.588
339 H HIS 65 H HIS 65 -6.336 1.437 -4.492
340 HA HIS 65 HA HIS 65 -4.538 0.034 -6.158
341 HB2 HIS 65 2HB HIS 65 -4.789 2.974 -5.586
342 HB3 HIS 65 1HB HIS 65 -3.541 2.349 -6.653
343 HD1 HIS 65 1HD HIS 65 -4.592 0.781 -8.694
344 HD2 HIS 65 2HD HIS 65 -7.054 3.583 -6.870
345 HE1 HIS 65 1HE HIS 65 -6.576 1.046 -10.215
346 HE2 HIS 65 2HE HIS 65 -8.004 2.792 -9.151
347 H LEU 66 H LEU 66 -4.099 1.682 -3.130
348 HA LEU 66 HA LEU 66 -1.309 1.465 -2.963
349 HB2 LEU 66 2HB LEU 66 -2.520 2.850 -1.407
350 HB3 LEU 66 1HB LEU 66 -3.464 1.485 -0.865
351 HG LEU 66 HG LEU 66 -1.529 0.535 0.268
352 HD11 LEU 66 1HD1 LEU 66 0.250 1.298 -1.205
353 HD12 LEU 66 2HD1 LEU 66 0.567 1.769 0.464
354 HD13 LEU 66 3HD1 LEU 66 -0.029 2.961 -0.691
355 HD21 LEU 66 3HD2 LEU 66 -2.969 2.144 1.414
356 HD22 LEU 66 1HD2 LEU 66 -1.888 3.445 0.929
357 HD23 LEU 66 2HD2 LEU 66 -1.316 2.172 2.019
358 H CYS 67 H CYS 67 -3.898 -0.720 -1.947
359 HA CYS 67 HA CYS 67 -2.274 -2.765 -0.959
360 HB2 CYS 67 2HB CYS 67 -4.631 -2.709 -0.444
361 HB3 CYS 67 1HB CYS 67 -5.053 -2.869 -2.143
362 H THR 68 H THR 68 -3.489 -2.200 -4.271
363 HA THR 68 HA THR 68 -2.630 -4.567 -5.459
364 HB THR 68 HB THR 68 -2.516 -1.843 -6.768
365 HG1 THR 68 1HG THR 68 -4.680 -3.359 -5.852
366 HG21 THR 68 3HG2 THR 68 -3.193 -3.102 -8.776
367 HG22 THR 68 1HG2 THR 68 -3.195 -4.594 -7.837
368 HG23 THR 68 2HG2 THR 68 -1.683 -3.728 -8.113
369 H GLU 69 H GLU 69 -0.854 -1.454 -5.219
370 HA GLU 69 HA GLU 69 1.533 -2.557 -6.247
371 HB2 GLU 69 2HB GLU 69 0.743 0.034 -5.118
372 HB3 GLU 69 1HB GLU 69 2.419 -0.400 -4.820
373 HG2 GLU 69 2HG GLU 69 2.186 0.953 -6.829
374 HG3 GLU 69 1HG GLU 69 2.819 -0.643 -7.187
375 H SER 70 H SER 70 0.266 -2.265 -3.008
376 HA SER 70 HA SER 70 2.555 -2.814 -1.521
377 HB2 SER 70 2HB SER 70 0.296 -2.098 -0.618
378 HB3 SER 70 1HB SER 70 -0.249 -3.757 -0.854
379 HG SER 70 HG SER 70 1.799 -2.784 0.797
380 H LEU 71 H LEU 71 0.224 -5.018 -3.007
381 HA LEU 71 HA LEU 71 1.499 -7.375 -2.047
382 HB2 LEU 71 2HB LEU 71 -0.447 -7.013 -4.321
383 HB3 LEU 71 1HB LEU 71 0.007 -8.551 -3.616
384 HG LEU 71 HG LEU 71 -1.478 -6.333 -2.210
385 HD11 LEU 71 1HD1 LEU 71 -3.368 -7.808 -2.220
386 HD12 LEU 71 2HD1 LEU 71 -2.431 -9.063 -3.006
387 HD13 LEU 71 3HD1 LEU 71 -2.807 -7.569 -3.881
388 HD21 LEU 71 3HD2 LEU 71 -1.721 -7.949 -0.384
389 HD22 LEU 71 1HD2 LEU 71 -0.036 -7.512 -0.660
390 HD23 LEU 71 2HD2 LEU 71 -0.654 -9.059 -1.239
391 H LYS 72 H LYS 72 1.644 -5.555 -5.023
392 HA LYS 72 HA LYS 72 3.260 -7.353 -6.460
393 HB2 LYS 72 2HB LYS 72 2.818 -4.393 -6.729
394 HB3 LYS 72 1HB LYS 72 3.805 -5.325 -7.851
395 HG2 LYS 72 2HG LYS 72 1.954 -6.589 -8.599
396 HG3 LYS 72 1HG LYS 72 0.949 -6.044 -7.258
397 HD2 LYS 72 2HD LYS 72 0.354 -4.940 -9.366
398 HD3 LYS 72 1HD LYS 72 0.917 -3.791 -8.158
399 HE2 LYS 72 2HE LYS 72 3.148 -3.827 -9.248
400 HE3 LYS 72 1HE LYS 72 2.482 -4.876 -10.499
401 HZ1 LYS 72 3HZ LYS 72 2.513 -2.512 -11.109
402 HZ2 LYS 72 1HZ LYS 72 1.473 -2.190 -9.817
403 HZ3 LYS 72 2HZ LYS 72 0.947 -3.147 -11.115
404 H SER 73 H SER 73 4.115 -4.622 -4.354
405 HA SER 73 HA SER 73 6.940 -5.089 -4.756
406 HB2 SER 73 2HB SER 73 5.555 -3.247 -2.803
407 HB3 SER 73 1HB SER 73 7.245 -3.192 -3.275
408 HG SER 73 HG SER 73 6.095 -3.082 -5.528
409 H ASN 74 H ASN 74 4.632 -6.605 -3.061
410 HA ASN 74 HA ASN 74 4.473 -8.070 -1.392
411 HB2 ASN 74 2HB ASN 74 6.414 -9.061 -2.702
412 HB3 ASN 74 1HB ASN 74 7.482 -8.331 -1.515
413 HD21 ASN 74 1HD2 ASN 74 7.116 -11.088 -2.201
414 HD22 ASN 74 2HD2 ASN 74 6.673 -11.932 -0.770
415 H GLY 75 H GLY 75 3.926 -6.045 -0.220
416 HA2 GLY 75 2HA GLY 75 3.728 -5.145 1.896
417 HA3 GLY 75 1HA GLY 75 4.876 -6.350 2.442
418 H ARG 76 H ARG 76 6.091 -4.487 -0.071
419 HA ARG 76 HA ARG 76 7.973 -3.240 1.715
420 HB2 ARG 76 2HB ARG 76 8.305 -4.166 -0.736
421 HB3 ARG 76 1HB ARG 76 7.788 -2.548 -1.176
422 HG2 ARG 76 2HG ARG 76 9.618 -1.542 -0.051
423 HG3 ARG 76 1HG ARG 76 10.081 -3.078 0.686
424 HD2 ARG 76 2HD ARG 76 10.217 -2.324 -2.226
425 HD3 ARG 76 1HD ARG 76 11.565 -2.700 -1.149
426 HE ARG 76 HE ARG 76 9.685 -4.559 -2.365
427 HH11 ARG 76 1HH1 ARG 76 12.465 -4.168 -0.182
428 HH12 ARG 76 2HH1 ARG 76 12.913 -5.802 -0.238
429 HH21 ARG 76 1HH2 ARG 76 10.273 -6.793 -2.401
430 HH22 ARG 76 2HH2 ARG 76 11.655 -7.339 -1.576
431 H VAL 77 H VAL 77 5.574 -2.074 -0.620
432 HA VAL 77 HA VAL 77 5.582 0.424 0.830
433 HB VAL 77 HB VAL 77 5.749 0.724 -1.598
434 HG11 VAL 77 1HG1 VAL 77 4.726 -1.329 -2.374
435 HG12 VAL 77 2HG1 VAL 77 3.989 0.073 -3.148
436 HG13 VAL 77 3HG1 VAL 77 3.141 -0.757 -1.843
437 HG21 VAL 77 3HG2 VAL 77 4.529 2.439 -0.414
438 HG22 VAL 77 1HG2 VAL 77 3.029 1.521 -0.579
439 HG23 VAL 77 2HG2 VAL 77 3.814 2.186 -2.009
440 H GLN 78 H GLN 78 4.218 0.681 2.392
441 HA GLN 78 HA GLN 78 1.678 -0.752 2.321
442 HB2 GLN 78 2HB GLN 78 3.515 -0.267 4.671
443 HB3 GLN 78 1HB GLN 78 1.867 -0.861 4.812
444 HG2 GLN 78 2HG GLN 78 2.486 -2.852 3.534
445 HG3 GLN 78 1HG GLN 78 4.135 -2.248 3.409
446 HE21 GLN 78 1HE2 GLN 78 4.962 -4.014 4.494
447 HE22 GLN 78 2HE2 GLN 78 4.745 -4.245 6.192
448 H PHE 79 H PHE 79 0.382 0.340 4.243
449 HA PHE 79 HA PHE 79 -0.140 3.017 3.432
450 HB2 PHE 79 2HB PHE 79 -1.840 1.460 4.304
451 HB3 PHE 79 1HB PHE 79 -1.039 1.474 5.869
452 HD1 PHE 79 1HD PHE 79 -1.196 3.466 7.286
453 HD2 PHE 79 2HD PHE 79 -3.255 3.197 3.580
454 HE1 PHE 79 1HE PHE 79 -2.652 5.295 7.969
455 HE2 PHE 79 2HE PHE 79 -4.726 5.041 4.261
456 HZ PHE 79 HZ PHE 79 -4.425 6.089 6.464
457 H LEU 80 H LEU 80 1.178 4.642 3.916
458 HA LEU 80 HA LEU 80 2.846 4.550 6.290
459 HB2 LEU 80 2HB LEU 80 3.716 5.301 4.084
460 HB3 LEU 80 1HB LEU 80 2.596 6.633 4.111
461 HG LEU 80 HG LEU 80 3.757 7.479 6.161
462 HD11 LEU 80 1HD1 LEU 80 5.739 5.322 5.477
463 HD12 LEU 80 2HD1 LEU 80 4.749 5.419 6.939
464 HD13 LEU 80 3HD1 LEU 80 5.995 6.626 6.631
465 HD21 LEU 80 3HD2 LEU 80 5.687 8.353 4.928
466 HD22 LEU 80 1HD2 LEU 80 4.204 8.397 3.974
467 HD23 LEU 80 2HD2 LEU 80 5.411 7.149 3.665
468 H HIS 81 H HIS 81 0.491 6.749 4.764
469 HA HIS 81 HA HIS 81 -0.843 7.147 7.210
470 HB2 HIS 81 2HB HIS 81 -0.598 9.594 7.380
471 HB3 HIS 81 1HB HIS 81 0.934 8.784 7.617
472 HD1 HIS 81 1HD HIS 81 -0.887 11.071 5.197
473 HD2 HIS 81 2HD HIS 81 2.919 9.465 5.762
474 HE1 HIS 81 1HE HIS 81 0.633 12.313 3.641
475 HE2 HIS 81 2HE HIS 81 2.927 11.491 4.177
476 H ASP 82 H ASP 82 -2.775 8.474 6.902
477 HA ASP 82 HA ASP 82 -3.907 8.061 4.292
478 HB2 ASP 82 2HB ASP 82 -5.968 8.957 5.225
479 HB3 ASP 82 1HB ASP 82 -5.280 7.860 6.408
480 H GLY 83 H GLY 83 -4.806 9.813 3.025
481 HA2 GLY 83 2HA GLY 83 -4.875 11.978 2.263
482 HA3 GLY 83 1HA GLY 83 -3.795 12.467 3.570
483 H SER 84 H SER 84 -3.359 13.347 1.006
484 HA SER 84 HA SER 84 -1.559 11.790 -0.454
485 HB2 SER 84 2HB SER 84 -1.862 14.789 -0.266
486 HB3 SER 84 1HB SER 84 -1.100 13.903 -1.596
487 HG SER 84 HG SER 84 -3.068 14.103 -2.332
488 H CYS 85 H CYS 85 0.751 12.007 -0.570
489 HA CYS 85 HA CYS 85 2.000 12.079 1.939
490 HB2 CYS 85 2HB CYS 85 3.321 12.252 -0.783
491 HB3 CYS 85 1HB CYS 85 4.070 11.775 0.739
Start of MODEL 5
1 H1 SER 20 1HT SER 20 11.420 8.250 13.997
2 H2 SER 20 2HT SER 20 12.517 9.202 14.873
3 H3 SER 20 3HT SER 20 10.856 9.502 15.018
4 HA SER 20 HA SER 20 10.538 7.399 16.037
5 HB2 SER 20 2HB SER 20 13.557 7.205 15.972
6 HB3 SER 20 1HB SER 20 12.408 5.969 16.500
7 HG SER 20 HG SER 20 12.581 5.305 14.500
8 H GLU 21 H GLU 21 9.809 8.881 17.502
9 HA GLU 21 HA GLU 21 11.769 10.446 18.967
10 HB2 GLU 21 2HB GLU 21 8.748 10.717 19.006
11 HB3 GLU 21 1HB GLU 21 9.912 11.841 19.681
12 HG2 GLU 21 2HG GLU 21 9.153 12.857 17.702
13 HG3 GLU 21 1HG GLU 21 10.721 12.182 17.273
14 H ALA 22 H ALA 22 8.647 9.150 19.917
15 HA ALA 22 HA ALA 22 9.853 7.558 22.025
16 HB1 ALA 22 1HB ALA 22 7.625 9.581 22.411
17 HB2 ALA 22 2HB ALA 22 9.250 9.699 23.084
18 HB3 ALA 22 3HB ALA 22 8.161 8.419 23.627
19 H ALA 23 H ALA 23 7.643 6.482 23.079
20 HA ALA 23 HA ALA 23 6.048 4.917 22.774
21 HB1 ALA 23 1HB ALA 23 4.201 5.478 21.247
22 HB2 ALA 23 2HB ALA 23 5.213 6.687 20.457
23 HB3 ALA 23 3HB ALA 23 4.723 6.911 22.133
24 H SER 24 H SER 24 4.875 4.050 20.221
25 HA SER 24 HA SER 24 7.222 2.874 18.954
26 HB2 SER 24 2HB SER 24 4.597 1.497 19.580
27 HB3 SER 24 1HB SER 24 5.996 0.769 18.796
28 HG SER 24 HG SER 24 6.999 0.629 20.598
29 H LEU 25 H LEU 25 7.256 3.750 16.949
30 HA LEU 25 HA LEU 25 4.802 4.526 15.667
31 HB2 LEU 25 2HB LEU 25 7.669 4.684 14.738
32 HB3 LEU 25 1HB LEU 25 6.332 5.057 13.677
33 HG LEU 25 HG LEU 25 5.683 6.898 15.255
34 HD11 LEU 25 1HD1 LEU 25 6.759 6.113 17.283
35 HD12 LEU 25 2HD1 LEU 25 7.325 7.725 16.837
36 HD13 LEU 25 3HD1 LEU 25 8.339 6.316 16.521
37 HD21 LEU 25 3HD2 LEU 25 6.913 7.356 13.230
38 HD22 LEU 25 1HD2 LEU 25 8.435 7.026 14.061
39 HD23 LEU 25 2HD2 LEU 25 7.455 8.418 14.529
40 H SER 26 H SER 26 3.796 2.620 15.590
41 HA SER 26 HA SER 26 4.783 0.353 14.190
42 HB2 SER 26 2HB SER 26 1.977 1.077 15.018
43 HB3 SER 26 1HB SER 26 2.607 -0.542 14.694
44 HG SER 26 HG SER 26 4.201 0.114 16.416
45 HA PRO 27 HA PRO 27 3.446 1.883 10.222
46 HB2 PRO 27 2HB PRO 27 3.564 -0.429 8.791
47 HB3 PRO 27 1HB PRO 27 5.004 0.494 9.227
48 HG2 PRO 27 2HG PRO 27 3.893 -1.980 10.462
49 HG3 PRO 27 1HG PRO 27 5.582 -1.511 10.216
50 HD2 PRO 27 2HD PRO 27 4.258 -1.302 12.616
51 HD3 PRO 27 1HD PRO 27 5.659 -0.315 12.157
52 H LYS 28 H LYS 28 1.376 2.385 10.788
53 HA LYS 28 HA LYS 28 -0.781 0.624 11.085
54 HB2 LYS 28 2HB LYS 28 -0.944 2.971 11.718
55 HB3 LYS 28 1HB LYS 28 -0.700 3.469 10.050
56 HG2 LYS 28 2HG LYS 28 -2.839 2.367 9.456
57 HG3 LYS 28 1HG LYS 28 -3.081 1.982 11.158
58 HD2 LYS 28 2HD LYS 28 -3.064 4.362 11.709
59 HD3 LYS 28 1HD LYS 28 -2.779 4.760 10.015
60 HE2 LYS 28 2HE LYS 28 -5.129 5.057 10.566
61 HE3 LYS 28 1HE LYS 28 -4.921 3.744 9.418
62 HZ1 LYS 28 3HZ LYS 28 -5.211 2.150 11.192
63 HZ2 LYS 28 1HZ LYS 28 -6.503 3.216 11.204
64 HZ3 LYS 28 2HZ LYS 28 -5.294 3.366 12.349
65 H LYS 29 H LYS 29 -1.237 -0.851 9.609
66 HA LYS 29 HA LYS 29 -0.846 -0.150 6.821
67 HB2 LYS 29 2HB LYS 29 -1.102 -2.547 6.351
68 HB3 LYS 29 1HB LYS 29 0.188 -2.235 7.503
69 HG2 LYS 29 2HG LYS 29 -1.157 -2.995 9.327
70 HG3 LYS 29 1HG LYS 29 -2.583 -3.102 8.296
71 HD2 LYS 29 2HD LYS 29 -1.662 -5.320 8.667
72 HD3 LYS 29 1HD LYS 29 -1.486 -4.852 6.980
73 HE2 LYS 29 2HE LYS 29 0.846 -4.293 7.348
74 HE3 LYS 29 1HE LYS 29 0.687 -4.681 9.064
75 HZ1 LYS 29 3HZ LYS 29 0.263 -6.612 6.851
76 HZ2 LYS 29 1HZ LYS 29 0.247 -6.957 8.495
77 HZ3 LYS 29 2HZ LYS 29 1.677 -6.503 7.753
78 H VAL 30 H VAL 30 -2.456 -0.196 5.380
79 HA VAL 30 HA VAL 30 -5.124 -0.068 6.437
80 HB VAL 30 HB VAL 30 -4.206 1.441 4.584
81 HG11 VAL 30 1HG1 VAL 30 -4.504 -1.017 2.892
82 HG12 VAL 30 2HG1 VAL 30 -3.017 -0.135 3.247
83 HG13 VAL 30 3HG1 VAL 30 -4.284 0.618 2.272
84 HG21 VAL 30 3HG2 VAL 30 -6.591 1.291 5.056
85 HG22 VAL 30 1HG2 VAL 30 -6.738 -0.058 3.934
86 HG23 VAL 30 2HG2 VAL 30 -6.292 1.553 3.343
87 H ASP 31 H ASP 31 -6.824 -1.540 5.423
88 HA ASP 31 HA ASP 31 -5.791 -4.189 5.593
89 HB2 ASP 31 2HB ASP 31 -7.999 -3.621 6.539
90 HB3 ASP 31 1HB ASP 31 -8.597 -3.345 4.903
91 H CYS 32 H CYS 32 -4.923 -5.191 4.088
92 HA CYS 32 HA CYS 32 -5.662 -4.719 1.291
93 HB2 CYS 32 2HB CYS 32 -3.302 -4.260 2.024
94 HB3 CYS 32 1HB CYS 32 -3.161 -5.928 2.532
95 H SER 33 H SER 33 -6.311 -6.631 3.856
96 HA SER 33 HA SER 33 -5.900 -9.275 3.040
97 HB2 SER 33 2HB SER 33 -8.110 -8.384 4.854
98 HB3 SER 33 1HB SER 33 -7.091 -9.821 4.967
99 HG SER 33 HG SER 33 -6.737 -7.332 5.923
100 H ILE 34 H ILE 34 -8.677 -7.062 2.787
101 HA ILE 34 HA ILE 34 -10.405 -8.979 1.648
102 HB ILE 34 HB ILE 34 -11.833 -7.085 0.936
103 HG12 ILE 34 2HG1 ILE 34 -9.662 -5.334 2.130
104 HG13 ILE 34 1HG1 ILE 34 -9.982 -5.495 0.411
105 HG21 ILE 34 1HG2 ILE 34 -10.812 -6.925 3.767
106 HG22 ILE 34 2HG2 ILE 34 -12.067 -8.010 3.169
107 HG23 ILE 34 3HG2 ILE 34 -12.345 -6.268 3.198
108 HD11 ILE 34 3HD1 ILE 34 -12.216 -4.539 0.756
109 HD12 ILE 34 1HD1 ILE 34 -10.936 -3.449 1.294
110 HD13 ILE 34 2HD1 ILE 34 -11.866 -4.372 2.474
111 H TYR 35 H TYR 35 -7.846 -7.168 0.242
112 HA TYR 35 HA TYR 35 -8.962 -7.557 -2.399
113 HB2 TYR 35 2HB TYR 35 -6.431 -6.129 -1.587
114 HB3 TYR 35 1HB TYR 35 -7.063 -6.220 -3.225
115 HD1 TYR 35 2HD TYR 35 -9.540 -5.332 -3.498
116 HD2 TYR 35 1HD TYR 35 -6.962 -4.288 -0.286
117 HE1 TYR 35 2HE TYR 35 -10.874 -3.309 -3.088
118 HE2 TYR 35 1HE TYR 35 -8.289 -2.261 0.136
119 HH TYR 35 HH TYR 35 -11.336 -1.770 -1.346
120 H LYS 36 H LYS 36 -7.035 -9.221 -0.267
121 HA LYS 36 HA LYS 36 -5.149 -10.535 -1.931
122 HB2 LYS 36 2HB LYS 36 -6.611 -11.681 0.448
123 HB3 LYS 36 1HB LYS 36 -5.151 -12.329 -0.255
124 HG2 LYS 36 2HG LYS 36 -5.383 -9.650 1.079
125 HG3 LYS 36 1HG LYS 36 -4.826 -11.122 1.875
126 HD2 LYS 36 2HD LYS 36 -2.995 -11.223 0.175
127 HD3 LYS 36 1HD LYS 36 -3.530 -9.638 -0.399
128 HE2 LYS 36 2HE LYS 36 -1.678 -9.392 1.180
129 HE3 LYS 36 1HE LYS 36 -3.158 -8.702 1.841
130 HZ1 LYS 36 3HZ LYS 36 -1.981 -9.984 3.497
131 HZ2 LYS 36 1HZ LYS 36 -1.986 -11.344 2.516
132 HZ3 LYS 36 2HZ LYS 36 -3.428 -10.768 3.145
133 H LYS 37 H LYS 37 -8.507 -10.688 -1.823
134 HA LYS 37 HA LYS 37 -8.878 -13.410 -2.711
135 HB2 LYS 37 2HB LYS 37 -10.801 -11.108 -2.420
136 HB3 LYS 37 1HB LYS 37 -11.271 -12.740 -2.877
137 HG2 LYS 37 2HG LYS 37 -10.445 -13.575 -0.730
138 HG3 LYS 37 1HG LYS 37 -9.966 -11.938 -0.285
139 HD2 LYS 37 2HD LYS 37 -12.798 -12.761 -0.928
140 HD3 LYS 37 1HD LYS 37 -12.149 -12.688 0.704
141 HE2 LYS 37 2HE LYS 37 -11.654 -10.269 0.334
142 HE3 LYS 37 1HE LYS 37 -12.429 -10.380 -1.239
143 HZ1 LYS 37 3HZ LYS 37 -14.504 -10.930 -0.164
144 HZ2 LYS 37 1HZ LYS 37 -13.914 -9.497 0.486
145 HZ3 LYS 37 2HZ LYS 37 -13.765 -10.929 1.352
146 H TYR 38 H TYR 38 -7.802 -10.710 -4.290
147 HA TYR 38 HA TYR 38 -8.987 -11.563 -6.846
148 HB2 TYR 38 2HB TYR 38 -8.060 -8.782 -6.087
149 HB3 TYR 38 1HB TYR 38 -8.841 -9.250 -7.592
150 HD1 TYR 38 2HD TYR 38 -11.278 -10.204 -7.329
151 HD2 TYR 38 1HD TYR 38 -9.284 -7.885 -4.385
152 HE1 TYR 38 2HE TYR 38 -13.450 -9.604 -6.329
153 HE2 TYR 38 1HE TYR 38 -11.437 -7.278 -3.382
154 HH TYR 38 HH TYR 38 -14.307 -8.882 -4.130
155 HA PRO 39 HA PRO 39 -4.664 -12.090 -8.007
156 HB2 PRO 39 2HB PRO 39 -4.791 -11.441 -10.676
157 HB3 PRO 39 1HB PRO 39 -5.292 -13.009 -10.039
158 HG2 PRO 39 2HG PRO 39 -6.957 -10.638 -10.757
159 HG3 PRO 39 1HG PRO 39 -7.279 -12.356 -11.060
160 HD2 PRO 39 2HD PRO 39 -8.473 -10.994 -9.055
161 HD3 PRO 39 1HD PRO 39 -8.041 -12.708 -8.899
162 H VAL 40 H VAL 40 -2.861 -10.753 -8.285
163 HA VAL 40 HA VAL 40 -3.118 -8.148 -7.353
164 HB VAL 40 HB VAL 40 -0.741 -9.343 -8.807
165 HG11 VAL 40 1HG1 VAL 40 -0.863 -6.959 -6.955
166 HG12 VAL 40 2HG1 VAL 40 -0.560 -6.911 -8.691
167 HG13 VAL 40 3HG1 VAL 40 0.609 -7.672 -7.610
168 HG21 VAL 40 3HG2 VAL 40 -1.403 -10.666 -6.867
169 HG22 VAL 40 1HG2 VAL 40 -1.380 -9.220 -5.861
170 HG23 VAL 40 2HG2 VAL 40 0.119 -9.828 -6.558
171 H VAL 41 H VAL 41 -2.793 -9.239 -10.680
172 HA VAL 41 HA VAL 41 -2.518 -6.571 -11.686
173 HB VAL 41 HB VAL 41 -1.548 -8.496 -12.881
174 HG11 VAL 41 1HG1 VAL 41 -3.222 -10.167 -12.510
175 HG12 VAL 41 2HG1 VAL 41 -2.941 -9.970 -14.241
176 HG13 VAL 41 3HG1 VAL 41 -4.378 -9.271 -13.497
177 HG21 VAL 41 3HG2 VAL 41 -3.574 -6.954 -14.497
178 HG22 VAL 41 1HG2 VAL 41 -2.230 -7.873 -15.173
179 HG23 VAL 41 2HG2 VAL 41 -1.915 -6.474 -14.147
180 H ALA 42 H ALA 42 -5.284 -8.603 -10.959
181 HA ALA 42 HA ALA 42 -6.914 -6.433 -12.017
182 HB1 ALA 42 1HB ALA 42 -7.134 -8.358 -13.531
183 HB2 ALA 42 2HB ALA 42 -8.653 -7.976 -12.727
184 HB3 ALA 42 3HB ALA 42 -7.694 -9.352 -12.189
185 H ILE 43 H ILE 43 -7.094 -5.496 -10.085
186 HA ILE 43 HA ILE 43 -8.733 -6.942 -8.115
187 HB ILE 43 HB ILE 43 -6.802 -4.645 -7.571
188 HG12 ILE 43 2HG1 ILE 43 -6.538 -7.581 -6.826
189 HG13 ILE 43 1HG1 ILE 43 -5.573 -6.728 -8.016
190 HG21 ILE 43 1HG2 ILE 43 -7.291 -5.073 -5.203
191 HG22 ILE 43 2HG2 ILE 43 -8.465 -6.301 -5.680
192 HG23 ILE 43 3HG2 ILE 43 -8.733 -4.608 -6.105
193 HD11 ILE 43 3HD1 ILE 43 -4.365 -7.050 -5.923
194 HD12 ILE 43 1HD1 ILE 43 -5.612 -6.151 -5.062
195 HD13 ILE 43 2HD1 ILE 43 -4.612 -5.336 -6.267
196 HA PRO 44 HA PRO 44 -11.420 -3.666 -9.688
197 HB2 PRO 44 2HB PRO 44 -13.270 -4.688 -7.622
198 HB3 PRO 44 1HB PRO 44 -13.539 -4.498 -9.357
199 HG2 PRO 44 2HG PRO 44 -13.229 -6.921 -8.253
200 HG3 PRO 44 1HG PRO 44 -12.597 -6.545 -9.863
201 HD2 PRO 44 2HD PRO 44 -11.146 -6.738 -7.256
202 HD3 PRO 44 1HD PRO 44 -10.643 -7.272 -8.874
203 H CYS 45 H CYS 45 -11.470 -1.676 -8.962
204 HA CYS 45 HA CYS 45 -11.197 -1.176 -6.094
205 HB2 CYS 45 2HB CYS 45 -9.821 0.243 -8.388
206 HB3 CYS 45 1HB CYS 45 -9.774 0.776 -6.715
207 HA PRO 46 HA PRO 46 -14.728 1.291 -6.841
208 HB2 PRO 46 2HB PRO 46 -14.524 3.079 -4.789
209 HB3 PRO 46 1HB PRO 46 -15.067 1.416 -4.569
210 HG2 PRO 46 2HG PRO 46 -12.377 2.612 -4.061
211 HG3 PRO 46 1HG PRO 46 -13.271 1.414 -3.110
212 HD2 PRO 46 2HD PRO 46 -11.245 0.754 -4.793
213 HD3 PRO 46 1HD PRO 46 -12.602 -0.333 -4.447
214 H ILE 47 H ILE 47 -15.334 3.479 -7.396
215 HA ILE 47 HA ILE 47 -13.145 4.899 -8.660
216 HB ILE 47 HB ILE 47 -14.891 6.356 -9.650
217 HG12 ILE 47 2HG1 ILE 47 -16.822 4.568 -8.148
218 HG13 ILE 47 1HG1 ILE 47 -16.543 6.272 -7.826
219 HG21 ILE 47 1HG2 ILE 47 -15.916 4.639 -11.087
220 HG22 ILE 47 2HG2 ILE 47 -15.381 3.398 -9.953
221 HG23 ILE 47 3HG2 ILE 47 -14.191 4.364 -10.827
222 HD11 ILE 47 3HD1 ILE 47 -17.708 5.112 -10.348
223 HD12 ILE 47 1HD1 ILE 47 -17.452 6.828 -10.028
224 HD13 ILE 47 2HD1 ILE 47 -18.607 5.911 -9.058
225 H THR 48 H THR 48 -14.440 4.831 -5.708
226 HA THR 48 HA THR 48 -14.560 7.446 -4.814
227 HB THR 48 HB THR 48 -13.546 5.032 -3.327
228 HG1 THR 48 1HG THR 48 -16.260 5.557 -3.311
229 HG21 THR 48 3HG2 THR 48 -13.553 7.215 -2.141
230 HG22 THR 48 1HG2 THR 48 -14.715 6.086 -1.442
231 HG23 THR 48 2HG2 THR 48 -15.270 7.382 -2.499
232 H TYR 49 H TYR 49 -12.950 8.864 -4.492
233 HA TYR 49 HA TYR 49 -10.205 7.929 -4.799
234 HB2 TYR 49 2HB TYR 49 -10.995 9.665 -6.392
235 HB3 TYR 49 1HB TYR 49 -11.348 10.717 -5.028
236 HD1 TYR 49 1HD TYR 49 -8.637 9.102 -6.950
237 HD2 TYR 49 2HD TYR 49 -9.615 11.984 -3.986
238 HE1 TYR 49 1HE TYR 49 -6.360 10.015 -7.092
239 HE2 TYR 49 2HE TYR 49 -7.343 12.894 -4.111
240 HH TYR 49 HH TYR 49 -5.195 12.378 -4.827
241 H LEU 50 H LEU 50 -9.341 7.526 -2.926
242 HA LEU 50 HA LEU 50 -9.754 9.408 -0.723
243 HB2 LEU 50 2HB LEU 50 -9.314 6.415 -0.512
244 HB3 LEU 50 1HB LEU 50 -9.471 7.519 0.832
245 HG LEU 50 HG LEU 50 -11.659 6.811 -1.130
246 HD11 LEU 50 1HD1 LEU 50 -11.302 6.061 1.759
247 HD12 LEU 50 2HD1 LEU 50 -11.074 4.994 0.377
248 HD13 LEU 50 3HD1 LEU 50 -12.677 5.645 0.727
249 HD21 LEU 50 3HD2 LEU 50 -13.137 8.030 0.417
250 HD22 LEU 50 1HD2 LEU 50 -11.927 9.081 -0.317
251 HD23 LEU 50 2HD2 LEU 50 -11.724 8.536 1.343
252 HA PRO 51 HA PRO 51 -5.384 9.554 -2.023
253 HB2 PRO 51 2HB PRO 51 -4.941 11.679 -0.198
254 HB3 PRO 51 1HB PRO 51 -5.072 11.829 -1.938
255 HG2 PRO 51 2HG PRO 51 -6.968 12.553 0.116
256 HG3 PRO 51 1HG PRO 51 -7.029 12.888 -1.613
257 HD2 PRO 51 2HD PRO 51 -8.654 11.068 -0.195
258 HD3 PRO 51 1HD PRO 51 -8.526 11.204 -1.951
259 H VAL 52 H VAL 52 -4.182 8.073 -1.145
260 HA VAL 52 HA VAL 52 -3.673 8.257 1.720
261 HB VAL 52 HB VAL 52 -3.399 5.820 1.867
262 HG11 VAL 52 1HG1 VAL 52 -5.758 5.138 1.756
263 HG12 VAL 52 2HG1 VAL 52 -6.118 6.596 0.834
264 HG13 VAL 52 3HG1 VAL 52 -5.551 6.724 2.499
265 HG21 VAL 52 3HG2 VAL 52 -2.822 5.291 -0.429
266 HG22 VAL 52 1HG2 VAL 52 -4.443 5.736 -0.966
267 HG23 VAL 52 2HG2 VAL 52 -4.211 4.330 0.070
268 H CYS 53 H CYS 53 -1.553 7.689 2.319
269 HA CYS 53 HA CYS 53 0.272 7.884 0.041
270 HB2 CYS 53 2HB CYS 53 0.275 9.882 1.441
271 HB3 CYS 53 1HB CYS 53 0.621 8.918 2.864
272 H GLY 54 H GLY 54 1.615 6.279 -0.256
273 HA2 GLY 54 2HA GLY 54 1.798 4.107 1.717
274 HA3 GLY 54 1HA GLY 54 2.357 4.092 0.059
275 H SER 55 H SER 55 3.921 3.217 2.151
276 HA SER 55 HA SER 55 5.679 5.202 3.071
277 HB2 SER 55 2HB SER 55 7.121 3.191 3.631
278 HB3 SER 55 1HB SER 55 5.489 3.180 4.299
279 HG SER 55 HG SER 55 6.692 1.504 2.573
280 H ASP 56 H ASP 56 5.285 4.100 -0.001
281 HA ASP 56 HA ASP 56 8.062 4.301 -0.865
282 HB2 ASP 56 2HB ASP 56 6.299 2.683 -1.840
283 HB3 ASP 56 1HB ASP 56 5.613 4.092 -2.631
284 H TYR 57 H TYR 57 5.734 6.356 0.054
285 HA TYR 57 HA TYR 57 5.460 8.563 0.063
286 HB2 TYR 57 2HB TYR 57 7.951 8.738 -1.665
287 HB3 TYR 57 1HB TYR 57 7.229 10.060 -0.744
288 HD1 TYR 57 2HD TYR 57 6.924 9.532 1.841
289 HD2 TYR 57 1HD TYR 57 9.728 7.590 -0.695
290 HE1 TYR 57 2HE TYR 57 8.227 8.859 3.808
291 HE2 TYR 57 1HE TYR 57 11.030 6.900 1.265
292 HH TYR 57 HH TYR 57 11.375 7.577 3.575
293 H ILE 58 H ILE 58 4.444 6.803 -1.983
294 HA ILE 58 HA ILE 58 3.813 8.680 -4.152
295 HB ILE 58 HB ILE 58 3.102 5.740 -3.873
296 HG12 ILE 58 2HG1 ILE 58 5.537 6.055 -4.125
297 HG13 ILE 58 1HG1 ILE 58 4.830 5.241 -5.513
298 HG21 ILE 58 1HG2 ILE 58 1.527 6.918 -5.275
299 HG22 ILE 58 2HG2 ILE 58 2.531 5.858 -6.269
300 HG23 ILE 58 3HG2 ILE 58 2.843 7.589 -6.240
301 HD11 ILE 58 3HD1 ILE 58 4.912 7.341 -6.768
302 HD12 ILE 58 1HD1 ILE 58 6.507 6.854 -6.189
303 HD13 ILE 58 2HD1 ILE 58 5.623 8.138 -5.364
304 H THR 59 H THR 59 1.856 9.638 -4.128
305 HA THR 59 HA THR 59 -0.058 8.880 -2.120
306 HB THR 59 HB THR 59 -0.147 11.046 -4.227
307 HG1 THR 59 1HG THR 59 1.262 10.744 -2.056
308 HG21 THR 59 3HG2 THR 59 -2.394 10.454 -3.442
309 HG22 THR 59 1HG2 THR 59 -1.922 12.018 -2.782
310 HG23 THR 59 2HG2 THR 59 -1.865 10.564 -1.768
311 H TYR 60 H TYR 60 -1.562 7.504 -2.475
312 HA TYR 60 HA TYR 60 -2.064 6.568 -5.191
313 HB2 TYR 60 2HB TYR 60 -2.695 5.296 -2.523
314 HB3 TYR 60 1HB TYR 60 -3.093 4.583 -4.086
315 HD1 TYR 60 1HD TYR 60 -0.396 5.426 -1.760
316 HD2 TYR 60 2HD TYR 60 -1.357 3.604 -5.473
317 HE1 TYR 60 1HE TYR 60 1.848 4.445 -1.849
318 HE2 TYR 60 2HE TYR 60 0.890 2.605 -5.565
319 HH TYR 60 HH TYR 60 3.097 3.050 -4.653
320 H GLY 61 H GLY 61 -4.175 6.219 -5.907
321 HA2 GLY 61 2HA GLY 61 -5.930 8.361 -5.289
322 HA3 GLY 61 1HA GLY 61 -6.237 7.052 -6.420
323 H ASN 62 H ASN 62 -5.628 5.182 -4.060
324 HA ASN 62 HA ASN 62 -7.383 5.593 -2.005
325 HB2 ASN 62 2HB ASN 62 -9.240 4.029 -2.456
326 HB3 ASN 62 1HB ASN 62 -9.237 5.362 -3.578
327 HD21 ASN 62 1HD2 ASN 62 -10.416 4.330 -5.096
328 HD22 ASN 62 2HD2 ASN 62 -9.846 3.032 -6.068
329 H GLU 63 H GLU 63 -7.955 3.402 -0.955
330 HA GLU 63 HA GLU 63 -5.466 2.324 -0.175
331 HB2 GLU 63 2HB GLU 63 -7.988 0.814 0.356
332 HB3 GLU 63 1HB GLU 63 -6.608 1.054 1.398
333 HG2 GLU 63 2HG GLU 63 -8.177 2.332 2.453
334 HG3 GLU 63 1HG GLU 63 -7.443 3.542 1.402
335 H CYS 64 H CYS 64 -7.922 1.254 -2.374
336 HA CYS 64 HA CYS 64 -7.172 -1.414 -2.661
337 HB2 CYS 64 2HB CYS 64 -9.303 -0.483 -3.487
338 HB3 CYS 64 1HB CYS 64 -8.426 0.414 -4.723
339 H HIS 65 H HIS 65 -6.155 1.479 -4.444
340 HA HIS 65 HA HIS 65 -4.387 0.102 -6.209
341 HB2 HIS 65 2HB HIS 65 -4.303 3.005 -5.361
342 HB3 HIS 65 1HB HIS 65 -3.310 2.311 -6.630
343 HD1 HIS 65 1HD HIS 65 -4.963 1.125 -8.631
344 HD2 HIS 65 2HD HIS 65 -6.490 4.207 -6.306
345 HE1 HIS 65 1HE HIS 65 -6.883 2.068 -9.923
346 HE2 HIS 65 2HE HIS 65 -7.937 3.723 -8.357
347 H LEU 66 H LEU 66 -3.982 1.516 -3.055
348 HA LEU 66 HA LEU 66 -1.186 1.284 -2.864
349 HB2 LEU 66 2HB LEU 66 -2.486 2.674 -1.321
350 HB3 LEU 66 1HB LEU 66 -3.335 1.268 -0.759
351 HG LEU 66 HG LEU 66 -1.349 0.410 0.347
352 HD11 LEU 66 1HD1 LEU 66 0.713 1.708 0.455
353 HD12 LEU 66 2HD1 LEU 66 0.048 2.861 -0.705
354 HD13 LEU 66 3HD1 LEU 66 0.358 1.198 -1.193
355 HD21 LEU 66 3HD2 LEU 66 -1.805 3.319 0.961
356 HD22 LEU 66 1HD2 LEU 66 -1.084 2.128 2.039
357 HD23 LEU 66 2HD2 LEU 66 -2.774 1.970 1.552
358 H CYS 67 H CYS 67 -3.806 -0.871 -1.869
359 HA CYS 67 HA CYS 67 -2.210 -2.940 -0.865
360 HB2 CYS 67 2HB CYS 67 -4.561 -2.883 -0.348
361 HB3 CYS 67 1HB CYS 67 -4.989 -2.978 -2.049
362 H THR 68 H THR 68 -3.417 -2.322 -4.149
363 HA THR 68 HA THR 68 -2.527 -4.645 -5.403
364 HB THR 68 HB THR 68 -2.585 -1.823 -6.504
365 HG1 THR 68 1HG THR 68 -4.557 -3.393 -5.680
366 HG21 THR 68 3HG2 THR 68 -2.822 -2.901 -8.698
367 HG22 THR 68 1HG2 THR 68 -2.660 -4.487 -7.945
368 HG23 THR 68 2HG2 THR 68 -1.304 -3.363 -7.931
369 H GLU 69 H GLU 69 -0.848 -1.525 -4.946
370 HA GLU 69 HA GLU 69 1.564 -2.199 -6.215
371 HB2 GLU 69 2HB GLU 69 0.651 0.092 -5.553
372 HB3 GLU 69 1HB GLU 69 1.205 -0.270 -3.931
373 HG2 GLU 69 2HG GLU 69 2.842 1.080 -4.933
374 HG3 GLU 69 1HG GLU 69 3.508 -0.550 -4.871
375 H SER 70 H SER 70 0.376 -2.526 -2.927
376 HA SER 70 HA SER 70 2.801 -3.180 -1.698
377 HB2 SER 70 2HB SER 70 0.673 -2.409 -0.552
378 HB3 SER 70 1HB SER 70 0.050 -4.041 -0.785
379 HG SER 70 HG SER 70 2.109 -3.088 0.808
380 H LEU 71 H LEU 71 0.160 -5.266 -2.911
381 HA LEU 71 HA LEU 71 1.447 -7.709 -2.291
382 HB2 LEU 71 2HB LEU 71 -0.614 -7.143 -4.432
383 HB3 LEU 71 1HB LEU 71 -0.153 -8.735 -3.863
384 HG LEU 71 HG LEU 71 -1.547 -6.606 -2.250
385 HD11 LEU 71 1HD1 LEU 71 -3.009 -7.675 -3.869
386 HD12 LEU 71 2HD1 LEU 71 -3.415 -8.172 -2.228
387 HD13 LEU 71 3HD1 LEU 71 -2.521 -9.266 -3.279
388 HD21 LEU 71 3HD2 LEU 71 -0.036 -7.859 -0.836
389 HD22 LEU 71 1HD2 LEU 71 -0.677 -9.383 -1.468
390 HD23 LEU 71 2HD2 LEU 71 -1.706 -8.308 -0.518
391 H LYS 72 H LYS 72 1.453 -5.688 -5.091
392 HA LYS 72 HA LYS 72 2.907 -7.210 -6.925
393 HB2 LYS 72 2HB LYS 72 1.698 -5.221 -7.478
394 HB3 LYS 72 1HB LYS 72 2.676 -4.268 -6.390
395 HG2 LYS 72 2HG LYS 72 4.608 -4.676 -7.909
396 HG3 LYS 72 1HG LYS 72 3.469 -5.432 -9.043
397 HD2 LYS 72 2HD LYS 72 2.147 -3.449 -9.137
398 HD3 LYS 72 1HD LYS 72 3.104 -2.692 -7.871
399 HE2 LYS 72 2HE LYS 72 5.061 -2.841 -9.445
400 HE3 LYS 72 1HE LYS 72 3.910 -3.309 -10.695
401 HZ1 LYS 72 3HZ LYS 72 3.724 -0.867 -9.059
402 HZ2 LYS 72 1HZ LYS 72 2.694 -1.273 -10.324
403 HZ3 LYS 72 2HZ LYS 72 4.310 -0.880 -10.660
404 H SER 73 H SER 73 3.938 -5.379 -4.112
405 HA SER 73 HA SER 73 6.733 -5.812 -4.844
406 HB2 SER 73 2HB SER 73 7.214 -3.945 -3.272
407 HB3 SER 73 1HB SER 73 6.203 -3.479 -4.636
408 HG SER 73 HG SER 73 4.475 -3.347 -3.389
409 H ASN 74 H ASN 74 4.643 -7.539 -3.339
410 HA ASN 74 HA ASN 74 4.625 -9.128 -1.725
411 HB2 ASN 74 2HB ASN 74 6.842 -9.675 -2.812
412 HB3 ASN 74 1HB ASN 74 7.640 -8.690 -1.601
413 HD21 ASN 74 1HD2 ASN 74 5.941 -11.687 -2.208
414 HD22 ASN 74 2HD2 ASN 74 6.390 -12.461 -0.748
415 H GLY 75 H GLY 75 4.362 -6.302 -0.958
416 HA2 GLY 75 2HA GLY 75 3.672 -5.444 1.113
417 HA3 GLY 75 1HA GLY 75 4.564 -6.726 1.917
418 H ARG 76 H ARG 76 5.989 -4.725 -0.533
419 HA ARG 76 HA ARG 76 8.034 -3.773 1.236
420 HB2 ARG 76 2HB ARG 76 8.428 -4.223 -1.179
421 HB3 ARG 76 1HB ARG 76 7.295 -2.939 -1.560
422 HG2 ARG 76 2HG ARG 76 8.782 -1.305 -0.521
423 HG3 ARG 76 1HG ARG 76 9.943 -2.594 -0.184
424 HD2 ARG 76 2HD ARG 76 10.203 -3.029 -2.544
425 HD3 ARG 76 1HD ARG 76 8.946 -1.858 -2.936
426 HE ARG 76 HE ARG 76 11.241 -0.895 -1.460
427 HH11 ARG 76 1HH1 ARG 76 9.712 -1.230 -4.648
428 HH12 ARG 76 2HH1 ARG 76 10.560 0.074 -5.334
429 HH21 ARG 76 1HH2 ARG 76 12.446 0.887 -2.464
430 HH22 ARG 76 2HH2 ARG 76 12.122 1.285 -4.080
431 H VAL 77 H VAL 77 5.512 -2.183 -0.684
432 HA VAL 77 HA VAL 77 5.707 0.204 0.961
433 HB VAL 77 HB VAL 77 5.451 0.476 -1.486
434 HG11 VAL 77 1HG1 VAL 77 3.336 -0.030 -2.605
435 HG12 VAL 77 2HG1 VAL 77 2.791 -0.863 -1.152
436 HG13 VAL 77 3HG1 VAL 77 4.183 -1.472 -2.048
437 HG21 VAL 77 3HG2 VAL 77 4.617 2.243 -0.051
438 HG22 VAL 77 1HG2 VAL 77 3.053 1.437 0.061
439 HG23 VAL 77 2HG2 VAL 77 3.600 2.090 -1.484
440 H GLN 78 H GLN 78 4.523 0.693 2.526
441 HA GLN 78 HA GLN 78 2.077 -0.832 3.053
442 HB2 GLN 78 2HB GLN 78 4.131 0.256 4.995
443 HB3 GLN 78 1HB GLN 78 2.558 -0.342 5.481
444 HG2 GLN 78 2HG GLN 78 4.658 -1.988 4.082
445 HG3 GLN 78 1HG GLN 78 4.394 -1.961 5.824
446 HE21 GLN 78 1HE2 GLN 78 3.140 -2.996 2.767
447 HE22 GLN 78 2HE2 GLN 78 1.962 -4.087 3.392
448 H PHE 79 H PHE 79 0.874 0.586 4.826
449 HA PHE 79 HA PHE 79 0.269 3.072 3.521
450 HB2 PHE 79 2HB PHE 79 -1.475 1.552 4.455
451 HB3 PHE 79 1HB PHE 79 -0.781 1.780 6.047
452 HD1 PHE 79 1HD PHE 79 -2.672 3.386 3.340
453 HD2 PHE 79 2HD PHE 79 -1.318 3.682 7.356
454 HE1 PHE 79 1HE PHE 79 -4.241 5.228 3.734
455 HE2 PHE 79 2HE PHE 79 -2.888 5.522 7.752
456 HZ PHE 79 HZ PHE 79 -4.348 6.296 5.940
457 H LEU 80 H LEU 80 1.157 4.963 4.089
458 HA LEU 80 HA LEU 80 2.959 4.985 6.388
459 HB2 LEU 80 2HB LEU 80 3.807 5.656 4.170
460 HB3 LEU 80 1HB LEU 80 2.638 6.951 4.118
461 HG LEU 80 HG LEU 80 3.753 7.927 6.140
462 HD11 LEU 80 1HD1 LEU 80 4.851 5.938 6.981
463 HD12 LEU 80 2HD1 LEU 80 6.033 7.204 6.650
464 HD13 LEU 80 3HD1 LEU 80 5.847 5.857 5.526
465 HD21 LEU 80 3HD2 LEU 80 5.416 7.590 3.650
466 HD22 LEU 80 1HD2 LEU 80 5.638 8.844 4.876
467 HD23 LEU 80 2HD2 LEU 80 4.150 8.792 3.933
468 H HIS 81 H HIS 81 0.451 6.982 4.871
469 HA HIS 81 HA HIS 81 -0.789 7.531 7.330
470 HB2 HIS 81 2HB HIS 81 -0.514 9.999 7.385
471 HB3 HIS 81 1HB HIS 81 1.018 9.174 7.626
472 HD1 HIS 81 1HD HIS 81 -0.842 11.286 5.056
473 HD2 HIS 81 2HD HIS 81 2.989 9.821 5.788
474 HE1 HIS 81 1HE HIS 81 0.656 12.391 3.386
475 HE2 HIS 81 2HE HIS 81 2.961 11.703 4.035
476 H ASP 82 H ASP 82 -2.739 8.825 7.019
477 HA ASP 82 HA ASP 82 -3.972 8.384 4.496
478 HB2 ASP 82 2HB ASP 82 -4.807 9.918 6.956
479 HB3 ASP 82 1HB ASP 82 -5.774 9.875 5.496
480 H GLY 83 H GLY 83 -4.678 9.991 3.061
481 HA2 GLY 83 2HA GLY 83 -4.826 12.118 2.215
482 HA3 GLY 83 1HA GLY 83 -3.757 12.696 3.491
483 H SER 84 H SER 84 -3.296 13.600 1.083
484 HA SER 84 HA SER 84 -1.559 12.162 -0.532
485 HB2 SER 84 2HB SER 84 -1.740 15.124 -0.025
486 HB3 SER 84 1HB SER 84 -1.144 14.333 -1.504
487 HG SER 84 HG SER 84 -3.117 14.123 -2.128
488 H CYS 85 H CYS 85 0.697 12.198 -0.604
489 HA CYS 85 HA CYS 85 2.024 11.941 1.830
490 HB2 CYS 85 2HB CYS 85 3.183 12.310 -0.931
491 HB3 CYS 85 1HB CYS 85 4.080 11.758 0.482
Start of MODEL 6
1 H1 SER 20 1HT SER 20 13.353 5.451 13.755
2 H2 SER 20 2HT SER 20 12.839 3.914 13.201
3 H3 SER 20 3HT SER 20 11.807 4.928 14.128
4 HA SER 20 HA SER 20 11.636 6.514 12.461
5 HB2 SER 20 2HB SER 20 13.680 4.882 10.958
6 HB3 SER 20 1HB SER 20 13.073 6.488 10.546
7 HG SER 20 HG SER 20 14.867 6.963 11.587
8 H GLU 21 H GLU 21 10.335 3.869 13.196
9 HA GLU 21 HA GLU 21 9.077 3.305 10.708
10 HB2 GLU 21 2HB GLU 21 9.794 0.998 10.522
11 HB3 GLU 21 1HB GLU 21 11.183 2.063 10.448
12 HG2 GLU 21 2HG GLU 21 10.338 0.345 12.799
13 HG3 GLU 21 1HG GLU 21 11.717 0.074 11.745
14 H ALA 22 H ALA 22 7.375 1.793 10.964
15 HA ALA 22 HA ALA 22 6.675 1.179 13.740
16 HB1 ALA 22 1HB ALA 22 4.848 1.481 11.335
17 HB2 ALA 22 2HB ALA 22 4.987 2.628 12.663
18 HB3 ALA 22 3HB ALA 22 4.325 1.020 12.953
19 H ALA 23 H ALA 23 8.064 -0.585 13.613
20 HA ALA 23 HA ALA 23 7.035 -2.804 11.975
21 HB1 ALA 23 1HB ALA 23 9.295 -3.515 11.440
22 HB2 ALA 23 2HB ALA 23 9.944 -2.137 12.330
23 HB3 ALA 23 3HB ALA 23 9.001 -1.872 10.870
24 H SER 24 H SER 24 8.652 -1.771 14.906
25 HA SER 24 HA SER 24 8.850 -4.419 15.978
26 HB2 SER 24 2HB SER 24 10.424 -2.612 16.632
27 HB3 SER 24 1HB SER 24 9.082 -1.702 17.323
28 HG SER 24 HG SER 24 9.336 -4.290 18.214
29 H LEU 25 H LEU 25 6.485 -2.156 15.510
30 HA LEU 25 HA LEU 25 4.600 -3.640 17.170
31 HB2 LEU 25 2HB LEU 25 4.562 -0.685 16.505
32 HB3 LEU 25 1HB LEU 25 3.249 -1.548 17.265
33 HG LEU 25 HG LEU 25 5.964 -1.019 18.476
34 HD11 LEU 25 1HD1 LEU 25 4.693 0.437 19.991
35 HD12 LEU 25 2HD1 LEU 25 3.232 0.117 19.058
36 HD13 LEU 25 3HD1 LEU 25 4.584 0.972 18.316
37 HD21 LEU 25 3HD2 LEU 25 4.989 -1.938 20.523
38 HD22 LEU 25 1HD2 LEU 25 5.030 -3.145 19.240
39 HD23 LEU 25 2HD2 LEU 25 3.514 -2.338 19.646
40 H SER 26 H SER 26 2.655 -3.975 16.054
41 HA SER 26 HA SER 26 2.855 -4.218 13.272
42 HB2 SER 26 2HB SER 26 0.372 -4.187 15.014
43 HB3 SER 26 1HB SER 26 0.469 -4.825 13.369
44 HG SER 26 HG SER 26 1.647 -5.796 15.737
45 HA PRO 27 HA PRO 27 2.241 0.094 12.378
46 HB2 PRO 27 2HB PRO 27 2.141 -0.135 9.662
47 HB3 PRO 27 1HB PRO 27 3.649 -0.161 10.581
48 HG2 PRO 27 2HG PRO 27 2.082 -2.428 9.442
49 HG3 PRO 27 1HG PRO 27 3.836 -2.201 9.513
50 HD2 PRO 27 2HD PRO 27 2.444 -3.791 11.219
51 HD3 PRO 27 1HD PRO 27 3.967 -2.987 11.678
52 H LYS 28 H LYS 28 0.574 1.381 11.937
53 HA LYS 28 HA LYS 28 -2.027 0.216 11.642
54 HB2 LYS 28 2HB LYS 28 -1.071 3.090 11.749
55 HB3 LYS 28 1HB LYS 28 -2.737 2.702 11.372
56 HG2 LYS 28 2HG LYS 28 -2.520 3.293 13.706
57 HG3 LYS 28 1HG LYS 28 -2.972 1.601 13.557
58 HD2 LYS 28 2HD LYS 28 -0.609 0.979 13.917
59 HD3 LYS 28 1HD LYS 28 -0.213 2.680 14.135
60 HE2 LYS 28 2HE LYS 28 -2.106 1.058 15.836
61 HE3 LYS 28 1HE LYS 28 -0.474 1.554 16.275
62 HZ1 LYS 28 3HZ LYS 28 -1.182 3.855 16.191
63 HZ2 LYS 28 1HZ LYS 28 -2.154 2.979 17.253
64 HZ3 LYS 28 2HZ LYS 28 -2.744 3.393 15.744
65 H LYS 29 H LYS 29 -3.152 -0.042 9.814
66 HA LYS 29 HA LYS 29 -1.959 0.993 7.382
67 HB2 LYS 29 2HB LYS 29 -1.896 -1.230 6.359
68 HB3 LYS 29 1HB LYS 29 -0.804 -1.081 7.732
69 HG2 LYS 29 2HG LYS 29 -2.381 -2.282 9.145
70 HG3 LYS 29 1HG LYS 29 -3.514 -2.396 7.800
71 HD2 LYS 29 2HD LYS 29 -2.302 -4.492 8.077
72 HD3 LYS 29 1HD LYS 29 -1.876 -3.719 6.548
73 HE2 LYS 29 2HE LYS 29 0.207 -2.921 7.483
74 HE3 LYS 29 1HE LYS 29 -0.234 -3.540 9.075
75 HZ1 LYS 29 3HZ LYS 29 0.188 -5.185 6.647
76 HZ2 LYS 29 1HZ LYS 29 -0.175 -5.753 8.194
77 HZ3 LYS 29 2HZ LYS 29 1.296 -4.979 7.904
78 H VAL 30 H VAL 30 -3.198 0.347 5.511
79 HA VAL 30 HA VAL 30 -6.024 0.736 5.861
80 HB VAL 30 HB VAL 30 -4.601 1.750 4.017
81 HG11 VAL 30 1HG1 VAL 30 -3.173 -0.096 3.461
82 HG12 VAL 30 2HG1 VAL 30 -4.084 0.390 2.026
83 HG13 VAL 30 3HG1 VAL 30 -4.557 -1.046 2.924
84 HG21 VAL 30 3HG2 VAL 30 -6.936 0.083 3.123
85 HG22 VAL 30 1HG2 VAL 30 -6.230 1.421 2.217
86 HG23 VAL 30 2HG2 VAL 30 -6.989 1.724 3.778
87 H ASP 31 H ASP 31 -7.581 -0.945 5.151
88 HA ASP 31 HA ASP 31 -6.498 -3.539 5.713
89 HB2 ASP 31 2HB ASP 31 -8.740 -2.908 6.588
90 HB3 ASP 31 1HB ASP 31 -9.346 -2.897 4.933
91 H CYS 32 H CYS 32 -5.225 -4.077 4.193
92 HA CYS 32 HA CYS 32 -5.982 -4.120 1.386
93 HB2 CYS 32 2HB CYS 32 -3.712 -3.439 2.073
94 HB3 CYS 32 1HB CYS 32 -3.480 -4.978 2.872
95 H SER 33 H SER 33 -6.336 -6.019 4.101
96 HA SER 33 HA SER 33 -5.766 -8.589 3.275
97 HB2 SER 33 2HB SER 33 -7.771 -7.638 5.293
98 HB3 SER 33 1HB SER 33 -7.019 -9.238 5.233
99 HG SER 33 HG SER 33 -6.113 -7.417 6.610
100 H ILE 34 H ILE 34 -8.838 -6.726 3.007
101 HA ILE 34 HA ILE 34 -10.214 -8.997 1.980
102 HB ILE 34 HB ILE 34 -12.018 -7.486 1.278
103 HG12 ILE 34 2HG1 ILE 34 -10.342 -5.238 2.402
104 HG13 ILE 34 1HG1 ILE 34 -10.520 -5.558 0.680
105 HG21 ILE 34 1HG2 ILE 34 -10.992 -7.047 4.069
106 HG22 ILE 34 2HG2 ILE 34 -12.081 -8.328 3.515
107 HG23 ILE 34 3HG2 ILE 34 -12.617 -6.649 3.520
108 HD11 ILE 34 3HD1 ILE 34 -12.719 -4.845 2.599
109 HD12 ILE 34 1HD1 ILE 34 -12.931 -5.186 0.883
110 HD13 ILE 34 2HD1 ILE 34 -11.997 -3.780 1.389
111 H TYR 35 H TYR 35 -8.083 -6.779 0.564
112 HA TYR 35 HA TYR 35 -9.146 -7.194 -2.081
113 HB2 TYR 35 2HB TYR 35 -6.803 -5.555 -1.107
114 HB3 TYR 35 1HB TYR 35 -7.274 -5.677 -2.793
115 HD1 TYR 35 1HD TYR 35 -9.469 -4.744 -3.521
116 HD2 TYR 35 2HD TYR 35 -7.978 -4.099 0.407
117 HE1 TYR 35 1HE TYR 35 -11.067 -2.910 -3.226
118 HE2 TYR 35 2HE TYR 35 -9.581 -2.250 0.715
119 HH TYR 35 HH TYR 35 -10.987 -0.710 -0.548
120 H LYS 36 H LYS 36 -7.030 -8.699 -0.004
121 HA LYS 36 HA LYS 36 -5.152 -9.694 -1.873
122 HB2 LYS 36 2HB LYS 36 -5.871 -10.592 0.891
123 HB3 LYS 36 1HB LYS 36 -4.678 -11.433 -0.090
124 HG2 LYS 36 2HG LYS 36 -3.360 -9.362 -0.215
125 HG3 LYS 36 1HG LYS 36 -4.556 -8.552 0.797
126 HD2 LYS 36 2HD LYS 36 -2.608 -9.266 2.103
127 HD3 LYS 36 1HD LYS 36 -4.068 -10.099 2.626
128 HE2 LYS 36 2HE LYS 36 -2.153 -11.627 2.518
129 HE3 LYS 36 1HE LYS 36 -3.391 -12.097 1.366
130 HZ1 LYS 36 3HZ LYS 36 -0.900 -10.603 0.733
131 HZ2 LYS 36 1HZ LYS 36 -2.039 -11.101 -0.421
132 HZ3 LYS 36 2HZ LYS 36 -1.163 -12.226 0.450
133 H LYS 37 H LYS 37 -8.385 -10.543 -1.348
134 HA LYS 37 HA LYS 37 -8.040 -13.272 -2.199
135 HB2 LYS 37 2HB LYS 37 -10.517 -13.407 -2.324
136 HB3 LYS 37 1HB LYS 37 -9.931 -12.863 -0.763
137 HG2 LYS 37 2HG LYS 37 -10.570 -10.588 -1.283
138 HG3 LYS 37 1HG LYS 37 -11.046 -11.069 -2.914
139 HD2 LYS 37 2HD LYS 37 -12.798 -12.491 -2.031
140 HD3 LYS 37 1HD LYS 37 -12.266 -12.167 -0.381
141 HE2 LYS 37 2HE LYS 37 -13.299 -10.063 -2.284
142 HE3 LYS 37 1HE LYS 37 -14.294 -10.887 -1.085
143 HZ1 LYS 37 3HZ LYS 37 -11.902 -9.224 -0.471
144 HZ2 LYS 37 1HZ LYS 37 -12.920 -9.971 0.656
145 HZ3 LYS 37 2HZ LYS 37 -13.490 -8.727 -0.313
146 H TYR 38 H TYR 38 -7.756 -10.496 -3.829
147 HA TYR 38 HA TYR 38 -8.744 -11.593 -6.366
148 HB2 TYR 38 2HB TYR 38 -7.763 -8.806 -5.693
149 HB3 TYR 38 1HB TYR 38 -8.483 -9.299 -7.216
150 HD1 TYR 38 2HD TYR 38 -10.962 -10.020 -7.139
151 HD2 TYR 38 1HD TYR 38 -9.018 -7.964 -3.985
152 HE1 TYR 38 2HE TYR 38 -13.143 -9.300 -6.265
153 HE2 TYR 38 1HE TYR 38 -11.178 -7.235 -3.100
154 HH TYR 38 HH TYR 38 -14.132 -8.555 -4.168
155 HA PRO 39 HA PRO 39 -4.470 -12.319 -7.626
156 HB2 PRO 39 2HB PRO 39 -4.499 -11.050 -10.111
157 HB3 PRO 39 1HB PRO 39 -4.986 -12.724 -9.828
158 HG2 PRO 39 2HG PRO 39 -6.667 -10.268 -10.065
159 HG3 PRO 39 1HG PRO 39 -6.979 -11.899 -10.687
160 HD2 PRO 39 2HD PRO 39 -8.217 -11.010 -8.495
161 HD3 PRO 39 1HD PRO 39 -7.654 -12.686 -8.598
162 H VAL 40 H VAL 40 -2.633 -11.177 -7.110
163 HA VAL 40 HA VAL 40 -2.842 -8.695 -5.992
164 HB VAL 40 HB VAL 40 -0.392 -8.709 -5.876
165 HG11 VAL 40 1HG1 VAL 40 -1.753 -11.280 -5.104
166 HG12 VAL 40 2HG1 VAL 40 -1.697 -9.796 -4.163
167 HG13 VAL 40 3HG1 VAL 40 -0.217 -10.710 -4.453
168 HG21 VAL 40 3HG2 VAL 40 0.139 -9.795 -7.993
169 HG22 VAL 40 1HG2 VAL 40 -0.598 -11.291 -7.422
170 HG23 VAL 40 2HG2 VAL 40 0.864 -10.674 -6.653
171 H VAL 41 H VAL 41 -2.223 -9.393 -9.307
172 HA VAL 41 HA VAL 41 -1.224 -6.692 -9.707
173 HB VAL 41 HB VAL 41 -0.907 -7.292 -12.086
174 HG11 VAL 41 1HG1 VAL 41 0.909 -7.634 -10.505
175 HG12 VAL 41 2HG1 VAL 41 0.920 -8.887 -11.747
176 HG13 VAL 41 3HG1 VAL 41 0.303 -9.250 -10.137
177 HG21 VAL 41 3HG2 VAL 41 -2.713 -8.914 -12.334
178 HG22 VAL 41 1HG2 VAL 41 -1.884 -10.024 -11.242
179 HG23 VAL 41 2HG2 VAL 41 -1.172 -9.626 -12.807
180 H ALA 42 H ALA 42 -4.215 -8.401 -9.991
181 HA ALA 42 HA ALA 42 -5.353 -6.040 -11.274
182 HB1 ALA 42 1HB ALA 42 -6.160 -8.893 -11.840
183 HB2 ALA 42 2HB ALA 42 -5.248 -7.846 -12.927
184 HB3 ALA 42 3HB ALA 42 -6.914 -7.446 -12.515
185 H ILE 43 H ILE 43 -6.103 -5.183 -9.393
186 HA ILE 43 HA ILE 43 -8.072 -6.811 -7.959
187 HB ILE 43 HB ILE 43 -6.340 -4.556 -6.879
188 HG12 ILE 43 2HG1 ILE 43 -6.304 -7.535 -6.305
189 HG13 ILE 43 1HG1 ILE 43 -5.090 -6.636 -7.191
190 HG21 ILE 43 1HG2 ILE 43 -8.375 -6.251 -5.427
191 HG22 ILE 43 2HG2 ILE 43 -8.568 -4.556 -5.871
192 HG23 ILE 43 3HG2 ILE 43 -7.330 -5.018 -4.707
193 HD11 ILE 43 3HD1 ILE 43 -4.518 -5.407 -5.152
194 HD12 ILE 43 1HD1 ILE 43 -4.347 -7.151 -4.946
195 HD13 ILE 43 2HD1 ILE 43 -5.745 -6.319 -4.272
196 HA PRO 44 HA PRO 44 -10.833 -3.683 -9.660
197 HB2 PRO 44 2HB PRO 44 -12.714 -4.717 -7.618
198 HB3 PRO 44 1HB PRO 44 -12.922 -4.597 -9.368
199 HG2 PRO 44 2HG PRO 44 -12.541 -6.962 -8.184
200 HG3 PRO 44 1HG PRO 44 -11.835 -6.598 -9.768
201 HD2 PRO 44 2HD PRO 44 -10.530 -6.628 -7.076
202 HD3 PRO 44 1HD PRO 44 -9.916 -7.197 -8.643
203 H CYS 45 H CYS 45 -11.090 -1.653 -9.039
204 HA CYS 45 HA CYS 45 -10.570 -1.028 -6.235
205 HB2 CYS 45 2HB CYS 45 -10.150 0.657 -8.709
206 HB3 CYS 45 1HB CYS 45 -9.809 1.184 -7.070
207 HA PRO 46 HA PRO 46 -14.688 0.644 -5.998
208 HB2 PRO 46 2HB PRO 46 -14.355 2.233 -3.809
209 HB3 PRO 46 1HB PRO 46 -14.543 0.483 -3.697
210 HG2 PRO 46 2HG PRO 46 -12.059 2.138 -3.566
211 HG3 PRO 46 1HG PRO 46 -12.504 0.709 -2.615
212 HD2 PRO 46 2HD PRO 46 -10.797 0.621 -4.724
213 HD3 PRO 46 1HD PRO 46 -11.826 -0.747 -4.262
214 H ILE 47 H ILE 47 -15.726 2.752 -6.108
215 HA ILE 47 HA ILE 47 -14.144 4.548 -7.722
216 HB ILE 47 HB ILE 47 -16.229 5.815 -8.105
217 HG12 ILE 47 2HG1 ILE 47 -17.560 3.724 -6.365
218 HG13 ILE 47 1HG1 ILE 47 -17.266 5.388 -5.876
219 HG21 ILE 47 1HG2 ILE 47 -17.429 4.062 -9.341
220 HG22 ILE 47 2HG2 ILE 47 -16.517 2.838 -8.462
221 HG23 ILE 47 3HG2 ILE 47 -15.681 3.941 -9.555
222 HD11 ILE 47 3HD1 ILE 47 -19.572 5.055 -6.558
223 HD12 ILE 47 1HD1 ILE 47 -19.036 4.476 -8.136
224 HD13 ILE 47 2HD1 ILE 47 -18.751 6.153 -7.669
225 H THR 48 H THR 48 -14.934 4.263 -4.476
226 HA THR 48 HA THR 48 -15.073 6.933 -3.633
227 HB THR 48 HB THR 48 -13.856 4.650 -2.077
228 HG1 THR 48 1HG THR 48 -16.533 5.118 -2.873
229 HG21 THR 48 3HG2 THR 48 -14.936 5.781 -0.187
230 HG22 THR 48 1HG2 THR 48 -15.609 6.985 -1.285
231 HG23 THR 48 2HG2 THR 48 -13.867 6.893 -1.046
232 H TYR 49 H TYR 49 -13.496 8.407 -3.864
233 HA TYR 49 HA TYR 49 -10.753 7.559 -4.165
234 HB2 TYR 49 2HB TYR 49 -11.832 9.465 -5.503
235 HB3 TYR 49 1HB TYR 49 -11.769 10.400 -4.014
236 HD1 TYR 49 2HD TYR 49 -9.587 11.094 -3.065
237 HD2 TYR 49 1HD TYR 49 -9.831 9.004 -6.754
238 HE1 TYR 49 2HE TYR 49 -7.246 11.697 -3.557
239 HE2 TYR 49 1HE TYR 49 -7.506 9.595 -7.250
240 HH TYR 49 HH TYR 49 -5.400 10.756 -4.941
241 H LEU 50 H LEU 50 -9.414 7.439 -2.545
242 HA LEU 50 HA LEU 50 -9.924 8.876 -0.072
243 HB2 LEU 50 2HB LEU 50 -9.325 5.917 -0.304
244 HB3 LEU 50 1HB LEU 50 -9.288 6.827 1.190
245 HG LEU 50 HG LEU 50 -11.763 6.402 -0.490
246 HD11 LEU 50 1HD1 LEU 50 -12.428 4.820 1.254
247 HD12 LEU 50 2HD1 LEU 50 -10.864 5.024 2.040
248 HD13 LEU 50 3HD1 LEU 50 -10.959 4.295 0.434
249 HD21 LEU 50 3HD2 LEU 50 -11.384 7.496 2.299
250 HD22 LEU 50 1HD2 LEU 50 -12.936 7.207 1.510
251 HD23 LEU 50 2HD2 LEU 50 -11.836 8.432 0.875
252 HA PRO 51 HA PRO 51 -5.699 9.548 -1.615
253 HB2 PRO 51 2HB PRO 51 -5.617 11.516 0.568
254 HB3 PRO 51 1HB PRO 51 -5.383 11.769 -1.158
255 HG2 PRO 51 2HG PRO 51 -7.560 12.558 0.291
256 HG3 PRO 51 1HG PRO 51 -7.513 12.302 -1.455
257 HD2 PRO 51 2HD PRO 51 -8.789 10.635 0.636
258 HD3 PRO 51 1HD PRO 51 -9.118 10.725 -1.096
259 H VAL 52 H VAL 52 -4.294 8.116 -0.932
260 HA VAL 52 HA VAL 52 -3.677 8.045 1.912
261 HB VAL 52 HB VAL 52 -3.261 5.590 1.799
262 HG11 VAL 52 1HG1 VAL 52 -6.097 6.365 1.141
263 HG12 VAL 52 2HG1 VAL 52 -5.359 6.364 2.741
264 HG13 VAL 52 3HG1 VAL 52 -5.594 4.843 1.878
265 HG21 VAL 52 3HG2 VAL 52 -2.924 5.312 -0.564
266 HG22 VAL 52 1HG2 VAL 52 -4.592 5.781 -0.906
267 HG23 VAL 52 2HG2 VAL 52 -4.255 4.277 -0.047
268 H CYS 53 H CYS 53 -1.525 7.600 2.383
269 HA CYS 53 HA CYS 53 0.230 7.952 0.070
270 HB2 CYS 53 2HB CYS 53 0.180 9.879 1.616
271 HB3 CYS 53 1HB CYS 53 0.684 8.874 2.938
272 H GLY 54 H GLY 54 1.659 6.432 -0.310
273 HA2 GLY 54 2HA GLY 54 1.800 4.166 1.490
274 HA3 GLY 54 1HA GLY 54 2.488 4.267 -0.127
275 H SER 55 H SER 55 3.897 3.196 1.939
276 HA SER 55 HA SER 55 5.639 4.743 3.448
277 HB2 SER 55 2HB SER 55 6.449 2.206 2.064
278 HB3 SER 55 1HB SER 55 6.913 2.783 3.667
279 HG SER 55 HG SER 55 5.157 1.969 4.468
280 H ASP 56 H ASP 56 5.557 4.368 0.089
281 HA ASP 56 HA ASP 56 8.366 5.001 -0.351
282 HB2 ASP 56 2HB ASP 56 7.241 3.194 -1.612
283 HB3 ASP 56 1HB ASP 56 6.142 4.378 -2.296
284 H TYR 57 H TYR 57 5.805 6.665 0.477
285 HA TYR 57 HA TYR 57 5.073 8.721 0.437
286 HB2 TYR 57 2HB TYR 57 7.784 8.957 0.507
287 HB3 TYR 57 1HB TYR 57 7.398 9.923 -0.919
288 HD1 TYR 57 1HD TYR 57 6.393 9.381 2.566
289 HD2 TYR 57 2HD TYR 57 6.666 12.127 -0.649
290 HE1 TYR 57 1HE TYR 57 5.631 11.153 4.052
291 HE2 TYR 57 2HE TYR 57 5.904 13.942 0.827
292 HH TYR 57 HH TYR 57 4.465 14.038 2.974
293 H ILE 58 H ILE 58 4.099 7.267 -1.433
294 HA ILE 58 HA ILE 58 3.802 9.072 -3.730
295 HB ILE 58 HB ILE 58 3.403 6.052 -3.676
296 HG12 ILE 58 2HG1 ILE 58 5.798 6.614 -3.662
297 HG13 ILE 58 1HG1 ILE 58 5.329 5.879 -5.190
298 HG21 ILE 58 1HG2 ILE 58 1.841 7.113 -5.189
299 HG22 ILE 58 2HG2 ILE 58 3.051 6.211 -6.102
300 HG23 ILE 58 3HG2 ILE 58 3.159 7.967 -5.992
301 HD11 ILE 58 3HD1 ILE 58 5.303 8.110 -6.220
302 HD12 ILE 58 1HD1 ILE 58 6.881 7.696 -5.544
303 HD13 ILE 58 2HD1 ILE 58 5.820 8.802 -4.680
304 H THR 59 H THR 59 1.734 9.798 -3.958
305 HA THR 59 HA THR 59 -0.213 8.962 -2.009
306 HB THR 59 HB THR 59 -0.437 11.039 -4.209
307 HG1 THR 59 1HG THR 59 1.130 11.029 -2.197
308 HG21 THR 59 3HG2 THR 59 -2.031 10.612 -1.661
309 HG22 THR 59 1HG2 THR 59 -2.615 10.325 -3.299
310 HG23 THR 59 2HG2 THR 59 -2.241 11.966 -2.770
311 H TYR 60 H TYR 60 -1.851 7.689 -2.417
312 HA TYR 60 HA TYR 60 -2.244 6.728 -5.159
313 HB2 TYR 60 2HB TYR 60 -2.657 5.315 -2.519
314 HB3 TYR 60 1HB TYR 60 -3.172 4.657 -4.070
315 HD1 TYR 60 2HD TYR 60 -0.227 5.625 -2.049
316 HD2 TYR 60 1HD TYR 60 -1.607 3.581 -5.505
317 HE1 TYR 60 2HE TYR 60 2.001 4.641 -2.347
318 HE2 TYR 60 1HE TYR 60 0.619 2.584 -5.805
319 HH TYR 60 HH TYR 60 2.880 2.985 -5.218
320 H GLY 61 H GLY 61 -4.373 6.315 -5.812
321 HA2 GLY 61 2HA GLY 61 -6.193 8.305 -5.032
322 HA3 GLY 61 1HA GLY 61 -6.521 6.989 -6.151
323 H ASN 62 H ASN 62 -5.842 4.994 -3.992
324 HA ASN 62 HA ASN 62 -7.403 5.355 -1.752
325 HB2 ASN 62 2HB ASN 62 -9.397 3.952 -2.160
326 HB3 ASN 62 1HB ASN 62 -9.385 5.366 -3.188
327 HD21 ASN 62 1HD2 ASN 62 -10.815 4.441 -4.567
328 HD22 ASN 62 2HD2 ASN 62 -10.400 3.231 -5.715
329 H GLU 63 H GLU 63 -8.202 3.116 -0.938
330 HA GLU 63 HA GLU 63 -6.199 1.610 0.058
331 HB2 GLU 63 2HB GLU 63 -8.798 0.414 -0.817
332 HB3 GLU 63 1HB GLU 63 -7.786 -0.068 0.526
333 HG2 GLU 63 2HG GLU 63 -8.358 1.968 1.705
334 HG3 GLU 63 1HG GLU 63 -9.326 2.505 0.330
335 H CYS 64 H CYS 64 -8.111 0.873 -2.803
336 HA CYS 64 HA CYS 64 -7.105 -1.646 -3.365
337 HB2 CYS 64 2HB CYS 64 -9.141 -0.919 -4.367
338 HB3 CYS 64 1HB CYS 64 -8.332 0.422 -5.172
339 H HIS 65 H HIS 65 -6.162 1.458 -4.777
340 HA HIS 65 HA HIS 65 -4.223 0.332 -6.513
341 HB2 HIS 65 2HB HIS 65 -4.460 3.174 -5.504
342 HB3 HIS 65 1HB HIS 65 -3.350 2.665 -6.769
343 HD1 HIS 65 1HD HIS 65 -4.710 1.466 -8.908
344 HD2 HIS 65 2HD HIS 65 -6.824 4.065 -6.453
345 HE1 HIS 65 1HE HIS 65 -6.713 2.143 -10.221
346 HE2 HIS 65 2HE HIS 65 -7.660 4.033 -8.886
347 H LEU 66 H LEU 66 -4.029 1.638 -3.289
348 HA LEU 66 HA LEU 66 -1.228 1.530 -2.993
349 HB2 LEU 66 2HB LEU 66 -2.700 2.846 -1.514
350 HB3 LEU 66 1HB LEU 66 -3.453 1.377 -0.976
351 HG LEU 66 HG LEU 66 -1.415 0.654 0.148
352 HD11 LEU 66 1HD1 LEU 66 0.251 1.660 -1.307
353 HD12 LEU 66 2HD1 LEU 66 0.499 2.147 0.371
354 HD13 LEU 66 3HD1 LEU 66 -0.240 3.268 -0.773
355 HD21 LEU 66 3HD2 LEU 66 -1.419 2.273 1.918
356 HD22 LEU 66 1HD2 LEU 66 -3.057 2.048 1.319
357 HD23 LEU 66 2HD2 LEU 66 -2.140 3.484 0.857
358 H CYS 67 H CYS 67 -3.821 -0.690 -2.089
359 HA CYS 67 HA CYS 67 -2.272 -2.678 -0.886
360 HB2 CYS 67 2HB CYS 67 -4.694 -2.483 -0.586
361 HB3 CYS 67 1HB CYS 67 -4.949 -2.850 -2.281
362 H THR 68 H THR 68 -3.368 -2.328 -4.262
363 HA THR 68 HA THR 68 -2.406 -4.747 -5.249
364 HB THR 68 HB THR 68 -2.636 -2.068 -6.646
365 HG1 THR 68 1HG THR 68 -4.448 -3.704 -5.596
366 HG21 THR 68 3HG2 THR 68 -2.633 -4.876 -7.781
367 HG22 THR 68 1HG2 THR 68 -1.338 -3.695 -7.962
368 HG23 THR 68 2HG2 THR 68 -2.908 -3.393 -8.703
369 H GLU 69 H GLU 69 -0.790 -1.545 -5.103
370 HA GLU 69 HA GLU 69 1.586 -2.434 -6.352
371 HB2 GLU 69 2HB GLU 69 0.659 -0.051 -6.107
372 HB3 GLU 69 1HB GLU 69 1.333 -0.085 -4.487
373 HG2 GLU 69 2HG GLU 69 2.838 1.029 -5.948
374 HG3 GLU 69 1HG GLU 69 3.563 -0.506 -5.457
375 H SER 70 H SER 70 0.465 -2.226 -3.024
376 HA SER 70 HA SER 70 2.888 -2.678 -1.698
377 HB2 SER 70 2HB SER 70 0.742 -1.885 -0.630
378 HB3 SER 70 1HB SER 70 0.131 -3.534 -0.766
379 HG SER 70 HG SER 70 2.438 -2.674 0.575
380 H LEU 71 H LEU 71 0.360 -4.931 -2.774
381 HA LEU 71 HA LEU 71 1.661 -7.241 -1.805
382 HB2 LEU 71 2HB LEU 71 -0.448 -6.961 -3.937
383 HB3 LEU 71 1HB LEU 71 0.036 -8.473 -3.196
384 HG LEU 71 HG LEU 71 -1.280 -6.159 -1.766
385 HD11 LEU 71 1HD1 LEU 71 -3.223 -7.586 -1.614
386 HD12 LEU 71 2HD1 LEU 71 -2.395 -8.857 -2.498
387 HD13 LEU 71 3HD1 LEU 71 -2.785 -7.331 -3.305
388 HD21 LEU 71 3HD2 LEU 71 0.206 -7.383 -0.276
389 HD22 LEU 71 1HD2 LEU 71 -0.528 -8.910 -0.773
390 HD23 LEU 71 2HD2 LEU 71 -1.473 -7.719 0.119
391 H LYS 72 H LYS 72 1.669 -5.616 -4.905
392 HA LYS 72 HA LYS 72 3.131 -7.543 -6.343
393 HB2 LYS 72 2HB LYS 72 2.858 -4.566 -6.705
394 HB3 LYS 72 1HB LYS 72 3.751 -5.593 -7.818
395 HG2 LYS 72 2HG LYS 72 1.791 -6.760 -8.446
396 HG3 LYS 72 1HG LYS 72 0.866 -6.033 -7.139
397 HD2 LYS 72 2HD LYS 72 0.276 -5.003 -9.275
398 HD3 LYS 72 1HD LYS 72 1.048 -3.835 -8.220
399 HE2 LYS 72 2HE LYS 72 2.556 -5.327 -10.362
400 HE3 LYS 72 1HE LYS 72 1.696 -3.835 -10.700
401 HZ1 LYS 72 3HZ LYS 72 4.068 -4.193 -8.909
402 HZ2 LYS 72 1HZ LYS 72 3.166 -2.757 -8.958
403 HZ3 LYS 72 2HZ LYS 72 3.937 -3.325 -10.325
404 H SER 73 H SER 73 4.168 -4.918 -4.242
405 HA SER 73 HA SER 73 6.948 -5.479 -4.855
406 HB2 SER 73 2HB SER 73 7.384 -3.531 -3.382
407 HB3 SER 73 1HB SER 73 6.325 -3.147 -4.735
408 HG SER 73 HG SER 73 4.638 -2.986 -3.421
409 H ASN 74 H ASN 74 4.708 -6.831 -2.999
410 HA ASN 74 HA ASN 74 4.583 -8.166 -1.227
411 HB2 ASN 74 2HB ASN 74 7.568 -8.451 -1.656
412 HB3 ASN 74 1HB ASN 74 6.638 -9.448 -0.544
413 HD21 ASN 74 1HD2 ASN 74 7.465 -8.863 -3.809
414 HD22 ASN 74 2HD2 ASN 74 6.597 -10.171 -4.514
415 H GLY 75 H GLY 75 4.959 -5.357 -0.779
416 HA2 GLY 75 2HA GLY 75 4.553 -4.408 1.379
417 HA3 GLY 75 1HA GLY 75 5.655 -5.586 2.065
418 H ARG 76 H ARG 76 6.680 -3.932 -0.818
419 HA ARG 76 HA ARG 76 8.811 -2.605 0.602
420 HB2 ARG 76 2HB ARG 76 8.929 -3.269 -1.859
421 HB3 ARG 76 1HB ARG 76 7.784 -1.966 -2.177
422 HG2 ARG 76 2HG ARG 76 9.420 -0.387 -1.173
423 HG3 ARG 76 1HG ARG 76 10.579 -1.712 -1.119
424 HD2 ARG 76 2HD ARG 76 11.031 -0.483 -3.118
425 HD3 ARG 76 1HD ARG 76 10.228 -1.974 -3.598
426 HE ARG 76 HE ARG 76 8.386 -0.768 -4.268
427 HH11 ARG 76 1HH1 ARG 76 10.735 1.413 -2.681
428 HH12 ARG 76 2HH1 ARG 76 9.946 2.836 -3.190
429 HH21 ARG 76 1HH2 ARG 76 7.374 1.203 -5.022
430 HH22 ARG 76 2HH2 ARG 76 8.024 2.715 -4.580
431 H VAL 77 H VAL 77 5.982 -1.559 -1.179
432 HA VAL 77 HA VAL 77 5.887 0.823 0.472
433 HB VAL 77 HB VAL 77 5.839 1.291 -1.956
434 HG11 VAL 77 1HG1 VAL 77 3.366 -0.409 -2.067
435 HG12 VAL 77 2HG1 VAL 77 4.930 -0.783 -2.794
436 HG13 VAL 77 3HG1 VAL 77 3.984 0.586 -3.385
437 HG21 VAL 77 3HG2 VAL 77 3.164 1.773 -0.655
438 HG22 VAL 77 1HG2 VAL 77 3.772 2.620 -2.077
439 HG23 VAL 77 2HG2 VAL 77 4.591 2.799 -0.524
440 H GLN 78 H GLN 78 4.367 0.903 2.030
441 HA GLN 78 HA GLN 78 2.048 -0.827 1.812
442 HB2 GLN 78 2HB GLN 78 3.958 -1.672 3.338
443 HB3 GLN 78 1HB GLN 78 3.613 -0.276 4.342
444 HG2 GLN 78 2HG GLN 78 1.411 -1.108 4.827
445 HG3 GLN 78 1HG GLN 78 1.619 -2.429 3.673
446 HE21 GLN 78 1HE2 GLN 78 3.072 -4.044 4.158
447 HE22 GLN 78 2HE2 GLN 78 3.591 -4.380 5.765
448 H PHE 79 H PHE 79 0.580 0.124 3.781
449 HA PHE 79 HA PHE 79 0.014 2.833 3.183
450 HB2 PHE 79 2HB PHE 79 -1.663 1.222 3.984
451 HB3 PHE 79 1HB PHE 79 -0.810 1.090 5.510
452 HD1 PHE 79 1HD PHE 79 -3.000 3.173 3.447
453 HD2 PHE 79 2HD PHE 79 -1.013 2.830 7.191
454 HE1 PHE 79 1HE PHE 79 -4.434 4.936 4.373
455 HE2 PHE 79 2HE PHE 79 -2.438 4.586 8.117
456 HZ PHE 79 HZ PHE 79 -4.152 5.639 6.718
457 H LEU 80 H LEU 80 1.164 4.527 3.819
458 HA LEU 80 HA LEU 80 2.916 4.284 6.135
459 HB2 LEU 80 2HB LEU 80 3.731 5.254 3.978
460 HB3 LEU 80 1HB LEU 80 2.567 6.540 4.158
461 HG LEU 80 HG LEU 80 3.715 7.265 6.220
462 HD11 LEU 80 1HD1 LEU 80 5.956 6.412 6.698
463 HD12 LEU 80 2HD1 LEU 80 5.766 5.200 5.437
464 HD13 LEU 80 3HD1 LEU 80 4.734 5.153 6.868
465 HD21 LEU 80 3HD2 LEU 80 5.425 7.117 3.741
466 HD22 LEU 80 1HD2 LEU 80 5.656 8.243 5.083
467 HD23 LEU 80 2HD2 LEU 80 4.195 8.330 4.103
468 H HIS 81 H HIS 81 0.616 6.640 4.781
469 HA HIS 81 HA HIS 81 -0.818 6.746 7.212
470 HB2 HIS 81 2HB HIS 81 -0.600 9.177 7.609
471 HB3 HIS 81 1HB HIS 81 0.956 8.391 7.779
472 HD1 HIS 81 1HD HIS 81 -0.951 10.683 5.431
473 HD2 HIS 81 2HD HIS 81 2.938 9.402 6.133
474 HE1 HIS 81 1HE HIS 81 0.530 12.094 3.943
475 HE2 HIS 81 2HE HIS 81 2.744 11.665 4.901
476 H ASP 82 H ASP 82 -2.836 7.851 6.862
477 HA ASP 82 HA ASP 82 -3.563 7.791 4.089
478 HB2 ASP 82 2HB ASP 82 -5.830 8.399 4.781
479 HB3 ASP 82 1HB ASP 82 -5.249 7.070 5.763
480 H GLY 83 H GLY 83 -4.762 9.633 3.131
481 HA2 GLY 83 2HA GLY 83 -5.003 11.880 2.766
482 HA3 GLY 83 1HA GLY 83 -3.794 12.220 4.011
483 H SER 84 H SER 84 -3.593 13.477 1.633
484 HA SER 84 HA SER 84 -1.922 12.149 -0.193
485 HB2 SER 84 2HB SER 84 -2.222 15.104 0.381
486 HB3 SER 84 1HB SER 84 -1.635 14.379 -1.124
487 HG SER 84 HG SER 84 -3.635 13.825 -1.664
488 H CYS 85 H CYS 85 0.364 12.323 -0.380
489 HA CYS 85 HA CYS 85 1.768 12.145 2.024
490 HB2 CYS 85 2HB CYS 85 2.922 12.607 -0.738
491 HB3 CYS 85 1HB CYS 85 3.743 11.982 0.699
Start of MODEL 7
1 H1 SER 20 1HT SER 20 -2.093 -8.518 14.846
2 H2 SER 20 2HT SER 20 -3.469 -8.451 15.829
3 H3 SER 20 3HT SER 20 -2.528 -9.873 15.754
4 HA SER 20 HA SER 20 -2.135 -8.682 17.767
5 HB2 SER 20 2HB SER 20 0.156 -8.605 15.801
6 HB3 SER 20 1HB SER 20 0.302 -8.696 17.558
7 HG SER 20 HG SER 20 -0.213 -10.753 17.515
8 H GLU 21 H GLU 21 -2.762 -6.737 18.425
9 HA GLU 21 HA GLU 21 -2.324 -4.485 16.679
10 HB2 GLU 21 2HB GLU 21 -4.135 -4.867 19.061
11 HB3 GLU 21 1HB GLU 21 -3.907 -3.314 18.281
12 HG2 GLU 21 2HG GLU 21 -5.968 -4.390 17.535
13 HG3 GLU 21 1HG GLU 21 -4.841 -4.204 16.200
14 H ALA 22 H ALA 22 -0.191 -4.211 17.006
15 HA ALA 22 HA ALA 22 0.427 -2.421 19.137
16 HB1 ALA 22 1HB ALA 22 0.912 -4.546 20.267
17 HB2 ALA 22 2HB ALA 22 2.402 -3.652 19.958
18 HB3 ALA 22 3HB ALA 22 1.966 -5.023 18.936
19 H ALA 23 H ALA 23 0.664 -1.049 17.391
20 HA ALA 23 HA ALA 23 3.236 -0.917 16.248
21 HB1 ALA 23 1HB ALA 23 1.086 -1.617 14.243
22 HB2 ALA 23 2HB ALA 23 2.339 -2.721 14.804
23 HB3 ALA 23 3HB ALA 23 2.785 -1.276 13.903
24 H SER 24 H SER 24 0.201 -0.016 14.716
25 HA SER 24 HA SER 24 1.200 2.676 14.369
26 HB2 SER 24 2HB SER 24 -1.376 1.453 13.405
27 HB3 SER 24 1HB SER 24 -0.560 2.884 12.769
28 HG SER 24 HG SER 24 1.265 1.362 12.435
29 H LEU 25 H LEU 25 -0.111 1.514 17.032
30 HA LEU 25 HA LEU 25 -1.278 2.311 18.796
31 HB2 LEU 25 2HB LEU 25 -1.651 4.863 17.190
32 HB3 LEU 25 1HB LEU 25 -2.030 4.674 18.887
33 HG LEU 25 HG LEU 25 0.746 4.526 17.709
34 HD11 LEU 25 1HD1 LEU 25 -0.599 6.727 19.266
35 HD12 LEU 25 2HD1 LEU 25 -0.210 6.758 17.545
36 HD13 LEU 25 3HD1 LEU 25 1.086 6.694 18.739
37 HD21 LEU 25 3HD2 LEU 25 0.549 3.207 19.741
38 HD22 LEU 25 1HD2 LEU 25 -0.216 4.563 20.575
39 HD23 LEU 25 2HD2 LEU 25 1.462 4.680 20.064
40 H SER 26 H SER 26 -2.925 3.794 16.072
41 HA SER 26 HA SER 26 -5.391 2.439 16.818
42 HB2 SER 26 2HB SER 26 -4.828 4.509 14.671
43 HB3 SER 26 1HB SER 26 -6.418 3.957 15.202
44 HG SER 26 HG SER 26 -4.795 4.849 17.210
45 HA PRO 27 HA PRO 27 -4.219 -0.435 13.576
46 HB2 PRO 27 2HB PRO 27 -6.951 -1.431 13.468
47 HB3 PRO 27 1HB PRO 27 -5.506 -2.247 14.062
48 HG2 PRO 27 2HG PRO 27 -7.543 -1.405 15.678
49 HG3 PRO 27 1HG PRO 27 -5.870 -1.602 16.219
50 HD2 PRO 27 2HD PRO 27 -7.356 0.901 15.525
51 HD3 PRO 27 1HD PRO 27 -6.120 0.609 16.768
52 H LYS 28 H LYS 28 -4.097 1.526 12.235
53 HA LYS 28 HA LYS 28 -6.017 1.213 10.114
54 HB2 LYS 28 2HB LYS 28 -6.864 3.232 10.966
55 HB3 LYS 28 1HB LYS 28 -5.258 3.898 11.237
56 HG2 LYS 28 2HG LYS 28 -4.885 4.262 8.925
57 HG3 LYS 28 1HG LYS 28 -6.245 3.244 8.477
58 HD2 LYS 28 2HD LYS 28 -6.621 5.787 10.025
59 HD3 LYS 28 1HD LYS 28 -6.503 5.786 8.266
60 HE2 LYS 28 2HE LYS 28 -8.475 4.127 9.825
61 HE3 LYS 28 1HE LYS 28 -8.846 5.705 9.129
62 HZ1 LYS 28 3HZ LYS 28 -9.567 3.864 7.718
63 HZ2 LYS 28 1HZ LYS 28 -7.987 3.309 7.561
64 HZ3 LYS 28 2HZ LYS 28 -8.433 4.805 6.935
65 H LYS 29 H LYS 29 -5.045 0.291 8.723
66 HA LYS 29 HA LYS 29 -3.176 1.692 7.137
67 HB2 LYS 29 2HB LYS 29 -2.700 -1.117 8.212
68 HB3 LYS 29 1HB LYS 29 -1.969 -0.542 6.726
69 HG2 LYS 29 2HG LYS 29 -0.822 1.219 8.023
70 HG3 LYS 29 1HG LYS 29 -1.515 0.543 9.499
71 HD2 LYS 29 2HD LYS 29 -0.376 -1.544 9.124
72 HD3 LYS 29 1HD LYS 29 0.228 -0.968 7.568
73 HE2 LYS 29 2HE LYS 29 1.492 0.783 8.716
74 HE3 LYS 29 1HE LYS 29 0.898 0.195 10.271
75 HZ1 LYS 29 3HZ LYS 29 2.047 -1.861 9.935
76 HZ2 LYS 29 1HZ LYS 29 3.136 -0.609 9.714
77 HZ3 LYS 29 2HZ LYS 29 2.516 -1.425 8.375
78 H VAL 30 H VAL 30 -3.263 0.430 5.006
79 HA VAL 30 HA VAL 30 -5.981 -0.131 4.473
80 HB VAL 30 HB VAL 30 -4.581 0.738 2.655
81 HG11 VAL 30 1HG1 VAL 30 -2.826 -0.591 1.586
82 HG12 VAL 30 2HG1 VAL 30 -3.037 -1.850 2.799
83 HG13 VAL 30 3HG1 VAL 30 -2.425 -0.268 3.274
84 HG21 VAL 30 3HG2 VAL 30 -5.162 -0.853 0.872
85 HG22 VAL 30 1HG2 VAL 30 -6.489 -0.646 2.018
86 HG23 VAL 30 2HG2 VAL 30 -5.479 -2.087 2.092
87 H ASP 31 H ASP 31 -7.044 -1.983 4.879
88 HA ASP 31 HA ASP 31 -5.490 -4.297 5.528
89 HB2 ASP 31 2HB ASP 31 -7.737 -4.012 6.591
90 HB3 ASP 31 1HB ASP 31 -8.477 -4.210 4.996
91 H CYS 32 H CYS 32 -4.452 -5.185 4.048
92 HA CYS 32 HA CYS 32 -5.399 -4.913 1.342
93 HB2 CYS 32 2HB CYS 32 -3.034 -4.382 2.040
94 HB3 CYS 32 1HB CYS 32 -2.788 -6.099 2.301
95 H SER 33 H SER 33 -5.773 -7.076 3.828
96 HA SER 33 HA SER 33 -5.522 -9.523 2.472
97 HB2 SER 33 2HB SER 33 -7.077 -8.769 4.943
98 HB3 SER 33 1HB SER 33 -6.788 -10.428 4.406
99 HG SER 33 HG SER 33 -5.230 -9.995 5.837
100 H ILE 34 H ILE 34 -8.205 -7.259 2.920
101 HA ILE 34 HA ILE 34 -10.165 -8.909 1.752
102 HB ILE 34 HB ILE 34 -11.517 -6.865 1.398
103 HG12 ILE 34 2HG1 ILE 34 -9.116 -5.405 2.530
104 HG13 ILE 34 1HG1 ILE 34 -9.675 -5.311 0.865
105 HG21 ILE 34 1HG2 ILE 34 -11.769 -6.280 3.755
106 HG22 ILE 34 2HG2 ILE 34 -10.244 -7.086 4.106
107 HG23 ILE 34 3HG2 ILE 34 -11.619 -8.023 3.516
108 HD11 ILE 34 3HD1 ILE 34 -11.758 -4.286 1.625
109 HD12 ILE 34 1HD1 ILE 34 -10.348 -3.360 2.139
110 HD13 ILE 34 2HD1 ILE 34 -11.201 -4.392 3.293
111 H TYR 35 H TYR 35 -7.588 -7.246 0.245
112 HA TYR 35 HA TYR 35 -8.936 -7.606 -2.332
113 HB2 TYR 35 2HB TYR 35 -6.560 -5.840 -1.695
114 HB3 TYR 35 1HB TYR 35 -7.251 -6.061 -3.295
115 HD1 TYR 35 2HD TYR 35 -9.792 -5.470 -3.517
116 HD2 TYR 35 1HD TYR 35 -7.291 -4.077 -0.375
117 HE1 TYR 35 2HE TYR 35 -11.361 -3.628 -3.097
118 HE2 TYR 35 1HE TYR 35 -8.847 -2.228 0.057
119 HH TYR 35 HH TYR 35 -11.974 -2.121 -1.405
120 H LYS 36 H LYS 36 -6.586 -8.777 -0.292
121 HA LYS 36 HA LYS 36 -4.744 -9.991 -2.088
122 HB2 LYS 36 2HB LYS 36 -4.461 -9.508 0.383
123 HB3 LYS 36 1HB LYS 36 -5.531 -10.858 0.702
124 HG2 LYS 36 2HG LYS 36 -3.905 -12.353 -0.403
125 HG3 LYS 36 1HG LYS 36 -2.827 -10.969 -0.603
126 HD2 LYS 36 2HD LYS 36 -3.836 -12.065 2.035
127 HD3 LYS 36 1HD LYS 36 -2.219 -12.306 1.383
128 HE2 LYS 36 2HE LYS 36 -1.790 -9.895 1.537
129 HE3 LYS 36 1HE LYS 36 -3.422 -9.622 2.129
130 HZ1 LYS 36 3HZ LYS 36 -2.871 -10.979 4.093
131 HZ2 LYS 36 1HZ LYS 36 -1.823 -9.667 3.958
132 HZ3 LYS 36 2HZ LYS 36 -1.323 -11.202 3.517
133 H LYS 37 H LYS 37 -7.895 -10.552 -1.161
134 HA LYS 37 HA LYS 37 -8.213 -13.347 -1.627
135 HB2 LYS 37 2HB LYS 37 -10.214 -11.083 -1.711
136 HB3 LYS 37 1HB LYS 37 -10.607 -12.795 -1.692
137 HG2 LYS 37 2HG LYS 37 -9.804 -13.051 0.526
138 HG3 LYS 37 1HG LYS 37 -9.049 -11.457 0.508
139 HD2 LYS 37 2HD LYS 37 -11.102 -11.404 1.800
140 HD3 LYS 37 1HD LYS 37 -11.270 -10.417 0.353
141 HE2 LYS 37 2HE LYS 37 -12.445 -12.324 -0.732
142 HE3 LYS 37 1HE LYS 37 -12.361 -13.193 0.797
143 HZ1 LYS 37 3HZ LYS 37 -13.747 -10.605 0.346
144 HZ2 LYS 37 1HZ LYS 37 -13.667 -11.405 1.825
145 HZ3 LYS 37 2HZ LYS 37 -14.490 -12.093 0.530
146 H TYR 38 H TYR 38 -7.734 -10.649 -3.683
147 HA TYR 38 HA TYR 38 -8.898 -12.059 -5.976
148 HB2 TYR 38 2HB TYR 38 -8.057 -9.153 -5.756
149 HB3 TYR 38 1HB TYR 38 -8.862 -9.901 -7.119
150 HD1 TYR 38 1HD TYR 38 -11.206 -11.043 -6.439
151 HD2 TYR 38 2HD TYR 38 -9.292 -7.872 -4.365
152 HE1 TYR 38 1HE TYR 38 -13.372 -10.352 -5.504
153 HE2 TYR 38 2HE TYR 38 -11.435 -7.171 -3.424
154 HH TYR 38 HH TYR 38 -13.853 -7.389 -3.989
155 HA PRO 39 HA PRO 39 -4.686 -12.559 -7.431
156 HB2 PRO 39 2HB PRO 39 -5.121 -12.118 -10.137
157 HB3 PRO 39 1HB PRO 39 -5.372 -13.678 -9.344
158 HG2 PRO 39 2HG PRO 39 -7.354 -11.568 -10.063
159 HG3 PRO 39 1HG PRO 39 -7.510 -13.334 -10.164
160 HD2 PRO 39 2HD PRO 39 -8.648 -11.915 -8.183
161 HD3 PRO 39 1HD PRO 39 -7.976 -13.535 -7.906
162 H VAL 40 H VAL 40 -3.072 -11.041 -7.571
163 HA VAL 40 HA VAL 40 -3.696 -8.364 -7.196
164 HB VAL 40 HB VAL 40 -1.617 -9.380 -6.345
165 HG11 VAL 40 1HG1 VAL 40 -0.932 -10.743 -8.188
166 HG12 VAL 40 2HG1 VAL 40 0.358 -9.616 -7.768
167 HG13 VAL 40 3HG1 VAL 40 -0.649 -9.314 -9.186
168 HG21 VAL 40 3HG2 VAL 40 -1.135 -6.969 -8.087
169 HG22 VAL 40 1HG2 VAL 40 -0.107 -7.486 -6.749
170 HG23 VAL 40 2HG2 VAL 40 -1.763 -6.960 -6.441
171 H VAL 41 H VAL 41 -3.190 -10.043 -10.153
172 HA VAL 41 HA VAL 41 -2.727 -7.664 -11.674
173 HB VAL 41 HB VAL 41 -3.104 -9.048 -13.695
174 HG11 VAL 41 1HG1 VAL 41 -0.896 -8.963 -12.701
175 HG12 VAL 41 2HG1 VAL 41 -1.200 -10.563 -13.381
176 HG13 VAL 41 3HG1 VAL 41 -1.299 -10.310 -11.638
177 HG21 VAL 41 3HG2 VAL 41 -3.475 -11.478 -13.469
178 HG22 VAL 41 1HG2 VAL 41 -4.840 -10.552 -12.844
179 HG23 VAL 41 2HG2 VAL 41 -3.681 -11.277 -11.731
180 H ALA 42 H ALA 42 -5.626 -9.262 -10.529
181 HA ALA 42 HA ALA 42 -7.150 -7.217 -11.938
182 HB1 ALA 42 1HB ALA 42 -7.541 -9.356 -13.075
183 HB2 ALA 42 2HB ALA 42 -9.003 -8.759 -12.290
184 HB3 ALA 42 3HB ALA 42 -8.077 -10.065 -11.552
185 H ILE 43 H ILE 43 -7.281 -5.892 -10.130
186 HA ILE 43 HA ILE 43 -8.911 -7.023 -7.959
187 HB ILE 43 HB ILE 43 -6.808 -4.828 -7.698
188 HG12 ILE 43 2HG1 ILE 43 -6.822 -7.639 -6.559
189 HG13 ILE 43 1HG1 ILE 43 -5.816 -7.086 -7.889
190 HG21 ILE 43 1HG2 ILE 43 -7.283 -4.887 -5.299
191 HG22 ILE 43 2HG2 ILE 43 -8.573 -6.053 -5.586
192 HG23 ILE 43 3HG2 ILE 43 -8.705 -4.422 -6.234
193 HD11 ILE 43 3HD1 ILE 43 -4.583 -7.214 -5.778
194 HD12 ILE 43 1HD1 ILE 43 -5.699 -6.053 -5.067
195 HD13 ILE 43 2HD1 ILE 43 -4.650 -5.562 -6.397
196 HA PRO 44 HA PRO 44 -11.528 -3.652 -9.333
197 HB2 PRO 44 2HB PRO 44 -13.635 -4.186 -7.673
198 HB3 PRO 44 1HB PRO 44 -13.364 -5.053 -9.182
199 HG2 PRO 44 2HG PRO 44 -12.851 -5.916 -6.390
200 HG3 PRO 44 1HG PRO 44 -13.304 -6.881 -7.802
201 HD2 PRO 44 2HD PRO 44 -10.745 -6.674 -6.725
202 HD3 PRO 44 1HD PRO 44 -11.134 -7.252 -8.355
203 H CYS 45 H CYS 45 -11.630 -1.597 -8.558
204 HA CYS 45 HA CYS 45 -11.115 -1.186 -5.709
205 HB2 CYS 45 2HB CYS 45 -9.835 0.216 -8.054
206 HB3 CYS 45 1HB CYS 45 -9.720 0.838 -6.423
207 HA PRO 46 HA PRO 46 -14.679 1.453 -5.638
208 HB2 PRO 46 2HB PRO 46 -13.717 3.375 -3.890
209 HB3 PRO 46 1HB PRO 46 -14.451 1.845 -3.406
210 HG2 PRO 46 2HG PRO 46 -11.568 2.584 -3.644
211 HG3 PRO 46 1HG PRO 46 -12.376 1.600 -2.406
212 HD2 PRO 46 2HD PRO 46 -10.939 0.484 -4.359
213 HD3 PRO 46 1HD PRO 46 -12.431 -0.283 -3.781
214 H ILE 47 H ILE 47 -15.419 3.463 -6.381
215 HA ILE 47 HA ILE 47 -13.609 4.673 -8.282
216 HB ILE 47 HB ILE 47 -15.536 5.943 -9.108
217 HG12 ILE 47 2HG1 ILE 47 -17.115 4.506 -6.960
218 HG13 ILE 47 1HG1 ILE 47 -16.708 6.212 -6.944
219 HG21 ILE 47 1HG2 ILE 47 -15.113 3.752 -10.037
220 HG22 ILE 47 2HG2 ILE 47 -16.854 4.029 -9.943
221 HG23 ILE 47 3HG2 ILE 47 -16.064 2.996 -8.756
222 HD11 ILE 47 3HD1 ILE 47 -19.009 5.851 -7.636
223 HD12 ILE 47 1HD1 ILE 47 -18.457 4.834 -8.968
224 HD13 ILE 47 2HD1 ILE 47 -18.062 6.554 -8.948
225 H THR 48 H THR 48 -14.716 5.311 -5.147
226 HA THR 48 HA THR 48 -14.476 8.106 -5.138
227 HB THR 48 HB THR 48 -14.136 6.177 -2.829
228 HG1 THR 48 1HG THR 48 -16.352 6.379 -2.611
229 HG21 THR 48 3HG2 THR 48 -14.901 8.079 -1.463
230 HG22 THR 48 1HG2 THR 48 -15.023 9.076 -2.913
231 HG23 THR 48 2HG2 THR 48 -13.449 8.514 -2.357
232 H TYR 49 H TYR 49 -12.780 9.380 -4.872
233 HA TYR 49 HA TYR 49 -10.145 8.202 -5.020
234 HB2 TYR 49 2HB TYR 49 -10.866 9.993 -6.580
235 HB3 TYR 49 1HB TYR 49 -11.074 11.075 -5.218
236 HD1 TYR 49 1HD TYR 49 -8.609 9.238 -7.235
237 HD2 TYR 49 2HD TYR 49 -9.193 12.219 -4.259
238 HE1 TYR 49 1HE TYR 49 -6.286 9.962 -7.512
239 HE2 TYR 49 2HE TYR 49 -6.862 12.945 -4.519
240 HH TYR 49 HH TYR 49 -4.787 12.209 -5.354
241 H LEU 50 H LEU 50 -9.254 7.771 -3.129
242 HA LEU 50 HA LEU 50 -9.592 9.689 -0.953
243 HB2 LEU 50 2HB LEU 50 -9.427 6.677 -0.758
244 HB3 LEU 50 1HB LEU 50 -9.382 7.767 0.610
245 HG LEU 50 HG LEU 50 -11.730 7.493 -1.268
246 HD11 LEU 50 1HD1 LEU 50 -11.316 6.374 1.495
247 HD12 LEU 50 2HD1 LEU 50 -11.380 5.452 -0.011
248 HD13 LEU 50 3HD1 LEU 50 -12.812 6.307 0.560
249 HD21 LEU 50 3HD2 LEU 50 -12.931 8.743 0.476
250 HD22 LEU 50 1HD2 LEU 50 -11.601 9.685 -0.202
251 HD23 LEU 50 2HD2 LEU 50 -11.425 8.920 1.376
252 HA PRO 51 HA PRO 51 -5.232 9.597 -2.175
253 HB2 PRO 51 2HB PRO 51 -4.554 11.732 -0.541
254 HB3 PRO 51 1HB PRO 51 -5.066 11.878 -2.219
255 HG2 PRO 51 2HG PRO 51 -6.617 12.290 0.281
256 HG3 PRO 51 1HG PRO 51 -6.738 13.132 -1.272
257 HD2 PRO 51 2HD PRO 51 -8.520 11.271 -0.465
258 HD3 PRO 51 1HD PRO 51 -8.120 11.520 -2.179
259 H VAL 52 H VAL 52 -4.096 8.093 -1.290
260 HA VAL 52 HA VAL 52 -3.635 8.218 1.595
261 HB VAL 52 HB VAL 52 -3.311 5.774 1.653
262 HG11 VAL 52 1HG1 VAL 52 -5.662 5.078 1.460
263 HG12 VAL 52 2HG1 VAL 52 -6.017 6.554 0.566
264 HG13 VAL 52 3HG1 VAL 52 -5.509 6.649 2.250
265 HG21 VAL 52 3HG2 VAL 52 -2.667 5.386 -0.648
266 HG22 VAL 52 1HG2 VAL 52 -4.288 5.809 -1.206
267 HG23 VAL 52 2HG2 VAL 52 -4.038 4.363 -0.223
268 H CYS 53 H CYS 53 -1.548 7.595 2.240
269 HA CYS 53 HA CYS 53 0.371 7.999 0.084
270 HB2 CYS 53 2HB CYS 53 0.346 9.848 1.613
271 HB3 CYS 53 1HB CYS 53 0.551 8.823 3.010
272 H GLY 54 H GLY 54 1.802 6.467 -0.290
273 HA2 GLY 54 2HA GLY 54 1.771 4.168 1.503
274 HA3 GLY 54 1HA GLY 54 2.390 4.180 -0.139
275 H SER 55 H SER 55 3.777 3.104 1.968
276 HA SER 55 HA SER 55 5.645 4.625 3.270
277 HB2 SER 55 2HB SER 55 6.179 1.913 2.079
278 HB3 SER 55 1HB SER 55 6.854 2.591 3.557
279 HG SER 55 HG SER 55 5.058 2.222 4.599
280 H ASP 56 H ASP 56 5.465 4.003 -0.110
281 HA ASP 56 HA ASP 56 8.290 4.413 -0.661
282 HB2 ASP 56 2HB ASP 56 6.836 2.781 -1.942
283 HB3 ASP 56 1HB ASP 56 5.994 4.161 -2.623
284 H TYR 57 H TYR 57 5.898 6.362 0.242
285 HA TYR 57 HA TYR 57 5.535 8.553 0.323
286 HB2 TYR 57 2HB TYR 57 8.136 8.832 -1.205
287 HB3 TYR 57 1HB TYR 57 7.257 10.165 -0.469
288 HD1 TYR 57 2HD TYR 57 6.687 9.739 2.120
289 HD2 TYR 57 1HD TYR 57 9.889 7.942 -0.020
290 HE1 TYR 57 2HE TYR 57 7.865 9.327 4.238
291 HE2 TYR 57 1HE TYR 57 11.071 7.522 2.091
292 HH TYR 57 HH TYR 57 11.072 8.547 4.408
293 H ILE 58 H ILE 58 4.572 6.926 -1.800
294 HA ILE 58 HA ILE 58 4.122 8.936 -3.892
295 HB ILE 58 HB ILE 58 3.627 5.941 -3.952
296 HG12 ILE 58 2HG1 ILE 58 5.982 6.483 -3.943
297 HG13 ILE 58 1HG1 ILE 58 5.513 5.825 -5.508
298 HG21 ILE 58 1HG2 ILE 58 2.041 7.142 -5.368
299 HG22 ILE 58 2HG2 ILE 58 3.189 6.214 -6.334
300 HG23 ILE 58 3HG2 ILE 58 3.380 7.958 -6.181
301 HD11 ILE 58 3HD1 ILE 58 6.031 8.733 -4.863
302 HD12 ILE 58 1HD1 ILE 58 5.467 8.126 -6.422
303 HD13 ILE 58 2HD1 ILE 58 7.054 7.662 -5.821
304 H THR 59 H THR 59 2.098 9.744 -4.130
305 HA THR 59 HA THR 59 0.126 8.950 -2.184
306 HB THR 59 HB THR 59 0.048 11.120 -4.303
307 HG1 THR 59 1HG THR 59 1.644 11.305 -2.629
308 HG21 THR 59 3HG2 THR 59 -2.191 10.480 -3.628
309 HG22 THR 59 1HG2 THR 59 -1.812 12.036 -2.894
310 HG23 THR 59 2HG2 THR 59 -1.751 10.549 -1.930
311 H TYR 60 H TYR 60 -1.503 7.664 -2.613
312 HA TYR 60 HA TYR 60 -1.883 6.764 -5.371
313 HB2 TYR 60 2HB TYR 60 -2.478 5.390 -2.750
314 HB3 TYR 60 1HB TYR 60 -2.891 4.721 -4.333
315 HD1 TYR 60 1HD TYR 60 -1.046 4.102 -5.900
316 HD2 TYR 60 2HD TYR 60 -0.282 5.247 -1.884
317 HE1 TYR 60 1HE TYR 60 1.203 3.140 -6.060
318 HE2 TYR 60 2HE TYR 60 1.972 4.277 -2.037
319 HH TYR 60 HH TYR 60 3.406 3.324 -4.961
320 H GLY 61 H GLY 61 -4.031 6.294 -6.039
321 HA2 GLY 61 2HA GLY 61 -5.764 8.468 -5.473
322 HA3 GLY 61 1HA GLY 61 -6.095 7.139 -6.583
323 H ASN 62 H ASN 62 -5.551 5.259 -4.298
324 HA ASN 62 HA ASN 62 -7.123 5.808 -2.141
325 HB2 ASN 62 2HB ASN 62 -9.076 4.328 -2.379
326 HB3 ASN 62 1HB ASN 62 -9.102 5.594 -3.572
327 HD21 ASN 62 1HD2 ASN 62 -10.472 4.531 -4.873
328 HD22 ASN 62 2HD2 ASN 62 -10.093 3.142 -5.808
329 H GLU 63 H GLU 63 -7.661 3.725 -0.962
330 HA GLU 63 HA GLU 63 -5.095 2.618 -0.527
331 HB2 GLU 63 2HB GLU 63 -6.043 1.419 1.336
332 HB3 GLU 63 1HB GLU 63 -6.540 3.094 1.353
333 HG2 GLU 63 2HG GLU 63 -8.203 0.691 0.574
334 HG3 GLU 63 1HG GLU 63 -8.373 1.656 2.032
335 H CYS 64 H CYS 64 -7.898 1.486 -2.190
336 HA CYS 64 HA CYS 64 -7.180 -1.214 -2.352
337 HB2 CYS 64 2HB CYS 64 -9.366 -0.453 -3.102
338 HB3 CYS 64 1HB CYS 64 -8.618 0.475 -4.401
339 H HIS 65 H HIS 65 -6.278 1.540 -4.402
340 HA HIS 65 HA HIS 65 -4.657 0.028 -6.179
341 HB2 HIS 65 2HB HIS 65 -4.521 2.961 -5.470
342 HB3 HIS 65 1HB HIS 65 -3.512 2.219 -6.701
343 HD1 HIS 65 1HD HIS 65 -5.084 0.953 -8.653
344 HD2 HIS 65 2HD HIS 65 -6.751 4.060 -6.476
345 HE1 HIS 65 1HE HIS 65 -7.056 1.725 -9.986
346 HE2 HIS 65 2HE HIS 65 -8.164 3.425 -8.555
347 H LEU 66 H LEU 66 -4.010 1.727 -3.202
348 HA LEU 66 HA LEU 66 -1.255 1.326 -3.045
349 HB2 LEU 66 2HB LEU 66 -2.369 2.831 -1.551
350 HB3 LEU 66 1HB LEU 66 -3.369 1.540 -0.922
351 HG LEU 66 HG LEU 66 -1.415 0.537 0.161
352 HD11 LEU 66 1HD1 LEU 66 0.329 1.272 -1.361
353 HD12 LEU 66 2HD1 LEU 66 0.692 1.768 0.293
354 HD13 LEU 66 3HD1 LEU 66 0.074 2.945 -0.865
355 HD21 LEU 66 3HD2 LEU 66 -1.133 2.202 1.868
356 HD22 LEU 66 1HD2 LEU 66 -2.813 2.126 1.347
357 HD23 LEU 66 2HD2 LEU 66 -1.780 3.453 0.798
358 H CYS 67 H CYS 67 -3.919 -0.699 -1.805
359 HA CYS 67 HA CYS 67 -2.313 -2.786 -0.881
360 HB2 CYS 67 2HB CYS 67 -4.584 -2.777 -0.211
361 HB3 CYS 67 1HB CYS 67 -5.168 -2.827 -1.880
362 H THR 68 H THR 68 -3.532 -2.207 -4.171
363 HA THR 68 HA THR 68 -2.734 -4.639 -5.315
364 HB THR 68 HB THR 68 -2.589 -1.903 -6.625
365 HG1 THR 68 1HG THR 68 -4.715 -3.154 -5.644
366 HG21 THR 68 3HG2 THR 68 -1.509 -3.701 -7.913
367 HG22 THR 68 1HG2 THR 68 -2.977 -3.147 -8.719
368 HG23 THR 68 2HG2 THR 68 -2.981 -4.662 -7.814
369 H GLU 69 H GLU 69 -0.936 -1.578 -4.919
370 HA GLU 69 HA GLU 69 1.485 -2.499 -6.013
371 HB2 GLU 69 2HB GLU 69 0.975 -0.259 -4.066
372 HB3 GLU 69 1HB GLU 69 2.432 -0.484 -5.017
373 HG2 GLU 69 2HG GLU 69 -0.322 0.207 -6.006
374 HG3 GLU 69 1HG GLU 69 1.131 1.200 -6.051
375 H SER 70 H SER 70 0.138 -2.505 -2.805
376 HA SER 70 HA SER 70 2.456 -3.162 -1.379
377 HB2 SER 70 2HB SER 70 0.159 -2.328 -0.500
378 HB3 SER 70 1HB SER 70 -0.318 -4.024 -0.559
379 HG SER 70 HG SER 70 1.831 -2.885 0.824
380 H LEU 71 H LEU 71 -0.038 -5.149 -2.931
381 HA LEU 71 HA LEU 71 1.126 -7.635 -2.167
382 HB2 LEU 71 2HB LEU 71 -0.762 -6.974 -4.425
383 HB3 LEU 71 1HB LEU 71 -0.338 -8.598 -3.932
384 HG LEU 71 HG LEU 71 -1.838 -6.590 -2.246
385 HD11 LEU 71 1HD1 LEU 71 -3.153 -7.403 -4.122
386 HD12 LEU 71 2HD1 LEU 71 -3.753 -8.051 -2.596
387 HD13 LEU 71 3HD1 LEU 71 -2.788 -9.068 -3.670
388 HD21 LEU 71 3HD2 LEU 71 -0.505 -8.109 -0.873
389 HD22 LEU 71 1HD2 LEU 71 -1.179 -9.490 -1.741
390 HD23 LEU 71 2HD2 LEU 71 -2.220 -8.484 -0.736
391 H LYS 72 H LYS 72 1.397 -5.556 -4.976
392 HA LYS 72 HA LYS 72 2.947 -7.195 -6.627
393 HB2 LYS 72 2HB LYS 72 2.871 -4.193 -6.375
394 HB3 LYS 72 1HB LYS 72 3.847 -5.023 -7.573
395 HG2 LYS 72 2HG LYS 72 1.910 -5.905 -8.657
396 HG3 LYS 72 1HG LYS 72 0.862 -5.349 -7.351
397 HD2 LYS 72 2HD LYS 72 0.733 -3.894 -9.342
398 HD3 LYS 72 1HD LYS 72 1.309 -3.025 -7.932
399 HE2 LYS 72 2HE LYS 72 3.646 -3.366 -8.774
400 HE3 LYS 72 1HE LYS 72 2.950 -4.081 -10.228
401 HZ1 LYS 72 3HZ LYS 72 1.835 -1.979 -10.669
402 HZ2 LYS 72 1HZ LYS 72 3.509 -1.770 -10.532
403 HZ3 LYS 72 2HZ LYS 72 2.481 -1.321 -9.252
404 H SER 73 H SER 73 3.973 -4.949 -4.100
405 HA SER 73 HA SER 73 6.741 -5.684 -4.565
406 HB2 SER 73 2HB SER 73 7.216 -3.921 -2.912
407 HB3 SER 73 1HB SER 73 6.299 -3.345 -4.291
408 HG SER 73 HG SER 73 4.486 -3.200 -3.115
409 H ASN 74 H ASN 74 4.196 -6.653 -2.656
410 HA ASN 74 HA ASN 74 3.852 -7.974 -0.954
411 HB2 ASN 74 2HB ASN 74 5.212 -9.634 -2.190
412 HB3 ASN 74 1HB ASN 74 6.666 -9.026 -1.405
413 HD21 ASN 74 1HD2 ASN 74 7.089 -9.628 0.703
414 HD22 ASN 74 2HD2 ASN 74 6.199 -10.810 1.568
415 H GLY 75 H GLY 75 3.689 -6.072 0.205
416 HA2 GLY 75 2HA GLY 75 3.755 -5.250 2.364
417 HA3 GLY 75 1HA GLY 75 5.004 -6.418 2.731
418 H ARG 76 H ARG 76 5.897 -4.563 0.040
419 HA ARG 76 HA ARG 76 7.871 -3.178 1.616
420 HB2 ARG 76 2HB ARG 76 8.376 -4.103 -0.640
421 HB3 ARG 76 1HB ARG 76 7.211 -2.954 -1.289
422 HG2 ARG 76 2HG ARG 76 8.571 -1.092 -0.543
423 HG3 ARG 76 1HG ARG 76 9.757 -2.224 0.109
424 HD2 ARG 76 2HD ARG 76 10.163 -3.121 -2.107
425 HD3 ARG 76 1HD ARG 76 8.928 -2.058 -2.784
426 HE ARG 76 HE ARG 76 10.603 -0.352 -1.572
427 HH11 ARG 76 1HH1 ARG 76 11.035 -2.847 -4.032
428 HH12 ARG 76 2HH1 ARG 76 12.456 -2.175 -4.672
429 HH21 ARG 76 1HH2 ARG 76 12.536 0.592 -2.464
430 HH22 ARG 76 2HH2 ARG 76 13.325 -0.151 -3.773
431 H VAL 77 H VAL 77 5.459 -2.052 -0.766
432 HA VAL 77 HA VAL 77 5.430 0.425 0.715
433 HB VAL 77 HB VAL 77 5.668 0.726 -1.704
434 HG11 VAL 77 1HG1 VAL 77 3.035 -0.696 -2.001
435 HG12 VAL 77 2HG1 VAL 77 4.611 -1.283 -2.524
436 HG13 VAL 77 3HG1 VAL 77 3.900 0.139 -3.287
437 HG21 VAL 77 3HG2 VAL 77 4.467 2.451 -0.506
438 HG22 VAL 77 1HG2 VAL 77 2.947 1.596 -0.754
439 HG23 VAL 77 2HG2 VAL 77 3.810 2.271 -2.135
440 H GLN 78 H GLN 78 4.003 0.755 2.223
441 HA GLN 78 HA GLN 78 1.467 -0.646 2.041
442 HB2 GLN 78 2HB GLN 78 3.215 -1.739 3.522
443 HB3 GLN 78 1HB GLN 78 3.160 -0.297 4.516
444 HG2 GLN 78 2HG GLN 78 0.924 -0.747 5.174
445 HG3 GLN 78 1HG GLN 78 0.772 -2.036 3.971
446 HE21 GLN 78 1HE2 GLN 78 1.884 -3.915 4.283
447 HE22 GLN 78 2HE2 GLN 78 2.426 -4.419 5.833
448 H PHE 79 H PHE 79 0.130 0.420 4.001
449 HA PHE 79 HA PHE 79 -0.252 3.147 3.340
450 HB2 PHE 79 2HB PHE 79 -2.033 1.590 4.056
451 HB3 PHE 79 1HB PHE 79 -1.313 1.517 5.653
452 HD1 PHE 79 1HD PHE 79 -3.232 3.519 3.285
453 HD2 PHE 79 2HD PHE 79 -1.601 3.346 7.209
454 HE1 PHE 79 1HE PHE 79 -4.678 5.380 3.966
455 HE2 PHE 79 2HE PHE 79 -3.041 5.204 7.895
456 HZ PHE 79 HZ PHE 79 -4.584 6.222 6.272
457 H LEU 80 H LEU 80 1.126 4.610 3.867
458 HA LEU 80 HA LEU 80 2.750 4.444 6.248
459 HB2 LEU 80 2HB LEU 80 3.679 5.207 4.114
460 HB3 LEU 80 1HB LEU 80 2.543 6.522 4.046
461 HG LEU 80 HG LEU 80 3.617 7.431 6.125
462 HD11 LEU 80 1HD1 LEU 80 4.629 5.410 6.953
463 HD12 LEU 80 2HD1 LEU 80 5.869 6.633 6.648
464 HD13 LEU 80 3HD1 LEU 80 5.636 5.306 5.510
465 HD21 LEU 80 3HD2 LEU 80 5.552 8.332 4.941
466 HD22 LEU 80 1HD2 LEU 80 4.107 8.328 3.931
467 HD23 LEU 80 2HD2 LEU 80 5.357 7.104 3.689
468 H HIS 81 H HIS 81 0.439 6.718 4.793
469 HA HIS 81 HA HIS 81 -0.880 7.118 7.255
470 HB2 HIS 81 2HB HIS 81 -0.565 9.564 7.451
471 HB3 HIS 81 1HB HIS 81 0.945 8.704 7.697
472 HD1 HIS 81 1HD HIS 81 -0.810 11.006 5.234
473 HD2 HIS 81 2HD HIS 81 2.967 9.392 5.941
474 HE1 HIS 81 1HE HIS 81 0.788 12.233 3.703
475 HE2 HIS 81 2HE HIS 81 3.048 11.430 4.396
476 H ASP 82 H ASP 82 -2.755 8.507 7.003
477 HA ASP 82 HA ASP 82 -4.005 8.133 4.464
478 HB2 ASP 82 2HB ASP 82 -5.169 8.072 6.748
479 HB3 ASP 82 1HB ASP 82 -4.946 9.809 6.812
480 H GLY 83 H GLY 83 -4.695 9.825 3.075
481 HA2 GLY 83 2HA GLY 83 -4.804 11.973 2.283
482 HA3 GLY 83 1HA GLY 83 -3.742 12.507 3.585
483 H SER 84 H SER 84 -3.327 13.383 1.065
484 HA SER 84 HA SER 84 -1.540 12.018 -0.540
485 HB2 SER 84 2HB SER 84 -1.654 14.973 0.096
486 HB3 SER 84 1HB SER 84 -0.941 14.247 -1.348
487 HG SER 84 HG SER 84 -2.814 14.051 -2.179
488 H CYS 85 H CYS 85 0.763 11.943 -0.579
489 HA CYS 85 HA CYS 85 2.051 11.878 1.923
490 HB2 CYS 85 2HB CYS 85 3.293 11.942 -0.845
491 HB3 CYS 85 1HB CYS 85 4.108 11.551 0.669
Start of MODEL 8
1 H1 SER 20 1HT SER 20 -10.035 11.457 22.300
2 H2 SER 20 2HT SER 20 -11.585 10.807 22.481
3 H3 SER 20 3HT SER 20 -10.345 9.855 21.864
4 HA SER 20 HA SER 20 -9.173 9.967 23.914
5 HB2 SER 20 2HB SER 20 -11.576 11.518 24.912
6 HB3 SER 20 1HB SER 20 -10.151 11.072 25.842
7 HG SER 20 HG SER 20 -9.359 12.869 25.196
8 H GLU 21 H GLU 21 -12.707 9.937 24.603
9 HA GLU 21 HA GLU 21 -12.420 7.051 24.953
10 HB2 GLU 21 2HB GLU 21 -14.352 7.170 26.475
11 HB3 GLU 21 1HB GLU 21 -13.016 8.147 27.056
12 HG2 GLU 21 2HG GLU 21 -14.100 10.149 26.492
13 HG3 GLU 21 1HG GLU 21 -15.293 9.310 25.495
14 H ALA 22 H ALA 22 -14.340 5.810 24.327
15 HA ALA 22 HA ALA 22 -15.810 5.093 22.795
16 HB1 ALA 22 1HB ALA 22 -17.415 6.646 21.752
17 HB2 ALA 22 2HB ALA 22 -16.447 8.019 22.289
18 HB3 ALA 22 3HB ALA 22 -17.257 6.995 23.473
19 H ALA 23 H ALA 23 -14.467 8.018 21.417
20 HA ALA 23 HA ALA 23 -13.348 6.451 19.222
21 HB1 ALA 23 1HB ALA 23 -12.936 8.675 18.176
22 HB2 ALA 23 2HB ALA 23 -13.697 9.441 19.571
23 HB3 ALA 23 3HB ALA 23 -14.646 8.399 18.504
24 H SER 24 H SER 24 -11.677 5.573 20.348
25 HA SER 24 HA SER 24 -9.947 7.315 21.909
26 HB2 SER 24 2HB SER 24 -9.963 4.320 21.593
27 HB3 SER 24 1HB SER 24 -9.010 5.237 22.756
28 HG SER 24 HG SER 24 -10.876 5.943 23.709
29 H LEU 25 H LEU 25 -10.182 5.962 18.832
30 HA LEU 25 HA LEU 25 -7.676 6.892 18.042
31 HB2 LEU 25 2HB LEU 25 -6.950 4.536 17.190
32 HB3 LEU 25 1HB LEU 25 -6.593 5.010 18.833
33 HG LEU 25 HG LEU 25 -8.565 3.649 19.592
34 HD11 LEU 25 1HD1 LEU 25 -9.861 3.609 17.548
35 HD12 LEU 25 2HD1 LEU 25 -9.517 1.978 18.131
36 HD13 LEU 25 3HD1 LEU 25 -8.608 2.642 16.771
37 HD21 LEU 25 3HD2 LEU 25 -6.336 2.758 19.732
38 HD22 LEU 25 1HD2 LEU 25 -6.431 2.180 18.068
39 HD23 LEU 25 2HD2 LEU 25 -7.475 1.480 19.308
40 H SER 26 H SER 26 -7.460 6.889 15.809
41 HA SER 26 HA SER 26 -9.840 6.072 14.322
42 HB2 SER 26 2HB SER 26 -7.882 8.308 13.668
43 HB3 SER 26 1HB SER 26 -9.360 7.922 12.782
44 HG SER 26 HG SER 26 -9.665 9.666 14.205
45 HA PRO 27 HA PRO 27 -6.255 3.630 13.054
46 HB2 PRO 27 2HB PRO 27 -7.357 1.209 13.065
47 HB3 PRO 27 1HB PRO 27 -6.940 2.043 14.567
48 HG2 PRO 27 2HG PRO 27 -9.599 1.611 13.322
49 HG3 PRO 27 1HG PRO 27 -9.174 1.741 15.033
50 HD2 PRO 27 2HD PRO 27 -10.232 3.789 13.370
51 HD3 PRO 27 1HD PRO 27 -9.607 3.974 15.021
52 H LYS 28 H LYS 28 -5.997 4.303 10.997
53 HA LYS 28 HA LYS 28 -7.485 2.697 9.089
54 HB2 LYS 28 2HB LYS 28 -7.949 5.051 8.599
55 HB3 LYS 28 1HB LYS 28 -6.222 5.396 8.530
56 HG2 LYS 28 2HG LYS 28 -5.963 3.948 6.599
57 HG3 LYS 28 1HG LYS 28 -7.658 3.497 6.676
58 HD2 LYS 28 2HD LYS 28 -6.667 6.303 6.214
59 HD3 LYS 28 1HD LYS 28 -7.091 5.183 4.923
60 HE2 LYS 28 2HE LYS 28 -9.362 5.022 5.862
61 HE3 LYS 28 1HE LYS 28 -8.932 6.223 7.081
62 HZ1 LYS 28 3HZ LYS 28 -10.022 7.343 5.328
63 HZ2 LYS 28 1HZ LYS 28 -9.047 6.586 4.155
64 HZ3 LYS 28 2HZ LYS 28 -8.371 7.709 5.211
65 H LYS 29 H LYS 29 -6.435 1.403 7.897
66 HA LYS 29 HA LYS 29 -3.566 1.534 7.695
67 HB2 LYS 29 2HB LYS 29 -4.353 0.123 9.710
68 HB3 LYS 29 1HB LYS 29 -5.106 -0.933 8.531
69 HG2 LYS 29 2HG LYS 29 -3.001 -1.845 9.232
70 HG3 LYS 29 1HG LYS 29 -2.901 -1.352 7.539
71 HD2 LYS 29 2HD LYS 29 -1.717 0.654 8.129
72 HD3 LYS 29 1HD LYS 29 -1.968 0.341 9.848
73 HE2 LYS 29 2HE LYS 29 -0.395 -1.389 7.959
74 HE3 LYS 29 1HE LYS 29 0.305 -0.235 9.095
75 HZ1 LYS 29 3HZ LYS 29 -1.327 -2.611 9.836
76 HZ2 LYS 29 1HZ LYS 29 -0.640 -1.512 10.915
77 HZ3 LYS 29 2HZ LYS 29 0.329 -2.490 9.955
78 H VAL 30 H VAL 30 -3.028 0.229 5.764
79 HA VAL 30 HA VAL 30 -5.119 0.271 3.868
80 HB VAL 30 HB VAL 30 -2.847 0.602 3.052
81 HG11 VAL 30 1HG1 VAL 30 -2.224 -2.195 3.955
82 HG12 VAL 30 2HG1 VAL 30 -1.632 -0.706 4.689
83 HG13 VAL 30 3HG1 VAL 30 -1.147 -1.133 3.044
84 HG21 VAL 30 3HG2 VAL 30 -3.981 -2.004 2.041
85 HG22 VAL 30 1HG2 VAL 30 -2.727 -1.067 1.228
86 HG23 VAL 30 2HG2 VAL 30 -4.332 -0.389 1.427
87 H ASP 31 H ASP 31 -6.810 -1.011 4.129
88 HA ASP 31 HA ASP 31 -6.452 -3.708 5.064
89 HB2 ASP 31 2HB ASP 31 -8.609 -2.378 5.430
90 HB3 ASP 31 1HB ASP 31 -8.932 -2.597 3.712
91 H CYS 32 H CYS 32 -5.134 -4.601 3.719
92 HA CYS 32 HA CYS 32 -5.682 -4.560 0.883
93 HB2 CYS 32 2HB CYS 32 -3.369 -4.233 1.874
94 HB3 CYS 32 1HB CYS 32 -3.445 -5.900 2.416
95 H SER 33 H SER 33 -6.192 -6.349 3.713
96 HA SER 33 HA SER 33 -6.127 -8.957 2.929
97 HB2 SER 33 2HB SER 33 -7.938 -9.063 4.852
98 HB3 SER 33 1HB SER 33 -6.240 -8.714 5.182
99 HG SER 33 HG SER 33 -8.207 -6.655 4.745
100 H ILE 34 H ILE 34 -8.792 -6.649 2.483
101 HA ILE 34 HA ILE 34 -10.483 -8.736 1.512
102 HB ILE 34 HB ILE 34 -12.021 -6.930 0.734
103 HG12 ILE 34 2HG1 ILE 34 -9.989 -5.064 1.996
104 HG13 ILE 34 1HG1 ILE 34 -10.310 -5.193 0.273
105 HG21 ILE 34 1HG2 ILE 34 -12.636 -6.164 2.984
106 HG22 ILE 34 2HG2 ILE 34 -11.097 -6.777 3.587
107 HG23 ILE 34 3HG2 ILE 34 -12.288 -7.892 2.918
108 HD11 ILE 34 3HD1 ILE 34 -12.592 -4.381 0.643
109 HD12 ILE 34 1HD1 ILE 34 -11.389 -3.242 1.242
110 HD13 ILE 34 2HD1 ILE 34 -12.266 -4.272 2.374
111 H TYR 35 H TYR 35 -8.126 -6.682 0.040
112 HA TYR 35 HA TYR 35 -9.179 -7.191 -2.613
113 HB2 TYR 35 2HB TYR 35 -6.728 -5.625 -1.803
114 HB3 TYR 35 1HB TYR 35 -7.405 -5.715 -3.421
115 HD1 TYR 35 1HD TYR 35 -9.862 -4.853 -3.691
116 HD2 TYR 35 2HD TYR 35 -7.373 -3.943 -0.369
117 HE1 TYR 35 1HE TYR 35 -11.252 -2.880 -3.189
118 HE2 TYR 35 2HE TYR 35 -8.751 -1.988 0.146
119 HH TYR 35 HH TYR 35 -10.267 -0.440 -0.981
120 H LYS 36 H LYS 36 -6.816 -8.429 -0.490
121 HA LYS 36 HA LYS 36 -5.002 -9.644 -2.246
122 HB2 LYS 36 2HB LYS 36 -5.861 -10.605 0.497
123 HB3 LYS 36 1HB LYS 36 -4.490 -11.247 -0.400
124 HG2 LYS 36 2HG LYS 36 -3.442 -9.050 -0.363
125 HG3 LYS 36 1HG LYS 36 -4.808 -8.397 0.534
126 HD2 LYS 36 2HD LYS 36 -3.056 -8.815 2.109
127 HD3 LYS 36 1HD LYS 36 -4.274 -10.065 2.351
128 HE2 LYS 36 2HE LYS 36 -2.936 -11.626 1.028
129 HE3 LYS 36 1HE LYS 36 -1.729 -10.374 0.766
130 HZ1 LYS 36 3HZ LYS 36 -2.480 -11.472 3.423
131 HZ2 LYS 36 1HZ LYS 36 -1.298 -10.320 3.127
132 HZ3 LYS 36 2HZ LYS 36 -1.100 -11.893 2.572
133 H LYS 37 H LYS 37 -8.215 -10.362 -1.800
134 HA LYS 37 HA LYS 37 -8.207 -13.143 -2.459
135 HB2 LYS 37 2HB LYS 37 -10.451 -11.133 -2.723
136 HB3 LYS 37 1HB LYS 37 -10.614 -12.883 -2.725
137 HG2 LYS 37 2HG LYS 37 -9.687 -11.191 -0.401
138 HG3 LYS 37 1HG LYS 37 -11.267 -11.957 -0.571
139 HD2 LYS 37 2HD LYS 37 -10.255 -14.150 -0.508
140 HD3 LYS 37 1HD LYS 37 -8.642 -13.440 -0.480
141 HE2 LYS 37 2HE LYS 37 -9.152 -12.392 1.674
142 HE3 LYS 37 1HE LYS 37 -10.751 -13.134 1.649
143 HZ1 LYS 37 3HZ LYS 37 -8.174 -14.606 1.647
144 HZ2 LYS 37 1HZ LYS 37 -9.711 -15.300 1.646
145 HZ3 LYS 37 2HZ LYS 37 -9.198 -14.415 2.981
146 H TYR 38 H TYR 38 -8.002 -10.205 -4.260
147 HA TYR 38 HA TYR 38 -8.791 -11.443 -6.773
148 HB2 TYR 38 2HB TYR 38 -7.765 -8.669 -6.150
149 HB3 TYR 38 1HB TYR 38 -8.401 -9.192 -7.704
150 HD1 TYR 38 1HD TYR 38 -10.899 -9.969 -7.680
151 HD2 TYR 38 2HD TYR 38 -9.107 -7.627 -4.626
152 HE1 TYR 38 1HE TYR 38 -13.118 -9.153 -7.003
153 HE2 TYR 38 2HE TYR 38 -11.320 -6.815 -3.936
154 HH TYR 38 HH TYR 38 -13.544 -6.505 -5.056
155 HA PRO 39 HA PRO 39 -4.555 -12.385 -7.958
156 HB2 PRO 39 2HB PRO 39 -4.650 -11.579 -10.616
157 HB3 PRO 39 1HB PRO 39 -5.191 -13.159 -10.039
158 HG2 PRO 39 2HG PRO 39 -6.782 -10.706 -10.642
159 HG3 PRO 39 1HG PRO 39 -7.176 -12.402 -10.982
160 HD2 PRO 39 2HD PRO 39 -8.295 -11.069 -8.944
161 HD3 PRO 39 1HD PRO 39 -7.875 -12.788 -8.797
162 H VAL 40 H VAL 40 -2.622 -11.202 -7.968
163 HA VAL 40 HA VAL 40 -2.739 -8.573 -7.130
164 HB VAL 40 HB VAL 40 -0.334 -8.593 -7.211
165 HG11 VAL 40 1HG1 VAL 40 0.063 -10.537 -5.746
166 HG12 VAL 40 2HG1 VAL 40 -1.508 -11.181 -6.219
167 HG13 VAL 40 3HG1 VAL 40 -1.411 -9.661 -5.333
168 HG21 VAL 40 3HG2 VAL 40 0.041 -9.714 -9.330
169 HG22 VAL 40 1HG2 VAL 40 -0.590 -11.221 -8.672
170 HG23 VAL 40 2HG2 VAL 40 0.914 -10.549 -8.044
171 H VAL 41 H VAL 41 -2.779 -9.670 -10.332
172 HA VAL 41 HA VAL 41 -1.714 -7.146 -11.328
173 HB VAL 41 HB VAL 41 -0.882 -9.208 -12.389
174 HG11 VAL 41 1HG1 VAL 41 -3.717 -9.667 -13.261
175 HG12 VAL 41 2HG1 VAL 41 -2.778 -10.653 -12.137
176 HG13 VAL 41 3HG1 VAL 41 -2.313 -10.569 -13.839
177 HG21 VAL 41 3HG2 VAL 41 -1.233 -8.589 -14.756
178 HG22 VAL 41 1HG2 VAL 41 -0.899 -7.185 -13.742
179 HG23 VAL 41 2HG2 VAL 41 -2.548 -7.523 -14.264
180 H ALA 42 H ALA 42 -4.751 -8.769 -10.809
181 HA ALA 42 HA ALA 42 -6.086 -6.526 -12.098
182 HB1 ALA 42 1HB ALA 42 -7.898 -7.968 -12.848
183 HB2 ALA 42 2HB ALA 42 -7.079 -9.381 -12.184
184 HB3 ALA 42 3HB ALA 42 -6.364 -8.500 -13.535
185 H ILE 43 H ILE 43 -6.448 -5.446 -10.239
186 HA ILE 43 HA ILE 43 -8.198 -6.783 -8.312
187 HB ILE 43 HB ILE 43 -6.074 -4.700 -7.670
188 HG12 ILE 43 2HG1 ILE 43 -6.242 -7.644 -6.949
189 HG13 ILE 43 1HG1 ILE 43 -5.099 -6.901 -8.052
190 HG21 ILE 43 1HG2 ILE 43 -8.072 -4.411 -6.295
191 HG22 ILE 43 2HG2 ILE 43 -6.726 -5.012 -5.332
192 HG23 ILE 43 3HG2 ILE 43 -8.014 -6.111 -5.831
193 HD11 ILE 43 3HD1 ILE 43 -4.052 -7.390 -5.928
194 HD12 ILE 43 1HD1 ILE 43 -5.261 -6.408 -5.089
195 HD13 ILE 43 2HD1 ILE 43 -4.135 -5.649 -6.212
196 HA PRO 44 HA PRO 44 -10.717 -3.361 -9.862
197 HB2 PRO 44 2HB PRO 44 -12.753 -4.641 -8.159
198 HB3 PRO 44 1HB PRO 44 -12.809 -4.305 -9.888
199 HG2 PRO 44 2HG PRO 44 -12.552 -6.809 -8.945
200 HG3 PRO 44 1HG PRO 44 -11.766 -6.281 -10.442
201 HD2 PRO 44 2HD PRO 44 -10.591 -6.656 -7.724
202 HD3 PRO 44 1HD PRO 44 -9.923 -7.049 -9.325
203 H CYS 45 H CYS 45 -10.968 -1.455 -8.884
204 HA CYS 45 HA CYS 45 -10.803 -1.388 -5.977
205 HB2 CYS 45 2HB CYS 45 -9.817 0.559 -8.055
206 HB3 CYS 45 1HB CYS 45 -9.772 0.874 -6.323
207 HA PRO 46 HA PRO 46 -14.756 0.620 -5.947
208 HB2 PRO 46 2HB PRO 46 -14.274 2.344 -3.819
209 HB3 PRO 46 1HB PRO 46 -14.847 0.682 -3.663
210 HG2 PRO 46 2HG PRO 46 -12.111 1.804 -3.317
211 HG3 PRO 46 1HG PRO 46 -12.880 0.460 -2.463
212 HD2 PRO 46 2HD PRO 46 -11.025 0.116 -4.401
213 HD3 PRO 46 1HD PRO 46 -12.306 -1.065 -4.113
214 H ILE 47 H ILE 47 -15.648 2.658 -6.472
215 HA ILE 47 HA ILE 47 -13.722 4.245 -7.897
216 HB ILE 47 HB ILE 47 -15.744 5.425 -8.892
217 HG12 ILE 47 2HG1 ILE 47 -17.878 4.001 -8.836
218 HG13 ILE 47 1HG1 ILE 47 -17.185 3.190 -7.451
219 HG21 ILE 47 1HG2 ILE 47 -15.428 2.466 -9.323
220 HG22 ILE 47 2HG2 ILE 47 -14.498 3.749 -10.093
221 HG23 ILE 47 3HG2 ILE 47 -16.218 3.578 -10.439
222 HD11 ILE 47 3HD1 ILE 47 -17.899 6.106 -7.625
223 HD12 ILE 47 1HD1 ILE 47 -17.165 5.311 -6.232
224 HD13 ILE 47 2HD1 ILE 47 -18.784 4.851 -6.754
225 H THR 48 H THR 48 -15.036 4.376 -4.922
226 HA THR 48 HA THR 48 -15.171 7.201 -4.578
227 HB THR 48 HB THR 48 -14.678 5.075 -2.478
228 HG1 THR 48 1HG THR 48 -17.184 6.104 -3.349
229 HG21 THR 48 3HG2 THR 48 -16.014 7.793 -2.333
230 HG22 THR 48 1HG2 THR 48 -14.408 7.404 -1.719
231 HG23 THR 48 2HG2 THR 48 -15.838 6.666 -0.993
232 H TYR 49 H TYR 49 -13.520 8.546 -4.093
233 HA TYR 49 HA TYR 49 -10.835 7.468 -4.282
234 HB2 TYR 49 2HB TYR 49 -11.668 9.400 -5.689
235 HB3 TYR 49 1HB TYR 49 -11.794 10.335 -4.208
236 HD1 TYR 49 2HD TYR 49 -9.748 11.033 -3.027
237 HD2 TYR 49 1HD TYR 49 -9.568 9.012 -6.751
238 HE1 TYR 49 2HE TYR 49 -7.418 11.772 -3.303
239 HE2 TYR 49 1HE TYR 49 -7.242 9.745 -7.048
240 HH TYR 49 HH TYR 49 -5.807 11.561 -6.256
241 H LEU 50 H LEU 50 -9.616 7.247 -2.517
242 HA LEU 50 HA LEU 50 -10.167 8.869 -0.156
243 HB2 LEU 50 2HB LEU 50 -9.449 5.908 -0.102
244 HB3 LEU 50 1HB LEU 50 -9.538 6.942 1.300
245 HG LEU 50 HG LEU 50 -12.041 7.190 0.711
246 HD11 LEU 50 1HD1 LEU 50 -11.957 6.258 -1.523
247 HD12 LEU 50 2HD1 LEU 50 -13.037 5.336 -0.477
248 HD13 LEU 50 3HD1 LEU 50 -11.430 4.709 -0.865
249 HD21 LEU 50 3HD2 LEU 50 -12.598 5.144 1.903
250 HD22 LEU 50 1HD2 LEU 50 -11.223 5.965 2.639
251 HD23 LEU 50 2HD2 LEU 50 -10.967 4.539 1.630
252 HA PRO 51 HA PRO 51 -5.913 9.502 -1.644
253 HB2 PRO 51 2HB PRO 51 -5.368 11.538 0.148
254 HB3 PRO 51 1HB PRO 51 -6.037 11.808 -1.453
255 HG2 PRO 51 2HG PRO 51 -7.371 11.757 1.196
256 HG3 PRO 51 1HG PRO 51 -7.773 12.705 -0.244
257 HD2 PRO 51 2HD PRO 51 -9.202 10.530 0.549
258 HD3 PRO 51 1HD PRO 51 -9.053 11.013 -1.150
259 H VAL 52 H VAL 52 -4.515 8.048 -0.952
260 HA VAL 52 HA VAL 52 -3.821 8.133 1.880
261 HB VAL 52 HB VAL 52 -3.371 5.717 1.918
262 HG11 VAL 52 1HG1 VAL 52 -5.674 4.880 1.959
263 HG12 VAL 52 2HG1 VAL 52 -6.201 6.340 1.117
264 HG13 VAL 52 3HG1 VAL 52 -5.519 6.454 2.738
265 HG21 VAL 52 3HG2 VAL 52 -4.597 5.672 -0.838
266 HG22 VAL 52 1HG2 VAL 52 -4.216 4.238 0.123
267 HG23 VAL 52 2HG2 VAL 52 -2.923 5.307 -0.419
268 H CYS 53 H CYS 53 -1.669 7.608 2.340
269 HA CYS 53 HA CYS 53 0.070 8.020 0.029
270 HB2 CYS 53 2HB CYS 53 0.018 9.972 1.457
271 HB3 CYS 53 1HB CYS 53 0.412 9.029 2.874
272 H GLY 54 H GLY 54 1.550 6.523 -0.340
273 HA2 GLY 54 2HA GLY 54 1.786 4.344 1.566
274 HA3 GLY 54 1HA GLY 54 2.378 4.361 -0.092
275 H SER 55 H SER 55 3.911 3.506 2.066
276 HA SER 55 HA SER 55 5.710 5.355 3.150
277 HB2 SER 55 2HB SER 55 6.354 2.529 2.342
278 HB3 SER 55 1HB SER 55 7.052 3.459 3.669
279 HG SER 55 HG SER 55 5.563 2.597 4.796
280 H ASP 56 H ASP 56 5.366 4.350 -0.006
281 HA ASP 56 HA ASP 56 8.103 4.837 -0.886
282 HB2 ASP 56 2HB ASP 56 6.774 2.940 -1.777
283 HB3 ASP 56 1HB ASP 56 5.595 4.075 -2.406
284 H TYR 57 H TYR 57 5.608 6.691 0.002
285 HA TYR 57 HA TYR 57 5.006 8.779 -0.153
286 HB2 TYR 57 2HB TYR 57 7.731 9.003 -1.358
287 HB3 TYR 57 1HB TYR 57 6.686 10.419 -1.285
288 HD1 TYR 57 2HD TYR 57 8.273 7.790 0.812
289 HD2 TYR 57 1HD TYR 57 6.415 11.611 0.710
290 HE1 TYR 57 2HE TYR 57 8.874 8.141 3.166
291 HE2 TYR 57 1HE TYR 57 7.005 11.971 3.062
292 HH TYR 57 HH TYR 57 9.190 9.905 4.692
293 H ILE 58 H ILE 58 4.265 6.949 -2.167
294 HA ILE 58 HA ILE 58 3.520 8.768 -4.334
295 HB ILE 58 HB ILE 58 3.061 5.775 -4.076
296 HG12 ILE 58 2HG1 ILE 58 5.441 6.252 -4.256
297 HG13 ILE 58 1HG1 ILE 58 4.854 5.462 -5.711
298 HG21 ILE 58 1HG2 ILE 58 1.423 6.836 -5.519
299 HG22 ILE 58 2HG2 ILE 58 2.523 5.839 -6.471
300 HG23 ILE 58 3HG2 ILE 58 2.709 7.592 -6.460
301 HD11 ILE 58 3HD1 ILE 58 5.440 8.401 -5.397
302 HD12 ILE 58 1HD1 ILE 58 4.825 7.634 -6.862
303 HD13 ILE 58 2HD1 ILE 58 6.432 7.225 -6.258
304 H THR 59 H THR 59 1.485 9.545 -4.326
305 HA THR 59 HA THR 59 -0.282 8.736 -2.198
306 HB THR 59 HB THR 59 -0.628 10.863 -4.339
307 HG1 THR 59 1HG THR 59 1.085 10.853 -2.525
308 HG21 THR 59 3HG2 THR 59 -2.761 10.149 -3.357
309 HG22 THR 59 1HG2 THR 59 -2.347 11.767 -2.786
310 HG23 THR 59 2HG2 THR 59 -2.103 10.360 -1.741
311 H TYR 60 H TYR 60 -2.026 7.537 -2.482
312 HA TYR 60 HA TYR 60 -2.547 6.536 -5.175
313 HB2 TYR 60 2HB TYR 60 -2.809 5.175 -2.498
314 HB3 TYR 60 1HB TYR 60 -3.433 4.489 -4.001
315 HD1 TYR 60 1HD TYR 60 -1.877 3.714 -5.730
316 HD2 TYR 60 2HD TYR 60 -0.449 5.198 -2.014
317 HE1 TYR 60 1HE TYR 60 0.337 2.752 -6.200
318 HE2 TYR 60 2HE TYR 60 1.768 4.229 -2.479
319 HH TYR 60 HH TYR 60 2.570 3.025 -5.592
320 H GLY 61 H GLY 61 -4.655 6.138 -5.758
321 HA2 GLY 61 2HA GLY 61 -6.472 8.147 -5.022
322 HA3 GLY 61 1HA GLY 61 -6.819 6.791 -6.090
323 H ASN 62 H ASN 62 -6.037 4.931 -3.896
324 HA ASN 62 HA ASN 62 -7.439 5.360 -1.602
325 HB2 ASN 62 2HB ASN 62 -9.355 3.786 -1.785
326 HB3 ASN 62 1HB ASN 62 -9.526 5.157 -2.829
327 HD21 ASN 62 1HD2 ASN 62 -10.963 4.192 -4.167
328 HD22 ASN 62 2HD2 ASN 62 -10.578 2.963 -5.289
329 H GLU 63 H GLU 63 -7.858 3.084 -0.522
330 HA GLU 63 HA GLU 63 -5.196 2.181 -0.265
331 HB2 GLU 63 2HB GLU 63 -5.916 0.707 1.494
332 HB3 GLU 63 1HB GLU 63 -6.686 2.256 1.681
333 HG2 GLU 63 2HG GLU 63 -7.927 -0.273 0.620
334 HG3 GLU 63 1HG GLU 63 -8.207 0.427 2.212
335 H CYS 64 H CYS 64 -7.875 0.977 -2.058
336 HA CYS 64 HA CYS 64 -7.028 -1.611 -2.565
337 HB2 CYS 64 2HB CYS 64 -9.167 -0.850 -3.367
338 HB3 CYS 64 1HB CYS 64 -8.396 0.339 -4.415
339 H HIS 65 H HIS 65 -6.131 1.377 -4.240
340 HA HIS 65 HA HIS 65 -4.422 0.066 -6.117
341 HB2 HIS 65 2HB HIS 65 -4.501 2.972 -5.291
342 HB3 HIS 65 1HB HIS 65 -3.506 2.361 -6.603
343 HD1 HIS 65 1HD HIS 65 -4.926 1.292 -8.687
344 HD2 HIS 65 2HD HIS 65 -7.021 3.621 -5.962
345 HE1 HIS 65 1HE HIS 65 -7.066 1.848 -9.797
346 HE2 HIS 65 2HE HIS 65 -8.339 3.234 -8.150
347 H LEU 66 H LEU 66 -3.951 1.438 -2.985
348 HA LEU 66 HA LEU 66 -1.124 1.289 -2.904
349 HB2 LEU 66 2HB LEU 66 -2.425 2.648 -1.330
350 HB3 LEU 66 1HB LEU 66 -3.210 1.215 -0.722
351 HG LEU 66 HG LEU 66 -1.141 0.460 0.316
352 HD11 LEU 66 1HD1 LEU 66 0.058 2.988 -0.796
353 HD12 LEU 66 2HD1 LEU 66 0.467 1.342 -1.280
354 HD13 LEU 66 3HD1 LEU 66 0.834 1.901 0.354
355 HD21 LEU 66 3HD2 LEU 66 -2.641 1.966 1.529
356 HD22 LEU 66 1HD2 LEU 66 -1.722 3.346 0.942
357 HD23 LEU 66 2HD2 LEU 66 -0.958 2.166 2.017
358 H CYS 67 H CYS 67 -3.706 -0.877 -1.833
359 HA CYS 67 HA CYS 67 -2.177 -3.006 -0.906
360 HB2 CYS 67 2HB CYS 67 -4.528 -2.907 -0.441
361 HB3 CYS 67 1HB CYS 67 -4.923 -2.934 -2.152
362 H THR 68 H THR 68 -3.407 -2.389 -4.213
363 HA THR 68 HA THR 68 -2.608 -4.756 -5.404
364 HB THR 68 HB THR 68 -2.556 -2.012 -6.710
365 HG1 THR 68 1HG THR 68 -4.631 -3.543 -5.765
366 HG21 THR 68 3HG2 THR 68 -3.113 -3.286 -8.751
367 HG22 THR 68 1HG2 THR 68 -2.952 -4.788 -7.846
368 HG23 THR 68 2HG2 THR 68 -1.548 -3.738 -8.079
369 H GLU 69 H GLU 69 -0.736 -1.736 -5.031
370 HA GLU 69 HA GLU 69 1.560 -2.784 -6.295
371 HB2 GLU 69 2HB GLU 69 1.131 -0.379 -4.551
372 HB3 GLU 69 1HB GLU 69 2.662 -0.772 -5.321
373 HG2 GLU 69 2HG GLU 69 0.055 -0.156 -6.666
374 HG3 GLU 69 1HG GLU 69 1.512 0.839 -6.649
375 H SER 70 H SER 70 0.445 -2.619 -3.001
376 HA SER 70 HA SER 70 2.892 -3.189 -1.759
377 HB2 SER 70 2HB SER 70 0.769 -2.257 -0.690
378 HB3 SER 70 1HB SER 70 0.172 -3.917 -0.667
379 HG SER 70 HG SER 70 2.260 -2.708 0.698
380 H LEU 71 H LEU 71 0.377 -5.228 -3.125
381 HA LEU 71 HA LEU 71 1.485 -7.663 -2.141
382 HB2 LEU 71 2HB LEU 71 -0.487 -7.188 -4.366
383 HB3 LEU 71 1HB LEU 71 -0.055 -8.763 -3.735
384 HG LEU 71 HG LEU 71 -1.430 -6.570 -2.190
385 HD11 LEU 71 1HD1 LEU 71 -3.357 -8.051 -2.219
386 HD12 LEU 71 2HD1 LEU 71 -2.469 -9.211 -3.206
387 HD13 LEU 71 3HD1 LEU 71 -2.869 -7.622 -3.858
388 HD21 LEU 71 3HD2 LEU 71 -0.714 -9.388 -1.366
389 HD22 LEU 71 1HD2 LEU 71 -1.647 -8.235 -0.413
390 HD23 LEU 71 2HD2 LEU 71 0.043 -7.913 -0.759
391 H LYS 72 H LYS 72 1.921 -5.811 -5.060
392 HA LYS 72 HA LYS 72 3.290 -7.797 -6.539
393 HB2 LYS 72 2HB LYS 72 3.441 -4.791 -6.724
394 HB3 LYS 72 1HB LYS 72 4.172 -5.888 -7.879
395 HG2 LYS 72 2HG LYS 72 1.996 -6.699 -8.537
396 HG3 LYS 72 1HG LYS 72 1.226 -5.701 -7.297
397 HD2 LYS 72 2HD LYS 72 2.110 -3.690 -8.368
398 HD3 LYS 72 1HD LYS 72 2.862 -4.688 -9.613
399 HE2 LYS 72 2HE LYS 72 0.739 -5.395 -10.423
400 HE3 LYS 72 1HE LYS 72 -0.098 -4.645 -9.064
401 HZ1 LYS 72 3HZ LYS 72 0.713 -2.499 -9.841
402 HZ2 LYS 72 1HZ LYS 72 -0.252 -3.246 -11.016
403 HZ3 LYS 72 2HZ LYS 72 1.423 -3.228 -11.186
404 H SER 73 H SER 73 4.457 -5.055 -4.602
405 HA SER 73 HA SER 73 7.183 -5.888 -4.923
406 HB2 SER 73 2HB SER 73 7.636 -3.953 -3.418
407 HB3 SER 73 1HB SER 73 6.745 -3.543 -4.879
408 HG SER 73 HG SER 73 5.077 -3.008 -3.756
409 H ASN 74 H ASN 74 4.678 -6.487 -2.781
410 HA ASN 74 HA ASN 74 4.364 -7.604 -0.926
411 HB2 ASN 74 2HB ASN 74 5.538 -9.468 -2.037
412 HB3 ASN 74 1HB ASN 74 7.073 -8.881 -1.409
413 HD21 ASN 74 1HD2 ASN 74 7.425 -10.807 -0.289
414 HD22 ASN 74 2HD2 ASN 74 6.569 -11.197 1.155
415 H GLY 75 H GLY 75 4.348 -5.671 0.117
416 HA2 GLY 75 2HA GLY 75 4.646 -4.721 2.219
417 HA3 GLY 75 1HA GLY 75 5.995 -5.800 2.487
418 H ARG 76 H ARG 76 6.532 -4.177 -0.420
419 HA ARG 76 HA ARG 76 8.515 -2.541 0.817
420 HB2 ARG 76 2HB ARG 76 8.889 -3.432 -1.449
421 HB3 ARG 76 1HB ARG 76 7.487 -2.538 -2.013
422 HG2 ARG 76 2HG ARG 76 8.584 -0.433 -1.604
423 HG3 ARG 76 1HG ARG 76 9.962 -1.274 -0.897
424 HD2 ARG 76 2HD ARG 76 9.056 -1.674 -3.738
425 HD3 ARG 76 1HD ARG 76 10.278 -0.493 -3.272
426 HE ARG 76 HE ARG 76 10.933 -3.047 -2.268
427 HH11 ARG 76 1HH1 ARG 76 10.819 -1.332 -5.387
428 HH12 ARG 76 2HH1 ARG 76 12.197 -2.100 -6.019
429 HH21 ARG 76 1HH2 ARG 76 12.747 -4.146 -3.160
430 HH22 ARG 76 2HH2 ARG 76 13.318 -3.776 -4.725
431 H VAL 77 H VAL 77 5.608 -1.777 -1.021
432 HA VAL 77 HA VAL 77 5.650 0.807 0.274
433 HB VAL 77 HB VAL 77 5.307 0.876 -2.150
434 HG11 VAL 77 1HG1 VAL 77 4.243 -1.250 -2.525
435 HG12 VAL 77 2HG1 VAL 77 3.278 0.054 -3.214
436 HG13 VAL 77 3HG1 VAL 77 2.792 -0.697 -1.692
437 HG21 VAL 77 3HG2 VAL 77 3.274 2.256 -2.244
438 HG22 VAL 77 1HG2 VAL 77 4.304 2.656 -0.865
439 HG23 VAL 77 2HG2 VAL 77 2.849 1.693 -0.624
440 H GLN 78 H GLN 78 4.736 0.935 2.142
441 HA GLN 78 HA GLN 78 2.367 -0.670 2.704
442 HB2 GLN 78 2HB GLN 78 4.468 0.501 4.522
443 HB3 GLN 78 1HB GLN 78 3.040 -0.356 5.083
444 HG2 GLN 78 2HG GLN 78 3.781 -2.362 3.945
445 HG3 GLN 78 1HG GLN 78 5.184 -1.506 3.319
446 HE21 GLN 78 1HE2 GLN 78 4.967 -3.825 4.965
447 HE22 GLN 78 2HE2 GLN 78 5.888 -3.513 6.387
448 H PHE 79 H PHE 79 1.196 0.537 4.633
449 HA PHE 79 HA PHE 79 0.270 3.027 3.549
450 HB2 PHE 79 2HB PHE 79 -1.262 1.387 4.605
451 HB3 PHE 79 1HB PHE 79 -0.416 1.588 6.131
452 HD1 PHE 79 1HD PHE 79 -2.662 3.168 3.696
453 HD2 PHE 79 2HD PHE 79 -0.854 3.481 7.535
454 HE1 PHE 79 1HE PHE 79 -4.219 4.976 4.280
455 HE2 PHE 79 2HE PHE 79 -2.403 5.290 8.122
456 HZ PHE 79 HZ PHE 79 -4.090 6.038 6.493
457 H LEU 80 H LEU 80 1.270 4.891 3.963
458 HA LEU 80 HA LEU 80 3.145 5.011 6.187
459 HB2 LEU 80 2HB LEU 80 3.780 5.771 3.908
460 HB3 LEU 80 1HB LEU 80 2.564 7.020 4.019
461 HG LEU 80 HG LEU 80 3.795 7.978 5.955
462 HD11 LEU 80 1HD1 LEU 80 5.867 5.932 5.201
463 HD12 LEU 80 2HD1 LEU 80 4.967 6.008 6.716
464 HD13 LEU 80 3HD1 LEU 80 6.115 7.282 6.300
465 HD21 LEU 80 3HD2 LEU 80 4.076 8.886 3.731
466 HD22 LEU 80 1HD2 LEU 80 5.338 7.701 3.382
467 HD23 LEU 80 2HD2 LEU 80 5.599 8.938 4.613
468 H HIS 81 H HIS 81 0.536 6.998 4.801
469 HA HIS 81 HA HIS 81 -0.635 7.393 7.336
470 HB2 HIS 81 2HB HIS 81 -0.491 9.874 7.425
471 HB3 HIS 81 1HB HIS 81 1.077 9.118 7.622
472 HD1 HIS 81 1HD HIS 81 -0.924 11.183 5.133
473 HD2 HIS 81 2HD HIS 81 2.976 9.877 5.785
474 HE1 HIS 81 1HE HIS 81 0.532 12.408 3.453
475 HE2 HIS 81 2HE HIS 81 2.843 11.880 4.192
476 H ASP 82 H ASP 82 -2.575 8.679 7.183
477 HA ASP 82 HA ASP 82 -4.007 8.145 4.765
478 HB2 ASP 82 2HB ASP 82 -5.120 7.985 6.955
479 HB3 ASP 82 1HB ASP 82 -4.756 9.674 7.280
480 H GLY 83 H GLY 83 -4.875 9.738 3.376
481 HA2 GLY 83 2HA GLY 83 -5.158 11.880 2.571
482 HA3 GLY 83 1HA GLY 83 -3.985 12.480 3.750
483 H SER 84 H SER 84 -3.654 13.439 1.368
484 HA SER 84 HA SER 84 -2.102 11.894 -0.403
485 HB2 SER 84 2HB SER 84 -2.355 14.877 -0.057
486 HB3 SER 84 1HB SER 84 -1.762 14.056 -1.516
487 HG SER 84 HG SER 84 -3.796 13.352 -1.919
488 H CYS 85 H CYS 85 0.219 12.137 -0.797
489 HA CYS 85 HA CYS 85 1.702 12.086 1.587
490 HB2 CYS 85 2HB CYS 85 2.681 12.200 -1.270
491 HB3 CYS 85 1HB CYS 85 3.653 11.874 0.170
Start of MODEL 9
1 H1 SER 20 1HT SER 20 13.032 6.537 7.842
2 H2 SER 20 2HT SER 20 11.515 6.086 7.257
3 H3 SER 20 3HT SER 20 12.688 6.797 6.207
4 HA SER 20 HA SER 20 12.571 4.481 5.804
5 HB2 SER 20 2HB SER 20 15.050 5.159 7.402
6 HB3 SER 20 1HB SER 20 14.927 4.097 5.997
7 HG SER 20 HG SER 20 15.105 5.760 4.740
8 H GLU 21 H GLU 21 11.245 3.103 6.878
9 HA GLU 21 HA GLU 21 11.511 3.049 9.712
10 HB2 GLU 21 2HB GLU 21 9.340 1.966 7.950
11 HB3 GLU 21 1HB GLU 21 9.404 1.629 9.670
12 HG2 GLU 21 2HG GLU 21 7.891 3.478 9.256
13 HG3 GLU 21 1HG GLU 21 9.297 4.051 10.139
14 H ALA 22 H ALA 22 13.492 2.155 9.639
15 HA ALA 22 HA ALA 22 13.518 -0.781 9.626
16 HB1 ALA 22 1HB ALA 22 15.943 -0.466 10.122
17 HB2 ALA 22 2HB ALA 22 15.695 1.280 10.074
18 HB3 ALA 22 3HB ALA 22 15.451 0.309 8.620
19 H ALA 23 H ALA 23 13.036 1.954 11.482
20 HA ALA 23 HA ALA 23 12.630 0.502 13.900
21 HB1 ALA 23 1HB ALA 23 14.436 2.940 13.696
22 HB2 ALA 23 2HB ALA 23 14.945 1.320 14.168
23 HB3 ALA 23 3HB ALA 23 13.856 2.239 15.205
24 H SER 24 H SER 24 11.432 2.136 15.377
25 HA SER 24 HA SER 24 9.670 3.444 15.744
26 HB2 SER 24 2HB SER 24 10.672 4.986 13.332
27 HB3 SER 24 1HB SER 24 9.522 5.588 14.529
28 HG SER 24 HG SER 24 11.777 4.581 15.661
29 H LEU 25 H LEU 25 9.290 1.108 14.285
30 HA LEU 25 HA LEU 25 7.420 1.543 12.148
31 HB2 LEU 25 2HB LEU 25 7.970 -0.928 13.817
32 HB3 LEU 25 1HB LEU 25 6.802 -0.883 12.525
33 HG LEU 25 HG LEU 25 8.720 -0.411 10.947
34 HD11 LEU 25 1HD1 LEU 25 10.389 -1.183 13.330
35 HD12 LEU 25 2HD1 LEU 25 10.344 0.401 12.559
36 HD13 LEU 25 3HD1 LEU 25 10.963 -0.994 11.672
37 HD21 LEU 25 3HD2 LEU 25 8.768 -2.986 12.503
38 HD22 LEU 25 1HD2 LEU 25 9.461 -2.733 10.902
39 HD23 LEU 25 2HD2 LEU 25 7.717 -2.606 11.139
40 H SER 26 H SER 26 5.217 1.571 12.293
41 HA SER 26 HA SER 26 4.060 1.425 14.957
42 HB2 SER 26 2HB SER 26 4.681 3.812 14.353
43 HB3 SER 26 1HB SER 26 3.616 3.664 12.960
44 HG SER 26 HG SER 26 2.954 3.594 15.701
45 HA PRO 27 HA PRO 27 1.010 -0.998 12.789
46 HB2 PRO 27 2HB PRO 27 -1.302 -0.318 14.038
47 HB3 PRO 27 1HB PRO 27 -0.028 -1.338 14.729
48 HG2 PRO 27 2HG PRO 27 -0.505 1.596 15.142
49 HG3 PRO 27 1HG PRO 27 -0.218 0.339 16.363
50 HD2 PRO 27 2HD PRO 27 1.754 1.931 15.553
51 HD3 PRO 27 1HD PRO 27 2.046 0.208 15.871
52 H LYS 28 H LYS 28 1.553 1.416 11.453
53 HA LYS 28 HA LYS 28 -1.030 2.218 10.359
54 HB2 LYS 28 2HB LYS 28 1.772 3.125 9.688
55 HB3 LYS 28 1HB LYS 28 0.427 3.482 8.628
56 HG2 LYS 28 2HG LYS 28 0.742 5.416 9.883
57 HG3 LYS 28 1HG LYS 28 -0.638 4.625 10.625
58 HD2 LYS 28 2HD LYS 28 0.810 3.766 12.398
59 HD3 LYS 28 1HD LYS 28 2.204 4.513 11.614
60 HE2 LYS 28 2HE LYS 28 1.082 6.723 11.858
61 HE3 LYS 28 1HE LYS 28 -0.189 5.935 12.782
62 HZ1 LYS 28 3HZ LYS 28 1.280 6.788 14.373
63 HZ2 LYS 28 1HZ LYS 28 2.654 6.301 13.510
64 HZ3 LYS 28 2HZ LYS 28 1.717 5.156 14.267
65 H LYS 29 H LYS 29 -1.919 0.684 9.229
66 HA LYS 29 HA LYS 29 -0.804 0.036 6.734
67 HB2 LYS 29 2HB LYS 29 -0.782 -2.390 6.881
68 HB3 LYS 29 1HB LYS 29 0.318 -1.753 8.085
69 HG2 LYS 29 2HG LYS 29 -2.483 -2.536 8.779
70 HG3 LYS 29 1HG LYS 29 -1.206 -3.743 8.678
71 HD2 LYS 29 2HD LYS 29 0.035 -2.563 10.418
72 HD3 LYS 29 1HD LYS 29 -1.197 -1.303 10.455
73 HE2 LYS 29 2HE LYS 29 -1.433 -2.948 12.295
74 HE3 LYS 29 1HE LYS 29 -2.846 -2.848 11.250
75 HZ1 LYS 29 3HZ LYS 29 -2.248 -4.874 10.198
76 HZ2 LYS 29 1HZ LYS 29 -2.210 -5.138 11.847
77 HZ3 LYS 29 2HZ LYS 29 -0.760 -4.967 10.988
78 H VAL 30 H VAL 30 -2.387 -0.953 5.407
79 HA VAL 30 HA VAL 30 -5.083 -0.647 6.507
80 HB VAL 30 HB VAL 30 -4.578 0.844 4.567
81 HG11 VAL 30 1HG1 VAL 30 -4.254 -0.093 2.315
82 HG12 VAL 30 2HG1 VAL 30 -4.114 -1.701 3.026
83 HG13 VAL 30 3HG1 VAL 30 -2.920 -0.462 3.407
84 HG21 VAL 30 3HG2 VAL 30 -6.537 -1.329 3.839
85 HG22 VAL 30 1HG2 VAL 30 -6.517 0.306 3.180
86 HG23 VAL 30 2HG2 VAL 30 -6.882 0.039 4.888
87 H ASP 31 H ASP 31 -6.583 -2.408 6.113
88 HA ASP 31 HA ASP 31 -5.216 -4.880 5.878
89 HB2 ASP 31 2HB ASP 31 -7.214 -4.796 7.310
90 HB3 ASP 31 1HB ASP 31 -8.222 -4.462 5.901
91 H CYS 32 H CYS 32 -4.460 -5.540 4.187
92 HA CYS 32 HA CYS 32 -5.588 -4.905 1.592
93 HB2 CYS 32 2HB CYS 32 -3.191 -4.510 2.101
94 HB3 CYS 32 1HB CYS 32 -2.986 -6.202 2.475
95 H SER 33 H SER 33 -5.976 -7.239 3.944
96 HA SER 33 HA SER 33 -5.754 -9.661 2.539
97 HB2 SER 33 2HB SER 33 -7.571 -9.114 4.870
98 HB3 SER 33 1HB SER 33 -6.756 -10.627 4.456
99 HG SER 33 HG SER 33 -5.947 -8.526 5.889
100 H ILE 34 H ILE 34 -8.444 -7.429 3.155
101 HA ILE 34 HA ILE 34 -10.507 -8.902 1.979
102 HB ILE 34 HB ILE 34 -11.677 -6.749 1.575
103 HG12 ILE 34 2HG1 ILE 34 -9.158 -5.470 2.665
104 HG13 ILE 34 1HG1 ILE 34 -9.665 -5.417 0.983
105 HG21 ILE 34 1HG2 ILE 34 -11.884 -6.083 3.897
106 HG22 ILE 34 2HG2 ILE 34 -10.396 -6.938 4.282
107 HG23 ILE 34 3HG2 ILE 34 -11.817 -7.843 3.749
108 HD11 ILE 34 3HD1 ILE 34 -11.671 -4.188 1.638
109 HD12 ILE 34 1HD1 ILE 34 -10.196 -3.354 2.129
110 HD13 ILE 34 2HD1 ILE 34 -11.143 -4.244 3.322
111 H TYR 35 H TYR 35 -7.961 -7.116 0.471
112 HA TYR 35 HA TYR 35 -9.264 -7.291 -2.104
113 HB2 TYR 35 2HB TYR 35 -6.653 -6.047 -1.265
114 HB3 TYR 35 1HB TYR 35 -7.204 -6.093 -2.930
115 HD1 TYR 35 2HD TYR 35 -9.612 -5.092 -3.310
116 HD2 TYR 35 1HD TYR 35 -7.146 -4.163 0.021
117 HE1 TYR 35 2HE TYR 35 -10.856 -3.015 -2.988
118 HE2 TYR 35 1HE TYR 35 -8.392 -2.071 0.367
119 HH TYR 35 HH TYR 35 -9.840 -0.470 -1.000
120 H LYS 36 H LYS 36 -6.628 -8.727 -0.313
121 HA LYS 36 HA LYS 36 -5.449 -10.200 -2.389
122 HB2 LYS 36 2HB LYS 36 -5.586 -10.910 0.539
123 HB3 LYS 36 1HB LYS 36 -4.608 -11.768 -0.636
124 HG2 LYS 36 2HG LYS 36 -3.443 -9.568 -1.079
125 HG3 LYS 36 1HG LYS 36 -4.276 -8.948 0.352
126 HD2 LYS 36 2HD LYS 36 -2.395 -11.318 0.267
127 HD3 LYS 36 1HD LYS 36 -2.011 -9.721 0.901
128 HE2 LYS 36 2HE LYS 36 -3.671 -9.995 2.646
129 HE3 LYS 36 1HE LYS 36 -4.149 -11.550 1.963
130 HZ1 LYS 36 3HZ LYS 36 -1.911 -12.379 2.446
131 HZ2 LYS 36 1HZ LYS 36 -2.698 -11.862 3.834
132 HZ3 LYS 36 2HZ LYS 36 -1.495 -10.912 3.173
133 H LYS 37 H LYS 37 -8.483 -10.603 -1.008
134 HA LYS 37 HA LYS 37 -8.697 -13.435 -1.475
135 HB2 LYS 37 2HB LYS 37 -10.934 -11.444 -1.061
136 HB3 LYS 37 1HB LYS 37 -11.056 -13.194 -0.939
137 HG2 LYS 37 2HG LYS 37 -9.504 -11.361 0.876
138 HG3 LYS 37 1HG LYS 37 -10.976 -12.254 1.261
139 HD2 LYS 37 2HD LYS 37 -9.802 -14.362 1.082
140 HD3 LYS 37 1HD LYS 37 -8.350 -13.552 0.494
141 HE2 LYS 37 2HE LYS 37 -8.056 -14.099 2.821
142 HE3 LYS 37 1HE LYS 37 -8.180 -12.359 2.630
143 HZ1 LYS 37 3HZ LYS 37 -10.441 -12.442 3.355
144 HZ2 LYS 37 1HZ LYS 37 -9.464 -13.155 4.502
145 HZ3 LYS 37 2HZ LYS 37 -10.420 -14.109 3.493
146 H TYR 38 H TYR 38 -8.571 -10.859 -3.512
147 HA TYR 38 HA TYR 38 -9.988 -12.302 -5.654
148 HB2 TYR 38 2HB TYR 38 -9.007 -9.430 -5.585
149 HB3 TYR 38 1HB TYR 38 -9.976 -10.158 -6.858
150 HD1 TYR 38 2HD TYR 38 -12.385 -10.699 -6.361
151 HD2 TYR 38 1HD TYR 38 -9.936 -8.507 -3.680
152 HE1 TYR 38 2HE TYR 38 -14.400 -9.855 -5.202
153 HE2 TYR 38 1HE TYR 38 -11.913 -7.660 -2.525
154 HH TYR 38 HH TYR 38 -15.002 -8.981 -3.014
155 HA PRO 39 HA PRO 39 -5.930 -13.188 -7.414
156 HB2 PRO 39 2HB PRO 39 -6.316 -12.321 -10.041
157 HB3 PRO 39 1HB PRO 39 -6.709 -13.934 -9.441
158 HG2 PRO 39 2HG PRO 39 -8.487 -11.577 -9.848
159 HG3 PRO 39 1HG PRO 39 -8.823 -13.296 -10.124
160 HD2 PRO 39 2HD PRO 39 -9.780 -12.006 -7.984
161 HD3 PRO 39 1HD PRO 39 -9.244 -13.690 -7.862
162 H VAL 40 H VAL 40 -4.070 -12.053 -7.510
163 HA VAL 40 HA VAL 40 -3.980 -9.410 -6.639
164 HB VAL 40 HB VAL 40 -1.741 -10.963 -7.981
165 HG11 VAL 40 1HG1 VAL 40 -1.583 -8.588 -6.127
166 HG12 VAL 40 2HG1 VAL 40 -1.225 -8.586 -7.852
167 HG13 VAL 40 3HG1 VAL 40 -0.211 -9.509 -6.744
168 HG21 VAL 40 3HG2 VAL 40 -2.638 -12.171 -6.076
169 HG22 VAL 40 1HG2 VAL 40 -2.483 -10.719 -5.078
170 HG23 VAL 40 2HG2 VAL 40 -1.038 -11.508 -5.702
171 H VAL 41 H VAL 41 -3.979 -10.598 -9.909
172 HA VAL 41 HA VAL 41 -3.188 -8.008 -10.927
173 HB VAL 41 HB VAL 41 -2.392 -10.025 -12.064
174 HG11 VAL 41 1HG1 VAL 41 -5.258 -10.530 -12.784
175 HG12 VAL 41 2HG1 VAL 41 -4.237 -11.517 -11.738
176 HG13 VAL 41 3HG1 VAL 41 -3.878 -11.390 -13.461
177 HG21 VAL 41 3HG2 VAL 41 -2.902 -9.386 -14.393
178 HG22 VAL 41 1HG2 VAL 41 -2.507 -7.995 -13.379
179 HG23 VAL 41 2HG2 VAL 41 -4.187 -8.332 -13.800
180 H ALA 42 H ALA 42 -6.202 -9.631 -10.270
181 HA ALA 42 HA ALA 42 -7.570 -7.366 -11.512
182 HB1 ALA 42 1HB ALA 42 -8.580 -10.210 -11.564
183 HB2 ALA 42 2HB ALA 42 -7.904 -9.333 -12.939
184 HB3 ALA 42 3HB ALA 42 -9.415 -8.797 -12.207
185 H ILE 43 H ILE 43 -7.837 -6.267 -9.628
186 HA ILE 43 HA ILE 43 -9.588 -7.560 -7.658
187 HB ILE 43 HB ILE 43 -7.442 -5.466 -7.107
188 HG12 ILE 43 2HG1 ILE 43 -7.523 -8.423 -6.432
189 HG13 ILE 43 1HG1 ILE 43 -6.424 -7.626 -7.536
190 HG21 ILE 43 1HG2 ILE 43 -9.257 -6.899 -5.177
191 HG22 ILE 43 2HG2 ILE 43 -9.377 -5.209 -5.662
192 HG23 ILE 43 3HG2 ILE 43 -7.970 -5.765 -4.758
193 HD11 ILE 43 3HD1 ILE 43 -5.306 -8.158 -5.461
194 HD12 ILE 43 1HD1 ILE 43 -6.523 -7.268 -4.553
195 HD13 ILE 43 2HD1 ILE 43 -5.435 -6.407 -5.635
196 HA PRO 44 HA PRO 44 -12.136 -4.021 -8.823
197 HB2 PRO 44 2HB PRO 44 -13.767 -4.545 -6.450
198 HB3 PRO 44 1HB PRO 44 -14.218 -4.682 -8.147
199 HG2 PRO 44 2HG PRO 44 -13.911 -6.837 -6.518
200 HG3 PRO 44 1HG PRO 44 -13.623 -6.895 -8.262
201 HD2 PRO 44 2HD PRO 44 -11.659 -6.734 -6.022
202 HD3 PRO 44 1HD PRO 44 -11.570 -7.623 -7.559
203 H CYS 45 H CYS 45 -11.925 -1.951 -8.277
204 HA CYS 45 HA CYS 45 -10.955 -1.320 -5.584
205 HB2 CYS 45 2HB CYS 45 -10.310 -0.028 -8.236
206 HB3 CYS 45 1HB CYS 45 -9.837 0.677 -6.702
207 HA PRO 46 HA PRO 46 -14.498 1.330 -5.113
208 HB2 PRO 46 2HB PRO 46 -13.168 3.364 -3.714
209 HB3 PRO 46 1HB PRO 46 -14.020 1.999 -2.990
210 HG2 PRO 46 2HG PRO 46 -11.132 2.440 -3.407
211 HG3 PRO 46 1HG PRO 46 -11.952 1.456 -2.188
212 HD2 PRO 46 2HD PRO 46 -10.635 0.449 -4.347
213 HD3 PRO 46 1HD PRO 46 -11.970 -0.397 -3.534
214 H ILE 47 H ILE 47 -15.274 3.165 -6.067
215 HA ILE 47 HA ILE 47 -13.660 4.070 -8.264
216 HB ILE 47 HB ILE 47 -15.669 5.250 -9.053
217 HG12 ILE 47 2HG1 ILE 47 -16.994 4.102 -6.576
218 HG13 ILE 47 1HG1 ILE 47 -16.663 5.805 -6.856
219 HG21 ILE 47 1HG2 ILE 47 -17.003 3.227 -9.504
220 HG22 ILE 47 2HG2 ILE 47 -16.098 2.373 -8.255
221 HG23 ILE 47 3HG2 ILE 47 -15.273 2.944 -9.705
222 HD11 ILE 47 3HD1 ILE 47 -18.987 5.303 -7.272
223 HD12 ILE 47 1HD1 ILE 47 -18.535 4.072 -8.452
224 HD13 ILE 47 2HD1 ILE 47 -18.187 5.769 -8.773
225 H THR 48 H THR 48 -14.410 5.312 -5.163
226 HA THR 48 HA THR 48 -14.068 8.049 -5.905
227 HB THR 48 HB THR 48 -14.109 6.794 -3.144
228 HG1 THR 48 1HG THR 48 -16.095 6.393 -3.799
229 HG21 THR 48 3HG2 THR 48 -13.223 9.107 -3.195
230 HG22 THR 48 1HG2 THR 48 -14.795 9.037 -2.399
231 HG23 THR 48 2HG2 THR 48 -14.672 9.633 -4.053
232 H TYR 49 H TYR 49 -12.298 9.272 -5.693
233 HA TYR 49 HA TYR 49 -9.736 7.979 -5.430
234 HB2 TYR 49 2HB TYR 49 -10.115 9.676 -7.193
235 HB3 TYR 49 1HB TYR 49 -10.501 10.866 -5.961
236 HD1 TYR 49 1HD TYR 49 -7.796 8.900 -7.494
237 HD2 TYR 49 2HD TYR 49 -8.744 12.013 -4.759
238 HE1 TYR 49 1HE TYR 49 -5.431 9.577 -7.446
239 HE2 TYR 49 2HE TYR 49 -6.383 12.692 -4.699
240 HH TYR 49 HH TYR 49 -4.132 11.562 -6.961
241 H LEU 50 H LEU 50 -9.098 7.594 -3.422
242 HA LEU 50 HA LEU 50 -9.515 9.678 -1.420
243 HB2 LEU 50 2HB LEU 50 -9.314 6.686 -1.030
244 HB3 LEU 50 1HB LEU 50 -9.498 7.871 0.247
245 HG LEU 50 HG LEU 50 -11.539 7.348 -1.911
246 HD11 LEU 50 1HD1 LEU 50 -11.512 6.478 0.970
247 HD12 LEU 50 2HD1 LEU 50 -11.337 5.443 -0.450
248 HD13 LEU 50 3HD1 LEU 50 -12.852 6.295 -0.163
249 HD21 LEU 50 3HD2 LEU 50 -13.020 8.699 -0.474
250 HD22 LEU 50 1HD2 LEU 50 -11.647 9.618 -1.082
251 HD23 LEU 50 2HD2 LEU 50 -11.647 9.047 0.581
252 HA PRO 51 HA PRO 51 -5.072 9.551 -2.293
253 HB2 PRO 51 2HB PRO 51 -4.505 11.776 -0.762
254 HB3 PRO 51 1HB PRO 51 -4.955 11.836 -2.464
255 HG2 PRO 51 2HG PRO 51 -6.612 12.315 -0.038
256 HG3 PRO 51 1HG PRO 51 -6.663 13.117 -1.614
257 HD2 PRO 51 2HD PRO 51 -8.485 11.267 -0.881
258 HD3 PRO 51 1HD PRO 51 -7.951 11.467 -2.562
259 H VAL 52 H VAL 52 -3.956 8.152 -1.256
260 HA VAL 52 HA VAL 52 -3.614 8.452 1.631
261 HB VAL 52 HB VAL 52 -3.385 6.020 1.895
262 HG11 VAL 52 1HG1 VAL 52 -6.036 6.795 0.696
263 HG12 VAL 52 2HG1 VAL 52 -5.547 6.987 2.379
264 HG13 VAL 52 3HG1 VAL 52 -5.750 5.371 1.699
265 HG21 VAL 52 3HG2 VAL 52 -4.152 4.462 0.129
266 HG22 VAL 52 1HG2 VAL 52 -2.714 5.376 -0.329
267 HG23 VAL 52 2HG2 VAL 52 -4.290 5.830 -0.980
268 H CYS 53 H CYS 53 -1.553 8.002 2.351
269 HA CYS 53 HA CYS 53 0.397 8.124 0.181
270 HB2 CYS 53 2HB CYS 53 0.392 10.085 1.608
271 HB3 CYS 53 1HB CYS 53 0.577 9.093 3.041
272 H GLY 54 H GLY 54 1.737 6.515 -0.070
273 HA2 GLY 54 2HA GLY 54 1.715 4.380 1.901
274 HA3 GLY 54 1HA GLY 54 2.371 4.290 0.268
275 H SER 55 H SER 55 3.725 3.424 2.579
276 HA SER 55 HA SER 55 5.572 5.212 3.672
277 HB2 SER 55 2HB SER 55 6.000 2.289 3.108
278 HB3 SER 55 1HB SER 55 6.737 3.249 4.396
279 HG SER 55 HG SER 55 5.102 2.670 5.522
280 H ASP 56 H ASP 56 5.401 4.050 0.542
281 HA ASP 56 HA ASP 56 8.225 4.215 -0.137
282 HB2 ASP 56 2HB ASP 56 6.667 2.500 -1.104
283 HB3 ASP 56 1HB ASP 56 5.790 3.795 -1.896
284 H TYR 57 H TYR 57 5.977 6.406 0.551
285 HA TYR 57 HA TYR 57 5.685 8.598 0.314
286 HB2 TYR 57 2HB TYR 57 8.336 8.485 -1.122
287 HB3 TYR 57 1HB TYR 57 7.487 9.983 -0.771
288 HD1 TYR 57 1HD TYR 57 6.670 10.024 1.852
289 HD2 TYR 57 2HD TYR 57 10.062 8.003 0.282
290 HE1 TYR 57 1HE TYR 57 7.737 10.110 4.063
291 HE2 TYR 57 2HE TYR 57 11.134 8.082 2.480
292 HH TYR 57 HH TYR 57 9.447 8.845 5.293
293 H ILE 58 H ILE 58 4.436 6.927 -1.442
294 HA ILE 58 HA ILE 58 4.139 8.649 -3.812
295 HB ILE 58 HB ILE 58 3.493 5.687 -3.594
296 HG12 ILE 58 2HG1 ILE 58 5.920 5.967 -3.601
297 HG13 ILE 58 1HG1 ILE 58 5.379 5.275 -5.122
298 HG21 ILE 58 1HG2 ILE 58 2.038 6.822 -5.157
299 HG22 ILE 58 2HG2 ILE 58 3.153 5.769 -6.028
300 HG23 ILE 58 3HG2 ILE 58 3.429 7.510 -5.994
301 HD11 ILE 58 3HD1 ILE 58 7.127 6.919 -5.465
302 HD12 ILE 58 1HD1 ILE 58 6.154 8.149 -4.658
303 HD13 ILE 58 2HD1 ILE 58 5.612 7.462 -6.192
304 H THR 59 H THR 59 2.139 9.565 -3.947
305 HA THR 59 HA THR 59 0.153 8.810 -2.018
306 HB THR 59 HB THR 59 -0.032 10.852 -4.259
307 HG1 THR 59 1HG THR 59 1.434 11.726 -2.992
308 HG21 THR 59 3HG2 THR 59 -1.704 10.350 -1.795
309 HG22 THR 59 1HG2 THR 59 -2.214 10.190 -3.468
310 HG23 THR 59 2HG2 THR 59 -1.850 11.789 -2.796
311 H TYR 60 H TYR 60 -1.330 7.378 -2.380
312 HA TYR 60 HA TYR 60 -1.679 6.329 -5.063
313 HB2 TYR 60 2HB TYR 60 -2.289 5.184 -2.345
314 HB3 TYR 60 1HB TYR 60 -2.812 4.407 -3.844
315 HD1 TYR 60 1HD TYR 60 0.115 5.379 -1.821
316 HD2 TYR 60 2HD TYR 60 -1.261 3.255 -5.222
317 HE1 TYR 60 1HE TYR 60 2.330 4.356 -2.071
318 HE2 TYR 60 2HE TYR 60 0.938 2.223 -5.483
319 HH TYR 60 HH TYR 60 3.163 2.727 -4.909
320 H GLY 61 H GLY 61 -3.731 5.887 -5.869
321 HA2 GLY 61 2HA GLY 61 -5.531 8.040 -5.496
322 HA3 GLY 61 1HA GLY 61 -5.791 6.663 -6.559
323 H ASN 62 H ASN 62 -5.319 5.043 -3.937
324 HA ASN 62 HA ASN 62 -7.004 5.566 -1.945
325 HB2 ASN 62 2HB ASN 62 -9.069 4.230 -2.259
326 HB3 ASN 62 1HB ASN 62 -8.959 5.485 -3.440
327 HD21 ASN 62 1HD2 ASN 62 -10.347 4.553 -4.823
328 HD22 ASN 62 2HD2 ASN 62 -10.032 3.158 -5.756
329 H GLU 63 H GLU 63 -7.854 3.192 -1.008
330 HA GLU 63 HA GLU 63 -5.255 2.162 -0.439
331 HB2 GLU 63 2HB GLU 63 -6.217 0.766 1.249
332 HB3 GLU 63 1HB GLU 63 -6.864 2.387 1.391
333 HG2 GLU 63 2HG GLU 63 -8.266 -0.038 0.257
334 HG3 GLU 63 1HG GLU 63 -8.577 0.705 1.824
335 H CYS 64 H CYS 64 -7.865 1.133 -2.430
336 HA CYS 64 HA CYS 64 -7.016 -1.532 -2.786
337 HB2 CYS 64 2HB CYS 64 -9.186 -0.741 -3.609
338 HB3 CYS 64 1HB CYS 64 -8.377 0.255 -4.825
339 H HIS 65 H HIS 65 -6.093 1.473 -4.396
340 HA HIS 65 HA HIS 65 -4.292 0.196 -6.220
341 HB2 HIS 65 2HB HIS 65 -4.286 3.097 -5.324
342 HB3 HIS 65 1HB HIS 65 -3.338 2.436 -6.647
343 HD1 HIS 65 1HD HIS 65 -4.932 1.411 -8.689
344 HD2 HIS 65 2HD HIS 65 -6.635 4.119 -6.060
345 HE1 HIS 65 1HE HIS 65 -6.987 2.275 -9.843
346 HE2 HIS 65 2HE HIS 65 -7.659 4.225 -8.358
347 H LEU 66 H LEU 66 -4.027 1.428 -3.014
348 HA LEU 66 HA LEU 66 -1.203 1.310 -2.775
349 HB2 LEU 66 2HB LEU 66 -2.583 2.594 -1.241
350 HB3 LEU 66 1HB LEU 66 -3.413 1.140 -0.738
351 HG LEU 66 HG LEU 66 -1.345 0.329 0.322
352 HD11 LEU 66 1HD1 LEU 66 0.534 1.848 0.622
353 HD12 LEU 66 2HD1 LEU 66 -0.234 3.011 -0.463
354 HD13 LEU 66 3HD1 LEU 66 0.293 1.442 -1.075
355 HD21 LEU 66 3HD2 LEU 66 -2.978 1.579 1.610
356 HD22 LEU 66 1HD2 LEU 66 -2.188 3.088 1.156
357 HD23 LEU 66 2HD2 LEU 66 -1.338 1.917 2.165
358 H CYS 67 H CYS 67 -3.798 -0.913 -1.847
359 HA CYS 67 HA CYS 67 -2.188 -2.968 -0.844
360 HB2 CYS 67 2HB CYS 67 -4.482 -2.907 -0.246
361 HB3 CYS 67 1HB CYS 67 -5.006 -2.951 -1.923
362 H THR 68 H THR 68 -3.511 -2.553 -4.176
363 HA THR 68 HA THR 68 -2.576 -4.981 -5.160
364 HB THR 68 HB THR 68 -2.614 -3.745 -7.399
365 HG1 THR 68 1HG THR 68 -4.096 -1.742 -6.719
366 HG21 THR 68 3HG2 THR 68 -5.088 -3.535 -7.389
367 HG22 THR 68 1HG2 THR 68 -5.072 -3.731 -5.638
368 HG23 THR 68 2HG2 THR 68 -4.518 -5.044 -6.694
369 H GLU 69 H GLU 69 -1.052 -1.764 -5.188
370 HA GLU 69 HA GLU 69 1.310 -2.505 -6.501
371 HB2 GLU 69 2HB GLU 69 0.492 -0.175 -6.163
372 HB3 GLU 69 1HB GLU 69 0.913 -0.319 -4.465
373 HG2 GLU 69 2HG GLU 69 2.623 0.876 -5.538
374 HG3 GLU 69 1HG GLU 69 3.265 -0.720 -5.149
375 H SER 70 H SER 70 0.346 -2.506 -3.120
376 HA SER 70 HA SER 70 2.836 -2.942 -1.957
377 HB2 SER 70 2HB SER 70 0.680 -2.288 -0.779
378 HB3 SER 70 1HB SER 70 0.193 -3.978 -0.905
379 HG SER 70 HG SER 70 2.140 -2.749 0.612
380 H LEU 71 H LEU 71 0.352 -5.208 -3.096
381 HA LEU 71 HA LEU 71 1.716 -7.601 -2.377
382 HB2 LEU 71 2HB LEU 71 -0.363 -7.145 -4.509
383 HB3 LEU 71 1HB LEU 71 0.108 -8.702 -3.861
384 HG LEU 71 HG LEU 71 -1.265 -6.503 -2.324
385 HD11 LEU 71 1HD1 LEU 71 -2.321 -9.140 -3.323
386 HD12 LEU 71 2HD1 LEU 71 -2.691 -7.555 -4.003
387 HD13 LEU 71 3HD1 LEU 71 -3.207 -7.948 -2.366
388 HD21 LEU 71 3HD2 LEU 71 0.203 -7.843 -0.902
389 HD22 LEU 71 1HD2 LEU 71 -0.542 -9.320 -1.513
390 HD23 LEU 71 2HD2 LEU 71 -1.489 -8.179 -0.558
391 H LYS 72 H LYS 72 1.359 -5.802 -5.343
392 HA LYS 72 HA LYS 72 2.778 -7.375 -7.119
393 HB2 LYS 72 2HB LYS 72 1.314 -5.608 -7.790
394 HB3 LYS 72 1HB LYS 72 2.259 -4.404 -6.963
395 HG2 LYS 72 2HG LYS 72 3.167 -5.896 -9.440
396 HG3 LYS 72 1HG LYS 72 2.381 -4.324 -9.466
397 HD2 LYS 72 2HD LYS 72 4.343 -3.647 -7.858
398 HD3 LYS 72 1HD LYS 72 5.129 -5.070 -8.532
399 HE2 LYS 72 2HE LYS 72 5.819 -3.131 -9.768
400 HE3 LYS 72 1HE LYS 72 4.768 -4.106 -10.802
401 HZ1 LYS 72 3HZ LYS 72 4.327 -1.646 -10.784
402 HZ2 LYS 72 1HZ LYS 72 3.798 -1.828 -9.189
403 HZ3 LYS 72 2HZ LYS 72 2.984 -2.612 -10.456
404 H SER 73 H SER 73 3.911 -4.746 -5.039
405 HA SER 73 HA SER 73 6.645 -5.106 -5.940
406 HB2 SER 73 2HB SER 73 5.454 -3.128 -3.994
407 HB3 SER 73 1HB SER 73 7.084 -3.073 -4.665
408 HG SER 73 HG SER 73 4.608 -2.723 -6.050
409 H ASN 74 H ASN 74 5.018 -6.938 -3.948
410 HA ASN 74 HA ASN 74 5.398 -8.239 -2.142
411 HB2 ASN 74 2HB ASN 74 8.198 -7.793 -3.100
412 HB3 ASN 74 1HB ASN 74 7.875 -8.795 -1.693
413 HD21 ASN 74 1HD2 ASN 74 8.718 -10.549 -2.728
414 HD22 ASN 74 2HD2 ASN 74 7.866 -11.401 -3.971
415 H GLY 75 H GLY 75 4.593 -6.097 -1.072
416 HA2 GLY 75 2HA GLY 75 4.477 -5.198 1.049
417 HA3 GLY 75 1HA GLY 75 5.853 -6.191 1.485
418 H ARG 76 H ARG 76 6.328 -4.168 -1.193
419 HA ARG 76 HA ARG 76 8.409 -2.660 -0.025
420 HB2 ARG 76 2HB ARG 76 8.227 -2.993 -2.436
421 HB3 ARG 76 1HB ARG 76 6.727 -2.095 -2.460
422 HG2 ARG 76 2HG ARG 76 7.913 -0.058 -1.795
423 HG3 ARG 76 1HG ARG 76 9.430 -0.959 -1.785
424 HD2 ARG 76 2HD ARG 76 9.173 -1.440 -4.160
425 HD3 ARG 76 1HD ARG 76 7.632 -0.595 -4.171
426 HE ARG 76 HE ARG 76 8.986 1.415 -3.468
427 HH11 ARG 76 1HH1 ARG 76 10.499 -1.191 -5.361
428 HH12 ARG 76 2HH1 ARG 76 11.488 -0.156 -6.261
429 HH21 ARG 76 1HH2 ARG 76 10.307 2.826 -4.691
430 HH22 ARG 76 2HH2 ARG 76 11.414 2.202 -5.841
431 H VAL 77 H VAL 77 5.122 -1.797 -0.830
432 HA VAL 77 HA VAL 77 5.481 0.637 0.720
433 HB VAL 77 HB VAL 77 5.056 1.099 -1.607
434 HG11 VAL 77 1HG1 VAL 77 3.941 -0.910 -2.300
435 HG12 VAL 77 2HG1 VAL 77 2.966 0.498 -2.728
436 HG13 VAL 77 3HG1 VAL 77 2.523 -0.493 -1.337
437 HG21 VAL 77 3HG2 VAL 77 2.648 1.693 0.075
438 HG22 VAL 77 1HG2 VAL 77 3.067 2.504 -1.432
439 HG23 VAL 77 2HG2 VAL 77 4.126 2.659 -0.022
440 H GLN 78 H GLN 78 4.546 0.749 2.591
441 HA GLN 78 HA GLN 78 2.084 -0.754 3.107
442 HB2 GLN 78 2HB GLN 78 4.207 0.423 4.903
443 HB3 GLN 78 1HB GLN 78 2.603 0.117 5.520
444 HG2 GLN 78 2HG GLN 78 4.124 -1.637 6.144
445 HG3 GLN 78 1HG GLN 78 2.873 -2.253 5.069
446 HE21 GLN 78 1HE2 GLN 78 3.471 -3.093 3.106
447 HE22 GLN 78 2HE2 GLN 78 5.147 -3.328 2.691
448 H PHE 79 H PHE 79 0.641 0.562 4.670
449 HA PHE 79 HA PHE 79 0.020 3.104 3.475
450 HB2 PHE 79 2HB PHE 79 -1.747 1.565 4.345
451 HB3 PHE 79 1HB PHE 79 -1.052 1.733 5.949
452 HD1 PHE 79 2HD PHE 79 -2.716 3.679 3.258
453 HD2 PHE 79 1HD PHE 79 -1.773 3.374 7.394
454 HE1 PHE 79 2HE PHE 79 -4.234 5.555 3.747
455 HE2 PHE 79 1HE PHE 79 -3.282 5.235 7.876
456 HZ PHE 79 HZ PHE 79 -4.515 6.332 6.055
457 H LEU 80 H LEU 80 1.007 4.957 4.046
458 HA LEU 80 HA LEU 80 2.683 4.917 6.425
459 HB2 LEU 80 2HB LEU 80 3.585 5.664 4.238
460 HB3 LEU 80 1HB LEU 80 2.456 6.997 4.263
461 HG LEU 80 HG LEU 80 3.548 7.821 6.332
462 HD11 LEU 80 1HD1 LEU 80 5.583 5.699 5.702
463 HD12 LEU 80 2HD1 LEU 80 4.540 5.753 7.125
464 HD13 LEU 80 3HD1 LEU 80 5.778 6.986 6.887
465 HD21 LEU 80 3HD2 LEU 80 5.507 8.728 5.180
466 HD22 LEU 80 1HD2 LEU 80 4.063 8.759 4.170
467 HD23 LEU 80 2HD2 LEU 80 5.301 7.529 3.896
468 H HIS 81 H HIS 81 0.268 7.037 4.892
469 HA HIS 81 HA HIS 81 -1.032 7.522 7.332
470 HB2 HIS 81 2HB HIS 81 -0.729 9.996 7.467
471 HB3 HIS 81 1HB HIS 81 0.753 9.115 7.800
472 HD1 HIS 81 1HD HIS 81 -0.850 11.338 5.140
473 HD2 HIS 81 2HD HIS 81 2.861 9.757 6.171
474 HE1 HIS 81 1HE HIS 81 0.842 12.445 3.630
475 HE2 HIS 81 2HE HIS 81 3.026 11.756 4.589
476 H ASP 82 H ASP 82 -2.798 9.162 7.052
477 HA ASP 82 HA ASP 82 -4.217 8.606 4.646
478 HB2 ASP 82 2HB ASP 82 -4.781 10.354 7.049
479 HB3 ASP 82 1HB ASP 82 -5.885 10.208 5.702
480 H GLY 83 H GLY 83 -4.823 10.148 3.036
481 HA2 GLY 83 2HA GLY 83 -4.850 12.199 2.015
482 HA3 GLY 83 1HA GLY 83 -3.842 12.848 3.303
483 H SER 84 H SER 84 -3.173 13.609 0.885
484 HA SER 84 HA SER 84 -1.402 11.972 -0.530
485 HB2 SER 84 2HB SER 84 -1.531 14.981 -0.333
486 HB3 SER 84 1HB SER 84 -0.779 14.048 -1.639
487 HG SER 84 HG SER 84 -2.680 13.649 -2.455
488 H CYS 85 H CYS 85 0.894 12.069 -0.595
489 HA CYS 85 HA CYS 85 2.132 12.042 1.909
490 HB2 CYS 85 2HB CYS 85 3.386 12.147 -0.839
491 HB3 CYS 85 1HB CYS 85 4.230 11.780 0.665
Start of MODEL 10
1 H1 SER 20 1HT SER 20 5.517 10.229 18.088
2 H2 SER 20 2HT SER 20 6.734 9.078 17.800
3 H3 SER 20 3HT SER 20 6.830 10.567 17.057
4 HA SER 20 HA SER 20 7.014 10.006 19.932
5 HB2 SER 20 2HB SER 20 9.366 10.874 19.541
6 HB3 SER 20 1HB SER 20 9.023 9.293 18.840
7 HG SER 20 HG SER 20 10.123 10.840 17.451
8 H GLU 21 H GLU 21 7.888 12.609 17.637
9 HA GLU 21 HA GLU 21 7.121 14.556 19.640
10 HB2 GLU 21 2HB GLU 21 7.956 16.225 18.013
11 HB3 GLU 21 1HB GLU 21 9.152 15.014 18.444
12 HG2 GLU 21 2HG GLU 21 8.796 13.862 16.361
13 HG3 GLU 21 1HG GLU 21 7.497 14.978 15.934
14 H ALA 22 H ALA 22 5.852 13.087 16.865
15 HA ALA 22 HA ALA 22 3.535 14.861 16.967
16 HB1 ALA 22 1HB ALA 22 4.623 13.294 14.621
17 HB2 ALA 22 2HB ALA 22 4.728 15.039 14.829
18 HB3 ALA 22 3HB ALA 22 3.154 14.270 14.609
19 H ALA 23 H ALA 23 1.714 13.880 17.504
20 HA ALA 23 HA ALA 23 1.731 11.029 18.070
21 HB1 ALA 23 1HB ALA 23 -0.327 13.179 18.608
22 HB2 ALA 23 2HB ALA 23 0.863 12.555 19.756
23 HB3 ALA 23 3HB ALA 23 -0.427 11.510 19.165
24 H SER 24 H SER 24 1.818 11.781 15.328
25 HA SER 24 HA SER 24 -0.797 11.551 14.196
26 HB2 SER 24 2HB SER 24 0.654 11.582 12.085
27 HB3 SER 24 1HB SER 24 0.658 13.017 13.116
28 HG SER 24 HG SER 24 2.692 11.415 12.436
29 H LEU 25 H LEU 25 0.978 9.348 15.661
30 HA LEU 25 HA LEU 25 0.966 7.282 13.659
31 HB2 LEU 25 2HB LEU 25 1.586 7.098 16.609
32 HB3 LEU 25 1HB LEU 25 1.813 5.816 15.442
33 HG LEU 25 HG LEU 25 3.320 8.432 15.515
34 HD11 LEU 25 1HD1 LEU 25 5.230 7.034 16.112
35 HD12 LEU 25 2HD1 LEU 25 4.177 5.621 16.155
36 HD13 LEU 25 3HD1 LEU 25 3.941 6.931 17.311
37 HD21 LEU 25 3HD2 LEU 25 3.639 6.046 13.685
38 HD22 LEU 25 1HD2 LEU 25 4.715 7.442 13.754
39 HD23 LEU 25 2HD2 LEU 25 3.051 7.644 13.218
40 H SER 26 H SER 26 -1.172 7.249 13.181
41 HA SER 26 HA SER 26 -3.094 6.473 15.199
42 HB2 SER 26 2HB SER 26 -3.423 6.861 12.207
43 HB3 SER 26 1HB SER 26 -4.724 6.731 13.392
44 HG SER 26 HG SER 26 -3.567 8.624 14.400
45 HA PRO 27 HA PRO 27 -2.262 2.145 14.304
46 HB2 PRO 27 2HB PRO 27 -4.237 1.023 15.737
47 HB3 PRO 27 1HB PRO 27 -2.863 1.844 16.494
48 HG2 PRO 27 2HG PRO 27 -5.618 2.895 15.962
49 HG3 PRO 27 1HG PRO 27 -4.663 2.995 17.455
50 HD2 PRO 27 2HD PRO 27 -4.831 5.039 15.683
51 HD3 PRO 27 1HD PRO 27 -3.381 4.735 16.660
52 H LYS 28 H LYS 28 -3.746 3.590 12.406
53 HA LYS 28 HA LYS 28 -5.783 1.697 11.443
54 HB2 LYS 28 2HB LYS 28 -6.514 4.039 11.571
55 HB3 LYS 28 1HB LYS 28 -5.149 4.537 10.585
56 HG2 LYS 28 2HG LYS 28 -6.079 3.266 8.693
57 HG3 LYS 28 1HG LYS 28 -7.459 2.808 9.698
58 HD2 LYS 28 2HD LYS 28 -8.055 5.149 9.967
59 HD3 LYS 28 1HD LYS 28 -6.664 5.638 9.005
60 HE2 LYS 28 2HE LYS 28 -8.711 5.695 7.675
61 HE3 LYS 28 1HE LYS 28 -7.600 4.473 7.062
62 HZ1 LYS 28 3HZ LYS 28 -9.935 3.913 8.823
63 HZ2 LYS 28 1HZ LYS 28 -8.911 2.780 8.130
64 HZ3 LYS 28 2HZ LYS 28 -9.920 3.700 7.161
65 H LYS 29 H LYS 29 -5.381 0.619 9.557
66 HA LYS 29 HA LYS 29 -2.912 1.260 8.124
67 HB2 LYS 29 2HB LYS 29 -2.371 -1.116 7.965
68 HB3 LYS 29 1HB LYS 29 -2.448 -0.632 9.653
69 HG2 LYS 29 2HG LYS 29 -4.662 -1.630 9.860
70 HG3 LYS 29 1HG LYS 29 -4.639 -2.066 8.153
71 HD2 LYS 29 2HD LYS 29 -2.669 -3.488 8.571
72 HD3 LYS 29 1HD LYS 29 -2.769 -3.072 10.285
73 HE2 LYS 29 2HE LYS 29 -4.997 -4.060 10.402
74 HE3 LYS 29 1HE LYS 29 -4.917 -4.461 8.690
75 HZ1 LYS 29 3HZ LYS 29 -4.406 -6.358 10.045
76 HZ2 LYS 29 1HZ LYS 29 -3.150 -5.560 10.821
77 HZ3 LYS 29 2HZ LYS 29 -3.025 -5.934 9.189
78 H VAL 30 H VAL 30 -2.987 -0.127 6.025
79 HA VAL 30 HA VAL 30 -5.645 0.175 4.917
80 HB VAL 30 HB VAL 30 -3.722 0.935 3.530
81 HG11 VAL 30 1HG1 VAL 30 -2.850 -1.955 3.474
82 HG12 VAL 30 2HG1 VAL 30 -2.011 -0.645 4.293
83 HG13 VAL 30 3HG1 VAL 30 -2.138 -0.644 2.532
84 HG21 VAL 30 3HG2 VAL 30 -5.113 -1.467 2.353
85 HG22 VAL 30 1HG2 VAL 30 -4.300 -0.199 1.435
86 HG23 VAL 30 2HG2 VAL 30 -5.736 0.180 2.394
87 H ASP 31 H ASP 31 -6.989 -1.557 4.519
88 HA ASP 31 HA ASP 31 -5.955 -4.118 5.455
89 HB2 ASP 31 2HB ASP 31 -8.321 -3.346 6.100
90 HB3 ASP 31 1HB ASP 31 -8.757 -3.619 4.417
91 H CYS 32 H CYS 32 -4.626 -4.712 3.950
92 HA CYS 32 HA CYS 32 -5.476 -4.650 1.194
93 HB2 CYS 32 2HB CYS 32 -3.193 -3.881 1.922
94 HB3 CYS 32 1HB CYS 32 -2.843 -5.530 2.405
95 H SER 33 H SER 33 -5.686 -6.637 3.851
96 HA SER 33 HA SER 33 -5.216 -9.126 2.642
97 HB2 SER 33 2HB SER 33 -6.595 -8.407 5.222
98 HB3 SER 33 1HB SER 33 -6.142 -10.050 4.732
99 HG SER 33 HG SER 33 -4.571 -8.731 6.060
100 H ILE 34 H ILE 34 -8.114 -7.161 3.034
101 HA ILE 34 HA ILE 34 -9.845 -9.146 2.030
102 HB ILE 34 HB ILE 34 -11.401 -7.287 1.397
103 HG12 ILE 34 2HG1 ILE 34 -9.215 -5.503 2.510
104 HG13 ILE 34 1HG1 ILE 34 -9.727 -5.578 0.832
105 HG21 ILE 34 1HG2 ILE 34 -11.848 -6.556 3.687
106 HG22 ILE 34 2HG2 ILE 34 -10.279 -7.185 4.180
107 HG23 ILE 34 3HG2 ILE 34 -11.522 -8.286 3.579
108 HD11 ILE 34 3HD1 ILE 34 -11.922 -4.718 1.460
109 HD12 ILE 34 1HD1 ILE 34 -10.630 -3.626 1.961
110 HD13 ILE 34 2HD1 ILE 34 -11.420 -4.664 3.150
111 H TYR 35 H TYR 35 -7.548 -7.117 0.427
112 HA TYR 35 HA TYR 35 -8.753 -7.731 -2.124
113 HB2 TYR 35 2HB TYR 35 -6.271 -6.092 -1.581
114 HB3 TYR 35 1HB TYR 35 -7.092 -6.244 -3.133
115 HD1 TYR 35 2HD TYR 35 -9.587 -5.515 -3.171
116 HD2 TYR 35 1HD TYR 35 -6.834 -4.353 -0.169
117 HE1 TYR 35 2HE TYR 35 -11.060 -3.657 -2.542
118 HE2 TYR 35 1HE TYR 35 -8.294 -2.497 0.472
119 HH TYR 35 HH TYR 35 -10.050 -1.157 -0.411
120 H LYS 36 H LYS 36 -6.570 -9.089 -0.029
121 HA LYS 36 HA LYS 36 -4.846 -10.425 -1.861
122 HB2 LYS 36 2HB LYS 36 -5.658 -11.166 0.964
123 HB3 LYS 36 1HB LYS 36 -4.479 -12.073 0.035
124 HG2 LYS 36 2HG LYS 36 -3.046 -10.096 -0.047
125 HG3 LYS 36 1HG LYS 36 -4.205 -9.189 0.923
126 HD2 LYS 36 2HD LYS 36 -3.921 -10.861 2.748
127 HD3 LYS 36 1HD LYS 36 -2.745 -11.711 1.754
128 HE2 LYS 36 2HE LYS 36 -1.565 -10.373 3.372
129 HE3 LYS 36 1HE LYS 36 -1.322 -9.666 1.780
130 HZ1 LYS 36 3HZ LYS 36 -2.960 -7.988 2.306
131 HZ2 LYS 36 1HZ LYS 36 -1.743 -8.000 3.457
132 HZ3 LYS 36 2HZ LYS 36 -3.238 -8.661 3.847
133 H LYS 37 H LYS 37 -8.081 -10.729 -1.108
134 HA LYS 37 HA LYS 37 -8.451 -13.490 -1.818
135 HB2 LYS 37 2HB LYS 37 -10.437 -11.231 -1.593
136 HB3 LYS 37 1HB LYS 37 -10.865 -12.920 -1.802
137 HG2 LYS 37 2HG LYS 37 -9.753 -13.410 0.371
138 HG3 LYS 37 1HG LYS 37 -9.483 -11.680 0.571
139 HD2 LYS 37 2HD LYS 37 -12.185 -13.013 0.281
140 HD3 LYS 37 1HD LYS 37 -11.461 -12.472 1.794
141 HE2 LYS 37 2HE LYS 37 -11.494 -10.159 1.007
142 HE3 LYS 37 1HE LYS 37 -12.134 -10.683 -0.547
143 HZ1 LYS 37 3HZ LYS 37 -13.539 -10.956 2.062
144 HZ2 LYS 37 1HZ LYS 37 -14.110 -11.445 0.546
145 HZ3 LYS 37 2HZ LYS 37 -13.870 -9.816 0.844
146 H TYR 38 H TYR 38 -7.815 -10.680 -3.568
147 HA TYR 38 HA TYR 38 -9.072 -11.742 -6.004
148 HB2 TYR 38 2HB TYR 38 -7.968 -8.950 -5.525
149 HB3 TYR 38 1HB TYR 38 -8.846 -9.504 -6.928
150 HD1 TYR 38 2HD TYR 38 -11.272 -10.514 -6.275
151 HD2 TYR 38 1HD TYR 38 -9.091 -7.637 -4.060
152 HE1 TYR 38 2HE TYR 38 -13.360 -9.709 -5.277
153 HE2 TYR 38 1HE TYR 38 -11.183 -6.823 -3.038
154 HH TYR 38 HH TYR 38 -13.533 -6.778 -3.511
155 HA PRO 39 HA PRO 39 -4.850 -12.443 -7.413
156 HB2 PRO 39 2HB PRO 39 -5.162 -11.778 -10.075
157 HB3 PRO 39 1HB PRO 39 -5.583 -13.356 -9.408
158 HG2 PRO 39 2HG PRO 39 -7.341 -11.024 -10.015
159 HG3 PRO 39 1HG PRO 39 -7.647 -12.757 -10.258
160 HD2 PRO 39 2HD PRO 39 -8.720 -11.385 -8.214
161 HD3 PRO 39 1HD PRO 39 -8.230 -13.084 -8.046
162 H VAL 40 H VAL 40 -3.045 -11.134 -7.866
163 HA VAL 40 HA VAL 40 -3.241 -8.472 -6.969
164 HB VAL 40 HB VAL 40 -0.917 -9.711 -8.464
165 HG11 VAL 40 1HG1 VAL 40 -0.727 -7.300 -8.256
166 HG12 VAL 40 2HG1 VAL 40 0.466 -8.106 -7.234
167 HG13 VAL 40 3HG1 VAL 40 -0.986 -7.413 -6.515
168 HG21 VAL 40 3HG2 VAL 40 -0.004 -10.276 -6.244
169 HG22 VAL 40 1HG2 VAL 40 -1.512 -11.125 -6.590
170 HG23 VAL 40 2HG2 VAL 40 -1.513 -9.733 -5.510
171 H VAL 41 H VAL 41 -3.182 -9.839 -10.166
172 HA VAL 41 HA VAL 41 -2.734 -7.290 -11.420
173 HB VAL 41 HB VAL 41 -3.073 -8.417 -13.570
174 HG11 VAL 41 1HG1 VAL 41 -0.880 -8.474 -12.557
175 HG12 VAL 41 2HG1 VAL 41 -1.187 -9.972 -13.437
176 HG13 VAL 41 3HG1 VAL 41 -1.300 -9.942 -11.676
177 HG21 VAL 41 3HG2 VAL 41 -4.827 -9.999 -12.954
178 HG22 VAL 41 1HG2 VAL 41 -3.697 -10.865 -11.914
179 HG23 VAL 41 2HG2 VAL 41 -3.455 -10.853 -13.661
180 H ALA 42 H ALA 42 -5.572 -9.021 -10.406
181 HA ALA 42 HA ALA 42 -7.156 -6.970 -11.739
182 HB1 ALA 42 1HB ALA 42 -7.413 -9.087 -12.968
183 HB2 ALA 42 2HB ALA 42 -8.924 -8.555 -12.238
184 HB3 ALA 42 3HB ALA 42 -8.001 -9.860 -11.496
185 H ILE 43 H ILE 43 -7.385 -5.739 -9.975
186 HA ILE 43 HA ILE 43 -8.938 -6.894 -7.779
187 HB ILE 43 HB ILE 43 -6.916 -4.616 -7.600
188 HG12 ILE 43 2HG1 ILE 43 -6.744 -7.428 -6.475
189 HG13 ILE 43 1HG1 ILE 43 -5.833 -6.832 -7.852
190 HG21 ILE 43 1HG2 ILE 43 -8.548 -5.957 -5.441
191 HG22 ILE 43 2HG2 ILE 43 -8.767 -4.316 -6.055
192 HG23 ILE 43 3HG2 ILE 43 -7.302 -4.737 -5.172
193 HD11 ILE 43 3HD1 ILE 43 -4.469 -6.903 -5.844
194 HD12 ILE 43 1HD1 ILE 43 -5.604 -5.833 -5.018
195 HD13 ILE 43 2HD1 ILE 43 -4.680 -5.243 -6.401
196 HA PRO 44 HA PRO 44 -11.629 -3.637 -9.406
197 HB2 PRO 44 2HB PRO 44 -13.516 -4.262 -7.278
198 HB3 PRO 44 1HB PRO 44 -13.678 -4.572 -9.006
199 HG2 PRO 44 2HG PRO 44 -13.378 -6.550 -7.158
200 HG3 PRO 44 1HG PRO 44 -12.829 -6.693 -8.836
201 HD2 PRO 44 2HD PRO 44 -11.255 -6.072 -6.373
202 HD3 PRO 44 1HD PRO 44 -10.847 -7.120 -7.748
203 H CYS 45 H CYS 45 -11.687 -1.529 -8.871
204 HA CYS 45 HA CYS 45 -11.318 -0.765 -6.069
205 HB2 CYS 45 2HB CYS 45 -9.913 0.466 -8.456
206 HB3 CYS 45 1HB CYS 45 -9.793 1.030 -6.797
207 HA PRO 46 HA PRO 46 -14.708 1.923 -7.044
208 HB2 PRO 46 2HB PRO 46 -14.387 3.859 -5.186
209 HB3 PRO 46 1HB PRO 46 -14.993 2.248 -4.790
210 HG2 PRO 46 2HG PRO 46 -12.224 3.358 -4.505
211 HG3 PRO 46 1HG PRO 46 -13.148 2.375 -3.355
212 HD2 PRO 46 2HD PRO 46 -11.247 1.308 -4.956
213 HD3 PRO 46 1HD PRO 46 -12.707 0.410 -4.491
214 H ILE 47 H ILE 47 -15.182 3.980 -7.866
215 HA ILE 47 HA ILE 47 -13.044 5.194 -9.362
216 HB ILE 47 HB ILE 47 -14.769 6.770 -10.221
217 HG12 ILE 47 2HG1 ILE 47 -16.666 5.243 -8.416
218 HG13 ILE 47 1HG1 ILE 47 -16.142 6.902 -8.163
219 HG21 ILE 47 1HG2 ILE 47 -16.130 5.102 -11.414
220 HG22 ILE 47 2HG2 ILE 47 -15.568 3.862 -10.291
221 HG23 ILE 47 3HG2 ILE 47 -14.422 4.662 -11.366
222 HD11 ILE 47 3HD1 ILE 47 -17.770 5.888 -10.483
223 HD12 ILE 47 1HD1 ILE 47 -17.255 7.556 -10.232
224 HD13 ILE 47 2HD1 ILE 47 -18.379 6.804 -9.100
225 H THR 48 H THR 48 -14.257 5.582 -6.293
226 HA THR 48 HA THR 48 -14.033 8.330 -5.790
227 HB THR 48 HB THR 48 -13.530 6.129 -3.798
228 HG1 THR 48 1HG THR 48 -15.994 6.998 -4.921
229 HG21 THR 48 3HG2 THR 48 -13.410 8.489 -3.041
230 HG22 THR 48 1HG2 THR 48 -14.778 7.641 -2.317
231 HG23 THR 48 2HG2 THR 48 -15.042 8.754 -3.655
232 H TYR 49 H TYR 49 -12.343 9.552 -5.414
233 HA TYR 49 HA TYR 49 -9.692 8.398 -5.325
234 HB2 TYR 49 2HB TYR 49 -10.063 10.230 -6.914
235 HB3 TYR 49 1HB TYR 49 -10.665 11.249 -5.625
236 HD1 TYR 49 1HD TYR 49 -7.575 9.600 -6.877
237 HD2 TYR 49 2HD TYR 49 -9.213 12.528 -4.262
238 HE1 TYR 49 1HE TYR 49 -5.312 10.470 -6.420
239 HE2 TYR 49 2HE TYR 49 -6.958 13.387 -3.803
240 HH TYR 49 HH TYR 49 -4.237 12.490 -5.648
241 H LEU 50 H LEU 50 -9.077 7.870 -3.387
242 HA LEU 50 HA LEU 50 -9.651 9.683 -1.163
243 HB2 LEU 50 2HB LEU 50 -9.336 6.671 -1.093
244 HB3 LEU 50 1HB LEU 50 -9.556 7.697 0.306
245 HG LEU 50 HG LEU 50 -11.606 7.294 -1.879
246 HD11 LEU 50 1HD1 LEU 50 -11.462 6.157 0.902
247 HD12 LEU 50 2HD1 LEU 50 -11.261 5.267 -0.611
248 HD13 LEU 50 3HD1 LEU 50 -12.817 6.001 -0.218
249 HD21 LEU 50 3HD2 LEU 50 -13.133 8.406 -0.323
250 HD22 LEU 50 1HD2 LEU 50 -11.801 9.467 -0.781
251 HD23 LEU 50 2HD2 LEU 50 -11.798 8.675 0.795
252 HA PRO 51 HA PRO 51 -5.215 9.695 -2.084
253 HB2 PRO 51 2HB PRO 51 -4.644 11.778 -0.346
254 HB3 PRO 51 1HB PRO 51 -5.055 11.975 -2.046
255 HG2 PRO 51 2HG PRO 51 -6.744 12.337 0.366
256 HG3 PRO 51 1HG PRO 51 -6.805 13.181 -1.186
257 HD2 PRO 51 2HD PRO 51 -8.597 11.269 -0.465
258 HD3 PRO 51 1HD PRO 51 -8.148 11.592 -2.148
259 H VAL 52 H VAL 52 -4.008 8.250 -1.192
260 HA VAL 52 HA VAL 52 -3.639 8.265 1.695
261 HB VAL 52 HB VAL 52 -3.390 5.793 1.715
262 HG11 VAL 52 1HG1 VAL 52 -5.763 5.174 1.562
263 HG12 VAL 52 2HG1 VAL 52 -6.094 6.700 0.738
264 HG13 VAL 52 3HG1 VAL 52 -5.523 6.704 2.406
265 HG21 VAL 52 3HG2 VAL 52 -4.412 5.932 -1.123
266 HG22 VAL 52 1HG2 VAL 52 -4.245 4.450 -0.174
267 HG23 VAL 52 2HG2 VAL 52 -2.817 5.395 -0.584
268 H CYS 53 H CYS 53 -1.556 7.632 2.331
269 HA CYS 53 HA CYS 53 0.379 7.879 0.149
270 HB2 CYS 53 2HB CYS 53 0.346 9.832 1.584
271 HB3 CYS 53 1HB CYS 53 0.551 8.830 3.013
272 H GLY 54 H GLY 54 1.789 6.313 -0.083
273 HA2 GLY 54 2HA GLY 54 1.722 4.101 1.807
274 HA3 GLY 54 1HA GLY 54 2.434 4.072 0.199
275 H SER 55 H SER 55 3.786 3.050 2.326
276 HA SER 55 HA SER 55 5.542 4.767 3.655
277 HB2 SER 55 2HB SER 55 6.859 2.601 3.947
278 HB3 SER 55 1HB SER 55 5.186 2.593 4.511
279 HG SER 55 HG SER 55 6.361 1.061 2.678
280 H ASP 56 H ASP 56 5.489 3.831 0.422
281 HA ASP 56 HA ASP 56 8.333 4.192 -0.071
282 HB2 ASP 56 2HB ASP 56 6.857 2.506 -1.292
283 HB3 ASP 56 1HB ASP 56 6.105 3.873 -2.105
284 H TYR 57 H TYR 57 5.895 6.166 0.630
285 HA TYR 57 HA TYR 57 5.456 8.326 0.569
286 HB2 TYR 57 2HB TYR 57 8.229 8.547 -0.598
287 HB3 TYR 57 1HB TYR 57 7.263 9.936 -0.113
288 HD1 TYR 57 1HD TYR 57 6.624 10.189 2.302
289 HD2 TYR 57 2HD TYR 57 9.448 7.284 1.016
290 HE1 TYR 57 1HE TYR 57 7.440 9.970 4.613
291 HE2 TYR 57 2HE TYR 57 10.271 7.050 3.322
292 HH TYR 57 HH TYR 57 8.618 8.162 5.983
293 H ILE 58 H ILE 58 4.513 6.744 -1.436
294 HA ILE 58 HA ILE 58 4.289 8.634 -3.671
295 HB ILE 58 HB ILE 58 3.644 5.664 -3.628
296 HG12 ILE 58 2HG1 ILE 58 6.062 5.990 -3.539
297 HG13 ILE 58 1HG1 ILE 58 5.589 5.365 -5.112
298 HG21 ILE 58 1HG2 ILE 58 3.638 7.606 -5.938
299 HG22 ILE 58 2HG2 ILE 58 2.224 6.870 -5.184
300 HG23 ILE 58 3HG2 ILE 58 3.376 5.868 -6.062
301 HD11 ILE 58 3HD1 ILE 58 6.289 8.231 -4.481
302 HD12 ILE 58 1HD1 ILE 58 5.802 7.610 -6.062
303 HD13 ILE 58 2HD1 ILE 58 7.305 7.061 -5.319
304 H THR 59 H THR 59 2.334 9.543 -3.923
305 HA THR 59 HA THR 59 0.227 8.944 -2.069
306 HB THR 59 HB THR 59 0.329 10.897 -4.387
307 HG1 THR 59 1HG THR 59 1.774 11.622 -3.002
308 HG21 THR 59 3HG2 THR 59 -1.967 10.419 -3.775
309 HG22 THR 59 1HG2 THR 59 -1.550 12.025 -3.186
310 HG23 THR 59 2HG2 THR 59 -1.613 10.650 -2.068
311 H TYR 60 H TYR 60 -1.363 7.580 -2.470
312 HA TYR 60 HA TYR 60 -1.729 6.646 -5.210
313 HB2 TYR 60 2HB TYR 60 -2.396 5.293 -2.595
314 HB3 TYR 60 1HB TYR 60 -2.795 4.637 -4.184
315 HD1 TYR 60 1HD TYR 60 -0.963 3.999 -5.730
316 HD2 TYR 60 2HD TYR 60 -0.207 5.094 -1.700
317 HE1 TYR 60 1HE TYR 60 1.255 2.989 -5.882
318 HE2 TYR 60 2HE TYR 60 2.024 4.071 -1.841
319 HH TYR 60 HH TYR 60 3.434 3.086 -4.791
320 H GLY 61 H GLY 61 -3.785 6.332 -5.988
321 HA2 GLY 61 2HA GLY 61 -5.497 8.517 -5.435
322 HA3 GLY 61 1HA GLY 61 -5.788 7.236 -6.603
323 H ASN 62 H ASN 62 -5.375 5.389 -4.162
324 HA ASN 62 HA ASN 62 -7.165 5.863 -2.196
325 HB2 ASN 62 2HB ASN 62 -9.108 4.409 -2.666
326 HB3 ASN 62 1HB ASN 62 -9.021 5.730 -3.786
327 HD21 ASN 62 1HD2 ASN 62 -10.256 4.765 -5.306
328 HD22 ASN 62 2HD2 ASN 62 -9.770 3.412 -6.256
329 H GLU 63 H GLU 63 -7.835 3.762 -1.118
330 HA GLU 63 HA GLU 63 -5.362 2.554 -0.535
331 HB2 GLU 63 2HB GLU 63 -6.895 1.016 0.933
332 HB3 GLU 63 1HB GLU 63 -6.558 2.678 1.389
333 HG2 GLU 63 2HG GLU 63 -8.901 2.070 1.733
334 HG3 GLU 63 1HG GLU 63 -8.752 3.347 0.546
335 H CYS 64 H CYS 64 -7.983 1.544 -2.500
336 HA CYS 64 HA CYS 64 -7.272 -1.145 -2.760
337 HB2 CYS 64 2HB CYS 64 -9.409 -0.207 -3.568
338 HB3 CYS 64 1HB CYS 64 -8.539 0.646 -4.837
339 H HIS 65 H HIS 65 -6.284 1.707 -4.658
340 HA HIS 65 HA HIS 65 -4.560 0.268 -6.403
341 HB2 HIS 65 2HB HIS 65 -4.478 3.197 -5.644
342 HB3 HIS 65 1HB HIS 65 -3.451 2.481 -6.873
343 HD1 HIS 65 1HD HIS 65 -5.217 1.066 -8.763
344 HD2 HIS 65 2HD HIS 65 -6.495 4.499 -6.803
345 HE1 HIS 65 1HE HIS 65 -7.095 1.942 -10.115
346 HE2 HIS 65 2HE HIS 65 -7.433 4.217 -9.180
347 H LEU 66 H LEU 66 -4.073 1.798 -3.307
348 HA LEU 66 HA LEU 66 -1.298 1.479 -3.060
349 HB2 LEU 66 2HB LEU 66 -2.487 2.848 -1.492
350 HB3 LEU 66 1HB LEU 66 -3.520 1.519 -1.027
351 HG LEU 66 HG LEU 66 -1.627 0.435 0.113
352 HD11 LEU 66 1HD1 LEU 66 0.465 1.634 0.469
353 HD12 LEU 66 2HD1 LEU 66 -0.069 2.897 -0.639
354 HD13 LEU 66 3HD1 LEU 66 0.212 1.259 -1.235
355 HD21 LEU 66 3HD2 LEU 66 -3.082 1.931 1.355
356 HD22 LEU 66 1HD2 LEU 66 -2.059 3.300 0.926
357 HD23 LEU 66 2HD2 LEU 66 -1.429 2.013 1.961
358 H CYS 67 H CYS 67 -3.964 -0.688 -2.154
359 HA CYS 67 HA CYS 67 -2.288 -2.732 -1.207
360 HB2 CYS 67 2HB CYS 67 -4.629 -2.648 -0.570
361 HB3 CYS 67 1HB CYS 67 -5.121 -2.925 -2.239
362 H THR 68 H THR 68 -3.512 -2.048 -4.476
363 HA THR 68 HA THR 68 -2.746 -4.408 -5.732
364 HB THR 68 HB THR 68 -2.505 -1.602 -6.882
365 HG1 THR 68 1HG THR 68 -4.672 -3.201 -6.225
366 HG21 THR 68 3HG2 THR 68 -2.941 -2.713 -9.040
367 HG22 THR 68 1HG2 THR 68 -3.001 -4.275 -8.225
368 HG23 THR 68 2HG2 THR 68 -1.489 -3.369 -8.281
369 H GLU 69 H GLU 69 -0.819 -1.439 -5.151
370 HA GLU 69 HA GLU 69 1.596 -2.502 -6.148
371 HB2 GLU 69 2HB GLU 69 0.926 -0.162 -4.407
372 HB3 GLU 69 1HB GLU 69 2.590 -0.636 -4.702
373 HG2 GLU 69 2HG GLU 69 0.609 0.033 -6.846
374 HG3 GLU 69 1HG GLU 69 1.763 1.163 -6.149
375 H SER 70 H SER 70 0.136 -2.412 -2.961
376 HA SER 70 HA SER 70 2.349 -3.177 -1.461
377 HB2 SER 70 2HB SER 70 0.125 -2.315 -0.579
378 HB3 SER 70 1HB SER 70 -0.512 -3.939 -0.831
379 HG SER 70 HG SER 70 1.665 -3.187 0.775
380 H LEU 71 H LEU 71 -0.154 -5.215 -2.966
381 HA LEU 71 HA LEU 71 1.055 -7.652 -2.111
382 HB2 LEU 71 2HB LEU 71 -0.927 -7.143 -4.323
383 HB3 LEU 71 1HB LEU 71 -0.476 -8.726 -3.727
384 HG LEU 71 HG LEU 71 -1.915 -6.587 -2.165
385 HD11 LEU 71 1HD1 LEU 71 -3.805 -8.129 -2.242
386 HD12 LEU 71 2HD1 LEU 71 -2.877 -9.221 -3.270
387 HD13 LEU 71 3HD1 LEU 71 -3.319 -7.618 -3.858
388 HD21 LEU 71 3HD2 LEU 71 -2.149 -8.279 -0.430
389 HD22 LEU 71 1HD2 LEU 71 -0.453 -7.918 -0.727
390 HD23 LEU 71 2HD2 LEU 71 -1.158 -9.403 -1.368
391 H LYS 72 H LYS 72 1.172 -5.749 -5.023
392 HA LYS 72 HA LYS 72 2.638 -7.531 -6.612
393 HB2 LYS 72 2HB LYS 72 1.423 -5.856 -7.689
394 HB3 LYS 72 1HB LYS 72 2.089 -4.594 -6.680
395 HG2 LYS 72 2HG LYS 72 4.152 -4.653 -7.863
396 HG3 LYS 72 1HG LYS 72 3.655 -6.093 -8.761
397 HD2 LYS 72 2HD LYS 72 2.021 -4.917 -9.970
398 HD3 LYS 72 1HD LYS 72 2.048 -3.562 -8.844
399 HE2 LYS 72 2HE LYS 72 4.347 -4.334 -10.626
400 HE3 LYS 72 1HE LYS 72 3.143 -3.113 -11.027
401 HZ1 LYS 72 3HZ LYS 72 5.063 -3.038 -8.765
402 HZ2 LYS 72 1HZ LYS 72 3.761 -1.964 -8.954
403 HZ3 LYS 72 2HZ LYS 72 4.995 -2.010 -10.104
404 H SER 73 H SER 73 3.687 -5.201 -4.225
405 HA SER 73 HA SER 73 6.467 -5.708 -4.949
406 HB2 SER 73 2HB SER 73 6.984 -3.858 -3.414
407 HB3 SER 73 1HB SER 73 5.832 -3.379 -4.653
408 HG SER 73 HG SER 73 4.219 -3.374 -3.243
409 H ASN 74 H ASN 74 4.166 -6.987 -3.057
410 HA ASN 74 HA ASN 74 3.967 -8.326 -1.310
411 HB2 ASN 74 2HB ASN 74 5.657 -9.676 -2.549
412 HB3 ASN 74 1HB ASN 74 6.926 -8.901 -1.607
413 HD21 ASN 74 1HD2 ASN 74 7.617 -10.753 -0.637
414 HD22 ASN 74 2HD2 ASN 74 6.702 -11.642 0.526
415 H GLY 75 H GLY 75 3.727 -6.115 -0.349
416 HA2 GLY 75 2HA GLY 75 3.613 -5.183 1.759
417 HA3 GLY 75 1HA GLY 75 4.775 -6.372 2.309
418 H ARG 76 H ARG 76 5.996 -4.771 -0.371
419 HA ARG 76 HA ARG 76 8.047 -3.455 1.099
420 HB2 ARG 76 2HB ARG 76 8.241 -4.170 -1.302
421 HB3 ARG 76 1HB ARG 76 7.119 -2.872 -1.704
422 HG2 ARG 76 2HG ARG 76 8.786 -1.272 -0.709
423 HG3 ARG 76 1HG ARG 76 9.924 -2.621 -0.664
424 HD2 ARG 76 2HD ARG 76 9.557 -2.930 -3.105
425 HD3 ARG 76 1HD ARG 76 8.552 -1.486 -3.095
426 HE ARG 76 HE ARG 76 11.390 -1.483 -2.343
427 HH11 ARG 76 1HH1 ARG 76 8.660 0.107 -3.977
428 HH12 ARG 76 2HH1 ARG 76 9.615 1.369 -4.585
429 HH21 ARG 76 1HH2 ARG 76 12.675 0.235 -3.240
430 HH22 ARG 76 2HH2 ARG 76 11.941 1.431 -4.208
431 H VAL 77 H VAL 77 5.360 -2.194 -0.809
432 HA VAL 77 HA VAL 77 5.475 0.255 0.744
433 HB VAL 77 HB VAL 77 5.537 0.650 -1.667
434 HG11 VAL 77 1HG1 VAL 77 4.507 -1.389 -2.457
435 HG12 VAL 77 2HG1 VAL 77 3.734 0.030 -3.158
436 HG13 VAL 77 3HG1 VAL 77 2.938 -0.850 -1.852
437 HG21 VAL 77 3HG2 VAL 77 4.339 2.334 -0.417
438 HG22 VAL 77 1HG2 VAL 77 2.853 1.376 -0.511
439 HG23 VAL 77 2HG2 VAL 77 3.533 2.057 -1.974
440 H GLN 78 H GLN 78 4.070 0.578 2.275
441 HA GLN 78 HA GLN 78 1.477 -0.731 2.128
442 HB2 GLN 78 2HB GLN 78 3.154 -2.057 3.509
443 HB3 GLN 78 1HB GLN 78 3.193 -0.713 4.631
444 HG2 GLN 78 2HG GLN 78 0.897 -1.051 5.227
445 HG3 GLN 78 1HG GLN 78 0.684 -2.235 3.937
446 HE21 GLN 78 1HE2 GLN 78 3.264 -3.539 4.505
447 HE22 GLN 78 2HE2 GLN 78 3.020 -4.411 5.956
448 H PHE 79 H PHE 79 0.211 0.292 4.197
449 HA PHE 79 HA PHE 79 -0.200 2.994 3.565
450 HB2 PHE 79 2HB PHE 79 -1.900 1.472 4.486
451 HB3 PHE 79 1HB PHE 79 -1.040 1.438 6.015
452 HD1 PHE 79 2HD PHE 79 -3.079 3.495 3.741
453 HD2 PHE 79 1HD PHE 79 -1.304 3.213 7.603
454 HE1 PHE 79 2HE PHE 79 -4.453 5.384 4.511
455 HE2 PHE 79 1HE PHE 79 -2.677 5.103 8.376
456 HZ PHE 79 HZ PHE 79 -4.254 6.185 6.832
457 H LEU 80 H LEU 80 0.938 4.731 4.140
458 HA LEU 80 HA LEU 80 2.637 4.606 6.516
459 HB2 LEU 80 2HB LEU 80 3.639 5.358 4.387
460 HB3 LEU 80 1HB LEU 80 2.477 6.662 4.307
461 HG LEU 80 HG LEU 80 3.455 7.596 6.401
462 HD11 LEU 80 1HD1 LEU 80 5.520 5.458 5.992
463 HD12 LEU 80 2HD1 LEU 80 4.402 5.593 7.353
464 HD13 LEU 80 3HD1 LEU 80 5.654 6.809 7.112
465 HD21 LEU 80 3HD2 LEU 80 5.479 8.461 5.333
466 HD22 LEU 80 1HD2 LEU 80 4.103 8.451 4.231
467 HD23 LEU 80 2HD2 LEU 80 5.350 7.213 4.091
468 H HIS 81 H HIS 81 0.386 6.849 4.900
469 HA HIS 81 HA HIS 81 -1.059 7.277 7.291
470 HB2 HIS 81 2HB HIS 81 -0.724 9.723 7.480
471 HB3 HIS 81 1HB HIS 81 0.762 8.852 7.778
472 HD1 HIS 81 1HD HIS 81 -0.860 11.115 5.156
473 HD2 HIS 81 2HD HIS 81 2.870 9.531 6.134
474 HE1 HIS 81 1HE HIS 81 0.801 12.247 3.643
475 HE2 HIS 81 2HE HIS 81 3.031 11.291 4.271
476 H ASP 82 H ASP 82 -2.880 8.730 6.901
477 HA ASP 82 HA ASP 82 -4.021 8.250 4.314
478 HB2 ASP 82 2HB ASP 82 -5.419 8.135 6.325
479 HB3 ASP 82 1HB ASP 82 -4.998 9.787 6.739
480 H GLY 83 H GLY 83 -4.712 9.932 2.859
481 HA2 GLY 83 2HA GLY 83 -4.771 12.092 2.058
482 HA3 GLY 83 1HA GLY 83 -3.707 12.600 3.368
483 H SER 84 H SER 84 -3.102 13.545 1.006
484 HA SER 84 HA SER 84 -1.411 11.961 -0.553
485 HB2 SER 84 2HB SER 84 -1.489 14.958 -0.176
486 HB3 SER 84 1HB SER 84 -0.859 14.085 -1.582
487 HG SER 84 HG SER 84 -2.813 14.265 -2.309
488 H CYS 85 H CYS 85 0.895 12.011 -0.595
489 HA CYS 85 HA CYS 85 2.075 11.798 1.916
490 HB2 CYS 85 2HB CYS 85 3.359 12.009 -0.802
491 HB3 CYS 85 1HB CYS 85 4.190 11.591 0.704
Start of MODEL 11
1 H1 SER 20 1HT SER 20 9.760 8.954 28.702
2 H2 SER 20 2HT SER 20 9.775 10.251 27.586
3 H3 SER 20 3HT SER 20 11.206 9.475 28.042
4 HA SER 20 HA SER 20 10.457 8.783 25.855
5 HB2 SER 20 2HB SER 20 10.562 6.674 28.011
6 HB3 SER 20 1HB SER 20 11.081 6.503 26.330
7 HG SER 20 HG SER 20 12.929 7.202 26.949
8 H GLU 21 H GLU 21 7.944 9.622 27.348
9 HA GLU 21 HA GLU 21 6.287 7.247 27.231
10 HB2 GLU 21 2HB GLU 21 5.701 9.991 28.368
11 HB3 GLU 21 1HB GLU 21 4.604 8.626 28.425
12 HG2 GLU 21 2HG GLU 21 5.600 8.839 30.580
13 HG3 GLU 21 1HG GLU 21 6.310 7.424 29.817
14 H ALA 22 H ALA 22 6.025 7.054 25.012
15 HA ALA 22 HA ALA 22 4.051 8.897 23.875
16 HB1 ALA 22 1HB ALA 22 6.590 8.112 22.441
17 HB2 ALA 22 2HB ALA 22 6.243 9.703 23.104
18 HB3 ALA 22 3HB ALA 22 5.274 9.076 21.768
19 H ALA 23 H ALA 23 4.464 6.019 24.856
20 HA ALA 23 HA ALA 23 3.792 3.949 24.459
21 HB1 ALA 23 1HB ALA 23 1.920 3.511 22.963
22 HB2 ALA 23 2HB ALA 23 2.149 5.075 22.177
23 HB3 ALA 23 3HB ALA 23 1.633 5.003 23.860
24 H SER 24 H SER 24 3.802 4.920 21.082
25 HA SER 24 HA SER 24 6.304 3.811 20.375
26 HB2 SER 24 2HB SER 24 3.838 2.185 19.587
27 HB3 SER 24 1HB SER 24 5.465 1.925 18.970
28 HG SER 24 HG SER 24 5.444 1.932 21.649
29 H LEU 25 H LEU 25 6.621 4.175 18.042
30 HA LEU 25 HA LEU 25 4.513 5.850 16.959
31 HB2 LEU 25 2HB LEU 25 6.159 6.760 15.327
32 HB3 LEU 25 1HB LEU 25 6.590 7.077 16.984
33 HG LEU 25 HG LEU 25 7.900 4.842 15.429
34 HD11 LEU 25 1HD1 LEU 25 9.696 6.436 14.913
35 HD12 LEU 25 2HD1 LEU 25 8.753 7.742 15.625
36 HD13 LEU 25 3HD1 LEU 25 8.179 6.934 14.168
37 HD21 LEU 25 3HD2 LEU 25 8.815 6.533 17.765
38 HD22 LEU 25 1HD2 LEU 25 9.702 5.201 17.031
39 HD23 LEU 25 2HD2 LEU 25 8.192 4.890 17.892
40 H SER 26 H SER 26 3.103 4.595 16.011
41 HA SER 26 HA SER 26 4.090 2.727 13.999
42 HB2 SER 26 2HB SER 26 3.525 1.520 16.099
43 HB3 SER 26 1HB SER 26 1.910 2.215 16.035
44 HG SER 26 HG SER 26 1.364 0.907 14.464
45 HA PRO 27 HA PRO 27 0.910 4.979 11.773
46 HB2 PRO 27 2HB PRO 27 1.235 3.790 9.380
47 HB3 PRO 27 1HB PRO 27 2.429 4.933 10.008
48 HG2 PRO 27 2HG PRO 27 2.505 1.945 9.975
49 HG3 PRO 27 1HG PRO 27 3.807 3.103 9.647
50 HD2 PRO 27 2HD PRO 27 3.466 1.798 12.044
51 HD3 PRO 27 1HD PRO 27 4.296 3.357 11.869
52 H LYS 28 H LYS 28 -0.780 4.062 10.010
53 HA LYS 28 HA LYS 28 -2.302 2.035 11.411
54 HB2 LYS 28 2HB LYS 28 -3.502 4.025 10.698
55 HB3 LYS 28 1HB LYS 28 -2.979 3.791 9.036
56 HG2 LYS 28 2HG LYS 28 -4.282 1.693 8.943
57 HG3 LYS 28 1HG LYS 28 -4.834 1.985 10.588
58 HD2 LYS 28 2HD LYS 28 -5.339 3.812 8.233
59 HD3 LYS 28 1HD LYS 28 -6.492 2.638 8.865
60 HE2 LYS 28 2HE LYS 28 -6.451 3.815 11.029
61 HE3 LYS 28 1HE LYS 28 -5.356 5.016 10.338
62 HZ1 LYS 28 3HZ LYS 28 -7.088 5.605 8.754
63 HZ2 LYS 28 1HZ LYS 28 -7.648 5.764 10.328
64 HZ3 LYS 28 2HZ LYS 28 -8.107 4.439 9.401
65 H LYS 29 H LYS 29 -2.712 0.033 10.613
66 HA LYS 29 HA LYS 29 -1.223 -0.747 8.257
67 HB2 LYS 29 2HB LYS 29 -2.821 -2.383 10.227
68 HB3 LYS 29 1HB LYS 29 -1.954 -3.049 8.853
69 HG2 LYS 29 2HG LYS 29 -0.731 -1.611 11.200
70 HG3 LYS 29 1HG LYS 29 -0.711 -3.348 10.916
71 HD2 LYS 29 2HD LYS 29 0.521 -2.899 8.779
72 HD3 LYS 29 1HD LYS 29 0.616 -1.207 9.259
73 HE2 LYS 29 2HE LYS 29 2.670 -2.320 9.853
74 HE3 LYS 29 1HE LYS 29 1.796 -1.881 11.315
75 HZ1 LYS 29 3HZ LYS 29 1.812 -4.581 10.073
76 HZ2 LYS 29 1HZ LYS 29 1.027 -4.167 11.512
77 HZ3 LYS 29 2HZ LYS 29 2.710 -4.134 11.418
78 H VAL 30 H VAL 30 -2.127 -0.736 6.361
79 HA VAL 30 HA VAL 30 -4.938 -0.312 6.045
80 HB VAL 30 HB VAL 30 -3.323 0.701 4.475
81 HG11 VAL 30 1HG1 VAL 30 -1.611 -1.004 4.400
82 HG12 VAL 30 2HG1 VAL 30 -2.172 -0.654 2.763
83 HG13 VAL 30 3HG1 VAL 30 -2.713 -2.113 3.589
84 HG21 VAL 30 3HG2 VAL 30 -5.560 0.384 3.630
85 HG22 VAL 30 1HG2 VAL 30 -5.177 -1.276 3.156
86 HG23 VAL 30 2HG2 VAL 30 -4.399 0.073 2.339
87 H ASP 31 H ASP 31 -6.487 -1.824 5.372
88 HA ASP 31 HA ASP 31 -5.568 -4.534 5.670
89 HB2 ASP 31 2HB ASP 31 -7.764 -3.847 6.703
90 HB3 ASP 31 1HB ASP 31 -8.414 -3.708 5.067
91 H CYS 32 H CYS 32 -4.556 -5.208 4.063
92 HA CYS 32 HA CYS 32 -5.491 -4.697 1.345
93 HB2 CYS 32 2HB CYS 32 -3.096 -4.316 1.983
94 HB3 CYS 32 1HB CYS 32 -2.956 -6.015 2.373
95 H SER 33 H SER 33 -5.907 -6.839 3.813
96 HA SER 33 HA SER 33 -5.715 -9.310 2.471
97 HB2 SER 33 2HB SER 33 -7.041 -8.573 5.069
98 HB3 SER 33 1HB SER 33 -6.774 -10.231 4.507
99 HG SER 33 HG SER 33 -4.763 -8.264 4.965
100 H ILE 34 H ILE 34 -8.357 -7.052 3.029
101 HA ILE 34 HA ILE 34 -10.401 -8.699 2.036
102 HB ILE 34 HB ILE 34 -11.655 -6.598 1.524
103 HG12 ILE 34 2HG1 ILE 34 -9.156 -5.222 2.558
104 HG13 ILE 34 1HG1 ILE 34 -9.728 -5.187 0.894
105 HG21 ILE 34 1HG2 ILE 34 -10.388 -6.763 4.250
106 HG22 ILE 34 2HG2 ILE 34 -11.825 -7.624 3.697
107 HG23 ILE 34 3HG2 ILE 34 -11.858 -5.868 3.859
108 HD11 ILE 34 3HD1 ILE 34 -11.151 -4.035 3.280
109 HD12 ILE 34 1HD1 ILE 34 -11.733 -3.990 1.615
110 HD13 ILE 34 2HD1 ILE 34 -10.258 -3.128 2.060
111 H TYR 35 H TYR 35 -7.944 -6.910 0.361
112 HA TYR 35 HA TYR 35 -9.294 -7.323 -2.163
113 HB2 TYR 35 2HB TYR 35 -6.670 -5.951 -1.547
114 HB3 TYR 35 1HB TYR 35 -7.353 -6.108 -3.162
115 HD1 TYR 35 2HD TYR 35 -9.745 -5.130 -3.496
116 HD2 TYR 35 1HD TYR 35 -7.218 -4.088 -0.237
117 HE1 TYR 35 2HE TYR 35 -11.054 -3.076 -3.148
118 HE2 TYR 35 1HE TYR 35 -8.520 -2.039 0.127
119 HH TYR 35 HH TYR 35 -10.043 -0.479 -1.242
120 H LYS 36 H LYS 36 -7.253 -8.981 -0.163
121 HA LYS 36 HA LYS 36 -5.723 -10.491 -2.020
122 HB2 LYS 36 2HB LYS 36 -6.604 -11.093 0.796
123 HB3 LYS 36 1HB LYS 36 -5.638 -12.227 -0.122
124 HG2 LYS 36 2HG LYS 36 -4.843 -9.403 0.588
125 HG3 LYS 36 1HG LYS 36 -4.298 -10.862 1.419
126 HD2 LYS 36 2HD LYS 36 -3.779 -10.176 -1.483
127 HD3 LYS 36 1HD LYS 36 -2.629 -10.020 -0.162
128 HE2 LYS 36 2HE LYS 36 -2.656 -12.410 0.201
129 HE3 LYS 36 1HE LYS 36 -3.898 -12.615 -1.032
130 HZ1 LYS 36 3HZ LYS 36 -1.143 -11.622 -1.509
131 HZ2 LYS 36 1HZ LYS 36 -2.342 -11.822 -2.686
132 HZ3 LYS 36 2HZ LYS 36 -1.725 -13.149 -1.878
133 H LYS 37 H LYS 37 -8.965 -10.441 -1.306
134 HA LYS 37 HA LYS 37 -9.719 -13.099 -1.935
135 HB2 LYS 37 2HB LYS 37 -11.268 -10.511 -2.167
136 HB3 LYS 37 1HB LYS 37 -11.963 -12.121 -2.300
137 HG2 LYS 37 2HG LYS 37 -11.357 -12.606 0.012
138 HG3 LYS 37 1HG LYS 37 -10.571 -11.039 0.147
139 HD2 LYS 37 2HD LYS 37 -12.795 -11.016 1.180
140 HD3 LYS 37 1HD LYS 37 -12.721 -9.917 -0.190
141 HE2 LYS 37 2HE LYS 37 -14.808 -11.163 -0.167
142 HE3 LYS 37 1HE LYS 37 -13.860 -11.587 -1.589
143 HZ1 LYS 37 3HZ LYS 37 -13.137 -13.611 -0.368
144 HZ2 LYS 37 1HZ LYS 37 -14.795 -13.565 -0.586
145 HZ3 LYS 37 2HZ LYS 37 -14.141 -13.198 0.900
146 H TYR 38 H TYR 38 -8.511 -10.546 -3.830
147 HA TYR 38 HA TYR 38 -9.432 -11.792 -6.313
148 HB2 TYR 38 2HB TYR 38 -8.369 -9.015 -5.789
149 HB3 TYR 38 1HB TYR 38 -8.905 -9.619 -7.352
150 HD1 TYR 38 1HD TYR 38 -11.420 -10.254 -7.518
151 HD2 TYR 38 2HD TYR 38 -9.776 -7.909 -4.377
152 HE1 TYR 38 1HE TYR 38 -13.651 -9.328 -7.047
153 HE2 TYR 38 2HE TYR 38 -11.992 -6.979 -3.895
154 HH TYR 38 HH TYR 38 -14.842 -8.279 -5.234
155 HA PRO 39 HA PRO 39 -5.124 -12.897 -6.914
156 HB2 PRO 39 2HB PRO 39 -4.912 -12.639 -9.629
157 HB3 PRO 39 1HB PRO 39 -5.711 -14.009 -8.848
158 HG2 PRO 39 2HG PRO 39 -6.920 -11.534 -10.015
159 HG3 PRO 39 1HG PRO 39 -7.426 -13.225 -10.203
160 HD2 PRO 39 2HD PRO 39 -8.669 -11.571 -8.489
161 HD3 PRO 39 1HD PRO 39 -8.413 -13.285 -8.099
162 H VAL 40 H VAL 40 -3.183 -11.863 -7.098
163 HA VAL 40 HA VAL 40 -3.007 -9.171 -6.556
164 HB VAL 40 HB VAL 40 -0.837 -10.973 -7.679
165 HG11 VAL 40 1HG1 VAL 40 -0.190 -8.644 -7.942
166 HG12 VAL 40 2HG1 VAL 40 0.762 -9.404 -6.662
167 HG13 VAL 40 3HG1 VAL 40 -0.572 -8.328 -6.250
168 HG21 VAL 40 3HG2 VAL 40 -1.811 -11.791 -5.603
169 HG22 VAL 40 1HG2 VAL 40 -1.539 -10.223 -4.845
170 HG23 VAL 40 2HG2 VAL 40 -0.166 -11.218 -5.335
171 H VAL 41 H VAL 41 -2.725 -10.665 -9.755
172 HA VAL 41 HA VAL 41 -1.959 -8.155 -10.922
173 HB VAL 41 HB VAL 41 -2.032 -9.225 -13.106
174 HG11 VAL 41 1HG1 VAL 41 -0.676 -10.920 -11.027
175 HG12 VAL 41 2HG1 VAL 41 -0.023 -9.488 -11.815
176 HG13 VAL 41 3HG1 VAL 41 -0.322 -10.948 -12.755
177 HG21 VAL 41 3HG2 VAL 41 -3.158 -11.648 -11.672
178 HG22 VAL 41 1HG2 VAL 41 -2.590 -11.632 -13.343
179 HG23 VAL 41 2HG2 VAL 41 -3.976 -10.657 -12.870
180 H ALA 42 H ALA 42 -5.010 -9.665 -10.280
181 HA ALA 42 HA ALA 42 -6.243 -7.503 -11.796
182 HB1 ALA 42 1HB ALA 42 -6.522 -9.582 -13.065
183 HB2 ALA 42 2HB ALA 42 -8.060 -8.938 -12.492
184 HB3 ALA 42 3HB ALA 42 -7.318 -10.311 -11.674
185 H ILE 43 H ILE 43 -6.572 -6.251 -10.007
186 HA ILE 43 HA ILE 43 -8.581 -7.325 -8.179
187 HB ILE 43 HB ILE 43 -6.398 -5.345 -7.423
188 HG12 ILE 43 2HG1 ILE 43 -6.790 -8.258 -6.663
189 HG13 ILE 43 1HG1 ILE 43 -5.475 -7.580 -7.593
190 HG21 ILE 43 1HG2 ILE 43 -7.296 -5.497 -5.152
191 HG22 ILE 43 2HG2 ILE 43 -8.578 -6.562 -5.725
192 HG23 ILE 43 3HG2 ILE 43 -8.508 -4.889 -6.281
193 HD11 ILE 43 3HD1 ILE 43 -6.020 -7.051 -4.682
194 HD12 ILE 43 1HD1 ILE 43 -4.669 -6.393 -5.604
195 HD13 ILE 43 2HD1 ILE 43 -4.789 -8.128 -5.327
196 HA PRO 44 HA PRO 44 -10.716 -3.777 -9.986
197 HB2 PRO 44 2HB PRO 44 -12.880 -4.736 -8.212
198 HB3 PRO 44 1HB PRO 44 -12.910 -4.470 -9.957
199 HG2 PRO 44 2HG PRO 44 -12.925 -6.942 -8.915
200 HG3 PRO 44 1HG PRO 44 -12.082 -6.565 -10.428
201 HD2 PRO 44 2HD PRO 44 -10.966 -6.955 -7.683
202 HD3 PRO 44 1HD PRO 44 -10.327 -7.481 -9.258
203 H CYS 45 H CYS 45 -10.758 -1.819 -9.135
204 HA CYS 45 HA CYS 45 -10.555 -1.531 -6.225
205 HB2 CYS 45 2HB CYS 45 -9.312 0.069 -8.461
206 HB3 CYS 45 1HB CYS 45 -9.291 0.609 -6.793
207 HA PRO 46 HA PRO 46 -14.234 0.960 -6.472
208 HB2 PRO 46 2HB PRO 46 -13.666 2.757 -4.464
209 HB3 PRO 46 1HB PRO 46 -14.344 1.154 -4.186
210 HG2 PRO 46 2HG PRO 46 -11.527 2.103 -3.922
211 HG3 PRO 46 1HG PRO 46 -12.415 0.945 -2.913
212 HD2 PRO 46 2HD PRO 46 -10.602 0.177 -4.759
213 HD3 PRO 46 1HD PRO 46 -12.032 -0.801 -4.376
214 H ILE 47 H ILE 47 -14.849 3.060 -7.105
215 HA ILE 47 HA ILE 47 -12.702 4.527 -8.404
216 HB ILE 47 HB ILE 47 -14.494 5.810 -9.536
217 HG12 ILE 47 2HG1 ILE 47 -16.363 3.866 -8.161
218 HG13 ILE 47 1HG1 ILE 47 -16.246 5.590 -7.808
219 HG21 ILE 47 1HG2 ILE 47 -15.255 3.967 -10.982
220 HG22 ILE 47 2HG2 ILE 47 -14.663 2.811 -9.785
221 HG23 ILE 47 3HG2 ILE 47 -13.535 3.882 -10.614
222 HD11 ILE 47 3HD1 ILE 47 -18.178 5.080 -9.177
223 HD12 ILE 47 1HD1 ILE 47 -17.144 4.341 -10.396
224 HD13 ILE 47 2HD1 ILE 47 -17.029 6.071 -10.075
225 H THR 48 H THR 48 -14.257 4.547 -5.528
226 HA THR 48 HA THR 48 -14.489 7.282 -4.924
227 HB THR 48 HB THR 48 -13.671 5.043 -3.045
228 HG1 THR 48 1HG THR 48 -16.182 5.744 -4.150
229 HG21 THR 48 3HG2 THR 48 -15.260 7.576 -2.579
230 HG22 THR 48 1HG2 THR 48 -13.569 7.341 -2.141
231 HG23 THR 48 2HG2 THR 48 -14.822 6.387 -1.353
232 H TYR 49 H TYR 49 -12.968 8.753 -4.752
233 HA TYR 49 HA TYR 49 -10.210 7.936 -4.829
234 HB2 TYR 49 2HB TYR 49 -10.907 9.679 -6.370
235 HB3 TYR 49 1HB TYR 49 -11.507 10.653 -5.038
236 HD1 TYR 49 2HD TYR 49 -8.318 9.055 -6.175
237 HD2 TYR 49 1HD TYR 49 -10.152 12.320 -4.162
238 HE1 TYR 49 2HE TYR 49 -6.113 10.116 -5.876
239 HE2 TYR 49 1HE TYR 49 -7.960 13.372 -3.858
240 HH TYR 49 HH TYR 49 -5.161 12.285 -5.478
241 H LEU 50 H LEU 50 -9.395 7.391 -2.980
242 HA LEU 50 HA LEU 50 -9.756 9.216 -0.724
243 HB2 LEU 50 2HB LEU 50 -9.313 6.226 -0.688
244 HB3 LEU 50 1HB LEU 50 -9.413 7.251 0.728
245 HG LEU 50 HG LEU 50 -11.669 6.746 -1.210
246 HD11 LEU 50 1HD1 LEU 50 -12.629 5.415 0.596
247 HD12 LEU 50 2HD1 LEU 50 -11.153 5.639 1.539
248 HD13 LEU 50 3HD1 LEU 50 -11.106 4.750 0.016
249 HD21 LEU 50 3HD2 LEU 50 -13.064 7.813 0.501
250 HD22 LEU 50 1HD2 LEU 50 -11.837 8.924 -0.110
251 HD23 LEU 50 2HD2 LEU 50 -11.622 8.152 1.460
252 HA PRO 51 HA PRO 51 -5.426 9.323 -2.123
253 HB2 PRO 51 2HB PRO 51 -4.831 11.515 -0.501
254 HB3 PRO 51 1HB PRO 51 -5.243 11.604 -2.203
255 HG2 PRO 51 2HG PRO 51 -6.849 12.221 0.160
256 HG3 PRO 51 1HG PRO 51 -7.052 12.773 -1.504
257 HD2 PRO 51 2HD PRO 51 -8.653 10.897 -0.242
258 HD3 PRO 51 1HD PRO 51 -8.510 11.083 -1.998
259 H VAL 52 H VAL 52 -4.212 7.891 -1.198
260 HA VAL 52 HA VAL 52 -3.706 8.158 1.664
261 HB VAL 52 HB VAL 52 -3.398 5.723 1.885
262 HG11 VAL 52 1HG1 VAL 52 -5.747 5.018 1.776
263 HG12 VAL 52 2HG1 VAL 52 -6.119 6.456 0.824
264 HG13 VAL 52 3HG1 VAL 52 -5.557 6.621 2.486
265 HG21 VAL 52 3HG2 VAL 52 -4.185 4.180 0.128
266 HG22 VAL 52 1HG2 VAL 52 -2.800 5.143 -0.393
267 HG23 VAL 52 2HG2 VAL 52 -4.425 5.559 -0.947
268 H CYS 53 H CYS 53 -1.599 7.768 2.304
269 HA CYS 53 HA CYS 53 0.272 7.882 0.067
270 HB2 CYS 53 2HB CYS 53 0.139 9.940 1.372
271 HB3 CYS 53 1HB CYS 53 0.557 9.144 2.843
272 H GLY 54 H GLY 54 1.574 6.260 -0.155
273 HA2 GLY 54 2HA GLY 54 1.815 4.176 1.886
274 HA3 GLY 54 1HA GLY 54 2.445 4.153 0.255
275 H SER 55 H SER 55 3.986 3.307 2.289
276 HA SER 55 HA SER 55 5.658 5.287 3.365
277 HB2 SER 55 2HB SER 55 7.182 3.305 3.789
278 HB3 SER 55 1HB SER 55 5.552 3.186 4.457
279 HG SER 55 HG SER 55 6.675 1.432 3.063
280 H ASP 56 H ASP 56 5.376 4.261 0.237
281 HA ASP 56 HA ASP 56 8.133 4.708 -0.593
282 HB2 ASP 56 2HB ASP 56 6.604 2.976 -1.655
283 HB3 ASP 56 1HB ASP 56 5.669 4.312 -2.308
284 H TYR 57 H TYR 57 5.665 6.605 0.357
285 HA TYR 57 HA TYR 57 5.161 8.758 0.286
286 HB2 TYR 57 2HB TYR 57 7.844 9.045 -1.102
287 HB3 TYR 57 1HB TYR 57 6.877 10.401 -0.529
288 HD1 TYR 57 2HD TYR 57 6.427 10.613 1.944
289 HD2 TYR 57 1HD TYR 57 9.247 7.832 0.395
290 HE1 TYR 57 2HE TYR 57 7.442 10.406 4.174
291 HE2 TYR 57 1HE TYR 57 10.266 7.618 2.624
292 HH TYR 57 HH TYR 57 10.444 8.878 4.672
293 H ILE 58 H ILE 58 4.067 7.157 -1.529
294 HA ILE 58 HA ILE 58 3.661 8.869 -3.884
295 HB ILE 58 HB ILE 58 3.285 5.876 -3.580
296 HG12 ILE 58 2HG1 ILE 58 5.613 6.497 -3.896
297 HG13 ILE 58 1HG1 ILE 58 4.996 5.673 -5.318
298 HG21 ILE 58 1HG2 ILE 58 2.656 7.596 -5.968
299 HG22 ILE 58 2HG2 ILE 58 1.500 6.732 -4.955
300 HG23 ILE 58 3HG2 ILE 58 2.649 5.833 -5.946
301 HD11 ILE 58 3HD1 ILE 58 4.751 7.820 -6.458
302 HD12 ILE 58 1HD1 ILE 58 6.410 7.522 -5.939
303 HD13 ILE 58 2HD1 ILE 58 5.395 8.640 -5.030
304 H THR 59 H THR 59 1.649 9.650 -4.141
305 HA THR 59 HA THR 59 -0.327 8.988 -2.146
306 HB THR 59 HB THR 59 -0.360 11.067 -4.349
307 HG1 THR 59 1HG THR 59 1.096 10.985 -2.314
308 HG21 THR 59 3HG2 THR 59 -2.617 10.476 -3.651
309 HG22 THR 59 1HG2 THR 59 -2.208 12.066 -3.008
310 HG23 THR 59 2HG2 THR 59 -2.174 10.641 -1.956
311 H TYR 60 H TYR 60 -1.585 7.416 -2.524
312 HA TYR 60 HA TYR 60 -2.076 6.468 -5.228
313 HB2 TYR 60 2HB TYR 60 -2.689 5.281 -2.527
314 HB3 TYR 60 1HB TYR 60 -3.055 4.486 -4.066
315 HD1 TYR 60 1HD TYR 60 -1.182 3.666 -5.477
316 HD2 TYR 60 2HD TYR 60 -0.500 5.333 -1.632
317 HE1 TYR 60 1HE TYR 60 1.085 2.698 -5.459
318 HE2 TYR 60 2HE TYR 60 1.758 4.379 -1.613
319 HH TYR 60 HH TYR 60 3.261 3.103 -4.348
320 H GLY 61 H GLY 61 -4.178 6.089 -5.971
321 HA2 GLY 61 2HA GLY 61 -5.995 8.165 -5.337
322 HA3 GLY 61 1HA GLY 61 -6.290 6.858 -6.480
323 H ASN 62 H ASN 62 -5.589 5.098 -4.006
324 HA ASN 62 HA ASN 62 -7.301 5.474 -1.948
325 HB2 ASN 62 2HB ASN 62 -9.161 3.896 -2.300
326 HB3 ASN 62 1HB ASN 62 -9.200 5.184 -3.448
327 HD21 ASN 62 1HD2 ASN 62 -10.422 4.110 -4.852
328 HD22 ASN 62 2HD2 ASN 62 -9.908 2.811 -5.846
329 H GLU 63 H GLU 63 -7.818 3.155 -0.922
330 HA GLU 63 HA GLU 63 -5.170 2.287 -0.421
331 HB2 GLU 63 2HB GLU 63 -5.999 0.929 1.327
332 HB3 GLU 63 1HB GLU 63 -6.909 2.421 1.351
333 HG2 GLU 63 2HG GLU 63 -7.833 -0.226 0.264
334 HG3 GLU 63 1HG GLU 63 -8.304 0.455 1.816
335 H CYS 64 H CYS 64 -7.746 1.060 -2.349
336 HA CYS 64 HA CYS 64 -6.731 -1.519 -2.753
337 HB2 CYS 64 2HB CYS 64 -8.970 -0.883 -3.522
338 HB3 CYS 64 1HB CYS 64 -8.262 0.190 -4.726
339 H HIS 65 H HIS 65 -5.968 1.527 -4.393
340 HA HIS 65 HA HIS 65 -4.153 0.272 -6.202
341 HB2 HIS 65 2HB HIS 65 -4.369 3.202 -5.440
342 HB3 HIS 65 1HB HIS 65 -3.246 2.597 -6.649
343 HD1 HIS 65 1HD HIS 65 -4.468 1.454 -8.860
344 HD2 HIS 65 2HD HIS 65 -6.868 3.751 -6.355
345 HE1 HIS 65 1HE HIS 65 -6.540 1.906 -10.145
346 HE2 HIS 65 2HE HIS 65 -7.819 3.522 -8.746
347 H LEU 66 H LEU 66 -3.855 1.562 -3.010
348 HA LEU 66 HA LEU 66 -1.027 1.389 -2.794
349 HB2 LEU 66 2HB LEU 66 -2.324 2.694 -1.214
350 HB3 LEU 66 1HB LEU 66 -3.247 1.288 -0.765
351 HG LEU 66 HG LEU 66 -1.277 0.295 0.309
352 HD11 LEU 66 1HD1 LEU 66 0.727 1.622 0.687
353 HD12 LEU 66 2HD1 LEU 66 0.098 2.883 -0.375
354 HD13 LEU 66 3HD1 LEU 66 0.482 1.290 -1.026
355 HD21 LEU 66 3HD2 LEU 66 -2.811 1.639 1.612
356 HD22 LEU 66 1HD2 LEU 66 -1.893 3.092 1.217
357 HD23 LEU 66 2HD2 LEU 66 -1.160 1.822 2.201
358 H CYS 67 H CYS 67 -3.655 -0.787 -1.830
359 HA CYS 67 HA CYS 67 -2.133 -2.902 -0.854
360 HB2 CYS 67 2HB CYS 67 -4.480 -2.773 -0.375
361 HB3 CYS 67 1HB CYS 67 -4.894 -2.842 -2.084
362 H THR 68 H THR 68 -3.401 -2.440 -4.155
363 HA THR 68 HA THR 68 -2.399 -4.819 -5.218
364 HB THR 68 HB THR 68 -2.386 -3.459 -7.436
365 HG1 THR 68 1HG THR 68 -3.898 -1.707 -5.835
366 HG21 THR 68 3HG2 THR 68 -4.170 -4.972 -6.906
367 HG22 THR 68 1HG2 THR 68 -4.862 -3.484 -7.535
368 HG23 THR 68 2HG2 THR 68 -4.900 -3.804 -5.796
369 H GLU 69 H GLU 69 -0.881 -1.614 -4.982
370 HA GLU 69 HA GLU 69 1.496 -2.213 -6.371
371 HB2 GLU 69 2HB GLU 69 0.512 0.044 -5.645
372 HB3 GLU 69 1HB GLU 69 1.216 -0.291 -4.078
373 HG2 GLU 69 2HG GLU 69 2.724 1.112 -5.185
374 HG3 GLU 69 1HG GLU 69 3.445 -0.496 -5.238
375 H SER 70 H SER 70 0.479 -2.430 -3.014
376 HA SER 70 HA SER 70 2.918 -3.048 -1.832
377 HB2 SER 70 2HB SER 70 0.834 -2.306 -0.631
378 HB3 SER 70 1HB SER 70 0.175 -3.921 -0.887
379 HG SER 70 HG SER 70 2.155 -3.021 0.809
380 H LEU 71 H LEU 71 0.284 -5.184 -2.946
381 HA LEU 71 HA LEU 71 1.568 -7.620 -2.309
382 HB2 LEU 71 2HB LEU 71 -0.525 -7.049 -4.394
383 HB3 LEU 71 1HB LEU 71 -0.088 -8.646 -3.822
384 HG LEU 71 HG LEU 71 -1.379 -6.464 -2.189
385 HD11 LEU 71 1HD1 LEU 71 -2.479 -9.063 -3.240
386 HD12 LEU 71 2HD1 LEU 71 -2.874 -7.452 -3.832
387 HD13 LEU 71 3HD1 LEU 71 -3.325 -7.922 -2.194
388 HD21 LEU 71 3HD2 LEU 71 -0.674 -9.304 -1.438
389 HD22 LEU 71 1HD2 LEU 71 -1.591 -8.168 -0.449
390 HD23 LEU 71 2HD2 LEU 71 0.098 -7.841 -0.813
391 H LYS 72 H LYS 72 1.432 -5.710 -5.218
392 HA LYS 72 HA LYS 72 2.780 -7.297 -7.050
393 HB2 LYS 72 2HB LYS 72 1.635 -5.325 -7.697
394 HB3 LYS 72 1HB LYS 72 2.581 -4.347 -6.604
395 HG2 LYS 72 2HG LYS 72 4.562 -4.754 -8.049
396 HG3 LYS 72 1HG LYS 72 3.489 -5.584 -9.191
397 HD2 LYS 72 2HD LYS 72 2.168 -3.652 -9.498
398 HD3 LYS 72 1HD LYS 72 2.951 -2.815 -8.165
399 HE2 LYS 72 2HE LYS 72 5.062 -2.867 -9.486
400 HE3 LYS 72 1HE LYS 72 4.133 -3.515 -10.843
401 HZ1 LYS 72 3HZ LYS 72 3.549 -0.991 -9.434
402 HZ2 LYS 72 1HZ LYS 72 2.749 -1.556 -10.809
403 HZ3 LYS 72 2HZ LYS 72 4.364 -1.074 -10.929
404 H SER 73 H SER 73 4.013 -4.956 -4.722
405 HA SER 73 HA SER 73 6.771 -5.572 -5.438
406 HB2 SER 73 2HB SER 73 5.684 -3.538 -3.494
407 HB3 SER 73 1HB SER 73 7.302 -3.583 -4.202
408 HG SER 73 HG SER 73 4.836 -2.950 -5.417
409 H ASN 74 H ASN 74 4.778 -7.219 -3.807
410 HA ASN 74 HA ASN 74 4.575 -8.510 -1.990
411 HB2 ASN 74 2HB ASN 74 6.406 -9.634 -3.235
412 HB3 ASN 74 1HB ASN 74 7.576 -8.777 -2.237
413 HD21 ASN 74 1HD2 ASN 74 4.499 -10.283 -1.222
414 HD22 ASN 74 2HD2 ASN 74 5.229 -11.413 -0.163
415 H GLY 75 H GLY 75 4.148 -6.307 -0.932
416 HA2 GLY 75 2HA GLY 75 3.884 -5.496 1.209
417 HA3 GLY 75 1HA GLY 75 5.079 -6.656 1.764
418 H ARG 76 H ARG 76 6.148 -4.742 -0.808
419 HA ARG 76 HA ARG 76 8.208 -3.503 0.663
420 HB2 ARG 76 2HB ARG 76 8.311 -3.890 -1.775
421 HB3 ARG 76 1HB ARG 76 7.060 -2.680 -2.004
422 HG2 ARG 76 2HG ARG 76 8.594 -0.995 -1.014
423 HG3 ARG 76 1HG ARG 76 9.854 -2.228 -0.993
424 HD2 ARG 76 2HD ARG 76 8.385 -1.264 -3.445
425 HD3 ARG 76 1HD ARG 76 10.010 -0.780 -2.971
426 HE ARG 76 HE ARG 76 10.120 -3.506 -3.118
427 HH11 ARG 76 1HH1 ARG 76 9.047 -1.024 -5.403
428 HH12 ARG 76 2HH1 ARG 76 9.711 -1.796 -6.768
429 HH21 ARG 76 1HH2 ARG 76 11.014 -4.568 -5.007
430 HH22 ARG 76 2HH2 ARG 76 10.875 -3.818 -6.535
431 H VAL 77 H VAL 77 5.385 -1.976 -0.863
432 HA VAL 77 HA VAL 77 5.728 0.358 0.846
433 HB VAL 77 HB VAL 77 5.308 0.723 -1.562
434 HG11 VAL 77 1HG1 VAL 77 2.664 -0.610 -1.085
435 HG12 VAL 77 2HG1 VAL 77 3.978 -1.187 -2.116
436 HG13 VAL 77 3HG1 VAL 77 3.106 0.285 -2.539
437 HG21 VAL 77 3HG2 VAL 77 3.036 1.629 0.182
438 HG22 VAL 77 1HG2 VAL 77 3.490 2.344 -1.363
439 HG23 VAL 77 2HG2 VAL 77 4.601 2.430 0.007
440 H GLN 78 H GLN 78 4.616 0.849 2.495
441 HA GLN 78 HA GLN 78 2.286 -0.783 3.214
442 HB2 GLN 78 2HB GLN 78 4.427 0.471 4.942
443 HB3 GLN 78 1HB GLN 78 2.903 -0.120 5.583
444 HG2 GLN 78 2HG GLN 78 4.943 -1.789 4.130
445 HG3 GLN 78 1HG GLN 78 4.737 -1.710 5.883
446 HE21 GLN 78 1HE2 GLN 78 3.408 -2.851 2.901
447 HE22 GLN 78 2HE2 GLN 78 2.235 -3.903 3.594
448 H PHE 79 H PHE 79 0.924 0.489 4.836
449 HA PHE 79 HA PHE 79 0.161 2.982 3.667
450 HB2 PHE 79 2HB PHE 79 -1.395 1.285 4.690
451 HB3 PHE 79 1HB PHE 79 -0.719 1.677 6.255
452 HD1 PHE 79 2HD PHE 79 -1.228 3.833 7.325
453 HD2 PHE 79 1HD PHE 79 -2.952 2.730 3.599
454 HE1 PHE 79 2HE PHE 79 -2.940 5.575 7.601
455 HE2 PHE 79 1HE PHE 79 -4.665 4.464 3.874
456 HZ PHE 79 HZ PHE 79 -4.664 5.881 5.872
457 H LEU 80 H LEU 80 1.163 4.834 4.149
458 HA LEU 80 HA LEU 80 2.840 4.955 6.528
459 HB2 LEU 80 2HB LEU 80 3.692 5.637 4.284
460 HB3 LEU 80 1HB LEU 80 2.505 6.919 4.261
461 HG LEU 80 HG LEU 80 3.618 7.890 6.278
462 HD11 LEU 80 1HD1 LEU 80 5.885 7.150 6.797
463 HD12 LEU 80 2HD1 LEU 80 5.699 5.814 5.662
464 HD13 LEU 80 3HD1 LEU 80 4.696 5.881 7.112
465 HD21 LEU 80 3HD2 LEU 80 5.511 8.802 5.018
466 HD22 LEU 80 1HD2 LEU 80 4.046 8.741 4.040
467 HD23 LEU 80 2HD2 LEU 80 5.312 7.534 3.809
468 H HIS 81 H HIS 81 0.455 6.989 4.824
469 HA HIS 81 HA HIS 81 -0.979 7.406 7.226
470 HB2 HIS 81 2HB HIS 81 -0.786 9.869 7.307
471 HB3 HIS 81 1HB HIS 81 0.759 9.100 7.632
472 HD1 HIS 81 1HD HIS 81 -1.047 11.167 5.045
473 HD2 HIS 81 2HD HIS 81 2.791 9.769 5.849
474 HE1 HIS 81 1HE HIS 81 0.473 12.339 3.414
475 HE2 HIS 81 2HE HIS 81 2.791 11.538 3.977
476 H ASP 82 H ASP 82 -2.973 8.508 6.824
477 HA ASP 82 HA ASP 82 -3.854 8.157 4.127
478 HB2 ASP 82 2HB ASP 82 -6.076 8.844 4.910
479 HB3 ASP 82 1HB ASP 82 -5.424 7.647 6.007
480 H GLY 83 H GLY 83 -4.863 9.862 2.938
481 HA2 GLY 83 2HA GLY 83 -5.060 12.067 2.297
482 HA3 GLY 83 1HA GLY 83 -3.935 12.539 3.586
483 H SER 84 H SER 84 -3.572 13.554 1.148
484 HA SER 84 HA SER 84 -1.927 12.081 -0.554
485 HB2 SER 84 2HB SER 84 -2.043 15.057 -0.105
486 HB3 SER 84 1HB SER 84 -1.557 14.211 -1.585
487 HG SER 84 HG SER 84 -3.591 14.422 -2.080
488 H CYS 85 H CYS 85 0.370 12.288 -0.799
489 HA CYS 85 HA CYS 85 1.754 12.347 1.670
490 HB2 CYS 85 2HB CYS 85 2.902 12.398 -1.129
491 HB3 CYS 85 1HB CYS 85 3.769 11.980 0.346
Start of MODEL 12
1 H1 SER 20 1HT SER 20 11.426 2.423 26.848
2 H2 SER 20 2HT SER 20 13.028 1.999 27.248
3 H3 SER 20 3HT SER 20 12.535 2.050 25.625
4 HA SER 20 HA SER 20 12.619 4.392 27.363
5 HB2 SER 20 2HB SER 20 14.533 3.476 25.209
6 HB3 SER 20 1HB SER 20 14.671 4.943 26.183
7 HG SER 20 HG SER 20 15.962 3.457 27.091
8 H GLU 21 H GLU 21 10.560 3.209 25.347
9 HA GLU 21 HA GLU 21 10.821 5.266 23.300
10 HB2 GLU 21 2HB GLU 21 9.410 2.602 23.086
11 HB3 GLU 21 1HB GLU 21 9.523 3.818 21.831
12 HG2 GLU 21 2HG GLU 21 11.112 2.274 21.161
13 HG3 GLU 21 1HG GLU 21 12.088 3.433 22.055
14 H ALA 22 H ALA 22 9.160 6.607 23.049
15 HA ALA 22 HA ALA 22 7.036 6.558 24.971
16 HB1 ALA 22 1HB ALA 22 7.530 8.433 22.650
17 HB2 ALA 22 2HB ALA 22 8.081 8.678 24.308
18 HB3 ALA 22 3HB ALA 22 6.356 8.676 23.945
19 H ALA 23 H ALA 23 5.516 5.137 24.665
20 HA ALA 23 HA ALA 23 3.739 4.057 23.880
21 HB1 ALA 23 1HB ALA 23 3.776 5.979 21.547
22 HB2 ALA 23 2HB ALA 23 2.963 6.263 23.085
23 HB3 ALA 23 3HB ALA 23 2.428 4.951 22.033
24 H SER 24 H SER 24 2.882 2.966 21.649
25 HA SER 24 HA SER 24 5.091 1.275 20.873
26 HB2 SER 24 2HB SER 24 3.161 -0.076 19.908
27 HB3 SER 24 1HB SER 24 3.189 0.112 21.662
28 HG SER 24 HG SER 24 1.372 1.160 21.559
29 H LEU 25 H LEU 25 3.942 4.069 19.741
30 HA LEU 25 HA LEU 25 3.973 5.230 17.810
31 HB2 LEU 25 2HB LEU 25 5.562 2.891 16.709
32 HB3 LEU 25 1HB LEU 25 5.361 4.427 15.905
33 HG LEU 25 HG LEU 25 6.891 3.897 18.437
34 HD11 LEU 25 1HD1 LEU 25 8.049 3.224 16.437
35 HD12 LEU 25 2HD1 LEU 25 8.791 4.693 17.081
36 HD13 LEU 25 3HD1 LEU 25 7.720 4.784 15.688
37 HD21 LEU 25 3HD2 LEU 25 5.760 6.041 18.642
38 HD22 LEU 25 1HD2 LEU 25 6.348 6.523 17.049
39 HD23 LEU 25 2HD2 LEU 25 7.484 6.279 18.378
40 H SER 26 H SER 26 3.746 4.294 15.066
41 HA SER 26 HA SER 26 1.116 3.116 15.360
42 HB2 SER 26 2HB SER 26 0.553 4.470 13.279
43 HB3 SER 26 1HB SER 26 0.759 5.366 14.784
44 HG SER 26 HG SER 26 2.302 5.310 12.491
45 HA PRO 27 HA PRO 27 2.781 0.156 12.325
46 HB2 PRO 27 2HB PRO 27 1.611 -2.027 13.362
47 HB3 PRO 27 1HB PRO 27 3.052 -1.356 14.127
48 HG2 PRO 27 2HG PRO 27 0.199 -1.156 14.955
49 HG3 PRO 27 1HG PRO 27 1.650 -1.288 15.958
50 HD2 PRO 27 2HD PRO 27 0.252 1.069 15.360
51 HD3 PRO 27 1HD PRO 27 1.883 0.978 16.054
52 H LYS 28 H LYS 28 0.703 1.972 12.226
53 HA LYS 28 HA LYS 28 -1.905 0.996 11.790
54 HB2 LYS 28 2HB LYS 28 -1.359 3.258 12.512
55 HB3 LYS 28 1HB LYS 28 -0.547 3.554 10.988
56 HG2 LYS 28 2HG LYS 28 -2.697 3.316 9.823
57 HG3 LYS 28 1HG LYS 28 -3.486 3.057 11.384
58 HD2 LYS 28 2HD LYS 28 -2.666 5.242 12.146
59 HD3 LYS 28 1HD LYS 28 -1.935 5.500 10.565
60 HE2 LYS 28 2HE LYS 28 -4.132 5.444 9.525
61 HE3 LYS 28 1HE LYS 28 -4.874 5.104 11.082
62 HZ1 LYS 28 3HZ LYS 28 -3.995 7.235 11.884
63 HZ2 LYS 28 1HZ LYS 28 -5.041 7.448 10.576
64 HZ3 LYS 28 2HZ LYS 28 -3.383 7.554 10.361
65 H LYS 29 H LYS 29 -2.724 0.137 10.026
66 HA LYS 29 HA LYS 29 -1.531 0.740 7.499
67 HB2 LYS 29 2HB LYS 29 -1.567 -1.645 6.827
68 HB3 LYS 29 1HB LYS 29 -0.394 -1.278 8.085
69 HG2 LYS 29 2HG LYS 29 -1.877 -2.237 9.763
70 HG3 LYS 29 1HG LYS 29 -3.089 -2.563 8.523
71 HD2 LYS 29 2HD LYS 29 -1.813 -4.589 9.044
72 HD3 LYS 29 1HD LYS 29 -1.526 -4.053 7.384
73 HE2 LYS 29 2HE LYS 29 0.586 -3.044 8.050
74 HE3 LYS 29 1HE LYS 29 0.304 -3.508 9.728
75 HZ1 LYS 29 3HZ LYS 29 0.570 -5.414 7.471
76 HZ2 LYS 29 1HZ LYS 29 0.489 -5.803 9.107
77 HZ3 LYS 29 2HZ LYS 29 1.836 -4.971 8.466
78 H VAL 30 H VAL 30 -2.949 -0.419 5.794
79 HA VAL 30 HA VAL 30 -5.729 -0.128 6.597
80 HB VAL 30 HB VAL 30 -4.789 1.510 4.868
81 HG11 VAL 30 1HG1 VAL 30 -4.660 -0.910 3.104
82 HG12 VAL 30 2HG1 VAL 30 -3.304 0.062 3.668
83 HG13 VAL 30 3HG1 VAL 30 -4.494 0.764 2.566
84 HG21 VAL 30 3HG2 VAL 30 -7.176 1.146 5.075
85 HG22 VAL 30 1HG2 VAL 30 -7.075 -0.253 4.003
86 HG23 VAL 30 2HG2 VAL 30 -6.734 1.366 3.384
87 H ASP 31 H ASP 31 -7.112 -1.839 5.685
88 HA ASP 31 HA ASP 31 -5.622 -4.252 5.749
89 HB2 ASP 31 2HB ASP 31 -7.835 -4.148 6.817
90 HB3 ASP 31 1HB ASP 31 -8.577 -3.986 5.220
91 H CYS 32 H CYS 32 -4.838 -5.332 4.261
92 HA CYS 32 HA CYS 32 -5.588 -4.772 1.487
93 HB2 CYS 32 2HB CYS 32 -3.238 -4.317 2.239
94 HB3 CYS 32 1HB CYS 32 -3.075 -6.010 2.652
95 H SER 33 H SER 33 -6.187 -6.912 3.953
96 HA SER 33 HA SER 33 -5.766 -9.454 2.792
97 HB2 SER 33 2HB SER 33 -7.774 -8.790 4.935
98 HB3 SER 33 1HB SER 33 -6.863 -10.284 4.720
99 HG SER 33 HG SER 33 -6.262 -7.981 5.960
100 H ILE 34 H ILE 34 -8.411 -7.170 2.909
101 HA ILE 34 HA ILE 34 -10.347 -8.866 1.760
102 HB ILE 34 HB ILE 34 -11.660 -6.797 1.329
103 HG12 ILE 34 2HG1 ILE 34 -9.232 -5.372 2.470
104 HG13 ILE 34 1HG1 ILE 34 -9.763 -5.287 0.796
105 HG21 ILE 34 1HG2 ILE 34 -11.767 -7.926 3.497
106 HG22 ILE 34 2HG2 ILE 34 -11.945 -6.182 3.685
107 HG23 ILE 34 3HG2 ILE 34 -10.411 -6.958 4.071
108 HD11 ILE 34 3HD1 ILE 34 -10.399 -3.297 2.026
109 HD12 ILE 34 1HD1 ILE 34 -11.283 -4.279 3.194
110 HD13 ILE 34 2HD1 ILE 34 -11.830 -4.192 1.519
111 H TYR 35 H TYR 35 -7.842 -6.900 0.351
112 HA TYR 35 HA TYR 35 -9.040 -7.192 -2.258
113 HB2 TYR 35 2HB TYR 35 -6.548 -5.716 -1.427
114 HB3 TYR 35 1HB TYR 35 -7.106 -5.833 -3.089
115 HD1 TYR 35 1HD TYR 35 -9.499 -4.956 -3.559
116 HD2 TYR 35 2HD TYR 35 -7.281 -3.962 -0.071
117 HE1 TYR 35 1HE TYR 35 -10.897 -2.957 -3.251
118 HE2 TYR 35 2HE TYR 35 -8.676 -1.976 0.258
119 HH TYR 35 HH TYR 35 -10.102 -0.414 -1.200
120 H LYS 36 H LYS 36 -6.636 -8.693 -0.351
121 HA LYS 36 HA LYS 36 -5.097 -9.963 -2.331
122 HB2 LYS 36 2HB LYS 36 -5.772 -10.833 0.472
123 HB3 LYS 36 1HB LYS 36 -4.684 -11.745 -0.566
124 HG2 LYS 36 2HG LYS 36 -3.200 -9.817 -0.698
125 HG3 LYS 36 1HG LYS 36 -4.305 -8.891 0.319
126 HD2 LYS 36 2HD LYS 36 -2.426 -9.739 1.630
127 HD3 LYS 36 1HD LYS 36 -3.931 -10.479 2.159
128 HE2 LYS 36 2HE LYS 36 -2.135 -12.128 2.048
129 HE3 LYS 36 1HE LYS 36 -3.382 -12.505 0.869
130 HZ1 LYS 36 3HZ LYS 36 -1.156 -12.757 -0.026
131 HZ2 LYS 36 1HZ LYS 36 -0.785 -11.157 0.254
132 HZ3 LYS 36 2HZ LYS 36 -1.965 -11.573 -0.871
133 H LYS 37 H LYS 37 -8.296 -10.387 -1.583
134 HA LYS 37 HA LYS 37 -8.537 -13.133 -2.409
135 HB2 LYS 37 2HB LYS 37 -10.553 -11.013 -1.705
136 HB3 LYS 37 1HB LYS 37 -10.985 -12.657 -2.176
137 HG2 LYS 37 2HG LYS 37 -9.981 -13.593 -0.300
138 HG3 LYS 37 1HG LYS 37 -9.058 -12.135 0.041
139 HD2 LYS 37 2HD LYS 37 -11.083 -10.978 0.683
140 HD3 LYS 37 1HD LYS 37 -12.049 -12.391 0.254
141 HE2 LYS 37 2HE LYS 37 -11.548 -12.139 2.704
142 HE3 LYS 37 1HE LYS 37 -11.098 -13.688 1.995
143 HZ1 LYS 37 3HZ LYS 37 -8.857 -13.077 1.958
144 HZ2 LYS 37 1HZ LYS 37 -9.397 -12.720 3.488
145 HZ3 LYS 37 2HZ LYS 37 -9.109 -11.476 2.348
146 H TYR 38 H TYR 38 -8.080 -10.299 -4.053
147 HA TYR 38 HA TYR 38 -9.416 -11.290 -6.474
148 HB2 TYR 38 2HB TYR 38 -8.122 -8.602 -5.917
149 HB3 TYR 38 1HB TYR 38 -8.975 -9.043 -7.386
150 HD1 TYR 38 1HD TYR 38 -11.501 -9.514 -7.146
151 HD2 TYR 38 2HD TYR 38 -9.180 -7.574 -4.186
152 HE1 TYR 38 1HE TYR 38 -13.547 -8.497 -6.221
153 HE2 TYR 38 2HE TYR 38 -11.208 -6.555 -3.238
154 HH TYR 38 HH TYR 38 -14.325 -7.548 -4.163
155 HA PRO 39 HA PRO 39 -5.368 -12.511 -7.986
156 HB2 PRO 39 2HB PRO 39 -5.475 -11.395 -10.547
157 HB3 PRO 39 1HB PRO 39 -6.055 -13.005 -10.117
158 HG2 PRO 39 2HG PRO 39 -7.572 -10.459 -10.414
159 HG3 PRO 39 1HG PRO 39 -8.051 -12.103 -10.870
160 HD2 PRO 39 2HD PRO 39 -9.034 -10.927 -8.673
161 HD3 PRO 39 1HD PRO 39 -8.632 -12.657 -8.674
162 H VAL 40 H VAL 40 -3.411 -11.607 -7.820
163 HA VAL 40 HA VAL 40 -3.028 -9.090 -6.753
164 HB VAL 40 HB VAL 40 -0.959 -10.742 -8.228
165 HG11 VAL 40 1HG1 VAL 40 0.693 -9.604 -6.812
166 HG12 VAL 40 2HG1 VAL 40 -0.582 -8.594 -6.140
167 HG13 VAL 40 3HG1 VAL 40 -0.171 -8.469 -7.849
168 HG21 VAL 40 3HG2 VAL 40 -0.393 -11.639 -6.017
169 HG22 VAL 40 1HG2 VAL 40 -2.045 -12.033 -6.481
170 HG23 VAL 40 2HG2 VAL 40 -1.738 -10.743 -5.315
171 H VAL 41 H VAL 41 -2.671 -10.038 -10.142
172 HA VAL 41 HA VAL 41 -1.733 -7.406 -10.844
173 HB VAL 41 HB VAL 41 -0.963 -9.422 -12.076
174 HG11 VAL 41 1HG1 VAL 41 -3.738 -9.506 -13.214
175 HG12 VAL 41 2HG1 VAL 41 -2.993 -10.708 -12.166
176 HG13 VAL 41 3HG1 VAL 41 -2.372 -10.453 -13.797
177 HG21 VAL 41 3HG2 VAL 41 -2.327 -7.359 -13.808
178 HG22 VAL 41 1HG2 VAL 41 -1.072 -8.472 -14.349
179 HG23 VAL 41 2HG2 VAL 41 -0.701 -7.249 -13.134
180 H ALA 42 H ALA 42 -4.876 -8.895 -10.632
181 HA ALA 42 HA ALA 42 -5.992 -6.485 -11.855
182 HB1 ALA 42 1HB ALA 42 -7.818 -7.787 -12.817
183 HB2 ALA 42 2HB ALA 42 -7.091 -9.272 -12.200
184 HB3 ALA 42 3HB ALA 42 -6.258 -8.332 -13.434
185 H ILE 43 H ILE 43 -6.398 -5.494 -9.932
186 HA ILE 43 HA ILE 43 -8.330 -6.847 -8.213
187 HB ILE 43 HB ILE 43 -6.280 -4.734 -7.434
188 HG12 ILE 43 2HG1 ILE 43 -6.479 -7.671 -6.698
189 HG13 ILE 43 1HG1 ILE 43 -5.280 -6.951 -7.756
190 HG21 ILE 43 1HG2 ILE 43 -8.371 -4.457 -6.197
191 HG22 ILE 43 2HG2 ILE 43 -7.089 -5.043 -5.142
192 HG23 ILE 43 3HG2 ILE 43 -8.327 -6.158 -5.729
193 HD11 ILE 43 3HD1 ILE 43 -5.589 -6.412 -4.810
194 HD12 ILE 43 1HD1 ILE 43 -4.391 -5.681 -5.880
195 HD13 ILE 43 2HD1 ILE 43 -4.358 -7.420 -5.576
196 HA PRO 44 HA PRO 44 -10.898 -3.518 -9.848
197 HB2 PRO 44 2HB PRO 44 -12.765 -4.648 -7.842
198 HB3 PRO 44 1HB PRO 44 -13.020 -4.349 -9.563
199 HG2 PRO 44 2HG PRO 44 -12.713 -6.820 -8.639
200 HG3 PRO 44 1HG PRO 44 -12.005 -6.332 -10.190
201 HD2 PRO 44 2HD PRO 44 -10.685 -6.674 -7.529
202 HD3 PRO 44 1HD PRO 44 -10.107 -7.115 -9.151
203 H CYS 45 H CYS 45 -11.051 -1.537 -9.065
204 HA CYS 45 HA CYS 45 -10.697 -1.152 -6.190
205 HB2 CYS 45 2HB CYS 45 -9.572 0.424 -8.498
206 HB3 CYS 45 1HB CYS 45 -9.534 1.016 -6.848
207 HA PRO 46 HA PRO 46 -14.505 1.144 -6.211
208 HB2 PRO 46 2HB PRO 46 -13.775 2.974 -4.238
209 HB3 PRO 46 1HB PRO 46 -14.477 1.385 -3.937
210 HG2 PRO 46 2HG PRO 46 -11.629 2.267 -3.842
211 HG3 PRO 46 1HG PRO 46 -12.485 1.117 -2.797
212 HD2 PRO 46 2HD PRO 46 -10.808 0.316 -4.713
213 HD3 PRO 46 1HD PRO 46 -12.272 -0.608 -4.313
214 H ILE 47 H ILE 47 -15.264 3.184 -6.861
215 HA ILE 47 HA ILE 47 -13.364 4.658 -8.468
216 HB ILE 47 HB ILE 47 -15.318 6.018 -9.203
217 HG12 ILE 47 2HG1 ILE 47 -16.920 4.070 -7.515
218 HG13 ILE 47 1HG1 ILE 47 -16.713 5.786 -7.184
219 HG21 ILE 47 1HG2 ILE 47 -15.583 3.035 -9.514
220 HG22 ILE 47 2HG2 ILE 47 -14.607 4.117 -10.505
221 HG23 ILE 47 3HG2 ILE 47 -16.368 4.239 -10.538
222 HD11 ILE 47 3HD1 ILE 47 -18.116 4.600 -9.567
223 HD12 ILE 47 1HD1 ILE 47 -17.925 6.320 -9.230
224 HD13 ILE 47 2HD1 ILE 47 -18.889 5.316 -8.151
225 H THR 48 H THR 48 -14.724 4.875 -5.392
226 HA THR 48 HA THR 48 -14.543 7.633 -4.953
227 HB THR 48 HB THR 48 -14.190 5.390 -2.948
228 HG1 THR 48 1HG THR 48 -16.442 6.625 -4.133
229 HG21 THR 48 3HG2 THR 48 -13.582 7.644 -2.112
230 HG22 THR 48 1HG2 THR 48 -15.044 7.030 -1.336
231 HG23 THR 48 2HG2 THR 48 -15.162 8.237 -2.614
232 H TYR 49 H TYR 49 -12.870 8.837 -4.940
233 HA TYR 49 HA TYR 49 -10.194 7.781 -4.902
234 HB2 TYR 49 2HB TYR 49 -10.868 9.525 -6.514
235 HB3 TYR 49 1HB TYR 49 -11.283 10.590 -5.186
236 HD1 TYR 49 1HD TYR 49 -8.462 8.931 -6.918
237 HD2 TYR 49 2HD TYR 49 -9.639 11.940 -4.155
238 HE1 TYR 49 1HE TYR 49 -6.201 9.906 -7.012
239 HE2 TYR 49 2HE TYR 49 -7.387 12.906 -4.236
240 HH TYR 49 HH TYR 49 -5.152 12.355 -4.823
241 H LEU 50 H LEU 50 -9.232 7.483 -3.043
242 HA LEU 50 HA LEU 50 -9.726 9.333 -0.831
243 HB2 LEU 50 2HB LEU 50 -9.366 6.330 -0.649
244 HB3 LEU 50 1HB LEU 50 -9.445 7.421 0.719
245 HG LEU 50 HG LEU 50 -11.715 6.970 -1.219
246 HD11 LEU 50 1HD1 LEU 50 -11.213 4.943 0.009
247 HD12 LEU 50 2HD1 LEU 50 -12.731 5.657 0.545
248 HD13 LEU 50 3HD1 LEU 50 -11.271 5.834 1.533
249 HD21 LEU 50 3HD2 LEU 50 -13.060 8.082 0.498
250 HD22 LEU 50 1HD2 LEU 50 -11.786 9.146 -0.094
251 HD23 LEU 50 2HD2 LEU 50 -11.617 8.351 1.470
252 HA PRO 51 HA PRO 51 -5.369 9.401 -2.129
253 HB2 PRO 51 2HB PRO 51 -4.803 11.599 -0.476
254 HB3 PRO 51 1HB PRO 51 -5.146 11.671 -2.196
255 HG2 PRO 51 2HG PRO 51 -6.857 12.330 0.094
256 HG3 PRO 51 1HG PRO 51 -6.979 12.852 -1.586
257 HD2 PRO 51 2HD PRO 51 -8.644 11.014 -0.371
258 HD3 PRO 51 1HD PRO 51 -8.415 11.147 -2.121
259 H VAL 52 H VAL 52 -4.098 8.013 -1.240
260 HA VAL 52 HA VAL 52 -3.653 8.161 1.643
261 HB VAL 52 HB VAL 52 -3.272 5.732 1.749
262 HG11 VAL 52 1HG1 VAL 52 -5.459 6.534 2.313
263 HG12 VAL 52 2HG1 VAL 52 -5.577 4.956 1.530
264 HG13 VAL 52 3HG1 VAL 52 -5.969 6.422 0.631
265 HG21 VAL 52 3HG2 VAL 52 -2.588 5.277 -0.514
266 HG22 VAL 52 1HG2 VAL 52 -4.196 5.689 -1.123
267 HG23 VAL 52 2HG2 VAL 52 -3.976 4.263 -0.109
268 H CYS 53 H CYS 53 -1.545 7.728 2.292
269 HA CYS 53 HA CYS 53 0.343 7.966 0.088
270 HB2 CYS 53 2HB CYS 53 0.258 9.948 1.488
271 HB3 CYS 53 1HB CYS 53 0.593 9.020 2.930
272 H GLY 54 H GLY 54 1.716 6.398 -0.165
273 HA2 GLY 54 2HA GLY 54 1.747 4.256 1.796
274 HA3 GLY 54 1HA GLY 54 2.412 4.195 0.170
275 H SER 55 H SER 55 3.846 3.254 2.306
276 HA SER 55 HA SER 55 5.641 5.001 3.533
277 HB2 SER 55 2HB SER 55 6.348 2.225 2.632
278 HB3 SER 55 1HB SER 55 6.835 3.063 4.110
279 HG SER 55 HG SER 55 4.917 2.709 4.984
280 H ASP 56 H ASP 56 5.426 4.177 0.262
281 HA ASP 56 HA ASP 56 8.245 4.564 -0.373
282 HB2 ASP 56 2HB ASP 56 6.813 2.790 -1.470
283 HB3 ASP 56 1HB ASP 56 5.911 4.085 -2.245
284 H TYR 57 H TYR 57 5.755 6.476 0.381
285 HA TYR 57 HA TYR 57 5.291 8.636 0.309
286 HB2 TYR 57 2HB TYR 57 7.966 8.906 -1.085
287 HB3 TYR 57 1HB TYR 57 7.001 10.272 -0.528
288 HD1 TYR 57 2HD TYR 57 6.591 10.560 1.930
289 HD2 TYR 57 1HD TYR 57 9.277 7.647 0.408
290 HE1 TYR 57 2HE TYR 57 7.605 10.331 4.164
291 HE2 TYR 57 1HE TYR 57 10.288 7.402 2.610
292 HH TYR 57 HH TYR 57 8.863 8.653 5.421
293 H ILE 58 H ILE 58 4.435 6.884 -1.709
294 HA ILE 58 HA ILE 58 3.958 8.701 -3.956
295 HB ILE 58 HB ILE 58 3.432 5.718 -3.719
296 HG12 ILE 58 2HG1 ILE 58 5.819 6.168 -3.827
297 HG13 ILE 58 1HG1 ILE 58 5.267 5.426 -5.321
298 HG21 ILE 58 1HG2 ILE 58 3.155 7.516 -6.125
299 HG22 ILE 58 2HG2 ILE 58 1.840 6.770 -5.219
300 HG23 ILE 58 3HG2 ILE 58 2.966 5.759 -6.124
301 HD11 ILE 58 3HD1 ILE 58 5.284 7.640 -6.401
302 HD12 ILE 58 1HD1 ILE 58 6.868 7.182 -5.776
303 HD13 ILE 58 2HD1 ILE 58 5.882 8.348 -4.900
304 H THR 59 H THR 59 1.993 9.610 -4.084
305 HA THR 59 HA THR 59 -0.021 8.887 -2.166
306 HB THR 59 HB THR 59 -0.083 10.964 -4.382
307 HG1 THR 59 1HG THR 59 1.493 11.224 -2.694
308 HG21 THR 59 3HG2 THR 59 -1.953 11.945 -3.074
309 HG22 THR 59 1HG2 THR 59 -1.888 10.563 -1.980
310 HG23 THR 59 2HG2 THR 59 -2.345 10.328 -3.668
311 H TYR 60 H TYR 60 -1.462 7.416 -2.511
312 HA TYR 60 HA TYR 60 -1.954 6.450 -5.219
313 HB2 TYR 60 2HB TYR 60 -2.469 5.180 -2.535
314 HB3 TYR 60 1HB TYR 60 -2.951 4.451 -4.070
315 HD1 TYR 60 1HD TYR 60 -1.247 3.535 -5.577
316 HD2 TYR 60 2HD TYR 60 -0.176 5.218 -1.824
317 HE1 TYR 60 1HE TYR 60 0.972 2.488 -5.744
318 HE2 TYR 60 2HE TYR 60 2.041 4.183 -1.983
319 HH TYR 60 HH TYR 60 3.225 2.798 -4.850
320 H GLY 61 H GLY 61 -4.056 6.056 -5.912
321 HA2 GLY 61 2HA GLY 61 -5.856 8.148 -5.388
322 HA3 GLY 61 1HA GLY 61 -6.169 6.735 -6.389
323 H ASN 62 H ASN 62 -5.611 4.971 -4.065
324 HA ASN 62 HA ASN 62 -7.188 5.538 -1.920
325 HB2 ASN 62 2HB ASN 62 -9.165 4.041 -2.237
326 HB3 ASN 62 1HB ASN 62 -9.176 5.411 -3.309
327 HD21 ASN 62 1HD2 ASN 62 -10.536 4.512 -4.743
328 HD22 ASN 62 2HD2 ASN 62 -10.167 3.210 -5.790
329 H GLU 63 H GLU 63 -7.861 3.283 -0.846
330 HA GLU 63 HA GLU 63 -5.288 2.241 -0.304
331 HB2 GLU 63 2HB GLU 63 -6.275 0.877 1.362
332 HB3 GLU 63 1HB GLU 63 -7.006 2.466 1.420
333 HG2 GLU 63 2HG GLU 63 -8.200 -0.088 0.346
334 HG3 GLU 63 1HG GLU 63 -8.687 0.756 1.815
335 H CYS 64 H CYS 64 -7.908 1.129 -2.250
336 HA CYS 64 HA CYS 64 -7.151 -1.484 -2.686
337 HB2 CYS 64 2HB CYS 64 -9.206 -0.585 -3.602
338 HB3 CYS 64 1HB CYS 64 -8.296 0.478 -4.672
339 H HIS 65 H HIS 65 -6.109 1.409 -4.455
340 HA HIS 65 HA HIS 65 -4.295 -0.039 -6.108
341 HB2 HIS 65 2HB HIS 65 -4.416 2.918 -5.507
342 HB3 HIS 65 1HB HIS 65 -3.290 2.224 -6.662
343 HD1 HIS 65 1HD HIS 65 -4.410 1.057 -8.795
344 HD2 HIS 65 2HD HIS 65 -6.882 3.384 -6.435
345 HE1 HIS 65 1HE HIS 65 -6.485 1.426 -10.161
346 HE2 HIS 65 2HE HIS 65 -7.681 3.202 -8.874
347 H LEU 66 H LEU 66 -3.979 1.496 -3.024
348 HA LEU 66 HA LEU 66 -1.177 1.307 -2.772
349 HB2 LEU 66 2HB LEU 66 -2.471 2.683 -1.267
350 HB3 LEU 66 1HB LEU 66 -3.394 1.298 -0.729
351 HG LEU 66 HG LEU 66 -1.435 0.399 0.414
352 HD11 LEU 66 1HD1 LEU 66 -0.053 2.914 -0.518
353 HD12 LEU 66 2HD1 LEU 66 0.326 1.267 -1.030
354 HD13 LEU 66 3HD1 LEU 66 0.592 1.755 0.643
355 HD21 LEU 66 3HD2 LEU 66 -1.991 3.278 1.088
356 HD22 LEU 66 1HD2 LEU 66 -1.273 2.079 2.162
357 HD23 LEU 66 2HD2 LEU 66 -2.938 1.884 1.606
358 H CYS 67 H CYS 67 -3.799 -0.856 -1.734
359 HA CYS 67 HA CYS 67 -2.179 -2.937 -0.814
360 HB2 CYS 67 2HB CYS 67 -4.517 -2.853 -0.227
361 HB3 CYS 67 1HB CYS 67 -4.993 -2.986 -1.914
362 H THR 68 H THR 68 -3.563 -2.434 -4.095
363 HA THR 68 HA THR 68 -2.684 -4.783 -5.288
364 HB THR 68 HB THR 68 -2.806 -2.046 -6.601
365 HG1 THR 68 1HG THR 68 -4.827 -3.842 -5.795
366 HG21 THR 68 3HG2 THR 68 -3.381 -3.323 -8.631
367 HG22 THR 68 1HG2 THR 68 -3.205 -4.828 -7.727
368 HG23 THR 68 2HG2 THR 68 -1.801 -3.796 -8.003
369 H GLU 69 H GLU 69 -1.007 -1.628 -5.050
370 HA GLU 69 HA GLU 69 1.308 -2.442 -6.443
371 HB2 GLU 69 2HB GLU 69 0.369 -0.079 -5.867
372 HB3 GLU 69 1HB GLU 69 1.258 -0.280 -4.366
373 HG2 GLU 69 2HG GLU 69 2.622 0.952 -5.838
374 HG3 GLU 69 1HG GLU 69 3.311 -0.669 -5.738
375 H SER 70 H SER 70 0.335 -2.471 -3.066
376 HA SER 70 HA SER 70 2.821 -3.041 -1.909
377 HB2 SER 70 2HB SER 70 0.749 -2.269 -0.680
378 HB3 SER 70 1HB SER 70 0.113 -3.901 -0.859
379 HG SER 70 HG SER 70 2.130 -2.897 0.709
380 H LEU 71 H LEU 71 0.174 -5.185 -2.962
381 HA LEU 71 HA LEU 71 1.424 -7.611 -2.237
382 HB2 LEU 71 2HB LEU 71 -0.642 -7.096 -4.374
383 HB3 LEU 71 1HB LEU 71 -0.191 -8.674 -3.767
384 HG LEU 71 HG LEU 71 -1.540 -6.491 -2.188
385 HD11 LEU 71 1HD1 LEU 71 -3.455 -8.008 -2.189
386 HD12 LEU 71 2HD1 LEU 71 -2.572 -9.121 -3.237
387 HD13 LEU 71 3HD1 LEU 71 -3.007 -7.513 -3.821
388 HD21 LEU 71 3HD2 LEU 71 -0.816 -9.309 -1.394
389 HD22 LEU 71 1HD2 LEU 71 -1.743 -8.165 -0.423
390 HD23 LEU 71 2HD2 LEU 71 -0.049 -7.842 -0.784
391 H LYS 72 H LYS 72 1.436 -5.735 -5.166
392 HA LYS 72 HA LYS 72 2.799 -7.505 -6.861
393 HB2 LYS 72 2HB LYS 72 1.603 -5.492 -7.557
394 HB3 LYS 72 1HB LYS 72 2.839 -4.493 -6.814
395 HG2 LYS 72 2HG LYS 72 4.488 -5.586 -8.391
396 HG3 LYS 72 1HG LYS 72 3.092 -6.258 -9.239
397 HD2 LYS 72 2HD LYS 72 3.653 -3.337 -8.758
398 HD3 LYS 72 1HD LYS 72 3.816 -4.183 -10.294
399 HE2 LYS 72 2HE LYS 72 1.442 -4.568 -10.390
400 HE3 LYS 72 1HE LYS 72 1.229 -3.930 -8.761
401 HZ1 LYS 72 3HZ LYS 72 0.628 -2.313 -10.371
402 HZ2 LYS 72 1HZ LYS 72 2.146 -2.393 -11.116
403 HZ3 LYS 72 2HZ LYS 72 2.000 -1.816 -9.517
404 H SER 73 H SER 73 3.943 -5.072 -4.580
405 HA SER 73 HA SER 73 6.705 -5.552 -5.320
406 HB2 SER 73 2HB SER 73 7.189 -3.722 -3.682
407 HB3 SER 73 1HB SER 73 6.113 -3.246 -4.992
408 HG SER 73 HG SER 73 4.394 -3.305 -3.643
409 H ASN 74 H ASN 74 4.647 -7.212 -3.536
410 HA ASN 74 HA ASN 74 4.732 -8.752 -1.920
411 HB2 ASN 74 2HB ASN 74 7.679 -8.572 -2.516
412 HB3 ASN 74 1HB ASN 74 7.030 -9.718 -1.347
413 HD21 ASN 74 1HD2 ASN 74 8.364 -10.136 -3.918
414 HD22 ASN 74 2HD2 ASN 74 7.269 -11.094 -4.843
415 H GLY 75 H GLY 75 4.682 -6.011 -1.167
416 HA2 GLY 75 2HA GLY 75 4.180 -5.350 1.050
417 HA3 GLY 75 1HA GLY 75 5.373 -6.500 1.628
418 H ARG 76 H ARG 76 6.221 -4.246 -0.946
419 HA ARG 76 HA ARG 76 8.160 -3.069 0.802
420 HB2 ARG 76 2HB ARG 76 8.892 -3.173 -1.452
421 HB3 ARG 76 1HB ARG 76 7.380 -2.501 -2.046
422 HG2 ARG 76 2HG ARG 76 7.891 -0.341 -1.197
423 HG3 ARG 76 1HG ARG 76 9.286 -0.960 -0.329
424 HD2 ARG 76 2HD ARG 76 9.048 -1.060 -3.319
425 HD3 ARG 76 1HD ARG 76 9.708 0.335 -2.461
426 HE ARG 76 HE ARG 76 10.898 -2.192 -1.795
427 HH11 ARG 76 1HH1 ARG 76 11.051 0.595 -3.994
428 HH12 ARG 76 2HH1 ARG 76 12.728 0.486 -4.240
429 HH21 ARG 76 1HH2 ARG 76 13.183 -2.303 -2.092
430 HH22 ARG 76 2HH2 ARG 76 13.985 -1.214 -3.121
431 H VAL 77 H VAL 77 5.295 -1.886 -0.799
432 HA VAL 77 HA VAL 77 5.499 0.517 0.806
433 HB VAL 77 HB VAL 77 5.211 0.877 -1.574
434 HG11 VAL 77 1HG1 VAL 77 3.147 0.306 -2.760
435 HG12 VAL 77 2HG1 VAL 77 2.604 -0.602 -1.350
436 HG13 VAL 77 3HG1 VAL 77 4.045 -1.116 -2.228
437 HG21 VAL 77 3HG2 VAL 77 2.755 1.657 -0.027
438 HG22 VAL 77 1HG2 VAL 77 3.281 2.382 -1.543
439 HG23 VAL 77 2HG2 VAL 77 4.280 2.548 -0.097
440 H GLN 78 H GLN 78 4.488 0.716 2.644
441 HA GLN 78 HA GLN 78 2.022 -0.778 3.110
442 HB2 GLN 78 2HB GLN 78 4.043 0.480 4.974
443 HB3 GLN 78 1HB GLN 78 2.440 0.060 5.518
444 HG2 GLN 78 2HG GLN 78 3.961 -1.609 6.212
445 HG3 GLN 78 1HG GLN 78 2.923 -2.293 4.965
446 HE21 GLN 78 1HE2 GLN 78 3.845 -2.920 3.061
447 HE22 GLN 78 2HE2 GLN 78 5.561 -3.076 2.871
448 H PHE 79 H PHE 79 0.675 0.614 4.756
449 HA PHE 79 HA PHE 79 0.020 3.129 3.530
450 HB2 PHE 79 2HB PHE 79 -1.681 1.549 4.450
451 HB3 PHE 79 1HB PHE 79 -0.933 1.731 6.024
452 HD1 PHE 79 2HD PHE 79 -3.036 3.337 3.495
453 HD2 PHE 79 1HD PHE 79 -1.369 3.656 7.397
454 HE1 PHE 79 2HE PHE 79 -4.599 5.162 4.014
455 HE2 PHE 79 1HE PHE 79 -2.925 5.473 7.916
456 HZ PHE 79 HZ PHE 79 -4.548 6.225 6.225
457 H LEU 80 H LEU 80 1.125 4.936 4.084
458 HA LEU 80 HA LEU 80 2.799 4.890 6.467
459 HB2 LEU 80 2HB LEU 80 3.721 5.624 4.295
460 HB3 LEU 80 1HB LEU 80 2.563 6.926 4.240
461 HG LEU 80 HG LEU 80 3.637 7.856 6.312
462 HD11 LEU 80 1HD1 LEU 80 4.673 5.824 7.135
463 HD12 LEU 80 2HD1 LEU 80 5.863 7.099 6.879
464 HD13 LEU 80 3HD1 LEU 80 5.725 5.782 5.715
465 HD21 LEU 80 3HD2 LEU 80 5.378 7.527 3.876
466 HD22 LEU 80 1HD2 LEU 80 5.558 8.773 5.114
467 HD23 LEU 80 2HD2 LEU 80 4.114 8.737 4.100
468 H HIS 81 H HIS 81 0.410 6.995 4.906
469 HA HIS 81 HA HIS 81 -0.919 7.491 7.341
470 HB2 HIS 81 2HB HIS 81 -0.670 9.960 7.397
471 HB3 HIS 81 1HB HIS 81 0.878 9.174 7.645
472 HD1 HIS 81 1HD HIS 81 -0.960 11.438 5.295
473 HD2 HIS 81 2HD HIS 81 2.753 9.605 5.601
474 HE1 HIS 81 1HE HIS 81 0.506 12.495 3.514
475 HE2 HIS 81 2HE HIS 81 2.783 11.603 4.021
476 H ASP 82 H ASP 82 -2.860 8.791 6.950
477 HA ASP 82 HA ASP 82 -3.955 8.247 4.340
478 HB2 ASP 82 2HB ASP 82 -5.318 8.072 6.465
479 HB3 ASP 82 1HB ASP 82 -5.156 9.809 6.644
480 H GLY 83 H GLY 83 -4.667 9.869 2.883
481 HA2 GLY 83 2HA GLY 83 -4.926 12.072 2.197
482 HA3 GLY 83 1HA GLY 83 -3.826 12.587 3.476
483 H SER 84 H SER 84 -3.453 13.544 1.079
484 HA SER 84 HA SER 84 -1.706 12.131 -0.606
485 HB2 SER 84 2HB SER 84 -1.925 15.109 -0.142
486 HB3 SER 84 1HB SER 84 -1.354 14.304 -1.614
487 HG SER 84 HG SER 84 -3.929 14.662 -0.624
488 H CYS 85 H CYS 85 0.589 12.179 -0.667
489 HA CYS 85 HA CYS 85 1.878 12.118 1.821
490 HB2 CYS 85 2HB CYS 85 3.135 12.306 -0.924
491 HB3 CYS 85 1HB CYS 85 3.938 11.854 0.581
Start of MODEL 13
1 H1 SER 20 1HT SER 20 -9.852 6.556 18.807
2 H2 SER 20 2HT SER 20 -11.164 6.413 19.859
3 H3 SER 20 3HT SER 20 -11.314 7.336 18.461
4 HA SER 20 HA SER 20 -10.874 4.420 18.593
5 HB2 SER 20 2HB SER 20 -13.335 6.004 17.810
6 HB3 SER 20 1HB SER 20 -13.210 4.244 17.877
7 HG SER 20 HG SER 20 -14.150 5.425 19.746
8 H GLU 21 H GLU 21 -11.946 7.082 16.518
9 HA GLU 21 HA GLU 21 -11.118 5.948 14.070
10 HB2 GLU 21 2HB GLU 21 -11.434 8.280 13.215
11 HB3 GLU 21 1HB GLU 21 -12.818 7.712 14.130
12 HG2 GLU 21 2HG GLU 21 -10.686 9.497 15.309
13 HG3 GLU 21 1HG GLU 21 -12.127 10.129 14.529
14 H ALA 22 H ALA 22 -9.790 8.070 16.469
15 HA ALA 22 HA ALA 22 -7.155 7.865 15.266
16 HB1 ALA 22 1HB ALA 22 -7.869 10.160 15.760
17 HB2 ALA 22 2HB ALA 22 -6.567 9.688 16.855
18 HB3 ALA 22 3HB ALA 22 -8.240 9.699 17.421
19 H ALA 23 H ALA 23 -5.756 6.538 16.289
20 HA ALA 23 HA ALA 23 -6.540 5.583 18.943
21 HB1 ALA 23 1HB ALA 23 -5.280 3.932 16.747
22 HB2 ALA 23 2HB ALA 23 -6.968 3.845 17.259
23 HB3 ALA 23 3HB ALA 23 -5.682 3.365 18.367
24 H SER 24 H SER 24 -4.536 7.515 17.524
25 HA SER 24 HA SER 24 -2.731 8.620 18.243
26 HB2 SER 24 2HB SER 24 -2.689 6.753 20.625
27 HB3 SER 24 1HB SER 24 -1.922 8.336 20.512
28 HG SER 24 HG SER 24 -4.260 8.949 19.952
29 H LEU 25 H LEU 25 -1.739 5.431 19.505
30 HA LEU 25 HA LEU 25 0.809 5.754 18.167
31 HB2 LEU 25 2HB LEU 25 -0.192 3.696 20.129
32 HB3 LEU 25 1HB LEU 25 1.361 3.545 19.343
33 HG LEU 25 HG LEU 25 2.014 5.741 20.420
34 HD11 LEU 25 1HD1 LEU 25 0.773 6.534 22.330
35 HD12 LEU 25 2HD1 LEU 25 -0.466 5.315 22.054
36 HD13 LEU 25 3HD1 LEU 25 -0.224 6.606 20.875
37 HD21 LEU 25 3HD2 LEU 25 2.425 4.758 22.622
38 HD22 LEU 25 1HD2 LEU 25 2.768 3.622 21.317
39 HD23 LEU 25 2HD2 LEU 25 1.281 3.467 22.250
40 H SER 26 H SER 26 -2.057 4.608 17.250
41 HA SER 26 HA SER 26 -0.859 3.208 15.061
42 HB2 SER 26 2HB SER 26 -2.824 1.485 15.349
43 HB3 SER 26 1HB SER 26 -1.349 1.279 16.291
44 HG SER 26 HG SER 26 -2.426 1.581 18.020
45 HA PRO 27 HA PRO 27 -4.092 5.783 13.325
46 HB2 PRO 27 2HB PRO 27 -3.266 5.746 10.784
47 HB3 PRO 27 1HB PRO 27 -2.353 6.631 12.013
48 HG2 PRO 27 2HG PRO 27 -1.784 3.967 10.785
49 HG3 PRO 27 1HG PRO 27 -0.655 5.256 11.232
50 HD2 PRO 27 2HD PRO 27 -1.195 2.985 12.760
51 HD3 PRO 27 1HD PRO 27 -0.469 4.486 13.370
52 H LYS 28 H LYS 28 -5.416 5.397 11.061
53 HA LYS 28 HA LYS 28 -6.355 2.684 11.310
54 HB2 LYS 28 2HB LYS 28 -7.507 4.959 9.688
55 HB3 LYS 28 1HB LYS 28 -8.210 3.351 9.797
56 HG2 LYS 28 2HG LYS 28 -8.370 3.708 12.281
57 HG3 LYS 28 1HG LYS 28 -7.922 5.387 11.992
58 HD2 LYS 28 2HD LYS 28 -10.311 5.276 12.143
59 HD3 LYS 28 1HD LYS 28 -9.890 5.569 10.457
60 HE2 LYS 28 2HE LYS 28 -11.676 3.906 10.664
61 HE3 LYS 28 1HE LYS 28 -10.238 3.197 9.941
62 HZ1 LYS 28 3HZ LYS 28 -11.240 1.746 11.643
63 HZ2 LYS 28 1HZ LYS 28 -11.031 2.923 12.806
64 HZ3 LYS 28 2HZ LYS 28 -9.705 2.197 12.115
65 H LYS 29 H LYS 29 -5.060 1.365 10.379
66 HA LYS 29 HA LYS 29 -3.714 2.033 7.943
67 HB2 LYS 29 2HB LYS 29 -2.747 0.759 9.943
68 HB3 LYS 29 1HB LYS 29 -3.711 -0.602 9.410
69 HG2 LYS 29 2HG LYS 29 -1.704 0.683 7.586
70 HG3 LYS 29 1HG LYS 29 -1.199 -0.492 8.786
71 HD2 LYS 29 2HD LYS 29 -3.261 -0.989 6.640
72 HD3 LYS 29 1HD LYS 29 -1.561 -1.433 6.516
73 HE2 LYS 29 2HE LYS 29 -1.816 -2.906 8.472
74 HE3 LYS 29 1HE LYS 29 -3.516 -2.458 8.589
75 HZ1 LYS 29 3HZ LYS 29 -2.251 -3.880 6.301
76 HZ2 LYS 29 1HZ LYS 29 -3.857 -3.383 6.378
77 HZ3 LYS 29 2HZ LYS 29 -3.273 -4.560 7.431
78 H VAL 30 H VAL 30 -4.006 1.114 6.020
79 HA VAL 30 HA VAL 30 -6.596 0.636 5.117
80 HB VAL 30 HB VAL 30 -4.713 1.513 3.731
81 HG11 VAL 30 1HG1 VAL 30 -3.754 -1.331 3.606
82 HG12 VAL 30 2HG1 VAL 30 -2.980 -0.028 4.482
83 HG13 VAL 30 3HG1 VAL 30 -3.084 0.042 2.716
84 HG21 VAL 30 3HG2 VAL 30 -5.302 0.353 1.650
85 HG22 VAL 30 1HG2 VAL 30 -6.729 0.711 2.624
86 HG23 VAL 30 2HG2 VAL 30 -6.074 -0.924 2.591
87 H ASP 31 H ASP 31 -7.793 -1.214 4.699
88 HA ASP 31 HA ASP 31 -6.600 -3.685 5.579
89 HB2 ASP 31 2HB ASP 31 -9.018 -3.124 6.143
90 HB3 ASP 31 1HB ASP 31 -9.382 -3.373 4.432
91 H CYS 32 H CYS 32 -5.336 -4.566 4.200
92 HA CYS 32 HA CYS 32 -5.912 -4.424 1.332
93 HB2 CYS 32 2HB CYS 32 -3.677 -3.687 2.161
94 HB3 CYS 32 1HB CYS 32 -3.411 -5.279 2.833
95 H SER 33 H SER 33 -6.469 -6.327 3.968
96 HA SER 33 HA SER 33 -5.824 -8.911 3.076
97 HB2 SER 33 2HB SER 33 -7.874 -8.005 5.104
98 HB3 SER 33 1HB SER 33 -7.182 -9.624 4.970
99 HG SER 33 HG SER 33 -5.279 -8.907 5.663
100 H ILE 34 H ILE 34 -8.797 -6.976 3.092
101 HA ILE 34 HA ILE 34 -10.418 -8.943 1.868
102 HB ILE 34 HB ILE 34 -12.059 -7.147 1.476
103 HG12 ILE 34 2HG1 ILE 34 -9.940 -5.320 2.641
104 HG13 ILE 34 1HG1 ILE 34 -10.452 -5.332 0.959
105 HG21 ILE 34 1HG2 ILE 34 -12.451 -6.590 3.831
106 HG22 ILE 34 2HG2 ILE 34 -10.819 -7.133 4.218
107 HG23 ILE 34 3HG2 ILE 34 -12.011 -8.285 3.614
108 HD11 ILE 34 3HD1 ILE 34 -12.690 -4.637 1.651
109 HD12 ILE 34 1HD1 ILE 34 -11.451 -3.492 2.168
110 HD13 ILE 34 2HD1 ILE 34 -12.158 -4.615 3.332
111 H TYR 35 H TYR 35 -8.061 -6.923 0.534
112 HA TYR 35 HA TYR 35 -9.234 -7.157 -2.108
113 HB2 TYR 35 2HB TYR 35 -6.820 -5.598 -1.156
114 HB3 TYR 35 1HB TYR 35 -7.315 -5.693 -2.841
115 HD1 TYR 35 2HD TYR 35 -9.405 -4.585 -3.581
116 HD2 TYR 35 1HD TYR 35 -8.021 -4.201 0.421
117 HE1 TYR 35 2HE TYR 35 -10.931 -2.686 -3.241
118 HE2 TYR 35 1HE TYR 35 -9.543 -2.300 0.771
119 HH TYR 35 HH TYR 35 -10.845 -0.687 -0.356
120 H LYS 36 H LYS 36 -7.134 -8.807 -0.104
121 HA LYS 36 HA LYS 36 -5.396 -9.891 -2.083
122 HB2 LYS 36 2HB LYS 36 -5.936 -10.731 0.748
123 HB3 LYS 36 1HB LYS 36 -4.837 -11.606 -0.309
124 HG2 LYS 36 2HG LYS 36 -3.475 -9.553 -0.545
125 HG3 LYS 36 1HG LYS 36 -4.574 -8.731 0.562
126 HD2 LYS 36 2HD LYS 36 -2.572 -9.477 1.741
127 HD3 LYS 36 1HD LYS 36 -3.999 -10.327 2.322
128 HE2 LYS 36 2HE LYS 36 -2.121 -11.858 2.086
129 HE3 LYS 36 1HE LYS 36 -3.388 -12.290 0.951
130 HZ1 LYS 36 3HZ LYS 36 -1.241 -12.401 -0.097
131 HZ2 LYS 36 1HZ LYS 36 -0.890 -10.808 0.332
132 HZ3 LYS 36 2HZ LYS 36 -2.112 -11.142 -0.790
133 H LYS 37 H LYS 37 -8.579 -10.529 -1.284
134 HA LYS 37 HA LYS 37 -8.542 -13.307 -2.042
135 HB2 LYS 37 2HB LYS 37 -11.006 -13.221 -1.925
136 HB3 LYS 37 1HB LYS 37 -10.247 -12.588 -0.475
137 HG2 LYS 37 2HG LYS 37 -10.692 -10.311 -1.233
138 HG3 LYS 37 1HG LYS 37 -11.432 -10.946 -2.706
139 HD2 LYS 37 2HD LYS 37 -13.132 -12.076 -1.391
140 HD3 LYS 37 1HD LYS 37 -12.384 -11.511 0.102
141 HE2 LYS 37 2HE LYS 37 -12.846 -9.204 -0.518
142 HE3 LYS 37 1HE LYS 37 -13.533 -9.736 -2.052
143 HZ1 LYS 37 3HZ LYS 37 -14.606 -10.370 0.647
144 HZ2 LYS 37 1HZ LYS 37 -15.246 -10.905 -0.812
145 HZ3 LYS 37 2HZ LYS 37 -15.270 -9.270 -0.429
146 H TYR 38 H TYR 38 -8.178 -10.600 -3.775
147 HA TYR 38 HA TYR 38 -9.332 -11.727 -6.238
148 HB2 TYR 38 2HB TYR 38 -8.222 -8.941 -5.746
149 HB3 TYR 38 1HB TYR 38 -9.111 -9.474 -7.159
150 HD1 TYR 38 1HD TYR 38 -11.598 -10.238 -6.687
151 HD2 TYR 38 2HD TYR 38 -9.284 -7.804 -4.090
152 HE1 TYR 38 1HE TYR 38 -13.664 -9.361 -5.661
153 HE2 TYR 38 2HE TYR 38 -11.336 -6.934 -3.057
154 HH TYR 38 HH TYR 38 -13.676 -6.655 -3.603
155 HA PRO 39 HA PRO 39 -5.023 -12.404 -7.443
156 HB2 PRO 39 2HB PRO 39 -5.063 -11.618 -10.085
157 HB3 PRO 39 1HB PRO 39 -5.638 -13.197 -9.534
158 HG2 PRO 39 2HG PRO 39 -7.183 -10.735 -10.196
159 HG3 PRO 39 1HG PRO 39 -7.570 -12.432 -10.547
160 HD2 PRO 39 2HD PRO 39 -8.738 -11.060 -8.533
161 HD3 PRO 39 1HD PRO 39 -8.414 -12.797 -8.429
162 H VAL 40 H VAL 40 -3.152 -11.127 -7.590
163 HA VAL 40 HA VAL 40 -3.328 -8.498 -6.636
164 HB VAL 40 HB VAL 40 -0.946 -9.773 -8.018
165 HG11 VAL 40 1HG1 VAL 40 -1.065 -7.453 -6.103
166 HG12 VAL 40 2HG1 VAL 40 -0.677 -7.371 -7.820
167 HG13 VAL 40 3HG1 VAL 40 0.412 -8.205 -6.709
168 HG21 VAL 40 3HG2 VAL 40 -1.720 -11.142 -6.166
169 HG22 VAL 40 1HG2 VAL 40 -1.687 -9.742 -5.094
170 HG23 VAL 40 2HG2 VAL 40 -0.183 -10.374 -5.766
171 H VAL 41 H VAL 41 -2.808 -9.722 -9.865
172 HA VAL 41 HA VAL 41 -2.247 -7.185 -11.003
173 HB VAL 41 HB VAL 41 -1.469 -9.289 -12.012
174 HG11 VAL 41 1HG1 VAL 41 -4.338 -9.777 -12.765
175 HG12 VAL 41 2HG1 VAL 41 -3.387 -10.706 -11.608
176 HG13 VAL 41 3HG1 VAL 41 -2.952 -10.719 -13.316
177 HG21 VAL 41 3HG2 VAL 41 -1.592 -7.297 -13.404
178 HG22 VAL 41 1HG2 VAL 41 -3.246 -7.696 -13.852
179 HG23 VAL 41 2HG2 VAL 41 -1.917 -8.743 -14.362
180 H ALA 42 H ALA 42 -5.247 -8.842 -10.303
181 HA ALA 42 HA ALA 42 -6.595 -6.569 -11.528
182 HB1 ALA 42 1HB ALA 42 -8.435 -7.955 -12.288
183 HB2 ALA 42 2HB ALA 42 -7.654 -9.396 -11.650
184 HB3 ALA 42 3HB ALA 42 -6.920 -8.513 -12.992
185 H ILE 43 H ILE 43 -6.835 -5.508 -9.622
186 HA ILE 43 HA ILE 43 -8.608 -6.816 -7.683
187 HB ILE 43 HB ILE 43 -6.625 -4.561 -7.188
188 HG12 ILE 43 2HG1 ILE 43 -6.556 -7.438 -6.234
189 HG13 ILE 43 1HG1 ILE 43 -5.521 -6.757 -7.478
190 HG21 ILE 43 1HG2 ILE 43 -7.223 -4.815 -4.826
191 HG22 ILE 43 2HG2 ILE 43 -8.423 -6.030 -5.261
192 HG23 ILE 43 3HG2 ILE 43 -8.621 -4.363 -5.806
193 HD11 ILE 43 3HD1 ILE 43 -4.534 -5.250 -5.813
194 HD12 ILE 43 1HD1 ILE 43 -4.337 -6.948 -5.370
195 HD13 ILE 43 2HD1 ILE 43 -5.565 -5.964 -4.574
196 HA PRO 44 HA PRO 44 -11.312 -3.628 -9.319
197 HB2 PRO 44 2HB PRO 44 -13.123 -4.474 -7.154
198 HB3 PRO 44 1HB PRO 44 -13.410 -4.446 -8.896
199 HG2 PRO 44 2HG PRO 44 -13.068 -6.749 -7.568
200 HG3 PRO 44 1HG PRO 44 -12.463 -6.521 -9.218
201 HD2 PRO 44 2HD PRO 44 -10.971 -6.447 -6.627
202 HD3 PRO 44 1HD PRO 44 -10.506 -7.152 -8.192
203 H CYS 45 H CYS 45 -11.450 -1.548 -8.728
204 HA CYS 45 HA CYS 45 -10.676 -0.907 -5.992
205 HB2 CYS 45 2HB CYS 45 -10.412 0.743 -8.507
206 HB3 CYS 45 1HB CYS 45 -9.900 1.246 -6.903
207 HA PRO 46 HA PRO 46 -14.698 0.901 -5.314
208 HB2 PRO 46 2HB PRO 46 -13.934 2.735 -3.391
209 HB3 PRO 46 1HB PRO 46 -14.283 1.039 -3.049
210 HG2 PRO 46 2HG PRO 46 -11.660 2.410 -3.409
211 HG3 PRO 46 1HG PRO 46 -12.105 1.118 -2.283
212 HD2 PRO 46 2HD PRO 46 -10.695 0.664 -4.529
213 HD3 PRO 46 1HD PRO 46 -11.829 -0.534 -3.876
214 H ILE 47 H ILE 47 -15.729 3.002 -5.569
215 HA ILE 47 HA ILE 47 -14.224 4.622 -7.463
216 HB ILE 47 HB ILE 47 -16.431 5.728 -7.936
217 HG12 ILE 47 2HG1 ILE 47 -17.484 3.489 -6.186
218 HG13 ILE 47 1HG1 ILE 47 -17.524 5.206 -5.802
219 HG21 ILE 47 1HG2 ILE 47 -15.541 4.003 -9.373
220 HG22 ILE 47 2HG2 ILE 47 -17.291 3.845 -9.250
221 HG23 ILE 47 3HG2 ILE 47 -16.241 2.751 -8.350
222 HD11 ILE 47 3HD1 ILE 47 -19.694 4.415 -6.526
223 HD12 ILE 47 1HD1 ILE 47 -18.997 3.843 -8.042
224 HD13 ILE 47 2HD1 ILE 47 -19.034 5.568 -7.687
225 H THR 48 H THR 48 -14.958 4.669 -4.249
226 HA THR 48 HA THR 48 -15.144 7.496 -3.897
227 HB THR 48 HB THR 48 -14.359 5.348 -1.897
228 HG1 THR 48 1HG THR 48 -16.690 5.819 -3.126
229 HG21 THR 48 3HG2 THR 48 -15.479 8.135 -1.478
230 HG22 THR 48 1HG2 THR 48 -13.815 7.642 -1.159
231 HG23 THR 48 2HG2 THR 48 -15.135 6.958 -0.213
232 H TYR 49 H TYR 49 -13.495 8.913 -3.772
233 HA TYR 49 HA TYR 49 -10.821 7.947 -4.250
234 HB2 TYR 49 2HB TYR 49 -11.719 9.919 -5.503
235 HB3 TYR 49 1HB TYR 49 -11.843 10.792 -3.982
236 HD1 TYR 49 1HD TYR 49 -9.540 9.447 -6.494
237 HD2 TYR 49 2HD TYR 49 -9.851 11.706 -2.909
238 HE1 TYR 49 1HE TYR 49 -7.229 10.214 -6.777
239 HE2 TYR 49 2HE TYR 49 -7.529 12.476 -3.186
240 HH TYR 49 HH TYR 49 -5.871 12.087 -6.094
241 H LEU 50 H LEU 50 -9.551 7.510 -2.633
242 HA LEU 50 HA LEU 50 -9.855 8.950 -0.113
243 HB2 LEU 50 2HB LEU 50 -9.408 5.975 -0.458
244 HB3 LEU 50 1HB LEU 50 -9.293 6.829 1.063
245 HG LEU 50 HG LEU 50 -11.820 6.597 -0.574
246 HD11 LEU 50 1HD1 LEU 50 -12.556 5.033 1.144
247 HD12 LEU 50 2HD1 LEU 50 -10.966 5.116 1.911
248 HD13 LEU 50 3HD1 LEU 50 -11.134 4.431 0.289
249 HD21 LEU 50 3HD2 LEU 50 -11.322 7.617 2.222
250 HD22 LEU 50 1HD2 LEU 50 -12.898 7.428 1.456
251 HD23 LEU 50 2HD2 LEU 50 -11.751 8.601 0.820
252 HA PRO 51 HA PRO 51 -5.645 9.363 -1.708
253 HB2 PRO 51 2HB PRO 51 -4.980 11.426 0.000
254 HB3 PRO 51 1HB PRO 51 -5.691 11.666 -1.591
255 HG2 PRO 51 2HG PRO 51 -6.949 11.761 1.091
256 HG3 PRO 51 1HG PRO 51 -7.344 12.684 -0.368
257 HD2 PRO 51 2HD PRO 51 -8.819 10.573 0.541
258 HD3 PRO 51 1HD PRO 51 -8.740 11.046 -1.167
259 H VAL 52 H VAL 52 -4.340 7.902 -1.002
260 HA VAL 52 HA VAL 52 -3.704 7.888 1.836
261 HB VAL 52 HB VAL 52 -3.339 5.436 1.766
262 HG11 VAL 52 1HG1 VAL 52 -6.155 6.273 1.087
263 HG12 VAL 52 2HG1 VAL 52 -5.418 6.246 2.686
264 HG13 VAL 52 3HG1 VAL 52 -5.699 4.736 1.821
265 HG21 VAL 52 3HG2 VAL 52 -4.633 5.606 -0.957
266 HG22 VAL 52 1HG2 VAL 52 -4.358 4.105 -0.066
267 HG23 VAL 52 2HG2 VAL 52 -2.988 5.078 -0.585
268 H CYS 53 H CYS 53 -1.579 7.435 2.329
269 HA CYS 53 HA CYS 53 0.172 7.891 0.042
270 HB2 CYS 53 2HB CYS 53 0.110 9.762 1.579
271 HB3 CYS 53 1HB CYS 53 0.524 8.735 2.931
272 H GLY 54 H GLY 54 1.604 6.430 -0.419
273 HA2 GLY 54 2HA GLY 54 1.882 4.144 1.335
274 HA3 GLY 54 1HA GLY 54 2.475 4.281 -0.319
275 H SER 55 H SER 55 3.947 3.282 1.815
276 HA SER 55 HA SER 55 5.755 4.877 3.120
277 HB2 SER 55 2HB SER 55 6.474 2.271 1.803
278 HB3 SER 55 1HB SER 55 7.066 2.924 3.327
279 HG SER 55 HG SER 55 5.399 2.179 4.306
280 H ASP 56 H ASP 56 5.610 4.201 -0.258
281 HA ASP 56 HA ASP 56 8.364 4.978 -0.817
282 HB2 ASP 56 2HB ASP 56 7.258 3.059 -1.982
283 HB3 ASP 56 1HB ASP 56 6.126 4.195 -2.698
284 H TYR 57 H TYR 57 5.812 6.668 0.025
285 HA TYR 57 HA TYR 57 5.122 8.742 -0.083
286 HB2 TYR 57 2HB TYR 57 7.751 9.151 -1.472
287 HB3 TYR 57 1HB TYR 57 6.615 10.488 -1.284
288 HD1 TYR 57 1HD TYR 57 5.869 11.127 0.989
289 HD2 TYR 57 2HD TYR 57 9.099 8.445 0.350
290 HE1 TYR 57 1HE TYR 57 6.624 11.510 3.284
291 HE2 TYR 57 2HE TYR 57 9.864 8.820 2.660
292 HH TYR 57 HH TYR 57 9.626 10.643 4.402
293 H ILE 58 H ILE 58 4.426 6.843 -2.070
294 HA ILE 58 HA ILE 58 3.617 8.582 -4.250
295 HB ILE 58 HB ILE 58 3.228 5.588 -3.931
296 HG12 ILE 58 2HG1 ILE 58 5.587 6.129 -4.208
297 HG13 ILE 58 1HG1 ILE 58 4.959 5.374 -5.670
298 HG21 ILE 58 1HG2 ILE 58 2.597 5.609 -6.309
299 HG22 ILE 58 2HG2 ILE 58 2.745 7.366 -6.329
300 HG23 ILE 58 3HG2 ILE 58 1.502 6.597 -5.340
301 HD11 ILE 58 3HD1 ILE 58 4.785 7.607 -6.707
302 HD12 ILE 58 1HD1 ILE 58 6.438 7.195 -6.247
303 HD13 ILE 58 2HD1 ILE 58 5.504 8.304 -5.254
304 H THR 59 H THR 59 1.750 9.555 -4.080
305 HA THR 59 HA THR 59 -0.178 8.739 -2.113
306 HB THR 59 HB THR 59 -0.330 10.937 -4.209
307 HG1 THR 59 1HG THR 59 1.234 10.735 -2.188
308 HG21 THR 59 3HG2 THR 59 -2.070 11.884 -2.713
309 HG22 THR 59 1HG2 THR 59 -1.951 10.451 -1.693
310 HG23 THR 59 2HG2 THR 59 -2.544 10.306 -3.346
311 H TYR 60 H TYR 60 -1.864 7.505 -2.483
312 HA TYR 60 HA TYR 60 -2.391 6.660 -5.232
313 HB2 TYR 60 2HB TYR 60 -2.815 5.242 -2.611
314 HB3 TYR 60 1HB TYR 60 -3.390 4.620 -4.162
315 HD1 TYR 60 2HD TYR 60 -1.691 4.040 -5.920
316 HD2 TYR 60 1HD TYR 60 -0.583 4.950 -1.925
317 HE1 TYR 60 2HE TYR 60 0.489 2.999 -6.301
318 HE2 TYR 60 1HE TYR 60 1.615 3.904 -2.289
319 HH TYR 60 HH TYR 60 2.737 3.021 -5.402
320 H GLY 61 H GLY 61 -4.521 6.415 -5.909
321 HA2 GLY 61 2HA GLY 61 -6.291 8.422 -5.035
322 HA3 GLY 61 1HA GLY 61 -6.631 7.176 -6.232
323 H ASN 62 H ASN 62 -5.948 5.102 -4.140
324 HA ASN 62 HA ASN 62 -7.508 5.370 -1.910
325 HB2 ASN 62 2HB ASN 62 -9.522 4.020 -2.327
326 HB3 ASN 62 1HB ASN 62 -9.502 5.429 -3.359
327 HD21 ASN 62 1HD2 ASN 62 -10.829 4.655 -4.857
328 HD22 ASN 62 2HD2 ASN 62 -10.503 3.356 -5.924
329 H GLU 63 H GLU 63 -8.216 3.214 -1.050
330 HA GLU 63 HA GLU 63 -6.171 1.758 -0.079
331 HB2 GLU 63 2HB GLU 63 -8.848 0.585 -0.729
332 HB3 GLU 63 1HB GLU 63 -7.759 0.110 0.560
333 HG2 GLU 63 2HG GLU 63 -8.129 2.239 1.670
334 HG3 GLU 63 1HG GLU 63 -9.203 2.745 0.366
335 H CYS 64 H CYS 64 -8.134 0.898 -2.866
336 HA CYS 64 HA CYS 64 -7.182 -1.660 -3.362
337 HB2 CYS 64 2HB CYS 64 -9.191 -0.909 -4.348
338 HB3 CYS 64 1HB CYS 64 -8.381 0.421 -5.162
339 H HIS 65 H HIS 65 -6.050 1.437 -4.571
340 HA HIS 65 HA HIS 65 -4.178 0.263 -6.390
341 HB2 HIS 65 2HB HIS 65 -4.389 3.120 -5.403
342 HB3 HIS 65 1HB HIS 65 -3.350 2.600 -6.721
343 HD1 HIS 65 1HD HIS 65 -4.666 1.695 -8.920
344 HD2 HIS 65 2HD HIS 65 -6.941 3.685 -6.079
345 HE1 HIS 65 1HE HIS 65 -6.822 2.228 -10.045
346 HE2 HIS 65 2HE HIS 65 -8.087 3.630 -8.373
347 H LEU 66 H LEU 66 -4.021 1.663 -3.189
348 HA LEU 66 HA LEU 66 -1.240 1.513 -2.804
349 HB2 LEU 66 2HB LEU 66 -2.711 2.795 -1.323
350 HB3 LEU 66 1HB LEU 66 -3.530 1.332 -0.852
351 HG LEU 66 HG LEU 66 -1.532 0.522 0.312
352 HD11 LEU 66 1HD1 LEU 66 -0.292 3.152 -0.471
353 HD12 LEU 66 2HD1 LEU 66 0.199 1.556 -1.038
354 HD13 LEU 66 3HD1 LEU 66 0.391 1.986 0.662
355 HD21 LEU 66 3HD2 LEU 66 -3.179 1.866 1.516
356 HD22 LEU 66 1HD2 LEU 66 -2.289 3.329 1.103
357 HD23 LEU 66 2HD2 LEU 66 -1.551 2.113 2.149
358 H CYS 67 H CYS 67 -3.854 -0.740 -2.051
359 HA CYS 67 HA CYS 67 -2.266 -2.740 -0.917
360 HB2 CYS 67 2HB CYS 67 -4.692 -2.612 -0.575
361 HB3 CYS 67 1HB CYS 67 -4.959 -2.959 -2.279
362 H THR 68 H THR 68 -3.287 -2.206 -4.302
363 HA THR 68 HA THR 68 -2.371 -4.615 -5.390
364 HB THR 68 HB THR 68 -2.361 -1.885 -6.737
365 HG1 THR 68 1HG THR 68 -4.457 -2.803 -5.877
366 HG21 THR 68 3HG2 THR 68 -2.502 -3.173 -8.837
367 HG22 THR 68 1HG2 THR 68 -2.353 -4.672 -7.920
368 HG23 THR 68 2HG2 THR 68 -1.015 -3.521 -7.956
369 H GLU 69 H GLU 69 -0.641 -1.499 -5.080
370 HA GLU 69 HA GLU 69 1.776 -2.452 -6.151
371 HB2 GLU 69 2HB GLU 69 1.138 -0.062 -4.450
372 HB3 GLU 69 1HB GLU 69 2.701 -0.365 -5.189
373 HG2 GLU 69 2HG GLU 69 0.115 -0.056 -6.665
374 HG3 GLU 69 1HG GLU 69 1.322 1.204 -6.452
375 H SER 70 H SER 70 0.472 -2.254 -2.912
376 HA SER 70 HA SER 70 2.822 -2.711 -1.475
377 HB2 SER 70 2HB SER 70 0.548 -1.986 -0.564
378 HB3 SER 70 1HB SER 70 0.069 -3.680 -0.679
379 HG SER 70 HG SER 70 2.215 -2.597 0.757
380 H LEU 71 H LEU 71 0.400 -4.927 -2.763
381 HA LEU 71 HA LEU 71 1.654 -7.301 -1.881
382 HB2 LEU 71 2HB LEU 71 -0.285 -6.851 -4.145
383 HB3 LEU 71 1HB LEU 71 0.104 -8.405 -3.430
384 HG LEU 71 HG LEU 71 -1.225 -6.130 -1.961
385 HD11 LEU 71 1HD1 LEU 71 -2.704 -6.959 -3.653
386 HD12 LEU 71 2HD1 LEU 71 -3.242 -7.535 -2.068
387 HD13 LEU 71 3HD1 LEU 71 -2.376 -8.617 -3.159
388 HD21 LEU 71 3HD2 LEU 71 -0.757 -9.002 -1.184
389 HD22 LEU 71 1HD2 LEU 71 -1.700 -7.828 -0.265
390 HD23 LEU 71 2HD2 LEU 71 0.031 -7.585 -0.487
391 H LYS 72 H LYS 72 1.635 -5.529 -4.925
392 HA LYS 72 HA LYS 72 3.146 -7.179 -6.544
393 HB2 LYS 72 2HB LYS 72 2.024 -5.248 -7.436
394 HB3 LYS 72 1HB LYS 72 2.962 -4.175 -6.418
395 HG2 LYS 72 2HG LYS 72 4.989 -4.776 -7.682
396 HG3 LYS 72 1HG LYS 72 4.001 -5.788 -8.742
397 HD2 LYS 72 2HD LYS 72 2.734 -3.879 -9.470
398 HD3 LYS 72 1HD LYS 72 3.554 -2.840 -8.303
399 HE2 LYS 72 2HE LYS 72 5.676 -3.211 -9.465
400 HE3 LYS 72 1HE LYS 72 4.856 -4.253 -10.628
401 HZ1 LYS 72 3HZ LYS 72 4.239 -1.374 -10.207
402 HZ2 LYS 72 1HZ LYS 72 3.541 -2.398 -11.348
403 HZ3 LYS 72 2HZ LYS 72 5.166 -1.993 -11.478
404 H SER 73 H SER 73 4.341 -4.452 -4.595
405 HA SER 73 HA SER 73 7.055 -5.299 -5.063
406 HB2 SER 73 2HB SER 73 6.004 -2.913 -3.536
407 HB3 SER 73 1HB SER 73 7.648 -3.176 -4.108
408 HG SER 73 HG SER 73 6.770 -3.319 -6.236
409 H ASN 74 H ASN 74 5.229 -6.885 -3.360
410 HA ASN 74 HA ASN 74 5.198 -8.148 -1.517
411 HB2 ASN 74 2HB ASN 74 7.242 -9.228 -0.869
412 HB3 ASN 74 1HB ASN 74 7.273 -8.917 -2.598
413 HD21 ASN 74 1HD2 ASN 74 8.866 -7.585 -3.425
414 HD22 ASN 74 2HD2 ASN 74 10.169 -6.985 -2.477
415 H GLY 75 H GLY 75 5.112 -5.291 -0.926
416 HA2 GLY 75 2HA GLY 75 4.485 -4.518 1.281
417 HA3 GLY 75 1HA GLY 75 5.712 -5.579 1.946
418 H ARG 76 H ARG 76 7.022 -4.051 -0.694
419 HA ARG 76 HA ARG 76 8.782 -2.384 0.705
420 HB2 ARG 76 2HB ARG 76 9.058 -3.127 -1.686
421 HB3 ARG 76 1HB ARG 76 7.785 -2.008 -2.111
422 HG2 ARG 76 2HG ARG 76 9.117 -0.142 -1.265
423 HG3 ARG 76 1HG ARG 76 10.433 -1.255 -0.919
424 HD2 ARG 76 2HD ARG 76 10.572 -1.826 -3.293
425 HD3 ARG 76 1HD ARG 76 9.230 -0.728 -3.629
426 HE ARG 76 HE ARG 76 11.700 0.205 -2.391
427 HH11 ARG 76 1HH1 ARG 76 9.440 0.364 -5.134
428 HH12 ARG 76 2HH1 ARG 76 9.985 1.880 -5.664
429 HH21 ARG 76 1HH2 ARG 76 12.489 2.249 -3.170
430 HH22 ARG 76 2HH2 ARG 76 11.798 2.975 -4.533
431 H VAL 77 H VAL 77 5.803 -1.656 -0.975
432 HA VAL 77 HA VAL 77 5.725 0.911 0.386
433 HB VAL 77 HB VAL 77 5.703 1.246 -2.024
434 HG11 VAL 77 1HG1 VAL 77 3.322 -0.593 -2.149
435 HG12 VAL 77 2HG1 VAL 77 4.934 -0.912 -2.788
436 HG13 VAL 77 3HG1 VAL 77 3.943 0.368 -3.488
437 HG21 VAL 77 3HG2 VAL 77 3.578 2.451 -2.335
438 HG22 VAL 77 1HG2 VAL 77 4.307 2.774 -0.758
439 HG23 VAL 77 2HG2 VAL 77 2.942 1.662 -0.891
440 H GLN 78 H GLN 78 4.403 1.029 2.041
441 HA GLN 78 HA GLN 78 1.991 -0.618 2.059
442 HB2 GLN 78 2HB GLN 78 3.848 -0.031 4.378
443 HB3 GLN 78 1HB GLN 78 2.330 -0.902 4.486
444 HG2 GLN 78 2HG GLN 78 3.250 -2.645 3.027
445 HG3 GLN 78 1HG GLN 78 4.773 -1.767 2.969
446 HE21 GLN 78 1HE2 GLN 78 5.939 -3.354 3.871
447 HE22 GLN 78 2HE2 GLN 78 5.801 -3.879 5.504
448 H PHE 79 H PHE 79 0.673 0.334 4.079
449 HA PHE 79 HA PHE 79 -0.016 2.993 3.447
450 HB2 PHE 79 2HB PHE 79 -1.598 1.415 4.380
451 HB3 PHE 79 1HB PHE 79 -0.643 1.251 5.845
452 HD1 PHE 79 2HD PHE 79 -2.933 3.385 3.950
453 HD2 PHE 79 1HD PHE 79 -0.761 2.937 7.580
454 HE1 PHE 79 2HE PHE 79 -4.273 5.172 4.977
455 HE2 PHE 79 1HE PHE 79 -2.098 4.716 8.609
456 HZ PHE 79 HZ PHE 79 -3.852 5.834 7.311
457 H LEU 80 H LEU 80 1.323 4.639 3.840
458 HA LEU 80 HA LEU 80 3.163 4.563 6.083
459 HB2 LEU 80 2HB LEU 80 3.851 5.440 3.857
460 HB3 LEU 80 1HB LEU 80 2.658 6.703 4.007
461 HG LEU 80 HG LEU 80 3.894 7.552 6.009
462 HD11 LEU 80 1HD1 LEU 80 5.069 5.509 6.621
463 HD12 LEU 80 2HD1 LEU 80 6.193 6.842 6.336
464 HD13 LEU 80 3HD1 LEU 80 5.989 5.594 5.114
465 HD21 LEU 80 3HD2 LEU 80 5.419 7.416 3.413
466 HD22 LEU 80 1HD2 LEU 80 5.672 8.597 4.703
467 HD23 LEU 80 2HD2 LEU 80 4.144 8.568 3.824
468 H HIS 81 H HIS 81 0.609 6.651 4.810
469 HA HIS 81 HA HIS 81 -0.597 6.950 7.333
470 HB2 HIS 81 2HB HIS 81 -0.397 9.409 7.564
471 HB3 HIS 81 1HB HIS 81 1.174 8.643 7.673
472 HD1 HIS 81 1HD HIS 81 -0.900 10.860 5.390
473 HD2 HIS 81 2HD HIS 81 3.003 9.472 5.785
474 HE1 HIS 81 1HE HIS 81 0.488 12.159 3.721
475 HE2 HIS 81 2HE HIS 81 2.828 11.568 4.340
476 H ASP 82 H ASP 82 -2.584 8.226 7.105
477 HA ASP 82 HA ASP 82 -3.683 7.787 4.481
478 HB2 ASP 82 2HB ASP 82 -5.829 8.421 5.392
479 HB3 ASP 82 1HB ASP 82 -5.055 7.370 6.565
480 H GLY 83 H GLY 83 -4.753 9.466 3.299
481 HA2 GLY 83 2HA GLY 83 -5.091 11.660 2.722
482 HA3 GLY 83 1HA GLY 83 -3.902 12.166 3.927
483 H SER 84 H SER 84 -3.551 13.351 1.673
484 HA SER 84 HA SER 84 -2.001 11.954 -0.242
485 HB2 SER 84 2HB SER 84 -2.215 14.897 0.399
486 HB3 SER 84 1HB SER 84 -1.582 14.208 -1.109
487 HG SER 84 HG SER 84 -4.091 13.371 -0.297
488 H CYS 85 H CYS 85 0.345 12.157 -0.523
489 HA CYS 85 HA CYS 85 1.739 11.903 1.906
490 HB2 CYS 85 2HB CYS 85 2.850 12.274 -0.888
491 HB3 CYS 85 1HB CYS 85 3.743 11.783 0.553
Start of MODEL 14
1 H1 SER 20 1HT SER 20 -16.803 -6.773 2.530
2 H2 SER 20 2HT SER 20 -15.857 -5.739 1.557
3 H3 SER 20 3HT SER 20 -17.207 -5.158 2.366
4 HA SER 20 HA SER 20 -14.828 -6.193 3.718
5 HB2 SER 20 2HB SER 20 -15.765 -3.336 3.363
6 HB3 SER 20 1HB SER 20 -14.263 -3.883 4.115
7 HG SER 20 HG SER 20 -13.930 -3.171 2.006
8 H GLU 21 H GLU 21 -15.779 -7.164 5.481
9 HA GLU 21 HA GLU 21 -18.300 -6.267 6.496
10 HB2 GLU 21 2HB GLU 21 -16.374 -8.248 7.705
11 HB3 GLU 21 1HB GLU 21 -18.056 -8.025 8.153
12 HG2 GLU 21 2HG GLU 21 -17.007 -9.041 5.543
13 HG3 GLU 21 1HG GLU 21 -17.790 -10.002 6.796
14 H ALA 22 H ALA 22 -18.678 -4.970 8.096
15 HA ALA 22 HA ALA 22 -18.492 -3.497 9.743
16 HB1 ALA 22 1HB ALA 22 -17.240 -4.101 11.712
17 HB2 ALA 22 2HB ALA 22 -16.287 -5.265 10.790
18 HB3 ALA 22 3HB ALA 22 -18.010 -5.538 11.037
19 H ALA 23 H ALA 23 -17.815 -1.950 8.223
20 HA ALA 23 HA ALA 23 -15.042 -1.207 8.159
21 HB1 ALA 23 1HB ALA 23 -17.504 0.309 7.247
22 HB2 ALA 23 2HB ALA 23 -16.508 -0.735 6.235
23 HB3 ALA 23 3HB ALA 23 -15.832 0.755 6.890
24 H SER 24 H SER 24 -14.311 -0.703 10.113
25 HA SER 24 HA SER 24 -15.696 1.400 11.627
26 HB2 SER 24 2HB SER 24 -14.334 -1.012 12.838
27 HB3 SER 24 1HB SER 24 -15.308 0.197 13.669
28 HG SER 24 HG SER 24 -17.085 -0.526 12.370
29 H LEU 25 H LEU 25 -14.252 2.738 12.803
30 HA LEU 25 HA LEU 25 -11.591 2.826 11.760
31 HB2 LEU 25 2HB LEU 25 -12.940 4.512 13.879
32 HB3 LEU 25 1HB LEU 25 -11.291 4.745 13.351
33 HG LEU 25 HG LEU 25 -12.193 5.220 11.045
34 HD11 LEU 25 1HD1 LEU 25 -14.825 5.385 12.488
35 HD12 LEU 25 2HD1 LEU 25 -14.376 4.192 11.268
36 HD13 LEU 25 3HD1 LEU 25 -14.499 5.896 10.831
37 HD21 LEU 25 3HD2 LEU 25 -12.853 7.505 11.610
38 HD22 LEU 25 1HD2 LEU 25 -11.440 6.970 12.520
39 HD23 LEU 25 2HD2 LEU 25 -13.024 7.018 13.298
40 H SER 26 H SER 26 -9.802 2.072 12.744
41 HA SER 26 HA SER 26 -9.778 1.317 15.540
42 HB2 SER 26 2HB SER 26 -9.564 -0.800 13.364
43 HB3 SER 26 1HB SER 26 -9.343 -1.063 15.091
44 HG SER 26 HG SER 26 -11.693 0.132 14.642
45 HA PRO 27 HA PRO 27 -5.334 1.913 14.709
46 HB2 PRO 27 2HB PRO 27 -4.797 -0.159 16.734
47 HB3 PRO 27 1HB PRO 27 -4.374 1.555 16.744
48 HG2 PRO 27 2HG PRO 27 -6.266 0.543 18.378
49 HG3 PRO 27 1HG PRO 27 -6.368 2.181 17.712
50 HD2 PRO 27 2HD PRO 27 -7.834 -0.297 16.855
51 HD3 PRO 27 1HD PRO 27 -8.381 1.379 16.980
52 H LYS 28 H LYS 28 -6.658 0.133 13.100
53 HA LYS 28 HA LYS 28 -5.236 -2.413 12.889
54 HB2 LYS 28 2HB LYS 28 -7.673 -2.411 12.759
55 HB3 LYS 28 1HB LYS 28 -7.631 -1.197 11.498
56 HG2 LYS 28 2HG LYS 28 -6.544 -2.866 10.010
57 HG3 LYS 28 1HG LYS 28 -6.747 -4.069 11.286
58 HD2 LYS 28 2HD LYS 28 -9.141 -3.809 11.224
59 HD3 LYS 28 1HD LYS 28 -9.008 -2.485 10.074
60 HE2 LYS 28 2HE LYS 28 -8.025 -4.052 8.425
61 HE3 LYS 28 1HE LYS 28 -8.242 -5.369 9.575
62 HZ1 LYS 28 3HZ LYS 28 -9.988 -5.195 7.861
63 HZ2 LYS 28 1HZ LYS 28 -10.465 -3.720 8.496
64 HZ3 LYS 28 2HZ LYS 28 -10.609 -5.148 9.415
65 H LYS 29 H LYS 29 -4.002 -2.875 11.014
66 HA LYS 29 HA LYS 29 -2.991 -0.639 9.566
67 HB2 LYS 29 2HB LYS 29 -1.513 -2.533 10.103
68 HB3 LYS 29 1HB LYS 29 -2.570 -3.626 9.238
69 HG2 LYS 29 2HG LYS 29 -2.002 -2.555 7.124
70 HG3 LYS 29 1HG LYS 29 -0.991 -1.391 7.972
71 HD2 LYS 29 2HD LYS 29 -0.473 -4.348 8.170
72 HD3 LYS 29 1HD LYS 29 0.134 -3.413 6.816
73 HE2 LYS 29 2HE LYS 29 1.851 -3.664 8.541
74 HE3 LYS 29 1HE LYS 29 1.395 -1.982 8.343
75 HZ1 LYS 29 3HZ LYS 29 1.694 -2.666 10.643
76 HZ2 LYS 29 1HZ LYS 29 0.423 -3.752 10.532
77 HZ3 LYS 29 2HZ LYS 29 0.160 -2.080 10.389
78 H VAL 30 H VAL 30 -3.281 -0.343 7.334
79 HA VAL 30 HA VAL 30 -5.774 -0.331 6.286
80 HB VAL 30 HB VAL 30 -3.901 0.879 5.262
81 HG11 VAL 30 1HG1 VAL 30 -3.001 -1.786 4.191
82 HG12 VAL 30 2HG1 VAL 30 -2.151 -0.771 5.356
83 HG13 VAL 30 3HG1 VAL 30 -2.357 -0.224 3.690
84 HG21 VAL 30 3HG2 VAL 30 -4.493 0.589 2.894
85 HG22 VAL 30 1HG2 VAL 30 -5.915 0.611 3.937
86 HG23 VAL 30 2HG2 VAL 30 -5.313 -0.920 3.298
87 H ASP 31 H ASP 31 -7.206 -1.706 5.410
88 HA ASP 31 HA ASP 31 -6.580 -4.491 5.604
89 HB2 ASP 31 2HB ASP 31 -8.845 -3.425 6.202
90 HB3 ASP 31 1HB ASP 31 -9.139 -3.363 4.468
91 H CYS 32 H CYS 32 -5.116 -4.896 4.126
92 HA CYS 32 HA CYS 32 -5.722 -4.523 1.301
93 HB2 CYS 32 2HB CYS 32 -3.425 -4.099 2.199
94 HB3 CYS 32 1HB CYS 32 -3.337 -5.772 2.710
95 H SER 33 H SER 33 -6.186 -6.720 3.827
96 HA SER 33 HA SER 33 -5.895 -9.170 2.572
97 HB2 SER 33 2HB SER 33 -7.643 -9.627 4.584
98 HB3 SER 33 1HB SER 33 -5.899 -9.476 4.798
99 HG SER 33 HG SER 33 -7.783 -7.329 4.974
100 H ILE 34 H ILE 34 -8.676 -6.990 2.749
101 HA ILE 34 HA ILE 34 -10.534 -8.773 1.622
102 HB ILE 34 HB ILE 34 -11.792 -6.690 0.921
103 HG12 ILE 34 2HG1 ILE 34 -9.474 -5.320 2.322
104 HG13 ILE 34 1HG1 ILE 34 -9.867 -5.196 0.617
105 HG21 ILE 34 1HG2 ILE 34 -10.947 -6.930 3.799
106 HG22 ILE 34 2HG2 ILE 34 -12.264 -7.802 3.010
107 HG23 ILE 34 3HG2 ILE 34 -12.364 -6.055 3.222
108 HD11 ILE 34 3HD1 ILE 34 -11.940 -4.039 1.186
109 HD12 ILE 34 1HD1 ILE 34 -10.531 -3.211 1.845
110 HD13 ILE 34 2HD1 ILE 34 -11.553 -4.190 2.899
111 H TYR 35 H TYR 35 -8.073 -6.806 0.132
112 HA TYR 35 HA TYR 35 -9.193 -7.259 -2.490
113 HB2 TYR 35 2HB TYR 35 -6.701 -5.767 -1.656
114 HB3 TYR 35 1HB TYR 35 -7.280 -5.891 -3.312
115 HD1 TYR 35 1HD TYR 35 -9.665 -5.011 -3.784
116 HD2 TYR 35 2HD TYR 35 -7.467 -4.025 -0.283
117 HE1 TYR 35 1HE TYR 35 -11.098 -3.044 -3.449
118 HE2 TYR 35 2HE TYR 35 -8.903 -2.067 0.069
119 HH TYR 35 HH TYR 35 -10.336 -0.540 -1.290
120 H LYS 36 H LYS 36 -7.001 -8.723 -0.403
121 HA LYS 36 HA LYS 36 -5.316 -10.057 -2.237
122 HB2 LYS 36 2HB LYS 36 -6.097 -10.820 0.582
123 HB3 LYS 36 1HB LYS 36 -4.897 -11.682 -0.361
124 HG2 LYS 36 2HG LYS 36 -3.576 -9.620 -0.517
125 HG3 LYS 36 1HG LYS 36 -4.759 -8.809 0.510
126 HD2 LYS 36 2HD LYS 36 -4.283 -10.444 2.308
127 HD3 LYS 36 1HD LYS 36 -3.089 -11.213 1.261
128 HE2 LYS 36 2HE LYS 36 -1.835 -9.111 1.163
129 HE3 LYS 36 1HE LYS 36 -3.013 -8.364 2.236
130 HZ1 LYS 36 3HZ LYS 36 -1.256 -10.655 2.904
131 HZ2 LYS 36 1HZ LYS 36 -2.365 -9.927 3.969
132 HZ3 LYS 36 2HZ LYS 36 -1.038 -9.058 3.378
133 H LYS 37 H LYS 37 -8.544 -10.444 -1.542
134 HA LYS 37 HA LYS 37 -8.866 -13.241 -2.065
135 HB2 LYS 37 2HB LYS 37 -10.858 -10.977 -2.209
136 HB3 LYS 37 1HB LYS 37 -11.243 -12.693 -2.244
137 HG2 LYS 37 2HG LYS 37 -10.458 -12.969 0.017
138 HG3 LYS 37 1HG LYS 37 -9.889 -11.301 0.057
139 HD2 LYS 37 2HD LYS 37 -12.022 -11.510 1.228
140 HD3 LYS 37 1HD LYS 37 -12.198 -10.507 -0.209
141 HE2 LYS 37 2HE LYS 37 -13.119 -12.427 -1.425
142 HE3 LYS 37 1HE LYS 37 -12.967 -13.422 0.025
143 HZ1 LYS 37 3HZ LYS 37 -14.490 -11.847 1.124
144 HZ2 LYS 37 1HZ LYS 37 -15.207 -12.606 -0.198
145 HZ3 LYS 37 2HZ LYS 37 -14.672 -11.021 -0.326
146 H TYR 38 H TYR 38 -8.145 -10.598 -4.051
147 HA TYR 38 HA TYR 38 -9.344 -11.884 -6.409
148 HB2 TYR 38 2HB TYR 38 -8.426 -9.014 -6.134
149 HB3 TYR 38 1HB TYR 38 -9.367 -9.702 -7.450
150 HD1 TYR 38 2HD TYR 38 -11.726 -10.647 -6.763
151 HD2 TYR 38 1HD TYR 38 -9.467 -7.904 -4.441
152 HE1 TYR 38 2HE TYR 38 -13.772 -9.968 -5.574
153 HE2 TYR 38 1HE TYR 38 -11.481 -7.215 -3.253
154 HH TYR 38 HH TYR 38 -13.901 -7.222 -3.567
155 HA PRO 39 HA PRO 39 -5.140 -12.564 -7.846
156 HB2 PRO 39 2HB PRO 39 -5.497 -11.944 -10.532
157 HB3 PRO 39 1HB PRO 39 -5.854 -13.524 -9.830
158 HG2 PRO 39 2HG PRO 39 -7.700 -11.265 -10.461
159 HG3 PRO 39 1HG PRO 39 -7.957 -13.010 -10.650
160 HD2 PRO 39 2HD PRO 39 -9.042 -11.624 -8.625
161 HD3 PRO 39 1HD PRO 39 -8.474 -13.292 -8.410
162 H VAL 40 H VAL 40 -3.375 -11.225 -8.065
163 HA VAL 40 HA VAL 40 -3.720 -8.554 -7.369
164 HB VAL 40 HB VAL 40 -1.202 -9.814 -8.505
165 HG11 VAL 40 1HG1 VAL 40 -1.552 -7.347 -6.809
166 HG12 VAL 40 2HG1 VAL 40 -1.064 -7.384 -8.502
167 HG13 VAL 40 3HG1 VAL 40 -0.012 -8.072 -7.264
168 HG21 VAL 40 3HG2 VAL 40 -2.146 -9.547 -5.658
169 HG22 VAL 40 1HG2 VAL 40 -0.572 -10.161 -6.160
170 HG23 VAL 40 2HG2 VAL 40 -2.039 -11.042 -6.585
171 H VAL 41 H VAL 41 -3.370 -9.946 -10.545
172 HA VAL 41 HA VAL 41 -2.898 -7.425 -11.782
173 HB VAL 41 HB VAL 41 -2.144 -9.525 -12.829
174 HG11 VAL 41 1HG1 VAL 41 -5.056 -10.095 -13.312
175 HG12 VAL 41 2HG1 VAL 41 -3.959 -11.003 -12.271
176 HG13 VAL 41 3HG1 VAL 41 -3.710 -10.989 -14.017
177 HG21 VAL 41 3HG2 VAL 41 -2.384 -7.581 -14.253
178 HG22 VAL 41 1HG2 VAL 41 -4.086 -7.965 -14.518
179 HG23 VAL 41 2HG2 VAL 41 -2.834 -9.037 -15.145
180 H ALA 42 H ALA 42 -5.815 -9.125 -10.816
181 HA ALA 42 HA ALA 42 -7.349 -6.969 -12.046
182 HB1 ALA 42 1HB ALA 42 -9.184 -8.488 -12.547
183 HB2 ALA 42 2HB ALA 42 -8.262 -9.844 -11.901
184 HB3 ALA 42 3HB ALA 42 -7.707 -9.015 -13.354
185 H ILE 43 H ILE 43 -7.543 -5.799 -10.208
186 HA ILE 43 HA ILE 43 -9.082 -7.058 -8.051
187 HB ILE 43 HB ILE 43 -6.982 -4.877 -7.696
188 HG12 ILE 43 2HG1 ILE 43 -6.894 -7.783 -6.822
189 HG13 ILE 43 1HG1 ILE 43 -5.926 -7.066 -8.101
190 HG21 ILE 43 1HG2 ILE 43 -8.837 -4.639 -6.160
191 HG22 ILE 43 2HG2 ILE 43 -7.378 -5.143 -5.307
192 HG23 ILE 43 3HG2 ILE 43 -8.649 -6.317 -5.647
193 HD11 ILE 43 3HD1 ILE 43 -5.798 -6.305 -5.196
194 HD12 ILE 43 1HD1 ILE 43 -4.778 -5.672 -6.483
195 HD13 ILE 43 2HD1 ILE 43 -4.665 -7.373 -6.014
196 HA PRO 44 HA PRO 44 -11.706 -3.654 -9.335
197 HB2 PRO 44 2HB PRO 44 -13.687 -4.059 -7.516
198 HB3 PRO 44 1HB PRO 44 -13.542 -5.027 -8.991
199 HG2 PRO 44 2HG PRO 44 -12.691 -5.675 -6.201
200 HG3 PRO 44 1HG PRO 44 -13.481 -6.716 -7.399
201 HD2 PRO 44 2HD PRO 44 -10.828 -6.818 -6.892
202 HD3 PRO 44 1HD PRO 44 -11.502 -7.155 -8.499
203 H CYS 45 H CYS 45 -11.590 -1.611 -8.660
204 HA CYS 45 HA CYS 45 -10.891 -1.116 -5.874
205 HB2 CYS 45 2HB CYS 45 -10.047 0.362 -8.378
206 HB3 CYS 45 1HB CYS 45 -9.748 0.980 -6.765
207 HA PRO 46 HA PRO 46 -14.700 1.061 -5.624
208 HB2 PRO 46 2HB PRO 46 -13.969 2.945 -3.740
209 HB3 PRO 46 1HB PRO 46 -14.549 1.321 -3.384
210 HG2 PRO 46 2HG PRO 46 -11.760 2.376 -3.443
211 HG3 PRO 46 1HG PRO 46 -12.472 1.156 -2.375
212 HD2 PRO 46 2HD PRO 46 -10.854 0.528 -4.444
213 HD3 PRO 46 1HD PRO 46 -12.170 -0.537 -3.907
214 H ILE 47 H ILE 47 -15.632 2.944 -6.331
215 HA ILE 47 HA ILE 47 -13.993 4.573 -8.034
216 HB ILE 47 HB ILE 47 -16.047 5.801 -8.609
217 HG12 ILE 47 2HG1 ILE 47 -17.463 3.973 -6.640
218 HG13 ILE 47 1HG1 ILE 47 -17.125 5.676 -6.359
219 HG21 ILE 47 1HG2 ILE 47 -16.350 2.802 -8.643
220 HG22 ILE 47 2HG2 ILE 47 -15.529 3.793 -9.849
221 HG23 ILE 47 3HG2 ILE 47 -17.276 3.920 -9.639
222 HD11 ILE 47 3HD1 ILE 47 -18.901 4.550 -8.517
223 HD12 ILE 47 1HD1 ILE 47 -18.558 6.259 -8.256
224 HD13 ILE 47 2HD1 ILE 47 -19.428 5.335 -7.030
225 H THR 48 H THR 48 -14.863 4.637 -4.821
226 HA THR 48 HA THR 48 -14.923 7.382 -4.264
227 HB THR 48 HB THR 48 -13.946 5.219 -2.403
228 HG1 THR 48 1HG THR 48 -16.628 5.790 -3.183
229 HG21 THR 48 3HG2 THR 48 -14.027 7.562 -1.599
230 HG22 THR 48 1HG2 THR 48 -15.188 6.542 -0.747
231 HG23 THR 48 2HG2 THR 48 -15.739 7.634 -2.019
232 H TYR 49 H TYR 49 -13.216 8.733 -3.896
233 HA TYR 49 HA TYR 49 -10.537 7.679 -4.336
234 HB2 TYR 49 2HB TYR 49 -11.417 9.562 -5.765
235 HB3 TYR 49 1HB TYR 49 -11.500 10.548 -4.313
236 HD1 TYR 49 2HD TYR 49 -9.236 8.862 -6.673
237 HD2 TYR 49 1HD TYR 49 -9.522 11.574 -3.414
238 HE1 TYR 49 2HE TYR 49 -6.914 9.569 -7.067
239 HE2 TYR 49 1HE TYR 49 -7.203 12.285 -3.795
240 HH TYR 49 HH TYR 49 -5.244 11.620 -4.816
241 H LEU 50 H LEU 50 -9.498 7.218 -2.548
242 HA LEU 50 HA LEU 50 -9.873 8.943 -0.211
243 HB2 LEU 50 2HB LEU 50 -9.108 6.001 -0.190
244 HB3 LEU 50 1HB LEU 50 -9.207 7.030 1.213
245 HG LEU 50 HG LEU 50 -11.719 7.217 0.671
246 HD11 LEU 50 1HD1 LEU 50 -12.678 5.342 -0.541
247 HD12 LEU 50 2HD1 LEU 50 -11.062 4.783 -0.971
248 HD13 LEU 50 3HD1 LEU 50 -11.655 6.328 -1.587
249 HD21 LEU 50 3HD2 LEU 50 -10.545 4.580 1.531
250 HD22 LEU 50 1HD2 LEU 50 -12.196 5.123 1.829
251 HD23 LEU 50 2HD2 LEU 50 -10.842 5.980 2.563
252 HA PRO 51 HA PRO 51 -5.600 9.500 -1.730
253 HB2 PRO 51 2HB PRO 51 -5.102 11.621 -0.014
254 HB3 PRO 51 1HB PRO 51 -5.732 11.800 -1.653
255 HG2 PRO 51 2HG PRO 51 -7.171 11.827 0.954
256 HG3 PRO 51 1HG PRO 51 -7.470 12.784 -0.507
257 HD2 PRO 51 2HD PRO 51 -8.999 10.687 0.167
258 HD3 PRO 51 1HD PRO 51 -8.655 11.080 -1.530
259 H VAL 52 H VAL 52 -4.267 8.085 -0.944
260 HA VAL 52 HA VAL 52 -3.681 8.149 1.908
261 HB VAL 52 HB VAL 52 -3.290 5.709 1.941
262 HG11 VAL 52 1HG1 VAL 52 -5.449 6.492 2.669
263 HG12 VAL 52 2HG1 VAL 52 -5.605 4.926 1.873
264 HG13 VAL 52 3HG1 VAL 52 -6.068 6.401 1.023
265 HG21 VAL 52 3HG2 VAL 52 -4.413 5.714 -0.862
266 HG22 VAL 52 1HG2 VAL 52 -4.093 4.271 0.108
267 HG23 VAL 52 2HG2 VAL 52 -2.760 5.316 -0.376
268 H CYS 53 H CYS 53 -1.544 7.775 2.410
269 HA CYS 53 HA CYS 53 0.207 8.109 0.107
270 HB2 CYS 53 2HB CYS 53 0.231 10.028 1.532
271 HB3 CYS 53 1HB CYS 53 0.532 9.108 2.972
272 H GLY 54 H GLY 54 1.577 6.570 -0.319
273 HA2 GLY 54 2HA GLY 54 1.828 4.363 1.580
274 HA3 GLY 54 1HA GLY 54 2.293 4.334 -0.113
275 H SER 55 H SER 55 3.901 3.446 1.960
276 HA SER 55 HA SER 55 5.807 5.077 3.024
277 HB2 SER 55 2HB SER 55 6.262 2.351 1.832
278 HB3 SER 55 1HB SER 55 7.195 3.090 3.129
279 HG SER 55 HG SER 55 5.626 2.777 4.491
280 H ASP 56 H ASP 56 5.426 4.209 -0.301
281 HA ASP 56 HA ASP 56 8.135 4.698 -1.146
282 HB2 ASP 56 2HB ASP 56 6.525 3.048 -2.216
283 HB3 ASP 56 1HB ASP 56 5.663 4.426 -2.877
284 H TYR 57 H TYR 57 5.730 6.662 -0.178
285 HA TYR 57 HA TYR 57 5.354 8.835 -0.113
286 HB2 TYR 57 2HB TYR 57 7.807 9.204 -1.866
287 HB3 TYR 57 1HB TYR 57 6.984 10.478 -0.968
288 HD1 TYR 57 2HD TYR 57 6.634 9.732 1.655
289 HD2 TYR 57 1HD TYR 57 9.763 8.473 -0.927
290 HE1 TYR 57 2HE TYR 57 8.024 9.188 3.609
291 HE2 TYR 57 1HE TYR 57 11.153 7.915 1.017
292 HH TYR 57 HH TYR 57 11.323 8.555 3.363
293 H ILE 58 H ILE 58 4.207 7.156 -1.974
294 HA ILE 58 HA ILE 58 3.562 8.983 -4.185
295 HB ILE 58 HB ILE 58 3.101 5.996 -3.966
296 HG12 ILE 58 2HG1 ILE 58 5.452 6.501 -4.255
297 HG13 ILE 58 1HG1 ILE 58 4.807 5.764 -5.715
298 HG21 ILE 58 1HG2 ILE 58 1.369 7.043 -5.304
299 HG22 ILE 58 2HG2 ILE 58 2.437 6.081 -6.325
300 HG23 ILE 58 3HG2 ILE 58 2.590 7.838 -6.300
301 HD11 ILE 58 3HD1 ILE 58 4.671 8.016 -6.734
302 HD12 ILE 58 1HD1 ILE 58 6.317 7.561 -6.285
303 HD13 ILE 58 2HD1 ILE 58 5.417 8.684 -5.276
304 H THR 59 H THR 59 1.589 9.851 -4.162
305 HA THR 59 HA THR 59 -0.302 9.122 -2.146
306 HB THR 59 HB THR 59 -0.454 11.093 -4.444
307 HG1 THR 59 1HG THR 59 0.921 12.052 -3.118
308 HG21 THR 59 3HG2 THR 59 -2.288 10.691 -2.065
309 HG22 THR 59 1HG2 THR 59 -2.696 10.440 -3.756
310 HG23 THR 59 2HG2 THR 59 -2.372 12.073 -3.162
311 H TYR 60 H TYR 60 -1.699 7.540 -2.417
312 HA TYR 60 HA TYR 60 -2.274 6.566 -5.106
313 HB2 TYR 60 2HB TYR 60 -2.694 5.303 -2.399
314 HB3 TYR 60 1HB TYR 60 -3.213 4.569 -3.915
315 HD1 TYR 60 2HD TYR 60 -0.337 5.462 -1.822
316 HD2 TYR 60 1HD TYR 60 -1.586 3.570 -5.417
317 HE1 TYR 60 2HE TYR 60 1.887 4.454 -2.060
318 HE2 TYR 60 1HE TYR 60 0.642 2.553 -5.657
319 HH TYR 60 HH TYR 60 2.907 2.959 -4.912
320 H GLY 61 H GLY 61 -4.394 6.134 -5.716
321 HA2 GLY 61 2HA GLY 61 -6.202 8.202 -5.016
322 HA3 GLY 61 1HA GLY 61 -6.508 6.889 -6.140
323 H ASN 62 H ASN 62 -5.754 5.024 -3.824
324 HA ASN 62 HA ASN 62 -7.436 5.345 -1.695
325 HB2 ASN 62 2HB ASN 62 -9.261 3.710 -2.143
326 HB3 ASN 62 1HB ASN 62 -9.355 5.106 -3.175
327 HD21 ASN 62 1HD2 ASN 62 -10.561 4.112 -4.698
328 HD22 ASN 62 2HD2 ASN 62 -9.980 2.916 -5.775
329 H GLU 63 H GLU 63 -7.946 2.985 -0.758
330 HA GLU 63 HA GLU 63 -5.311 2.060 -0.276
331 HB2 GLU 63 2HB GLU 63 -6.209 0.626 1.387
332 HB3 GLU 63 1HB GLU 63 -7.043 2.158 1.484
333 HG2 GLU 63 2HG GLU 63 -8.062 -0.392 0.281
334 HG3 GLU 63 1HG GLU 63 -8.569 0.277 1.831
335 H CYS 64 H CYS 64 -7.931 0.938 -2.242
336 HA CYS 64 HA CYS 64 -7.137 -1.652 -2.790
337 HB2 CYS 64 2HB CYS 64 -9.214 -0.711 -3.670
338 HB3 CYS 64 1HB CYS 64 -8.303 0.366 -4.724
339 H HIS 65 H HIS 65 -6.164 1.316 -4.442
340 HA HIS 65 HA HIS 65 -4.332 0.028 -6.177
341 HB2 HIS 65 2HB HIS 65 -4.514 2.932 -5.363
342 HB3 HIS 65 1HB HIS 65 -3.393 2.349 -6.581
343 HD1 HIS 65 1HD HIS 65 -4.675 1.068 -8.664
344 HD2 HIS 65 2HD HIS 65 -6.911 3.667 -6.340
345 HE1 HIS 65 1HE HIS 65 -6.697 1.658 -10.050
346 HE2 HIS 65 2HE HIS 65 -8.134 3.006 -8.515
347 H LEU 66 H LEU 66 -3.966 1.503 -3.033
348 HA LEU 66 HA LEU 66 -1.161 1.312 -2.827
349 HB2 LEU 66 2HB LEU 66 -2.473 2.629 -1.258
350 HB3 LEU 66 1HB LEU 66 -3.324 1.200 -0.719
351 HG LEU 66 HG LEU 66 -1.233 0.333 0.274
352 HD11 LEU 66 1HD1 LEU 66 0.691 1.810 0.544
353 HD12 LEU 66 2HD1 LEU 66 -0.077 2.996 -0.512
354 HD13 LEU 66 3HD1 LEU 66 0.394 1.420 -1.148
355 HD21 LEU 66 3HD2 LEU 66 -2.014 3.095 1.190
356 HD22 LEU 66 1HD2 LEU 66 -1.141 1.898 2.147
357 HD23 LEU 66 2HD2 LEU 66 -2.802 1.582 1.644
358 H CYS 67 H CYS 67 -3.755 -0.887 -1.830
359 HA CYS 67 HA CYS 67 -2.180 -2.965 -0.868
360 HB2 CYS 67 2HB CYS 67 -4.567 -2.822 -0.421
361 HB3 CYS 67 1HB CYS 67 -4.928 -3.043 -2.127
362 H THR 68 H THR 68 -3.412 -2.430 -4.198
363 HA THR 68 HA THR 68 -2.528 -4.823 -5.338
364 HB THR 68 HB THR 68 -2.548 -2.114 -6.705
365 HG1 THR 68 1HG THR 68 -4.624 -3.705 -5.777
366 HG21 THR 68 3HG2 THR 68 -3.025 -3.428 -8.726
367 HG22 THR 68 1HG2 THR 68 -2.924 -4.915 -7.783
368 HG23 THR 68 2HG2 THR 68 -1.493 -3.911 -8.001
369 H GLU 69 H GLU 69 -0.847 -1.701 -5.012
370 HA GLU 69 HA GLU 69 1.523 -2.453 -6.337
371 HB2 GLU 69 2HB GLU 69 0.679 -0.125 -5.847
372 HB3 GLU 69 1HB GLU 69 1.192 -0.367 -4.187
373 HG2 GLU 69 2HG GLU 69 2.861 0.874 -5.321
374 HG3 GLU 69 1HG GLU 69 3.498 -0.745 -5.017
375 H SER 70 H SER 70 0.477 -2.496 -2.996
376 HA SER 70 HA SER 70 2.906 -3.170 -1.777
377 HB2 SER 70 2HB SER 70 0.819 -2.257 -0.659
378 HB3 SER 70 1HB SER 70 0.133 -3.866 -0.804
379 HG SER 70 HG SER 70 2.174 -2.912 0.796
380 H LEU 71 H LEU 71 0.294 -5.149 -3.118
381 HA LEU 71 HA LEU 71 1.277 -7.641 -2.210
382 HB2 LEU 71 2HB LEU 71 -0.543 -7.007 -4.526
383 HB3 LEU 71 1HB LEU 71 -0.220 -8.623 -3.943
384 HG LEU 71 HG LEU 71 -1.594 -6.431 -2.389
385 HD11 LEU 71 1HD1 LEU 71 -2.967 -7.329 -4.191
386 HD12 LEU 71 2HD1 LEU 71 -3.580 -7.819 -2.613
387 HD13 LEU 71 3HD1 LEU 71 -2.680 -8.968 -3.602
388 HD21 LEU 71 3HD2 LEU 71 -1.064 -9.312 -1.652
389 HD22 LEU 71 1HD2 LEU 71 -2.046 -8.171 -0.738
390 HD23 LEU 71 2HD2 LEU 71 -0.318 -7.891 -0.914
391 H LYS 72 H LYS 72 1.861 -5.812 -5.149
392 HA LYS 72 HA LYS 72 3.294 -7.922 -6.390
393 HB2 LYS 72 2HB LYS 72 3.299 -4.968 -6.978
394 HB3 LYS 72 1HB LYS 72 4.103 -6.167 -7.978
395 HG2 LYS 72 2HG LYS 72 1.916 -7.250 -8.365
396 HG3 LYS 72 1HG LYS 72 1.147 -5.957 -7.447
397 HD2 LYS 72 2HD LYS 72 2.771 -5.599 -9.965
398 HD3 LYS 72 1HD LYS 72 1.012 -5.602 -9.881
399 HE2 LYS 72 2HE LYS 72 1.101 -3.624 -8.419
400 HE3 LYS 72 1HE LYS 72 2.860 -3.628 -8.532
401 HZ1 LYS 72 3HZ LYS 72 1.865 -2.053 -10.059
402 HZ2 LYS 72 1HZ LYS 72 0.986 -3.268 -10.798
403 HZ3 LYS 72 2HZ LYS 72 2.660 -3.253 -10.926
404 H SER 73 H SER 73 4.210 -5.061 -4.574
405 HA SER 73 HA SER 73 7.013 -5.587 -4.880
406 HB2 SER 73 2HB SER 73 5.658 -3.568 -3.098
407 HB3 SER 73 1HB SER 73 7.307 -3.537 -3.724
408 HG SER 73 HG SER 73 4.976 -2.783 -4.965
409 H ASN 74 H ASN 74 4.736 -6.969 -3.017
410 HA ASN 74 HA ASN 74 4.639 -8.238 -1.180
411 HB2 ASN 74 2HB ASN 74 6.345 -9.515 -2.429
412 HB3 ASN 74 1HB ASN 74 7.614 -8.577 -1.656
413 HD21 ASN 74 1HD2 ASN 74 5.184 -11.018 -1.208
414 HD22 ASN 74 2HD2 ASN 74 5.826 -11.652 0.263
415 H GLY 75 H GLY 75 4.125 -6.204 -0.082
416 HA2 GLY 75 2HA GLY 75 4.070 -5.267 2.070
417 HA3 GLY 75 1HA GLY 75 5.428 -6.288 2.470
418 H ARG 76 H ARG 76 6.486 -4.737 -0.138
419 HA ARG 76 HA ARG 76 8.342 -3.127 1.186
420 HB2 ARG 76 2HB ARG 76 8.610 -3.970 -1.117
421 HB3 ARG 76 1HB ARG 76 7.356 -2.876 -1.636
422 HG2 ARG 76 2HG ARG 76 8.694 -0.961 -1.133
423 HG3 ARG 76 1HG ARG 76 9.960 -1.982 -0.446
424 HD2 ARG 76 2HD ARG 76 10.381 -2.993 -2.570
425 HD3 ARG 76 1HD ARG 76 9.013 -2.155 -3.304
426 HE ARG 76 HE ARG 76 10.630 -0.191 -2.325
427 HH11 ARG 76 1HH1 ARG 76 11.081 -2.861 -4.615
428 HH12 ARG 76 2HH1 ARG 76 12.174 -2.013 -5.604
429 HH21 ARG 76 1HH2 ARG 76 12.133 0.957 -3.647
430 HH22 ARG 76 2HH2 ARG 76 12.771 0.227 -5.057
431 H VAL 77 H VAL 77 5.501 -2.039 -0.624
432 HA VAL 77 HA VAL 77 5.697 0.502 0.792
433 HB VAL 77 HB VAL 77 5.585 0.750 -1.644
434 HG11 VAL 77 1HG1 VAL 77 4.469 -1.289 -2.264
435 HG12 VAL 77 2HG1 VAL 77 3.606 0.097 -2.935
436 HG13 VAL 77 3HG1 VAL 77 2.974 -0.732 -1.512
437 HG21 VAL 77 3HG2 VAL 77 3.007 1.599 -0.330
438 HG22 VAL 77 1HG2 VAL 77 3.649 2.257 -1.837
439 HG23 VAL 77 2HG2 VAL 77 4.525 2.494 -0.322
440 H GLN 78 H GLN 78 4.399 0.956 2.408
441 HA GLN 78 HA GLN 78 1.895 -0.508 2.612
442 HB2 GLN 78 2HB GLN 78 3.837 0.073 4.868
443 HB3 GLN 78 1HB GLN 78 2.236 -0.631 5.065
444 HG2 GLN 78 2HG GLN 78 2.918 -2.551 3.710
445 HG3 GLN 78 1HG GLN 78 4.519 -1.851 3.535
446 HE21 GLN 78 1HE2 GLN 78 5.520 -3.534 4.480
447 HE22 GLN 78 2HE2 GLN 78 5.415 -3.890 6.170
448 H PHE 79 H PHE 79 0.739 0.682 4.641
449 HA PHE 79 HA PHE 79 0.077 3.252 3.601
450 HB2 PHE 79 2HB PHE 79 -1.531 1.634 4.618
451 HB3 PHE 79 1HB PHE 79 -0.729 1.871 6.158
452 HD1 PHE 79 1HD PHE 79 -2.976 3.314 3.671
453 HD2 PHE 79 2HD PHE 79 -1.118 3.870 7.456
454 HE1 PHE 79 1HE PHE 79 -4.575 5.104 4.189
455 HE2 PHE 79 2HE PHE 79 -2.710 5.665 7.975
456 HZ PHE 79 HZ PHE 79 -4.445 6.278 6.344
457 H LEU 80 H LEU 80 1.369 4.916 3.946
458 HA LEU 80 HA LEU 80 3.128 5.012 6.245
459 HB2 LEU 80 2HB LEU 80 3.945 5.659 4.039
460 HB3 LEU 80 1HB LEU 80 2.739 6.911 3.920
461 HG LEU 80 HG LEU 80 3.828 7.992 5.919
462 HD11 LEU 80 1HD1 LEU 80 6.136 7.381 6.402
463 HD12 LEU 80 2HD1 LEU 80 6.004 6.013 5.300
464 HD13 LEU 80 3HD1 LEU 80 5.026 6.058 6.769
465 HD21 LEU 80 3HD2 LEU 80 4.118 8.792 3.663
466 HD22 LEU 80 1HD2 LEU 80 5.450 7.664 3.401
467 HD23 LEU 80 2HD2 LEU 80 5.611 8.977 4.580
468 H HIS 81 H HIS 81 0.513 6.938 4.808
469 HA HIS 81 HA HIS 81 -0.624 7.441 7.311
470 HB2 HIS 81 2HB HIS 81 -0.497 9.914 7.377
471 HB3 HIS 81 1HB HIS 81 1.064 9.139 7.577
472 HD1 HIS 81 1HD HIS 81 -0.902 11.267 5.095
473 HD2 HIS 81 2HD HIS 81 2.975 9.872 5.742
474 HE1 HIS 81 1HE HIS 81 0.575 12.507 3.479
475 HE2 HIS 81 2HE HIS 81 2.894 11.823 4.067
476 H ASP 82 H ASP 82 -2.562 8.731 7.159
477 HA ASP 82 HA ASP 82 -4.010 8.197 4.746
478 HB2 ASP 82 2HB ASP 82 -4.991 8.218 7.115
479 HB3 ASP 82 1HB ASP 82 -4.825 9.964 7.065
480 H GLY 83 H GLY 83 -4.721 9.764 3.279
481 HA2 GLY 83 2HA GLY 83 -4.944 11.867 2.424
482 HA3 GLY 83 1HA GLY 83 -3.874 12.500 3.674
483 H SER 84 H SER 84 -3.581 13.265 1.085
484 HA SER 84 HA SER 84 -1.805 11.819 -0.471
485 HB2 SER 84 2HB SER 84 -2.095 14.805 -0.178
486 HB3 SER 84 1HB SER 84 -1.461 13.941 -1.587
487 HG SER 84 HG SER 84 -3.629 14.530 -1.856
488 H CYS 85 H CYS 85 0.476 12.051 -0.723
489 HA CYS 85 HA CYS 85 1.855 12.208 1.719
490 HB2 CYS 85 2HB CYS 85 3.025 12.179 -1.084
491 HB3 CYS 85 1HB CYS 85 3.875 11.869 0.424
Start of MODEL 15
1 H1 SER 20 1HT SER 20 14.732 -2.204 6.642
2 H2 SER 20 2HT SER 20 15.268 -3.677 7.365
3 H3 SER 20 3HT SER 20 16.164 -2.914 6.149
4 HA SER 20 HA SER 20 17.078 -2.517 8.364
5 HB2 SER 20 2HB SER 20 16.112 -0.106 6.816
6 HB3 SER 20 1HB SER 20 17.619 -0.264 7.722
7 HG SER 20 HG SER 20 18.503 -1.161 6.050
8 H GLU 21 H GLU 21 14.165 -3.049 8.815
9 HA GLU 21 HA GLU 21 13.470 -0.726 10.426
10 HB2 GLU 21 2HB GLU 21 11.578 -2.776 9.228
11 HB3 GLU 21 1HB GLU 21 11.118 -1.387 10.194
12 HG2 GLU 21 2HG GLU 21 10.612 -0.823 7.956
13 HG3 GLU 21 1HG GLU 21 12.082 0.060 8.343
14 H ALA 22 H ALA 22 15.028 -1.902 11.867
15 HA ALA 22 HA ALA 22 13.972 -4.272 13.124
16 HB1 ALA 22 1HB ALA 22 15.985 -4.277 14.483
17 HB2 ALA 22 2HB ALA 22 16.414 -2.669 13.906
18 HB3 ALA 22 3HB ALA 22 16.424 -4.034 12.791
19 H ALA 23 H ALA 23 12.037 -3.250 13.686
20 HA ALA 23 HA ALA 23 11.917 -2.614 16.430
21 HB1 ALA 23 1HB ALA 23 10.987 -0.351 16.323
22 HB2 ALA 23 2HB ALA 23 11.222 -0.317 14.578
23 HB3 ALA 23 3HB ALA 23 12.617 -0.374 15.654
24 H SER 24 H SER 24 10.029 -1.566 13.651
25 HA SER 24 HA SER 24 7.917 -1.820 13.031
26 HB2 SER 24 2HB SER 24 8.630 -4.235 12.779
27 HB3 SER 24 1HB SER 24 8.033 -4.535 14.406
28 HG SER 24 HG SER 24 6.412 -3.484 12.323
29 H LEU 25 H LEU 25 7.546 -0.103 14.422
30 HA LEU 25 HA LEU 25 6.815 -0.464 17.168
31 HB2 LEU 25 2HB LEU 25 6.437 1.947 15.408
32 HB3 LEU 25 1HB LEU 25 6.392 1.915 17.159
33 HG LEU 25 HG LEU 25 8.822 1.416 15.441
34 HD11 LEU 25 1HD1 LEU 25 9.601 3.536 16.374
35 HD12 LEU 25 2HD1 LEU 25 8.042 3.740 17.176
36 HD13 LEU 25 3HD1 LEU 25 8.134 3.723 15.415
37 HD21 LEU 25 3HD2 LEU 25 10.071 1.452 17.550
38 HD22 LEU 25 1HD2 LEU 25 8.915 0.122 17.516
39 HD23 LEU 25 2HD2 LEU 25 8.556 1.578 18.442
40 H SER 26 H SER 26 5.122 0.404 14.223
41 HA SER 26 HA SER 26 2.671 -0.649 15.320
42 HB2 SER 26 2HB SER 26 2.706 1.791 15.896
43 HB3 SER 26 1HB SER 26 2.885 2.162 14.183
44 HG SER 26 HG SER 26 0.714 1.158 15.608
45 HA PRO 27 HA PRO 27 2.990 -1.827 10.971
46 HB2 PRO 27 2HB PRO 27 0.748 -3.622 11.462
47 HB3 PRO 27 1HB PRO 27 2.419 -4.042 11.075
48 HG2 PRO 27 2HG PRO 27 1.285 -4.506 13.516
49 HG3 PRO 27 1HG PRO 27 3.019 -4.233 13.276
50 HD2 PRO 27 2HD PRO 27 0.916 -2.334 14.244
51 HD3 PRO 27 1HD PRO 27 2.600 -2.550 14.783
52 H LYS 28 H LYS 28 2.207 0.215 10.429
53 HA LYS 28 HA LYS 28 -0.599 0.811 10.460
54 HB2 LYS 28 2HB LYS 28 1.672 2.203 9.012
55 HB3 LYS 28 1HB LYS 28 0.053 2.842 9.236
56 HG2 LYS 28 2HG LYS 28 0.395 2.937 11.644
57 HG3 LYS 28 1HG LYS 28 2.009 2.260 11.451
58 HD2 LYS 28 2HD LYS 28 1.079 4.894 10.273
59 HD3 LYS 28 1HD LYS 28 2.020 4.714 11.752
60 HE2 LYS 28 2HE LYS 28 3.847 3.692 10.461
61 HE3 LYS 28 1HE LYS 28 2.902 3.882 8.986
62 HZ1 LYS 28 3HZ LYS 28 2.976 6.266 9.255
63 HZ2 LYS 28 1HZ LYS 28 4.552 5.670 9.287
64 HZ3 LYS 28 2HZ LYS 28 3.807 6.127 10.715
65 H LYS 29 H LYS 29 -1.824 -0.393 9.161
66 HA LYS 29 HA LYS 29 -1.028 -0.534 6.391
67 HB2 LYS 29 2HB LYS 29 -1.637 -2.912 6.203
68 HB3 LYS 29 1HB LYS 29 -0.285 -2.671 7.281
69 HG2 LYS 29 2HG LYS 29 -1.543 -4.325 8.349
70 HG3 LYS 29 1HG LYS 29 -2.034 -2.842 9.170
71 HD2 LYS 29 2HD LYS 29 -4.074 -2.757 7.820
72 HD3 LYS 29 1HD LYS 29 -3.570 -4.190 6.931
73 HE2 LYS 29 2HE LYS 29 -3.692 -5.519 8.990
74 HE3 LYS 29 1HE LYS 29 -4.154 -4.086 9.895
75 HZ1 LYS 29 3HZ LYS 29 -6.115 -5.374 9.371
76 HZ2 LYS 29 1HZ LYS 29 -5.806 -5.352 7.718
77 HZ3 LYS 29 2HZ LYS 29 -6.175 -3.949 8.548
78 H VAL 30 H VAL 30 -2.632 -0.368 4.970
79 HA VAL 30 HA VAL 30 -5.302 0.130 5.982
80 HB VAL 30 HB VAL 30 -4.242 1.373 3.984
81 HG11 VAL 30 1HG1 VAL 30 -4.339 0.291 1.770
82 HG12 VAL 30 2HG1 VAL 30 -4.689 -1.240 2.571
83 HG13 VAL 30 3HG1 VAL 30 -3.149 -0.431 2.860
84 HG21 VAL 30 3HG2 VAL 30 -6.870 -0.011 3.474
85 HG22 VAL 30 1HG2 VAL 30 -6.280 1.420 2.629
86 HG23 VAL 30 2HG2 VAL 30 -6.628 1.496 4.359
87 H ASP 31 H ASP 31 -7.088 -1.463 5.167
88 HA ASP 31 HA ASP 31 -5.786 -4.001 5.417
89 HB2 ASP 31 2HB ASP 31 -7.919 -3.596 6.686
90 HB3 ASP 31 1HB ASP 31 -8.773 -3.728 5.138
91 H CYS 32 H CYS 32 -4.758 -4.442 3.819
92 HA CYS 32 HA CYS 32 -5.767 -4.366 1.136
93 HB2 CYS 32 2HB CYS 32 -3.428 -3.806 1.682
94 HB3 CYS 32 1HB CYS 32 -3.193 -5.401 2.366
95 H SER 33 H SER 33 -5.772 -6.453 3.811
96 HA SER 33 HA SER 33 -5.542 -9.002 2.817
97 HB2 SER 33 2HB SER 33 -7.522 -8.240 4.927
98 HB3 SER 33 1HB SER 33 -6.504 -9.683 4.833
99 HG SER 33 HG SER 33 -6.042 -7.287 5.904
100 H ILE 34 H ILE 34 -8.541 -7.048 3.110
101 HA ILE 34 HA ILE 34 -10.182 -9.018 1.905
102 HB ILE 34 HB ILE 34 -11.865 -7.195 1.569
103 HG12 ILE 34 2HG1 ILE 34 -9.771 -5.469 2.915
104 HG13 ILE 34 1HG1 ILE 34 -10.265 -5.337 1.234
105 HG21 ILE 34 1HG2 ILE 34 -12.308 -6.869 3.952
106 HG22 ILE 34 2HG2 ILE 34 -10.667 -7.397 4.316
107 HG23 ILE 34 3HG2 ILE 34 -11.817 -8.531 3.602
108 HD11 ILE 34 3HD1 ILE 34 -12.520 -4.708 1.959
109 HD12 ILE 34 1HD1 ILE 34 -11.284 -3.621 2.593
110 HD13 ILE 34 2HD1 ILE 34 -12.002 -4.841 3.643
111 H TYR 35 H TYR 35 -7.990 -6.836 0.506
112 HA TYR 35 HA TYR 35 -9.271 -7.068 -2.088
113 HB2 TYR 35 2HB TYR 35 -6.879 -5.448 -1.187
114 HB3 TYR 35 1HB TYR 35 -7.437 -5.519 -2.850
115 HD1 TYR 35 2HD TYR 35 -9.650 -4.527 -3.447
116 HD2 TYR 35 1HD TYR 35 -7.983 -4.056 0.439
117 HE1 TYR 35 2HE TYR 35 -11.202 -2.663 -3.015
118 HE2 TYR 35 1HE TYR 35 -9.533 -2.190 0.883
119 HH TYR 35 HH TYR 35 -10.949 -0.562 -0.261
120 H LYS 36 H LYS 36 -6.684 -8.354 -0.218
121 HA LYS 36 HA LYS 36 -5.109 -9.618 -2.202
122 HB2 LYS 36 2HB LYS 36 -5.667 -10.526 0.628
123 HB3 LYS 36 1HB LYS 36 -4.437 -11.202 -0.423
124 HG2 LYS 36 2HG LYS 36 -3.330 -9.033 -0.488
125 HG3 LYS 36 1HG LYS 36 -4.539 -8.386 0.622
126 HD2 LYS 36 2HD LYS 36 -2.552 -8.989 1.867
127 HD3 LYS 36 1HD LYS 36 -3.847 -10.108 2.287
128 HE2 LYS 36 2HE LYS 36 -2.929 -11.781 0.777
129 HE3 LYS 36 1HE LYS 36 -1.672 -10.655 0.272
130 HZ1 LYS 36 3HZ LYS 36 -0.870 -12.239 1.865
131 HZ2 LYS 36 1HZ LYS 36 -2.021 -11.771 3.002
132 HZ3 LYS 36 2HZ LYS 36 -0.802 -10.697 2.517
133 H LYS 37 H LYS 37 -8.185 -10.139 -1.168
134 HA LYS 37 HA LYS 37 -8.530 -12.914 -1.565
135 HB2 LYS 37 2HB LYS 37 -9.983 -11.286 -0.290
136 HB3 LYS 37 1HB LYS 37 -10.563 -10.700 -1.835
137 HG2 LYS 37 2HG LYS 37 -11.565 -12.825 -2.312
138 HG3 LYS 37 1HG LYS 37 -10.852 -13.528 -0.859
139 HD2 LYS 37 2HD LYS 37 -12.097 -11.889 0.508
140 HD3 LYS 37 1HD LYS 37 -12.866 -11.286 -0.958
141 HE2 LYS 37 2HE LYS 37 -14.308 -12.836 0.240
142 HE3 LYS 37 1HE LYS 37 -13.867 -13.473 -1.341
143 HZ1 LYS 37 3HZ LYS 37 -13.778 -15.118 0.435
144 HZ2 LYS 37 1HZ LYS 37 -12.590 -14.241 1.236
145 HZ3 LYS 37 2HZ LYS 37 -12.268 -14.930 -0.284
146 H TYR 38 H TYR 38 -8.033 -10.296 -3.696
147 HA TYR 38 HA TYR 38 -8.990 -11.772 -6.051
148 HB2 TYR 38 2HB TYR 38 -8.121 -8.875 -5.772
149 HB3 TYR 38 1HB TYR 38 -8.831 -9.598 -7.204
150 HD1 TYR 38 1HD TYR 38 -11.258 -10.240 -7.146
151 HD2 TYR 38 2HD TYR 38 -9.411 -8.037 -4.033
152 HE1 TYR 38 1HE TYR 38 -13.482 -9.511 -6.342
153 HE2 TYR 38 2HE TYR 38 -11.587 -7.311 -3.221
154 HH TYR 38 HH TYR 38 -14.491 -8.711 -4.262
155 HA PRO 39 HA PRO 39 -4.707 -12.549 -7.340
156 HB2 PRO 39 2HB PRO 39 -4.737 -11.245 -9.833
157 HB3 PRO 39 1HB PRO 39 -5.124 -12.941 -9.542
158 HG2 PRO 39 2HG PRO 39 -6.936 -10.594 -9.816
159 HG3 PRO 39 1HG PRO 39 -7.164 -12.258 -10.390
160 HD2 PRO 39 2HD PRO 39 -8.455 -11.362 -8.247
161 HD3 PRO 39 1HD PRO 39 -7.782 -13.003 -8.259
162 H VAL 40 H VAL 40 -2.704 -11.492 -7.647
163 HA VAL 40 HA VAL 40 -2.410 -9.200 -6.067
164 HB VAL 40 HB VAL 40 -0.406 -10.552 -7.889
165 HG11 VAL 40 1HG1 VAL 40 0.349 -8.290 -7.379
166 HG12 VAL 40 2HG1 VAL 40 1.336 -9.479 -6.529
167 HG13 VAL 40 3HG1 VAL 40 0.093 -8.578 -5.658
168 HG21 VAL 40 3HG2 VAL 40 0.390 -11.615 -5.813
169 HG22 VAL 40 1HG2 VAL 40 -1.283 -12.036 -6.184
170 HG23 VAL 40 2HG2 VAL 40 -0.928 -10.845 -4.933
171 H VAL 41 H VAL 41 -2.258 -9.557 -9.592
172 HA VAL 41 HA VAL 41 -1.790 -6.677 -9.719
173 HB VAL 41 HB VAL 41 -1.358 -6.921 -12.139
174 HG11 VAL 41 1HG1 VAL 41 0.248 -8.755 -10.377
175 HG12 VAL 41 2HG1 VAL 41 0.492 -7.024 -10.595
176 HG13 VAL 41 3HG1 VAL 41 0.771 -8.128 -11.939
177 HG21 VAL 41 3HG2 VAL 41 -1.680 -9.881 -11.640
178 HG22 VAL 41 1HG2 VAL 41 -1.120 -9.141 -13.138
179 HG23 VAL 41 2HG2 VAL 41 -2.775 -8.870 -12.580
180 H ALA 42 H ALA 42 -4.452 -8.687 -9.809
181 HA ALA 42 HA ALA 42 -5.875 -6.569 -11.212
182 HB1 ALA 42 1HB ALA 42 -6.523 -9.506 -11.467
183 HB2 ALA 42 2HB ALA 42 -5.752 -8.504 -12.692
184 HB3 ALA 42 3HB ALA 42 -7.414 -8.174 -12.201
185 H ILE 43 H ILE 43 -6.524 -5.545 -9.453
186 HA ILE 43 HA ILE 43 -8.458 -6.927 -7.745
187 HB ILE 43 HB ILE 43 -6.600 -4.640 -6.964
188 HG12 ILE 43 2HG1 ILE 43 -6.562 -7.527 -6.030
189 HG13 ILE 43 1HG1 ILE 43 -5.415 -6.813 -7.149
190 HG21 ILE 43 1HG2 ILE 43 -8.783 -4.536 -5.867
191 HG22 ILE 43 2HG2 ILE 43 -7.486 -4.877 -4.733
192 HG23 ILE 43 3HG2 ILE 43 -8.557 -6.181 -5.261
193 HD11 ILE 43 3HD1 ILE 43 -4.494 -7.011 -4.913
194 HD12 ILE 43 1HD1 ILE 43 -5.800 -6.019 -4.269
195 HD13 ILE 43 2HD1 ILE 43 -4.628 -5.320 -5.388
196 HA PRO 44 HA PRO 44 -10.903 -3.667 -9.609
197 HB2 PRO 44 2HB PRO 44 -13.166 -4.046 -8.128
198 HB3 PRO 44 1HB PRO 44 -12.751 -4.989 -9.562
199 HG2 PRO 44 2HG PRO 44 -12.479 -5.697 -6.679
200 HG3 PRO 44 1HG PRO 44 -12.900 -6.731 -8.052
201 HD2 PRO 44 2HD PRO 44 -10.432 -6.668 -6.895
202 HD3 PRO 44 1HD PRO 44 -10.709 -7.108 -8.592
203 H CYS 45 H CYS 45 -11.069 -1.615 -9.100
204 HA CYS 45 HA CYS 45 -10.606 -0.859 -6.330
205 HB2 CYS 45 2HB CYS 45 -9.990 0.596 -8.902
206 HB3 CYS 45 1HB CYS 45 -9.738 1.289 -7.309
207 HA PRO 46 HA PRO 46 -14.687 0.910 -6.338
208 HB2 PRO 46 2HB PRO 46 -14.355 2.612 -4.230
209 HB3 PRO 46 1HB PRO 46 -14.617 0.876 -4.046
210 HG2 PRO 46 2HG PRO 46 -12.058 2.415 -3.952
211 HG3 PRO 46 1HG PRO 46 -12.609 1.101 -2.897
212 HD2 PRO 46 2HD PRO 46 -10.860 0.699 -4.895
213 HD3 PRO 46 1HD PRO 46 -12.058 -0.531 -4.434
214 H ILE 47 H ILE 47 -15.670 3.017 -6.631
215 HA ILE 47 HA ILE 47 -13.926 4.747 -8.168
216 HB ILE 47 HB ILE 47 -16.006 5.998 -8.776
217 HG12 ILE 47 2HG1 ILE 47 -17.433 3.782 -7.285
218 HG13 ILE 47 1HG1 ILE 47 -17.298 5.435 -6.706
219 HG21 ILE 47 1HG2 ILE 47 -16.937 4.237 -10.217
220 HG22 ILE 47 2HG2 ILE 47 -16.056 3.027 -9.286
221 HG23 ILE 47 3HG2 ILE 47 -15.174 4.237 -10.216
222 HD11 ILE 47 3HD1 ILE 47 -19.473 5.011 -7.697
223 HD12 ILE 47 1HD1 ILE 47 -18.703 4.534 -9.211
224 HD13 ILE 47 2HD1 ILE 47 -18.580 6.200 -8.648
225 H THR 48 H THR 48 -14.729 4.501 -5.044
226 HA THR 48 HA THR 48 -15.018 7.228 -4.315
227 HB THR 48 HB THR 48 -14.109 4.895 -2.623
228 HG1 THR 48 1HG THR 48 -16.645 5.737 -3.542
229 HG21 THR 48 3HG2 THR 48 -15.102 6.179 -0.791
230 HG22 THR 48 1HG2 THR 48 -15.595 7.443 -1.921
231 HG23 THR 48 2HG2 THR 48 -13.886 7.153 -1.616
232 H TYR 49 H TYR 49 -13.427 8.664 -4.084
233 HA TYR 49 HA TYR 49 -10.684 7.796 -4.415
234 HB2 TYR 49 2HB TYR 49 -11.535 9.673 -5.791
235 HB3 TYR 49 1HB TYR 49 -11.862 10.585 -4.322
236 HD1 TYR 49 2HD TYR 49 -9.221 9.164 -6.436
237 HD2 TYR 49 1HD TYR 49 -10.099 11.739 -3.178
238 HE1 TYR 49 2HE TYR 49 -6.919 10.015 -6.491
239 HE2 TYR 49 1HE TYR 49 -7.801 12.597 -3.224
240 HH TYR 49 HH TYR 49 -5.575 11.894 -4.014
241 H LEU 50 H LEU 50 -9.532 7.434 -2.700
242 HA LEU 50 HA LEU 50 -10.016 8.957 -0.254
243 HB2 LEU 50 2HB LEU 50 -9.424 5.990 -0.436
244 HB3 LEU 50 1HB LEU 50 -9.515 6.910 1.052
245 HG LEU 50 HG LEU 50 -11.831 6.437 -0.826
246 HD11 LEU 50 1HD1 LEU 50 -12.666 4.932 0.898
247 HD12 LEU 50 2HD1 LEU 50 -11.179 5.153 1.820
248 HD13 LEU 50 3HD1 LEU 50 -11.130 4.371 0.236
249 HD21 LEU 50 3HD2 LEU 50 -11.718 7.666 1.934
250 HD22 LEU 50 1HD2 LEU 50 -13.188 7.312 1.026
251 HD23 LEU 50 2HD2 LEU 50 -12.051 8.517 0.428
252 HA PRO 51 HA PRO 51 -5.746 9.476 -1.760
253 HB2 PRO 51 2HB PRO 51 -5.187 11.569 -0.043
254 HB3 PRO 51 1HB PRO 51 -5.865 11.762 -1.658
255 HG2 PRO 51 2HG PRO 51 -7.216 11.826 0.994
256 HG3 PRO 51 1HG PRO 51 -7.583 12.744 -0.474
257 HD2 PRO 51 2HD PRO 51 -9.044 10.617 0.348
258 HD3 PRO 51 1HD PRO 51 -8.864 11.052 -1.361
259 H VAL 52 H VAL 52 -4.350 8.063 -1.037
260 HA VAL 52 HA VAL 52 -3.719 8.080 1.809
261 HB VAL 52 HB VAL 52 -3.359 5.631 1.789
262 HG11 VAL 52 1HG1 VAL 52 -5.459 6.462 2.643
263 HG12 VAL 52 2HG1 VAL 52 -5.707 4.922 1.824
264 HG13 VAL 52 3HG1 VAL 52 -6.159 6.430 1.025
265 HG21 VAL 52 3HG2 VAL 52 -4.608 5.733 -0.960
266 HG22 VAL 52 1HG2 VAL 52 -4.313 4.257 -0.032
267 HG23 VAL 52 2HG2 VAL 52 -2.956 5.257 -0.554
268 H CYS 53 H CYS 53 -1.580 7.436 2.297
269 HA CYS 53 HA CYS 53 0.229 7.755 0.015
270 HB2 CYS 53 2HB CYS 53 0.212 9.743 1.446
271 HB3 CYS 53 1HB CYS 53 0.584 8.782 2.848
272 H GLY 54 H GLY 54 1.684 6.217 -0.248
273 HA2 GLY 54 2HA GLY 54 1.755 4.070 1.705
274 HA3 GLY 54 1HA GLY 54 2.401 4.028 0.067
275 H SER 55 H SER 55 3.820 3.140 2.288
276 HA SER 55 HA SER 55 5.655 4.917 3.425
277 HB2 SER 55 2HB SER 55 6.241 2.054 2.685
278 HB3 SER 55 1HB SER 55 6.881 2.972 4.048
279 HG SER 55 HG SER 55 5.106 2.588 5.153
280 H ASP 56 H ASP 56 5.421 3.847 0.251
281 HA ASP 56 HA ASP 56 8.210 4.273 -0.460
282 HB2 ASP 56 2HB ASP 56 6.907 2.402 -1.403
283 HB3 ASP 56 1HB ASP 56 5.794 3.546 -2.136
284 H TYR 57 H TYR 57 5.702 6.206 0.228
285 HA TYR 57 HA TYR 57 5.230 8.359 0.026
286 HB2 TYR 57 2HB TYR 57 7.943 8.455 -1.252
287 HB3 TYR 57 1HB TYR 57 6.947 9.896 -1.018
288 HD1 TYR 57 1HD TYR 57 6.413 10.690 1.196
289 HD2 TYR 57 2HD TYR 57 8.978 7.357 0.625
290 HE1 TYR 57 1HE TYR 57 7.172 10.890 3.509
291 HE2 TYR 57 2HE TYR 57 9.746 7.551 2.946
292 HH TYR 57 HH TYR 57 9.910 9.423 4.616
293 H ILE 58 H ILE 58 4.439 6.492 -1.930
294 HA ILE 58 HA ILE 58 3.884 8.314 -4.143
295 HB ILE 58 HB ILE 58 3.297 5.341 -3.925
296 HG12 ILE 58 2HG1 ILE 58 5.713 5.686 -3.966
297 HG13 ILE 58 1HG1 ILE 58 5.168 4.998 -5.492
298 HG21 ILE 58 1HG2 ILE 58 3.167 7.178 -6.317
299 HG22 ILE 58 2HG2 ILE 58 1.793 6.476 -5.462
300 HG23 ILE 58 3HG2 ILE 58 2.906 5.435 -6.347
301 HD11 ILE 58 3HD1 ILE 58 5.883 7.893 -5.016
302 HD12 ILE 58 1HD1 ILE 58 5.332 7.205 -6.545
303 HD13 ILE 58 2HD1 ILE 58 6.870 6.694 -5.852
304 H THR 59 H THR 59 1.941 9.255 -4.146
305 HA THR 59 HA THR 59 -0.015 8.536 -2.175
306 HB THR 59 HB THR 59 -0.089 10.628 -4.372
307 HG1 THR 59 1HG THR 59 1.352 10.492 -2.274
308 HG21 THR 59 3HG2 THR 59 -1.891 11.647 -2.989
309 HG22 THR 59 1HG2 THR 59 -1.856 10.233 -1.939
310 HG23 THR 59 2HG2 THR 59 -2.355 10.066 -3.624
311 H TYR 60 H TYR 60 -1.909 7.545 -2.532
312 HA TYR 60 HA TYR 60 -2.378 6.514 -5.228
313 HB2 TYR 60 2HB TYR 60 -2.805 5.145 -2.582
314 HB3 TYR 60 1HB TYR 60 -3.394 4.512 -4.123
315 HD1 TYR 60 2HD TYR 60 -1.779 3.803 -5.841
316 HD2 TYR 60 1HD TYR 60 -0.522 4.958 -1.961
317 HE1 TYR 60 2HE TYR 60 0.395 2.764 -6.251
318 HE2 TYR 60 1HE TYR 60 1.664 3.925 -2.352
319 HH TYR 60 HH TYR 60 2.631 2.887 -5.466
320 H GLY 61 H GLY 61 -4.491 6.172 -5.826
321 HA2 GLY 61 2HA GLY 61 -6.240 8.271 -5.119
322 HA3 GLY 61 1HA GLY 61 -6.585 6.944 -6.220
323 H ASN 62 H ASN 62 -5.961 4.977 -4.052
324 HA ASN 62 HA ASN 62 -7.562 5.368 -1.852
325 HB2 ASN 62 2HB ASN 62 -9.550 3.950 -2.308
326 HB3 ASN 62 1HB ASN 62 -9.519 5.380 -3.319
327 HD21 ASN 62 1HD2 ASN 62 -10.828 4.589 -4.838
328 HD22 ASN 62 2HD2 ASN 62 -10.448 3.334 -5.937
329 H GLU 63 H GLU 63 -8.304 3.159 -0.947
330 HA GLU 63 HA GLU 63 -6.202 1.732 0.010
331 HB2 GLU 63 2HB GLU 63 -8.902 0.557 -0.575
332 HB3 GLU 63 1HB GLU 63 -7.771 0.056 0.665
333 HG2 GLU 63 2HG GLU 63 -8.160 2.057 1.915
334 HG3 GLU 63 1HG GLU 63 -9.125 2.746 0.612
335 H CYS 64 H CYS 64 -8.233 0.904 -2.761
336 HA CYS 64 HA CYS 64 -7.246 -1.629 -3.317
337 HB2 CYS 64 2HB CYS 64 -9.281 -0.891 -4.328
338 HB3 CYS 64 1HB CYS 64 -8.457 0.431 -5.149
339 H HIS 65 H HIS 65 -6.258 1.475 -4.721
340 HA HIS 65 HA HIS 65 -4.327 0.310 -6.455
341 HB2 HIS 65 2HB HIS 65 -4.503 3.163 -5.460
342 HB3 HIS 65 1HB HIS 65 -3.429 2.624 -6.742
343 HD1 HIS 65 1HD HIS 65 -4.514 2.171 -9.074
344 HD2 HIS 65 2HD HIS 65 -7.136 3.475 -6.145
345 HE1 HIS 65 1HE HIS 65 -6.650 2.739 -10.273
346 HE2 HIS 65 2HE HIS 65 -8.064 3.809 -8.516
347 H LEU 66 H LEU 66 -4.132 1.648 -3.226
348 HA LEU 66 HA LEU 66 -1.344 1.481 -2.912
349 HB2 LEU 66 2HB LEU 66 -2.797 2.748 -1.365
350 HB3 LEU 66 1HB LEU 66 -3.570 1.268 -0.890
351 HG LEU 66 HG LEU 66 -1.594 0.483 0.261
352 HD11 LEU 66 1HD1 LEU 66 -0.257 3.018 -0.662
353 HD12 LEU 66 2HD1 LEU 66 0.122 1.384 -1.209
354 HD13 LEU 66 3HD1 LEU 66 0.421 1.844 0.467
355 HD21 LEU 66 3HD2 LEU 66 -1.436 2.153 2.014
356 HD22 LEU 66 1HD2 LEU 66 -3.104 1.962 1.480
357 HD23 LEU 66 2HD2 LEU 66 -2.166 3.357 0.951
358 H CYS 67 H CYS 67 -3.946 -0.783 -2.221
359 HA CYS 67 HA CYS 67 -2.383 -2.818 -1.103
360 HB2 CYS 67 2HB CYS 67 -4.782 -2.698 -0.761
361 HB3 CYS 67 1HB CYS 67 -5.068 -2.931 -2.477
362 H THR 68 H THR 68 -3.452 -2.311 -4.492
363 HA THR 68 HA THR 68 -2.501 -4.717 -5.538
364 HB THR 68 HB THR 68 -2.534 -2.053 -7.007
365 HG1 THR 68 1HG THR 68 -4.584 -3.625 -5.979
366 HG21 THR 68 3HG2 THR 68 -3.096 -3.437 -8.951
367 HG22 THR 68 1HG2 THR 68 -3.049 -4.885 -7.947
368 HG23 THR 68 2HG2 THR 68 -1.575 -3.970 -8.239
369 H GLU 69 H GLU 69 -0.835 -1.561 -5.178
370 HA GLU 69 HA GLU 69 1.599 -2.503 -6.254
371 HB2 GLU 69 2HB GLU 69 0.893 -0.072 -4.647
372 HB3 GLU 69 1HB GLU 69 2.518 -0.405 -5.229
373 HG2 GLU 69 2HG GLU 69 0.059 -0.009 -6.907
374 HG3 GLU 69 1HG GLU 69 1.398 1.122 -6.703
375 H SER 70 H SER 70 0.274 -2.321 -3.018
376 HA SER 70 HA SER 70 2.632 -2.697 -1.568
377 HB2 SER 70 2HB SER 70 0.353 -1.976 -0.681
378 HB3 SER 70 1HB SER 70 -0.102 -3.679 -0.730
379 HG SER 70 HG SER 70 1.919 -2.415 0.721
380 H LEU 71 H LEU 71 0.284 -4.986 -2.869
381 HA LEU 71 HA LEU 71 1.536 -7.294 -1.830
382 HB2 LEU 71 2HB LEU 71 -0.294 -6.991 -4.198
383 HB3 LEU 71 1HB LEU 71 0.167 -8.521 -3.478
384 HG LEU 71 HG LEU 71 -1.459 -6.350 -2.171
385 HD11 LEU 71 1HD1 LEU 71 -2.649 -7.591 -3.900
386 HD12 LEU 71 2HD1 LEU 71 -3.277 -7.946 -2.298
387 HD13 LEU 71 3HD1 LEU 71 -2.226 -9.110 -3.109
388 HD21 LEU 71 3HD2 LEU 71 -0.023 -7.521 -0.555
389 HD22 LEU 71 1HD2 LEU 71 -0.653 -9.066 -1.121
390 HD23 LEU 71 2HD2 LEU 71 -1.714 -7.903 -0.314
391 H LYS 72 H LYS 72 1.752 -5.631 -4.892
392 HA LYS 72 HA LYS 72 3.314 -7.429 -6.343
393 HB2 LYS 72 2HB LYS 72 2.227 -5.424 -7.244
394 HB3 LYS 72 1HB LYS 72 3.426 -4.421 -6.437
395 HG2 LYS 72 2HG LYS 72 5.164 -5.731 -7.778
396 HG3 LYS 72 1HG LYS 72 3.801 -6.320 -8.734
397 HD2 LYS 72 2HD LYS 72 4.686 -4.439 -9.893
398 HD3 LYS 72 1HD LYS 72 3.199 -3.889 -9.125
399 HE2 LYS 72 2HE LYS 72 4.529 -2.958 -7.269
400 HE3 LYS 72 1HE LYS 72 6.001 -3.467 -8.092
401 HZ1 LYS 72 3HZ LYS 72 5.185 -2.003 -10.000
402 HZ2 LYS 72 1HZ LYS 72 5.689 -1.219 -8.590
403 HZ3 LYS 72 2HZ LYS 72 4.072 -1.378 -8.887
404 H SER 73 H SER 73 4.323 -4.715 -4.293
405 HA SER 73 HA SER 73 7.115 -5.354 -4.727
406 HB2 SER 73 2HB SER 73 7.495 -3.271 -3.450
407 HB3 SER 73 1HB SER 73 6.453 -3.041 -4.852
408 HG SER 73 HG SER 73 4.703 -2.806 -3.564
409 H ASN 74 H ASN 74 4.768 -6.365 -2.694
410 HA ASN 74 HA ASN 74 4.559 -7.284 -0.708
411 HB2 ASN 74 2HB ASN 74 7.371 -8.236 -1.245
412 HB3 ASN 74 1HB ASN 74 6.352 -8.845 0.055
413 HD21 ASN 74 1HD2 ASN 74 7.022 -8.905 -3.304
414 HD22 ASN 74 2HD2 ASN 74 5.882 -10.122 -3.724
415 H GLY 75 H GLY 75 4.457 -5.085 0.027
416 HA2 GLY 75 2HA GLY 75 4.564 -4.025 2.110
417 HA3 GLY 75 1HA GLY 75 5.893 -5.080 2.539
418 H ARG 76 H ARG 76 6.705 -3.712 -0.395
419 HA ARG 76 HA ARG 76 8.641 -1.944 0.730
420 HB2 ARG 76 2HB ARG 76 8.747 -2.936 -1.604
421 HB3 ARG 76 1HB ARG 76 7.459 -1.827 -2.044
422 HG2 ARG 76 2HG ARG 76 8.983 0.065 -1.414
423 HG3 ARG 76 1HG ARG 76 10.273 -1.125 -1.244
424 HD2 ARG 76 2HD ARG 76 9.827 -1.844 -3.590
425 HD3 ARG 76 1HD ARG 76 8.680 -0.516 -3.730
426 HE ARG 76 HE ARG 76 11.484 -0.023 -3.052
427 HH11 ARG 76 1HH1 ARG 76 8.732 0.585 -5.210
428 HH12 ARG 76 2HH1 ARG 76 9.565 1.673 -6.210
429 HH21 ARG 76 1HH2 ARG 76 12.647 1.419 -4.504
430 HH22 ARG 76 2HH2 ARG 76 11.832 2.111 -5.833
431 H VAL 77 H VAL 77 5.587 -1.495 -0.893
432 HA VAL 77 HA VAL 77 5.387 1.101 0.361
433 HB VAL 77 HB VAL 77 5.262 1.297 -2.067
434 HG11 VAL 77 1HG1 VAL 77 4.538 -0.911 -2.689
435 HG12 VAL 77 2HG1 VAL 77 3.484 0.311 -3.406
436 HG13 VAL 77 3HG1 VAL 77 2.942 -0.602 -2.003
437 HG21 VAL 77 3HG2 VAL 77 2.575 1.708 -0.784
438 HG22 VAL 77 1HG2 VAL 77 3.093 2.403 -2.323
439 HG23 VAL 77 2HG2 VAL 77 3.924 2.849 -0.831
440 H GLN 78 H GLN 78 4.623 0.582 2.286
441 HA GLN 78 HA GLN 78 2.111 -0.891 2.402
442 HB2 GLN 78 2HB GLN 78 4.173 -1.646 3.763
443 HB3 GLN 78 1HB GLN 78 3.975 -0.177 4.699
444 HG2 GLN 78 2HG GLN 78 1.862 -0.927 5.548
445 HG3 GLN 78 1HG GLN 78 1.853 -2.306 4.448
446 HE21 GLN 78 1HE2 GLN 78 3.220 -4.064 4.907
447 HE22 GLN 78 2HE2 GLN 78 3.924 -4.247 6.477
448 H PHE 79 H PHE 79 0.890 0.237 4.547
449 HA PHE 79 HA PHE 79 0.192 2.812 3.542
450 HB2 PHE 79 2HB PHE 79 -1.427 1.242 4.585
451 HB3 PHE 79 1HB PHE 79 -0.577 1.419 6.109
452 HD1 PHE 79 1HD PHE 79 -2.665 3.176 3.626
453 HD2 PHE 79 2HD PHE 79 -1.044 3.203 7.553
454 HE1 PHE 79 1HE PHE 79 -4.179 5.011 4.230
455 HE2 PHE 79 2HE PHE 79 -2.547 5.042 8.168
456 HZ PHE 79 HZ PHE 79 -4.121 5.947 6.507
457 H LEU 80 H LEU 80 1.214 4.669 4.008
458 HA LEU 80 HA LEU 80 3.103 4.697 6.234
459 HB2 LEU 80 2HB LEU 80 3.782 5.455 3.958
460 HB3 LEU 80 1HB LEU 80 2.620 6.751 4.088
461 HG LEU 80 HG LEU 80 3.864 7.626 6.042
462 HD11 LEU 80 1HD1 LEU 80 4.972 5.614 6.789
463 HD12 LEU 80 2HD1 LEU 80 6.157 6.864 6.423
464 HD13 LEU 80 3HD1 LEU 80 5.908 5.537 5.297
465 HD21 LEU 80 3HD2 LEU 80 4.182 8.559 3.842
466 HD22 LEU 80 1HD2 LEU 80 5.418 7.356 3.476
467 HD23 LEU 80 2HD2 LEU 80 5.705 8.564 4.730
468 H HIS 81 H HIS 81 0.543 6.742 4.841
469 HA HIS 81 HA HIS 81 -0.624 7.170 7.364
470 HB2 HIS 81 2HB HIS 81 -0.416 9.643 7.449
471 HB3 HIS 81 1HB HIS 81 1.138 8.856 7.641
472 HD1 HIS 81 1HD HIS 81 -0.830 10.971 5.176
473 HD2 HIS 81 2HD HIS 81 3.027 9.523 5.753
474 HE1 HIS 81 1HE HIS 81 0.628 12.149 3.476
475 HE2 HIS 81 2HE HIS 81 2.940 11.543 4.202
476 H ASP 82 H ASP 82 -2.526 8.616 7.134
477 HA ASP 82 HA ASP 82 -3.848 8.027 4.651
478 HB2 ASP 82 2HB ASP 82 -5.047 7.836 6.825
479 HB3 ASP 82 1HB ASP 82 -4.782 9.548 7.110
480 H GLY 83 H GLY 83 -4.722 9.677 3.277
481 HA2 GLY 83 2HA GLY 83 -4.901 11.833 2.476
482 HA3 GLY 83 1HA GLY 83 -3.746 12.376 3.693
483 H SER 84 H SER 84 -3.387 13.236 1.186
484 HA SER 84 HA SER 84 -1.715 11.573 -0.350
485 HB2 SER 84 2HB SER 84 -2.069 14.574 -0.326
486 HB3 SER 84 1HB SER 84 -1.325 13.626 -1.621
487 HG SER 84 HG SER 84 -3.160 13.106 -2.315
488 H CYS 85 H CYS 85 0.572 11.910 -0.667
489 HA CYS 85 HA CYS 85 1.957 11.875 1.762
490 HB2 CYS 85 2HB CYS 85 3.097 12.117 -1.037
491 HB3 CYS 85 1HB CYS 85 3.958 11.626 0.423
Start of MODEL 16
1 H1 SER 20 1HT SER 20 -3.138 10.735 32.232
2 H2 SER 20 2HT SER 20 -1.595 10.055 31.996
3 H3 SER 20 3HT SER 20 -2.951 9.067 32.260
4 HA SER 20 HA SER 20 -2.274 9.095 29.978
5 HB2 SER 20 2HB SER 20 -4.968 10.315 30.606
6 HB3 SER 20 1HB SER 20 -4.554 9.437 29.131
7 HG SER 20 HG SER 20 -5.589 8.325 31.105
8 H GLU 21 H GLU 21 -0.918 10.362 28.902
9 HA GLU 21 HA GLU 21 -1.836 12.857 27.923
10 HB2 GLU 21 2HB GLU 21 0.139 14.192 28.659
11 HB3 GLU 21 1HB GLU 21 -0.879 13.695 29.989
12 HG2 GLU 21 2HG GLU 21 1.763 12.426 29.241
13 HG3 GLU 21 1HG GLU 21 1.537 13.614 30.516
14 H ALA 22 H ALA 22 -1.693 12.332 25.915
15 HA ALA 22 HA ALA 22 -0.910 11.858 23.885
16 HB1 ALA 22 1HB ALA 22 1.485 12.029 23.365
17 HB2 ALA 22 2HB ALA 22 1.873 11.987 25.079
18 HB3 ALA 22 3HB ALA 22 1.002 13.364 24.413
19 H ALA 23 H ALA 23 0.963 10.206 22.876
20 HA ALA 23 HA ALA 23 1.630 8.106 22.526
21 HB1 ALA 23 1HB ALA 23 2.595 8.175 24.785
22 HB2 ALA 23 2HB ALA 23 2.009 6.559 24.373
23 HB3 ALA 23 3HB ALA 23 1.069 7.591 25.447
24 H SER 24 H SER 24 -1.373 8.955 22.780
25 HA SER 24 HA SER 24 -2.692 6.432 22.979
26 HB2 SER 24 2HB SER 24 -3.684 9.059 21.830
27 HB3 SER 24 1HB SER 24 -4.684 7.695 22.334
28 HG SER 24 HG SER 24 -3.606 8.034 24.455
29 H LEU 25 H LEU 25 -1.765 5.095 21.489
30 HA LEU 25 HA LEU 25 -1.431 5.953 18.742
31 HB2 LEU 25 2HB LEU 25 -0.805 3.309 20.055
32 HB3 LEU 25 1HB LEU 25 -0.381 3.758 18.420
33 HG LEU 25 HG LEU 25 0.692 5.089 20.907
34 HD11 LEU 25 1HD1 LEU 25 2.783 3.960 20.350
35 HD12 LEU 25 2HD1 LEU 25 1.978 3.127 19.019
36 HD13 LEU 25 3HD1 LEU 25 1.494 2.802 20.684
37 HD21 LEU 25 3HD2 LEU 25 0.630 6.609 19.003
38 HD22 LEU 25 1HD2 LEU 25 1.433 5.404 17.995
39 HD23 LEU 25 2HD2 LEU 25 2.287 6.131 19.353
40 H SER 26 H SER 26 -3.162 5.919 17.522
41 HA SER 26 HA SER 26 -5.132 3.822 17.881
42 HB2 SER 26 2HB SER 26 -5.803 6.268 17.739
43 HB3 SER 26 1HB SER 26 -5.200 6.276 16.085
44 HG SER 26 HG SER 26 -7.101 5.572 15.559
45 HA PRO 27 HA PRO 27 -2.777 1.819 14.558
46 HB2 PRO 27 2HB PRO 27 -4.982 -0.134 14.585
47 HB3 PRO 27 1HB PRO 27 -3.258 -0.393 14.865
48 HG2 PRO 27 2HG PRO 27 -5.057 -0.521 16.855
49 HG3 PRO 27 1HG PRO 27 -3.414 0.090 17.107
50 HD2 PRO 27 2HD PRO 27 -5.973 1.607 16.823
51 HD3 PRO 27 1HD PRO 27 -4.582 1.907 17.887
52 H LYS 28 H LYS 28 -3.107 3.220 12.907
53 HA LYS 28 HA LYS 28 -5.550 2.869 11.331
54 HB2 LYS 28 2HB LYS 28 -3.562 5.149 11.324
55 HB3 LYS 28 1HB LYS 28 -4.960 5.023 10.271
56 HG2 LYS 28 2HG LYS 28 -6.439 5.156 12.179
57 HG3 LYS 28 1HG LYS 28 -5.052 5.219 13.269
58 HD2 LYS 28 2HD LYS 28 -4.320 7.297 12.224
59 HD3 LYS 28 1HD LYS 28 -5.693 7.219 11.114
60 HE2 LYS 28 2HE LYS 28 -7.229 7.372 12.989
61 HE3 LYS 28 1HE LYS 28 -5.873 7.414 14.117
62 HZ1 LYS 28 3HZ LYS 28 -6.735 9.619 13.707
63 HZ2 LYS 28 1HZ LYS 28 -6.469 9.458 12.044
64 HZ3 LYS 28 2HZ LYS 28 -5.164 9.480 13.103
65 H LYS 29 H LYS 29 -5.215 1.454 9.827
66 HA LYS 29 HA LYS 29 -2.979 1.647 8.016
67 HB2 LYS 29 2HB LYS 29 -3.570 -0.831 9.674
68 HB3 LYS 29 1HB LYS 29 -2.608 -0.881 8.215
69 HG2 LYS 29 2HG LYS 29 -1.916 0.762 10.644
70 HG3 LYS 29 1HG LYS 29 -1.282 -0.850 10.332
71 HD2 LYS 29 2HD LYS 29 -0.142 -0.087 8.356
72 HD3 LYS 29 1HD LYS 29 -0.950 1.475 8.424
73 HE2 LYS 29 2HE LYS 29 0.212 2.013 10.488
74 HE3 LYS 29 1HE LYS 29 0.974 0.423 10.500
75 HZ1 LYS 29 3HZ LYS 29 2.225 0.963 8.622
76 HZ2 LYS 29 1HZ LYS 29 2.390 2.260 9.650
77 HZ3 LYS 29 2HZ LYS 29 1.391 2.367 8.272
78 H VAL 30 H VAL 30 -3.508 0.438 5.996
79 HA VAL 30 HA VAL 30 -6.337 0.451 5.597
80 HB VAL 30 HB VAL 30 -5.761 0.057 3.265
81 HG11 VAL 30 1HG1 VAL 30 -5.955 2.314 3.967
82 HG12 VAL 30 2HG1 VAL 30 -4.592 2.217 2.850
83 HG13 VAL 30 3HG1 VAL 30 -4.312 2.309 4.591
84 HG21 VAL 30 3HG2 VAL 30 -3.765 -1.270 3.474
85 HG22 VAL 30 1HG2 VAL 30 -2.885 0.098 4.161
86 HG23 VAL 30 2HG2 VAL 30 -3.442 0.152 2.484
87 H ASP 31 H ASP 31 -7.469 -1.364 4.708
88 HA ASP 31 HA ASP 31 -6.282 -3.851 5.615
89 HB2 ASP 31 2HB ASP 31 -8.652 -3.349 6.280
90 HB3 ASP 31 1HB ASP 31 -9.096 -3.431 4.574
91 H CYS 32 H CYS 32 -4.972 -4.558 4.224
92 HA CYS 32 HA CYS 32 -5.517 -4.455 1.386
93 HB2 CYS 32 2HB CYS 32 -3.255 -3.940 2.329
94 HB3 CYS 32 1HB CYS 32 -3.160 -5.579 2.941
95 H SER 33 H SER 33 -6.147 -6.443 4.041
96 HA SER 33 HA SER 33 -5.757 -9.001 3.060
97 HB2 SER 33 2HB SER 33 -7.812 -8.063 5.053
98 HB3 SER 33 1HB SER 33 -7.247 -9.725 4.849
99 HG SER 33 HG SER 33 -6.278 -8.020 6.440
100 H ILE 34 H ILE 34 -8.681 -6.950 2.840
101 HA ILE 34 HA ILE 34 -10.220 -8.900 1.507
102 HB ILE 34 HB ILE 34 -11.580 -6.981 0.565
103 HG12 ILE 34 2HG1 ILE 34 -9.734 -5.324 2.303
104 HG13 ILE 34 1HG1 ILE 34 -9.828 -5.263 0.548
105 HG21 ILE 34 1HG2 ILE 34 -12.215 -8.150 2.588
106 HG22 ILE 34 2HG2 ILE 34 -12.613 -6.433 2.682
107 HG23 ILE 34 3HG2 ILE 34 -11.202 -7.051 3.532
108 HD11 ILE 34 3HD1 ILE 34 -10.980 -3.382 1.571
109 HD12 ILE 34 1HD1 ILE 34 -12.026 -4.493 2.457
110 HD13 ILE 34 2HD1 ILE 34 -12.113 -4.415 0.698
111 H TYR 35 H TYR 35 -7.735 -6.846 0.295
112 HA TYR 35 HA TYR 35 -8.580 -7.336 -2.416
113 HB2 TYR 35 2HB TYR 35 -6.207 -5.756 -1.420
114 HB3 TYR 35 1HB TYR 35 -6.738 -5.850 -3.100
115 HD1 TYR 35 2HD TYR 35 -9.150 -5.097 -3.589
116 HD2 TYR 35 1HD TYR 35 -7.066 -4.088 -0.033
117 HE1 TYR 35 2HE TYR 35 -10.720 -3.262 -3.202
118 HE2 TYR 35 1HE TYR 35 -8.637 -2.244 0.370
119 HH TYR 35 HH TYR 35 -10.209 -0.905 -0.682
120 H LYS 36 H LYS 36 -6.517 -8.705 -0.133
121 HA LYS 36 HA LYS 36 -4.719 -10.093 -1.861
122 HB2 LYS 36 2HB LYS 36 -5.716 -10.819 0.908
123 HB3 LYS 36 1HB LYS 36 -4.421 -11.656 0.079
124 HG2 LYS 36 2HG LYS 36 -3.034 -9.693 0.168
125 HG3 LYS 36 1HG LYS 36 -4.357 -8.746 0.865
126 HD2 LYS 36 2HD LYS 36 -4.358 -10.326 2.819
127 HD3 LYS 36 1HD LYS 36 -2.978 -11.124 2.098
128 HE2 LYS 36 2HE LYS 36 -2.956 -8.191 2.794
129 HE3 LYS 36 1HE LYS 36 -2.465 -9.444 3.925
130 HZ1 LYS 36 3HZ LYS 36 -1.183 -8.956 1.270
131 HZ2 LYS 36 1HZ LYS 36 -0.740 -10.114 2.394
132 HZ3 LYS 36 2HZ LYS 36 -0.568 -8.487 2.756
133 H LYS 37 H LYS 37 -7.987 -10.331 -1.241
134 HA LYS 37 HA LYS 37 -8.261 -13.129 -1.911
135 HB2 LYS 37 2HB LYS 37 -10.350 -11.030 -1.322
136 HB3 LYS 37 1HB LYS 37 -10.671 -12.748 -1.541
137 HG2 LYS 37 2HG LYS 37 -9.254 -13.247 0.403
138 HG3 LYS 37 1HG LYS 37 -8.982 -11.519 0.625
139 HD2 LYS 37 2HD LYS 37 -11.366 -11.186 0.998
140 HD3 LYS 37 1HD LYS 37 -11.655 -12.913 0.763
141 HE2 LYS 37 2HE LYS 37 -10.182 -13.402 2.668
142 HE3 LYS 37 1HE LYS 37 -9.941 -11.674 2.912
143 HZ1 LYS 37 3HZ LYS 37 -12.322 -11.464 3.344
144 HZ2 LYS 37 1HZ LYS 37 -11.558 -12.507 4.414
145 HZ3 LYS 37 2HZ LYS 37 -12.524 -13.131 3.181
146 H TYR 38 H TYR 38 -7.555 -10.580 -3.705
147 HA TYR 38 HA TYR 38 -9.069 -11.547 -6.026
148 HB2 TYR 38 2HB TYR 38 -7.860 -8.796 -5.605
149 HB3 TYR 38 1HB TYR 38 -8.734 -9.320 -7.029
150 HD1 TYR 38 2HD TYR 38 -11.224 -10.318 -6.253
151 HD2 TYR 38 1HD TYR 38 -8.941 -7.316 -4.324
152 HE1 TYR 38 2HE TYR 38 -13.281 -9.387 -5.273
153 HE2 TYR 38 1HE TYR 38 -10.986 -6.371 -3.336
154 HH TYR 38 HH TYR 38 -13.865 -8.002 -3.243
155 HA PRO 39 HA PRO 39 -5.010 -12.571 -7.658
156 HB2 PRO 39 2HB PRO 39 -5.332 -11.668 -10.275
157 HB3 PRO 39 1HB PRO 39 -5.826 -13.264 -9.702
158 HG2 PRO 39 2HG PRO 39 -7.459 -10.796 -10.089
159 HG3 PRO 39 1HG PRO 39 -7.891 -12.483 -10.415
160 HD2 PRO 39 2HD PRO 39 -8.798 -11.191 -8.251
161 HD3 PRO 39 1HD PRO 39 -8.362 -12.913 -8.186
162 H VAL 40 H VAL 40 -3.144 -11.468 -7.677
163 HA VAL 40 HA VAL 40 -2.958 -8.862 -6.773
164 HB VAL 40 HB VAL 40 -0.829 -10.476 -8.207
165 HG11 VAL 40 1HG1 VAL 40 -0.519 -8.107 -6.363
166 HG12 VAL 40 2HG1 VAL 40 -0.169 -8.144 -8.091
167 HG13 VAL 40 3HG1 VAL 40 0.797 -9.108 -6.975
168 HG21 VAL 40 3HG2 VAL 40 -1.489 -10.253 -5.273
169 HG22 VAL 40 1HG2 VAL 40 -0.102 -11.113 -5.944
170 HG23 VAL 40 2HG2 VAL 40 -1.736 -11.664 -6.303
171 H VAL 41 H VAL 41 -2.843 -10.024 -10.074
172 HA VAL 41 HA VAL 41 -2.097 -7.424 -11.071
173 HB VAL 41 HB VAL 41 -2.292 -8.361 -13.330
174 HG11 VAL 41 1HG1 VAL 41 -0.800 -10.144 -11.420
175 HG12 VAL 41 2HG1 VAL 41 -0.218 -8.631 -12.109
176 HG13 VAL 41 3HG1 VAL 41 -0.509 -10.024 -13.156
177 HG21 VAL 41 3HG2 VAL 41 -3.210 -10.884 -11.941
178 HG22 VAL 41 1HG2 VAL 41 -2.803 -10.754 -13.653
179 HG23 VAL 41 2HG2 VAL 41 -4.184 -9.869 -13.003
180 H ALA 42 H ALA 42 -5.116 -9.022 -10.442
181 HA ALA 42 HA ALA 42 -6.412 -6.774 -11.771
182 HB1 ALA 42 1HB ALA 42 -8.254 -8.188 -12.495
183 HB2 ALA 42 2HB ALA 42 -7.464 -9.605 -11.808
184 HB3 ALA 42 3HB ALA 42 -6.732 -8.762 -13.173
185 H ILE 43 H ILE 43 -6.731 -5.643 -9.978
186 HA ILE 43 HA ILE 43 -8.413 -6.869 -7.922
187 HB ILE 43 HB ILE 43 -6.246 -4.776 -7.544
188 HG12 ILE 43 2HG1 ILE 43 -6.492 -7.612 -6.511
189 HG13 ILE 43 1HG1 ILE 43 -5.400 -7.065 -7.771
190 HG21 ILE 43 1HG2 ILE 43 -8.147 -4.262 -6.122
191 HG22 ILE 43 2HG2 ILE 43 -6.808 -4.872 -5.149
192 HG23 ILE 43 3HG2 ILE 43 -8.175 -5.921 -5.529
193 HD11 ILE 43 3HD1 ILE 43 -5.320 -6.234 -4.880
194 HD12 ILE 43 1HD1 ILE 43 -4.245 -5.675 -6.162
195 HD13 ILE 43 2HD1 ILE 43 -4.235 -7.374 -5.683
196 HA PRO 44 HA PRO 44 -11.084 -3.613 -9.556
197 HB2 PRO 44 2HB PRO 44 -13.007 -4.720 -7.632
198 HB3 PRO 44 1HB PRO 44 -13.132 -4.601 -9.389
199 HG2 PRO 44 2HG PRO 44 -12.793 -6.956 -8.098
200 HG3 PRO 44 1HG PRO 44 -12.173 -6.656 -9.730
201 HD2 PRO 44 2HD PRO 44 -10.729 -6.702 -7.123
202 HD3 PRO 44 1HD PRO 44 -10.204 -7.229 -8.738
203 H CYS 45 H CYS 45 -11.362 -1.624 -8.737
204 HA CYS 45 HA CYS 45 -10.964 -1.286 -5.857
205 HB2 CYS 45 2HB CYS 45 -10.075 0.434 -8.166
206 HB3 CYS 45 1HB CYS 45 -10.013 0.978 -6.497
207 HA PRO 46 HA PRO 46 -14.852 0.886 -5.633
208 HB2 PRO 46 2HB PRO 46 -14.161 2.732 -3.700
209 HB3 PRO 46 1HB PRO 46 -14.633 1.068 -3.348
210 HG2 PRO 46 2HG PRO 46 -11.901 2.266 -3.532
211 HG3 PRO 46 1HG PRO 46 -12.539 1.079 -2.378
212 HD2 PRO 46 2HD PRO 46 -10.981 0.358 -4.427
213 HD3 PRO 46 1HD PRO 46 -12.305 -0.676 -3.851
214 H ILE 47 H ILE 47 -15.706 3.029 -6.048
215 HA ILE 47 HA ILE 47 -14.034 4.378 -8.012
216 HB ILE 47 HB ILE 47 -16.059 5.613 -8.668
217 HG12 ILE 47 2HG1 ILE 47 -17.472 3.967 -6.549
218 HG13 ILE 47 1HG1 ILE 47 -17.136 5.689 -6.422
219 HG21 ILE 47 1HG2 ILE 47 -15.575 3.497 -9.739
220 HG22 ILE 47 2HG2 ILE 47 -17.321 3.675 -9.542
221 HG23 ILE 47 3HG2 ILE 47 -16.416 2.625 -8.457
222 HD11 ILE 47 3HD1 ILE 47 -18.916 4.373 -8.468
223 HD12 ILE 47 1HD1 ILE 47 -18.588 6.102 -8.345
224 HD13 ILE 47 2HD1 ILE 47 -19.444 5.275 -7.045
225 H THR 48 H THR 48 -14.494 4.748 -4.824
226 HA THR 48 HA THR 48 -14.594 7.613 -4.725
227 HB THR 48 HB THR 48 -13.949 5.673 -2.491
228 HG1 THR 48 1HG THR 48 -16.451 6.660 -3.442
229 HG21 THR 48 3HG2 THR 48 -15.162 8.453 -2.487
230 HG22 THR 48 1HG2 THR 48 -13.508 8.062 -2.023
231 HG23 THR 48 2HG2 THR 48 -14.859 7.458 -1.067
232 H TYR 49 H TYR 49 -12.901 8.944 -4.666
233 HA TYR 49 HA TYR 49 -10.239 7.842 -4.870
234 HB2 TYR 49 2HB TYR 49 -10.942 9.627 -6.449
235 HB3 TYR 49 1HB TYR 49 -11.249 10.700 -5.094
236 HD1 TYR 49 2HD TYR 49 -8.567 8.908 -6.912
237 HD2 TYR 49 1HD TYR 49 -9.501 12.006 -4.151
238 HE1 TYR 49 2HE TYR 49 -6.249 9.724 -7.044
239 HE2 TYR 49 1HE TYR 49 -7.183 12.825 -4.276
240 HH TYR 49 HH TYR 49 -4.984 12.101 -4.882
241 H LEU 50 H LEU 50 -9.392 7.366 -3.026
242 HA LEU 50 HA LEU 50 -9.722 9.194 -0.759
243 HB2 LEU 50 2HB LEU 50 -9.312 6.202 -0.735
244 HB3 LEU 50 1HB LEU 50 -9.336 7.227 0.685
245 HG LEU 50 HG LEU 50 -11.677 6.805 -1.171
246 HD11 LEU 50 1HD1 LEU 50 -12.605 5.483 0.646
247 HD12 LEU 50 2HD1 LEU 50 -11.101 5.656 1.556
248 HD13 LEU 50 3HD1 LEU 50 -11.116 4.775 0.024
249 HD21 LEU 50 3HD2 LEU 50 -11.450 8.192 1.502
250 HD22 LEU 50 1HD2 LEU 50 -12.949 7.892 0.623
251 HD23 LEU 50 2HD2 LEU 50 -11.734 8.970 -0.055
252 HA PRO 51 HA PRO 51 -5.396 9.365 -2.134
253 HB2 PRO 51 2HB PRO 51 -4.779 11.571 -0.611
254 HB3 PRO 51 1HB PRO 51 -5.453 11.652 -2.242
255 HG2 PRO 51 2HG PRO 51 -6.822 11.911 0.393
256 HG3 PRO 51 1HG PRO 51 -7.096 12.824 -1.102
257 HD2 PRO 51 2HD PRO 51 -8.723 10.857 -0.312
258 HD3 PRO 51 1HD PRO 51 -8.387 11.154 -2.032
259 H VAL 52 H VAL 52 -4.090 8.019 -1.248
260 HA VAL 52 HA VAL 52 -3.627 8.165 1.631
261 HB VAL 52 HB VAL 52 -3.213 5.719 1.690
262 HG11 VAL 52 1HG1 VAL 52 -5.985 6.448 0.771
263 HG12 VAL 52 2HG1 VAL 52 -5.371 6.523 2.422
264 HG13 VAL 52 3HG1 VAL 52 -5.549 4.964 1.619
265 HG21 VAL 52 3HG2 VAL 52 -4.023 4.284 -0.145
266 HG22 VAL 52 1HG2 VAL 52 -2.689 5.327 -0.639
267 HG23 VAL 52 2HG2 VAL 52 -4.344 5.727 -1.108
268 H CYS 53 H CYS 53 -1.522 7.469 2.231
269 HA CYS 53 HA CYS 53 0.393 7.810 0.056
270 HB2 CYS 53 2HB CYS 53 0.352 9.801 1.418
271 HB3 CYS 53 1HB CYS 53 0.547 8.877 2.889
272 H GLY 54 H GLY 54 1.771 6.255 -0.158
273 HA2 GLY 54 2HA GLY 54 1.693 4.070 1.723
274 HA3 GLY 54 1HA GLY 54 2.491 4.097 0.155
275 H SER 55 H SER 55 3.637 3.077 2.447
276 HA SER 55 HA SER 55 5.393 4.689 3.875
277 HB2 SER 55 2HB SER 55 6.638 2.467 4.093
278 HB3 SER 55 1HB SER 55 4.952 2.512 4.626
279 HG SER 55 HG SER 55 6.086 1.012 2.686
280 H ASP 56 H ASP 56 5.518 3.694 0.643
281 HA ASP 56 HA ASP 56 8.377 4.120 0.350
282 HB2 ASP 56 2HB ASP 56 7.070 2.281 -0.825
283 HB3 ASP 56 1HB ASP 56 6.325 3.538 -1.802
284 H TYR 57 H TYR 57 5.897 6.103 0.794
285 HA TYR 57 HA TYR 57 5.455 8.266 0.534
286 HB2 TYR 57 2HB TYR 57 8.305 8.332 -0.479
287 HB3 TYR 57 1HB TYR 57 7.324 9.784 -0.269
288 HD1 TYR 57 2HD TYR 57 9.045 7.041 1.493
289 HD2 TYR 57 1HD TYR 57 6.775 10.601 1.917
290 HE1 TYR 57 2HE TYR 57 9.628 7.118 3.871
291 HE2 TYR 57 1HE TYR 57 7.346 10.695 4.310
292 HH TYR 57 HH TYR 57 8.038 9.244 6.065
293 H ILE 58 H ILE 58 4.478 6.583 -1.265
294 HA ILE 58 HA ILE 58 4.340 8.235 -3.690
295 HB ILE 58 HB ILE 58 3.736 5.261 -3.434
296 HG12 ILE 58 2HG1 ILE 58 6.158 5.634 -3.274
297 HG13 ILE 58 1HG1 ILE 58 5.748 4.867 -4.800
298 HG21 ILE 58 1HG2 ILE 58 2.384 6.333 -5.135
299 HG22 ILE 58 2HG2 ILE 58 3.583 5.276 -5.881
300 HG23 ILE 58 3HG2 ILE 58 3.829 7.022 -5.875
301 HD11 ILE 58 3HD1 ILE 58 6.391 7.783 -4.403
302 HD12 ILE 58 1HD1 ILE 58 5.975 7.021 -5.939
303 HD13 ILE 58 2HD1 ILE 58 7.456 6.562 -5.097
304 H THR 59 H THR 59 2.377 9.128 -4.029
305 HA THR 59 HA THR 59 0.220 8.586 -2.205
306 HB THR 59 HB THR 59 0.389 10.526 -4.531
307 HG1 THR 59 1HG THR 59 1.855 11.141 -3.037
308 HG21 THR 59 3HG2 THR 59 -1.496 11.672 -3.379
309 HG22 THR 59 1HG2 THR 59 -1.572 10.336 -2.232
310 HG23 THR 59 2HG2 THR 59 -1.934 10.053 -3.929
311 H TYR 60 H TYR 60 -1.626 7.537 -2.651
312 HA TYR 60 HA TYR 60 -1.980 6.433 -5.351
313 HB2 TYR 60 2HB TYR 60 -2.522 5.119 -2.695
314 HB3 TYR 60 1HB TYR 60 -3.046 4.444 -4.244
315 HD1 TYR 60 1HD TYR 60 -0.245 5.091 -2.024
316 HD2 TYR 60 2HD TYR 60 -1.386 3.572 -5.817
317 HE1 TYR 60 1HE TYR 60 1.965 4.092 -2.275
318 HE2 TYR 60 2HE TYR 60 0.831 2.549 -6.077
319 HH TYR 60 HH TYR 60 3.092 2.859 -5.229
320 H GLY 61 H GLY 61 -4.129 5.985 -5.994
321 HA2 GLY 61 2HA GLY 61 -5.875 8.136 -5.399
322 HA3 GLY 61 1HA GLY 61 -6.227 6.794 -6.484
323 H ASN 62 H ASN 62 -5.584 5.001 -4.059
324 HA ASN 62 HA ASN 62 -7.205 5.540 -1.949
325 HB2 ASN 62 2HB ASN 62 -9.126 3.965 -2.224
326 HB3 ASN 62 1HB ASN 62 -9.208 5.318 -3.326
327 HD21 ASN 62 1HD2 ASN 62 -10.574 4.280 -4.687
328 HD22 ASN 62 2HD2 ASN 62 -10.128 2.973 -5.703
329 H GLU 63 H GLU 63 -7.775 3.424 -0.751
330 HA GLU 63 HA GLU 63 -5.271 2.276 -0.288
331 HB2 GLU 63 2HB GLU 63 -6.715 0.710 1.261
332 HB3 GLU 63 1HB GLU 63 -6.398 2.381 1.676
333 HG2 GLU 63 2HG GLU 63 -8.697 1.790 2.132
334 HG3 GLU 63 1HG GLU 63 -8.600 3.011 0.874
335 H CYS 64 H CYS 64 -8.011 1.134 -2.051
336 HA CYS 64 HA CYS 64 -7.265 -1.481 -2.500
337 HB2 CYS 64 2HB CYS 64 -9.369 -0.660 -3.308
338 HB3 CYS 64 1HB CYS 64 -8.566 0.475 -4.390
339 H HIS 65 H HIS 65 -6.363 1.371 -4.438
340 HA HIS 65 HA HIS 65 -4.623 -0.100 -6.140
341 HB2 HIS 65 2HB HIS 65 -4.670 2.879 -5.595
342 HB3 HIS 65 1HB HIS 65 -3.641 2.129 -6.803
343 HD1 HIS 65 1HD HIS 65 -5.136 0.687 -8.697
344 HD2 HIS 65 2HD HIS 65 -7.024 3.719 -6.577
345 HE1 HIS 65 1HE HIS 65 -7.182 1.260 -10.015
346 HE2 HIS 65 2HE HIS 65 -7.889 3.419 -8.948
347 H LEU 66 H LEU 66 -4.137 1.531 -3.114
348 HA LEU 66 HA LEU 66 -1.337 1.379 -2.976
349 HB2 LEU 66 2HB LEU 66 -2.578 2.747 -1.428
350 HB3 LEU 66 1HB LEU 66 -3.471 1.362 -0.849
351 HG LEU 66 HG LEU 66 -1.452 0.492 0.239
352 HD11 LEU 66 1HD1 LEU 66 0.554 1.858 0.410
353 HD12 LEU 66 2HD1 LEU 66 -0.136 3.019 -0.727
354 HD13 LEU 66 3HD1 LEU 66 0.239 1.380 -1.258
355 HD21 LEU 66 3HD2 LEU 66 -2.008 3.364 0.932
356 HD22 LEU 66 1HD2 LEU 66 -1.289 2.153 1.991
357 HD23 LEU 66 2HD2 LEU 66 -2.967 1.981 1.452
358 H CYS 67 H CYS 67 -3.860 -0.894 -1.956
359 HA CYS 67 HA CYS 67 -2.032 -2.842 -1.030
360 HB2 CYS 67 2HB CYS 67 -4.310 -2.851 -0.201
361 HB3 CYS 67 1HB CYS 67 -4.940 -3.094 -1.824
362 H THR 68 H THR 68 -3.561 -2.302 -4.180
363 HA THR 68 HA THR 68 -2.778 -4.668 -5.453
364 HB THR 68 HB THR 68 -2.896 -1.900 -6.704
365 HG1 THR 68 1HG THR 68 -4.858 -3.466 -5.621
366 HG21 THR 68 3HG2 THR 68 -3.503 -3.114 -8.758
367 HG22 THR 68 1HG2 THR 68 -3.351 -4.649 -7.901
368 HG23 THR 68 2HG2 THR 68 -1.932 -3.637 -8.160
369 H GLU 69 H GLU 69 -1.086 -1.588 -5.092
370 HA GLU 69 HA GLU 69 1.275 -2.373 -6.437
371 HB2 GLU 69 2HB GLU 69 0.474 -0.048 -6.122
372 HB3 GLU 69 1HB GLU 69 0.838 -0.188 -4.413
373 HG2 GLU 69 2HG GLU 69 2.593 0.995 -5.493
374 HG3 GLU 69 1HG GLU 69 3.187 -0.579 -4.965
375 H SER 70 H SER 70 0.171 -2.454 -3.116
376 HA SER 70 HA SER 70 2.581 -2.930 -1.795
377 HB2 SER 70 2HB SER 70 0.286 -2.350 -0.818
378 HB3 SER 70 1HB SER 70 -0.092 -4.062 -0.963
379 HG SER 70 HG SER 70 1.885 -2.787 0.545
380 H LEU 71 H LEU 71 0.104 -5.208 -2.963
381 HA LEU 71 HA LEU 71 1.479 -7.579 -2.295
382 HB2 LEU 71 2HB LEU 71 -0.602 -7.093 -4.428
383 HB3 LEU 71 1HB LEU 71 -0.105 -8.672 -3.851
384 HG LEU 71 HG LEU 71 -1.509 -6.562 -2.196
385 HD11 LEU 71 1HD1 LEU 71 -2.963 -7.523 -3.890
386 HD12 LEU 71 2HD1 LEU 71 -3.415 -8.081 -2.279
387 HD13 LEU 71 3HD1 LEU 71 -2.525 -9.149 -3.359
388 HD21 LEU 71 3HD2 LEU 71 -0.011 -7.991 -0.881
389 HD22 LEU 71 1HD2 LEU 71 -0.803 -9.420 -1.541
390 HD23 LEU 71 2HD2 LEU 71 -1.704 -8.296 -0.515
391 H LYS 72 H LYS 72 1.506 -5.529 -5.090
392 HA LYS 72 HA LYS 72 2.961 -7.173 -6.847
393 HB2 LYS 72 2HB LYS 72 1.641 -5.223 -7.530
394 HB3 LYS 72 1HB LYS 72 2.737 -4.175 -6.654
395 HG2 LYS 72 2HG LYS 72 4.550 -4.872 -8.204
396 HG3 LYS 72 1HG LYS 72 3.343 -5.773 -9.132
397 HD2 LYS 72 2HD LYS 72 2.068 -3.736 -9.495
398 HD3 LYS 72 1HD LYS 72 3.211 -2.824 -8.519
399 HE2 LYS 72 2HE LYS 72 3.710 -2.408 -10.812
400 HE3 LYS 72 1HE LYS 72 4.985 -3.430 -10.153
401 HZ1 LYS 72 3HZ LYS 72 2.716 -4.317 -11.832
402 HZ2 LYS 72 1HZ LYS 72 3.884 -5.348 -11.185
403 HZ3 LYS 72 2HZ LYS 72 4.319 -4.182 -12.310
404 H SER 73 H SER 73 3.925 -4.543 -4.661
405 HA SER 73 HA SER 73 6.714 -5.011 -5.234
406 HB2 SER 73 2HB SER 73 5.465 -2.907 -3.448
407 HB3 SER 73 1HB SER 73 7.123 -2.966 -4.025
408 HG SER 73 HG SER 73 4.772 -2.499 -5.552
409 H ASN 74 H ASN 74 4.966 -6.838 -3.509
410 HA ASN 74 HA ASN 74 5.299 -8.328 -1.822
411 HB2 ASN 74 2HB ASN 74 8.162 -7.376 -2.049
412 HB3 ASN 74 1HB ASN 74 7.658 -8.774 -1.112
413 HD21 ASN 74 1HD2 ASN 74 6.933 -10.623 -2.221
414 HD22 ASN 74 2HD2 ASN 74 7.307 -10.882 -3.879
415 H GLY 75 H GLY 75 4.425 -5.708 -1.010
416 HA2 GLY 75 2HA GLY 75 3.784 -5.012 1.120
417 HA3 GLY 75 1HA GLY 75 5.062 -5.982 1.819
418 H ARG 76 H ARG 76 6.367 -4.208 -0.626
419 HA ARG 76 HA ARG 76 8.012 -2.569 0.919
420 HB2 ARG 76 2HB ARG 76 8.553 -3.045 -1.383
421 HB3 ARG 76 1HB ARG 76 7.087 -2.260 -1.924
422 HG2 ARG 76 2HG ARG 76 9.034 -0.900 -2.359
423 HG3 ARG 76 1HG ARG 76 7.938 -0.100 -1.234
424 HD2 ARG 76 2HD ARG 76 9.371 -0.859 0.633
425 HD3 ARG 76 1HD ARG 76 10.491 -1.559 -0.540
426 HE ARG 76 HE ARG 76 10.063 1.143 -1.171
427 HH11 ARG 76 1HH1 ARG 76 11.566 -0.761 1.404
428 HH12 ARG 76 2HH1 ARG 76 12.788 0.385 1.709
429 HH21 ARG 76 1HH2 ARG 76 11.713 2.723 -0.714
430 HH22 ARG 76 2HH2 ARG 76 12.883 2.397 0.469
431 H VAL 77 H VAL 77 5.050 -1.715 -0.774
432 HA VAL 77 HA VAL 77 5.074 0.759 0.733
433 HB VAL 77 HB VAL 77 5.324 1.167 -1.644
434 HG11 VAL 77 1HG1 VAL 77 4.351 -0.823 -2.571
435 HG12 VAL 77 2HG1 VAL 77 3.597 0.613 -3.263
436 HG13 VAL 77 3HG1 VAL 77 2.746 -0.323 -2.031
437 HG21 VAL 77 3HG2 VAL 77 3.444 2.663 -2.021
438 HG22 VAL 77 1HG2 VAL 77 4.078 2.789 -0.380
439 HG23 VAL 77 2HG2 VAL 77 2.578 1.900 -0.683
440 H GLN 78 H GLN 78 3.709 0.814 2.288
441 HA GLN 78 HA GLN 78 1.074 -0.393 1.956
442 HB2 GLN 78 2HB GLN 78 2.853 -1.782 3.238
443 HB3 GLN 78 1HB GLN 78 2.671 -0.579 4.500
444 HG2 GLN 78 2HG GLN 78 0.398 -1.161 4.826
445 HG3 GLN 78 1HG GLN 78 0.403 -2.202 3.397
446 HE21 GLN 78 1HE2 GLN 78 1.570 -4.132 3.457
447 HE22 GLN 78 2HE2 GLN 78 1.991 -4.877 4.944
448 H PHE 79 H PHE 79 -0.255 0.534 4.094
449 HA PHE 79 HA PHE 79 -0.431 3.281 3.707
450 HB2 PHE 79 2HB PHE 79 -2.248 1.926 4.529
451 HB3 PHE 79 1HB PHE 79 -1.390 1.630 6.034
452 HD1 PHE 79 1HD PHE 79 -3.224 4.098 4.032
453 HD2 PHE 79 2HD PHE 79 -1.369 3.310 7.769
454 HE1 PHE 79 1HE PHE 79 -4.367 6.030 5.012
455 HE2 PHE 79 2HE PHE 79 -2.504 5.239 8.746
456 HZ PHE 79 HZ PHE 79 -4.002 6.599 7.385
457 H LEU 80 H LEU 80 0.986 4.765 4.181
458 HA LEU 80 HA LEU 80 2.637 4.617 6.585
459 HB2 LEU 80 2HB LEU 80 3.612 5.279 4.394
460 HB3 LEU 80 1HB LEU 80 2.531 6.641 4.351
461 HG LEU 80 HG LEU 80 3.640 7.563 6.378
462 HD11 LEU 80 1HD1 LEU 80 4.506 5.500 7.325
463 HD12 LEU 80 2HD1 LEU 80 5.809 6.657 7.048
464 HD13 LEU 80 3HD1 LEU 80 5.582 5.302 5.941
465 HD21 LEU 80 3HD2 LEU 80 4.276 8.321 4.155
466 HD22 LEU 80 1HD2 LEU 80 5.445 7.009 4.025
467 HD23 LEU 80 2HD2 LEU 80 5.678 8.278 5.223
468 H HIS 81 H HIS 81 0.534 6.959 4.920
469 HA HIS 81 HA HIS 81 -0.804 7.546 7.369
470 HB2 HIS 81 2HB HIS 81 -0.460 9.968 7.337
471 HB3 HIS 81 1HB HIS 81 1.074 9.148 7.554
472 HD1 HIS 81 1HD HIS 81 -0.853 11.284 5.074
473 HD2 HIS 81 2HD HIS 81 2.955 9.651 5.559
474 HE1 HIS 81 1HE HIS 81 0.603 12.366 3.337
475 HE2 HIS 81 2HE HIS 81 2.891 11.436 3.707
476 H ASP 82 H ASP 82 -2.653 8.903 7.006
477 HA ASP 82 HA ASP 82 -3.901 8.217 4.520
478 HB2 ASP 82 2HB ASP 82 -5.040 8.198 6.812
479 HB3 ASP 82 1HB ASP 82 -4.963 9.950 6.762
480 H GLY 83 H GLY 83 -4.691 9.771 3.025
481 HA2 GLY 83 2HA GLY 83 -4.843 11.854 2.077
482 HA3 GLY 83 1HA GLY 83 -3.799 12.510 3.347
483 H SER 84 H SER 84 -3.361 13.126 0.694
484 HA SER 84 HA SER 84 -1.515 11.505 -0.619
485 HB2 SER 84 2HB SER 84 -1.752 14.514 -0.638
486 HB3 SER 84 1HB SER 84 -1.058 13.505 -1.914
487 HG SER 84 HG SER 84 -3.076 13.739 -2.607
488 H CYS 85 H CYS 85 0.826 11.737 -0.756
489 HA CYS 85 HA CYS 85 2.030 11.871 1.765
490 HB2 CYS 85 2HB CYS 85 3.379 11.944 -0.956
491 HB3 CYS 85 1HB CYS 85 4.138 11.566 0.593
Start of MODEL 17
1 H1 SER 20 1HT SER 20 -5.424 -3.284 22.629
2 H2 SER 20 2HT SER 20 -7.031 -2.761 22.691
3 H3 SER 20 3HT SER 20 -6.312 -3.473 24.038
4 HA SER 20 HA SER 20 -5.470 -0.912 22.861
5 HB2 SER 20 2HB SER 20 -7.706 -0.827 24.028
6 HB3 SER 20 1HB SER 20 -6.936 -1.499 25.458
7 HG SER 20 HG SER 20 -7.121 1.009 24.672
8 H GLU 21 H GLU 21 -3.462 -0.341 23.468
9 HA GLU 21 HA GLU 21 -2.195 -1.959 25.562
10 HB2 GLU 21 2HB GLU 21 -0.879 -0.259 23.439
11 HB3 GLU 21 1HB GLU 21 -0.073 -1.332 24.572
12 HG2 GLU 21 2HG GLU 21 -1.852 -2.112 22.283
13 HG3 GLU 21 1HG GLU 21 -0.114 -2.363 22.422
14 H ALA 22 H ALA 22 -0.551 -0.632 26.829
15 HA ALA 22 HA ALA 22 -1.893 1.826 27.578
16 HB1 ALA 22 1HB ALA 22 -0.530 1.790 29.578
17 HB2 ALA 22 2HB ALA 22 0.395 0.433 28.939
18 HB3 ALA 22 3HB ALA 22 -1.312 0.229 29.331
19 H ALA 23 H ALA 23 1.435 0.869 26.920
20 HA ALA 23 HA ALA 23 2.146 3.682 26.534
21 HB1 ALA 23 1HB ALA 23 3.920 1.246 26.594
22 HB2 ALA 23 2HB ALA 23 3.583 2.309 27.961
23 HB3 ALA 23 3HB ALA 23 4.452 2.924 26.553
24 H SER 24 H SER 24 0.947 1.350 24.640
25 HA SER 24 HA SER 24 2.367 2.396 22.311
26 HB2 SER 24 2HB SER 24 1.053 -0.323 22.563
27 HB3 SER 24 1HB SER 24 1.988 0.273 21.192
28 HG SER 24 HG SER 24 2.926 -0.157 23.825
29 H LEU 25 H LEU 25 1.109 3.690 21.172
30 HA LEU 25 HA LEU 25 -1.736 3.783 21.533
31 HB2 LEU 25 2HB LEU 25 -1.753 5.627 20.013
32 HB3 LEU 25 1HB LEU 25 -0.327 5.813 20.999
33 HG LEU 25 HG LEU 25 -0.321 4.762 18.151
34 HD11 LEU 25 1HD1 LEU 25 -1.016 7.084 18.223
35 HD12 LEU 25 2HD1 LEU 25 0.599 6.927 17.537
36 HD13 LEU 25 3HD1 LEU 25 0.400 7.487 19.195
37 HD21 LEU 25 3HD2 LEU 25 1.955 5.619 19.946
38 HD22 LEU 25 1HD2 LEU 25 2.100 5.181 18.240
39 HD23 LEU 25 2HD2 LEU 25 1.600 3.970 19.419
40 H SER 26 H SER 26 -3.177 3.695 19.517
41 HA SER 26 HA SER 26 -2.474 1.285 18.082
42 HB2 SER 26 2HB SER 26 -5.087 2.794 18.267
43 HB3 SER 26 1HB SER 26 -4.857 1.247 17.442
44 HG SER 26 HG SER 26 -5.020 1.839 20.130
45 HA PRO 27 HA PRO 27 -1.546 4.091 14.647
46 HB2 PRO 27 2HB PRO 27 -0.247 1.849 13.364
47 HB3 PRO 27 1HB PRO 27 0.509 3.282 14.057
48 HG2 PRO 27 2HG PRO 27 0.786 0.760 15.093
49 HG3 PRO 27 1HG PRO 27 0.953 2.247 16.039
50 HD2 PRO 27 2HD PRO 27 -1.373 0.378 15.848
51 HD3 PRO 27 1HD PRO 27 -0.704 1.248 17.252
52 H LYS 28 H LYS 28 -1.690 3.430 12.104
53 HA LYS 28 HA LYS 28 -3.923 1.619 11.850
54 HB2 LYS 28 2HB LYS 28 -5.078 3.163 10.313
55 HB3 LYS 28 1HB LYS 28 -4.972 3.762 11.959
56 HG2 LYS 28 2HG LYS 28 -3.143 5.227 11.309
57 HG3 LYS 28 1HG LYS 28 -3.252 4.606 9.658
58 HD2 LYS 28 2HD LYS 28 -5.549 5.408 9.508
59 HD3 LYS 28 1HD LYS 28 -5.448 6.034 11.151
60 HE2 LYS 28 2HE LYS 28 -3.640 7.535 10.451
61 HE3 LYS 28 1HE LYS 28 -3.775 6.917 8.805
62 HZ1 LYS 28 3HZ LYS 28 -6.137 7.657 8.884
63 HZ2 LYS 28 1HZ LYS 28 -5.009 8.912 8.901
64 HZ3 LYS 28 2HZ LYS 28 -5.801 8.432 10.324
65 H LYS 29 H LYS 29 -4.169 0.641 9.938
66 HA LYS 29 HA LYS 29 -1.981 0.879 8.000
67 HB2 LYS 29 2HB LYS 29 -3.252 -1.717 8.937
68 HB3 LYS 29 1HB LYS 29 -1.922 -1.549 7.819
69 HG2 LYS 29 2HG LYS 29 -1.795 -0.840 10.742
70 HG3 LYS 29 1HG LYS 29 -1.251 -2.362 10.055
71 HD2 LYS 29 2HD LYS 29 -0.146 0.366 9.356
72 HD3 LYS 29 1HD LYS 29 0.583 -0.759 10.497
73 HE2 LYS 29 2HE LYS 29 0.741 -2.418 8.606
74 HE3 LYS 29 1HE LYS 29 0.222 -1.129 7.521
75 HZ1 LYS 29 3HZ LYS 29 2.641 -1.084 9.222
76 HZ2 LYS 29 1HZ LYS 29 2.222 0.135 8.153
77 HZ3 LYS 29 2HZ LYS 29 2.657 -1.393 7.585
78 H VAL 30 H VAL 30 -2.804 -0.483 5.991
79 HA VAL 30 HA VAL 30 -5.631 0.191 5.632
80 HB VAL 30 HB VAL 30 -4.027 1.263 4.015
81 HG11 VAL 30 1HG1 VAL 30 -3.003 -0.082 2.229
82 HG12 VAL 30 2HG1 VAL 30 -3.489 -1.548 3.082
83 HG13 VAL 30 3HG1 VAL 30 -2.335 -0.441 3.819
84 HG21 VAL 30 3HG2 VAL 30 -6.318 0.965 3.335
85 HG22 VAL 30 1HG2 VAL 30 -5.979 -0.685 2.802
86 HG23 VAL 30 2HG2 VAL 30 -5.250 0.680 1.961
87 H ASP 31 H ASP 31 -7.055 -1.454 4.996
88 HA ASP 31 HA ASP 31 -6.061 -4.083 5.571
89 HB2 ASP 31 2HB ASP 31 -8.389 -3.458 6.241
90 HB3 ASP 31 1HB ASP 31 -8.816 -3.344 4.535
91 H CYS 32 H CYS 32 -4.832 -4.905 4.163
92 HA CYS 32 HA CYS 32 -5.454 -4.633 1.336
93 HB2 CYS 32 2HB CYS 32 -3.142 -4.158 2.245
94 HB3 CYS 32 1HB CYS 32 -3.034 -5.849 2.700
95 H SER 33 H SER 33 -6.435 -6.499 3.788
96 HA SER 33 HA SER 33 -5.844 -9.149 3.040
97 HB2 SER 33 2HB SER 33 -8.251 -8.323 4.621
98 HB3 SER 33 1HB SER 33 -7.190 -9.710 4.863
99 HG SER 33 HG SER 33 -7.117 -7.298 5.920
100 H ILE 34 H ILE 34 -8.687 -7.049 2.754
101 HA ILE 34 HA ILE 34 -10.276 -8.949 1.385
102 HB ILE 34 HB ILE 34 -11.834 -7.087 0.924
103 HG12 ILE 34 2HG1 ILE 34 -9.722 -5.362 2.261
104 HG13 ILE 34 1HG1 ILE 34 -10.139 -5.314 0.555
105 HG21 ILE 34 1HG2 ILE 34 -11.951 -8.277 3.039
106 HG22 ILE 34 2HG2 ILE 34 -12.343 -6.574 3.281
107 HG23 ILE 34 3HG2 ILE 34 -10.755 -7.189 3.742
108 HD11 ILE 34 3HD1 ILE 34 -11.950 -4.584 2.851
109 HD12 ILE 34 1HD1 ILE 34 -12.391 -4.552 1.142
110 HD13 ILE 34 2HD1 ILE 34 -11.144 -3.465 1.749
111 H TYR 35 H TYR 35 -7.770 -6.983 0.258
112 HA TYR 35 HA TYR 35 -8.779 -7.177 -2.458
113 HB2 TYR 35 2HB TYR 35 -6.375 -5.643 -1.454
114 HB3 TYR 35 1HB TYR 35 -6.973 -5.633 -3.110
115 HD1 TYR 35 1HD TYR 35 -9.396 -4.792 -3.469
116 HD2 TYR 35 2HD TYR 35 -7.183 -4.085 0.092
117 HE1 TYR 35 1HE TYR 35 -10.902 -2.932 -2.903
118 HE2 TYR 35 2HE TYR 35 -8.684 -2.225 0.666
119 HH TYR 35 HH TYR 35 -10.260 -0.724 -0.305
120 H LYS 36 H LYS 36 -6.643 -8.758 -0.334
121 HA LYS 36 HA LYS 36 -4.842 -9.963 -2.171
122 HB2 LYS 36 2HB LYS 36 -5.908 -10.988 0.480
123 HB3 LYS 36 1HB LYS 36 -4.656 -11.801 -0.432
124 HG2 LYS 36 2HG LYS 36 -3.171 -9.898 -0.117
125 HG3 LYS 36 1HG LYS 36 -4.452 -9.018 0.724
126 HD2 LYS 36 2HD LYS 36 -4.502 -10.813 2.439
127 HD3 LYS 36 1HD LYS 36 -3.169 -11.609 1.614
128 HE2 LYS 36 2HE LYS 36 -3.062 -8.832 2.807
129 HE3 LYS 36 1HE LYS 36 -2.454 -10.291 3.583
130 HZ1 LYS 36 3HZ LYS 36 -1.449 -9.153 1.030
131 HZ2 LYS 36 1HZ LYS 36 -0.883 -10.550 1.758
132 HZ3 LYS 36 2HZ LYS 36 -0.652 -9.094 2.526
133 H LYS 37 H LYS 37 -8.103 -10.285 -1.668
134 HA LYS 37 HA LYS 37 -8.783 -12.900 -2.420
135 HB2 LYS 37 2HB LYS 37 -10.361 -11.249 -1.497
136 HB3 LYS 37 1HB LYS 37 -10.234 -10.306 -2.969
137 HG2 LYS 37 2HG LYS 37 -11.141 -12.312 -4.208
138 HG3 LYS 37 1HG LYS 37 -11.479 -13.027 -2.634
139 HD2 LYS 37 2HD LYS 37 -12.567 -10.384 -3.622
140 HD3 LYS 37 1HD LYS 37 -13.447 -11.909 -3.625
141 HE2 LYS 37 2HE LYS 37 -12.391 -10.503 -1.166
142 HE3 LYS 37 1HE LYS 37 -14.056 -10.451 -1.733
143 HZ1 LYS 37 3HZ LYS 37 -12.608 -12.877 -0.785
144 HZ2 LYS 37 1HZ LYS 37 -14.167 -12.868 -1.433
145 HZ3 LYS 37 2HZ LYS 37 -13.859 -12.063 -0.011
146 H TYR 38 H TYR 38 -7.744 -10.125 -4.297
147 HA TYR 38 HA TYR 38 -8.606 -11.344 -6.820
148 HB2 TYR 38 2HB TYR 38 -7.558 -8.582 -6.247
149 HB3 TYR 38 1HB TYR 38 -8.315 -9.116 -7.744
150 HD1 TYR 38 1HD TYR 38 -10.787 -9.936 -7.487
151 HD2 TYR 38 2HD TYR 38 -8.764 -7.524 -4.654
152 HE1 TYR 38 1HE TYR 38 -12.955 -9.156 -6.605
153 HE2 TYR 38 2HE TYR 38 -10.883 -6.737 -3.770
154 HH TYR 38 HH TYR 38 -13.214 -6.498 -4.503
155 HA PRO 39 HA PRO 39 -4.344 -12.168 -7.972
156 HB2 PRO 39 2HB PRO 39 -4.390 -11.418 -10.622
157 HB3 PRO 39 1HB PRO 39 -5.024 -12.962 -10.038
158 HG2 PRO 39 2HG PRO 39 -6.482 -10.437 -10.670
159 HG3 PRO 39 1HG PRO 39 -6.926 -12.109 -11.059
160 HD2 PRO 39 2HD PRO 39 -8.054 -10.791 -9.021
161 HD3 PRO 39 1HD PRO 39 -7.700 -12.526 -8.910
162 H VAL 40 H VAL 40 -2.451 -11.002 -8.125
163 HA VAL 40 HA VAL 40 -2.488 -8.384 -7.157
164 HB VAL 40 HB VAL 40 -0.169 -9.890 -8.412
165 HG11 VAL 40 1HG1 VAL 40 1.282 -8.437 -7.096
166 HG12 VAL 40 2HG1 VAL 40 -0.121 -7.528 -6.539
167 HG13 VAL 40 3HG1 VAL 40 0.323 -7.508 -8.246
168 HG21 VAL 40 3HG2 VAL 40 0.422 -10.469 -6.108
169 HG22 VAL 40 1HG2 VAL 40 -1.163 -11.110 -6.556
170 HG23 VAL 40 2HG2 VAL 40 -1.041 -9.672 -5.539
171 H VAL 41 H VAL 41 -2.387 -9.490 -10.454
172 HA VAL 41 HA VAL 41 -1.573 -6.890 -11.422
173 HB VAL 41 HB VAL 41 -0.821 -8.939 -12.582
174 HG11 VAL 41 1HG1 VAL 41 -2.320 -10.214 -14.024
175 HG12 VAL 41 2HG1 VAL 41 -3.689 -9.295 -13.404
176 HG13 VAL 41 3HG1 VAL 41 -2.774 -10.342 -12.323
177 HG21 VAL 41 3HG2 VAL 41 -1.244 -8.208 -14.893
178 HG22 VAL 41 1HG2 VAL 41 -0.846 -6.854 -13.834
179 HG23 VAL 41 2HG2 VAL 41 -2.520 -7.138 -14.312
180 H ALA 42 H ALA 42 -4.609 -8.505 -10.815
181 HA ALA 42 HA ALA 42 -5.985 -6.285 -12.123
182 HB1 ALA 42 1HB ALA 42 -6.195 -8.264 -13.564
183 HB2 ALA 42 2HB ALA 42 -7.753 -7.762 -12.903
184 HB3 ALA 42 3HB ALA 42 -6.922 -9.156 -12.226
185 H ILE 43 H ILE 43 -6.530 -5.162 -10.306
186 HA ILE 43 HA ILE 43 -8.145 -6.674 -8.396
187 HB ILE 43 HB ILE 43 -6.186 -4.469 -7.646
188 HG12 ILE 43 2HG1 ILE 43 -6.161 -7.454 -7.101
189 HG13 ILE 43 1HG1 ILE 43 -5.057 -6.572 -8.130
190 HG21 ILE 43 1HG2 ILE 43 -8.192 -4.381 -6.263
191 HG22 ILE 43 2HG2 ILE 43 -6.828 -4.986 -5.319
192 HG23 ILE 43 3HG2 ILE 43 -8.050 -6.104 -5.927
193 HD11 ILE 43 3HD1 ILE 43 -5.292 -6.273 -5.147
194 HD12 ILE 43 1HD1 ILE 43 -4.170 -5.407 -6.196
195 HD13 ILE 43 2HD1 ILE 43 -4.032 -7.158 -6.012
196 HA PRO 44 HA PRO 44 -11.186 -3.551 -9.633
197 HB2 PRO 44 2HB PRO 44 -12.717 -5.200 -7.674
198 HB3 PRO 44 1HB PRO 44 -13.187 -4.679 -9.296
199 HG2 PRO 44 2HG PRO 44 -12.479 -7.199 -8.858
200 HG3 PRO 44 1HG PRO 44 -11.958 -6.360 -10.331
201 HD2 PRO 44 2HD PRO 44 -10.403 -6.957 -7.846
202 HD3 PRO 44 1HD PRO 44 -9.893 -7.040 -9.546
203 H CYS 45 H CYS 45 -11.644 -1.716 -8.584
204 HA CYS 45 HA CYS 45 -10.966 -1.539 -5.727
205 HB2 CYS 45 2HB CYS 45 -10.317 0.362 -7.969
206 HB3 CYS 45 1HB CYS 45 -10.031 0.728 -6.283
207 HA PRO 46 HA PRO 46 -14.870 0.586 -5.241
208 HB2 PRO 46 2HB PRO 46 -14.037 2.546 -3.452
209 HB3 PRO 46 1HB PRO 46 -14.595 0.936 -3.004
210 HG2 PRO 46 2HG PRO 46 -11.827 1.998 -3.255
211 HG3 PRO 46 1HG PRO 46 -12.475 0.810 -2.110
212 HD2 PRO 46 2HD PRO 46 -10.964 0.118 -4.232
213 HD3 PRO 46 1HD PRO 46 -12.255 -0.932 -3.611
214 H ILE 47 H ILE 47 -15.843 2.543 -5.882
215 HA ILE 47 HA ILE 47 -14.292 3.994 -7.831
216 HB ILE 47 HB ILE 47 -16.423 5.204 -8.337
217 HG12 ILE 47 2HG1 ILE 47 -17.649 3.240 -6.381
218 HG13 ILE 47 1HG1 ILE 47 -17.434 4.956 -6.060
219 HG21 ILE 47 1HG2 ILE 47 -17.513 3.269 -9.393
220 HG22 ILE 47 2HG2 ILE 47 -16.524 2.190 -8.409
221 HG23 ILE 47 3HG2 ILE 47 -15.762 3.241 -9.598
222 HD11 ILE 47 3HD1 ILE 47 -18.959 5.483 -7.890
223 HD12 ILE 47 1HD1 ILE 47 -19.726 4.431 -6.700
224 HD13 ILE 47 2HD1 ILE 47 -19.148 3.762 -8.228
225 H THR 48 H THR 48 -14.869 4.390 -4.623
226 HA THR 48 HA THR 48 -14.847 7.258 -4.539
227 HB THR 48 HB THR 48 -14.291 5.281 -2.324
228 HG1 THR 48 1HG THR 48 -16.635 6.251 -3.540
229 HG21 THR 48 3HG2 THR 48 -15.057 7.105 -0.861
230 HG22 THR 48 1HG2 THR 48 -15.309 8.136 -2.271
231 HG23 THR 48 2HG2 THR 48 -13.680 7.620 -1.829
232 H TYR 49 H TYR 49 -13.079 8.489 -4.634
233 HA TYR 49 HA TYR 49 -10.476 7.258 -4.643
234 HB2 TYR 49 2HB TYR 49 -11.173 9.087 -6.277
235 HB3 TYR 49 1HB TYR 49 -11.223 10.181 -4.905
236 HD1 TYR 49 2HD TYR 49 -9.116 10.790 -3.734
237 HD2 TYR 49 1HD TYR 49 -9.113 8.479 -7.299
238 HE1 TYR 49 2HE TYR 49 -6.721 11.281 -4.042
239 HE2 TYR 49 1HE TYR 49 -6.730 8.967 -7.620
240 HH TYR 49 HH TYR 49 -4.771 10.228 -5.214
241 H LEU 50 H LEU 50 -9.190 7.302 -2.970
242 HA LEU 50 HA LEU 50 -9.792 8.973 -0.649
243 HB2 LEU 50 2HB LEU 50 -9.157 6.010 -0.655
244 HB3 LEU 50 1HB LEU 50 -9.213 7.007 0.780
245 HG LEU 50 HG LEU 50 -11.613 6.592 -1.004
246 HD11 LEU 50 1HD1 LEU 50 -12.363 4.951 0.627
247 HD12 LEU 50 2HD1 LEU 50 -10.825 5.080 1.490
248 HD13 LEU 50 3HD1 LEU 50 -10.870 4.432 -0.151
249 HD21 LEU 50 3HD2 LEU 50 -11.317 7.501 1.852
250 HD22 LEU 50 1HD2 LEU 50 -12.830 7.336 0.962
251 HD23 LEU 50 2HD2 LEU 50 -11.639 8.548 0.474
252 HA PRO 51 HA PRO 51 -5.471 9.493 -2.017
253 HB2 PRO 51 2HB PRO 51 -4.977 11.572 -0.241
254 HB3 PRO 51 1HB PRO 51 -5.529 11.800 -1.893
255 HG2 PRO 51 2HG PRO 51 -7.044 11.893 0.655
256 HG3 PRO 51 1HG PRO 51 -7.322 12.779 -0.852
257 HD2 PRO 51 2HD PRO 51 -8.840 10.668 -0.048
258 HD3 PRO 51 1HD PRO 51 -8.589 11.083 -1.754
259 H VAL 52 H VAL 52 -4.118 8.043 -1.222
260 HA VAL 52 HA VAL 52 -3.563 8.132 1.634
261 HB VAL 52 HB VAL 52 -3.235 5.663 1.679
262 HG11 VAL 52 1HG1 VAL 52 -5.313 6.557 2.534
263 HG12 VAL 52 2HG1 VAL 52 -5.602 5.005 1.745
264 HG13 VAL 52 3HG1 VAL 52 -6.025 6.506 0.922
265 HG21 VAL 52 3HG2 VAL 52 -4.215 4.267 -0.107
266 HG22 VAL 52 1HG2 VAL 52 -2.866 5.250 -0.677
267 HG23 VAL 52 2HG2 VAL 52 -4.522 5.727 -1.052
268 H CYS 53 H CYS 53 -1.446 7.567 2.185
269 HA CYS 53 HA CYS 53 0.393 7.809 -0.079
270 HB2 CYS 53 2HB CYS 53 0.352 9.805 1.344
271 HB3 CYS 53 1HB CYS 53 0.735 8.856 2.753
272 H GLY 54 H GLY 54 1.854 6.278 -0.322
273 HA2 GLY 54 2HA GLY 54 1.861 4.100 1.599
274 HA3 GLY 54 1HA GLY 54 2.561 4.081 -0.015
275 H SER 55 H SER 55 3.897 3.113 2.174
276 HA SER 55 HA SER 55 5.705 4.668 3.555
277 HB2 SER 55 2HB SER 55 6.421 2.047 2.279
278 HB3 SER 55 1HB SER 55 6.937 2.676 3.846
279 HG SER 55 HG SER 55 5.328 1.646 4.611
280 H ASP 56 H ASP 56 5.636 3.948 0.207
281 HA ASP 56 HA ASP 56 8.430 4.549 -0.272
282 HB2 ASP 56 2HB ASP 56 7.265 2.651 -1.377
283 HB3 ASP 56 1HB ASP 56 6.230 3.809 -2.199
284 H TYR 57 H TYR 57 5.931 6.399 0.393
285 HA TYR 57 HA TYR 57 5.401 8.526 0.211
286 HB2 TYR 57 2HB TYR 57 8.126 8.739 -1.052
287 HB3 TYR 57 1HB TYR 57 7.100 10.148 -0.796
288 HD1 TYR 57 1HD TYR 57 6.266 10.582 1.561
289 HD2 TYR 57 2HD TYR 57 9.484 7.945 0.705
290 HE1 TYR 57 1HE TYR 57 7.008 10.758 3.882
291 HE2 TYR 57 2HE TYR 57 10.245 8.113 3.046
292 HH TYR 57 HH TYR 57 10.039 9.688 4.904
293 H ILE 58 H ILE 58 4.703 6.667 -1.823
294 HA ILE 58 HA ILE 58 4.147 8.457 -4.069
295 HB ILE 58 HB ILE 58 3.673 5.464 -3.808
296 HG12 ILE 58 2HG1 ILE 58 6.069 5.979 -3.858
297 HG13 ILE 58 1HG1 ILE 58 5.565 5.166 -5.334
298 HG21 ILE 58 1HG2 ILE 58 2.119 6.516 -5.372
299 HG22 ILE 58 2HG2 ILE 58 3.265 5.478 -6.218
300 HG23 ILE 58 3HG2 ILE 58 3.476 7.228 -6.252
301 HD11 ILE 58 3HD1 ILE 58 7.129 6.950 -5.840
302 HD12 ILE 58 1HD1 ILE 58 6.095 8.117 -5.015
303 HD13 ILE 58 2HD1 ILE 58 5.539 7.337 -6.493
304 H THR 59 H THR 59 2.120 9.275 -4.239
305 HA THR 59 HA THR 59 0.158 8.512 -2.265
306 HB THR 59 HB THR 59 0.011 10.593 -4.464
307 HG1 THR 59 1HG THR 59 1.387 10.462 -2.272
308 HG21 THR 59 3HG2 THR 59 -1.731 10.139 -2.020
309 HG22 THR 59 1HG2 THR 59 -2.221 9.893 -3.691
310 HG23 THR 59 2HG2 THR 59 -1.860 11.521 -3.110
311 H TYR 60 H TYR 60 -1.500 7.253 -2.585
312 HA TYR 60 HA TYR 60 -1.928 6.194 -5.268
313 HB2 TYR 60 2HB TYR 60 -2.255 4.858 -2.582
314 HB3 TYR 60 1HB TYR 60 -2.762 4.118 -4.110
315 HD1 TYR 60 1HD TYR 60 -1.023 3.546 -5.811
316 HD2 TYR 60 2HD TYR 60 0.027 4.883 -1.916
317 HE1 TYR 60 1HE TYR 60 1.277 2.749 -6.159
318 HE2 TYR 60 2HE TYR 60 2.324 4.081 -2.250
319 HH TYR 60 HH TYR 60 3.442 3.122 -5.358
320 H GLY 61 H GLY 61 -4.058 5.600 -5.816
321 HA2 GLY 61 2HA GLY 61 -5.848 7.713 -5.380
322 HA3 GLY 61 1HA GLY 61 -6.174 6.265 -6.311
323 H ASN 62 H ASN 62 -5.667 4.604 -3.838
324 HA ASN 62 HA ASN 62 -7.291 5.327 -1.758
325 HB2 ASN 62 2HB ASN 62 -9.346 3.948 -2.053
326 HB3 ASN 62 1HB ASN 62 -9.259 5.249 -3.218
327 HD21 ASN 62 1HD2 ASN 62 -10.720 4.222 -4.529
328 HD22 ASN 62 2HD2 ASN 62 -10.332 2.868 -5.503
329 H GLU 63 H GLU 63 -8.213 3.240 -0.671
330 HA GLU 63 HA GLU 63 -6.249 1.776 0.482
331 HB2 GLU 63 2HB GLU 63 -8.963 0.673 -0.189
332 HB3 GLU 63 1HB GLU 63 -7.949 0.241 1.172
333 HG2 GLU 63 2HG GLU 63 -8.315 2.410 2.171
334 HG3 GLU 63 1HG GLU 63 -9.243 2.932 0.765
335 H CYS 64 H CYS 64 -8.212 0.870 -2.276
336 HA CYS 64 HA CYS 64 -7.235 -1.715 -2.663
337 HB2 CYS 64 2HB CYS 64 -9.334 -1.049 -3.574
338 HB3 CYS 64 1HB CYS 64 -8.566 0.193 -4.561
339 H HIS 65 H HIS 65 -6.423 1.315 -4.354
340 HA HIS 65 HA HIS 65 -4.536 0.061 -6.059
341 HB2 HIS 65 2HB HIS 65 -4.802 2.995 -5.348
342 HB3 HIS 65 1HB HIS 65 -3.717 2.370 -6.588
343 HD1 HIS 65 1HD HIS 65 -5.069 0.913 -8.540
344 HD2 HIS 65 2HD HIS 65 -7.263 3.644 -6.304
345 HE1 HIS 65 1HE HIS 65 -7.204 1.265 -9.791
346 HE2 HIS 65 2HE HIS 65 -8.575 2.773 -8.355
347 H LEU 66 H LEU 66 -4.248 1.544 -2.931
348 HA LEU 66 HA LEU 66 -1.441 1.465 -2.763
349 HB2 LEU 66 2HB LEU 66 -2.750 2.800 -1.224
350 HB3 LEU 66 1HB LEU 66 -3.583 1.381 -0.641
351 HG LEU 66 HG LEU 66 -1.537 0.584 0.440
352 HD11 LEU 66 1HD1 LEU 66 0.451 1.983 0.561
353 HD12 LEU 66 2HD1 LEU 66 -0.275 3.129 -0.564
354 HD13 LEU 66 3HD1 LEU 66 0.118 1.493 -1.099
355 HD21 LEU 66 3HD2 LEU 66 -2.139 3.456 1.091
356 HD22 LEU 66 1HD2 LEU 66 -1.386 2.274 2.158
357 HD23 LEU 66 2HD2 LEU 66 -3.062 2.061 1.652
358 H CYS 67 H CYS 67 -3.963 -0.845 -1.801
359 HA CYS 67 HA CYS 67 -2.202 -2.787 -0.793
360 HB2 CYS 67 2HB CYS 67 -4.524 -2.873 -0.175
361 HB3 CYS 67 1HB CYS 67 -5.015 -3.029 -1.855
362 H THR 68 H THR 68 -3.513 -2.269 -4.053
363 HA THR 68 HA THR 68 -2.598 -4.600 -5.263
364 HB THR 68 HB THR 68 -2.705 -1.820 -6.475
365 HG1 THR 68 1HG THR 68 -4.653 -3.643 -5.721
366 HG21 THR 68 3HG2 THR 68 -3.091 -3.012 -8.600
367 HG22 THR 68 1HG2 THR 68 -2.916 -4.558 -7.769
368 HG23 THR 68 2HG2 THR 68 -1.542 -3.465 -7.896
369 H GLU 69 H GLU 69 -0.965 -1.467 -4.829
370 HA GLU 69 HA GLU 69 1.433 -2.273 -6.068
371 HB2 GLU 69 2HB GLU 69 0.509 0.079 -5.653
372 HB3 GLU 69 1HB GLU 69 1.166 -0.097 -4.029
373 HG2 GLU 69 2HG GLU 69 2.733 1.078 -5.356
374 HG3 GLU 69 1HG GLU 69 3.382 -0.534 -5.036
375 H SER 70 H SER 70 0.197 -2.279 -2.789
376 HA SER 70 HA SER 70 2.546 -2.838 -1.383
377 HB2 SER 70 2HB SER 70 0.326 -2.133 -0.374
378 HB3 SER 70 1HB SER 70 -0.242 -3.780 -0.647
379 HG SER 70 HG SER 70 1.880 -2.899 0.976
380 H LEU 71 H LEU 71 0.179 -4.970 -2.918
381 HA LEU 71 HA LEU 71 1.546 -7.362 -2.199
382 HB2 LEU 71 2HB LEU 71 -0.535 -6.863 -4.336
383 HB3 LEU 71 1HB LEU 71 0.035 -8.446 -3.849
384 HG LEU 71 HG LEU 71 -1.473 -6.503 -2.095
385 HD11 LEU 71 1HD1 LEU 71 -3.279 -8.139 -2.193
386 HD12 LEU 71 2HD1 LEU 71 -2.357 -9.093 -3.354
387 HD13 LEU 71 3HD1 LEU 71 -2.913 -7.471 -3.784
388 HD21 LEU 71 3HD2 LEU 71 -1.591 -8.357 -0.513
389 HD22 LEU 71 1HD2 LEU 71 0.072 -7.839 -0.777
390 HD23 LEU 71 2HD2 LEU 71 -0.525 -9.311 -1.545
391 H LYS 72 H LYS 72 1.464 -5.327 -5.075
392 HA LYS 72 HA LYS 72 3.070 -6.741 -6.845
393 HB2 LYS 72 2HB LYS 72 2.794 -3.799 -6.334
394 HB3 LYS 72 1HB LYS 72 3.871 -4.412 -7.569
395 HG2 LYS 72 2HG LYS 72 0.933 -5.027 -7.511
396 HG3 LYS 72 1HG LYS 72 1.611 -3.626 -8.342
397 HD2 LYS 72 2HD LYS 72 3.076 -5.167 -9.610
398 HD3 LYS 72 1HD LYS 72 2.223 -6.528 -8.884
399 HE2 LYS 72 2HE LYS 72 0.139 -5.780 -9.886
400 HE3 LYS 72 1HE LYS 72 0.945 -4.350 -10.529
401 HZ1 LYS 72 3HZ LYS 72 1.457 -7.170 -11.309
402 HZ2 LYS 72 1HZ LYS 72 2.384 -5.871 -11.826
403 HZ3 LYS 72 2HZ LYS 72 0.788 -5.946 -12.261
404 H SER 73 H SER 73 4.168 -4.199 -4.639
405 HA SER 73 HA SER 73 6.924 -4.831 -5.094
406 HB2 SER 73 2HB SER 73 5.708 -3.010 -3.013
407 HB3 SER 73 1HB SER 73 7.361 -2.975 -3.638
408 HG SER 73 HG SER 73 5.017 -2.019 -4.775
409 H ASN 74 H ASN 74 4.489 -5.771 -2.904
410 HA ASN 74 HA ASN 74 4.286 -7.158 -1.225
411 HB2 ASN 74 2HB ASN 74 5.354 -8.730 -2.827
412 HB3 ASN 74 1HB ASN 74 6.915 -8.366 -2.103
413 HD21 ASN 74 1HD2 ASN 74 7.417 -9.234 -0.100
414 HD22 ASN 74 2HD2 ASN 74 6.435 -10.422 0.668
415 H GLY 75 H GLY 75 4.401 -5.556 0.290
416 HA2 GLY 75 2HA GLY 75 4.966 -5.196 2.545
417 HA3 GLY 75 1HA GLY 75 6.455 -6.087 2.326
418 H ARG 76 H ARG 76 7.138 -4.491 -0.010
419 HA ARG 76 HA ARG 76 8.770 -2.537 1.099
420 HB2 ARG 76 2HB ARG 76 9.305 -3.367 -1.035
421 HB3 ARG 76 1HB ARG 76 7.718 -2.991 -1.661
422 HG2 ARG 76 2HG ARG 76 9.351 -1.487 -2.613
423 HG3 ARG 76 1HG ARG 76 8.228 -0.602 -1.589
424 HD2 ARG 76 2HD ARG 76 9.988 -0.695 0.215
425 HD3 ARG 76 1HD ARG 76 11.090 -1.345 -1.008
426 HE ARG 76 HE ARG 76 9.815 0.993 -1.926
427 HH11 ARG 76 1HH1 ARG 76 12.577 -0.041 0.091
428 HH12 ARG 76 2HH1 ARG 76 13.326 1.481 -0.008
429 HH21 ARG 76 1HH2 ARG 76 10.860 2.986 -2.018
430 HH22 ARG 76 2HH2 ARG 76 12.363 3.245 -1.247
431 H VAL 77 H VAL 77 5.558 -2.109 -0.369
432 HA VAL 77 HA VAL 77 5.590 0.513 0.870
433 HB VAL 77 HB VAL 77 5.646 0.825 -1.553
434 HG11 VAL 77 1HG1 VAL 77 3.112 -0.780 -1.671
435 HG12 VAL 77 2HG1 VAL 77 4.691 -1.261 -2.291
436 HG13 VAL 77 3HG1 VAL 77 3.837 0.105 -3.012
437 HG21 VAL 77 3HG2 VAL 77 2.934 1.488 -0.418
438 HG22 VAL 77 1HG2 VAL 77 3.649 2.221 -1.853
439 HG23 VAL 77 2HG2 VAL 77 4.397 2.459 -0.270
440 H GLN 78 H GLN 78 4.175 0.828 2.377
441 HA GLN 78 HA GLN 78 1.734 -0.758 2.448
442 HB2 GLN 78 2HB GLN 78 3.567 -0.109 4.767
443 HB3 GLN 78 1HB GLN 78 2.014 -0.920 4.897
444 HG2 GLN 78 2HG GLN 78 2.893 -2.798 3.616
445 HG3 GLN 78 1HG GLN 78 4.440 -1.968 3.465
446 HE21 GLN 78 1HE2 GLN 78 5.562 -3.520 4.486
447 HE22 GLN 78 2HE2 GLN 78 5.430 -3.886 6.160
448 H PHE 79 H PHE 79 0.455 0.370 4.384
449 HA PHE 79 HA PHE 79 -0.105 3.026 3.551
450 HB2 PHE 79 2HB PHE 79 -1.782 1.467 4.497
451 HB3 PHE 79 1HB PHE 79 -0.948 1.524 6.040
452 HD1 PHE 79 1HD PHE 79 -1.060 3.546 7.417
453 HD2 PHE 79 2HD PHE 79 -3.217 3.216 3.770
454 HE1 PHE 79 1HE PHE 79 -2.467 5.426 8.084
455 HE2 PHE 79 2HE PHE 79 -4.641 5.099 4.440
456 HZ PHE 79 HZ PHE 79 -4.264 6.203 6.613
457 H LEU 80 H LEU 80 1.226 4.678 3.969
458 HA LEU 80 HA LEU 80 2.916 4.658 6.341
459 HB2 LEU 80 2HB LEU 80 3.808 5.364 4.136
460 HB3 LEU 80 1HB LEU 80 2.657 6.673 4.103
461 HG LEU 80 HG LEU 80 3.765 7.618 6.140
462 HD11 LEU 80 1HD1 LEU 80 6.007 6.853 6.701
463 HD12 LEU 80 2HD1 LEU 80 5.841 5.520 5.563
464 HD13 LEU 80 3HD1 LEU 80 4.804 5.595 6.990
465 HD21 LEU 80 3HD2 LEU 80 4.238 8.479 3.926
466 HD22 LEU 80 1HD2 LEU 80 5.483 7.251 3.692
467 HD23 LEU 80 2HD2 LEU 80 5.693 8.500 4.921
468 H HIS 81 H HIS 81 0.582 6.826 4.754
469 HA HIS 81 HA HIS 81 -0.789 7.299 7.174
470 HB2 HIS 81 2HB HIS 81 -0.518 9.759 7.267
471 HB3 HIS 81 1HB HIS 81 1.014 8.954 7.543
472 HD1 HIS 81 1HD HIS 81 -0.794 11.091 4.960
473 HD2 HIS 81 2HD HIS 81 3.026 9.638 5.759
474 HE1 HIS 81 1HE HIS 81 0.748 12.288 3.375
475 HE2 HIS 81 2HE HIS 81 3.025 11.669 4.171
476 H ASP 82 H ASP 82 -2.684 8.791 6.713
477 HA ASP 82 HA ASP 82 -3.599 8.119 4.058
478 HB2 ASP 82 2HB ASP 82 -5.785 8.879 4.767
479 HB3 ASP 82 1HB ASP 82 -5.146 7.814 6.002
480 H GLY 83 H GLY 83 -4.679 9.798 2.817
481 HA2 GLY 83 2HA GLY 83 -4.824 11.925 2.010
482 HA3 GLY 83 1HA GLY 83 -3.723 12.479 3.275
483 H SER 84 H SER 84 -3.328 13.346 0.791
484 HA SER 84 HA SER 84 -1.551 11.823 -0.743
485 HB2 SER 84 2HB SER 84 -1.857 14.811 -0.495
486 HB3 SER 84 1HB SER 84 -1.156 13.946 -1.879
487 HG SER 84 HG SER 84 -3.093 13.801 -2.596
488 H CYS 85 H CYS 85 0.717 11.995 -0.846
489 HA CYS 85 HA CYS 85 2.009 11.973 1.621
490 HB2 CYS 85 2HB CYS 85 3.218 12.208 -1.138
491 HB3 CYS 85 1HB CYS 85 4.067 11.735 0.333
Start of MODEL 18
1 H1 SER 20 1HT SER 20 8.504 -16.724 10.202
2 H2 SER 20 2HT SER 20 9.886 -16.568 9.262
3 H3 SER 20 3HT SER 20 8.449 -17.172 8.576
4 HA SER 20 HA SER 20 8.851 -14.894 7.943
5 HB2 SER 20 2HB SER 20 6.542 -15.249 9.884
6 HB3 SER 20 1HB SER 20 6.624 -14.084 8.562
7 HG SER 20 HG SER 20 6.026 -16.763 8.522
8 H GLU 21 H GLU 21 8.394 -12.561 8.978
9 HA GLU 21 HA GLU 21 10.115 -12.427 11.290
10 HB2 GLU 21 2HB GLU 21 10.668 -11.022 9.349
11 HB3 GLU 21 1HB GLU 21 9.086 -10.266 9.441
12 HG2 GLU 21 2HG GLU 21 9.646 -9.152 11.444
13 HG3 GLU 21 1HG GLU 21 11.110 -10.119 11.651
14 H ALA 22 H ALA 22 9.300 -12.167 13.212
15 HA ALA 22 HA ALA 22 6.591 -12.455 13.737
16 HB1 ALA 22 1HB ALA 22 8.384 -13.068 15.310
17 HB2 ALA 22 2HB ALA 22 7.107 -12.117 16.064
18 HB3 ALA 22 3HB ALA 22 8.643 -11.356 15.647
19 H ALA 23 H ALA 23 8.480 -9.544 14.361
20 HA ALA 23 HA ALA 23 6.167 -7.955 13.666
21 HB1 ALA 23 1HB ALA 23 5.874 -8.351 16.063
22 HB2 ALA 23 2HB ALA 23 6.253 -6.657 15.750
23 HB3 ALA 23 3HB ALA 23 7.498 -7.740 16.368
24 H SER 24 H SER 24 6.701 -5.884 13.079
25 HA SER 24 HA SER 24 9.484 -5.063 13.197
26 HB2 SER 24 2HB SER 24 9.186 -6.279 11.037
27 HB3 SER 24 1HB SER 24 7.841 -5.211 10.649
28 HG SER 24 HG SER 24 10.278 -4.869 10.040
29 H LEU 25 H LEU 25 9.520 -2.926 13.705
30 HA LEU 25 HA LEU 25 7.054 -1.615 14.217
31 HB2 LEU 25 2HB LEU 25 9.867 -0.547 14.262
32 HB3 LEU 25 1HB LEU 25 8.467 0.327 14.845
33 HG LEU 25 HG LEU 25 9.530 -2.254 15.985
34 HD11 LEU 25 1HD1 LEU 25 10.937 -0.338 16.464
35 HD12 LEU 25 2HD1 LEU 25 10.099 -0.899 17.914
36 HD13 LEU 25 3HD1 LEU 25 9.535 0.542 17.070
37 HD21 LEU 25 3HD2 LEU 25 7.114 -2.162 16.221
38 HD22 LEU 25 1HD2 LEU 25 7.221 -0.525 16.871
39 HD23 LEU 25 2HD2 LEU 25 7.885 -1.880 17.777
40 H SER 26 H SER 26 5.829 -0.846 12.769
41 HA SER 26 HA SER 26 6.926 0.480 10.396
42 HB2 SER 26 2HB SER 26 4.631 -1.499 10.457
43 HB3 SER 26 1HB SER 26 5.385 -0.808 9.024
44 HG SER 26 HG SER 26 6.754 -2.385 10.917
45 HA PRO 27 HA PRO 27 3.529 3.296 11.299
46 HB2 PRO 27 2HB PRO 27 2.368 3.724 8.840
47 HB3 PRO 27 1HB PRO 27 3.862 4.503 9.365
48 HG2 PRO 27 2HG PRO 27 3.485 2.104 7.629
49 HG3 PRO 27 1HG PRO 27 4.627 3.444 7.448
50 HD2 PRO 27 2HD PRO 27 5.374 1.064 8.425
51 HD3 PRO 27 1HD PRO 27 6.086 2.580 9.001
52 H LYS 28 H LYS 28 1.024 3.551 10.427
53 HA LYS 28 HA LYS 28 -0.272 1.202 11.434
54 HB2 LYS 28 2HB LYS 28 -1.085 3.462 11.975
55 HB3 LYS 28 1HB LYS 28 -1.363 3.786 10.275
56 HG2 LYS 28 2HG LYS 28 -3.446 3.322 11.442
57 HG3 LYS 28 1HG LYS 28 -3.106 2.084 10.231
58 HD2 LYS 28 2HD LYS 28 -2.203 0.638 12.023
59 HD3 LYS 28 1HD LYS 28 -2.661 1.866 13.208
60 HE2 LYS 28 2HE LYS 28 -4.985 1.643 12.569
61 HE3 LYS 28 1HE LYS 28 -4.544 0.490 11.309
62 HZ1 LYS 28 3HZ LYS 28 -3.699 -0.983 13.071
63 HZ2 LYS 28 1HZ LYS 28 -5.352 -0.664 13.201
64 HZ3 LYS 28 2HZ LYS 28 -4.280 0.102 14.232
65 H LYS 29 H LYS 29 -1.812 -0.131 10.166
66 HA LYS 29 HA LYS 29 -1.184 0.043 7.321
67 HB2 LYS 29 2HB LYS 29 -2.139 -2.380 8.849
68 HB3 LYS 29 1HB LYS 29 -1.740 -2.318 7.144
69 HG2 LYS 29 2HG LYS 29 0.585 -1.740 7.743
70 HG3 LYS 29 1HG LYS 29 0.155 -1.948 9.445
71 HD2 LYS 29 2HD LYS 29 -0.532 -4.267 8.950
72 HD3 LYS 29 1HD LYS 29 -0.001 -4.041 7.284
73 HE2 LYS 29 2HE LYS 29 1.730 -5.178 8.485
74 HE3 LYS 29 1HE LYS 29 2.273 -3.541 8.136
75 HZ1 LYS 29 3HZ LYS 29 1.731 -2.915 10.433
76 HZ2 LYS 29 1HZ LYS 29 2.779 -4.234 10.424
77 HZ3 LYS 29 2HZ LYS 29 1.164 -4.456 10.726
78 H VAL 30 H VAL 30 -2.838 -0.586 5.846
79 HA VAL 30 HA VAL 30 -5.534 0.111 6.750
80 HB VAL 30 HB VAL 30 -4.382 1.600 5.006
81 HG11 VAL 30 1HG1 VAL 30 -4.742 -0.786 3.226
82 HG12 VAL 30 2HG1 VAL 30 -3.220 -0.033 3.705
83 HG13 VAL 30 3HG1 VAL 30 -4.355 0.841 2.672
84 HG21 VAL 30 3HG2 VAL 30 -6.791 1.660 5.289
85 HG22 VAL 30 1HG2 VAL 30 -6.972 0.301 4.180
86 HG23 VAL 30 2HG2 VAL 30 -6.367 1.853 3.591
87 H ASP 31 H ASP 31 -7.261 -1.237 5.477
88 HA ASP 31 HA ASP 31 -6.414 -3.972 5.619
89 HB2 ASP 31 2HB ASP 31 -8.743 -3.231 6.291
90 HB3 ASP 31 1HB ASP 31 -9.085 -2.999 4.580
91 H CYS 32 H CYS 32 -5.268 -4.753 4.157
92 HA CYS 32 HA CYS 32 -5.846 -4.287 1.320
93 HB2 CYS 32 2HB CYS 32 -3.548 -3.751 2.098
94 HB3 CYS 32 1HB CYS 32 -3.397 -5.365 2.761
95 H SER 33 H SER 33 -6.404 -6.269 3.903
96 HA SER 33 HA SER 33 -5.823 -8.858 3.102
97 HB2 SER 33 2HB SER 33 -7.994 -7.900 4.954
98 HB3 SER 33 1HB SER 33 -7.152 -9.455 4.973
99 HG SER 33 HG SER 33 -5.193 -8.195 5.328
100 H ILE 34 H ILE 34 -8.753 -6.872 2.775
101 HA ILE 34 HA ILE 34 -10.305 -8.955 1.642
102 HB ILE 34 HB ILE 34 -11.913 -7.197 0.959
103 HG12 ILE 34 2HG1 ILE 34 -9.878 -5.285 2.153
104 HG13 ILE 34 1HG1 ILE 34 -10.292 -5.404 0.450
105 HG21 ILE 34 1HG2 ILE 34 -10.907 -7.002 3.791
106 HG22 ILE 34 2HG2 ILE 34 -12.053 -8.188 3.163
107 HG23 ILE 34 3HG2 ILE 34 -12.496 -6.480 3.231
108 HD11 ILE 34 3HD1 ILE 34 -11.358 -3.482 1.499
109 HD12 ILE 34 1HD1 ILE 34 -12.146 -4.545 2.664
110 HD13 ILE 34 2HD1 ILE 34 -12.566 -4.647 0.955
111 H TYR 35 H TYR 35 -7.932 -6.912 0.257
112 HA TYR 35 HA TYR 35 -8.951 -7.402 -2.419
113 HB2 TYR 35 2HB TYR 35 -6.588 -5.752 -1.530
114 HB3 TYR 35 1HB TYR 35 -7.130 -5.921 -3.190
115 HD1 TYR 35 1HD TYR 35 -9.510 -5.141 -3.738
116 HD2 TYR 35 2HD TYR 35 -7.475 -4.092 -0.158
117 HE1 TYR 35 1HE TYR 35 -11.032 -3.235 -3.438
118 HE2 TYR 35 2HE TYR 35 -8.987 -2.185 0.150
119 HH TYR 35 HH TYR 35 -10.433 -0.817 -1.051
120 H LYS 36 H LYS 36 -6.607 -8.553 -0.221
121 HA LYS 36 HA LYS 36 -4.837 -9.847 -2.018
122 HB2 LYS 36 2HB LYS 36 -5.561 -10.603 0.821
123 HB3 LYS 36 1HB LYS 36 -4.227 -11.285 -0.095
124 HG2 LYS 36 2HG LYS 36 -3.225 -9.055 -0.232
125 HG3 LYS 36 1HG LYS 36 -4.524 -8.426 0.787
126 HD2 LYS 36 2HD LYS 36 -3.878 -10.027 2.542
127 HD3 LYS 36 1HD LYS 36 -2.547 -10.582 1.532
128 HE2 LYS 36 2HE LYS 36 -1.618 -8.269 1.567
129 HE3 LYS 36 1HE LYS 36 -2.905 -7.816 2.687
130 HZ1 LYS 36 3HZ LYS 36 -0.812 -8.346 3.804
131 HZ2 LYS 36 1HZ LYS 36 -0.854 -9.889 3.155
132 HZ3 LYS 36 2HZ LYS 36 -2.030 -9.408 4.272
133 H LYS 37 H LYS 37 -7.984 -10.403 -1.174
134 HA LYS 37 HA LYS 37 -8.180 -13.217 -1.627
135 HB2 LYS 37 2HB LYS 37 -10.308 -11.065 -1.624
136 HB3 LYS 37 1HB LYS 37 -10.595 -12.802 -1.639
137 HG2 LYS 37 2HG LYS 37 -9.700 -13.069 0.541
138 HG3 LYS 37 1HG LYS 37 -9.081 -11.425 0.556
139 HD2 LYS 37 2HD LYS 37 -11.053 -11.538 1.957
140 HD3 LYS 37 1HD LYS 37 -11.419 -10.580 0.533
141 HE2 LYS 37 2HE LYS 37 -12.161 -13.500 0.812
142 HE3 LYS 37 1HE LYS 37 -13.216 -12.192 1.318
143 HZ1 LYS 37 3HZ LYS 37 -13.838 -12.949 -0.858
144 HZ2 LYS 37 1HZ LYS 37 -12.300 -12.740 -1.474
145 HZ3 LYS 37 2HZ LYS 37 -13.223 -11.413 -1.027
146 H TYR 38 H TYR 38 -7.498 -10.725 -3.695
147 HA TYR 38 HA TYR 38 -8.679 -12.084 -6.024
148 HB2 TYR 38 2HB TYR 38 -7.841 -9.177 -5.745
149 HB3 TYR 38 1HB TYR 38 -8.551 -9.900 -7.180
150 HD1 TYR 38 2HD TYR 38 -10.926 -11.069 -6.660
151 HD2 TYR 38 1HD TYR 38 -9.164 -7.918 -4.426
152 HE1 TYR 38 2HE TYR 38 -13.145 -10.439 -5.810
153 HE2 TYR 38 1HE TYR 38 -11.363 -7.280 -3.567
154 HH TYR 38 HH TYR 38 -13.776 -7.547 -4.303
155 HA PRO 39 HA PRO 39 -4.452 -12.764 -7.239
156 HB2 PRO 39 2HB PRO 39 -4.550 -12.241 -9.951
157 HB3 PRO 39 1HB PRO 39 -5.070 -13.764 -9.223
158 HG2 PRO 39 2HG PRO 39 -6.699 -11.415 -10.078
159 HG3 PRO 39 1HG PRO 39 -7.054 -13.145 -10.258
160 HD2 PRO 39 2HD PRO 39 -8.213 -11.635 -8.354
161 HD3 PRO 39 1HD PRO 39 -7.794 -13.335 -8.072
162 H VAL 40 H VAL 40 -2.599 -11.593 -7.540
163 HA VAL 40 HA VAL 40 -2.606 -8.907 -6.787
164 HB VAL 40 HB VAL 40 -0.346 -10.422 -8.139
165 HG11 VAL 40 1HG1 VAL 40 -0.243 -7.938 -6.430
166 HG12 VAL 40 2HG1 VAL 40 0.081 -8.028 -8.162
167 HG13 VAL 40 3HG1 VAL 40 1.154 -8.836 -7.021
168 HG21 VAL 40 3HG2 VAL 40 0.449 -10.852 -5.858
169 HG22 VAL 40 1HG2 VAL 40 -1.140 -11.564 -6.141
170 HG23 VAL 40 2HG2 VAL 40 -0.996 -10.073 -5.215
171 H VAL 41 H VAL 41 -2.495 -10.277 -10.003
172 HA VAL 41 HA VAL 41 -1.952 -7.708 -11.187
173 HB VAL 41 HB VAL 41 -2.198 -8.783 -13.378
174 HG11 VAL 41 1HG1 VAL 41 -0.458 -10.312 -11.458
175 HG12 VAL 41 2HG1 VAL 41 -0.042 -8.821 -12.300
176 HG13 VAL 41 3HG1 VAL 41 -0.295 -10.308 -13.214
177 HG21 VAL 41 3HG2 VAL 41 -2.527 -11.228 -13.538
178 HG22 VAL 41 1HG2 VAL 41 -3.941 -10.400 -12.887
179 HG23 VAL 41 2HG2 VAL 41 -2.863 -11.279 -11.808
180 H ALA 42 H ALA 42 -4.850 -9.412 -10.345
181 HA ALA 42 HA ALA 42 -6.329 -7.351 -11.787
182 HB1 ALA 42 1HB ALA 42 -6.539 -9.450 -13.040
183 HB2 ALA 42 2HB ALA 42 -8.084 -8.903 -12.396
184 HB3 ALA 42 3HB ALA 42 -7.226 -10.228 -11.614
185 H ILE 43 H ILE 43 -6.704 -6.096 -10.014
186 HA ILE 43 HA ILE 43 -8.451 -7.294 -7.987
187 HB ILE 43 HB ILE 43 -6.425 -5.057 -7.562
188 HG12 ILE 43 2HG1 ILE 43 -6.423 -7.895 -6.493
189 HG13 ILE 43 1HG1 ILE 43 -5.363 -7.278 -7.749
190 HG21 ILE 43 1HG2 ILE 43 -8.428 -4.740 -6.216
191 HG22 ILE 43 2HG2 ILE 43 -7.047 -5.165 -5.209
192 HG23 ILE 43 3HG2 ILE 43 -8.273 -6.380 -5.579
193 HD11 ILE 43 3HD1 ILE 43 -4.212 -7.431 -5.624
194 HD12 ILE 43 1HD1 ILE 43 -5.416 -6.383 -4.875
195 HD13 ILE 43 2HD1 ILE 43 -4.352 -5.749 -6.132
196 HA PRO 44 HA PRO 44 -10.993 -4.028 -9.758
197 HB2 PRO 44 2HB PRO 44 -13.257 -4.545 -8.313
198 HB3 PRO 44 1HB PRO 44 -12.800 -5.477 -9.741
199 HG2 PRO 44 2HG PRO 44 -12.494 -6.159 -6.853
200 HG3 PRO 44 1HG PRO 44 -12.899 -7.209 -8.219
201 HD2 PRO 44 2HD PRO 44 -10.408 -7.056 -7.081
202 HD3 PRO 44 1HD PRO 44 -10.702 -7.546 -8.761
203 H CYS 45 H CYS 45 -11.139 -1.961 -9.113
204 HA CYS 45 HA CYS 45 -10.913 -1.388 -6.247
205 HB2 CYS 45 2HB CYS 45 -9.758 0.071 -8.627
206 HB3 CYS 45 1HB CYS 45 -9.787 0.768 -7.019
207 HA PRO 46 HA PRO 46 -14.679 0.972 -6.646
208 HB2 PRO 46 2HB PRO 46 -14.253 2.787 -4.651
209 HB3 PRO 46 1HB PRO 46 -14.773 1.131 -4.348
210 HG2 PRO 46 2HG PRO 46 -12.046 2.333 -4.143
211 HG3 PRO 46 1HG PRO 46 -12.843 1.148 -3.091
212 HD2 PRO 46 2HD PRO 46 -10.990 0.452 -4.929
213 HD3 PRO 46 1HD PRO 46 -12.334 -0.615 -4.466
214 H ILE 47 H ILE 47 -15.382 3.199 -7.113
215 HA ILE 47 HA ILE 47 -13.340 4.621 -8.628
216 HB ILE 47 HB ILE 47 -15.194 6.000 -9.512
217 HG12 ILE 47 2HG1 ILE 47 -17.008 4.223 -7.848
218 HG13 ILE 47 1HG1 ILE 47 -16.645 5.908 -7.489
219 HG21 ILE 47 1HG2 ILE 47 -14.577 3.970 -10.686
220 HG22 ILE 47 2HG2 ILE 47 -16.316 4.233 -10.804
221 HG23 ILE 47 3HG2 ILE 47 -15.681 3.029 -9.683
222 HD11 ILE 47 3HD1 ILE 47 -18.810 5.695 -8.545
223 HD12 ILE 47 1HD1 ILE 47 -18.081 4.871 -9.926
224 HD13 ILE 47 2HD1 ILE 47 -17.700 6.562 -9.603
225 H THR 48 H THR 48 -14.333 4.606 -5.568
226 HA THR 48 HA THR 48 -14.535 7.328 -4.908
227 HB THR 48 HB THR 48 -13.672 5.023 -3.155
228 HG1 THR 48 1HG THR 48 -16.164 5.129 -2.855
229 HG21 THR 48 3HG2 THR 48 -15.283 7.535 -2.609
230 HG22 THR 48 1HG2 THR 48 -13.599 7.283 -2.156
231 HG23 THR 48 2HG2 THR 48 -14.862 6.299 -1.421
232 H TYR 49 H TYR 49 -12.914 8.748 -4.630
233 HA TYR 49 HA TYR 49 -10.187 7.791 -4.870
234 HB2 TYR 49 2HB TYR 49 -10.941 9.609 -6.405
235 HB3 TYR 49 1HB TYR 49 -11.246 10.630 -5.006
236 HD1 TYR 49 1HD TYR 49 -8.607 8.959 -6.965
237 HD2 TYR 49 2HD TYR 49 -9.440 11.781 -3.896
238 HE1 TYR 49 1HE TYR 49 -6.267 9.704 -7.025
239 HE2 TYR 49 2HE TYR 49 -7.099 12.534 -3.945
240 HH TYR 49 HH TYR 49 -4.951 11.612 -6.445
241 H LEU 50 H LEU 50 -9.448 7.248 -2.998
242 HA LEU 50 HA LEU 50 -9.872 9.024 -0.705
243 HB2 LEU 50 2HB LEU 50 -9.294 6.052 -0.709
244 HB3 LEU 50 1HB LEU 50 -9.471 7.053 0.713
245 HG LEU 50 HG LEU 50 -11.673 6.470 -1.271
246 HD11 LEU 50 1HD1 LEU 50 -12.605 5.072 0.480
247 HD12 LEU 50 2HD1 LEU 50 -11.192 5.374 1.493
248 HD13 LEU 50 3HD1 LEU 50 -11.020 4.486 -0.023
249 HD21 LEU 50 3HD2 LEU 50 -13.127 7.463 0.413
250 HD22 LEU 50 1HD2 LEU 50 -11.934 8.627 -0.157
251 HD23 LEU 50 2HD2 LEU 50 -11.728 7.847 1.413
252 HA PRO 51 HA PRO 51 -5.518 9.357 -1.966
253 HB2 PRO 51 2HB PRO 51 -4.976 11.436 -0.209
254 HB3 PRO 51 1HB PRO 51 -5.509 11.658 -1.871
255 HG2 PRO 51 2HG PRO 51 -7.058 11.804 0.659
256 HG3 PRO 51 1HG PRO 51 -7.259 12.726 -0.840
257 HD2 PRO 51 2HD PRO 51 -8.903 10.688 -0.132
258 HD3 PRO 51 1HD PRO 51 -8.536 11.080 -1.824
259 H VAL 52 H VAL 52 -4.130 8.002 -1.151
260 HA VAL 52 HA VAL 52 -3.663 8.000 1.725
261 HB VAL 52 HB VAL 52 -3.270 5.537 1.714
262 HG11 VAL 52 1HG1 VAL 52 -5.597 4.783 1.650
263 HG12 VAL 52 2HG1 VAL 52 -6.053 6.278 0.832
264 HG13 VAL 52 3HG1 VAL 52 -5.432 6.331 2.480
265 HG21 VAL 52 3HG2 VAL 52 -4.386 5.653 -1.085
266 HG22 VAL 52 1HG2 VAL 52 -4.126 4.168 -0.159
267 HG23 VAL 52 2HG2 VAL 52 -2.755 5.187 -0.592
268 H CYS 53 H CYS 53 -1.504 7.459 2.279
269 HA CYS 53 HA CYS 53 0.313 7.782 0.008
270 HB2 CYS 53 2HB CYS 53 0.239 9.775 1.431
271 HB3 CYS 53 1HB CYS 53 0.625 8.835 2.838
272 H GLY 54 H GLY 54 1.802 6.307 -0.230
273 HA2 GLY 54 2HA GLY 54 1.903 4.155 1.724
274 HA3 GLY 54 1HA GLY 54 2.521 4.093 0.079
275 H SER 55 H SER 55 3.981 3.202 2.218
276 HA SER 55 HA SER 55 5.800 4.815 3.474
277 HB2 SER 55 2HB SER 55 6.555 2.189 2.238
278 HB3 SER 55 1HB SER 55 7.046 2.853 3.797
279 HG SER 55 HG SER 55 5.383 1.931 4.631
280 H ASP 56 H ASP 56 5.624 4.014 0.133
281 HA ASP 56 HA ASP 56 8.391 4.610 -0.503
282 HB2 ASP 56 2HB ASP 56 7.049 2.757 -1.586
283 HB3 ASP 56 1HB ASP 56 6.108 3.998 -2.394
284 H TYR 57 H TYR 57 5.976 6.480 0.345
285 HA TYR 57 HA TYR 57 5.471 8.644 0.266
286 HB2 TYR 57 2HB TYR 57 8.043 8.945 -1.317
287 HB3 TYR 57 1HB TYR 57 7.148 10.255 -0.557
288 HD1 TYR 57 2HD TYR 57 6.800 10.099 2.007
289 HD2 TYR 57 1HD TYR 57 9.695 7.821 -0.115
290 HE1 TYR 57 2HE TYR 57 8.019 9.696 4.109
291 HE2 TYR 57 1HE TYR 57 10.912 7.409 1.969
292 HH TYR 57 HH TYR 57 11.166 8.387 4.163
293 H ILE 58 H ILE 58 4.486 6.888 -1.650
294 HA ILE 58 HA ILE 58 3.924 8.674 -3.912
295 HB ILE 58 HB ILE 58 3.536 5.668 -3.699
296 HG12 ILE 58 2HG1 ILE 58 5.905 6.229 -3.890
297 HG13 ILE 58 1HG1 ILE 58 5.331 5.483 -5.374
298 HG21 ILE 58 1HG2 ILE 58 2.991 5.731 -6.081
299 HG22 ILE 58 2HG2 ILE 58 3.111 7.491 -6.062
300 HG23 ILE 58 3HG2 ILE 58 1.853 6.684 -5.127
301 HD11 ILE 58 3HD1 ILE 58 5.848 8.405 -4.905
302 HD12 ILE 58 1HD1 ILE 58 5.166 7.728 -6.387
303 HD13 ILE 58 2HD1 ILE 58 6.800 7.296 -5.890
304 H THR 59 H THR 59 1.912 9.466 -4.014
305 HA THR 59 HA THR 59 -0.039 8.646 -2.081
306 HB THR 59 HB THR 59 -0.142 10.731 -4.277
307 HG1 THR 59 1HG THR 59 1.244 10.684 -2.162
308 HG21 THR 59 3HG2 THR 59 -1.981 10.236 -1.917
309 HG22 THR 59 1HG2 THR 59 -2.395 10.033 -3.615
310 HG23 THR 59 2HG2 THR 59 -2.067 11.646 -2.978
311 H TYR 60 H TYR 60 -1.726 7.439 -2.505
312 HA TYR 60 HA TYR 60 -2.060 6.428 -5.232
313 HB2 TYR 60 2HB TYR 60 -2.569 5.052 -2.595
314 HB3 TYR 60 1HB TYR 60 -2.992 4.361 -4.167
315 HD1 TYR 60 1HD TYR 60 -1.192 3.685 -5.727
316 HD2 TYR 60 2HD TYR 60 -0.314 5.069 -1.807
317 HE1 TYR 60 1HE TYR 60 1.095 2.807 -5.929
318 HE2 TYR 60 2HE TYR 60 1.967 4.184 -1.999
319 HH TYR 60 HH TYR 60 3.223 3.115 -5.001
320 H GLY 61 H GLY 61 -4.150 6.037 -5.947
321 HA2 GLY 61 2HA GLY 61 -5.918 8.155 -5.287
322 HA3 GLY 61 1HA GLY 61 -6.218 6.893 -6.466
323 H ASN 62 H ASN 62 -5.625 5.078 -3.967
324 HA ASN 62 HA ASN 62 -7.443 5.480 -2.010
325 HB2 ASN 62 2HB ASN 62 -9.233 3.794 -2.465
326 HB3 ASN 62 1HB ASN 62 -9.311 5.164 -3.551
327 HD21 ASN 62 1HD2 ASN 62 -10.465 4.088 -5.037
328 HD22 ASN 62 2HD2 ASN 62 -9.850 2.839 -6.049
329 H GLU 63 H GLU 63 -7.964 3.301 -0.911
330 HA GLU 63 HA GLU 63 -5.411 2.270 -0.376
331 HB2 GLU 63 2HB GLU 63 -6.876 0.664 1.141
332 HB3 GLU 63 1HB GLU 63 -6.550 2.334 1.569
333 HG2 GLU 63 2HG GLU 63 -8.876 1.737 1.976
334 HG3 GLU 63 1HG GLU 63 -8.747 2.997 0.763
335 H CYS 64 H CYS 64 -8.041 1.118 -2.285
336 HA CYS 64 HA CYS 64 -7.210 -1.501 -2.697
337 HB2 CYS 64 2HB CYS 64 -9.337 -0.668 -3.582
338 HB3 CYS 64 1HB CYS 64 -8.479 0.380 -4.709
339 H HIS 65 H HIS 65 -6.282 1.429 -4.496
340 HA HIS 65 HA HIS 65 -4.434 0.088 -6.193
341 HB2 HIS 65 2HB HIS 65 -4.581 3.022 -5.475
342 HB3 HIS 65 1HB HIS 65 -3.425 2.368 -6.627
343 HD1 HIS 65 1HD HIS 65 -4.697 1.002 -8.708
344 HD2 HIS 65 2HD HIS 65 -6.877 3.845 -6.617
345 HE1 HIS 65 1HE HIS 65 -6.635 1.570 -10.167
346 HE2 HIS 65 2HE HIS 65 -8.038 3.117 -8.797
347 H LEU 66 H LEU 66 -4.091 1.585 -3.079
348 HA LEU 66 HA LEU 66 -1.286 1.377 -2.874
349 HB2 LEU 66 2HB LEU 66 -2.507 2.763 -1.328
350 HB3 LEU 66 1HB LEU 66 -3.455 1.398 -0.783
351 HG LEU 66 HG LEU 66 -1.482 0.433 0.307
352 HD11 LEU 66 1HD1 LEU 66 0.261 1.289 -1.157
353 HD12 LEU 66 2HD1 LEU 66 0.580 1.728 0.521
354 HD13 LEU 66 3HD1 LEU 66 -0.058 2.932 -0.598
355 HD21 LEU 66 3HD2 LEU 66 -1.274 2.055 2.086
356 HD22 LEU 66 1HD2 LEU 66 -2.944 1.935 1.542
357 HD23 LEU 66 2HD2 LEU 66 -1.953 3.309 1.047
358 H CYS 67 H CYS 67 -3.909 -0.796 -1.925
359 HA CYS 67 HA CYS 67 -2.332 -2.820 -0.847
360 HB2 CYS 67 2HB CYS 67 -4.728 -2.698 -0.449
361 HB3 CYS 67 1HB CYS 67 -5.053 -2.964 -2.156
362 H THR 68 H THR 68 -3.578 -2.406 -4.182
363 HA THR 68 HA THR 68 -2.578 -4.735 -5.307
364 HB THR 68 HB THR 68 -2.650 -2.020 -6.657
365 HG1 THR 68 1HG THR 68 -4.706 -3.819 -5.940
366 HG21 THR 68 3HG2 THR 68 -3.096 -3.337 -8.692
367 HG22 THR 68 1HG2 THR 68 -2.983 -4.826 -7.754
368 HG23 THR 68 2HG2 THR 68 -1.562 -3.806 -7.961
369 H GLU 69 H GLU 69 -1.015 -1.563 -4.920
370 HA GLU 69 HA GLU 69 1.415 -2.196 -6.218
371 HB2 GLU 69 2HB GLU 69 0.361 0.076 -5.636
372 HB3 GLU 69 1HB GLU 69 1.056 -0.158 -4.046
373 HG2 GLU 69 2HG GLU 69 2.553 1.195 -5.223
374 HG3 GLU 69 1HG GLU 69 3.286 -0.410 -5.180
375 H SER 70 H SER 70 0.283 -2.321 -2.888
376 HA SER 70 HA SER 70 2.713 -2.800 -1.582
377 HB2 SER 70 2HB SER 70 0.512 -2.092 -0.520
378 HB3 SER 70 1HB SER 70 -0.021 -3.759 -0.700
379 HG SER 70 HG SER 70 2.169 -2.768 0.755
380 H LEU 71 H LEU 71 0.253 -5.003 -2.862
381 HA LEU 71 HA LEU 71 1.600 -7.391 -2.106
382 HB2 LEU 71 2HB LEU 71 -0.447 -6.936 -4.276
383 HB3 LEU 71 1HB LEU 71 0.047 -8.501 -3.660
384 HG LEU 71 HG LEU 71 -1.406 -6.366 -2.112
385 HD11 LEU 71 1HD1 LEU 71 -2.329 -9.039 -3.151
386 HD12 LEU 71 2HD1 LEU 71 -2.802 -7.458 -3.772
387 HD13 LEU 71 3HD1 LEU 71 -3.272 -7.939 -2.142
388 HD21 LEU 71 3HD2 LEU 71 -0.585 -9.152 -1.286
389 HD22 LEU 71 1HD2 LEU 71 -1.572 -8.025 -0.357
390 HD23 LEU 71 2HD2 LEU 71 0.112 -7.641 -0.687
391 H LYS 72 H LYS 72 1.385 -5.528 -5.046
392 HA LYS 72 HA LYS 72 2.867 -7.045 -6.812
393 HB2 LYS 72 2HB LYS 72 1.585 -5.074 -7.403
394 HB3 LYS 72 1HB LYS 72 2.676 -4.064 -6.481
395 HG2 LYS 72 2HG LYS 72 4.479 -4.651 -8.077
396 HG3 LYS 72 1HG LYS 72 3.277 -5.537 -9.030
397 HD2 LYS 72 2HD LYS 72 1.944 -3.517 -9.256
398 HD3 LYS 72 1HD LYS 72 3.101 -2.626 -8.278
399 HE2 LYS 72 2HE LYS 72 4.824 -3.065 -9.990
400 HE3 LYS 72 1HE LYS 72 3.596 -3.856 -10.979
401 HZ1 LYS 72 3HZ LYS 72 2.332 -1.745 -10.924
402 HZ2 LYS 72 1HZ LYS 72 3.835 -1.563 -11.664
403 HZ3 LYS 72 2HZ LYS 72 3.581 -1.037 -10.089
404 H SER 73 H SER 73 3.969 -4.639 -4.459
405 HA SER 73 HA SER 73 6.752 -5.103 -5.200
406 HB2 SER 73 2HB SER 73 5.738 -3.234 -3.067
407 HB3 SER 73 1HB SER 73 7.239 -3.160 -3.985
408 HG SER 73 HG SER 73 4.616 -2.711 -4.922
409 H ASN 74 H ASN 74 4.652 -6.636 -3.346
410 HA ASN 74 HA ASN 74 4.496 -7.787 -1.464
411 HB2 ASN 74 2HB ASN 74 5.905 -9.278 -2.828
412 HB3 ASN 74 1HB ASN 74 7.345 -8.575 -2.095
413 HD21 ASN 74 1HD2 ASN 74 8.032 -10.414 -1.127
414 HD22 ASN 74 2HD2 ASN 74 7.234 -11.163 0.201
415 H GLY 75 H GLY 75 4.323 -5.870 -0.235
416 HA2 GLY 75 2HA GLY 75 4.509 -5.133 1.950
417 HA3 GLY 75 1HA GLY 75 5.838 -6.242 2.193
418 H ARG 76 H ARG 76 6.783 -4.554 -0.410
419 HA ARG 76 HA ARG 76 8.676 -2.931 0.854
420 HB2 ARG 76 2HB ARG 76 8.950 -3.540 -1.475
421 HB3 ARG 76 1HB ARG 76 7.459 -2.724 -1.888
422 HG2 ARG 76 2HG ARG 76 8.453 -0.573 -1.274
423 HG3 ARG 76 1HG ARG 76 9.971 -1.395 -0.927
424 HD2 ARG 76 2HD ARG 76 10.306 -1.953 -3.186
425 HD3 ARG 76 1HD ARG 76 8.627 -1.603 -3.602
426 HE ARG 76 HE ARG 76 9.704 0.723 -2.613
427 HH11 ARG 76 1HH1 ARG 76 10.512 -1.384 -5.355
428 HH12 ARG 76 2HH1 ARG 76 10.833 -0.086 -6.402
429 HH21 ARG 76 1HH2 ARG 76 10.099 2.477 -4.068
430 HH22 ARG 76 2HH2 ARG 76 10.594 2.142 -5.662
431 H VAL 77 H VAL 77 5.686 -1.926 -0.757
432 HA VAL 77 HA VAL 77 5.814 0.539 0.769
433 HB VAL 77 HB VAL 77 5.741 0.959 -1.633
434 HG11 VAL 77 1HG1 VAL 77 3.200 -0.648 -1.716
435 HG12 VAL 77 2HG1 VAL 77 4.753 -1.110 -2.407
436 HG13 VAL 77 3HG1 VAL 77 3.879 0.279 -3.055
437 HG21 VAL 77 3HG2 VAL 77 3.071 1.567 -0.372
438 HG22 VAL 77 1HG2 VAL 77 3.728 2.357 -1.804
439 HG23 VAL 77 2HG2 VAL 77 4.533 2.548 -0.247
440 H GLN 78 H GLN 78 4.444 0.807 2.398
441 HA GLN 78 HA GLN 78 2.030 -0.813 2.439
442 HB2 GLN 78 2HB GLN 78 3.806 -0.087 4.797
443 HB3 GLN 78 1HB GLN 78 2.328 -1.037 4.875
444 HG2 GLN 78 2HG GLN 78 3.382 -2.769 3.482
445 HG3 GLN 78 1HG GLN 78 4.861 -1.823 3.449
446 HE21 GLN 78 1HE2 GLN 78 6.051 -3.408 4.370
447 HE22 GLN 78 2HE2 GLN 78 5.926 -3.876 6.029
448 H PHE 79 H PHE 79 0.698 0.314 4.395
449 HA PHE 79 HA PHE 79 0.059 2.934 3.455
450 HB2 PHE 79 2HB PHE 79 -1.617 1.346 4.367
451 HB3 PHE 79 1HB PHE 79 -0.805 1.401 5.917
452 HD1 PHE 79 1HD PHE 79 -2.847 3.358 3.542
453 HD2 PHE 79 2HD PHE 79 -1.280 3.106 7.484
454 HE1 PHE 79 1HE PHE 79 -4.371 5.144 4.271
455 HE2 PHE 79 2HE PHE 79 -2.791 4.883 8.212
456 HZ PHE 79 HZ PHE 79 -4.338 5.899 6.625
457 H LEU 80 H LEU 80 1.114 4.720 4.032
458 HA LEU 80 HA LEU 80 2.874 4.631 6.367
459 HB2 LEU 80 2HB LEU 80 3.787 5.355 4.197
460 HB3 LEU 80 1HB LEU 80 2.626 6.652 4.122
461 HG LEU 80 HG LEU 80 3.691 7.585 6.200
462 HD11 LEU 80 1HD1 LEU 80 5.787 5.527 5.567
463 HD12 LEU 80 2HD1 LEU 80 4.788 5.608 7.026
464 HD13 LEU 80 3HD1 LEU 80 5.975 6.869 6.691
465 HD21 LEU 80 3HD2 LEU 80 5.386 7.319 3.724
466 HD22 LEU 80 1HD2 LEU 80 5.580 8.546 4.982
467 HD23 LEU 80 2HD2 LEU 80 4.107 8.503 4.010
468 H HIS 81 H HIS 81 0.484 6.751 4.819
469 HA HIS 81 HA HIS 81 -0.916 7.170 7.227
470 HB2 HIS 81 2HB HIS 81 -0.698 9.640 7.335
471 HB3 HIS 81 1HB HIS 81 0.862 8.882 7.593
472 HD1 HIS 81 1HD HIS 81 -0.985 11.143 5.245
473 HD2 HIS 81 2HD HIS 81 2.762 9.376 5.570
474 HE1 HIS 81 1HE HIS 81 0.485 12.284 3.524
475 HE2 HIS 81 2HE HIS 81 2.773 11.435 4.040
476 H ASP 82 H ASP 82 -2.936 8.380 6.694
477 HA ASP 82 HA ASP 82 -3.554 7.863 3.920
478 HB2 ASP 82 2HB ASP 82 -5.837 8.199 4.422
479 HB3 ASP 82 1HB ASP 82 -5.218 7.426 5.867
480 H GLY 83 H GLY 83 -4.726 9.567 2.695
481 HA2 GLY 83 2HA GLY 83 -4.970 11.748 2.049
482 HA3 GLY 83 1HA GLY 83 -3.878 12.236 3.356
483 H SER 84 H SER 84 -3.500 13.264 0.852
484 HA SER 84 HA SER 84 -1.654 11.843 -0.684
485 HB2 SER 84 2HB SER 84 -1.968 14.808 -0.277
486 HB3 SER 84 1HB SER 84 -1.199 14.028 -1.673
487 HG SER 84 HG SER 84 -3.105 13.674 -2.485
488 H CYS 85 H CYS 85 0.620 12.119 -0.749
489 HA CYS 85 HA CYS 85 1.821 11.988 1.792
490 HB2 CYS 85 2HB CYS 85 3.156 12.305 -0.911
491 HB3 CYS 85 1HB CYS 85 3.925 11.787 0.593
Start of MODEL 19
1 H1 SER 20 1HT SER 20 -12.310 9.791 7.984
2 H2 SER 20 2HT SER 20 -13.778 10.668 7.888
3 H3 SER 20 3HT SER 20 -12.872 10.323 6.496
4 HA SER 20 HA SER 20 -14.811 8.920 6.712
5 HB2 SER 20 2HB SER 20 -12.125 7.546 6.796
6 HB3 SER 20 1HB SER 20 -13.582 6.972 5.985
7 HG SER 20 HG SER 20 -11.731 8.366 4.901
8 H GLU 21 H GLU 21 -13.521 9.585 9.591
9 HA GLU 21 HA GLU 21 -14.730 7.432 10.970
10 HB2 GLU 21 2HB GLU 21 -12.643 6.895 12.232
11 HB3 GLU 21 1HB GLU 21 -12.558 6.415 10.551
12 HG2 GLU 21 2HG GLU 21 -11.277 8.914 11.680
13 HG3 GLU 21 1HG GLU 21 -10.445 7.384 11.453
14 H ALA 22 H ALA 22 -15.181 8.093 13.057
15 HA ALA 22 HA ALA 22 -14.807 10.922 13.556
16 HB1 ALA 22 1HB ALA 22 -17.017 9.941 13.977
17 HB2 ALA 22 2HB ALA 22 -16.313 10.554 15.471
18 HB3 ALA 22 3HB ALA 22 -16.305 8.822 15.142
19 H ALA 23 H ALA 23 -14.172 7.828 15.066
20 HA ALA 23 HA ALA 23 -11.663 8.741 16.115
21 HB1 ALA 23 1HB ALA 23 -12.201 8.083 18.421
22 HB2 ALA 23 2HB ALA 23 -13.876 7.803 17.951
23 HB3 ALA 23 3HB ALA 23 -13.201 9.433 17.889
24 H SER 24 H SER 24 -10.604 7.112 15.011
25 HA SER 24 HA SER 24 -11.682 4.445 15.109
26 HB2 SER 24 2HB SER 24 -10.549 5.322 13.034
27 HB3 SER 24 1HB SER 24 -9.043 5.406 13.948
28 HG SER 24 HG SER 24 -8.807 3.313 13.775
29 H LEU 25 H LEU 25 -11.246 3.112 16.692
30 HA LEU 25 HA LEU 25 -9.456 3.923 18.780
31 HB2 LEU 25 2HB LEU 25 -11.098 1.422 18.472
32 HB3 LEU 25 1HB LEU 25 -10.227 1.874 19.921
33 HG LEU 25 HG LEU 25 -12.573 3.351 18.719
34 HD11 LEU 25 1HD1 LEU 25 -13.176 1.261 19.781
35 HD12 LEU 25 2HD1 LEU 25 -13.745 2.638 20.727
36 HD13 LEU 25 3HD1 LEU 25 -12.317 1.740 21.243
37 HD21 LEU 25 3HD2 LEU 25 -10.996 3.922 21.230
38 HD22 LEU 25 1HD2 LEU 25 -12.487 4.731 20.747
39 HD23 LEU 25 2HD2 LEU 25 -11.033 4.918 19.772
40 H SER 26 H SER 26 -9.334 1.961 16.079
41 HA SER 26 HA SER 26 -6.845 0.758 16.973
42 HB2 SER 26 2HB SER 26 -7.255 -0.702 14.900
43 HB3 SER 26 1HB SER 26 -8.323 -0.940 16.284
44 HG SER 26 HG SER 26 -9.930 -0.300 15.157
45 HA PRO 27 HA PRO 27 -4.860 3.605 14.072
46 HB2 PRO 27 2HB PRO 27 -2.486 1.911 14.374
47 HB3 PRO 27 1HB PRO 27 -2.703 3.595 14.855
48 HG2 PRO 27 2HG PRO 27 -2.482 1.576 16.652
49 HG3 PRO 27 1HG PRO 27 -3.417 3.048 16.953
50 HD2 PRO 27 2HD PRO 27 -4.356 0.328 16.178
51 HD3 PRO 27 1HD PRO 27 -5.071 1.506 17.304
52 H LYS 28 H LYS 28 -5.754 3.059 12.154
53 HA LYS 28 HA LYS 28 -5.498 0.375 11.211
54 HB2 LYS 28 2HB LYS 28 -6.943 2.686 9.940
55 HB3 LYS 28 1HB LYS 28 -7.019 1.013 9.406
56 HG2 LYS 28 2HG LYS 28 -7.883 0.487 11.760
57 HG3 LYS 28 1HG LYS 28 -8.084 2.221 11.932
58 HD2 LYS 28 2HD LYS 28 -9.542 2.274 9.971
59 HD3 LYS 28 1HD LYS 28 -9.340 0.533 9.779
60 HE2 LYS 28 2HE LYS 28 -10.613 1.939 12.127
61 HE3 LYS 28 1HE LYS 28 -11.449 1.032 10.872
62 HZ1 LYS 28 3HZ LYS 28 -10.174 -0.991 11.687
63 HZ2 LYS 28 1HZ LYS 28 -11.243 -0.328 12.817
64 HZ3 LYS 28 2HZ LYS 28 -9.620 -0.038 12.959
65 H LYS 29 H LYS 29 -4.608 -0.344 9.499
66 HA LYS 29 HA LYS 29 -2.747 1.307 7.944
67 HB2 LYS 29 2HB LYS 29 -2.772 -1.691 8.462
68 HB3 LYS 29 1HB LYS 29 -1.604 -0.837 7.481
69 HG2 LYS 29 2HG LYS 29 -1.878 -0.211 10.404
70 HG3 LYS 29 1HG LYS 29 -0.971 -1.617 9.875
71 HD2 LYS 29 2HD LYS 29 0.612 0.115 10.204
72 HD3 LYS 29 1HD LYS 29 0.430 -0.051 8.470
73 HE2 LYS 29 2HE LYS 29 0.560 2.275 9.124
74 HE3 LYS 29 1HE LYS 29 -1.016 1.903 8.438
75 HZ1 LYS 29 3HZ LYS 29 -0.455 2.045 11.354
76 HZ2 LYS 29 1HZ LYS 29 -1.966 1.886 10.646
77 HZ3 LYS 29 2HZ LYS 29 -1.111 3.315 10.480
78 H VAL 30 H VAL 30 -2.588 0.045 5.653
79 HA VAL 30 HA VAL 30 -5.247 0.106 4.642
80 HB VAL 30 HB VAL 30 -3.427 0.817 3.157
81 HG11 VAL 30 1HG1 VAL 30 -1.630 -0.613 3.978
82 HG12 VAL 30 2HG1 VAL 30 -1.793 -0.753 2.229
83 HG13 VAL 30 3HG1 VAL 30 -2.423 -2.022 3.277
84 HG21 VAL 30 3HG2 VAL 30 -3.981 -0.427 1.148
85 HG22 VAL 30 1HG2 VAL 30 -5.418 -0.151 2.130
86 HG23 VAL 30 2HG2 VAL 30 -4.646 -1.738 2.122
87 H ASP 31 H ASP 31 -6.693 -1.511 4.526
88 HA ASP 31 HA ASP 31 -5.801 -4.153 5.323
89 HB2 ASP 31 2HB ASP 31 -8.064 -3.241 6.081
90 HB3 ASP 31 1HB ASP 31 -8.588 -3.370 4.404
91 H CYS 32 H CYS 32 -4.664 -5.006 3.791
92 HA CYS 32 HA CYS 32 -5.629 -4.819 1.054
93 HB2 CYS 32 2HB CYS 32 -3.241 -4.264 1.664
94 HB3 CYS 32 1HB CYS 32 -3.027 -5.948 2.113
95 H SER 33 H SER 33 -6.031 -6.710 3.703
96 HA SER 33 HA SER 33 -5.617 -9.302 2.676
97 HB2 SER 33 2HB SER 33 -5.559 -8.804 5.098
98 HB3 SER 33 1HB SER 33 -7.268 -8.388 5.050
99 HG SER 33 HG SER 33 -6.007 -10.865 4.911
100 H ILE 34 H ILE 34 -8.428 -7.161 2.971
101 HA ILE 34 HA ILE 34 -10.306 -9.037 2.010
102 HB ILE 34 HB ILE 34 -11.790 -7.095 1.544
103 HG12 ILE 34 2HG1 ILE 34 -9.436 -5.447 2.520
104 HG13 ILE 34 1HG1 ILE 34 -10.055 -5.471 0.877
105 HG21 ILE 34 1HG2 ILE 34 -10.450 -7.100 4.237
106 HG22 ILE 34 2HG2 ILE 34 -11.785 -8.135 3.728
107 HG23 ILE 34 3HG2 ILE 34 -12.025 -6.393 3.881
108 HD11 ILE 34 3HD1 ILE 34 -11.533 -4.492 3.313
109 HD12 ILE 34 1HD1 ILE 34 -12.159 -4.505 1.663
110 HD13 ILE 34 2HD1 ILE 34 -10.779 -3.488 2.077
111 H TYR 35 H TYR 35 -7.892 -7.363 0.337
112 HA TYR 35 HA TYR 35 -9.314 -7.701 -2.185
113 HB2 TYR 35 2HB TYR 35 -6.898 -6.043 -1.502
114 HB3 TYR 35 1HB TYR 35 -7.489 -6.285 -3.141
115 HD1 TYR 35 2HD TYR 35 -10.021 -5.703 -3.500
116 HD2 TYR 35 1HD TYR 35 -7.662 -4.194 -0.298
117 HE1 TYR 35 2HE TYR 35 -11.603 -3.854 -3.223
118 HE2 TYR 35 1HE TYR 35 -9.249 -2.330 -0.010
119 HH TYR 35 HH TYR 35 -12.307 -2.354 -1.418
120 H LYS 36 H LYS 36 -7.017 -9.244 -0.305
121 HA LYS 36 HA LYS 36 -5.205 -10.198 -2.242
122 HB2 LYS 36 2HB LYS 36 -5.986 -11.372 0.416
123 HB3 LYS 36 1HB LYS 36 -4.726 -12.052 -0.599
124 HG2 LYS 36 2HG LYS 36 -3.502 -9.923 -0.451
125 HG3 LYS 36 1HG LYS 36 -4.753 -9.302 0.625
126 HD2 LYS 36 2HD LYS 36 -4.268 -11.134 2.201
127 HD3 LYS 36 1HD LYS 36 -2.987 -11.695 1.127
128 HE2 LYS 36 2HE LYS 36 -1.851 -9.521 1.382
129 HE3 LYS 36 1HE LYS 36 -3.112 -9.013 2.502
130 HZ1 LYS 36 3HZ LYS 36 -1.218 -11.278 2.921
131 HZ2 LYS 36 1HZ LYS 36 -2.460 -10.830 3.974
132 HZ3 LYS 36 2HZ LYS 36 -1.195 -9.791 3.707
133 H LYS 37 H LYS 37 -8.413 -10.987 -1.802
134 HA LYS 37 HA LYS 37 -8.332 -13.713 -2.634
135 HB2 LYS 37 2HB LYS 37 -10.612 -11.734 -2.538
136 HB3 LYS 37 1HB LYS 37 -10.815 -13.376 -3.112
137 HG2 LYS 37 2HG LYS 37 -11.561 -13.308 -0.863
138 HG3 LYS 37 1HG LYS 37 -10.025 -14.168 -0.866
139 HD2 LYS 37 2HD LYS 37 -8.911 -12.077 -0.112
140 HD3 LYS 37 1HD LYS 37 -10.493 -11.298 -0.035
141 HE2 LYS 37 2HE LYS 37 -11.224 -13.008 1.593
142 HE3 LYS 37 1HE LYS 37 -9.613 -13.716 1.519
143 HZ1 LYS 37 3HZ LYS 37 -8.727 -11.594 2.361
144 HZ2 LYS 37 1HZ LYS 37 -9.807 -12.312 3.442
145 HZ3 LYS 37 2HZ LYS 37 -10.308 -11.015 2.523
146 H TYR 38 H TYR 38 -8.051 -10.785 -4.286
147 HA TYR 38 HA TYR 38 -8.850 -11.884 -6.887
148 HB2 TYR 38 2HB TYR 38 -7.965 -9.106 -6.038
149 HB3 TYR 38 1HB TYR 38 -8.530 -9.518 -7.645
150 HD1 TYR 38 1HD TYR 38 -10.950 -10.296 -7.875
151 HD2 TYR 38 2HD TYR 38 -9.434 -8.475 -4.346
152 HE1 TYR 38 1HE TYR 38 -13.243 -9.727 -7.186
153 HE2 TYR 38 2HE TYR 38 -11.714 -7.904 -3.647
154 HH TYR 38 HH TYR 38 -13.881 -7.567 -4.627
155 HA PRO 39 HA PRO 39 -4.598 -12.479 -8.359
156 HB2 PRO 39 2HB PRO 39 -4.516 -10.609 -10.470
157 HB3 PRO 39 1HB PRO 39 -4.925 -12.319 -10.607
158 HG2 PRO 39 2HG PRO 39 -6.699 -9.947 -10.453
159 HG3 PRO 39 1HG PRO 39 -6.950 -11.478 -11.303
160 HD2 PRO 39 2HD PRO 39 -8.258 -10.887 -9.035
161 HD3 PRO 39 1HD PRO 39 -7.728 -12.537 -9.385
162 H VAL 40 H VAL 40 -2.516 -11.337 -8.587
163 HA VAL 40 HA VAL 40 -2.291 -9.474 -6.443
164 HB VAL 40 HB VAL 40 -0.157 -10.446 -8.369
165 HG11 VAL 40 1HG1 VAL 40 0.551 -8.416 -7.272
166 HG12 VAL 40 2HG1 VAL 40 1.457 -9.800 -6.655
167 HG13 VAL 40 3HG1 VAL 40 0.149 -9.105 -5.699
168 HG21 VAL 40 3HG2 VAL 40 0.455 -12.023 -6.596
169 HG22 VAL 40 1HG2 VAL 40 -1.194 -12.285 -7.165
170 HG23 VAL 40 2HG2 VAL 40 -0.909 -11.460 -5.631
171 H VAL 41 H VAL 41 -1.921 -9.155 -9.952
172 HA VAL 41 HA VAL 41 -1.361 -6.325 -9.489
173 HB VAL 41 HB VAL 41 -0.763 -6.125 -11.869
174 HG11 VAL 41 1HG1 VAL 41 1.301 -7.467 -11.775
175 HG12 VAL 41 2HG1 VAL 41 0.638 -8.333 -10.385
176 HG13 VAL 41 3HG1 VAL 41 0.971 -6.608 -10.270
177 HG21 VAL 41 3HG2 VAL 41 -0.515 -8.148 -13.256
178 HG22 VAL 41 1HG2 VAL 41 -2.198 -7.864 -12.811
179 HG23 VAL 41 2HG2 VAL 41 -1.264 -9.104 -11.978
180 H ALA 42 H ALA 42 -4.038 -8.197 -10.223
181 HA ALA 42 HA ALA 42 -5.328 -5.807 -11.310
182 HB1 ALA 42 1HB ALA 42 -6.757 -7.200 -12.701
183 HB2 ALA 42 2HB ALA 42 -5.933 -8.645 -12.113
184 HB3 ALA 42 3HB ALA 42 -5.055 -7.462 -13.081
185 H ILE 43 H ILE 43 -6.157 -5.151 -9.411
186 HA ILE 43 HA ILE 43 -8.206 -6.910 -8.272
187 HB ILE 43 HB ILE 43 -6.582 -4.775 -6.836
188 HG12 ILE 43 2HG1 ILE 43 -6.488 -7.804 -6.572
189 HG13 ILE 43 1HG1 ILE 43 -5.260 -6.787 -7.286
190 HG21 ILE 43 1HG2 ILE 43 -7.701 -5.421 -4.828
191 HG22 ILE 43 2HG2 ILE 43 -8.613 -6.668 -5.678
192 HG23 ILE 43 3HG2 ILE 43 -8.903 -4.962 -6.034
193 HD11 ILE 43 3HD1 ILE 43 -4.876 -5.744 -5.080
194 HD12 ILE 43 1HD1 ILE 43 -4.597 -7.488 -5.083
195 HD13 ILE 43 2HD1 ILE 43 -6.076 -6.838 -4.395
196 HA PRO 44 HA PRO 44 -10.780 -3.509 -9.651
197 HB2 PRO 44 2HB PRO 44 -13.085 -4.288 -8.414
198 HB3 PRO 44 1HB PRO 44 -12.520 -5.005 -9.928
199 HG2 PRO 44 2HG PRO 44 -12.284 -6.035 -7.137
200 HG3 PRO 44 1HG PRO 44 -12.654 -6.915 -8.627
201 HD2 PRO 44 2HD PRO 44 -10.204 -6.923 -7.478
202 HD3 PRO 44 1HD PRO 44 -10.428 -7.069 -9.231
203 H CYS 45 H CYS 45 -11.162 -1.582 -8.758
204 HA CYS 45 HA CYS 45 -10.874 -1.362 -5.854
205 HB2 CYS 45 2HB CYS 45 -9.808 0.377 -8.076
206 HB3 CYS 45 1HB CYS 45 -9.799 0.900 -6.401
207 HA PRO 46 HA PRO 46 -14.706 0.860 -5.762
208 HB2 PRO 46 2HB PRO 46 -14.005 2.942 -4.072
209 HB3 PRO 46 1HB PRO 46 -14.531 1.349 -3.532
210 HG2 PRO 46 2HG PRO 46 -11.765 2.443 -3.801
211 HG3 PRO 46 1HG PRO 46 -12.438 1.389 -2.543
212 HD2 PRO 46 2HD PRO 46 -10.868 0.436 -4.480
213 HD3 PRO 46 1HD PRO 46 -12.230 -0.511 -3.856
214 H ILE 47 H ILE 47 -15.642 2.822 -6.518
215 HA ILE 47 HA ILE 47 -13.888 4.232 -8.351
216 HB ILE 47 HB ILE 47 -15.962 5.212 -9.301
217 HG12 ILE 47 2HG1 ILE 47 -17.385 3.378 -7.345
218 HG13 ILE 47 1HG1 ILE 47 -17.363 5.134 -7.257
219 HG21 ILE 47 1HG2 ILE 47 -16.784 3.129 -10.324
220 HG22 ILE 47 2HG2 ILE 47 -15.903 2.207 -9.104
221 HG23 ILE 47 3HG2 ILE 47 -15.021 3.204 -10.258
222 HD11 ILE 47 3HD1 ILE 47 -19.452 4.270 -8.172
223 HD12 ILE 47 1HD1 ILE 47 -18.561 3.502 -9.483
224 HD13 ILE 47 2HD1 ILE 47 -18.590 5.261 -9.351
225 H THR 48 H THR 48 -14.177 4.603 -5.362
226 HA THR 48 HA THR 48 -14.662 7.478 -5.241
227 HB THR 48 HB THR 48 -14.023 5.553 -2.989
228 HG1 THR 48 1HG THR 48 -16.276 5.907 -4.480
229 HG21 THR 48 3HG2 THR 48 -15.088 7.278 -1.594
230 HG22 THR 48 1HG2 THR 48 -15.392 8.258 -3.028
231 HG23 THR 48 2HG2 THR 48 -13.738 7.963 -2.497
232 H TYR 49 H TYR 49 -12.948 8.816 -5.143
233 HA TYR 49 HA TYR 49 -10.278 7.687 -5.123
234 HB2 TYR 49 2HB TYR 49 -10.916 9.468 -6.781
235 HB3 TYR 49 1HB TYR 49 -11.191 10.568 -5.442
236 HD1 TYR 49 1HD TYR 49 -9.283 11.438 -4.137
237 HD2 TYR 49 2HD TYR 49 -8.673 8.949 -7.527
238 HE1 TYR 49 1HE TYR 49 -6.917 12.100 -4.187
239 HE2 TYR 49 2HE TYR 49 -6.302 9.611 -7.589
240 HH TYR 49 HH TYR 49 -4.877 11.353 -6.834
241 H LEU 50 H LEU 50 -9.169 7.598 -3.307
242 HA LEU 50 HA LEU 50 -9.820 9.381 -1.084
243 HB2 LEU 50 2HB LEU 50 -9.388 6.389 -0.909
244 HB3 LEU 50 1HB LEU 50 -9.492 7.461 0.468
245 HG LEU 50 HG LEU 50 -11.750 6.963 -1.478
246 HD11 LEU 50 1HD1 LEU 50 -12.729 5.638 0.323
247 HD12 LEU 50 2HD1 LEU 50 -11.253 5.838 1.272
248 HD13 LEU 50 3HD1 LEU 50 -11.212 4.946 -0.251
249 HD21 LEU 50 3HD2 LEU 50 -11.668 8.362 1.201
250 HD22 LEU 50 1HD2 LEU 50 -13.120 8.043 0.252
251 HD23 LEU 50 2HD2 LEU 50 -11.885 9.134 -0.370
252 HA PRO 51 HA PRO 51 -5.437 9.567 -2.251
253 HB2 PRO 51 2HB PRO 51 -4.868 11.732 -0.630
254 HB3 PRO 51 1HB PRO 51 -5.438 11.857 -2.293
255 HG2 PRO 51 2HG PRO 51 -6.948 12.133 0.262
256 HG3 PRO 51 1HG PRO 51 -7.154 13.007 -1.264
257 HD2 PRO 51 2HD PRO 51 -8.807 11.024 -0.479
258 HD3 PRO 51 1HD PRO 51 -8.447 11.337 -2.188
259 H VAL 52 H VAL 52 -4.168 8.130 -1.363
260 HA VAL 52 HA VAL 52 -3.727 8.285 1.540
261 HB VAL 52 HB VAL 52 -3.362 5.864 1.665
262 HG11 VAL 52 1HG1 VAL 52 -6.055 6.535 0.500
263 HG12 VAL 52 2HG1 VAL 52 -5.578 6.663 2.195
264 HG13 VAL 52 3HG1 VAL 52 -5.673 5.078 1.422
265 HG21 VAL 52 3HG2 VAL 52 -2.638 5.432 -0.607
266 HG22 VAL 52 1HG2 VAL 52 -4.259 5.778 -1.216
267 HG23 VAL 52 2HG2 VAL 52 -3.983 4.373 -0.187
268 H CYS 53 H CYS 53 -1.628 7.603 2.215
269 HA CYS 53 HA CYS 53 0.331 7.992 0.081
270 HB2 CYS 53 2HB CYS 53 0.206 9.953 1.480
271 HB3 CYS 53 1HB CYS 53 0.414 8.999 2.938
272 H GLY 54 H GLY 54 1.711 6.429 -0.178
273 HA2 GLY 54 2HA GLY 54 1.796 4.240 1.737
274 HA3 GLY 54 1HA GLY 54 2.503 4.265 0.130
275 H SER 55 H SER 55 3.784 3.372 2.441
276 HA SER 55 HA SER 55 5.581 5.175 3.635
277 HB2 SER 55 2HB SER 55 6.092 2.263 3.057
278 HB3 SER 55 1HB SER 55 6.738 3.236 4.385
279 HG SER 55 HG SER 55 4.997 2.881 5.460
280 H ASP 56 H ASP 56 5.467 4.184 0.449
281 HA ASP 56 HA ASP 56 8.324 4.432 -0.029
282 HB2 ASP 56 2HB ASP 56 6.893 2.625 -1.114
283 HB3 ASP 56 1HB ASP 56 6.094 3.894 -2.017
284 H TYR 57 H TYR 57 6.001 6.466 0.630
285 HA TYR 57 HA TYR 57 5.493 8.615 0.365
286 HB2 TYR 57 2HB TYR 57 8.291 8.723 -0.772
287 HB3 TYR 57 1HB TYR 57 7.305 10.153 -0.504
288 HD1 TYR 57 1HD TYR 57 6.646 10.789 1.795
289 HD2 TYR 57 2HD TYR 57 9.374 7.610 1.064
290 HE1 TYR 57 1HE TYR 57 7.375 10.890 4.135
291 HE2 TYR 57 2HE TYR 57 10.110 7.700 3.410
292 HH TYR 57 HH TYR 57 8.408 9.426 5.784
293 H ILE 58 H ILE 58 4.348 7.055 -1.342
294 HA ILE 58 HA ILE 58 4.165 8.677 -3.777
295 HB ILE 58 HB ILE 58 3.679 5.687 -3.516
296 HG12 ILE 58 2HG1 ILE 58 6.081 6.166 -3.517
297 HG13 ILE 58 1HG1 ILE 58 5.607 5.369 -5.010
298 HG21 ILE 58 1HG2 ILE 58 2.160 6.691 -5.105
299 HG22 ILE 58 2HG2 ILE 58 3.349 5.695 -5.938
300 HG23 ILE 58 3HG2 ILE 58 3.509 7.450 -5.950
301 HD11 ILE 58 3HD1 ILE 58 7.215 7.117 -5.436
302 HD12 ILE 58 1HD1 ILE 58 6.173 8.305 -4.652
303 HD13 ILE 58 2HD1 ILE 58 5.662 7.542 -6.160
304 H THR 59 H THR 59 2.137 9.472 -4.083
305 HA THR 59 HA THR 59 0.091 8.803 -2.177
306 HB THR 59 HB THR 59 0.027 10.722 -4.532
307 HG1 THR 59 1HG THR 59 1.502 11.526 -3.223
308 HG21 THR 59 3HG2 THR 59 -2.206 10.131 -3.781
309 HG22 THR 59 1HG2 THR 59 -1.842 11.777 -3.267
310 HG23 THR 59 2HG2 THR 59 -1.766 10.442 -2.108
311 H TYR 60 H TYR 60 -1.616 7.562 -2.614
312 HA TYR 60 HA TYR 60 -1.843 6.454 -5.325
313 HB2 TYR 60 2HB TYR 60 -2.522 5.185 -2.670
314 HB3 TYR 60 1HB TYR 60 -2.897 4.464 -4.234
315 HD1 TYR 60 2HD TYR 60 -0.226 5.336 -1.877
316 HD2 TYR 60 1HD TYR 60 -1.156 3.421 -5.555
317 HE1 TYR 60 2HE TYR 60 1.987 4.289 -1.884
318 HE2 TYR 60 1HE TYR 60 1.066 2.362 -5.565
319 HH TYR 60 HH TYR 60 3.285 2.693 -4.587
320 H GLY 61 H GLY 61 -3.899 6.159 -6.159
321 HA2 GLY 61 2HA GLY 61 -5.709 8.207 -5.628
322 HA3 GLY 61 1HA GLY 61 -6.064 6.801 -6.633
323 H ASN 62 H ASN 62 -5.550 5.045 -4.289
324 HA ASN 62 HA ASN 62 -7.071 5.758 -2.129
325 HB2 ASN 62 2HB ASN 62 -9.036 4.244 -2.296
326 HB3 ASN 62 1HB ASN 62 -9.095 5.517 -3.492
327 HD21 ASN 62 1HD2 ASN 62 -10.475 4.452 -4.788
328 HD22 ASN 62 2HD2 ASN 62 -10.069 3.072 -5.731
329 H GLU 63 H GLU 63 -7.648 3.687 -0.870
330 HA GLU 63 HA GLU 63 -5.103 2.586 -0.485
331 HB2 GLU 63 2HB GLU 63 -6.506 1.176 1.281
332 HB3 GLU 63 1HB GLU 63 -5.997 2.831 1.573
333 HG2 GLU 63 2HG GLU 63 -8.266 2.557 2.256
334 HG3 GLU 63 1HG GLU 63 -8.245 3.578 0.825
335 H CYS 64 H CYS 64 -7.903 1.329 -2.070
336 HA CYS 64 HA CYS 64 -7.033 -1.305 -2.365
337 HB2 CYS 64 2HB CYS 64 -9.244 -0.694 -3.123
338 HB3 CYS 64 1HB CYS 64 -8.576 0.442 -4.290
339 H HIS 65 H HIS 65 -6.174 1.586 -4.246
340 HA HIS 65 HA HIS 65 -4.493 0.198 -6.083
341 HB2 HIS 65 2HB HIS 65 -4.429 3.122 -5.287
342 HB3 HIS 65 1HB HIS 65 -3.418 2.431 -6.549
343 HD1 HIS 65 1HD HIS 65 -4.937 1.227 -8.550
344 HD2 HIS 65 2HD HIS 65 -6.743 4.129 -6.211
345 HE1 HIS 65 1HE HIS 65 -6.981 1.929 -9.803
346 HE2 HIS 65 2HE HIS 65 -7.894 3.853 -8.490
347 H LEU 66 H LEU 66 -3.932 1.661 -2.993
348 HA LEU 66 HA LEU 66 -1.149 1.285 -2.896
349 HB2 LEU 66 2HB LEU 66 -2.253 2.723 -1.316
350 HB3 LEU 66 1HB LEU 66 -3.237 1.401 -0.733
351 HG LEU 66 HG LEU 66 -1.294 0.373 0.319
352 HD11 LEU 66 1HD1 LEU 66 0.843 1.541 0.418
353 HD12 LEU 66 2HD1 LEU 66 0.238 2.752 -0.717
354 HD13 LEU 66 3HD1 LEU 66 0.439 1.077 -1.234
355 HD21 LEU 66 3HD2 LEU 66 -2.617 2.000 1.529
356 HD22 LEU 66 1HD2 LEU 66 -1.558 3.292 0.968
357 HD23 LEU 66 2HD2 LEU 66 -0.927 2.027 2.033
358 H CYS 67 H CYS 67 -3.853 -0.788 -1.967
359 HA CYS 67 HA CYS 67 -2.396 -2.937 -0.957
360 HB2 CYS 67 2HB CYS 67 -4.775 -2.783 -0.575
361 HB3 CYS 67 1HB CYS 67 -5.106 -2.863 -2.300
362 H THR 68 H THR 68 -3.546 -2.387 -4.312
363 HA THR 68 HA THR 68 -2.566 -4.751 -5.369
364 HB THR 68 HB THR 68 -2.430 -3.484 -7.570
365 HG1 THR 68 1HG THR 68 -2.479 -1.336 -6.013
366 HG21 THR 68 3HG2 THR 68 -4.986 -3.311 -6.004
367 HG22 THR 68 1HG2 THR 68 -4.415 -4.701 -6.928
368 HG23 THR 68 2HG2 THR 68 -4.851 -3.207 -7.761
369 H GLU 69 H GLU 69 -0.897 -1.631 -5.010
370 HA GLU 69 HA GLU 69 1.444 -2.504 -6.318
371 HB2 GLU 69 2HB GLU 69 0.666 -0.139 -6.114
372 HB3 GLU 69 1HB GLU 69 1.079 -0.197 -4.409
373 HG2 GLU 69 2HG GLU 69 2.785 0.899 -5.755
374 HG3 GLU 69 1HG GLU 69 3.406 -0.539 -4.943
375 H SER 70 H SER 70 0.311 -2.442 -3.008
376 HA SER 70 HA SER 70 2.726 -2.943 -1.711
377 HB2 SER 70 2HB SER 70 0.544 -2.230 -0.631
378 HB3 SER 70 1HB SER 70 -0.016 -3.887 -0.823
379 HG SER 70 HG SER 70 2.049 -2.852 0.746
380 H LEU 71 H LEU 71 0.227 -5.200 -2.904
381 HA LEU 71 HA LEU 71 1.638 -7.555 -2.158
382 HB2 LEU 71 2HB LEU 71 -0.493 -7.187 -4.266
383 HB3 LEU 71 1HB LEU 71 0.074 -8.725 -3.647
384 HG LEU 71 HG LEU 71 -1.385 -6.630 -2.044
385 HD11 LEU 71 1HD1 LEU 71 -3.227 -8.230 -2.056
386 HD12 LEU 71 2HD1 LEU 71 -2.298 -9.294 -3.111
387 HD13 LEU 71 3HD1 LEU 71 -2.815 -7.709 -3.689
388 HD21 LEU 71 3HD2 LEU 71 -0.498 -9.422 -1.306
389 HD22 LEU 71 1HD2 LEU 71 -1.505 -8.361 -0.322
390 HD23 LEU 71 2HD2 LEU 71 0.165 -7.914 -0.665
391 H LYS 72 H LYS 72 1.348 -5.757 -5.161
392 HA LYS 72 HA LYS 72 2.824 -7.327 -6.907
393 HB2 LYS 72 2HB LYS 72 1.428 -5.387 -7.509
394 HB3 LYS 72 1HB LYS 72 2.537 -4.323 -6.691
395 HG2 LYS 72 2HG LYS 72 3.238 -5.895 -9.173
396 HG3 LYS 72 1HG LYS 72 2.577 -4.268 -9.194
397 HD2 LYS 72 2HD LYS 72 4.614 -3.798 -7.576
398 HD3 LYS 72 1HD LYS 72 5.277 -5.222 -8.374
399 HE2 LYS 72 2HE LYS 72 5.989 -3.215 -9.523
400 HE3 LYS 72 1HE LYS 72 4.890 -4.135 -10.553
401 HZ1 LYS 72 3HZ LYS 72 4.427 -1.719 -10.490
402 HZ2 LYS 72 1HZ LYS 72 4.053 -1.852 -8.852
403 HZ3 LYS 72 2HZ LYS 72 3.114 -2.647 -10.012
404 H SER 73 H SER 73 3.913 -4.744 -4.738
405 HA SER 73 HA SER 73 6.663 -5.369 -5.339
406 HB2 SER 73 2HB SER 73 5.402 -3.153 -3.715
407 HB3 SER 73 1HB SER 73 7.137 -3.344 -3.981
408 HG SER 73 HG SER 73 5.158 -2.519 -5.831
409 H ASN 74 H ASN 74 4.693 -6.981 -3.533
410 HA ASN 74 HA ASN 74 4.846 -8.446 -1.827
411 HB2 ASN 74 2HB ASN 74 7.784 -8.146 -2.436
412 HB3 ASN 74 1HB ASN 74 7.140 -9.362 -1.339
413 HD21 ASN 74 1HD2 ASN 74 5.955 -11.085 -2.185
414 HD22 ASN 74 2HD2 ASN 74 5.948 -11.444 -3.872
415 H GLY 75 H GLY 75 4.685 -5.708 -0.970
416 HA2 GLY 75 2HA GLY 75 4.330 -5.098 1.315
417 HA3 GLY 75 1HA GLY 75 5.649 -6.165 1.768
418 H ARG 76 H ARG 76 6.677 -4.486 -0.833
419 HA ARG 76 HA ARG 76 8.634 -2.954 0.413
420 HB2 ARG 76 2HB ARG 76 8.478 -3.622 -2.011
421 HB3 ARG 76 1HB ARG 76 7.288 -2.360 -2.204
422 HG2 ARG 76 2HG ARG 76 8.914 -0.650 -1.732
423 HG3 ARG 76 1HG ARG 76 10.135 -1.874 -1.366
424 HD2 ARG 76 2HD ARG 76 8.773 -1.491 -4.039
425 HD3 ARG 76 1HD ARG 76 10.416 -0.981 -3.647
426 HE ARG 76 HE ARG 76 10.705 -3.482 -3.117
427 HH11 ARG 76 1HH1 ARG 76 8.792 -2.191 -5.845
428 HH12 ARG 76 2HH1 ARG 76 9.015 -3.546 -6.827
429 HH21 ARG 76 1HH2 ARG 76 10.985 -5.370 -4.502
430 HH22 ARG 76 2HH2 ARG 76 10.246 -5.410 -6.035
431 H VAL 77 H VAL 77 5.470 -1.971 -0.752
432 HA VAL 77 HA VAL 77 5.763 0.523 0.757
433 HB VAL 77 HB VAL 77 5.377 0.876 -1.655
434 HG11 VAL 77 1HG1 VAL 77 3.225 0.337 -2.695
435 HG12 VAL 77 2HG1 VAL 77 2.770 -0.562 -1.249
436 HG13 VAL 77 3HG1 VAL 77 4.134 -1.098 -2.229
437 HG21 VAL 77 3HG2 VAL 77 3.047 1.702 0.067
438 HG22 VAL 77 1HG2 VAL 77 3.473 2.428 -1.483
439 HG23 VAL 77 2HG2 VAL 77 4.577 2.558 -0.112
440 H GLN 78 H GLN 78 4.465 0.978 2.383
441 HA GLN 78 HA GLN 78 2.187 -0.783 2.955
442 HB2 GLN 78 2HB GLN 78 4.163 0.482 4.877
443 HB3 GLN 78 1HB GLN 78 2.704 -0.363 5.367
444 HG2 GLN 78 2HG GLN 78 4.940 -1.623 3.807
445 HG3 GLN 78 1HG GLN 78 4.793 -1.686 5.562
446 HE21 GLN 78 1HE2 GLN 78 3.454 -2.764 2.545
447 HE22 GLN 78 2HE2 GLN 78 2.485 -4.031 3.206
448 H PHE 79 H PHE 79 0.877 0.506 4.776
449 HA PHE 79 HA PHE 79 0.128 3.020 3.554
450 HB2 PHE 79 2HB PHE 79 -1.570 1.404 4.368
451 HB3 PHE 79 1HB PHE 79 -0.968 1.608 6.004
452 HD1 PHE 79 1HD PHE 79 -2.675 3.295 3.200
453 HD2 PHE 79 2HD PHE 79 -1.743 3.410 7.346
454 HE1 PHE 79 1HE PHE 79 -4.314 5.091 3.520
455 HE2 PHE 79 2HE PHE 79 -3.380 5.204 7.663
456 HZ PHE 79 HZ PHE 79 -4.667 6.048 5.753
457 H LEU 80 H LEU 80 1.270 4.756 4.030
458 HA LEU 80 HA LEU 80 2.797 4.891 6.477
459 HB2 LEU 80 2HB LEU 80 3.685 5.635 4.274
460 HB3 LEU 80 1HB LEU 80 2.486 6.903 4.253
461 HG LEU 80 HG LEU 80 3.527 7.876 6.282
462 HD11 LEU 80 1HD1 LEU 80 5.644 5.789 5.803
463 HD12 LEU 80 2HD1 LEU 80 4.570 5.892 7.204
464 HD13 LEU 80 3HD1 LEU 80 5.773 7.145 6.919
465 HD21 LEU 80 3HD2 LEU 80 5.488 8.776 5.124
466 HD22 LEU 80 1HD2 LEU 80 4.074 8.720 4.073
467 HD23 LEU 80 2HD2 LEU 80 5.345 7.510 3.907
468 H HIS 81 H HIS 81 0.460 7.011 4.833
469 HA HIS 81 HA HIS 81 -0.978 7.423 7.257
470 HB2 HIS 81 2HB HIS 81 -0.770 9.876 7.377
471 HB3 HIS 81 1HB HIS 81 0.774 9.097 7.666
472 HD1 HIS 81 1HD HIS 81 -1.040 11.198 5.062
473 HD2 HIS 81 2HD HIS 81 2.796 9.870 5.963
474 HE1 HIS 81 1HE HIS 81 0.534 12.451 3.514
475 HE2 HIS 81 2HE HIS 81 2.762 11.941 4.460
476 H ASP 82 H ASP 82 -2.834 8.761 6.971
477 HA ASP 82 HA ASP 82 -4.224 8.168 4.575
478 HB2 ASP 82 2HB ASP 82 -4.916 10.081 6.817
479 HB3 ASP 82 1HB ASP 82 -6.040 9.381 5.659
480 H GLY 83 H GLY 83 -4.984 9.815 3.067
481 HA2 GLY 83 2HA GLY 83 -5.062 11.907 2.129
482 HA3 GLY 83 1HA GLY 83 -4.015 12.509 3.409
483 H SER 84 H SER 84 -3.539 13.324 0.898
484 HA SER 84 HA SER 84 -1.745 11.815 -0.627
485 HB2 SER 84 2HB SER 84 -1.872 14.819 -0.325
486 HB3 SER 84 1HB SER 84 -1.307 13.915 -1.733
487 HG SER 84 HG SER 84 -3.309 13.503 -2.313
488 H CYS 85 H CYS 85 0.620 12.031 -0.767
489 HA CYS 85 HA CYS 85 1.847 12.005 1.769
490 HB2 CYS 85 2HB CYS 85 3.147 12.083 -0.969
491 HB3 CYS 85 1HB CYS 85 3.956 11.781 0.574
Start of MODEL 20
1 H1 SER 20 1HT SER 20 -6.658 13.042 6.679
2 H2 SER 20 2HT SER 20 -5.612 12.103 7.573
3 H3 SER 20 3HT SER 20 -6.342 13.476 8.292
4 HA SER 20 HA SER 20 -7.635 10.997 7.378
5 HB2 SER 20 2HB SER 20 -7.360 12.166 10.161
6 HB3 SER 20 1HB SER 20 -8.045 10.599 9.737
7 HG SER 20 HG SER 20 -5.817 10.257 8.749
8 H GLU 21 H GLU 21 -9.680 11.323 6.737
9 HA GLU 21 HA GLU 21 -10.992 13.838 6.907
10 HB2 GLU 21 2HB GLU 21 -12.202 11.110 6.414
11 HB3 GLU 21 1HB GLU 21 -12.976 12.650 6.098
12 HG2 GLU 21 2HG GLU 21 -11.229 13.121 4.403
13 HG3 GLU 21 1HG GLU 21 -10.587 11.499 4.676
14 H ALA 22 H ALA 22 -11.066 10.850 8.679
15 HA ALA 22 HA ALA 22 -12.245 12.197 10.952
16 HB1 ALA 22 1HB ALA 22 -13.288 9.597 9.789
17 HB2 ALA 22 2HB ALA 22 -14.163 11.126 9.848
18 HB3 ALA 22 3HB ALA 22 -13.769 10.278 11.342
19 H ALA 23 H ALA 23 -11.840 10.794 12.897
20 HA ALA 23 HA ALA 23 -9.172 9.765 12.756
21 HB1 ALA 23 1HB ALA 23 -9.412 9.398 15.164
22 HB2 ALA 23 2HB ALA 23 -11.140 9.725 15.044
23 HB3 ALA 23 3HB ALA 23 -9.977 11.004 14.706
24 H SER 24 H SER 24 -12.177 8.451 12.200
25 HA SER 24 HA SER 24 -12.980 6.435 11.667
26 HB2 SER 24 2HB SER 24 -10.128 5.415 11.996
27 HB3 SER 24 1HB SER 24 -11.450 4.540 11.219
28 HG SER 24 HG SER 24 -10.534 7.080 10.378
29 H LEU 25 H LEU 25 -13.071 4.001 12.719
30 HA LEU 25 HA LEU 25 -13.688 4.579 15.469
31 HB2 LEU 25 2HB LEU 25 -14.007 2.011 13.882
32 HB3 LEU 25 1HB LEU 25 -14.448 2.173 15.560
33 HG LEU 25 HG LEU 25 -16.127 3.918 14.879
34 HD11 LEU 25 1HD1 LEU 25 -15.205 4.572 12.732
35 HD12 LEU 25 2HD1 LEU 25 -16.863 3.997 12.557
36 HD13 LEU 25 3HD1 LEU 25 -15.516 2.959 12.089
37 HD21 LEU 25 3HD2 LEU 25 -17.752 2.288 14.046
38 HD22 LEU 25 1HD2 LEU 25 -16.786 1.641 15.372
39 HD23 LEU 25 2HD2 LEU 25 -16.439 1.161 13.712
40 H SER 26 H SER 26 -11.159 3.199 13.688
41 HA SER 26 HA SER 26 -9.552 2.985 16.070
42 HB2 SER 26 2HB SER 26 -9.750 0.737 14.032
43 HB3 SER 26 1HB SER 26 -8.724 0.762 15.462
44 HG SER 26 HG SER 26 -11.134 1.228 16.306
45 HA PRO 27 HA PRO 27 -6.734 4.837 13.022
46 HB2 PRO 27 2HB PRO 27 -4.607 3.399 14.534
47 HB3 PRO 27 1HB PRO 27 -4.725 5.121 14.154
48 HG2 PRO 27 2HG PRO 27 -5.165 4.248 16.630
49 HG3 PRO 27 1HG PRO 27 -6.141 5.553 15.931
50 HD2 PRO 27 2HD PRO 27 -6.834 2.668 16.307
51 HD3 PRO 27 1HD PRO 27 -7.841 4.117 16.531
52 H LYS 28 H LYS 28 -6.649 3.872 11.102
53 HA LYS 28 HA LYS 28 -6.061 1.020 11.065
54 HB2 LYS 28 2HB LYS 28 -8.085 2.597 9.594
55 HB3 LYS 28 1HB LYS 28 -7.399 1.170 8.836
56 HG2 LYS 28 2HG LYS 28 -8.106 -0.174 10.727
57 HG3 LYS 28 1HG LYS 28 -8.789 1.259 11.500
58 HD2 LYS 28 2HD LYS 28 -10.440 1.492 9.833
59 HD3 LYS 28 1HD LYS 28 -9.615 0.372 8.747
60 HE2 LYS 28 2HE LYS 28 -10.773 -0.405 11.410
61 HE3 LYS 28 1HE LYS 28 -11.644 -0.571 9.890
62 HZ1 LYS 28 3HZ LYS 28 -10.580 -2.647 10.506
63 HZ2 LYS 28 1HZ LYS 28 -9.073 -1.898 10.589
64 HZ3 LYS 28 2HZ LYS 28 -9.844 -2.029 9.113
65 H LYS 29 H LYS 29 -4.721 0.194 9.778
66 HA LYS 29 HA LYS 29 -3.212 1.781 7.876
67 HB2 LYS 29 2HB LYS 29 -3.035 -1.094 8.832
68 HB3 LYS 29 1HB LYS 29 -2.077 -0.483 7.502
69 HG2 LYS 29 2HG LYS 29 -1.975 0.625 10.298
70 HG3 LYS 29 1HG LYS 29 -0.878 -0.617 9.685
71 HD2 LYS 29 2HD LYS 29 -0.265 0.992 7.845
72 HD3 LYS 29 1HD LYS 29 -1.220 2.202 8.707
73 HE2 LYS 29 2HE LYS 29 1.145 0.737 9.861
74 HE3 LYS 29 1HE LYS 29 1.218 2.339 9.137
75 HZ1 LYS 29 3HZ LYS 29 -0.370 1.591 11.528
76 HZ2 LYS 29 1HZ LYS 29 -0.283 3.141 10.847
77 HZ3 LYS 29 2HZ LYS 29 1.091 2.421 11.517
78 H VAL 30 H VAL 30 -2.949 0.400 5.713
79 HA VAL 30 HA VAL 30 -5.555 0.271 4.621
80 HB VAL 30 HB VAL 30 -3.636 0.977 3.222
81 HG11 VAL 30 1HG1 VAL 30 -2.007 -0.599 2.332
82 HG12 VAL 30 2HG1 VAL 30 -2.718 -1.891 3.294
83 HG13 VAL 30 3HG1 VAL 30 -1.905 -0.554 4.098
84 HG21 VAL 30 3HG2 VAL 30 -5.008 -1.503 2.198
85 HG22 VAL 30 1HG2 VAL 30 -4.178 -0.311 1.196
86 HG23 VAL 30 2HG2 VAL 30 -5.617 0.148 2.107
87 H ASP 31 H ASP 31 -6.936 -1.339 4.911
88 HA ASP 31 HA ASP 31 -5.882 -3.927 5.524
89 HB2 ASP 31 2HB ASP 31 -7.929 -3.293 6.660
90 HB3 ASP 31 1HB ASP 31 -8.742 -3.064 5.115
91 H CYS 32 H CYS 32 -4.857 -4.647 3.986
92 HA CYS 32 HA CYS 32 -5.781 -4.574 1.250
93 HB2 CYS 32 2HB CYS 32 -3.421 -4.053 2.000
94 HB3 CYS 32 1HB CYS 32 -3.276 -5.729 2.487
95 H SER 33 H SER 33 -6.031 -6.540 4.005
96 HA SER 33 HA SER 33 -5.713 -9.152 3.267
97 HB2 SER 33 2HB SER 33 -7.994 -8.206 4.972
98 HB3 SER 33 1HB SER 33 -7.037 -9.681 5.135
99 HG SER 33 HG SER 33 -6.610 -7.174 6.034
100 H ILE 34 H ILE 34 -8.647 -7.171 2.877
101 HA ILE 34 HA ILE 34 -10.148 -9.317 1.762
102 HB ILE 34 HB ILE 34 -11.898 -7.637 1.284
103 HG12 ILE 34 2HG1 ILE 34 -9.956 -5.642 2.487
104 HG13 ILE 34 1HG1 ILE 34 -10.351 -5.744 0.776
105 HG21 ILE 34 1HG2 ILE 34 -10.720 -7.508 4.055
106 HG22 ILE 34 2HG2 ILE 34 -11.839 -8.728 3.446
107 HG23 ILE 34 3HG2 ILE 34 -12.370 -7.056 3.625
108 HD11 ILE 34 3HD1 ILE 34 -12.274 -5.096 2.997
109 HD12 ILE 34 1HD1 ILE 34 -12.667 -5.176 1.281
110 HD13 ILE 34 2HD1 ILE 34 -11.555 -3.941 1.873
111 H TYR 35 H TYR 35 -7.862 -7.219 0.401
112 HA TYR 35 HA TYR 35 -8.978 -7.509 -2.275
113 HB2 TYR 35 2HB TYR 35 -6.594 -5.924 -1.310
114 HB3 TYR 35 1HB TYR 35 -7.113 -6.020 -2.984
115 HD1 TYR 35 1HD TYR 35 -7.932 -4.707 0.350
116 HD2 TYR 35 2HD TYR 35 -8.976 -4.735 -3.764
117 HE1 TYR 35 1HE TYR 35 -9.394 -2.768 0.711
118 HE2 TYR 35 2HE TYR 35 -10.442 -2.803 -3.414
119 HH TYR 35 HH TYR 35 -10.508 -1.088 -0.364
120 H LYS 36 H LYS 36 -6.684 -8.827 -0.175
121 HA LYS 36 HA LYS 36 -4.843 -9.927 -2.012
122 HB2 LYS 36 2HB LYS 36 -5.606 -10.786 0.770
123 HB3 LYS 36 1HB LYS 36 -4.292 -11.515 -0.148
124 HG2 LYS 36 2HG LYS 36 -3.129 -9.425 -0.224
125 HG3 LYS 36 1HG LYS 36 -4.463 -8.598 0.585
126 HD2 LYS 36 2HD LYS 36 -2.650 -9.042 2.160
127 HD3 LYS 36 1HD LYS 36 -4.071 -9.989 2.584
128 HE2 LYS 36 2HE LYS 36 -3.078 -11.950 1.503
129 HE3 LYS 36 1HE LYS 36 -1.658 -10.991 1.085
130 HZ1 LYS 36 3HZ LYS 36 -1.197 -10.702 3.411
131 HZ2 LYS 36 1HZ LYS 36 -1.333 -12.341 3.072
132 HZ3 LYS 36 2HZ LYS 36 -2.588 -11.523 3.854
133 H LYS 37 H LYS 37 -8.015 -10.697 -1.344
134 HA LYS 37 HA LYS 37 -7.946 -13.456 -2.101
135 HB2 LYS 37 2HB LYS 37 -9.666 -12.451 -0.649
136 HB3 LYS 37 1HB LYS 37 -10.248 -11.503 -2.004
137 HG2 LYS 37 2HG LYS 37 -10.948 -13.509 -3.168
138 HG3 LYS 37 1HG LYS 37 -10.262 -14.520 -1.895
139 HD2 LYS 37 2HD LYS 37 -12.496 -12.528 -1.514
140 HD3 LYS 37 1HD LYS 37 -12.711 -14.273 -1.678
141 HE2 LYS 37 2HE LYS 37 -11.367 -14.625 0.342
142 HE3 LYS 37 1HE LYS 37 -11.134 -12.889 0.501
143 HZ1 LYS 37 3HZ LYS 37 -12.822 -13.600 1.953
144 HZ2 LYS 37 1HZ LYS 37 -13.711 -14.330 0.701
145 HZ3 LYS 37 2HZ LYS 37 -13.524 -12.655 0.740
146 H TYR 38 H TYR 38 -7.860 -10.450 -3.727
147 HA TYR 38 HA TYR 38 -8.816 -11.551 -6.245
148 HB2 TYR 38 2HB TYR 38 -7.773 -8.776 -5.624
149 HB3 TYR 38 1HB TYR 38 -8.647 -9.265 -7.064
150 HD1 TYR 38 1HD TYR 38 -11.051 -10.532 -6.141
151 HD2 TYR 38 2HD TYR 38 -8.943 -7.297 -4.389
152 HE1 TYR 38 1HE TYR 38 -13.143 -9.732 -5.100
153 HE2 TYR 38 2HE TYR 38 -10.999 -6.498 -3.337
154 HH TYR 38 HH TYR 38 -13.395 -6.649 -3.744
155 HA PRO 39 HA PRO 39 -4.606 -12.440 -7.387
156 HB2 PRO 39 2HB PRO 39 -4.746 -12.098 -10.098
157 HB3 PRO 39 1HB PRO 39 -5.362 -13.530 -9.267
158 HG2 PRO 39 2HG PRO 39 -6.816 -11.110 -10.213
159 HG3 PRO 39 1HG PRO 39 -7.295 -12.816 -10.349
160 HD2 PRO 39 2HD PRO 39 -8.339 -11.195 -8.472
161 HD3 PRO 39 1HD PRO 39 -8.010 -12.909 -8.145
162 H VAL 40 H VAL 40 -2.698 -11.382 -8.128
163 HA VAL 40 HA VAL 40 -2.565 -8.672 -7.414
164 HB VAL 40 HB VAL 40 -0.494 -10.311 -8.922
165 HG11 VAL 40 1HG1 VAL 40 -0.131 -7.771 -7.330
166 HG12 VAL 40 2HG1 VAL 40 -0.001 -7.926 -9.082
167 HG13 VAL 40 3HG1 VAL 40 1.165 -8.737 -8.038
168 HG21 VAL 40 3HG2 VAL 40 -0.836 -9.827 -5.966
169 HG22 VAL 40 1HG2 VAL 40 0.514 -10.682 -6.714
170 HG23 VAL 40 2HG2 VAL 40 -1.116 -11.345 -6.819
171 H VAL 41 H VAL 41 -3.119 -10.110 -10.511
172 HA VAL 41 HA VAL 41 -2.554 -7.639 -11.920
173 HB VAL 41 HB VAL 41 -1.977 -9.797 -12.964
174 HG11 VAL 41 1HG1 VAL 41 -3.705 -11.252 -13.909
175 HG12 VAL 41 2HG1 VAL 41 -4.932 -10.293 -13.080
176 HG13 VAL 41 3HG1 VAL 41 -3.738 -11.194 -12.147
177 HG21 VAL 41 3HG2 VAL 41 -2.881 -9.363 -15.212
178 HG22 VAL 41 1HG2 VAL 41 -2.341 -7.883 -14.422
179 HG23 VAL 41 2HG2 VAL 41 -4.061 -8.257 -14.508
180 H ALA 42 H ALA 42 -5.351 -9.162 -10.502
181 HA ALA 42 HA ALA 42 -6.989 -7.110 -11.766
182 HB1 ALA 42 1HB ALA 42 -7.952 -9.919 -11.243
183 HB2 ALA 42 2HB ALA 42 -7.466 -9.289 -12.814
184 HB3 ALA 42 3HB ALA 42 -8.855 -8.598 -11.978
185 H ILE 43 H ILE 43 -6.986 -5.772 -10.009
186 HA ILE 43 HA ILE 43 -8.440 -6.842 -7.702
187 HB ILE 43 HB ILE 43 -6.244 -4.722 -7.625
188 HG12 ILE 43 2HG1 ILE 43 -6.308 -7.499 -6.415
189 HG13 ILE 43 1HG1 ILE 43 -5.413 -7.056 -7.860
190 HG21 ILE 43 1HG2 ILE 43 -7.901 -5.855 -5.378
191 HG22 ILE 43 2HG2 ILE 43 -8.020 -4.219 -6.028
192 HG23 ILE 43 3HG2 ILE 43 -6.553 -4.734 -5.192
193 HD11 ILE 43 3HD1 ILE 43 -4.945 -5.988 -5.080
194 HD12 ILE 43 1HD1 ILE 43 -4.041 -5.538 -6.526
195 HD13 ILE 43 2HD1 ILE 43 -3.963 -7.192 -5.920
196 HA PRO 44 HA PRO 44 -11.145 -3.570 -9.291
197 HB2 PRO 44 2HB PRO 44 -13.305 -4.247 -7.753
198 HB3 PRO 44 1HB PRO 44 -12.915 -5.046 -9.278
199 HG2 PRO 44 2HG PRO 44 -12.421 -5.956 -6.486
200 HG3 PRO 44 1HG PRO 44 -12.881 -6.899 -7.910
201 HD2 PRO 44 2HD PRO 44 -10.350 -6.794 -6.912
202 HD3 PRO 44 1HD PRO 44 -10.706 -7.111 -8.620
203 H CYS 45 H CYS 45 -11.403 -1.580 -8.550
204 HA CYS 45 HA CYS 45 -10.684 -1.081 -5.773
205 HB2 CYS 45 2HB CYS 45 -10.384 0.639 -8.242
206 HB3 CYS 45 1HB CYS 45 -9.952 1.161 -6.622
207 HA PRO 46 HA PRO 46 -14.698 0.689 -4.972
208 HB2 PRO 46 2HB PRO 46 -13.862 2.751 -3.301
209 HB3 PRO 46 1HB PRO 46 -14.202 1.101 -2.776
210 HG2 PRO 46 2HG PRO 46 -11.592 2.403 -3.386
211 HG3 PRO 46 1HG PRO 46 -11.989 1.222 -2.125
212 HD2 PRO 46 2HD PRO 46 -10.686 0.538 -4.359
213 HD3 PRO 46 1HD PRO 46 -11.840 -0.566 -3.585
214 H ILE 47 H ILE 47 -15.891 2.549 -5.496
215 HA ILE 47 HA ILE 47 -14.794 3.975 -7.725
216 HB ILE 47 HB ILE 47 -17.000 5.095 -7.886
217 HG12 ILE 47 2HG1 ILE 47 -17.733 3.387 -5.487
218 HG13 ILE 47 1HG1 ILE 47 -17.519 5.133 -5.451
219 HG21 ILE 47 1HG2 ILE 47 -18.269 3.067 -8.458
220 HG22 ILE 47 2HG2 ILE 47 -17.070 2.101 -7.594
221 HG23 ILE 47 3HG2 ILE 47 -16.602 3.002 -9.035
222 HD11 ILE 47 3HD1 ILE 47 -19.406 5.376 -6.990
223 HD12 ILE 47 1HD1 ILE 47 -19.866 4.536 -5.508
224 HD13 ILE 47 2HD1 ILE 47 -19.612 3.626 -7.000
225 H THR 48 H THR 48 -15.193 4.645 -4.402
226 HA THR 48 HA THR 48 -15.113 7.472 -4.592
227 HB THR 48 HB THR 48 -14.482 5.728 -2.214
228 HG1 THR 48 1HG THR 48 -16.976 6.612 -3.284
229 HG21 THR 48 3HG2 THR 48 -14.077 8.151 -1.941
230 HG22 THR 48 1HG2 THR 48 -15.441 7.611 -0.960
231 HG23 THR 48 2HG2 THR 48 -15.730 8.480 -2.468
232 H TYR 49 H TYR 49 -13.371 8.784 -4.248
233 HA TYR 49 HA TYR 49 -10.723 7.613 -4.554
234 HB2 TYR 49 2HB TYR 49 -11.464 9.410 -6.115
235 HB3 TYR 49 1HB TYR 49 -11.688 10.486 -4.748
236 HD1 TYR 49 2HD TYR 49 -9.737 11.399 -3.566
237 HD2 TYR 49 1HD TYR 49 -9.274 8.970 -7.016
238 HE1 TYR 49 2HE TYR 49 -7.426 12.199 -3.800
239 HE2 TYR 49 1HE TYR 49 -6.959 9.766 -7.268
240 HH TYR 49 HH TYR 49 -5.394 11.619 -4.807
241 H LEU 50 H LEU 50 -9.346 7.600 -2.884
242 HA LEU 50 HA LEU 50 -9.851 9.291 -0.554
243 HB2 LEU 50 2HB LEU 50 -9.146 6.337 -0.422
244 HB3 LEU 50 1HB LEU 50 -9.137 7.420 0.939
245 HG LEU 50 HG LEU 50 -11.669 7.652 0.559
246 HD11 LEU 50 1HD1 LEU 50 -11.204 5.164 -1.074
247 HD12 LEU 50 2HD1 LEU 50 -11.753 6.719 -1.696
248 HD13 LEU 50 3HD1 LEU 50 -12.768 5.811 -0.578
249 HD21 LEU 50 3HD2 LEU 50 -10.505 4.997 1.372
250 HD22 LEU 50 1HD2 LEU 50 -12.116 5.582 1.781
251 HD23 LEU 50 2HD2 LEU 50 -10.693 6.414 2.405
252 HA PRO 51 HA PRO 51 -5.514 9.800 -1.909
253 HB2 PRO 51 2HB PRO 51 -5.022 11.750 0.033
254 HB3 PRO 51 1HB PRO 51 -5.475 12.095 -1.626
255 HG2 PRO 51 2HG PRO 51 -7.105 12.133 0.838
256 HG3 PRO 51 1HG PRO 51 -7.305 13.052 -0.661
257 HD2 PRO 51 2HD PRO 51 -8.894 10.956 0.051
258 HD3 PRO 51 1HD PRO 51 -8.586 11.413 -1.635
259 H VAL 52 H VAL 52 -4.176 8.290 -1.173
260 HA VAL 52 HA VAL 52 -3.657 8.197 1.697
261 HB VAL 52 HB VAL 52 -3.363 5.732 1.633
262 HG11 VAL 52 1HG1 VAL 52 -5.476 6.585 2.446
263 HG12 VAL 52 2HG1 VAL 52 -5.731 5.079 1.564
264 HG13 VAL 52 3HG1 VAL 52 -6.117 6.623 0.804
265 HG21 VAL 52 3HG2 VAL 52 -4.287 4.426 -0.256
266 HG22 VAL 52 1HG2 VAL 52 -2.890 5.408 -0.700
267 HG23 VAL 52 2HG2 VAL 52 -4.513 5.932 -1.149
268 H CYS 53 H CYS 53 -1.547 7.515 2.248
269 HA CYS 53 HA CYS 53 0.340 7.854 0.032
270 HB2 CYS 53 2HB CYS 53 0.321 9.782 1.518
271 HB3 CYS 53 1HB CYS 53 0.579 8.757 2.911
272 H GLY 54 H GLY 54 1.773 6.308 -0.262
273 HA2 GLY 54 2HA GLY 54 1.835 4.093 1.614
274 HA3 GLY 54 1HA GLY 54 2.521 4.111 -0.010
275 H SER 55 H SER 55 3.946 3.154 2.154
276 HA SER 55 HA SER 55 5.644 4.995 3.393
277 HB2 SER 55 2HB SER 55 7.077 2.931 3.755
278 HB3 SER 55 1HB SER 55 5.410 2.826 4.328
279 HG SER 55 HG SER 55 6.633 1.207 2.686
280 H ASP 56 H ASP 56 5.580 3.972 0.199
281 HA ASP 56 HA ASP 56 8.393 4.474 -0.354
282 HB2 ASP 56 2HB ASP 56 7.130 2.653 -1.519
283 HB3 ASP 56 1HB ASP 56 6.117 3.879 -2.265
284 H TYR 57 H TYR 57 5.960 6.379 0.387
285 HA TYR 57 HA TYR 57 5.426 8.510 0.211
286 HB2 TYR 57 2HB TYR 57 8.199 8.727 -0.958
287 HB3 TYR 57 1HB TYR 57 7.187 10.129 -0.621
288 HD1 TYR 57 1HD TYR 57 6.516 10.616 1.712
289 HD2 TYR 57 2HD TYR 57 9.365 7.600 0.785
290 HE1 TYR 57 1HE TYR 57 7.290 10.640 4.041
291 HE2 TYR 57 2HE TYR 57 10.143 7.616 3.118
292 HH TYR 57 HH TYR 57 8.433 9.061 5.610
293 H ILE 58 H ILE 58 4.326 6.971 -1.554
294 HA ILE 58 HA ILE 58 4.040 8.664 -3.933
295 HB ILE 58 HB ILE 58 3.607 5.659 -3.717
296 HG12 ILE 58 2HG1 ILE 58 6.000 6.186 -3.790
297 HG13 ILE 58 1HG1 ILE 58 5.488 5.411 -5.282
298 HG21 ILE 58 1HG2 ILE 58 3.184 5.687 -6.127
299 HG22 ILE 58 2HG2 ILE 58 3.337 7.442 -6.131
300 HG23 ILE 58 3HG2 ILE 58 2.015 6.678 -5.249
301 HD11 ILE 58 3HD1 ILE 58 6.008 8.357 -4.897
302 HD12 ILE 58 1HD1 ILE 58 5.455 7.600 -6.392
303 HD13 ILE 58 2HD1 ILE 58 7.041 7.203 -5.738
304 H THR 59 H THR 59 2.033 9.470 -4.113
305 HA THR 59 HA THR 59 0.075 8.749 -2.119
306 HB THR 59 HB THR 59 -0.007 10.845 -4.312
307 HG1 THR 59 1HG THR 59 1.568 11.319 -2.847
308 HG21 THR 59 3HG2 THR 59 -1.842 11.834 -2.957
309 HG22 THR 59 1HG2 THR 59 -1.784 10.430 -1.891
310 HG23 THR 59 2HG2 THR 59 -2.261 10.239 -3.578
311 H TYR 60 H TYR 60 -1.743 7.637 -2.536
312 HA TYR 60 HA TYR 60 -2.127 6.693 -5.277
313 HB2 TYR 60 2HB TYR 60 -2.620 5.243 -2.678
314 HB3 TYR 60 1HB TYR 60 -3.140 4.638 -4.252
315 HD1 TYR 60 1HD TYR 60 -1.435 3.987 -5.931
316 HD2 TYR 60 2HD TYR 60 -0.356 5.065 -1.966
317 HE1 TYR 60 1HE TYR 60 0.763 2.974 -6.267
318 HE2 TYR 60 2HE TYR 60 1.860 4.045 -2.285
319 HH TYR 60 HH TYR 60 2.950 3.066 -5.393
320 H GLY 61 H GLY 61 -4.267 6.236 -5.909
321 HA2 GLY 61 2HA GLY 61 -6.046 8.345 -5.275
322 HA3 GLY 61 1HA GLY 61 -6.375 7.008 -6.365
323 H ASN 62 H ASN 62 -5.740 5.137 -4.053
324 HA ASN 62 HA ASN 62 -7.340 5.587 -1.891
325 HB2 ASN 62 2HB ASN 62 -9.336 4.161 -2.231
326 HB3 ASN 62 1HB ASN 62 -9.337 5.519 -3.333
327 HD21 ASN 62 1HD2 ASN 62 -10.739 4.555 -4.728
328 HD22 ASN 62 2HD2 ASN 62 -10.352 3.236 -5.743
329 H GLU 63 H GLU 63 -8.001 3.466 -0.824
330 HA GLU 63 HA GLU 63 -5.760 2.099 -0.083
331 HB2 GLU 63 2HB GLU 63 -7.388 0.399 0.825
332 HB3 GLU 63 1HB GLU 63 -7.566 2.064 1.356
333 HG2 GLU 63 2HG GLU 63 -9.420 2.370 -0.206
334 HG3 GLU 63 1HG GLU 63 -9.183 0.737 -0.822
335 H CYS 64 H CYS 64 -7.988 1.226 -2.653
336 HA CYS 64 HA CYS 64 -7.106 -1.425 -2.985
337 HB2 CYS 64 2HB CYS 64 -9.182 -0.834 -3.928
338 HB3 CYS 64 1HB CYS 64 -8.473 0.491 -4.851
339 H HIS 65 H HIS 65 -6.111 1.607 -4.478
340 HA HIS 65 HA HIS 65 -4.296 0.359 -6.295
341 HB2 HIS 65 2HB HIS 65 -4.355 3.226 -5.330
342 HB3 HIS 65 1HB HIS 65 -3.355 2.630 -6.652
343 HD1 HIS 65 1HD HIS 65 -4.887 1.561 -8.732
344 HD2 HIS 65 2HD HIS 65 -6.734 4.184 -6.104
345 HE1 HIS 65 1HE HIS 65 -6.990 2.271 -9.858
346 HE2 HIS 65 2HE HIS 65 -7.836 4.143 -8.408
347 H LEU 66 H LEU 66 -4.004 1.774 -3.116
348 HA LEU 66 HA LEU 66 -1.220 1.515 -2.830
349 HB2 LEU 66 2HB LEU 66 -2.546 2.897 -1.337
350 HB3 LEU 66 1HB LEU 66 -3.451 1.507 -0.801
351 HG LEU 66 HG LEU 66 -1.476 0.626 0.349
352 HD11 LEU 66 1HD1 LEU 66 0.267 1.499 -1.114
353 HD12 LEU 66 2HD1 LEU 66 0.548 1.964 0.563
354 HD13 LEU 66 3HD1 LEU 66 -0.098 3.139 -0.580
355 HD21 LEU 66 3HD2 LEU 66 -2.027 3.510 1.003
356 HD22 LEU 66 1HD2 LEU 66 -1.346 2.303 2.093
357 HD23 LEU 66 2HD2 LEU 66 -3.003 2.132 1.508
358 H CYS 67 H CYS 67 -3.885 -0.639 -1.834
359 HA CYS 67 HA CYS 67 -2.315 -2.740 -0.892
360 HB2 CYS 67 2HB CYS 67 -4.682 -2.630 -0.413
361 HB3 CYS 67 1HB CYS 67 -5.077 -2.744 -2.116
362 H THR 68 H THR 68 -3.386 -2.027 -4.203
363 HA THR 68 HA THR 68 -2.601 -4.404 -5.425
364 HB THR 68 HB THR 68 -2.540 -1.601 -6.610
365 HG1 THR 68 1HG THR 68 -4.613 -2.429 -5.766
366 HG21 THR 68 3HG2 THR 68 -2.607 -4.310 -7.949
367 HG22 THR 68 1HG2 THR 68 -1.265 -3.168 -7.980
368 HG23 THR 68 2HG2 THR 68 -2.786 -2.768 -8.786
369 H GLU 69 H GLU 69 -0.719 -1.374 -5.051
370 HA GLU 69 HA GLU 69 1.664 -2.450 -6.081
371 HB2 GLU 69 2HB GLU 69 1.023 -0.028 -4.441
372 HB3 GLU 69 1HB GLU 69 2.682 -0.483 -4.806
373 HG2 GLU 69 2HG GLU 69 0.593 -0.074 -6.900
374 HG3 GLU 69 1HG GLU 69 1.657 1.198 -6.317
375 H SER 70 H SER 70 0.298 -2.317 -2.879
376 HA SER 70 HA SER 70 2.569 -2.983 -1.414
377 HB2 SER 70 2HB SER 70 0.291 -2.194 -0.532
378 HB3 SER 70 1HB SER 70 -0.232 -3.870 -0.703
379 HG SER 70 HG SER 70 1.887 -2.853 0.819
380 H LEU 71 H LEU 71 0.076 -5.064 -2.861
381 HA LEU 71 HA LEU 71 1.366 -7.478 -2.065
382 HB2 LEU 71 2HB LEU 71 -0.702 -7.015 -4.204
383 HB3 LEU 71 1HB LEU 71 -0.211 -8.579 -3.590
384 HG LEU 71 HG LEU 71 -1.639 -6.427 -2.047
385 HD11 LEU 71 1HD1 LEU 71 -3.490 -8.012 -2.021
386 HD12 LEU 71 2HD1 LEU 71 -2.551 -9.131 -3.008
387 HD13 LEU 71 3HD1 LEU 71 -3.047 -7.574 -3.669
388 HD21 LEU 71 3HD2 LEU 71 -0.808 -9.196 -1.164
389 HD22 LEU 71 1HD2 LEU 71 -1.735 -8.027 -0.223
390 HD23 LEU 71 2HD2 LEU 71 -0.063 -7.685 -0.634
391 H LYS 72 H LYS 72 1.298 -5.567 -5.004
392 HA LYS 72 HA LYS 72 2.684 -7.383 -6.631
393 HB2 LYS 72 2HB LYS 72 1.325 -5.427 -7.397
394 HB3 LYS 72 1HB LYS 72 2.616 -4.372 -6.856
395 HG2 LYS 72 2HG LYS 72 4.113 -5.294 -8.493
396 HG3 LYS 72 1HG LYS 72 2.900 -6.481 -8.981
397 HD2 LYS 72 2HD LYS 72 1.417 -4.672 -9.691
398 HD3 LYS 72 1HD LYS 72 2.617 -3.479 -9.203
399 HE2 LYS 72 2HE LYS 72 2.947 -5.578 -11.341
400 HE3 LYS 72 1HE LYS 72 2.675 -3.856 -11.608
401 HZ1 LYS 72 3HZ LYS 72 5.007 -4.376 -11.837
402 HZ2 LYS 72 1HZ LYS 72 5.053 -5.062 -10.299
403 HZ3 LYS 72 2HZ LYS 72 4.782 -3.413 -10.490
404 H SER 73 H SER 73 3.814 -4.959 -4.367
405 HA SER 73 HA SER 73 6.581 -5.596 -5.055
406 HB2 SER 73 2HB SER 73 5.507 -3.447 -3.219
407 HB3 SER 73 1HB SER 73 7.167 -3.625 -3.781
408 HG SER 73 HG SER 73 4.885 -2.828 -5.205
409 H ASN 74 H ASN 74 4.378 -6.969 -3.260
410 HA ASN 74 HA ASN 74 4.127 -8.058 -1.330
411 HB2 ASN 74 2HB ASN 74 5.631 -9.556 -2.628
412 HB3 ASN 74 1HB ASN 74 7.014 -8.834 -1.814
413 HD21 ASN 74 1HD2 ASN 74 7.453 -9.428 0.298
414 HD22 ASN 74 2HD2 ASN 74 6.663 -10.736 1.090
415 H GLY 75 H GLY 75 3.846 -6.115 -0.166
416 HA2 GLY 75 2HA GLY 75 3.885 -5.174 1.916
417 HA3 GLY 75 1HA GLY 75 5.146 -6.266 2.396
418 H ARG 76 H ARG 76 6.363 -4.808 -0.226
419 HA ARG 76 HA ARG 76 8.281 -3.209 1.029
420 HB2 ARG 76 2HB ARG 76 8.473 -4.001 -1.291
421 HB3 ARG 76 1HB ARG 76 7.130 -2.972 -1.743
422 HG2 ARG 76 2HG ARG 76 8.498 -0.997 -1.093
423 HG3 ARG 76 1HG ARG 76 9.862 -2.099 -0.874
424 HD2 ARG 76 2HD ARG 76 9.744 -2.773 -3.190
425 HD3 ARG 76 1HD ARG 76 8.285 -1.805 -3.426
426 HE ARG 76 HE ARG 76 10.899 -0.681 -2.747
427 HH11 ARG 76 1HH1 ARG 76 7.916 -0.580 -4.743
428 HH12 ARG 76 2HH1 ARG 76 8.315 0.904 -5.451
429 HH21 ARG 76 1HH2 ARG 76 11.396 1.342 -3.778
430 HH22 ARG 76 2HH2 ARG 76 10.300 2.028 -4.883
431 H VAL 77 H VAL 77 5.512 -2.049 -0.860
432 HA VAL 77 HA VAL 77 5.643 0.425 0.611
433 HB VAL 77 HB VAL 77 5.481 0.734 -1.794
434 HG11 VAL 77 1HG1 VAL 77 4.518 -1.378 -2.423
435 HG12 VAL 77 2HG1 VAL 77 3.627 -0.025 -3.121
436 HG13 VAL 77 3HG1 VAL 77 2.968 -0.890 -1.733
437 HG21 VAL 77 3HG2 VAL 77 4.282 2.416 -0.546
438 HG22 VAL 77 1HG2 VAL 77 2.843 1.388 -0.494
439 HG23 VAL 77 2HG2 VAL 77 3.397 2.034 -2.031
440 H GLN 78 H GLN 78 4.438 0.771 2.244
441 HA GLN 78 HA GLN 78 2.065 -0.906 2.692
442 HB2 GLN 78 2HB GLN 78 4.224 -1.352 4.058
443 HB3 GLN 78 1HB GLN 78 3.922 0.205 4.806
444 HG2 GLN 78 2HG GLN 78 3.043 -1.308 6.306
445 HG3 GLN 78 1HG GLN 78 1.627 -0.758 5.427
446 HE21 GLN 78 1HE2 GLN 78 2.579 -2.600 3.062
447 HE22 GLN 78 2HE2 GLN 78 2.019 -4.127 3.605
448 H PHE 79 H PHE 79 0.636 0.320 4.376
449 HA PHE 79 HA PHE 79 0.085 2.960 3.462
450 HB2 PHE 79 2HB PHE 79 -1.639 1.409 4.288
451 HB3 PHE 79 1HB PHE 79 -0.903 1.416 5.879
452 HD1 PHE 79 1HD PHE 79 -1.072 3.502 7.261
453 HD2 PHE 79 2HD PHE 79 -3.155 3.050 3.584
454 HE1 PHE 79 1HE PHE 79 -2.621 5.277 7.927
455 HE2 PHE 79 2HE PHE 79 -4.703 4.834 4.238
456 HZ PHE 79 HZ PHE 79 -4.438 5.949 6.418
457 H LEU 80 H LEU 80 1.264 4.666 3.998
458 HA LEU 80 HA LEU 80 2.915 4.619 6.383
459 HB2 LEU 80 2HB LEU 80 3.734 5.457 4.171
460 HB3 LEU 80 1HB LEU 80 2.563 6.751 4.274
461 HG LEU 80 HG LEU 80 3.730 7.541 6.348
462 HD11 LEU 80 1HD1 LEU 80 5.808 5.538 5.507
463 HD12 LEU 80 2HD1 LEU 80 4.822 5.457 6.968
464 HD13 LEU 80 3HD1 LEU 80 5.995 6.758 6.765
465 HD21 LEU 80 3HD2 LEU 80 5.590 8.558 5.130
466 HD22 LEU 80 1HD2 LEU 80 4.095 8.579 4.194
467 HD23 LEU 80 2HD2 LEU 80 5.357 7.400 3.816
468 H HIS 81 H HIS 81 0.518 6.730 4.853
469 HA HIS 81 HA HIS 81 -0.973 7.084 7.221
470 HB2 HIS 81 2HB HIS 81 -0.794 9.563 7.341
471 HB3 HIS 81 1HB HIS 81 0.720 8.778 7.743
472 HD1 HIS 81 1HD HIS 81 -0.890 10.931 5.054
473 HD2 HIS 81 2HD HIS 81 2.856 9.454 6.087
474 HE1 HIS 81 1HE HIS 81 0.777 12.117 3.567
475 HE2 HIS 81 2HE HIS 81 2.981 11.471 4.553
476 H ASP 82 H ASP 82 -2.910 8.392 6.699
477 HA ASP 82 HA ASP 82 -3.612 8.000 3.925
478 HB2 ASP 82 2HB ASP 82 -5.842 8.614 4.513
479 HB3 ASP 82 1HB ASP 82 -5.263 7.690 5.890
480 H GLY 83 H GLY 83 -4.638 9.890 2.775
481 HA2 GLY 83 2HA GLY 83 -4.663 12.089 2.204
482 HA3 GLY 83 1HA GLY 83 -3.542 12.456 3.524
483 H SER 84 H SER 84 -3.142 13.481 1.041
484 HA SER 84 HA SER 84 -1.419 11.936 -0.532
485 HB2 SER 84 2HB SER 84 -1.688 14.926 -0.249
486 HB3 SER 84 1HB SER 84 -0.943 14.072 -1.619
487 HG SER 84 HG SER 84 -3.452 14.734 -1.231
488 H CYS 85 H CYS 85 0.824 11.920 -0.595
489 HA CYS 85 HA CYS 85 2.107 11.762 1.848
490 HB2 CYS 85 2HB CYS 85 3.312 11.993 -0.901
491 HB3 CYS 85 1HB CYS 85 4.168 11.522 0.574
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