Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
504357 | 2ecy RC | 11164 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -44.128 15.589 -17.428
2 HA2 GLY 1 1HA GLY 1 -44.994 13.325 -16.074
3 HA3 GLY 1 2HA GLY 1 -45.048 12.927 -17.784
4 H SER 2 H SER 2 -42.717 15.013 -16.138
5 HA SER 2 HA SER 2 -40.647 12.973 -16.478
6 HB3 SER 2 2HB SER 2 -40.882 15.450 -18.021
7 HG SER 2 HG SER 2 -38.273 14.868 -17.187
8 H SER 3 H SER 3 -39.663 12.744 -14.594
9 HA SER 3 HA SER 3 -38.465 14.860 -13.175
10 HB3 SER 3 2HB SER 3 -40.602 13.744 -11.443
11 HG SER 3 HG SER 3 -38.978 15.385 -10.871
12 H GLY 4 H GLY 4 -37.195 14.137 -11.421
13 HA2 GLY 4 1HA GLY 4 -36.091 11.615 -11.638
14 HA3 GLY 4 2HA GLY 4 -35.976 12.620 -10.202
15 H SER 5 H SER 5 -36.030 9.880 -9.993
16 HA SER 5 HA SER 5 -38.514 9.506 -8.508
17 HB3 SER 5 2HB SER 5 -37.531 7.364 -10.399
18 HG SER 5 HG SER 5 -39.721 6.637 -10.032
19 H SER 6 H SER 6 -35.284 8.365 -9.326
20 HA SER 6 HA SER 6 -35.153 6.711 -6.939
21 HB3 SER 6 2HB SER 6 -33.710 5.547 -8.194
22 HG SER 6 HG SER 6 -33.525 6.035 -10.286
23 H GLY 7 H GLY 7 -35.007 7.905 -5.120
24 HA2 GLY 7 1HA GLY 7 -34.205 9.414 -3.582
25 HA3 GLY 7 2HA GLY 7 -32.638 9.042 -4.287
26 H PHE 8 H PHE 8 -32.684 11.447 -3.366
27 HA PHE 8 HA PHE 8 -33.081 13.162 -5.724
28 HB3 PHE 8 2HB PHE 8 -33.605 15.027 -4.077
29 HD1 PHE 8 1HD PHE 8 -35.373 11.778 -3.588
30 HD2 PHE 8 2HD PHE 8 -35.505 15.737 -5.142
31 HE1 PHE 8 1HE PHE 8 -37.713 11.431 -4.264
32 HE2 PHE 8 2HE PHE 8 -37.845 15.399 -5.819
33 HZ PHE 8 HZ PHE 8 -38.954 13.243 -5.379
34 H VAL 9 H VAL 9 -30.711 11.777 -4.798
35 HA VAL 9 HA VAL 9 -29.025 14.043 -3.961
36 HB VAL 9 HB VAL 9 -28.916 12.141 -2.433
37 HG11 VAL 9 1HG1 VAL 9 -29.498 10.390 -4.065
38 HG12 VAL 9 2HG1 VAL 9 -27.898 10.558 -4.791
39 HG13 VAL 9 3HG1 VAL 9 -28.059 9.985 -3.131
40 HG21 VAL 9 3HG2 VAL 9 -26.330 11.617 -3.031
41 HG22 VAL 9 1HG2 VAL 9 -26.597 13.079 -3.979
42 HG23 VAL 9 2HG2 VAL 9 -26.883 13.093 -2.239
43 H LYS 10 H LYS 10 -27.579 14.844 -5.342
44 HA LYS 10 HA LYS 10 -27.116 13.388 -7.856
45 HB3 LYS 10 2HB LYS 10 -26.145 15.964 -8.203
46 HG3 LYS 10 2HG LYS 10 -28.744 14.673 -8.932
47 HD3 LYS 10 2HD LYS 10 -28.640 17.359 -8.608
48 HE3 LYS 10 2HE LYS 10 -28.564 17.992 -11.199
49 HZ1 LYS 10 3HZ LYS 10 -26.489 19.006 -10.804
50 HZ2 LYS 10 1HZ LYS 10 -26.053 17.865 -9.633
51 HZ3 LYS 10 2HZ LYS 10 -27.278 18.984 -9.307
52 H THR 11 H THR 11 -25.076 12.938 -8.557
53 HA THR 11 HA THR 11 -22.819 12.628 -8.514
54 HB THR 11 HB THR 11 -22.308 14.688 -6.441
55 HG1 THR 11 1HG THR 11 -23.785 15.906 -7.449
56 HG21 THR 11 3HG2 THR 11 -20.618 13.428 -7.929
57 HG22 THR 11 1HG2 THR 11 -20.429 15.171 -7.741
58 HG23 THR 11 2HG2 THR 11 -21.158 14.516 -9.208
59 H VAL 12 H VAL 12 -21.109 11.752 -7.171
60 HA VAL 12 HA VAL 12 -22.098 10.068 -5.123
61 HB VAL 12 HB VAL 12 -20.231 9.336 -6.458
62 HG11 VAL 12 1HG1 VAL 12 -18.513 10.634 -7.015
63 HG12 VAL 12 2HG1 VAL 12 -19.321 11.955 -6.167
64 HG13 VAL 12 3HG1 VAL 12 -18.133 10.960 -5.325
65 HG21 VAL 12 3HG2 VAL 12 -19.083 8.276 -4.794
66 HG22 VAL 12 1HG2 VAL 12 -18.897 9.744 -3.835
67 HG23 VAL 12 2HG2 VAL 12 -20.442 8.894 -3.855
68 H GLU 13 H GLU 13 -22.676 10.754 -3.171
69 HA GLU 13 HA GLU 13 -21.120 12.906 -1.907
70 HB3 GLU 13 2HB GLU 13 -23.213 12.890 -0.334
71 HG3 GLU 13 2HG GLU 13 -24.508 14.313 -1.934
72 H ASP 14 H ASP 14 -19.583 10.993 -1.556
73 HA ASP 14 HA ASP 14 -19.598 10.321 1.172
74 HB3 ASP 14 2HB ASP 14 -20.084 7.913 -0.576
75 H LYS 15 H LYS 15 -17.660 9.368 1.841
76 HA LYS 15 HA LYS 15 -15.746 8.486 -0.153
77 HB3 LYS 15 2HB LYS 15 -15.331 10.848 -0.230
78 HG3 LYS 15 2HG LYS 15 -14.436 11.268 2.491
79 HD3 LYS 15 2HD LYS 15 -15.630 13.349 2.235
80 HE3 LYS 15 2HE LYS 15 -13.769 12.364 0.258
81 HZ1 LYS 15 3HZ LYS 15 -15.960 13.634 -0.860
82 HZ2 LYS 15 1HZ LYS 15 -14.477 13.300 -1.603
83 HZ3 LYS 15 2HZ LYS 15 -14.724 14.787 -0.834
84 H TYR 16 H TYR 16 -13.479 8.315 1.220
85 HA TYR 16 HA TYR 16 -14.196 6.814 3.653
86 HB3 TYR 16 2HB TYR 16 -12.448 5.240 3.167
87 HD1 TYR 16 1HD TYR 16 -13.199 6.403 -0.257
88 HD2 TYR 16 2HD TYR 16 -14.246 3.709 2.866
89 HE1 TYR 16 1HE TYR 16 -14.633 5.157 -1.820
90 HE2 TYR 16 2HE TYR 16 -15.681 2.456 1.311
91 HH TYR 16 HH TYR 16 -15.728 2.130 -1.295
92 H LYS 17 H LYS 17 -12.163 6.470 5.072
93 HA LYS 17 HA LYS 17 -10.292 8.683 5.037
94 HB3 LYS 17 2HB LYS 17 -12.495 8.424 7.042
95 HG3 LYS 17 2HG LYS 17 -10.779 10.262 8.164
96 HD3 LYS 17 2HD LYS 17 -10.385 8.136 9.756
97 HE3 LYS 17 2HE LYS 17 -12.355 10.211 9.505
98 HZ1 LYS 17 3HZ LYS 17 -14.181 8.921 9.567
99 HZ2 LYS 17 1HZ LYS 17 -13.811 8.794 11.212
100 HZ3 LYS 17 2HZ LYS 17 -13.358 7.561 10.147
101 H CYS 18 H CYS 18 -8.400 8.232 6.086
102 HA CYS 18 HA CYS 18 -7.773 5.537 6.605
103 HB3 CYS 18 2HB CYS 18 -6.311 8.095 7.272
104 H GLU 19 H GLU 19 -7.581 4.369 8.462
105 HA GLU 19 HA GLU 19 -9.000 5.381 10.774
106 HB3 GLU 19 2HB GLU 19 -8.105 2.918 11.520
107 HG3 GLU 19 2HG GLU 19 -10.219 2.056 11.037
108 H LYS 20 H LYS 20 -6.325 6.451 10.011
109 HA LYS 20 HA LYS 20 -5.027 6.033 12.616
110 HB3 LYS 20 2HB LYS 20 -3.071 6.652 10.597
111 HG3 LYS 20 2HG LYS 20 -3.509 4.411 12.529
112 HD3 LYS 20 2HD LYS 20 -1.177 4.613 10.629
113 HE3 LYS 20 2HE LYS 20 -0.288 2.819 11.686
114 HZ1 LYS 20 3HZ LYS 20 -0.778 2.815 14.074
115 HZ2 LYS 20 1HZ LYS 20 -2.117 3.812 13.805
116 HZ3 LYS 20 2HZ LYS 20 -0.559 4.383 13.478
117 H CYS 21 H CYS 21 -4.656 8.053 9.694
118 HA CYS 21 HA CYS 21 -4.291 10.385 11.433
119 HB3 CYS 21 2HB CYS 21 -2.517 10.158 9.855
120 H HIS 22 H HIS 22 -6.792 8.872 10.079
121 HA HIS 22 HA HIS 22 -8.907 9.452 9.478
122 HB3 HIS 22 2HB HIS 22 -9.790 10.950 10.894
123 HD2 HIS 22 2HD HIS 22 -7.637 9.255 12.497
124 HE1 HIS 22 1HE HIS 22 -6.334 12.941 14.145
125 HE2 HIS 22 2HE HIS 22 -6.240 10.431 14.329
126 H LEU 23 H LEU 23 -6.598 9.961 7.661
127 HA LEU 23 HA LEU 23 -7.139 12.313 6.159
128 HB3 LEU 23 2HB LEU 23 -5.873 10.699 4.389
129 HG LEU 23 HG LEU 23 -3.671 11.382 5.724
130 HD11 LEU 23 1HD1 LEU 23 -3.698 13.475 4.501
131 HD12 LEU 23 2HD1 LEU 23 -5.443 13.348 4.280
132 HD13 LEU 23 3HD1 LEU 23 -4.369 12.180 3.510
133 HD21 LEU 23 3HD2 LEU 23 -3.891 13.034 7.278
134 HD22 LEU 23 1HD2 LEU 23 -5.380 12.143 7.599
135 HD23 LEU 23 2HD2 LEU 23 -5.424 13.607 6.616
136 H VAL 24 H VAL 24 -8.912 12.656 5.009
137 HA VAL 24 HA VAL 24 -10.701 10.594 4.224
138 HB VAL 24 HB VAL 24 -10.575 13.478 3.331
139 HG11 VAL 24 1HG1 VAL 24 -13.133 12.860 2.998
140 HG12 VAL 24 2HG1 VAL 24 -11.939 12.616 1.721
141 HG13 VAL 24 3HG1 VAL 24 -12.450 11.258 2.725
142 HG21 VAL 24 3HG2 VAL 24 -10.916 13.402 5.684
143 HG22 VAL 24 1HG2 VAL 24 -12.491 13.701 4.949
144 HG23 VAL 24 2HG2 VAL 24 -12.084 12.089 5.538
145 H LEU 25 H LEU 25 -10.451 9.236 2.588
146 HA LEU 25 HA LEU 25 -9.081 10.189 0.161
147 HB3 LEU 25 2HB LEU 25 -7.600 8.552 0.307
148 HG LEU 25 HG LEU 25 -8.936 8.051 2.921
149 HD11 LEU 25 1HD1 LEU 25 -6.649 6.330 2.536
150 HD12 LEU 25 2HD1 LEU 25 -7.961 5.918 1.433
151 HD13 LEU 25 3HD1 LEU 25 -8.250 5.953 3.173
152 HD21 LEU 25 3HD2 LEU 25 -6.144 8.730 2.015
153 HD22 LEU 25 1HD2 LEU 25 -6.588 8.410 3.692
154 HD23 LEU 25 2HD2 LEU 25 -7.295 9.784 2.840
155 H CYS 26 H CYS 26 -9.644 8.879 -1.797
156 HA CYS 26 HA CYS 26 -12.531 8.422 -1.825
157 HB3 CYS 26 2HB CYS 26 -11.603 8.193 -4.437
158 H SER 27 H SER 27 -9.485 6.819 -2.590
159 HA SER 27 HA SER 27 -10.940 4.262 -2.670
160 HB3 SER 27 2HB SER 27 -8.762 5.213 -4.533
161 HG SER 27 HG SER 27 -9.712 2.693 -4.955
162 HA PRO 28 HA PRO 28 -7.645 4.104 0.556
163 HB3 PRO 28 2HB PRO 28 -9.206 4.459 2.203
164 HG3 PRO 28 2HG PRO 28 -11.450 3.954 1.859
165 HD3 PRO 28 2HD PRO 28 -11.026 5.192 -0.039
166 H LYS 29 H LYS 29 -7.474 1.838 2.058
167 HA LYS 29 HA LYS 29 -7.286 -0.325 0.066
168 HB3 LYS 29 2HB LYS 29 -5.174 -0.942 0.823
169 HG3 LYS 29 2HG LYS 29 -3.861 1.224 1.293
170 HD3 LYS 29 2HD LYS 29 -5.155 1.757 -1.236
171 HE3 LYS 29 2HE LYS 29 -2.474 0.650 -0.419
172 HZ1 LYS 29 3HZ LYS 29 -3.356 1.583 -3.097
173 HZ2 LYS 29 1HZ LYS 29 -2.993 -0.017 -2.683
174 HZ3 LYS 29 2HZ LYS 29 -1.776 1.157 -2.671
175 H GLN 30 H GLN 30 -9.570 -0.308 1.352
176 HA GLN 30 HA GLN 30 -10.027 -1.192 3.833
177 HB3 GLN 30 2HB GLN 30 -11.356 -2.892 1.819
178 HG3 GLN 30 2HG GLN 30 -12.425 -0.905 3.809
179 HE21 GLN 30 1HE2 GLN 30 -14.334 -3.250 4.250
180 HE22 GLN 30 2HE2 GLN 30 -15.538 -3.024 3.032
181 H THR 31 H THR 31 -9.060 -2.631 5.085
182 HA THR 31 HA THR 31 -7.442 -4.740 4.060
183 HB THR 31 HB THR 31 -6.917 -5.281 6.295
184 HG1 THR 31 1HG THR 31 -9.349 -3.966 6.985
185 HG21 THR 31 3HG2 THR 31 -7.542 -2.439 6.839
186 HG22 THR 31 1HG2 THR 31 -6.573 -2.774 5.405
187 HG23 THR 31 2HG2 THR 31 -6.019 -3.313 6.990
188 H GLU 32 H GLU 32 -8.160 -6.705 6.106
189 HA GLU 32 HA GLU 32 -10.407 -7.937 4.682
190 HB3 GLU 32 2HB GLU 32 -9.131 -9.672 6.601
191 HG3 GLU 32 2HG GLU 32 -8.711 -11.089 4.709
192 H CYS 33 H CYS 33 -10.311 -5.925 7.062
193 HA CYS 33 HA CYS 33 -12.165 -7.430 8.790
194 HB3 CYS 33 2HB CYS 33 -9.997 -6.687 9.855
195 H GLY 34 H GLY 34 -11.575 -4.507 6.981
196 HA2 GLY 34 1HA GLY 34 -13.802 -3.668 6.055
197 HA3 GLY 34 2HA GLY 34 -14.240 -3.503 7.750
198 H HIS 35 H HIS 35 -12.084 -2.395 8.907
199 HA HIS 35 HA HIS 35 -12.299 0.290 8.458
200 HB3 HIS 35 2HB HIS 35 -10.078 0.516 9.583
201 HD2 HIS 35 2HD HIS 35 -12.246 1.306 11.334
202 HE1 HIS 35 1HE HIS 35 -12.276 -2.420 13.362
203 HE2 HIS 35 2HE HIS 35 -13.134 -0.052 13.348
204 H ARG 36 H ARG 36 -10.363 1.750 7.789
205 HA ARG 36 HA ARG 36 -9.035 0.751 5.383
206 HB3 ARG 36 2HB ARG 36 -9.694 2.938 4.234
207 HG3 ARG 36 2HG ARG 36 -11.471 0.620 4.685
208 HD3 ARG 36 2HD ARG 36 -12.573 2.586 2.823
209 HE ARG 36 HE ARG 36 -14.192 1.029 3.224
210 HH11 ARG 36 1HH1 ARG 36 -12.791 1.996 6.261
211 HH12 ARG 36 2HH1 ARG 36 -13.925 1.102 7.218
212 HH21 ARG 36 1HH2 ARG 36 -15.691 -0.152 4.474
213 HH22 ARG 36 2HH2 ARG 36 -15.574 -0.121 6.200
214 H PHE 37 H PHE 37 -7.272 2.107 4.663
215 HA PHE 37 HA PHE 37 -6.360 4.122 6.576
216 HB3 PHE 37 2HB PHE 37 -4.029 3.049 6.394
217 HD1 PHE 37 1HD PHE 37 -6.419 0.410 7.307
218 HD2 PHE 37 2HD PHE 37 -4.067 3.679 8.688
219 HE1 PHE 37 1HE PHE 37 -6.836 -0.276 9.633
220 HE2 PHE 37 2HE PHE 37 -4.479 2.996 11.016
221 HZ PHE 37 HZ PHE 37 -5.864 1.016 11.491
222 H CYS 38 H CYS 38 -4.279 5.179 5.721
223 HA CYS 38 HA CYS 38 -4.749 5.828 2.912
224 HB3 CYS 38 2HB CYS 38 -4.581 7.629 4.657
225 H GLU 39 H GLU 39 -2.890 6.137 1.470
226 HA GLU 39 HA GLU 39 -1.409 3.924 1.008
227 HB3 GLU 39 2HB GLU 39 0.350 5.865 0.184
228 HG3 GLU 39 2HG GLU 39 -2.128 5.513 -1.418
229 H SER 40 H SER 40 -0.320 6.715 2.925
230 HA SER 40 HA SER 40 2.212 5.718 3.581
231 HB3 SER 40 2HB SER 40 1.981 7.300 5.591
232 HG SER 40 HG SER 40 1.301 8.802 3.385
233 H CYS 41 H CYS 41 -0.131 6.201 6.164
234 HA CYS 41 HA CYS 41 0.729 4.482 8.005
235 HB3 CYS 41 2HB CYS 41 -1.613 4.131 8.738
236 H MET 42 H MET 42 -1.252 3.516 5.225
237 HA MET 42 HA MET 42 -1.584 0.830 5.825
238 HB3 MET 42 2HB MET 42 -1.344 2.279 3.197
239 HG3 MET 42 2HG MET 42 -0.669 -0.021 2.770
240 HE1 MET 42 3HE MET 42 -3.421 0.069 5.611
241 HE2 MET 42 1HE MET 42 -4.235 0.313 4.065
242 HE3 MET 42 2HE MET 42 -4.517 -1.164 4.985
243 H ALA 43 H ALA 43 0.960 2.268 3.777
244 HA ALA 43 HA ALA 43 2.428 -0.082 3.389
245 HB1 ALA 43 3HB ALA 43 3.426 1.323 1.989
246 HB2 ALA 43 1HB ALA 43 2.749 2.719 2.829
247 HB3 ALA 43 2HB ALA 43 4.275 2.019 3.369
248 H ALA 44 H ALA 44 2.268 2.087 6.090
249 HA ALA 44 HA ALA 44 4.726 1.352 7.316
250 HB1 ALA 44 3HB ALA 44 2.489 2.254 9.026
251 HB2 ALA 44 1HB ALA 44 4.163 2.805 8.958
252 HB3 ALA 44 2HB ALA 44 3.005 3.351 7.747
253 H LEU 45 H LEU 45 1.355 0.470 8.095
254 HA LEU 45 HA LEU 45 1.920 -1.404 10.068
255 HB3 LEU 45 2HB LEU 45 -0.303 -2.291 9.664
256 HG LEU 45 HG LEU 45 -0.290 0.702 9.293
257 HD11 LEU 45 1HD1 LEU 45 -2.595 0.677 9.960
258 HD12 LEU 45 2HD1 LEU 45 -2.563 -1.075 10.161
259 HD13 LEU 45 3HD1 LEU 45 -2.401 -0.369 8.552
260 HD21 LEU 45 3HD2 LEU 45 0.079 0.865 11.481
261 HD22 LEU 45 1HD2 LEU 45 0.485 -0.852 11.461
262 HD23 LEU 45 2HD2 LEU 45 -1.158 -0.339 11.847
263 H LEU 46 H LEU 46 1.305 -1.981 6.605
264 HA LEU 46 HA LEU 46 1.639 -4.714 6.542
265 HB3 LEU 46 2HB LEU 46 2.229 -4.472 4.199
266 HG LEU 46 HG LEU 46 0.147 -2.465 5.044
267 HD11 LEU 46 1HD1 LEU 46 -0.593 -2.644 2.644
268 HD12 LEU 46 2HD1 LEU 46 0.979 -3.362 2.296
269 HD13 LEU 46 3HD1 LEU 46 0.880 -1.716 2.922
270 HD21 LEU 46 3HD2 LEU 46 -0.413 -4.754 5.573
271 HD22 LEU 46 1HD2 LEU 46 -0.011 -5.264 3.933
272 HD23 LEU 46 2HD2 LEU 46 -1.394 -4.204 4.214
273 H SER 47 H SER 47 4.064 -2.212 6.773
274 HA SER 47 HA SER 47 6.250 -4.069 6.343
275 HB3 SER 47 2HB SER 47 6.426 -1.194 7.265
276 HG SER 47 HG SER 47 8.468 -1.398 6.158
277 H SER 48 H SER 48 4.343 -4.310 8.645
278 HA SER 48 HA SER 48 6.259 -4.054 10.865
279 HB3 SER 48 2HB SER 48 3.271 -4.460 11.085
280 HG SER 48 HG SER 48 5.342 -3.809 12.886
281 H SER 49 H SER 49 5.701 -6.243 8.723
282 HA SER 49 HA SER 49 6.058 -8.498 8.657
283 HB3 SER 49 2HB SER 49 6.064 -8.930 11.578
284 HG SER 49 HG SER 49 8.001 -9.429 9.564
285 H SER 50 H SER 50 4.193 -7.949 11.649
286 HA SER 50 HA SER 50 2.123 -9.744 10.572
287 HB3 SER 50 2HB SER 50 1.448 -9.859 13.074
288 HG SER 50 HG SER 50 2.382 -11.642 12.147
289 HA PRO 51 HA PRO 51 0.323 -5.439 10.769
290 HB3 PRO 51 2HB PRO 51 0.971 -4.941 8.621
291 HG3 PRO 51 2HG PRO 51 1.424 -6.627 7.084
292 HD3 PRO 51 2HD PRO 51 2.702 -7.355 8.859
293 H LYS 52 H LYS 52 -1.567 -5.394 11.793
294 HA LYS 52 HA LYS 52 -3.629 -7.361 11.050
295 HB3 LYS 52 2HB LYS 52 -4.462 -7.257 13.270
296 HG3 LYS 52 2HG LYS 52 -1.487 -7.375 13.148
297 HD3 LYS 52 2HD LYS 52 -2.907 -7.999 15.698
298 HE3 LYS 52 2HE LYS 52 -0.255 -6.779 15.733
299 HZ1 LYS 52 3HZ LYS 52 0.192 -8.799 17.068
300 HZ2 LYS 52 1HZ LYS 52 -1.395 -9.313 16.781
301 HZ3 LYS 52 2HZ LYS 52 -1.111 -7.888 17.648
302 H CYS 53 H CYS 53 -3.671 -4.188 12.670
303 HA CYS 53 HA CYS 53 -4.719 -2.546 10.824
304 HB3 CYS 53 2HB CYS 53 -6.810 -4.472 11.762
305 H THR 54 H THR 54 -3.896 -0.971 12.116
306 HA THR 54 HA THR 54 -3.853 -0.537 14.735
307 HB THR 54 HB THR 54 -3.887 1.200 12.459
308 HG1 THR 54 1HG THR 54 -2.139 0.968 13.898
309 HG21 THR 54 3HG2 THR 54 -5.984 2.096 13.210
310 HG22 THR 54 1HG2 THR 54 -4.718 3.252 13.623
311 HG23 THR 54 2HG2 THR 54 -5.398 2.207 14.869
312 H ALA 55 H ALA 55 -6.743 -0.108 12.744
313 HA ALA 55 HA ALA 55 -8.458 1.030 14.592
314 HB1 ALA 55 3HB ALA 55 -8.698 0.022 12.040
315 HB2 ALA 55 1HB ALA 55 -9.773 -1.007 12.988
316 HB3 ALA 55 2HB ALA 55 -9.991 0.743 12.998
317 H CYS 56 H CYS 56 -8.759 -2.408 13.754
318 HA CYS 56 HA CYS 56 -9.283 -2.959 16.601
319 HB3 CYS 56 2HB CYS 56 -11.269 -3.325 15.265
320 H GLN 57 H GLN 57 -7.476 -3.853 13.775
321 HA GLN 57 HA GLN 57 -5.481 -5.001 13.673
322 HB3 GLN 57 2HB GLN 57 -4.422 -5.846 15.574
323 HG3 GLN 57 2HG GLN 57 -5.795 -4.275 17.467
324 HE21 GLN 57 1HE2 GLN 57 -3.403 -4.356 14.890
325 HE22 GLN 57 2HE2 GLN 57 -2.121 -3.648 15.807
326 H GLU 58 H GLU 58 -6.294 -6.314 12.069
327 HA GLU 58 HA GLU 58 -7.168 -8.977 12.960
328 HB3 GLU 58 2HB GLU 58 -8.358 -8.616 10.472
329 HG3 GLU 58 2HG GLU 58 -10.471 -8.628 11.622
330 H SER 59 H SER 59 -6.329 -7.311 9.917
331 HA SER 59 HA SER 59 -3.889 -8.583 9.491
332 HB3 SER 59 2HB SER 59 -5.827 -9.898 7.657
333 HG SER 59 HG SER 59 -3.764 -10.493 7.333
334 H ILE 60 H ILE 60 -2.875 -7.361 8.048
335 HA ILE 60 HA ILE 60 -4.480 -6.016 5.974
336 HB ILE 60 HB ILE 60 -1.940 -4.764 6.865
337 HG13 ILE 60 2HG1 ILE 60 -3.171 -5.429 8.964
338 HG21 ILE 60 1HG2 ILE 60 -4.240 -4.087 5.316
339 HG22 ILE 60 2HG2 ILE 60 -4.083 -2.945 6.650
340 HG23 ILE 60 3HG2 ILE 60 -2.741 -3.183 5.530
341 HD11 ILE 60 3HD1 ILE 60 -3.473 -2.529 9.045
342 HD12 ILE 60 1HD1 ILE 60 -2.483 -3.600 10.036
343 HD13 ILE 60 2HD1 ILE 60 -1.903 -3.074 8.455
344 H VAL 61 H VAL 61 -4.037 -6.975 4.098
345 HA VAL 61 HA VAL 61 -1.211 -7.378 3.383
346 HB VAL 61 HB VAL 61 -3.476 -9.313 2.901
347 HG11 VAL 61 1HG1 VAL 61 -2.467 -9.808 0.973
348 HG12 VAL 61 2HG1 VAL 61 -1.052 -8.832 1.370
349 HG13 VAL 61 3HG1 VAL 61 -1.171 -10.492 1.955
350 HG21 VAL 61 3HG2 VAL 61 -1.471 -10.774 3.925
351 HG22 VAL 61 1HG2 VAL 61 -1.128 -9.221 4.689
352 HG23 VAL 61 2HG2 VAL 61 -2.699 -9.989 4.918
353 H LYS 62 H LYS 62 -0.706 -6.246 1.639
354 HA LYS 62 HA LYS 62 -2.326 -4.659 0.141
355 HB3 LYS 62 2HB LYS 62 -0.021 -4.365 -0.167
356 HG3 LYS 62 2HG LYS 62 0.187 -7.216 -1.117
357 HD3 LYS 62 2HD LYS 62 2.064 -4.900 -1.092
358 HE3 LYS 62 2HE LYS 62 3.238 -6.351 0.376
359 HZ1 LYS 62 3HZ LYS 62 1.858 -8.358 -0.148
360 HZ2 LYS 62 1HZ LYS 62 3.513 -8.654 0.036
361 HZ3 LYS 62 2HZ LYS 62 2.831 -8.599 -1.511
362 H ASP 63 H ASP 63 -1.539 -8.050 -0.514
363 HA ASP 63 HA ASP 63 -2.902 -8.261 -2.964
364 HB3 ASP 63 2HB ASP 63 -2.903 -10.674 -1.279
365 H LYS 64 H LYS 64 -3.960 -8.777 0.369
366 HA LYS 64 HA LYS 64 -6.643 -9.477 -0.486
367 HB3 LYS 64 2HB LYS 64 -7.097 -9.964 1.787
368 HG3 LYS 64 2HG LYS 64 -4.988 -11.150 2.625
369 HD3 LYS 64 2HD LYS 64 -6.641 -11.702 0.258
370 HE3 LYS 64 2HE LYS 64 -4.321 -13.531 0.754
371 HZ1 LYS 64 3HZ LYS 64 -5.222 -13.393 -1.900
372 HZ2 LYS 64 1HZ LYS 64 -6.570 -13.569 -0.894
373 HZ3 LYS 64 2HZ LYS 64 -5.312 -14.696 -0.825
374 H VAL 65 H VAL 65 -4.983 -6.657 -0.146
375 HA VAL 65 HA VAL 65 -7.168 -5.105 0.996
376 HB VAL 65 HB VAL 65 -4.345 -4.735 0.752
377 HG11 VAL 65 1HG1 VAL 65 -4.925 -3.482 -1.301
378 HG12 VAL 65 2HG1 VAL 65 -5.954 -2.425 -0.331
379 HG13 VAL 65 3HG1 VAL 65 -4.212 -2.464 -0.049
380 HG21 VAL 65 3HG2 VAL 65 -5.043 -4.182 2.823
381 HG22 VAL 65 1HG2 VAL 65 -5.237 -2.577 2.119
382 HG23 VAL 65 2HG2 VAL 65 -6.628 -3.653 2.260
383 H PHE 66 H PHE 66 -8.210 -3.403 -0.110
384 HA PHE 66 HA PHE 66 -7.985 -3.486 -3.043
385 HB3 PHE 66 2HB PHE 66 -10.451 -3.213 -3.173
386 HD1 PHE 66 1HD PHE 66 -9.351 -5.589 -0.516
387 HD2 PHE 66 2HD PHE 66 -10.828 -5.064 -4.473
388 HE1 PHE 66 1HE PHE 66 -9.500 -8.031 -0.781
389 HE2 PHE 66 2HE PHE 66 -10.981 -7.505 -4.744
390 HZ PHE 66 HZ PHE 66 -10.317 -8.991 -2.896
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -49.063 19.040 -17.256
2 HA2 GLY 1 1HA GLY 1 -50.893 18.514 -15.247
3 HA3 GLY 1 2HA GLY 1 -50.911 17.747 -16.829
4 H SER 2 H SER 2 -50.476 15.627 -16.970
5 HA SER 2 HA SER 2 -48.814 14.213 -15.158
6 HB3 SER 2 2HB SER 2 -51.744 13.539 -14.878
7 HG SER 2 HG SER 2 -50.412 11.897 -14.213
8 H SER 3 H SER 3 -48.128 13.807 -17.404
9 HA SER 3 HA SER 3 -49.750 11.738 -18.728
10 HB3 SER 3 2HB SER 3 -47.926 12.361 -20.610
11 HG SER 3 HG SER 3 -50.226 12.527 -20.792
12 H GLY 4 H GLY 4 -48.445 10.780 -16.602
13 HA2 GLY 4 1HA GLY 4 -47.255 8.743 -16.366
14 HA3 GLY 4 2HA GLY 4 -46.382 9.113 -17.847
15 H SER 5 H SER 5 -44.355 9.785 -17.639
16 HA SER 5 HA SER 5 -42.422 10.583 -16.741
17 HB3 SER 5 2HB SER 5 -44.517 12.251 -15.543
18 HG SER 5 HG SER 5 -43.095 13.134 -13.979
19 H SER 6 H SER 6 -41.098 10.599 -14.683
20 HA SER 6 HA SER 6 -42.084 8.717 -12.670
21 HB3 SER 6 2HB SER 6 -40.922 7.302 -14.267
22 HG SER 6 HG SER 6 -38.535 8.723 -13.817
23 H GLY 7 H GLY 7 -40.123 8.419 -10.995
24 HA2 GLY 7 1HA GLY 7 -39.561 11.135 -10.091
25 HA3 GLY 7 2HA GLY 7 -39.391 9.666 -9.143
26 H PHE 8 H PHE 8 -37.457 11.676 -9.172
27 HA PHE 8 HA PHE 8 -35.335 10.846 -10.963
28 HB3 PHE 8 2HB PHE 8 -34.357 12.830 -10.478
29 HD1 PHE 8 1HD PHE 8 -36.896 12.894 -11.728
30 HD2 PHE 8 2HD PHE 8 -35.764 14.508 -7.955
31 HE1 PHE 8 1HE PHE 8 -38.715 14.543 -11.891
32 HE2 PHE 8 2HE PHE 8 -37.581 16.158 -8.112
33 HZ PHE 8 HZ PHE 8 -39.061 16.177 -10.081
34 H VAL 9 H VAL 9 -33.142 10.400 -10.054
35 HA VAL 9 HA VAL 9 -33.370 8.665 -7.682
36 HB VAL 9 HB VAL 9 -32.894 7.370 -9.677
37 HG11 VAL 9 1HG1 VAL 9 -31.867 8.559 -11.297
38 HG12 VAL 9 2HG1 VAL 9 -30.943 9.528 -10.148
39 HG13 VAL 9 3HG1 VAL 9 -30.407 7.899 -10.563
40 HG21 VAL 9 3HG2 VAL 9 -31.540 7.212 -7.332
41 HG22 VAL 9 1HG2 VAL 9 -31.409 6.037 -8.642
42 HG23 VAL 9 2HG2 VAL 9 -30.209 7.320 -8.485
43 H LYS 10 H LYS 10 -31.878 8.826 -6.065
44 HA LYS 10 HA LYS 10 -29.728 10.807 -6.387
45 HB3 LYS 10 2HB LYS 10 -30.375 11.096 -3.756
46 HG3 LYS 10 2HG LYS 10 -30.180 12.809 -5.750
47 HD3 LYS 10 2HD LYS 10 -33.057 12.165 -5.583
48 HE3 LYS 10 2HE LYS 10 -32.637 14.921 -6.416
49 HZ1 LYS 10 3HZ LYS 10 -34.745 13.473 -5.755
50 HZ2 LYS 10 1HZ LYS 10 -34.725 15.160 -5.632
51 HZ3 LYS 10 2HZ LYS 10 -34.459 14.209 -4.258
52 H THR 11 H THR 11 -27.893 9.707 -6.202
53 HA THR 11 HA THR 11 -27.754 7.350 -4.495
54 HB THR 11 HB THR 11 -25.240 8.086 -5.737
55 HG1 THR 11 1HG THR 11 -27.375 7.583 -7.545
56 HG21 THR 11 3HG2 THR 11 -27.001 5.743 -6.405
57 HG22 THR 11 1HG2 THR 11 -26.097 5.825 -4.894
58 HG23 THR 11 2HG2 THR 11 -25.240 5.842 -6.436
59 H VAL 12 H VAL 12 -26.706 7.246 -2.594
60 HA VAL 12 HA VAL 12 -25.930 9.643 -1.277
61 HB VAL 12 HB VAL 12 -25.477 6.773 -0.449
62 HG11 VAL 12 1HG1 VAL 12 -24.963 7.541 1.710
63 HG12 VAL 12 2HG1 VAL 12 -24.035 8.581 0.627
64 HG13 VAL 12 3HG1 VAL 12 -25.528 9.174 1.356
65 HG21 VAL 12 3HG2 VAL 12 -27.604 8.634 0.569
66 HG22 VAL 12 1HG2 VAL 12 -27.865 7.590 -0.829
67 HG23 VAL 12 2HG2 VAL 12 -27.497 6.881 0.744
68 H GLU 13 H GLU 13 -24.224 10.618 -2.325
69 HA GLU 13 HA GLU 13 -21.810 9.128 -2.901
70 HB3 GLU 13 2HB GLU 13 -20.957 11.272 -3.757
71 HG3 GLU 13 2HG GLU 13 -23.282 11.755 -5.148
72 H ASP 14 H ASP 14 -20.407 8.679 -1.347
73 HA ASP 14 HA ASP 14 -19.873 10.729 0.700
74 HB3 ASP 14 2HB ASP 14 -21.160 8.502 1.349
75 H LYS 15 H LYS 15 -17.812 9.240 1.971
76 HA LYS 15 HA LYS 15 -15.821 8.648 -0.050
77 HB3 LYS 15 2HB LYS 15 -15.522 11.008 0.005
78 HG3 LYS 15 2HG LYS 15 -15.046 11.091 2.943
79 HD3 LYS 15 2HD LYS 15 -16.264 13.169 1.148
80 HE3 LYS 15 2HE LYS 15 -14.780 13.201 3.767
81 HZ1 LYS 15 3HZ LYS 15 -14.149 15.277 3.405
82 HZ2 LYS 15 1HZ LYS 15 -15.719 15.740 2.975
83 HZ3 LYS 15 2HZ LYS 15 -14.658 15.150 1.797
84 H TYR 16 H TYR 16 -13.581 8.402 1.234
85 HA TYR 16 HA TYR 16 -14.199 6.787 3.621
86 HB3 TYR 16 2HB TYR 16 -12.416 5.287 3.019
87 HD1 TYR 16 2HD TYR 16 -13.271 6.527 -0.344
88 HD2 TYR 16 1HD TYR 16 -14.232 3.754 2.737
89 HE1 TYR 16 2HE TYR 16 -14.725 5.304 -1.906
90 HE2 TYR 16 1HE TYR 16 -15.689 2.524 1.183
91 HH TYR 16 HH TYR 16 -15.681 3.097 -2.185
92 H LYS 17 H LYS 17 -12.217 6.469 5.047
93 HA LYS 17 HA LYS 17 -10.335 8.678 5.043
94 HB3 LYS 17 2HB LYS 17 -12.538 8.381 7.045
95 HG3 LYS 17 2HG LYS 17 -10.820 10.212 8.185
96 HD3 LYS 17 2HD LYS 17 -10.429 8.069 9.755
97 HE3 LYS 17 2HE LYS 17 -12.370 10.162 9.541
98 HZ1 LYS 17 3HZ LYS 17 -14.222 9.223 10.595
99 HZ2 LYS 17 1HZ LYS 17 -13.433 7.757 10.898
100 HZ3 LYS 17 2HZ LYS 17 -13.880 8.167 9.318
101 H CYS 18 H CYS 18 -8.444 8.208 6.086
102 HA CYS 18 HA CYS 18 -7.820 5.504 6.561
103 HB3 CYS 18 2HB CYS 18 -6.359 8.056 7.251
104 H GLU 19 H GLU 19 -7.612 4.311 8.404
105 HA GLU 19 HA GLU 19 -9.033 5.289 10.732
106 HB3 GLU 19 2HB GLU 19 -8.292 2.858 11.514
107 HG3 GLU 19 2HG GLU 19 -10.293 1.956 10.734
108 H LYS 20 H LYS 20 -6.377 6.392 10.000
109 HA LYS 20 HA LYS 20 -5.072 5.926 12.591
110 HB3 LYS 20 2HB LYS 20 -3.104 6.561 10.601
111 HG3 LYS 20 2HG LYS 20 -3.584 4.265 12.457
112 HD3 LYS 20 2HD LYS 20 -1.238 4.519 10.581
113 HE3 LYS 20 2HE LYS 20 -0.324 2.743 11.627
114 HZ1 LYS 20 3HZ LYS 20 -0.859 2.640 13.995
115 HZ2 LYS 20 1HZ LYS 20 -2.240 3.580 13.735
116 HZ3 LYS 20 2HZ LYS 20 -0.707 4.238 13.465
117 H CYS 21 H CYS 21 -4.715 7.979 9.692
118 HA CYS 21 HA CYS 21 -4.334 10.290 11.457
119 HB3 CYS 21 2HB CYS 21 -2.563 10.075 9.872
120 H HIS 22 H HIS 22 -6.836 8.796 10.075
121 HA HIS 22 HA HIS 22 -8.953 9.388 9.488
122 HB3 HIS 22 2HB HIS 22 -9.833 10.871 10.922
123 HD2 HIS 22 2HD HIS 22 -7.678 9.148 12.499
124 HE1 HIS 22 1HE HIS 22 -6.378 12.809 14.204
125 HE2 HIS 22 2HE HIS 22 -6.283 10.296 14.350
126 H LEU 23 H LEU 23 -6.635 9.925 7.682
127 HA LEU 23 HA LEU 23 -7.174 12.293 6.207
128 HB3 LEU 23 2HB LEU 23 -5.916 10.700 4.415
129 HG LEU 23 HG LEU 23 -3.710 11.348 5.767
130 HD11 LEU 23 1HD1 LEU 23 -3.925 13.625 4.677
131 HD12 LEU 23 2HD1 LEU 23 -5.535 13.118 4.164
132 HD13 LEU 23 3HD1 LEU 23 -4.115 12.225 3.620
133 HD21 LEU 23 3HD2 LEU 23 -5.524 13.530 6.692
134 HD22 LEU 23 1HD2 LEU 23 -3.933 13.056 7.290
135 HD23 LEU 23 2HD2 LEU 23 -5.346 12.074 7.673
136 H VAL 24 H VAL 24 -8.951 12.657 5.068
137 HA VAL 24 HA VAL 24 -10.741 10.605 4.253
138 HB VAL 24 HB VAL 24 -10.634 13.501 3.395
139 HG11 VAL 24 1HG1 VAL 24 -12.711 13.265 2.420
140 HG12 VAL 24 2HG1 VAL 24 -11.952 11.726 2.006
141 HG13 VAL 24 3HG1 VAL 24 -13.098 11.814 3.344
142 HG21 VAL 24 3HG2 VAL 24 -10.898 13.352 5.776
143 HG22 VAL 24 1HG2 VAL 24 -12.460 13.765 5.068
144 HG23 VAL 24 2HG2 VAL 24 -12.145 12.116 5.607
145 H LEU 25 H LEU 25 -10.450 9.267 2.606
146 HA LEU 25 HA LEU 25 -9.111 10.283 0.186
147 HB3 LEU 25 2HB LEU 25 -7.608 8.665 0.317
148 HG LEU 25 HG LEU 25 -8.969 8.073 2.896
149 HD11 LEU 25 1HD1 LEU 25 -8.145 5.947 1.431
150 HD12 LEU 25 2HD1 LEU 25 -8.146 6.008 3.193
151 HD13 LEU 25 3HD1 LEU 25 -6.665 6.357 2.299
152 HD21 LEU 25 3HD2 LEU 25 -6.153 8.745 2.056
153 HD22 LEU 25 1HD2 LEU 25 -6.652 8.423 3.717
154 HD23 LEU 25 2HD2 LEU 25 -7.313 9.811 2.852
155 H CYS 26 H CYS 26 -9.634 8.883 -1.771
156 HA CYS 26 HA CYS 26 -12.528 8.385 -1.780
157 HB3 CYS 26 2HB CYS 26 -11.296 8.391 -4.400
158 H SER 27 H SER 27 -9.428 6.916 -2.373
159 HA SER 27 HA SER 27 -10.777 4.336 -2.761
160 HB3 SER 27 2HB SER 27 -10.040 5.104 -4.972
161 HG SER 27 HG SER 27 -8.228 6.367 -4.087
162 HA PRO 28 HA PRO 28 -7.635 4.148 0.633
163 HB3 PRO 28 2HB PRO 28 -9.259 4.486 2.223
164 HG3 PRO 28 2HG PRO 28 -11.489 4.001 1.782
165 HD3 PRO 28 2HD PRO 28 -10.983 5.267 -0.077
166 H LYS 29 H LYS 29 -7.537 1.857 2.104
167 HA LYS 29 HA LYS 29 -7.291 -0.279 0.088
168 HB3 LYS 29 2HB LYS 29 -5.244 -1.007 1.075
169 HG3 LYS 29 2HG LYS 29 -3.752 0.916 0.937
170 HD3 LYS 29 2HD LYS 29 -5.821 1.412 -1.164
171 HE3 LYS 29 2HE LYS 29 -3.443 2.417 -1.052
172 HZ1 LYS 29 3HZ LYS 29 -1.735 1.033 -1.144
173 HZ2 LYS 29 1HZ LYS 29 -2.327 0.320 -2.559
174 HZ3 LYS 29 2HZ LYS 29 -2.787 -0.288 -1.048
175 H GLN 30 H GLN 30 -9.613 -0.277 1.295
176 HA GLN 30 HA GLN 30 -10.182 -1.168 3.739
177 HB3 GLN 30 2HB GLN 30 -11.394 -2.937 1.733
178 HG3 GLN 30 2HG GLN 30 -12.450 -0.890 3.660
179 HE21 GLN 30 1HE2 GLN 30 -14.853 -2.099 4.090
180 HE22 GLN 30 2HE2 GLN 30 -15.851 -1.945 2.688
181 H THR 31 H THR 31 -9.098 -2.505 5.021
182 HA THR 31 HA THR 31 -7.461 -4.624 4.094
183 HB THR 31 HB THR 31 -7.059 -5.163 6.387
184 HG1 THR 31 1HG THR 31 -9.502 -3.802 6.816
185 HG21 THR 31 3HG2 THR 31 -7.541 -2.193 6.410
186 HG22 THR 31 1HG2 THR 31 -6.242 -2.930 5.475
187 HG23 THR 31 2HG2 THR 31 -6.272 -3.102 7.230
188 H GLU 32 H GLU 32 -7.968 -6.730 5.817
189 HA GLU 32 HA GLU 32 -10.250 -7.952 4.488
190 HB3 GLU 32 2HB GLU 32 -8.767 -9.557 6.453
191 HG3 GLU 32 2HG GLU 32 -8.383 -10.822 4.148
192 H CYS 33 H CYS 33 -10.230 -5.971 6.894
193 HA CYS 33 HA CYS 33 -12.056 -7.554 8.583
194 HB3 CYS 33 2HB CYS 33 -9.890 -6.775 9.660
195 H GLY 34 H GLY 34 -11.513 -4.588 6.835
196 HA2 GLY 34 1HA GLY 34 -13.753 -3.771 5.921
197 HA3 GLY 34 2HA GLY 34 -14.193 -3.641 7.618
198 H HIS 35 H HIS 35 -12.036 -2.525 8.785
199 HA HIS 35 HA HIS 35 -12.299 0.168 8.380
200 HB3 HIS 35 2HB HIS 35 -10.060 0.396 9.495
201 HD2 HIS 35 2HD HIS 35 -12.122 1.246 11.298
202 HE1 HIS 35 1HE HIS 35 -12.375 -2.519 13.236
203 HE2 HIS 35 2HE HIS 35 -13.086 -0.104 13.283
204 H ARG 36 H ARG 36 -10.411 1.676 7.724
205 HA ARG 36 HA ARG 36 -9.073 0.727 5.296
206 HB3 ARG 36 2HB ARG 36 -9.735 2.972 4.233
207 HG3 ARG 36 2HG ARG 36 -11.484 0.610 4.565
208 HD3 ARG 36 2HD ARG 36 -12.575 2.635 2.759
209 HE ARG 36 HE ARG 36 -14.111 0.955 3.072
210 HH11 ARG 36 1HH1 ARG 36 -13.045 2.161 6.160
211 HH12 ARG 36 2HH1 ARG 36 -14.251 1.300 7.058
212 HH21 ARG 36 1HH2 ARG 36 -15.703 -0.183 4.244
213 HH22 ARG 36 2HH2 ARG 36 -15.761 -0.034 5.969
214 H PHE 37 H PHE 37 -7.330 2.130 4.586
215 HA PHE 37 HA PHE 37 -6.401 4.097 6.534
216 HB3 PHE 37 2HB PHE 37 -4.075 3.014 6.362
217 HD1 PHE 37 2HD PHE 37 -6.550 0.423 7.228
218 HD2 PHE 37 1HD PHE 37 -4.066 3.567 8.660
219 HE1 PHE 37 2HE PHE 37 -6.990 -0.289 9.541
220 HE2 PHE 37 1HE PHE 37 -4.500 2.860 10.977
221 HZ PHE 37 HZ PHE 37 -5.965 0.930 11.419
222 H CYS 38 H CYS 38 -4.325 5.166 5.701
223 HA CYS 38 HA CYS 38 -4.767 5.825 2.891
224 HB3 CYS 38 2HB CYS 38 -4.613 7.611 4.661
225 H GLU 39 H GLU 39 -2.908 6.126 1.459
226 HA GLU 39 HA GLU 39 -1.419 3.922 1.000
227 HB3 GLU 39 2HB GLU 39 0.355 5.753 0.128
228 HG3 GLU 39 2HG GLU 39 -2.168 5.864 -1.383
229 H SER 40 H SER 40 -0.291 6.719 2.893
230 HA SER 40 HA SER 40 2.214 5.705 3.583
231 HB3 SER 40 2HB SER 40 1.751 7.240 5.712
232 HG SER 40 HG SER 40 1.970 8.191 3.046
233 H CYS 41 H CYS 41 -0.159 6.168 6.145
234 HA CYS 41 HA CYS 41 0.687 4.442 7.987
235 HB3 CYS 41 2HB CYS 41 -1.666 4.069 8.682
236 H MET 42 H MET 42 -1.115 3.501 5.098
237 HA MET 42 HA MET 42 -1.479 0.795 5.705
238 HB3 MET 42 2HB MET 42 -1.191 2.218 3.060
239 HG3 MET 42 2HG MET 42 -0.800 -0.417 3.203
240 HE1 MET 42 3HE MET 42 -2.376 -1.031 5.499
241 HE2 MET 42 1HE MET 42 -3.391 0.394 5.282
242 HE3 MET 42 2HE MET 42 -4.128 -1.205 5.390
243 H ALA 43 H ALA 43 1.063 2.301 3.704
244 HA ALA 43 HA ALA 43 2.565 -0.038 3.319
245 HB1 ALA 43 3HB ALA 43 2.957 2.837 2.894
246 HB2 ALA 43 1HB ALA 43 4.441 1.918 3.147
247 HB3 ALA 43 2HB ALA 43 3.337 1.469 1.846
248 H ALA 44 H ALA 44 2.160 1.900 6.083
249 HA ALA 44 HA ALA 44 4.707 1.290 7.292
250 HB1 ALA 44 3HB ALA 44 2.525 3.066 7.824
251 HB2 ALA 44 1HB ALA 44 2.910 2.142 9.276
252 HB3 ALA 44 2HB ALA 44 4.165 3.087 8.474
253 H LEU 45 H LEU 45 1.337 0.497 8.170
254 HA LEU 45 HA LEU 45 1.852 -1.355 10.141
255 HB3 LEU 45 2HB LEU 45 -0.352 -2.292 9.665
256 HG LEU 45 HG LEU 45 -0.355 0.705 9.316
257 HD11 LEU 45 1HD1 LEU 45 -2.678 0.632 9.974
258 HD12 LEU 45 2HD1 LEU 45 -2.621 -1.127 10.090
259 HD13 LEU 45 3HD1 LEU 45 -2.439 -0.340 8.521
260 HD21 LEU 45 3HD2 LEU 45 0.260 -0.960 11.527
261 HD22 LEU 45 1HD2 LEU 45 -1.294 -0.189 11.842
262 HD23 LEU 45 2HD2 LEU 45 0.122 0.798 11.480
263 H LEU 46 H LEU 46 1.298 -2.054 6.687
264 HA LEU 46 HA LEU 46 1.684 -4.782 6.726
265 HB3 LEU 46 2HB LEU 46 2.274 -4.620 4.382
266 HG LEU 46 HG LEU 46 0.161 -2.632 5.179
267 HD11 LEU 46 1HD1 LEU 46 -0.512 -2.498 2.872
268 HD12 LEU 46 2HD1 LEU 46 0.793 -3.581 2.389
269 HD13 LEU 46 3HD1 LEU 46 1.167 -1.976 3.018
270 HD21 LEU 46 3HD2 LEU 46 -1.365 -4.319 4.711
271 HD22 LEU 46 1HD2 LEU 46 -0.044 -5.187 5.493
272 HD23 LEU 46 2HD2 LEU 46 -0.211 -5.231 3.737
273 H SER 47 H SER 47 4.046 -2.236 6.961
274 HA SER 47 HA SER 47 6.276 -4.068 6.599
275 HB3 SER 47 2HB SER 47 6.908 -1.377 7.574
276 HG SER 47 HG SER 47 7.606 -2.177 5.029
277 H SER 48 H SER 48 4.369 -4.294 8.876
278 HA SER 48 HA SER 48 6.242 -3.874 11.110
279 HB3 SER 48 2HB SER 48 3.230 -4.167 11.114
280 HG SER 48 HG SER 48 3.899 -3.396 13.437
281 H SER 49 H SER 49 5.805 -6.164 9.059
282 HA SER 49 HA SER 49 6.241 -8.405 9.098
283 HB3 SER 49 2HB SER 49 7.205 -9.386 10.966
284 HG SER 49 HG SER 49 8.437 -7.806 11.949
285 H SER 50 H SER 50 4.239 -7.772 11.985
286 HA SER 50 HA SER 50 2.262 -9.671 10.906
287 HB3 SER 50 2HB SER 50 1.661 -9.324 13.599
288 HG SER 50 HG SER 50 3.418 -11.366 12.886
289 HA PRO 51 HA PRO 51 0.342 -5.417 10.934
290 HB3 PRO 51 2HB PRO 51 1.025 -4.970 8.786
291 HG3 PRO 51 2HG PRO 51 1.557 -6.689 7.314
292 HD3 PRO 51 2HD PRO 51 2.812 -7.327 9.140
293 H LYS 52 H LYS 52 -1.573 -5.389 11.911
294 HA LYS 52 HA LYS 52 -3.573 -7.420 11.166
295 HB3 LYS 52 2HB LYS 52 -4.358 -7.452 13.356
296 HG3 LYS 52 2HG LYS 52 -1.402 -7.010 13.404
297 HD3 LYS 52 2HD LYS 52 -2.975 -7.863 15.820
298 HE3 LYS 52 2HE LYS 52 -0.672 -6.771 16.701
299 HZ1 LYS 52 3HZ LYS 52 -1.024 -8.847 17.502
300 HZ2 LYS 52 1HZ LYS 52 0.183 -9.230 16.382
301 HZ3 LYS 52 2HZ LYS 52 -1.442 -9.499 15.998
302 H CYS 53 H CYS 53 -3.700 -4.232 12.754
303 HA CYS 53 HA CYS 53 -4.758 -2.632 10.878
304 HB3 CYS 53 2HB CYS 53 -6.823 -4.587 11.815
305 H THR 54 H THR 54 -3.993 -1.017 12.151
306 HA THR 54 HA THR 54 -3.984 -0.555 14.767
307 HB THR 54 HB THR 54 -4.047 1.158 12.468
308 HG1 THR 54 1HG THR 54 -3.124 1.544 15.140
309 HG21 THR 54 3HG2 THR 54 -4.907 3.204 13.606
310 HG22 THR 54 1HG2 THR 54 -5.542 2.172 14.888
311 HG23 THR 54 2HG2 THR 54 -6.160 2.017 13.242
312 H ALA 55 H ALA 55 -6.855 -0.107 12.737
313 HA ALA 55 HA ALA 55 -8.608 0.981 14.562
314 HB1 ALA 55 3HB ALA 55 -8.795 -0.127 12.012
315 HB2 ALA 55 1HB ALA 55 -9.943 -1.038 12.994
316 HB3 ALA 55 2HB ALA 55 -10.061 0.719 12.901
317 H CYS 56 H CYS 56 -8.922 -2.451 13.721
318 HA CYS 56 HA CYS 56 -9.449 -3.006 16.566
319 HB3 CYS 56 2HB CYS 56 -11.410 -3.378 15.175
320 H GLN 57 H GLN 57 -7.634 -3.925 13.744
321 HA GLN 57 HA GLN 57 -5.630 -5.060 13.655
322 HB3 GLN 57 2HB GLN 57 -4.549 -5.835 15.564
323 HG3 GLN 57 2HG GLN 57 -6.025 -4.282 17.426
324 HE21 GLN 57 1HE2 GLN 57 -3.504 -4.347 14.969
325 HE22 GLN 57 2HE2 GLN 57 -2.270 -3.648 15.955
326 H GLU 58 H GLU 58 -6.177 -6.512 12.124
327 HA GLU 58 HA GLU 58 -7.113 -9.127 13.053
328 HB3 GLU 58 2HB GLU 58 -8.354 -8.957 10.626
329 HG3 GLU 58 2HG GLU 58 -10.117 -7.891 12.639
330 H SER 59 H SER 59 -6.182 -7.426 10.056
331 HA SER 59 HA SER 59 -3.762 -8.696 9.641
332 HB3 SER 59 2HB SER 59 -5.029 -10.144 7.619
333 HG SER 59 HG SER 59 -4.552 -11.879 9.396
334 H ILE 60 H ILE 60 -2.750 -7.493 8.178
335 HA ILE 60 HA ILE 60 -4.355 -6.202 6.071
336 HB ILE 60 HB ILE 60 -1.854 -4.886 6.984
337 HG13 ILE 60 2HG1 ILE 60 -3.114 -5.538 9.070
338 HG21 ILE 60 1HG2 ILE 60 -4.273 -3.305 6.613
339 HG22 ILE 60 2HG2 ILE 60 -2.687 -3.143 5.863
340 HG23 ILE 60 3HG2 ILE 60 -3.858 -4.285 5.206
341 HD11 ILE 60 3HD1 ILE 60 -2.435 -3.697 10.106
342 HD12 ILE 60 1HD1 ILE 60 -1.908 -3.142 8.517
343 HD13 ILE 60 2HD1 ILE 60 -3.485 -2.661 9.141
344 H VAL 61 H VAL 61 -3.746 -6.656 4.063
345 HA VAL 61 HA VAL 61 -0.946 -7.178 3.455
346 HB VAL 61 HB VAL 61 -3.138 -9.186 2.936
347 HG11 VAL 61 1HG1 VAL 61 -2.061 -9.318 0.922
348 HG12 VAL 61 2HG1 VAL 61 -0.521 -8.764 1.583
349 HG13 VAL 61 3HG1 VAL 61 -1.064 -10.417 1.874
350 HG21 VAL 61 3HG2 VAL 61 -1.440 -10.708 4.033
351 HG22 VAL 61 1HG2 VAL 61 -0.560 -9.248 4.488
352 HG23 VAL 61 2HG2 VAL 61 -2.200 -9.512 5.085
353 H LYS 62 H LYS 62 -0.398 -6.210 1.615
354 HA LYS 62 HA LYS 62 -2.084 -4.611 0.125
355 HB3 LYS 62 2HB LYS 62 0.292 -4.304 -0.001
356 HG3 LYS 62 2HG LYS 62 0.550 -6.872 -1.537
357 HD3 LYS 62 2HD LYS 62 2.574 -5.031 -0.263
358 HE3 LYS 62 2HE LYS 62 2.717 -7.759 -1.325
359 HZ1 LYS 62 3HZ LYS 62 5.026 -7.264 -2.198
360 HZ2 LYS 62 1HZ LYS 62 4.536 -5.650 -2.318
361 HZ3 LYS 62 2HZ LYS 62 3.732 -6.846 -3.204
362 H ASP 63 H ASP 63 -1.201 -7.985 -0.393
363 HA ASP 63 HA ASP 63 -2.351 -8.310 -2.932
364 HB3 ASP 63 2HB ASP 63 -2.100 -10.629 -2.608
365 H LYS 64 H LYS 64 -3.713 -8.599 0.312
366 HA LYS 64 HA LYS 64 -6.313 -9.355 -0.740
367 HB3 LYS 64 2HB LYS 64 -6.961 -9.757 1.482
368 HG3 LYS 64 2HG LYS 64 -5.088 -10.911 2.610
369 HD3 LYS 64 2HD LYS 64 -6.036 -11.399 -0.096
370 HE3 LYS 64 2HE LYS 64 -3.282 -12.250 0.684
371 HZ1 LYS 64 3HZ LYS 64 -4.220 -14.352 0.399
372 HZ2 LYS 64 1HZ LYS 64 -3.571 -13.990 -1.121
373 HZ3 LYS 64 2HZ LYS 64 -5.235 -13.848 -0.856
374 H VAL 65 H VAL 65 -4.636 -6.514 -0.254
375 HA VAL 65 HA VAL 65 -6.939 -4.904 0.492
376 HB VAL 65 HB VAL 65 -4.056 -4.519 0.444
377 HG11 VAL 65 1HG1 VAL 65 -4.082 -2.136 -0.098
378 HG12 VAL 65 2HG1 VAL 65 -4.567 -3.113 -1.485
379 HG13 VAL 65 3HG1 VAL 65 -5.785 -2.252 -0.542
380 HG21 VAL 65 3HG2 VAL 65 -6.417 -3.370 1.890
381 HG22 VAL 65 1HG2 VAL 65 -5.100 -4.362 2.519
382 HG23 VAL 65 2HG2 VAL 65 -4.807 -2.677 2.086
383 H PHE 66 H PHE 66 -7.948 -3.404 -0.820
384 HA PHE 66 HA PHE 66 -7.358 -3.643 -3.698
385 HB3 PHE 66 2HB PHE 66 -9.840 -2.947 -3.921
386 HD1 PHE 66 1HD PHE 66 -8.972 -4.701 -5.555
387 HD2 PHE 66 2HD PHE 66 -10.301 -5.623 -1.618
388 HE1 PHE 66 1HE PHE 66 -9.286 -7.051 -6.215
389 HE2 PHE 66 2HE PHE 66 -10.616 -7.974 -2.271
390 HZ PHE 66 HZ PHE 66 -10.108 -8.691 -4.572
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -32.975 35.986 5.811
2 HA2 GLY 1 1HA GLY 1 -32.307 33.321 5.094
3 HA3 GLY 1 2HA GLY 1 -31.584 34.780 4.434
4 H SER 2 H SER 2 -31.443 32.465 7.083
5 HA SER 2 HA SER 2 -28.596 32.558 7.145
6 HB3 SER 2 2HB SER 2 -28.439 33.320 9.548
7 HG SER 2 HG SER 2 -27.827 34.992 8.423
8 H SER 3 H SER 3 -27.830 31.332 9.259
9 HA SER 3 HA SER 3 -29.560 29.513 10.516
10 HB3 SER 3 2HB SER 3 -29.280 28.784 7.913
11 HG SER 3 HG SER 3 -27.558 27.616 7.608
12 H GLY 4 H GLY 4 -28.307 27.691 11.587
13 HA2 GLY 4 1HA GLY 4 -25.681 27.268 11.807
14 HA3 GLY 4 2HA GLY 4 -25.831 28.824 12.610
15 H SER 5 H SER 5 -27.524 25.683 12.614
16 HA SER 5 HA SER 5 -26.930 25.059 15.279
17 HB3 SER 5 2HB SER 5 -28.790 27.105 15.166
18 HG SER 5 HG SER 5 -30.748 26.284 15.405
19 H SER 6 H SER 6 -27.222 22.939 15.477
20 HA SER 6 HA SER 6 -29.264 21.645 13.790
21 HB3 SER 6 2HB SER 6 -26.449 21.263 13.771
22 HG SER 6 HG SER 6 -27.711 18.824 14.364
23 H GLY 7 H GLY 7 -30.420 19.935 14.670
24 HA2 GLY 7 1HA GLY 7 -30.756 20.005 17.506
25 HA3 GLY 7 2HA GLY 7 -31.582 18.930 16.387
26 H PHE 8 H PHE 8 -31.330 16.936 17.161
27 HA PHE 8 HA PHE 8 -29.479 15.911 18.843
28 HB3 PHE 8 2HB PHE 8 -31.507 14.762 17.742
29 HD1 PHE 8 2HD PHE 8 -28.614 12.934 16.408
30 HD2 PHE 8 1HD PHE 8 -32.154 15.105 15.473
31 HE1 PHE 8 2HE PHE 8 -28.481 12.142 14.082
32 HE2 PHE 8 1HE PHE 8 -32.028 14.315 13.146
33 HZ PHE 8 HZ PHE 8 -30.189 12.833 12.448
34 H VAL 9 H VAL 9 -27.632 14.451 18.492
35 HA VAL 9 HA VAL 9 -25.466 15.587 17.347
36 HB VAL 9 HB VAL 9 -25.233 13.630 18.738
37 HG11 VAL 9 1HG1 VAL 9 -26.381 12.043 16.443
38 HG12 VAL 9 2HG1 VAL 9 -25.804 11.398 17.982
39 HG13 VAL 9 3HG1 VAL 9 -27.232 12.434 17.937
40 HG21 VAL 9 3HG2 VAL 9 -23.952 13.851 16.132
41 HG22 VAL 9 1HG2 VAL 9 -23.244 13.565 17.722
42 HG23 VAL 9 2HG2 VAL 9 -23.896 12.215 16.791
43 H LYS 10 H LYS 10 -24.754 16.029 15.366
44 HA LYS 10 HA LYS 10 -25.805 14.481 13.099
45 HB3 LYS 10 2HB LYS 10 -25.561 17.490 13.264
46 HG3 LYS 10 2HG LYS 10 -25.046 16.219 10.996
47 HD3 LYS 10 2HD LYS 10 -28.045 16.533 10.928
48 HE3 LYS 10 2HE LYS 10 -27.185 16.866 8.762
49 HZ1 LYS 10 3HZ LYS 10 -25.275 14.727 9.448
50 HZ2 LYS 10 1HZ LYS 10 -24.966 16.271 8.829
51 HZ3 LYS 10 2HZ LYS 10 -25.627 15.077 7.831
52 H THR 11 H THR 11 -24.350 13.975 11.540
53 HA THR 11 HA THR 11 -21.724 15.269 11.574
54 HB THR 11 HB THR 11 -21.531 12.374 11.174
55 HG1 THR 11 1HG THR 11 -21.626 12.090 13.565
56 HG21 THR 11 3HG2 THR 11 -19.471 13.346 11.383
57 HG22 THR 11 1HG2 THR 11 -19.753 12.912 13.068
58 HG23 THR 11 2HG2 THR 11 -20.040 14.565 12.523
59 H VAL 12 H VAL 12 -20.488 14.939 9.633
60 HA VAL 12 HA VAL 12 -22.205 14.352 7.317
61 HB VAL 12 HB VAL 12 -21.286 16.640 7.415
62 HG11 VAL 12 1HG1 VAL 12 -19.018 15.470 8.380
63 HG12 VAL 12 2HG1 VAL 12 -18.559 15.841 6.717
64 HG13 VAL 12 3HG1 VAL 12 -19.130 17.125 7.783
65 HG21 VAL 12 3HG2 VAL 12 -20.671 14.746 5.221
66 HG22 VAL 12 1HG2 VAL 12 -21.706 16.173 5.231
67 HG23 VAL 12 2HG2 VAL 12 -19.956 16.355 5.123
68 H GLU 13 H GLU 13 -21.887 12.428 6.429
69 HA GLU 13 HA GLU 13 -19.208 11.224 6.569
70 HB3 GLU 13 2HB GLU 13 -20.294 9.076 6.238
71 HG3 GLU 13 2HG GLU 13 -20.459 10.434 8.541
72 H ASP 14 H ASP 14 -18.066 11.610 4.790
73 HA ASP 14 HA ASP 14 -19.165 10.859 2.214
74 HB3 ASP 14 2HB ASP 14 -17.872 13.314 1.687
75 H LYS 15 H LYS 15 -17.671 9.820 1.065
76 HA LYS 15 HA LYS 15 -15.664 9.059 0.306
77 HB3 LYS 15 2HB LYS 15 -13.796 10.510 0.236
78 HG3 LYS 15 2HG LYS 15 -16.412 11.765 -0.074
79 HD3 LYS 15 2HD LYS 15 -15.240 13.433 1.372
80 HE3 LYS 15 2HE LYS 15 -13.008 12.766 -0.051
81 HZ1 LYS 15 3HZ LYS 15 -14.318 14.782 -1.536
82 HZ2 LYS 15 1HZ LYS 15 -12.852 14.003 -1.863
83 HZ3 LYS 15 2HZ LYS 15 -12.874 15.395 -0.902
84 H TYR 16 H TYR 16 -13.931 7.782 1.018
85 HA TYR 16 HA TYR 16 -14.185 6.782 3.659
86 HB3 TYR 16 2HB TYR 16 -12.446 5.244 3.080
87 HD1 TYR 16 1HD TYR 16 -13.219 6.517 -0.298
88 HD2 TYR 16 2HD TYR 16 -14.253 3.725 2.742
89 HE1 TYR 16 1HE TYR 16 -14.656 5.320 -1.895
90 HE2 TYR 16 2HE TYR 16 -15.692 2.520 1.153
91 HH TYR 16 HH TYR 16 -16.671 2.605 -0.876
92 H LYS 17 H LYS 17 -12.208 6.491 5.089
93 HA LYS 17 HA LYS 17 -10.314 8.688 5.031
94 HB3 LYS 17 2HB LYS 17 -12.513 8.446 7.042
95 HG3 LYS 17 2HG LYS 17 -10.788 10.286 8.149
96 HD3 LYS 17 2HD LYS 17 -10.398 8.165 9.752
97 HE3 LYS 17 2HE LYS 17 -12.362 10.247 9.493
98 HZ1 LYS 17 3HZ LYS 17 -13.316 7.645 10.536
99 HZ2 LYS 17 1HZ LYS 17 -14.062 8.652 9.398
100 HZ3 LYS 17 2HZ LYS 17 -13.992 9.118 11.023
101 H CYS 18 H CYS 18 -8.422 8.234 6.079
102 HA CYS 18 HA CYS 18 -7.807 5.538 6.611
103 HB3 CYS 18 2HB CYS 18 -6.329 8.091 7.260
104 H GLU 19 H GLU 19 -7.616 4.380 8.475
105 HA GLU 19 HA GLU 19 -9.021 5.413 10.783
106 HB3 GLU 19 2HB GLU 19 -8.204 2.972 11.580
107 HG3 GLU 19 2HG GLU 19 -10.262 2.035 10.791
108 H LYS 20 H LYS 20 -6.342 6.462 10.005
109 HA LYS 20 HA LYS 20 -5.038 6.054 12.609
110 HB3 LYS 20 2HB LYS 20 -3.085 6.655 10.587
111 HG3 LYS 20 2HG LYS 20 -3.536 4.396 12.499
112 HD3 LYS 20 2HD LYS 20 -1.211 4.652 10.592
113 HE3 LYS 20 2HE LYS 20 -0.222 2.953 11.694
114 HZ1 LYS 20 3HZ LYS 20 -0.481 3.071 13.998
115 HZ2 LYS 20 1HZ LYS 20 -2.119 3.484 13.898
116 HZ3 LYS 20 2HZ LYS 20 -0.935 4.608 13.455
117 H CYS 21 H CYS 21 -4.670 8.058 9.676
118 HA CYS 21 HA CYS 21 -4.291 10.397 11.403
119 HB3 CYS 21 2HB CYS 21 -2.521 10.155 9.821
120 H HIS 22 H HIS 22 -6.800 8.888 10.062
121 HA HIS 22 HA HIS 22 -8.915 9.473 9.463
122 HB3 HIS 22 2HB HIS 22 -9.787 10.980 10.877
123 HD2 HIS 22 2HD HIS 22 -7.634 9.289 12.482
124 HE1 HIS 22 1HE HIS 22 -6.310 12.981 14.101
125 HE2 HIS 22 2HE HIS 22 -6.225 10.472 14.301
126 H LEU 23 H LEU 23 -6.608 9.965 7.639
127 HA LEU 23 HA LEU 23 -7.142 12.311 6.126
128 HB3 LEU 23 2HB LEU 23 -5.890 10.685 4.360
129 HG LEU 23 HG LEU 23 -3.680 11.357 5.690
130 HD11 LEU 23 1HD1 LEU 23 -3.701 13.452 4.463
131 HD12 LEU 23 2HD1 LEU 23 -5.444 13.322 4.234
132 HD13 LEU 23 3HD1 LEU 23 -4.365 12.151 3.475
133 HD21 LEU 23 3HD2 LEU 23 -3.888 13.005 7.245
134 HD22 LEU 23 1HD2 LEU 23 -5.395 12.141 7.557
135 HD23 LEU 23 2HD2 LEU 23 -5.405 13.604 6.572
136 H VAL 24 H VAL 24 -8.921 12.658 4.985
137 HA VAL 24 HA VAL 24 -10.719 10.599 4.213
138 HB VAL 24 HB VAL 24 -10.589 13.482 3.315
139 HG11 VAL 24 1HG1 VAL 24 -12.615 11.317 2.865
140 HG12 VAL 24 2HG1 VAL 24 -13.074 13.021 2.857
141 HG13 VAL 24 3HG1 VAL 24 -11.891 12.421 1.695
142 HG21 VAL 24 3HG2 VAL 24 -10.892 13.120 5.755
143 HG22 VAL 24 1HG2 VAL 24 -12.269 13.907 4.982
144 HG23 VAL 24 2HG2 VAL 24 -12.349 12.195 5.398
145 H LEU 25 H LEU 25 -10.451 9.227 2.591
146 HA LEU 25 HA LEU 25 -9.098 10.174 0.151
147 HB3 LEU 25 2HB LEU 25 -7.620 8.535 0.301
148 HG LEU 25 HG LEU 25 -8.956 8.041 2.916
149 HD11 LEU 25 1HD1 LEU 25 -7.999 5.900 1.431
150 HD12 LEU 25 2HD1 LEU 25 -8.275 5.941 3.173
151 HD13 LEU 25 3HD1 LEU 25 -6.676 6.307 2.525
152 HD21 LEU 25 3HD2 LEU 25 -6.626 8.408 3.698
153 HD22 LEU 25 1HD2 LEU 25 -7.297 9.770 2.800
154 HD23 LEU 25 2HD2 LEU 25 -6.149 8.681 2.022
155 H CYS 26 H CYS 26 -9.640 8.757 -1.781
156 HA CYS 26 HA CYS 26 -12.540 8.326 -1.799
157 HB3 CYS 26 2HB CYS 26 -10.552 9.222 -3.789
158 H SER 27 H SER 27 -9.487 6.768 -2.648
159 HA SER 27 HA SER 27 -10.918 4.194 -2.736
160 HB3 SER 27 2HB SER 27 -8.922 5.331 -4.649
161 HG SER 27 HG SER 27 -9.281 2.581 -4.705
162 HA PRO 28 HA PRO 28 -7.635 4.055 0.516
163 HB3 PRO 28 2HB PRO 28 -9.188 4.463 2.159
164 HG3 PRO 28 2HG PRO 28 -11.440 3.992 1.823
165 HD3 PRO 28 2HD PRO 28 -10.997 5.194 -0.093
166 H LYS 29 H LYS 29 -7.502 1.810 2.052
167 HA LYS 29 HA LYS 29 -7.375 -0.393 0.100
168 HB3 LYS 29 2HB LYS 29 -5.235 -0.944 0.705
169 HG3 LYS 29 2HG LYS 29 -3.818 0.933 0.895
170 HD3 LYS 29 2HD LYS 29 -5.859 2.551 -0.352
171 HE3 LYS 29 2HE LYS 29 -3.380 2.478 -0.815
172 HZ1 LYS 29 3HZ LYS 29 -3.552 0.505 -2.829
173 HZ2 LYS 29 1HZ LYS 29 -3.905 -0.191 -1.328
174 HZ3 LYS 29 2HZ LYS 29 -2.444 0.630 -1.557
175 H GLN 30 H GLN 30 -9.618 -0.510 1.272
176 HA GLN 30 HA GLN 30 -10.064 -1.264 3.834
177 HB3 GLN 30 2HB GLN 30 -11.369 -2.976 1.786
178 HG3 GLN 30 2HG GLN 30 -12.552 -1.123 3.838
179 HE21 GLN 30 1HE2 GLN 30 -14.595 -2.574 4.623
180 HE22 GLN 30 2HE2 GLN 30 -15.672 -2.936 3.323
181 H THR 31 H THR 31 -9.010 -2.635 5.097
182 HA THR 31 HA THR 31 -7.403 -4.760 4.133
183 HB THR 31 HB THR 31 -6.895 -5.260 6.380
184 HG1 THR 31 1HG THR 31 -9.368 -3.996 7.001
185 HG21 THR 31 3HG2 THR 31 -6.066 -3.257 7.106
186 HG22 THR 31 1HG2 THR 31 -7.578 -2.398 6.813
187 HG23 THR 31 2HG2 THR 31 -6.514 -2.795 5.463
188 H GLU 32 H GLU 32 -8.118 -6.703 6.202
189 HA GLU 32 HA GLU 32 -10.338 -7.981 4.777
190 HB3 GLU 32 2HB GLU 32 -8.723 -9.445 6.807
191 HG3 GLU 32 2HG GLU 32 -8.747 -10.983 4.600
192 H CYS 33 H CYS 33 -10.287 -5.936 7.128
193 HA CYS 33 HA CYS 33 -12.131 -7.443 8.866
194 HB3 CYS 33 2HB CYS 33 -9.962 -6.631 9.912
195 H GLY 34 H GLY 34 -11.569 -4.537 7.020
196 HA2 GLY 34 1HA GLY 34 -13.789 -3.734 6.061
197 HA3 GLY 34 2HA GLY 34 -14.261 -3.570 7.745
198 H HIS 35 H HIS 35 -12.032 -2.465 8.880
199 HA HIS 35 HA HIS 35 -12.320 0.233 8.448
200 HB3 HIS 35 2HB HIS 35 -10.065 0.467 9.552
201 HD2 HIS 35 2HD HIS 35 -12.265 1.363 11.236
202 HE1 HIS 35 1HE HIS 35 -12.329 -2.263 13.437
203 HE2 HIS 35 2HE HIS 35 -13.174 0.106 13.304
204 H ARG 36 H ARG 36 -10.428 1.730 7.772
205 HA ARG 36 HA ARG 36 -9.089 0.742 5.363
206 HB3 ARG 36 2HB ARG 36 -9.747 2.903 4.209
207 HG3 ARG 36 2HG ARG 36 -11.646 0.696 4.794
208 HD3 ARG 36 2HD ARG 36 -12.601 2.598 2.794
209 HE ARG 36 HE ARG 36 -14.339 1.737 4.917
210 HH11 ARG 36 1HH1 ARG 36 -12.829 0.851 1.908
211 HH12 ARG 36 2HH1 ARG 36 -14.017 -0.346 1.513
212 HH21 ARG 36 1HH2 ARG 36 -15.911 0.163 4.408
213 HH22 ARG 36 2HH2 ARG 36 -15.769 -0.736 2.936
214 H PHE 37 H PHE 37 -7.332 2.113 4.644
215 HA PHE 37 HA PHE 37 -6.405 4.112 6.562
216 HB3 PHE 37 2HB PHE 37 -4.077 3.017 6.383
217 HD1 PHE 37 2HD PHE 37 -6.562 0.470 7.346
218 HD2 PHE 37 1HD PHE 37 -4.037 3.633 8.665
219 HE1 PHE 37 2HE PHE 37 -6.979 -0.177 9.683
220 HE2 PHE 37 1HE PHE 37 -4.449 2.990 11.005
221 HZ PHE 37 HZ PHE 37 -5.923 1.084 11.516
222 H CYS 38 H CYS 38 -4.318 5.158 5.714
223 HA CYS 38 HA CYS 38 -4.763 5.788 2.897
224 HB3 CYS 38 2HB CYS 38 -4.611 7.598 4.639
225 H GLU 39 H GLU 39 -2.823 6.174 1.522
226 HA GLU 39 HA GLU 39 -1.361 3.939 1.044
227 HB3 GLU 39 2HB GLU 39 0.428 5.686 0.157
228 HG3 GLU 39 2HG GLU 39 -2.320 5.735 -1.053
229 H SER 40 H SER 40 -0.161 6.737 2.902
230 HA SER 40 HA SER 40 2.292 5.671 3.646
231 HB3 SER 40 2HB SER 40 0.488 7.660 5.027
232 HG SER 40 HG SER 40 1.917 7.868 6.579
233 H CYS 41 H CYS 41 -0.098 6.177 6.183
234 HA CYS 41 HA CYS 41 0.700 4.439 8.035
235 HB3 CYS 41 2HB CYS 41 -1.658 4.118 8.718
236 H MET 42 H MET 42 -1.216 3.513 5.198
237 HA MET 42 HA MET 42 -1.568 0.815 5.798
238 HB3 MET 42 2HB MET 42 -1.328 2.253 3.158
239 HG3 MET 42 2HG MET 42 -0.761 -0.095 2.784
240 HE1 MET 42 3HE MET 42 -3.470 0.227 5.613
241 HE2 MET 42 1HE MET 42 -4.313 0.459 4.082
242 HE3 MET 42 2HE MET 42 -4.644 -0.969 5.062
243 H ALA 43 H ALA 43 0.960 2.294 3.760
244 HA ALA 43 HA ALA 43 2.427 -0.054 3.326
245 HB1 ALA 43 3HB ALA 43 3.008 2.855 3.103
246 HB2 ALA 43 1HB ALA 43 4.354 1.717 3.034
247 HB3 ALA 43 2HB ALA 43 3.036 1.598 1.867
248 H ALA 44 H ALA 44 2.260 2.065 6.056
249 HA ALA 44 HA ALA 44 4.745 1.315 7.244
250 HB1 ALA 44 3HB ALA 44 4.211 3.178 8.342
251 HB2 ALA 44 1HB ALA 44 2.509 3.043 7.897
252 HB3 ALA 44 2HB ALA 44 3.124 2.181 9.308
253 H LEU 45 H LEU 45 1.372 0.525 8.108
254 HA LEU 45 HA LEU 45 1.908 -1.349 10.073
255 HB3 LEU 45 2HB LEU 45 -0.323 -2.221 9.668
256 HG LEU 45 HG LEU 45 -0.256 0.772 9.308
257 HD11 LEU 45 1HD1 LEU 45 -2.559 0.836 9.810
258 HD12 LEU 45 2HD1 LEU 45 -2.600 -0.883 10.201
259 HD13 LEU 45 3HD1 LEU 45 -2.374 -0.364 8.531
260 HD21 LEU 45 3HD2 LEU 45 -1.103 -0.546 11.817
261 HD22 LEU 45 1HD2 LEU 45 -0.214 0.957 11.566
262 HD23 LEU 45 2HD2 LEU 45 0.618 -0.592 11.430
263 H LEU 46 H LEU 46 1.299 -1.957 6.615
264 HA LEU 46 HA LEU 46 1.594 -4.694 6.579
265 HB3 LEU 46 2HB LEU 46 2.234 -4.474 4.237
266 HG LEU 46 HG LEU 46 0.117 -2.495 5.058
267 HD11 LEU 46 1HD1 LEU 46 1.073 -3.295 2.328
268 HD12 LEU 46 2HD1 LEU 46 0.803 -1.677 2.973
269 HD13 LEU 46 3HD1 LEU 46 -0.570 -2.722 2.613
270 HD21 LEU 46 3HD2 LEU 46 -1.226 -4.259 5.153
271 HD22 LEU 46 1HD2 LEU 46 0.184 -5.297 4.936
272 HD23 LEU 46 2HD2 LEU 46 -0.746 -4.768 3.533
273 H SER 47 H SER 47 4.081 -2.217 6.675
274 HA SER 47 HA SER 47 6.226 -4.130 6.342
275 HB3 SER 47 2HB SER 47 6.703 -1.339 7.304
276 HG SER 47 HG SER 47 8.042 -2.263 5.121
277 H SER 48 H SER 48 4.303 -4.238 8.657
278 HA SER 48 HA SER 48 6.205 -3.920 10.877
279 HB3 SER 48 2HB SER 48 3.202 -4.305 10.976
280 HG SER 48 HG SER 48 5.144 -4.384 12.868
281 H SER 49 H SER 49 5.629 -6.189 8.777
282 HA SER 49 HA SER 49 6.052 -8.435 8.773
283 HB3 SER 49 2HB SER 49 6.101 -8.698 11.732
284 HG SER 49 HG SER 49 8.011 -9.865 11.154
285 H SER 50 H SER 50 4.149 -7.736 11.711
286 HA SER 50 HA SER 50 2.122 -9.633 10.726
287 HB3 SER 50 2HB SER 50 1.492 -9.549 13.304
288 HG SER 50 HG SER 50 2.748 -11.386 13.554
289 HA PRO 51 HA PRO 51 0.269 -5.344 10.825
290 HB3 PRO 51 2HB PRO 51 0.910 -4.883 8.667
291 HG3 PRO 51 2HG PRO 51 1.386 -6.595 7.166
292 HD3 PRO 51 2HD PRO 51 2.673 -7.267 8.956
293 H LYS 52 H LYS 52 -1.625 -5.299 11.843
294 HA LYS 52 HA LYS 52 -3.665 -7.299 11.127
295 HB3 LYS 52 2HB LYS 52 -4.402 -7.338 13.333
296 HG3 LYS 52 2HG LYS 52 -1.442 -6.924 13.324
297 HD3 LYS 52 2HD LYS 52 -2.984 -7.775 15.761
298 HE3 LYS 52 2HE LYS 52 -0.141 -7.191 15.082
299 HZ1 LYS 52 3HZ LYS 52 0.439 -6.566 17.189
300 HZ2 LYS 52 1HZ LYS 52 -0.954 -7.211 17.902
301 HZ3 LYS 52 2HZ LYS 52 -1.040 -5.756 17.042
302 H CYS 53 H CYS 53 -3.718 -4.120 12.737
303 HA CYS 53 HA CYS 53 -4.794 -2.493 10.898
304 HB3 CYS 53 2HB CYS 53 -6.862 -4.434 11.852
305 H THR 54 H THR 54 -3.985 -0.901 12.175
306 HA THR 54 HA THR 54 -3.923 -0.462 14.793
307 HB THR 54 HB THR 54 -4.014 1.276 12.510
308 HG1 THR 54 1HG THR 54 -2.970 1.448 15.152
309 HG21 THR 54 3HG2 THR 54 -6.128 2.096 13.421
310 HG22 THR 54 1HG2 THR 54 -4.860 3.309 13.600
311 HG23 THR 54 2HG2 THR 54 -5.365 2.349 14.991
312 H ALA 55 H ALA 55 -6.825 0.040 12.820
313 HA ALA 55 HA ALA 55 -8.532 1.130 14.684
314 HB1 ALA 55 3HB ALA 55 -10.020 0.897 13.051
315 HB2 ALA 55 1HB ALA 55 -8.777 0.048 12.130
316 HB3 ALA 55 2HB ALA 55 -9.915 -0.863 13.124
317 H CYS 56 H CYS 56 -8.899 -2.291 13.825
318 HA CYS 56 HA CYS 56 -9.375 -2.863 16.675
319 HB3 CYS 56 2HB CYS 56 -11.373 -3.196 15.332
320 H GLN 57 H GLN 57 -7.628 -3.774 13.810
321 HA GLN 57 HA GLN 57 -5.641 -4.933 13.672
322 HB3 GLN 57 2HB GLN 57 -4.535 -5.736 15.548
323 HG3 GLN 57 2HG GLN 57 -6.012 -4.216 17.453
324 HE21 GLN 57 1HE2 GLN 57 -4.429 -1.837 16.203
325 HE22 GLN 57 2HE2 GLN 57 -2.821 -2.123 16.767
326 H GLU 58 H GLU 58 -6.185 -6.376 12.141
327 HA GLU 58 HA GLU 58 -7.153 -8.985 13.042
328 HB3 GLU 58 2HB GLU 58 -8.403 -8.666 10.586
329 HG3 GLU 58 2HG GLU 58 -10.099 -7.936 12.845
330 H SER 59 H SER 59 -6.265 -7.243 10.055
331 HA SER 59 HA SER 59 -3.869 -8.534 9.570
332 HB3 SER 59 2HB SER 59 -5.616 -9.859 7.636
333 HG SER 59 HG SER 59 -3.450 -10.428 7.899
334 H ILE 60 H ILE 60 -2.871 -7.315 8.111
335 HA ILE 60 HA ILE 60 -4.499 -5.982 6.047
336 HB ILE 60 HB ILE 60 -1.992 -4.675 6.953
337 HG13 ILE 60 2HG1 ILE 60 -3.216 -5.371 9.045
338 HG21 ILE 60 1HG2 ILE 60 -2.826 -3.139 5.585
339 HG22 ILE 60 2HG2 ILE 60 -4.331 -4.042 5.422
340 HG23 ILE 60 3HG2 ILE 60 -4.138 -2.881 6.735
341 HD11 ILE 60 3HD1 ILE 60 -1.831 -3.218 8.811
342 HD12 ILE 60 1HD1 ILE 60 -3.394 -2.400 8.798
343 HD13 ILE 60 2HD1 ILE 60 -2.923 -3.382 10.186
344 H VAL 61 H VAL 61 -4.017 -6.877 4.154
345 HA VAL 61 HA VAL 61 -1.182 -7.248 3.469
346 HB VAL 61 HB VAL 61 -3.416 -9.199 2.909
347 HG11 VAL 61 1HG1 VAL 61 -1.245 -10.453 1.972
348 HG12 VAL 61 2HG1 VAL 61 -2.292 -9.458 0.958
349 HG13 VAL 61 3HG1 VAL 61 -0.794 -8.788 1.605
350 HG21 VAL 61 3HG2 VAL 61 -1.685 -10.744 4.039
351 HG22 VAL 61 1HG2 VAL 61 -0.970 -9.247 4.637
352 HG23 VAL 61 2HG2 VAL 61 -2.635 -9.657 5.053
353 H LYS 62 H LYS 62 -0.624 -6.277 1.634
354 HA LYS 62 HA LYS 62 -2.296 -4.645 0.158
355 HB3 LYS 62 2HB LYS 62 0.055 -4.319 0.000
356 HG3 LYS 62 2HG LYS 62 0.656 -6.688 -1.632
357 HD3 LYS 62 2HD LYS 62 2.425 -6.240 0.555
358 HE3 LYS 62 2HE LYS 62 4.019 -5.746 -1.185
359 HZ1 LYS 62 3HZ LYS 62 2.323 -7.997 -1.285
360 HZ2 LYS 62 1HZ LYS 62 3.969 -7.893 -1.663
361 HZ3 LYS 62 2HZ LYS 62 2.808 -7.598 -2.856
362 H ASP 63 H ASP 63 -1.393 -8.011 -0.432
363 HA ASP 63 HA ASP 63 -2.646 -8.262 -2.948
364 HB3 ASP 63 2HB ASP 63 -2.426 -10.658 -2.631
365 H LYS 64 H LYS 64 -3.823 -8.521 0.334
366 HA LYS 64 HA LYS 64 -6.447 -9.414 -0.610
367 HB3 LYS 64 2HB LYS 64 -6.965 -9.918 1.659
368 HG3 LYS 64 2HG LYS 64 -4.498 -10.878 2.389
369 HD3 LYS 64 2HD LYS 64 -6.099 -12.355 0.353
370 HE3 LYS 64 2HE LYS 64 -5.160 -13.158 3.100
371 HZ1 LYS 64 3HZ LYS 64 -5.217 -15.390 1.861
372 HZ2 LYS 64 1HZ LYS 64 -6.234 -14.601 0.764
373 HZ3 LYS 64 2HZ LYS 64 -6.680 -14.728 2.390
374 H VAL 65 H VAL 65 -4.902 -6.570 -0.313
375 HA VAL 65 HA VAL 65 -7.062 -5.058 0.914
376 HB VAL 65 HB VAL 65 -4.275 -4.602 0.441
377 HG11 VAL 65 1HG1 VAL 65 -5.058 -3.401 -1.570
378 HG12 VAL 65 2HG1 VAL 65 -6.058 -2.376 -0.539
379 HG13 VAL 65 3HG1 VAL 65 -4.301 -2.334 -0.389
380 HG21 VAL 65 3HG2 VAL 65 -4.970 -4.151 2.577
381 HG22 VAL 65 1HG2 VAL 65 -4.965 -2.522 1.903
382 HG23 VAL 65 2HG2 VAL 65 -6.481 -3.412 2.048
383 H PHE 66 H PHE 66 -8.442 -3.688 -0.139
384 HA PHE 66 HA PHE 66 -8.157 -3.078 -2.929
385 HB3 PHE 66 2HB PHE 66 -10.315 -4.157 -3.596
386 HD1 PHE 66 2HD PHE 66 -7.957 -4.444 -4.868
387 HD2 PHE 66 1HD PHE 66 -9.597 -7.138 -2.009
388 HE1 PHE 66 2HE PHE 66 -6.596 -6.265 -5.807
389 HE2 PHE 66 1HE PHE 66 -8.237 -8.963 -2.943
390 HZ PHE 66 HZ PHE 66 -6.734 -8.528 -4.846
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -37.402 19.346 -12.186
2 HA2 GLY 1 1HA GLY 1 -39.075 21.327 -11.250
3 HA3 GLY 1 2HA GLY 1 -37.986 22.136 -12.367
4 H SER 2 H SER 2 -39.464 18.904 -12.483
5 HA SER 2 HA SER 2 -41.008 19.727 -14.831
6 HB3 SER 2 2HB SER 2 -38.767 17.796 -14.791
7 HG SER 2 HG SER 2 -40.406 17.033 -16.743
8 H SER 3 H SER 3 -40.240 16.865 -12.842
9 HA SER 3 HA SER 3 -41.576 15.397 -11.724
10 HB3 SER 3 2HB SER 3 -43.135 17.845 -11.795
11 HG SER 3 HG SER 3 -45.147 16.963 -11.574
12 H GLY 4 H GLY 4 -42.832 13.608 -12.219
13 HA2 GLY 4 1HA GLY 4 -44.515 12.507 -13.551
14 HA3 GLY 4 2HA GLY 4 -44.122 13.601 -14.869
15 H SER 5 H SER 5 -43.752 10.513 -13.737
16 HA SER 5 HA SER 5 -42.509 8.722 -14.385
17 HB3 SER 5 2HB SER 5 -41.165 9.349 -16.676
18 HG SER 5 HG SER 5 -43.750 8.471 -16.110
19 H SER 6 H SER 6 -40.257 10.927 -15.916
20 HA SER 6 HA SER 6 -38.034 9.861 -14.539
21 HB3 SER 6 2HB SER 6 -37.674 12.549 -15.678
22 HG SER 6 HG SER 6 -35.895 11.618 -16.406
23 H GLY 7 H GLY 7 -39.472 13.126 -14.356
24 HA2 GLY 7 1HA GLY 7 -39.384 14.716 -12.699
25 HA3 GLY 7 2HA GLY 7 -39.586 13.351 -11.610
26 H PHE 8 H PHE 8 -38.256 15.219 -10.459
27 HA PHE 8 HA PHE 8 -35.417 15.087 -11.018
28 HB3 PHE 8 2HB PHE 8 -35.842 16.376 -8.546
29 HD1 PHE 8 2HD PHE 8 -36.234 17.261 -12.155
30 HD2 PHE 8 1HD PHE 8 -34.147 17.907 -8.502
31 HE1 PHE 8 2HE PHE 8 -34.784 18.902 -13.277
32 HE2 PHE 8 1HE PHE 8 -32.696 19.551 -9.618
33 HZ PHE 8 HZ PHE 8 -33.013 20.050 -12.008
34 H VAL 9 H VAL 9 -33.944 13.880 -9.978
35 HA VAL 9 HA VAL 9 -34.824 12.363 -7.609
36 HB VAL 9 HB VAL 9 -34.742 10.841 -9.494
37 HG11 VAL 9 1HG1 VAL 9 -33.366 11.477 -11.155
38 HG12 VAL 9 2HG1 VAL 9 -32.238 12.271 -10.054
39 HG13 VAL 9 3HG1 VAL 9 -32.166 10.524 -10.283
40 HG21 VAL 9 3HG2 VAL 9 -33.817 10.246 -7.160
41 HG22 VAL 9 1HG2 VAL 9 -33.479 9.155 -8.504
42 HG23 VAL 9 2HG2 VAL 9 -32.238 10.277 -7.946
43 H LYS 10 H LYS 10 -33.216 11.860 -6.067
44 HA LYS 10 HA LYS 10 -30.846 13.600 -6.223
45 HB3 LYS 10 2HB LYS 10 -31.246 12.752 -3.556
46 HG3 LYS 10 2HG LYS 10 -31.554 15.338 -5.011
47 HD3 LYS 10 2HD LYS 10 -31.772 15.405 -2.071
48 HE3 LYS 10 2HE LYS 10 -33.410 16.865 -4.121
49 HZ1 LYS 10 3HZ LYS 10 -34.167 17.825 -2.287
50 HZ2 LYS 10 1HZ LYS 10 -32.633 18.496 -2.050
51 HZ3 LYS 10 2HZ LYS 10 -33.039 17.032 -1.309
52 H THR 11 H THR 11 -28.841 12.811 -5.522
53 HA THR 11 HA THR 11 -28.657 9.872 -5.480
54 HB THR 11 HB THR 11 -26.194 11.422 -5.985
55 HG1 THR 11 1HG THR 11 -26.903 11.655 -8.250
56 HG21 THR 11 3HG2 THR 11 -26.358 9.617 -7.957
57 HG22 THR 11 1HG2 THR 11 -27.452 8.865 -6.798
58 HG23 THR 11 2HG2 THR 11 -25.785 9.212 -6.339
59 H VAL 12 H VAL 12 -26.313 9.314 -4.467
60 HA VAL 12 HA VAL 12 -26.169 10.693 -1.866
61 HB VAL 12 HB VAL 12 -27.201 8.638 -1.347
62 HG11 VAL 12 1HG1 VAL 12 -25.989 6.462 -2.104
63 HG12 VAL 12 2HG1 VAL 12 -27.060 7.302 -3.226
64 HG13 VAL 12 3HG1 VAL 12 -25.312 7.495 -3.362
65 HG21 VAL 12 3HG2 VAL 12 -24.515 7.611 -0.799
66 HG22 VAL 12 1HG2 VAL 12 -24.760 9.290 -0.320
67 HG23 VAL 12 2HG2 VAL 12 -25.819 8.029 0.312
68 H GLU 13 H GLU 13 -24.251 11.593 -1.550
69 HA GLU 13 HA GLU 13 -21.903 10.404 -2.874
70 HB3 GLU 13 2HB GLU 13 -20.994 12.839 -2.369
71 HG3 GLU 13 2HG GLU 13 -22.268 13.605 -4.544
72 H ASP 14 H ASP 14 -20.090 9.974 -1.701
73 HA ASP 14 HA ASP 14 -19.844 10.881 1.038
74 HB3 ASP 14 2HB ASP 14 -20.018 8.843 2.126
75 H LYS 15 H LYS 15 -17.909 9.019 1.853
76 HA LYS 15 HA LYS 15 -15.867 8.650 -0.079
77 HB3 LYS 15 2HB LYS 15 -15.354 10.904 -0.111
78 HG3 LYS 15 2HG LYS 15 -16.995 11.451 1.767
79 HD3 LYS 15 2HD LYS 15 -14.446 11.150 3.356
80 HE3 LYS 15 2HE LYS 15 -17.113 12.357 4.078
81 HZ1 LYS 15 3HZ LYS 15 -14.872 12.151 5.966
82 HZ2 LYS 15 1HZ LYS 15 -15.911 10.829 5.781
83 HZ3 LYS 15 2HZ LYS 15 -16.526 12.324 6.277
84 H TYR 16 H TYR 16 -13.636 8.405 1.233
85 HA TYR 16 HA TYR 16 -14.283 6.809 3.624
86 HB3 TYR 16 2HB TYR 16 -12.452 5.317 3.042
87 HD1 TYR 16 2HD TYR 16 -14.389 3.851 2.969
88 HD2 TYR 16 1HD TYR 16 -13.374 6.291 -0.365
89 HE1 TYR 16 2HE TYR 16 -15.900 2.529 1.549
90 HE2 TYR 16 1HE TYR 16 -14.884 4.977 -1.794
91 HH TYR 16 HH TYR 16 -17.031 2.562 -0.467
92 H LYS 17 H LYS 17 -12.300 6.473 5.051
93 HA LYS 17 HA LYS 17 -10.405 8.671 5.038
94 HB3 LYS 17 2HB LYS 17 -12.599 8.379 7.049
95 HG3 LYS 17 2HG LYS 17 -10.875 10.196 8.194
96 HD3 LYS 17 2HD LYS 17 -10.474 8.044 9.746
97 HE3 LYS 17 2HE LYS 17 -12.586 10.039 9.469
98 HZ1 LYS 17 3HZ LYS 17 -13.276 7.946 11.378
99 HZ2 LYS 17 1HZ LYS 17 -13.669 7.659 9.758
100 HZ3 LYS 17 2HZ LYS 17 -14.277 9.025 10.546
101 H CYS 18 H CYS 18 -8.510 8.194 6.075
102 HA CYS 18 HA CYS 18 -7.895 5.486 6.542
103 HB3 CYS 18 2HB CYS 18 -6.415 8.025 7.243
104 H GLU 19 H GLU 19 -7.707 4.285 8.376
105 HA GLU 19 HA GLU 19 -9.101 5.269 10.714
106 HB3 GLU 19 2HB GLU 19 -8.268 2.799 11.438
107 HG3 GLU 19 2HG GLU 19 -10.363 1.947 10.857
108 H LYS 20 H LYS 20 -6.422 6.328 9.954
109 HA LYS 20 HA LYS 20 -5.104 5.840 12.536
110 HB3 LYS 20 2HB LYS 20 -3.189 6.520 10.484
111 HG3 LYS 20 2HG LYS 20 -3.542 4.261 12.415
112 HD3 LYS 20 2HD LYS 20 -1.248 4.536 10.479
113 HE3 LYS 20 2HE LYS 20 -0.291 2.772 11.518
114 HZ1 LYS 20 3HZ LYS 20 -2.135 3.424 13.744
115 HZ2 LYS 20 1HZ LYS 20 -0.831 4.411 13.310
116 HZ3 LYS 20 2HZ LYS 20 -0.554 2.833 13.849
117 H CYS 21 H CYS 21 -4.745 7.948 9.677
118 HA CYS 21 HA CYS 21 -4.376 10.226 11.484
119 HB3 CYS 21 2HB CYS 21 -2.602 10.063 9.908
120 H HIS 22 H HIS 22 -6.873 8.754 10.066
121 HA HIS 22 HA HIS 22 -8.988 9.353 9.477
122 HB3 HIS 22 2HB HIS 22 -9.867 10.766 10.977
123 HD2 HIS 22 2HD HIS 22 -7.689 9.085 12.526
124 HE1 HIS 22 1HE HIS 22 -6.377 12.752 14.206
125 HE2 HIS 22 2HE HIS 22 -6.269 10.240 14.352
126 H LEU 23 H LEU 23 -6.717 9.893 7.664
127 HA LEU 23 HA LEU 23 -7.238 12.323 6.267
128 HB3 LEU 23 2HB LEU 23 -5.990 10.682 4.454
129 HG LEU 23 HG LEU 23 -4.830 12.478 6.552
130 HD11 LEU 23 1HD1 LEU 23 -3.459 10.292 5.385
131 HD12 LEU 23 2HD1 LEU 23 -2.812 11.579 6.399
132 HD13 LEU 23 3HD1 LEU 23 -2.846 11.772 4.647
133 HD21 LEU 23 3HD2 LEU 23 -4.595 12.633 3.563
134 HD22 LEU 23 1HD2 LEU 23 -4.386 13.915 4.756
135 HD23 LEU 23 2HD2 LEU 23 -5.995 13.272 4.425
136 H VAL 24 H VAL 24 -8.936 12.735 5.033
137 HA VAL 24 HA VAL 24 -10.777 10.725 4.217
138 HB VAL 24 HB VAL 24 -10.538 13.657 3.587
139 HG11 VAL 24 1HG1 VAL 24 -12.299 11.602 2.343
140 HG12 VAL 24 2HG1 VAL 24 -12.956 13.210 2.658
141 HG13 VAL 24 3HG1 VAL 24 -11.538 13.021 1.624
142 HG21 VAL 24 3HG2 VAL 24 -11.488 12.393 5.788
143 HG22 VAL 24 1HG2 VAL 24 -12.033 13.978 5.239
144 HG23 VAL 24 2HG2 VAL 24 -12.957 12.535 4.824
145 H LEU 25 H LEU 25 -10.459 9.348 2.605
146 HA LEU 25 HA LEU 25 -9.086 10.313 0.184
147 HB3 LEU 25 2HB LEU 25 -7.575 8.713 0.407
148 HG LEU 25 HG LEU 25 -9.050 8.108 2.912
149 HD11 LEU 25 1HD1 LEU 25 -6.782 6.323 2.387
150 HD12 LEU 25 2HD1 LEU 25 -8.238 5.969 1.459
151 HD13 LEU 25 3HD1 LEU 25 -8.306 6.014 3.220
152 HD21 LEU 25 3HD2 LEU 25 -6.762 8.381 3.831
153 HD22 LEU 25 1HD2 LEU 25 -7.336 9.792 2.944
154 HD23 LEU 25 2HD2 LEU 25 -6.180 8.690 2.195
155 H CYS 26 H CYS 26 -9.605 8.923 -1.764
156 HA CYS 26 HA CYS 26 -12.499 8.432 -1.796
157 HB3 CYS 26 2HB CYS 26 -11.899 8.392 -4.391
158 H SER 27 H SER 27 -9.399 6.940 -2.455
159 HA SER 27 HA SER 27 -10.776 4.358 -2.754
160 HB3 SER 27 2HB SER 27 -9.900 5.262 -4.952
161 HG SER 27 HG SER 27 -7.462 4.678 -4.962
162 HA PRO 28 HA PRO 28 -7.695 4.172 0.688
163 HB3 PRO 28 2HB PRO 28 -9.353 4.505 2.244
164 HG3 PRO 28 2HG PRO 28 -11.572 4.008 1.757
165 HD3 PRO 28 2HD PRO 28 -11.033 5.275 -0.093
166 H LYS 29 H LYS 29 -7.616 1.884 2.163
167 HA LYS 29 HA LYS 29 -7.334 -0.258 0.160
168 HB3 LYS 29 2HB LYS 29 -5.279 -0.952 1.124
169 HG3 LYS 29 2HG LYS 29 -3.809 0.975 1.029
170 HD3 LYS 29 2HD LYS 29 -6.056 0.913 -0.971
171 HE3 LYS 29 2HE LYS 29 -3.468 2.457 -1.139
172 HZ1 LYS 29 3HZ LYS 29 -5.173 1.424 -3.152
173 HZ2 LYS 29 1HZ LYS 29 -3.717 2.269 -3.318
174 HZ3 LYS 29 2HZ LYS 29 -5.176 3.114 -3.203
175 H GLN 30 H GLN 30 -9.661 -0.265 1.355
176 HA GLN 30 HA GLN 30 -10.226 -1.148 3.807
177 HB3 GLN 30 2HB GLN 30 -11.435 -2.913 1.790
178 HG3 GLN 30 2HG GLN 30 -12.536 -0.868 3.699
179 HE21 GLN 30 1HE2 GLN 30 -14.734 -2.853 4.012
180 HE22 GLN 30 2HE2 GLN 30 -15.803 -2.546 2.691
181 H THR 31 H THR 31 -9.143 -2.485 5.090
182 HA THR 31 HA THR 31 -7.499 -4.598 4.168
183 HB THR 31 HB THR 31 -7.113 -5.145 6.462
184 HG1 THR 31 1HG THR 31 -9.029 -3.403 7.486
185 HG21 THR 31 3HG2 THR 31 -6.280 -3.119 7.271
186 HG22 THR 31 1HG2 THR 31 -7.609 -2.188 6.584
187 HG23 THR 31 2HG2 THR 31 -6.364 -2.856 5.530
188 H GLU 32 H GLU 32 -8.016 -6.711 5.882
189 HA GLU 32 HA GLU 32 -10.302 -7.921 4.543
190 HB3 GLU 32 2HB GLU 32 -8.821 -9.588 6.441
191 HG3 GLU 32 2HG GLU 32 -8.820 -10.024 3.501
192 H CYS 33 H CYS 33 -10.251 -5.989 6.987
193 HA CYS 33 HA CYS 33 -12.020 -7.620 8.691
194 HB3 CYS 33 2HB CYS 33 -9.860 -6.776 9.728
195 H GLY 34 H GLY 34 -11.586 -4.618 6.963
196 HA2 GLY 34 1HA GLY 34 -13.880 -3.880 6.087
197 HA3 GLY 34 2HA GLY 34 -14.277 -3.749 7.793
198 H HIS 35 H HIS 35 -12.103 -2.576 8.884
199 HA HIS 35 HA HIS 35 -12.454 0.110 8.457
200 HB3 HIS 35 2HB HIS 35 -10.221 0.416 9.550
201 HD2 HIS 35 2HD HIS 35 -12.410 1.145 11.310
202 HE1 HIS 35 1HE HIS 35 -12.273 -2.558 13.377
203 HE2 HIS 35 2HE HIS 35 -13.225 -0.225 13.347
204 H ARG 36 H ARG 36 -10.439 1.587 7.837
205 HA ARG 36 HA ARG 36 -9.195 0.657 5.364
206 HB3 ARG 36 2HB ARG 36 -9.868 2.838 4.257
207 HG3 ARG 36 2HG ARG 36 -11.685 0.576 4.791
208 HD3 ARG 36 2HD ARG 36 -12.917 2.497 3.010
209 HE ARG 36 HE ARG 36 -14.483 0.988 3.739
210 HH11 ARG 36 1HH1 ARG 36 -12.852 2.377 6.484
211 HH12 ARG 36 2HH1 ARG 36 -13.930 1.674 7.644
212 HH21 ARG 36 1HH2 ARG 36 -15.909 0.058 5.256
213 HH22 ARG 36 2HH2 ARG 36 -15.667 0.355 6.945
214 H PHE 37 H PHE 37 -7.474 2.085 4.614
215 HA PHE 37 HA PHE 37 -6.507 4.047 6.540
216 HB3 PHE 37 2HB PHE 37 -4.185 2.940 6.348
217 HD1 PHE 37 2HD PHE 37 -6.630 0.374 7.332
218 HD2 PHE 37 1HD PHE 37 -4.171 3.596 8.630
219 HE1 PHE 37 2HE PHE 37 -7.034 -0.266 9.673
220 HE2 PHE 37 1HE PHE 37 -4.570 2.961 10.974
221 HZ PHE 37 HZ PHE 37 -6.004 1.029 11.497
222 H CYS 38 H CYS 38 -4.389 5.049 5.671
223 HA CYS 38 HA CYS 38 -4.850 5.666 2.849
224 HB3 CYS 38 2HB CYS 38 -4.745 7.514 4.530
225 H GLU 39 H GLU 39 -2.853 6.128 1.527
226 HA GLU 39 HA GLU 39 -1.379 3.890 1.052
227 HB3 GLU 39 2HB GLU 39 0.403 5.606 0.164
228 HG3 GLU 39 2HG GLU 39 -2.288 5.963 -1.070
229 H SER 40 H SER 40 -0.056 6.727 2.767
230 HA SER 40 HA SER 40 2.327 5.655 3.598
231 HB3 SER 40 2HB SER 40 0.507 7.719 4.793
232 HG SER 40 HG SER 40 3.046 7.211 5.894
233 H CYS 41 H CYS 41 -0.106 6.147 6.102
234 HA CYS 41 HA CYS 41 0.687 4.430 7.977
235 HB3 CYS 41 2HB CYS 41 -1.699 4.052 8.592
236 H MET 42 H MET 42 -1.262 3.447 5.171
237 HA MET 42 HA MET 42 -1.568 0.762 5.752
238 HB3 MET 42 2HB MET 42 -1.233 2.154 3.096
239 HG3 MET 42 2HG MET 42 -0.865 -0.482 3.271
240 HE1 MET 42 3HE MET 42 -3.484 0.399 5.290
241 HE2 MET 42 1HE MET 42 -4.254 -1.184 5.416
242 HE3 MET 42 2HE MET 42 -2.502 -1.042 5.562
243 H ALA 43 H ALA 43 0.972 2.169 3.674
244 HA ALA 43 HA ALA 43 2.469 -0.181 3.394
245 HB1 ALA 43 3HB ALA 43 2.875 2.675 2.859
246 HB2 ALA 43 1HB ALA 43 4.355 1.759 3.145
247 HB3 ALA 43 2HB ALA 43 3.246 1.267 1.864
248 H ALA 44 H ALA 44 2.157 1.968 6.047
249 HA ALA 44 HA ALA 44 4.677 1.368 7.282
250 HB1 ALA 44 3HB ALA 44 4.113 2.908 8.840
251 HB2 ALA 44 1HB ALA 44 2.944 3.382 7.608
252 HB3 ALA 44 2HB ALA 44 2.444 2.349 8.949
253 H LEU 45 H LEU 45 1.304 0.412 7.910
254 HA LEU 45 HA LEU 45 1.841 -1.318 10.049
255 HB3 LEU 45 2HB LEU 45 -0.357 -2.303 9.560
256 HG LEU 45 HG LEU 45 -0.394 0.700 9.262
257 HD11 LEU 45 1HD1 LEU 45 -2.679 0.678 9.693
258 HD12 LEU 45 2HD1 LEU 45 -2.657 -0.994 10.254
259 HD13 LEU 45 3HD1 LEU 45 -2.467 -0.638 8.537
260 HD21 LEU 45 3HD2 LEU 45 0.270 -0.993 11.443
261 HD22 LEU 45 1HD2 LEU 45 -1.282 -0.230 11.790
262 HD23 LEU 45 2HD2 LEU 45 0.125 0.766 11.416
263 H LEU 46 H LEU 46 1.612 -1.936 6.565
264 HA LEU 46 HA LEU 46 1.834 -4.698 6.575
265 HB3 LEU 46 2HB LEU 46 2.779 -4.469 4.312
266 HG LEU 46 HG LEU 46 0.517 -2.540 4.823
267 HD11 LEU 46 1HD1 LEU 46 0.177 -2.331 2.555
268 HD12 LEU 46 2HD1 LEU 46 1.102 -3.782 2.172
269 HD13 LEU 46 3HD1 LEU 46 1.937 -2.307 2.655
270 HD21 LEU 46 3HD2 LEU 46 -0.739 -4.354 5.040
271 HD22 LEU 46 1HD2 LEU 46 0.685 -5.378 4.848
272 HD23 LEU 46 2HD2 LEU 46 -0.246 -4.889 3.432
273 H SER 47 H SER 47 4.264 -2.264 7.120
274 HA SER 47 HA SER 47 6.422 -4.222 6.995
275 HB3 SER 47 2HB SER 47 7.011 -1.477 7.925
276 HG SER 47 HG SER 47 8.705 -2.790 7.347
277 H SER 48 H SER 48 4.387 -4.481 9.036
278 HA SER 48 HA SER 48 5.956 -3.916 11.464
279 HB3 SER 48 2HB SER 48 3.002 -4.553 11.309
280 HG SER 48 HG SER 48 2.992 -3.898 13.411
281 H SER 49 H SER 49 6.365 -6.166 9.640
282 HA SER 49 HA SER 49 6.452 -8.465 9.598
283 HB3 SER 49 2HB SER 49 7.026 -8.272 12.541
284 HG SER 49 HG SER 49 8.635 -9.762 11.944
285 H SER 50 H SER 50 3.805 -7.311 10.314
286 HA SER 50 HA SER 50 2.249 -9.493 10.578
287 HB3 SER 50 2HB SER 50 3.002 -10.320 12.594
288 HG SER 50 HG SER 50 4.335 -9.130 13.675
289 HA PRO 51 HA PRO 51 0.263 -5.255 10.499
290 HB3 PRO 51 2HB PRO 51 0.862 -4.865 8.314
291 HG3 PRO 51 2HG PRO 51 1.380 -6.621 6.881
292 HD3 PRO 51 2HD PRO 51 2.711 -7.172 8.681
293 H LYS 52 H LYS 52 -1.614 -5.239 11.547
294 HA LYS 52 HA LYS 52 -3.614 -7.303 10.895
295 HB3 LYS 52 2HB LYS 52 -4.309 -7.355 13.126
296 HG3 LYS 52 2HG LYS 52 -1.349 -7.020 12.979
297 HD3 LYS 52 2HD LYS 52 -2.729 -7.795 15.529
298 HE3 LYS 52 2HE LYS 52 -0.059 -6.506 15.353
299 HZ1 LYS 52 3HZ LYS 52 -1.518 -8.225 17.155
300 HZ2 LYS 52 1HZ LYS 52 -0.298 -7.099 17.481
301 HZ3 LYS 52 2HZ LYS 52 0.106 -8.655 16.956
302 H CYS 53 H CYS 53 -3.688 -4.146 12.545
303 HA CYS 53 HA CYS 53 -4.849 -2.517 10.761
304 HB3 CYS 53 2HB CYS 53 -6.851 -4.517 11.738
305 H THR 54 H THR 54 -4.036 -0.932 12.046
306 HA THR 54 HA THR 54 -3.923 -0.530 14.668
307 HB THR 54 HB THR 54 -4.048 1.225 12.425
308 HG1 THR 54 1HG THR 54 -2.408 0.875 14.182
309 HG21 THR 54 3HG2 THR 54 -6.208 1.981 13.244
310 HG22 THR 54 1HG2 THR 54 -4.992 3.229 13.513
311 HG23 THR 54 2HG2 THR 54 -5.537 2.223 14.856
312 H ALA 55 H ALA 55 -6.883 -0.069 12.774
313 HA ALA 55 HA ALA 55 -8.565 0.956 14.699
314 HB1 ALA 55 3HB ALA 55 -10.087 0.721 13.097
315 HB2 ALA 55 1HB ALA 55 -8.851 -0.085 12.131
316 HB3 ALA 55 2HB ALA 55 -9.946 -1.036 13.136
317 H CYS 56 H CYS 56 -8.884 -2.456 13.785
318 HA CYS 56 HA CYS 56 -9.288 -3.088 16.633
319 HB3 CYS 56 2HB CYS 56 -11.295 -3.448 15.295
320 H GLN 57 H GLN 57 -7.571 -3.911 13.722
321 HA GLN 57 HA GLN 57 -5.557 -5.015 13.531
322 HB3 GLN 57 2HB GLN 57 -4.397 -5.828 15.377
323 HG3 GLN 57 2HG GLN 57 -5.883 -4.319 17.300
324 HE21 GLN 57 1HE2 GLN 57 -3.660 -3.104 14.858
325 HE22 GLN 57 2HE2 GLN 57 -2.297 -2.954 15.909
326 H GLU 58 H GLU 58 -6.248 -6.389 11.962
327 HA GLU 58 HA GLU 58 -7.098 -9.052 12.861
328 HB3 GLU 58 2HB GLU 58 -8.338 -8.656 10.378
329 HG3 GLU 58 2HG GLU 58 -10.455 -8.516 11.815
330 H SER 59 H SER 59 -6.292 -7.304 9.854
331 HA SER 59 HA SER 59 -3.864 -8.551 9.355
332 HB3 SER 59 2HB SER 59 -5.286 -9.925 7.336
333 HG SER 59 HG SER 59 -4.318 -11.210 9.636
334 H ILE 60 H ILE 60 -2.883 -7.357 7.859
335 HA ILE 60 HA ILE 60 -4.539 -6.019 5.822
336 HB ILE 60 HB ILE 60 -2.061 -4.662 6.722
337 HG13 ILE 60 2HG1 ILE 60 -3.242 -5.403 8.823
338 HG21 ILE 60 1HG2 ILE 60 -2.947 -2.990 5.558
339 HG22 ILE 60 2HG2 ILE 60 -4.247 -4.083 5.084
340 HG23 ILE 60 3HG2 ILE 60 -4.435 -3.052 6.502
341 HD11 ILE 60 3HD1 ILE 60 -2.020 -3.063 8.402
342 HD12 ILE 60 1HD1 ILE 60 -3.632 -2.485 8.823
343 HD13 ILE 60 2HD1 ILE 60 -2.746 -3.518 9.944
344 H VAL 61 H VAL 61 -4.054 -7.231 4.067
345 HA VAL 61 HA VAL 61 -1.204 -7.448 3.341
346 HB VAL 61 HB VAL 61 -3.437 -9.414 2.847
347 HG11 VAL 61 1HG1 VAL 61 -1.728 -10.726 1.582
348 HG12 VAL 61 2HG1 VAL 61 -2.250 -9.245 0.777
349 HG13 VAL 61 3HG1 VAL 61 -0.693 -9.297 1.605
350 HG21 VAL 61 3HG2 VAL 61 -2.608 -10.224 4.766
351 HG22 VAL 61 1HG2 VAL 61 -1.256 -10.780 3.779
352 HG23 VAL 61 2HG2 VAL 61 -1.141 -9.252 4.652
353 H LYS 62 H LYS 62 -0.662 -6.366 1.574
354 HA LYS 62 HA LYS 62 -2.224 -4.732 0.078
355 HB3 LYS 62 2HB LYS 62 0.098 -4.555 -0.240
356 HG3 LYS 62 2HG LYS 62 0.339 -7.241 -1.525
357 HD3 LYS 62 2HD LYS 62 2.137 -5.119 -0.485
358 HE3 LYS 62 2HE LYS 62 2.648 -8.064 -0.261
359 HZ1 LYS 62 3HZ LYS 62 5.039 -7.373 0.035
360 HZ2 LYS 62 1HZ LYS 62 4.638 -5.924 -0.740
361 HZ3 LYS 62 2HZ LYS 62 4.468 -7.396 -1.557
362 H ASP 63 H ASP 63 -1.459 -8.110 -0.732
363 HA ASP 63 HA ASP 63 -2.877 -8.293 -3.113
364 HB3 ASP 63 2HB ASP 63 -3.135 -10.779 -2.382
365 H LYS 64 H LYS 64 -3.995 -8.750 0.213
366 HA LYS 64 HA LYS 64 -6.707 -9.285 -0.675
367 HB3 LYS 64 2HB LYS 64 -7.219 -9.663 1.645
368 HG3 LYS 64 2HG LYS 64 -4.606 -10.818 1.983
369 HD3 LYS 64 2HD LYS 64 -6.878 -12.454 1.052
370 HE3 LYS 64 2HE LYS 64 -5.431 -12.593 3.676
371 HZ1 LYS 64 3HZ LYS 64 -5.772 -15.001 3.255
372 HZ2 LYS 64 1HZ LYS 64 -6.698 -14.600 1.897
373 HZ3 LYS 64 2HZ LYS 64 -7.211 -14.131 3.439
374 H VAL 65 H VAL 65 -4.958 -6.574 -0.501
375 HA VAL 65 HA VAL 65 -7.081 -4.907 0.650
376 HB VAL 65 HB VAL 65 -4.189 -4.651 0.444
377 HG11 VAL 65 1HG1 VAL 65 -5.874 -2.268 -0.317
378 HG12 VAL 65 2HG1 VAL 65 -4.152 -2.224 0.068
379 HG13 VAL 65 3HG1 VAL 65 -4.717 -3.103 -1.353
380 HG21 VAL 65 3HG2 VAL 65 -4.446 -3.875 2.529
381 HG22 VAL 65 1HG2 VAL 65 -5.672 -2.707 2.038
382 HG23 VAL 65 2HG2 VAL 65 -6.128 -4.379 2.364
383 H PHE 66 H PHE 66 -8.366 -3.678 -0.577
384 HA PHE 66 HA PHE 66 -8.515 -3.999 -3.352
385 HB3 PHE 66 2HB PHE 66 -9.982 -1.858 -3.163
386 HD1 PHE 66 2HD PHE 66 -11.050 -3.752 -4.431
387 HD2 PHE 66 1HD PHE 66 -10.970 -3.577 -0.178
388 HE1 PHE 66 2HE PHE 66 -12.892 -5.381 -4.333
389 HE2 PHE 66 1HE PHE 66 -12.811 -5.207 -0.074
390 HZ PHE 66 HZ PHE 66 -13.775 -6.110 -2.152
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -56.144 8.109 0.752
2 HA2 GLY 1 1HA GLY 1 -55.475 6.928 -1.726
3 HA3 GLY 1 2HA GLY 1 -55.637 8.664 -1.938
4 H SER 2 H SER 2 -53.343 6.562 -1.815
5 HA SER 2 HA SER 2 -51.676 7.244 0.342
6 HB3 SER 2 2HB SER 2 -49.845 6.293 -1.045
7 HG SER 2 HG SER 2 -52.296 4.862 -1.089
8 H SER 3 H SER 3 -49.726 8.515 0.334
9 HA SER 3 HA SER 3 -50.084 11.004 -1.146
10 HB3 SER 3 2HB SER 3 -48.178 11.758 0.415
11 HG SER 3 HG SER 3 -50.055 12.491 1.120
12 H GLY 4 H GLY 4 -48.936 11.477 -2.897
13 HA2 GLY 4 1HA GLY 4 -46.879 9.701 -3.827
14 HA3 GLY 4 2HA GLY 4 -47.441 11.160 -4.630
15 H SER 5 H SER 5 -44.779 9.802 -3.429
16 HA SER 5 HA SER 5 -43.484 12.379 -3.047
17 HB3 SER 5 2HB SER 5 -42.997 10.224 -0.999
18 HG SER 5 HG SER 5 -42.634 12.496 0.073
19 H SER 6 H SER 6 -42.848 11.447 -5.219
20 HA SER 6 HA SER 6 -41.000 9.248 -5.231
21 HB3 SER 6 2HB SER 6 -41.385 9.271 -7.441
22 HG SER 6 HG SER 6 -43.423 10.113 -6.779
23 H GLY 7 H GLY 7 -38.827 9.286 -5.118
24 HA2 GLY 7 1HA GLY 7 -37.570 11.824 -4.436
25 HA3 GLY 7 2HA GLY 7 -36.855 10.228 -4.266
26 H PHE 8 H PHE 8 -36.310 12.981 -5.737
27 HA PHE 8 HA PHE 8 -35.996 12.284 -8.469
28 HB3 PHE 8 2HB PHE 8 -35.117 14.399 -8.757
29 HD1 PHE 8 2HD PHE 8 -37.816 13.494 -7.528
30 HD2 PHE 8 1HD PHE 8 -35.019 16.544 -6.532
31 HE1 PHE 8 2HE PHE 8 -39.627 14.819 -6.517
32 HE2 PHE 8 1HE PHE 8 -36.824 17.873 -5.519
33 HZ PHE 8 HZ PHE 8 -39.132 17.012 -5.511
34 H VAL 9 H VAL 9 -34.085 11.840 -9.632
35 HA VAL 9 HA VAL 9 -32.325 10.016 -8.355
36 HB VAL 9 HB VAL 9 -33.046 10.369 -10.923
37 HG11 VAL 9 1HG1 VAL 9 -31.689 12.445 -11.082
38 HG12 VAL 9 2HG1 VAL 9 -30.243 11.474 -10.797
39 HG13 VAL 9 3HG1 VAL 9 -31.219 11.203 -12.242
40 HG21 VAL 9 3HG2 VAL 9 -30.377 9.169 -10.231
41 HG22 VAL 9 1HG2 VAL 9 -31.904 8.424 -9.757
42 HG23 VAL 9 2HG2 VAL 9 -31.524 8.650 -11.465
43 H LYS 10 H LYS 10 -30.422 10.328 -7.390
44 HA LYS 10 HA LYS 10 -28.639 12.446 -8.065
45 HB3 LYS 10 2HB LYS 10 -29.057 12.948 -5.302
46 HG3 LYS 10 2HG LYS 10 -29.641 14.592 -7.752
47 HD3 LYS 10 2HD LYS 10 -29.174 16.153 -5.408
48 HE3 LYS 10 2HE LYS 10 -31.554 15.817 -7.229
49 HZ1 LYS 10 3HZ LYS 10 -32.485 17.700 -6.310
50 HZ2 LYS 10 1HZ LYS 10 -31.049 18.196 -5.566
51 HZ3 LYS 10 2HZ LYS 10 -31.921 16.890 -4.937
52 H THR 11 H THR 11 -26.595 12.015 -7.378
53 HA THR 11 HA THR 11 -26.005 9.431 -6.411
54 HB THR 11 HB THR 11 -24.548 11.470 -7.607
55 HG1 THR 11 1HG THR 11 -23.097 9.368 -6.515
56 HG21 THR 11 3HG2 THR 11 -22.741 12.041 -6.214
57 HG22 THR 11 1HG2 THR 11 -23.178 10.831 -5.007
58 HG23 THR 11 2HG2 THR 11 -24.170 12.276 -5.208
59 H VAL 12 H VAL 12 -24.385 9.193 -4.504
60 HA VAL 12 HA VAL 12 -25.539 10.596 -2.181
61 HB VAL 12 HB VAL 12 -26.123 8.365 -1.866
62 HG11 VAL 12 1HG1 VAL 12 -23.416 7.678 -2.984
63 HG12 VAL 12 2HG1 VAL 12 -24.453 6.495 -2.183
64 HG13 VAL 12 3HG1 VAL 12 -25.002 7.298 -3.655
65 HG21 VAL 12 3HG2 VAL 12 -25.159 7.889 0.134
66 HG22 VAL 12 1HG2 VAL 12 -23.520 8.085 -0.486
67 HG23 VAL 12 2HG2 VAL 12 -24.487 9.505 -0.089
68 H GLU 13 H GLU 13 -23.941 12.285 -2.513
69 HA GLU 13 HA GLU 13 -21.250 12.146 -2.673
70 HB3 GLU 13 2HB GLU 13 -22.376 14.273 -2.537
71 HG3 GLU 13 2HG GLU 13 -22.636 14.368 0.369
72 H ASP 14 H ASP 14 -19.820 10.913 -1.666
73 HA ASP 14 HA ASP 14 -19.726 10.858 1.227
74 HB3 ASP 14 2HB ASP 14 -19.478 8.133 0.206
75 H LYS 15 H LYS 15 -17.873 8.961 1.686
76 HA LYS 15 HA LYS 15 -15.766 8.697 -0.117
77 HB3 LYS 15 2HB LYS 15 -15.285 10.971 -0.161
78 HG3 LYS 15 2HG LYS 15 -16.801 11.812 1.498
79 HD3 LYS 15 2HD LYS 15 -14.894 10.624 3.514
80 HE3 LYS 15 2HE LYS 15 -16.439 12.946 3.734
81 HZ1 LYS 15 3HZ LYS 15 -18.339 11.308 3.998
82 HZ2 LYS 15 1HZ LYS 15 -18.147 12.457 5.225
83 HZ3 LYS 15 2HZ LYS 15 -17.626 10.867 5.468
84 H TYR 16 H TYR 16 -13.590 8.344 1.165
85 HA TYR 16 HA TYR 16 -14.283 6.833 3.597
86 HB3 TYR 16 2HB TYR 16 -12.496 5.292 3.059
87 HD1 TYR 16 1HD TYR 16 -13.357 6.381 -0.349
88 HD2 TYR 16 2HD TYR 16 -14.364 3.793 2.874
89 HE1 TYR 16 1HE TYR 16 -14.845 5.113 -1.841
90 HE2 TYR 16 2HE TYR 16 -15.854 2.516 1.391
91 HH TYR 16 HH TYR 16 -16.446 3.538 -1.940
92 H LYS 17 H LYS 17 -12.301 6.474 5.037
93 HA LYS 17 HA LYS 17 -10.397 8.667 5.031
94 HB3 LYS 17 2HB LYS 17 -12.596 8.372 7.037
95 HG3 LYS 17 2HG LYS 17 -10.872 10.185 8.189
96 HD3 LYS 17 2HD LYS 17 -10.476 8.027 9.737
97 HE3 LYS 17 2HE LYS 17 -12.524 10.065 9.488
98 HZ1 LYS 17 3HZ LYS 17 -14.226 8.572 9.624
99 HZ2 LYS 17 1HZ LYS 17 -13.881 8.748 11.272
100 HZ3 LYS 17 2HZ LYS 17 -13.307 7.400 10.427
101 H CYS 18 H CYS 18 -8.506 8.184 6.070
102 HA CYS 18 HA CYS 18 -7.897 5.473 6.532
103 HB3 CYS 18 2HB CYS 18 -6.414 8.010 7.227
104 H GLU 19 H GLU 19 -7.709 4.270 8.366
105 HA GLU 19 HA GLU 19 -9.105 5.253 10.704
106 HB3 GLU 19 2HB GLU 19 -8.280 2.783 11.427
107 HG3 GLU 19 2HG GLU 19 -10.373 1.935 10.840
108 H LYS 20 H LYS 20 -6.434 6.324 9.957
109 HA LYS 20 HA LYS 20 -5.115 5.824 12.536
110 HB3 LYS 20 2HB LYS 20 -3.191 6.507 10.499
111 HG3 LYS 20 2HG LYS 20 -3.569 4.229 12.402
112 HD3 LYS 20 2HD LYS 20 -1.268 4.510 10.474
113 HE3 LYS 20 2HE LYS 20 -0.351 2.671 11.455
114 HZ1 LYS 20 3HZ LYS 20 -0.427 4.204 13.252
115 HZ2 LYS 20 1HZ LYS 20 -0.785 2.676 13.886
116 HZ3 LYS 20 2HZ LYS 20 -2.025 3.797 13.629
117 H CYS 21 H CYS 21 -4.756 7.938 9.680
118 HA CYS 21 HA CYS 21 -4.384 10.212 11.492
119 HB3 CYS 21 2HB CYS 21 -2.612 10.052 9.914
120 H HIS 22 H HIS 22 -6.878 8.743 10.052
121 HA HIS 22 HA HIS 22 -8.995 9.345 9.475
122 HB3 HIS 22 2HB HIS 22 -9.873 10.756 10.976
123 HD2 HIS 22 2HD HIS 22 -7.697 9.068 12.522
124 HE1 HIS 22 1HE HIS 22 -6.383 12.730 14.212
125 HE2 HIS 22 2HE HIS 22 -6.277 10.218 14.352
126 H LEU 23 H LEU 23 -6.710 9.901 7.672
127 HA LEU 23 HA LEU 23 -7.232 12.328 6.277
128 HB3 LEU 23 2HB LEU 23 -5.992 10.690 4.457
129 HG LEU 23 HG LEU 23 -4.824 12.472 6.563
130 HD11 LEU 23 1HD1 LEU 23 -2.843 11.760 4.654
131 HD12 LEU 23 2HD1 LEU 23 -3.462 10.283 5.391
132 HD13 LEU 23 3HD1 LEU 23 -2.809 11.568 6.408
133 HD21 LEU 23 3HD2 LEU 23 -4.623 13.992 4.890
134 HD22 LEU 23 1HD2 LEU 23 -5.977 13.072 4.236
135 HD23 LEU 23 2HD2 LEU 23 -4.341 12.765 3.655
136 H VAL 24 H VAL 24 -8.937 12.748 5.054
137 HA VAL 24 HA VAL 24 -10.789 10.754 4.236
138 HB VAL 24 HB VAL 24 -10.559 13.632 3.347
139 HG11 VAL 24 1HG1 VAL 24 -13.201 12.876 3.164
140 HG12 VAL 24 2HG1 VAL 24 -12.075 13.046 1.816
141 HG13 VAL 24 3HG1 VAL 24 -12.334 11.466 2.556
142 HG21 VAL 24 3HG2 VAL 24 -10.924 13.699 5.654
143 HG22 VAL 24 1HG2 VAL 24 -12.542 13.832 4.965
144 HG23 VAL 24 2HG2 VAL 24 -11.987 12.292 5.621
145 H LEU 25 H LEU 25 -10.466 9.362 2.637
146 HA LEU 25 HA LEU 25 -9.077 10.303 0.216
147 HB3 LEU 25 2HB LEU 25 -7.616 8.654 0.409
148 HG LEU 25 HG LEU 25 -9.051 8.133 2.962
149 HD11 LEU 25 1HD1 LEU 25 -6.799 6.335 2.508
150 HD12 LEU 25 2HD1 LEU 25 -8.205 5.973 1.509
151 HD13 LEU 25 3HD1 LEU 25 -8.363 6.031 3.263
152 HD21 LEU 25 3HD2 LEU 25 -6.731 8.409 3.823
153 HD22 LEU 25 1HD2 LEU 25 -7.340 9.811 2.943
154 HD23 LEU 25 2HD2 LEU 25 -6.200 8.710 2.168
155 H CYS 26 H CYS 26 -9.588 8.808 -1.706
156 HA CYS 26 HA CYS 26 -12.502 8.425 -1.768
157 HB3 CYS 26 2HB CYS 26 -11.840 8.334 -4.365
158 H SER 27 H SER 27 -9.429 6.872 -2.463
159 HA SER 27 HA SER 27 -10.854 4.309 -2.691
160 HB3 SER 27 2HB SER 27 -10.036 5.164 -4.925
161 HG SER 27 HG SER 27 -7.474 4.360 -4.445
162 HA PRO 28 HA PRO 28 -7.681 4.110 0.665
163 HB3 PRO 28 2HB PRO 28 -9.293 4.474 2.261
164 HG3 PRO 28 2HG PRO 28 -11.529 3.998 1.837
165 HD3 PRO 28 2HD PRO 28 -11.027 5.244 -0.035
166 H LYS 29 H LYS 29 -7.589 1.833 2.155
167 HA LYS 29 HA LYS 29 -7.368 -0.322 0.158
168 HB3 LYS 29 2HB LYS 29 -5.314 -1.045 1.115
169 HG3 LYS 29 2HG LYS 29 -3.820 0.874 0.997
170 HD3 LYS 29 2HD LYS 29 -6.053 0.774 -1.017
171 HE3 LYS 29 2HE LYS 29 -3.569 2.457 -0.978
172 HZ1 LYS 29 3HZ LYS 29 -4.914 1.252 -3.298
173 HZ2 LYS 29 1HZ LYS 29 -3.264 1.519 -3.033
174 HZ3 LYS 29 2HZ LYS 29 -4.276 2.814 -3.432
175 H GLN 30 H GLN 30 -9.684 -0.271 1.399
176 HA GLN 30 HA GLN 30 -10.230 -1.151 3.852
177 HB3 GLN 30 2HB GLN 30 -11.466 -2.862 1.778
178 HG3 GLN 30 2HG GLN 30 -12.612 -0.944 3.794
179 HE21 GLN 30 1HE2 GLN 30 -14.861 -1.117 4.107
180 HE22 GLN 30 2HE2 GLN 30 -15.900 -1.671 2.844
181 H THR 31 H THR 31 -9.083 -2.476 5.100
182 HA THR 31 HA THR 31 -7.502 -4.616 4.171
183 HB THR 31 HB THR 31 -7.107 -5.176 6.457
184 HG1 THR 31 1HG THR 31 -9.533 -3.783 6.919
185 HG21 THR 31 3HG2 THR 31 -6.375 -2.869 5.529
186 HG22 THR 31 1HG2 THR 31 -6.240 -3.172 7.261
187 HG23 THR 31 2HG2 THR 31 -7.589 -2.223 6.634
188 H GLU 32 H GLU 32 -8.039 -6.730 5.887
189 HA GLU 32 HA GLU 32 -10.338 -7.913 4.544
190 HB3 GLU 32 2HB GLU 32 -8.556 -9.382 6.457
191 HG3 GLU 32 2HG GLU 32 -8.968 -10.804 4.079
192 H CYS 33 H CYS 33 -10.259 -5.992 6.998
193 HA CYS 33 HA CYS 33 -12.032 -7.612 8.706
194 HB3 CYS 33 2HB CYS 33 -9.868 -6.768 9.734
195 H GLY 34 H GLY 34 -11.597 -4.609 6.977
196 HA2 GLY 34 1HA GLY 34 -13.890 -3.870 6.102
197 HA3 GLY 34 2HA GLY 34 -14.289 -3.743 7.807
198 H HIS 35 H HIS 35 -12.050 -2.597 8.868
199 HA HIS 35 HA HIS 35 -12.422 0.104 8.446
200 HB3 HIS 35 2HB HIS 35 -10.202 0.405 9.562
201 HD2 HIS 35 2HD HIS 35 -12.443 1.129 11.277
202 HE1 HIS 35 1HE HIS 35 -12.275 -2.545 13.391
203 HE2 HIS 35 2HE HIS 35 -13.262 -0.229 13.320
204 H ARG 36 H ARG 36 -10.499 1.613 7.791
205 HA ARG 36 HA ARG 36 -9.204 0.656 5.346
206 HB3 ARG 36 2HB ARG 36 -9.856 2.885 4.273
207 HG3 ARG 36 2HG ARG 36 -11.620 0.556 4.668
208 HD3 ARG 36 2HD ARG 36 -12.909 2.422 2.912
209 HE ARG 36 HE ARG 36 -14.401 0.881 3.738
210 HH11 ARG 36 1HH1 ARG 36 -12.855 2.549 6.373
211 HH12 ARG 36 2HH1 ARG 36 -13.923 1.909 7.578
212 HH21 ARG 36 1HH2 ARG 36 -15.813 0.030 5.315
213 HH22 ARG 36 2HH2 ARG 36 -15.604 0.474 6.975
214 H PHE 37 H PHE 37 -7.481 2.090 4.594
215 HA PHE 37 HA PHE 37 -6.504 4.039 6.528
216 HB3 PHE 37 2HB PHE 37 -4.187 2.917 6.333
217 HD1 PHE 37 1HD PHE 37 -6.678 0.394 7.330
218 HD2 PHE 37 2HD PHE 37 -4.138 3.559 8.613
219 HE1 PHE 37 1HE PHE 37 -7.084 -0.235 9.674
220 HE2 PHE 37 2HE PHE 37 -4.538 2.934 10.958
221 HZ PHE 37 HZ PHE 37 -6.012 1.035 11.492
222 H CYS 38 H CYS 38 -4.402 5.054 5.670
223 HA CYS 38 HA CYS 38 -4.844 5.664 2.842
224 HB3 CYS 38 2HB CYS 38 -4.747 7.512 4.526
225 H GLU 39 H GLU 39 -2.869 6.090 1.506
226 HA GLU 39 HA GLU 39 -1.383 3.864 1.052
227 HB3 GLU 39 2HB GLU 39 0.402 5.590 0.170
228 HG3 GLU 39 2HG GLU 39 -2.373 5.644 -0.987
229 H SER 40 H SER 40 -0.064 6.709 2.757
230 HA SER 40 HA SER 40 2.318 5.644 3.597
231 HB3 SER 40 2HB SER 40 0.491 7.703 4.790
232 HG SER 40 HG SER 40 2.968 7.595 5.928
233 H CYS 41 H CYS 41 -0.120 6.137 6.097
234 HA CYS 41 HA CYS 41 0.673 4.426 7.976
235 HB3 CYS 41 2HB CYS 41 -1.716 4.041 8.584
236 H MET 42 H MET 42 -1.276 3.431 5.174
237 HA MET 42 HA MET 42 -1.571 0.747 5.763
238 HB3 MET 42 2HB MET 42 -1.250 2.134 3.103
239 HG3 MET 42 2HG MET 42 -0.869 -0.500 3.281
240 HE1 MET 42 3HE MET 42 -2.509 -1.054 5.584
241 HE2 MET 42 1HE MET 42 -3.487 0.386 5.299
242 HE3 MET 42 2HE MET 42 -4.260 -1.193 5.434
243 H ALA 43 H ALA 43 0.962 2.164 3.683
244 HA ALA 43 HA ALA 43 2.466 -0.179 3.392
245 HB1 ALA 43 3HB ALA 43 3.149 2.729 3.132
246 HB2 ALA 43 1HB ALA 43 4.365 1.473 2.898
247 HB3 ALA 43 2HB ALA 43 2.936 1.521 1.864
248 H ALA 44 H ALA 44 2.179 1.995 6.042
249 HA ALA 44 HA ALA 44 4.690 1.373 7.277
250 HB1 ALA 44 3HB ALA 44 2.244 2.538 8.593
251 HB2 ALA 44 1HB ALA 44 3.920 2.659 9.132
252 HB3 ALA 44 2HB ALA 44 3.405 3.484 7.661
253 H LEU 45 H LEU 45 1.315 0.425 7.896
254 HA LEU 45 HA LEU 45 1.839 -1.300 10.043
255 HB3 LEU 45 2HB LEU 45 -0.356 -2.292 9.533
256 HG LEU 45 HG LEU 45 -0.391 0.714 9.268
257 HD11 LEU 45 1HD1 LEU 45 -2.699 0.626 9.877
258 HD12 LEU 45 2HD1 LEU 45 -2.634 -1.124 10.083
259 HD13 LEU 45 3HD1 LEU 45 -2.466 -0.418 8.475
260 HD21 LEU 45 3HD2 LEU 45 0.226 -1.026 11.442
261 HD22 LEU 45 1HD2 LEU 45 -1.295 -0.200 11.781
262 HD23 LEU 45 2HD2 LEU 45 0.155 0.736 11.417
263 H LEU 46 H LEU 46 1.623 -1.930 6.561
264 HA LEU 46 HA LEU 46 1.848 -4.692 6.583
265 HB3 LEU 46 2HB LEU 46 2.783 -4.478 4.322
266 HG LEU 46 HG LEU 46 0.526 -2.555 4.859
267 HD11 LEU 46 1HD1 LEU 46 0.150 -2.361 2.554
268 HD12 LEU 46 2HD1 LEU 46 1.287 -3.653 2.171
269 HD13 LEU 46 3HD1 LEU 46 1.883 -2.099 2.753
270 HD21 LEU 46 3HD2 LEU 46 -0.870 -4.302 4.629
271 HD22 LEU 46 1HD2 LEU 46 0.546 -5.253 5.074
272 HD23 LEU 46 2HD2 LEU 46 0.114 -5.059 3.375
273 H SER 47 H SER 47 4.275 -2.252 7.117
274 HA SER 47 HA SER 47 6.435 -4.208 7.008
275 HB3 SER 47 2HB SER 47 7.163 -1.547 7.958
276 HG SER 47 HG SER 47 8.756 -1.861 6.544
277 H SER 48 H SER 48 4.399 -4.467 9.045
278 HA SER 48 HA SER 48 5.961 -3.889 11.474
279 HB3 SER 48 2HB SER 48 2.992 -4.417 11.184
280 HG SER 48 HG SER 48 4.650 -4.455 13.333
281 H SER 49 H SER 49 6.376 -6.145 9.658
282 HA SER 49 HA SER 49 6.465 -8.445 9.623
283 HB3 SER 49 2HB SER 49 7.220 -9.217 12.081
284 HG SER 49 HG SER 49 9.049 -7.533 10.838
285 H SER 50 H SER 50 3.816 -7.291 10.333
286 HA SER 50 HA SER 50 2.262 -9.473 10.600
287 HB3 SER 50 2HB SER 50 2.968 -10.307 12.619
288 HG SER 50 HG SER 50 3.265 -8.278 14.274
289 HA PRO 51 HA PRO 51 0.272 -5.238 10.506
290 HB3 PRO 51 2HB PRO 51 0.872 -4.854 8.321
291 HG3 PRO 51 2HG PRO 51 1.394 -6.614 6.894
292 HD3 PRO 51 2HD PRO 51 2.725 -7.157 8.697
293 H LYS 52 H LYS 52 -1.604 -5.226 11.558
294 HA LYS 52 HA LYS 52 -3.602 -7.292 10.908
295 HB3 LYS 52 2HB LYS 52 -4.327 -7.295 13.145
296 HG3 LYS 52 2HG LYS 52 -1.366 -7.143 12.934
297 HD3 LYS 52 2HD LYS 52 -2.682 -7.733 15.561
298 HE3 LYS 52 2HE LYS 52 0.099 -6.923 14.720
299 HZ1 LYS 52 3HZ LYS 52 -1.194 -6.827 17.278
300 HZ2 LYS 52 1HZ LYS 52 0.290 -6.176 16.793
301 HZ3 LYS 52 2HZ LYS 52 0.198 -7.789 17.291
302 H CYS 53 H CYS 53 -3.684 -4.131 12.551
303 HA CYS 53 HA CYS 53 -4.843 -2.508 10.760
304 HB3 CYS 53 2HB CYS 53 -6.843 -4.509 11.735
305 H THR 54 H THR 54 -4.033 -0.920 12.047
306 HA THR 54 HA THR 54 -3.929 -0.514 14.669
307 HB THR 54 HB THR 54 -4.054 1.239 12.420
308 HG1 THR 54 1HG THR 54 -3.199 2.362 14.752
309 HG21 THR 54 3HG2 THR 54 -5.550 2.227 14.851
310 HG22 THR 54 1HG2 THR 54 -6.208 2.005 13.230
311 HG23 THR 54 2HG2 THR 54 -4.990 3.244 13.525
312 H ALA 55 H ALA 55 -6.885 -0.072 12.764
313 HA ALA 55 HA ALA 55 -8.575 0.960 14.681
314 HB1 ALA 55 3HB ALA 55 -10.099 0.710 13.082
315 HB2 ALA 55 1HB ALA 55 -8.851 -0.079 12.116
316 HB3 ALA 55 2HB ALA 55 -9.938 -1.046 13.114
317 H CYS 56 H CYS 56 -8.875 -2.457 13.776
318 HA CYS 56 HA CYS 56 -9.287 -3.082 16.626
319 HB3 CYS 56 2HB CYS 56 -11.293 -3.450 15.294
320 H GLN 57 H GLN 57 -7.558 -3.903 13.723
321 HA GLN 57 HA GLN 57 -5.542 -5.004 13.538
322 HB3 GLN 57 2HB GLN 57 -4.397 -5.842 15.391
323 HG3 GLN 57 2HG GLN 57 -5.804 -4.300 17.320
324 HE21 GLN 57 1HE2 GLN 57 -3.818 -2.822 14.871
325 HE22 GLN 57 2HE2 GLN 57 -2.368 -2.750 15.806
326 H GLU 58 H GLU 58 -6.232 -6.377 11.966
327 HA GLU 58 HA GLU 58 -7.080 -9.042 12.859
328 HB3 GLU 58 2HB GLU 58 -8.302 -8.616 10.360
329 HG3 GLU 58 2HG GLU 58 -10.394 -8.391 12.000
330 H SER 59 H SER 59 -6.271 -7.298 9.851
331 HA SER 59 HA SER 59 -3.837 -8.537 9.363
332 HB3 SER 59 2HB SER 59 -5.291 -9.911 7.348
333 HG SER 59 HG SER 59 -3.503 -10.901 7.963
334 H ILE 60 H ILE 60 -2.854 -7.340 7.870
335 HA ILE 60 HA ILE 60 -4.507 -6.014 5.823
336 HB ILE 60 HB ILE 60 -2.043 -4.638 6.733
337 HG13 ILE 60 2HG1 ILE 60 -3.226 -5.387 8.831
338 HG21 ILE 60 1HG2 ILE 60 -4.389 -3.015 6.518
339 HG22 ILE 60 2HG2 ILE 60 -2.934 -3.006 5.523
340 HG23 ILE 60 3HG2 ILE 60 -4.274 -4.078 5.116
341 HD11 ILE 60 3HD1 ILE 60 -1.981 -3.085 8.468
342 HD12 ILE 60 1HD1 ILE 60 -3.602 -2.451 8.753
343 HD13 ILE 60 2HD1 ILE 60 -2.825 -3.468 9.968
344 H VAL 61 H VAL 61 -4.001 -7.051 3.993
345 HA VAL 61 HA VAL 61 -1.146 -7.303 3.311
346 HB VAL 61 HB VAL 61 -3.339 -9.288 2.697
347 HG11 VAL 61 1HG1 VAL 61 -2.174 -9.878 0.902
348 HG12 VAL 61 2HG1 VAL 61 -0.915 -8.699 1.278
349 HG13 VAL 61 3HG1 VAL 61 -0.837 -10.324 1.963
350 HG21 VAL 61 3HG2 VAL 61 -1.636 -10.806 3.901
351 HG22 VAL 61 1HG2 VAL 61 -0.962 -9.299 4.522
352 HG23 VAL 61 2HG2 VAL 61 -2.637 -9.728 4.873
353 H LYS 62 H LYS 62 -0.624 -6.175 1.568
354 HA LYS 62 HA LYS 62 -2.214 -4.575 0.066
355 HB3 LYS 62 2HB LYS 62 0.151 -4.405 -0.168
356 HG3 LYS 62 2HG LYS 62 0.533 -6.796 -1.832
357 HD3 LYS 62 2HD LYS 62 2.133 -4.891 -0.662
358 HE3 LYS 62 2HE LYS 62 3.061 -7.314 0.717
359 HZ1 LYS 62 3HZ LYS 62 4.250 -5.788 1.770
360 HZ2 LYS 62 1HZ LYS 62 2.865 -4.958 2.276
361 HZ3 LYS 62 2HZ LYS 62 3.567 -4.600 0.780
362 H ASP 63 H ASP 63 -1.328 -7.915 -0.791
363 HA ASP 63 HA ASP 63 -2.768 -8.094 -3.167
364 HB3 ASP 63 2HB ASP 63 -2.365 -10.360 -1.210
365 H LYS 64 H LYS 64 -3.790 -8.724 0.161
366 HA LYS 64 HA LYS 64 -6.486 -9.381 -0.693
367 HB3 LYS 64 2HB LYS 64 -6.916 -9.961 1.562
368 HG3 LYS 64 2HG LYS 64 -4.928 -11.271 2.320
369 HD3 LYS 64 2HD LYS 64 -5.324 -11.728 -0.611
370 HE3 LYS 64 2HE LYS 64 -3.974 -13.313 0.685
371 HZ1 LYS 64 3HZ LYS 64 -5.194 -14.726 2.318
372 HZ2 LYS 64 1HZ LYS 64 -6.438 -13.580 2.312
373 HZ3 LYS 64 2HZ LYS 64 -4.893 -13.147 2.847
374 H VAL 65 H VAL 65 -4.812 -6.582 -0.254
375 HA VAL 65 HA VAL 65 -6.956 -5.066 0.995
376 HB VAL 65 HB VAL 65 -4.138 -4.674 0.600
377 HG11 VAL 65 1HG1 VAL 65 -5.883 -2.382 -0.293
378 HG12 VAL 65 2HG1 VAL 65 -4.144 -2.304 -0.006
379 HG13 VAL 65 3HG1 VAL 65 -4.780 -3.304 -1.312
380 HG21 VAL 65 3HG2 VAL 65 -4.846 -4.363 2.757
381 HG22 VAL 65 1HG2 VAL 65 -4.797 -2.689 2.206
382 HG23 VAL 65 2HG2 VAL 65 -6.333 -3.551 2.269
383 H PHE 66 H PHE 66 -8.057 -3.347 -0.015
384 HA PHE 66 HA PHE 66 -8.147 -3.558 -2.952
385 HB3 PHE 66 2HB PHE 66 -10.475 -2.800 -2.805
386 HD1 PHE 66 1HD PHE 66 -10.209 -4.668 0.336
387 HD2 PHE 66 2HD PHE 66 -10.738 -4.927 -3.880
388 HE1 PHE 66 1HE PHE 66 -10.915 -7.013 0.572
389 HE2 PHE 66 2HE PHE 66 -11.447 -7.273 -3.649
390 HZ PHE 66 HZ PHE 66 -11.536 -8.318 -1.421
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -39.176 29.672 11.103
2 HA2 GLY 1 1HA GLY 1 -41.412 27.970 11.958
3 HA3 GLY 1 2HA GLY 1 -40.485 27.494 10.543
4 H SER 2 H SER 2 -38.939 26.066 10.915
5 HA SER 2 HA SER 2 -37.326 24.836 11.945
6 HB3 SER 2 2HB SER 2 -37.074 27.489 13.294
7 HG SER 2 HG SER 2 -35.287 26.570 14.492
8 H SER 3 H SER 3 -36.676 23.932 14.193
9 HA SER 3 HA SER 3 -39.049 23.721 15.916
10 HB3 SER 3 2HB SER 3 -37.607 21.226 15.860
11 HG SER 3 HG SER 3 -40.226 21.909 14.998
12 H GLY 4 H GLY 4 -38.619 23.098 18.105
13 HA2 GLY 4 1HA GLY 4 -35.884 23.821 18.935
14 HA3 GLY 4 2HA GLY 4 -37.325 24.030 19.918
15 H SER 5 H SER 5 -37.610 21.109 18.414
16 HA SER 5 HA SER 5 -36.900 19.700 20.850
17 HB3 SER 5 2HB SER 5 -38.736 18.559 20.241
18 HG SER 5 HG SER 5 -39.850 19.296 18.615
19 H SER 6 H SER 6 -36.056 17.303 20.235
20 HA SER 6 HA SER 6 -34.044 17.222 18.204
21 HB3 SER 6 2HB SER 6 -32.703 16.856 20.786
22 HG SER 6 HG SER 6 -31.325 18.483 19.521
23 H GLY 7 H GLY 7 -33.135 15.155 17.944
24 HA2 GLY 7 1HA GLY 7 -33.236 13.015 19.685
25 HA3 GLY 7 2HA GLY 7 -34.788 13.018 18.860
26 H PHE 8 H PHE 8 -34.910 11.871 17.054
27 HA PHE 8 HA PHE 8 -33.116 10.196 16.014
28 HB3 PHE 8 2HB PHE 8 -34.557 11.672 13.896
29 HD1 PHE 8 1HD PHE 8 -35.088 8.527 15.827
30 HD2 PHE 8 2HD PHE 8 -34.096 10.320 12.096
31 HE1 PHE 8 1HE PHE 8 -35.047 6.304 14.773
32 HE2 PHE 8 2HE PHE 8 -34.055 8.100 11.036
33 HZ PHE 8 HZ PHE 8 -34.533 6.089 12.374
34 H VAL 9 H VAL 9 -30.991 10.727 15.901
35 HA VAL 9 HA VAL 9 -30.181 13.112 14.423
36 HB VAL 9 HB VAL 9 -29.104 12.636 16.597
37 HG11 VAL 9 1HG1 VAL 9 -27.979 10.725 17.094
38 HG12 VAL 9 2HG1 VAL 9 -29.138 10.056 15.943
39 HG13 VAL 9 3HG1 VAL 9 -27.497 10.442 15.421
40 HG21 VAL 9 3HG2 VAL 9 -27.055 12.349 14.420
41 HG22 VAL 9 1HG2 VAL 9 -27.981 13.833 14.638
42 HG23 VAL 9 2HG2 VAL 9 -26.938 13.247 15.933
43 H LYS 10 H LYS 10 -29.754 12.991 12.331
44 HA LYS 10 HA LYS 10 -29.267 10.401 11.092
45 HB3 LYS 10 2HB LYS 10 -29.159 12.465 9.161
46 HG3 LYS 10 2HG LYS 10 -31.780 11.231 9.545
47 HD3 LYS 10 2HD LYS 10 -29.938 10.683 7.268
48 HE3 LYS 10 2HE LYS 10 -32.854 11.437 7.445
49 HZ1 LYS 10 3HZ LYS 10 -32.991 11.139 5.202
50 HZ2 LYS 10 1HZ LYS 10 -31.634 10.133 5.121
51 HZ3 LYS 10 2HZ LYS 10 -31.438 11.804 5.298
52 H THR 11 H THR 11 -27.428 9.853 9.963
53 HA THR 11 HA THR 11 -25.150 11.709 10.197
54 HB THR 11 HB THR 11 -24.499 8.833 10.163
55 HG1 THR 11 1HG THR 11 -26.414 9.188 11.638
56 HG21 THR 11 3HG2 THR 11 -23.540 11.324 11.520
57 HG22 THR 11 1HG2 THR 11 -22.659 10.210 10.474
58 HG23 THR 11 2HG2 THR 11 -23.053 9.742 12.128
59 H VAL 12 H VAL 12 -24.012 12.064 8.388
60 HA VAL 12 HA VAL 12 -24.466 10.275 6.090
61 HB VAL 12 HB VAL 12 -25.690 12.305 5.661
62 HG11 VAL 12 1HG1 VAL 12 -23.598 13.527 7.104
63 HG12 VAL 12 2HG1 VAL 12 -23.594 14.236 5.487
64 HG13 VAL 12 3HG1 VAL 12 -25.062 14.276 6.465
65 HG21 VAL 12 3HG2 VAL 12 -24.623 11.364 3.732
66 HG22 VAL 12 1HG2 VAL 12 -24.493 13.120 3.630
67 HG23 VAL 12 2HG2 VAL 12 -23.099 12.160 4.126
68 H GLU 13 H GLU 13 -22.641 9.283 5.565
69 HA GLU 13 HA GLU 13 -20.079 10.558 6.177
70 HB3 GLU 13 2HB GLU 13 -19.341 8.135 5.318
71 HG3 GLU 13 2HG GLU 13 -20.332 8.973 8.000
72 H ASP 14 H ASP 14 -18.736 11.302 4.653
73 HA ASP 14 HA ASP 14 -19.388 10.717 1.838
74 HB3 ASP 14 2HB ASP 14 -18.093 13.104 1.685
75 H LYS 15 H LYS 15 -17.839 9.690 0.777
76 HA LYS 15 HA LYS 15 -15.804 8.909 0.129
77 HB3 LYS 15 2HB LYS 15 -13.952 10.351 0.185
78 HG3 LYS 15 2HG LYS 15 -16.505 11.564 -0.241
79 HD3 LYS 15 2HD LYS 15 -15.414 12.980 1.706
80 HE3 LYS 15 2HE LYS 15 -13.281 13.202 0.329
81 HZ1 LYS 15 3HZ LYS 15 -14.536 15.473 -1.011
82 HZ2 LYS 15 1HZ LYS 15 -14.798 13.941 -1.679
83 HZ3 LYS 15 2HZ LYS 15 -13.222 14.523 -1.494
84 H TYR 16 H TYR 16 -13.650 8.097 1.020
85 HA TYR 16 HA TYR 16 -14.196 6.828 3.584
86 HB3 TYR 16 2HB TYR 16 -12.385 5.318 3.030
87 HD1 TYR 16 2HD TYR 16 -13.317 6.456 -0.350
88 HD2 TYR 16 1HD TYR 16 -14.189 3.761 2.825
89 HE1 TYR 16 2HE TYR 16 -14.793 5.180 -1.847
90 HE2 TYR 16 1HE TYR 16 -15.666 2.477 1.337
91 HH TYR 16 HH TYR 16 -16.599 3.636 -1.775
92 H LYS 17 H LYS 17 -12.222 6.481 5.030
93 HA LYS 17 HA LYS 17 -10.329 8.681 5.046
94 HB3 LYS 17 2HB LYS 17 -12.545 8.383 7.033
95 HG3 LYS 17 2HG LYS 17 -10.826 10.208 8.186
96 HD3 LYS 17 2HD LYS 17 -10.460 8.062 9.758
97 HE3 LYS 17 2HE LYS 17 -12.402 10.160 9.521
98 HZ1 LYS 17 3HZ LYS 17 -13.615 7.690 9.640
99 HZ2 LYS 17 1HZ LYS 17 -14.325 9.188 9.974
100 HZ3 LYS 17 2HZ LYS 17 -13.653 8.272 11.228
101 H CYS 18 H CYS 18 -8.447 8.200 6.101
102 HA CYS 18 HA CYS 18 -7.836 5.492 6.569
103 HB3 CYS 18 2HB CYS 18 -6.373 8.036 7.273
104 H GLU 19 H GLU 19 -7.635 4.292 8.412
105 HA GLU 19 HA GLU 19 -9.074 5.262 10.731
106 HB3 GLU 19 2HB GLU 19 -8.190 2.780 11.432
107 HG3 GLU 19 2HG GLU 19 -10.308 1.937 10.927
108 H LYS 20 H LYS 20 -6.420 6.373 10.032
109 HA LYS 20 HA LYS 20 -5.133 5.890 12.628
110 HB3 LYS 20 2HB LYS 20 -3.154 6.535 10.645
111 HG3 LYS 20 2HG LYS 20 -3.630 4.242 12.507
112 HD3 LYS 20 2HD LYS 20 -1.280 4.509 10.634
113 HE3 LYS 20 2HE LYS 20 -0.331 2.784 11.720
114 HZ1 LYS 20 3HZ LYS 20 -0.977 4.326 13.535
115 HZ2 LYS 20 1HZ LYS 20 -0.774 2.724 14.042
116 HZ3 LYS 20 2HZ LYS 20 -2.329 3.355 13.838
117 H CYS 21 H CYS 21 -4.733 7.957 9.743
118 HA CYS 21 HA CYS 21 -4.373 10.259 11.523
119 HB3 CYS 21 2HB CYS 21 -2.587 10.050 9.954
120 H HIS 22 H HIS 22 -6.861 8.774 10.101
121 HA HIS 22 HA HIS 22 -8.973 9.372 9.501
122 HB3 HIS 22 2HB HIS 22 -9.864 10.849 10.933
123 HD2 HIS 22 2HD HIS 22 -7.731 9.113 12.523
124 HE1 HIS 22 1HE HIS 22 -6.438 12.761 14.260
125 HE2 HIS 22 2HE HIS 22 -6.351 10.248 14.394
126 H LEU 23 H LEU 23 -6.634 9.919 7.722
127 HA LEU 23 HA LEU 23 -7.153 12.294 6.255
128 HB3 LEU 23 2HB LEU 23 -5.885 10.728 4.460
129 HG LEU 23 HG LEU 23 -3.689 11.309 5.867
130 HD11 LEU 23 1HD1 LEU 23 -3.745 13.535 4.771
131 HD12 LEU 23 2HD1 LEU 23 -5.431 13.241 4.347
132 HD13 LEU 23 3HD1 LEU 23 -4.165 12.204 3.692
133 HD21 LEU 23 3HD2 LEU 23 -3.915 12.890 7.482
134 HD22 LEU 23 1HD2 LEU 23 -5.456 12.065 7.708
135 HD23 LEU 23 2HD2 LEU 23 -5.387 13.562 6.778
136 H VAL 24 H VAL 24 -8.893 12.681 5.071
137 HA VAL 24 HA VAL 24 -10.704 10.649 4.245
138 HB VAL 24 HB VAL 24 -10.534 13.560 3.459
139 HG11 VAL 24 1HG1 VAL 24 -12.757 13.343 2.560
140 HG12 VAL 24 2HG1 VAL 24 -11.701 12.171 1.769
141 HG13 VAL 24 3HG1 VAL 24 -12.821 11.644 3.027
142 HG21 VAL 24 3HG2 VAL 24 -12.815 12.979 5.012
143 HG22 VAL 24 1HG2 VAL 24 -11.440 12.220 5.815
144 HG23 VAL 24 2HG2 VAL 24 -11.413 13.948 5.463
145 H LEU 25 H LEU 25 -10.481 9.331 2.573
146 HA LEU 25 HA LEU 25 -9.113 10.323 0.163
147 HB3 LEU 25 2HB LEU 25 -7.563 8.758 0.348
148 HG LEU 25 HG LEU 25 -8.972 8.114 2.880
149 HD11 LEU 25 1HD1 LEU 25 -6.672 6.385 2.238
150 HD12 LEU 25 2HD1 LEU 25 -8.194 5.985 1.444
151 HD13 LEU 25 3HD1 LEU 25 -8.109 6.056 3.204
152 HD21 LEU 25 3HD2 LEU 25 -6.142 8.791 2.095
153 HD22 LEU 25 1HD2 LEU 25 -6.656 8.426 3.743
154 HD23 LEU 25 2HD2 LEU 25 -7.310 9.836 2.908
155 H CYS 26 H CYS 26 -9.636 8.969 -1.793
156 HA CYS 26 HA CYS 26 -12.515 8.430 -1.802
157 HB3 CYS 26 2HB CYS 26 -12.561 9.128 -3.969
158 H SER 27 H SER 27 -9.415 6.939 -2.501
159 HA SER 27 HA SER 27 -10.786 4.343 -2.708
160 HB3 SER 27 2HB SER 27 -8.613 5.458 -4.470
161 HG SER 27 HG SER 27 -8.748 3.123 -5.271
162 HA PRO 28 HA PRO 28 -7.651 4.220 0.679
163 HB3 PRO 28 2HB PRO 28 -9.296 4.524 2.254
164 HG3 PRO 28 2HG PRO 28 -11.510 3.981 1.796
165 HD3 PRO 28 2HD PRO 28 -11.021 5.250 -0.065
166 H LYS 29 H LYS 29 -7.507 1.940 2.162
167 HA LYS 29 HA LYS 29 -7.398 -0.283 0.250
168 HB3 LYS 29 2HB LYS 29 -5.166 -0.526 0.341
169 HG3 LYS 29 2HG LYS 29 -3.827 1.459 1.088
170 HD3 LYS 29 2HD LYS 29 -5.696 2.879 -0.519
171 HE3 LYS 29 2HE LYS 29 -3.146 1.388 -1.108
172 HZ1 LYS 29 3HZ LYS 29 -3.067 2.500 -3.185
173 HZ2 LYS 29 1HZ LYS 29 -4.469 3.387 -2.853
174 HZ3 LYS 29 2HZ LYS 29 -4.565 1.718 -3.112
175 H GLN 30 H GLN 30 -9.167 -1.211 1.320
176 HA GLN 30 HA GLN 30 -9.581 -1.549 4.007
177 HB3 GLN 30 2HB GLN 30 -10.298 -4.001 2.754
178 HG3 GLN 30 2HG GLN 30 -11.879 -1.524 3.382
179 HE21 GLN 30 1HE2 GLN 30 -13.002 -4.716 3.928
180 HE22 GLN 30 2HE2 GLN 30 -14.241 -4.725 2.723
181 H THR 31 H THR 31 -9.545 -3.884 5.053
182 HA THR 31 HA THR 31 -6.898 -5.092 4.650
183 HB THR 31 HB THR 31 -6.294 -5.015 6.900
184 HG1 THR 31 1HG THR 31 -9.024 -4.907 7.302
185 HG21 THR 31 3HG2 THR 31 -6.722 -2.678 5.625
186 HG22 THR 31 1HG2 THR 31 -6.007 -2.792 7.233
187 HG23 THR 31 2HG2 THR 31 -7.726 -2.436 7.055
188 H GLU 32 H GLU 32 -9.963 -5.684 4.348
189 HA GLU 32 HA GLU 32 -11.049 -7.705 4.125
190 HB3 GLU 32 2HB GLU 32 -9.341 -9.241 5.965
191 HG3 GLU 32 2HG GLU 32 -9.501 -9.966 3.128
192 H CYS 33 H CYS 33 -10.584 -5.842 6.732
193 HA CYS 33 HA CYS 33 -12.388 -7.421 8.445
194 HB3 CYS 33 2HB CYS 33 -10.103 -6.781 9.357
195 H GLY 34 H GLY 34 -11.921 -4.427 6.754
196 HA2 GLY 34 1HA GLY 34 -14.179 -3.461 6.116
197 HA3 GLY 34 2HA GLY 34 -14.470 -3.416 7.849
198 H HIS 35 H HIS 35 -12.027 -2.509 8.776
199 HA HIS 35 HA HIS 35 -12.275 0.261 8.459
200 HB3 HIS 35 2HB HIS 35 -10.106 0.392 9.661
201 HD2 HIS 35 2HD HIS 35 -12.191 1.156 11.469
202 HE1 HIS 35 1HE HIS 35 -12.494 -2.700 13.212
203 HE2 HIS 35 2HE HIS 35 -13.196 -0.287 13.366
204 H ARG 36 H ARG 36 -10.533 1.742 7.699
205 HA ARG 36 HA ARG 36 -9.099 0.689 5.360
206 HB3 ARG 36 2HB ARG 36 -9.684 2.980 4.289
207 HG3 ARG 36 2HG ARG 36 -11.398 0.579 4.475
208 HD3 ARG 36 2HD ARG 36 -12.528 2.473 2.626
209 HE ARG 36 HE ARG 36 -14.042 0.835 3.208
210 HH11 ARG 36 1HH1 ARG 36 -12.935 2.503 6.056
211 HH12 ARG 36 2HH1 ARG 36 -14.132 1.800 7.092
212 HH21 ARG 36 1HH2 ARG 36 -15.622 -0.098 4.562
213 HH22 ARG 36 2HH2 ARG 36 -15.659 0.319 6.242
214 H PHE 37 H PHE 37 -7.385 2.183 4.588
215 HA PHE 37 HA PHE 37 -6.410 4.089 6.563
216 HB3 PHE 37 2HB PHE 37 -4.093 2.976 6.359
217 HD1 PHE 37 2HD PHE 37 -6.482 0.350 7.279
218 HD2 PHE 37 1HD PHE 37 -4.158 3.639 8.656
219 HE1 PHE 37 2HE PHE 37 -6.900 -0.333 9.606
220 HE2 PHE 37 1HE PHE 37 -4.571 2.959 10.985
221 HZ PHE 37 HZ PHE 37 -5.944 0.972 11.463
222 H CYS 38 H CYS 38 -4.348 5.164 5.734
223 HA CYS 38 HA CYS 38 -4.782 5.832 2.927
224 HB3 CYS 38 2HB CYS 38 -4.625 7.617 4.687
225 H GLU 39 H GLU 39 -2.996 6.029 1.447
226 HA GLU 39 HA GLU 39 -1.491 3.845 1.018
227 HB3 GLU 39 2HB GLU 39 0.264 5.606 0.051
228 HG3 GLU 39 2HG GLU 39 -2.438 5.669 -1.213
229 H SER 40 H SER 40 -0.432 6.634 2.948
230 HA SER 40 HA SER 40 2.117 5.660 3.593
231 HB3 SER 40 2HB SER 40 1.659 7.204 5.714
232 HG SER 40 HG SER 40 1.621 8.792 3.507
233 H CYS 41 H CYS 41 -0.225 6.127 6.179
234 HA CYS 41 HA CYS 41 0.648 4.412 8.018
235 HB3 CYS 41 2HB CYS 41 -1.701 4.033 8.739
236 H MET 42 H MET 42 -1.156 3.458 5.140
237 HA MET 42 HA MET 42 -1.531 0.756 5.766
238 HB3 MET 42 2HB MET 42 -1.238 2.165 3.113
239 HG3 MET 42 2HG MET 42 -0.695 -0.211 2.817
240 HE1 MET 42 3HE MET 42 -4.288 0.456 3.984
241 HE2 MET 42 1HE MET 42 -4.656 -0.929 5.011
242 HE3 MET 42 2HE MET 42 -3.460 0.259 5.529
243 H ALA 43 H ALA 43 1.012 2.237 3.748
244 HA ALA 43 HA ALA 43 2.511 -0.093 3.354
245 HB1 ALA 43 3HB ALA 43 2.827 2.733 2.855
246 HB2 ALA 43 1HB ALA 43 4.351 1.994 3.349
247 HB3 ALA 43 2HB ALA 43 3.467 1.353 1.962
248 H ALA 44 H ALA 44 2.342 2.091 6.054
249 HA ALA 44 HA ALA 44 4.783 1.327 7.298
250 HB1 ALA 44 3HB ALA 44 3.243 2.212 9.357
251 HB2 ALA 44 1HB ALA 44 4.181 3.248 8.282
252 HB3 ALA 44 2HB ALA 44 2.464 2.984 7.977
253 H LEU 45 H LEU 45 1.396 0.527 8.098
254 HA LEU 45 HA LEU 45 1.912 -1.339 10.083
255 HB3 LEU 45 2HB LEU 45 -0.321 -2.242 9.596
256 HG LEU 45 HG LEU 45 -0.216 0.768 9.459
257 HD11 LEU 45 1HD1 LEU 45 -2.391 -0.861 8.840
258 HD12 LEU 45 2HD1 LEU 45 -2.421 0.858 9.230
259 HD13 LEU 45 3HD1 LEU 45 -2.661 -0.339 10.503
260 HD21 LEU 45 3HD2 LEU 45 -1.192 -0.666 11.839
261 HD22 LEU 45 1HD2 LEU 45 -0.175 0.770 11.711
262 HD23 LEU 45 2HD2 LEU 45 0.531 -0.832 11.497
263 H LEU 46 H LEU 46 1.561 -1.843 6.587
264 HA LEU 46 HA LEU 46 1.709 -4.596 6.482
265 HB3 LEU 46 2HB LEU 46 2.744 -4.269 4.228
266 HG LEU 46 HG LEU 46 0.371 -2.492 4.788
267 HD11 LEU 46 1HD1 LEU 46 1.834 -3.150 2.291
268 HD12 LEU 46 2HD1 LEU 46 0.987 -1.674 2.755
269 HD13 LEU 46 3HD1 LEU 46 0.072 -3.086 2.229
270 HD21 LEU 46 3HD2 LEU 46 -0.027 -4.825 5.324
271 HD22 LEU 46 1HD2 LEU 46 0.588 -5.314 3.745
272 HD23 LEU 46 2HD2 LEU 46 -0.902 -4.379 3.858
273 H SER 47 H SER 47 4.296 -2.256 6.900
274 HA SER 47 HA SER 47 6.335 -4.325 6.787
275 HB3 SER 47 2HB SER 47 7.027 -1.573 7.669
276 HG SER 47 HG SER 47 8.291 -2.533 5.494
277 H SER 48 H SER 48 4.340 -4.476 8.875
278 HA SER 48 HA SER 48 5.953 -3.926 11.272
279 HB3 SER 48 2HB SER 48 2.985 -4.467 11.011
280 HG SER 48 HG SER 48 2.894 -4.170 13.184
281 H SER 49 H SER 49 6.321 -6.192 9.430
282 HA SER 49 HA SER 49 6.460 -8.483 9.408
283 HB3 SER 49 2HB SER 49 7.440 -9.379 11.564
284 HG SER 49 HG SER 49 8.462 -7.136 10.213
285 H SER 50 H SER 50 3.805 -7.327 10.168
286 HA SER 50 HA SER 50 2.251 -9.512 10.401
287 HB3 SER 50 2HB SER 50 1.804 -9.163 13.074
288 HG SER 50 HG SER 50 2.132 -11.213 12.828
289 HA PRO 51 HA PRO 51 0.270 -5.271 10.450
290 HB3 PRO 51 2HB PRO 51 0.849 -4.822 8.272
291 HG3 PRO 51 2HG PRO 51 1.353 -6.538 6.787
292 HD3 PRO 51 2HD PRO 51 2.701 -7.138 8.559
293 H LYS 52 H LYS 52 -1.599 -5.283 11.514
294 HA LYS 52 HA LYS 52 -3.589 -7.355 10.860
295 HB3 LYS 52 2HB LYS 52 -4.263 -7.416 13.083
296 HG3 LYS 52 2HG LYS 52 -1.324 -6.873 13.009
297 HD3 LYS 52 2HD LYS 52 -2.789 -7.785 15.473
298 HE3 LYS 52 2HE LYS 52 -0.417 -6.611 16.194
299 HZ1 LYS 52 3HZ LYS 52 -0.155 -9.414 15.595
300 HZ2 LYS 52 1HZ LYS 52 -1.565 -9.041 16.453
301 HZ3 LYS 52 2HZ LYS 52 -0.055 -8.611 17.081
302 H CYS 53 H CYS 53 -3.711 -4.176 12.466
303 HA CYS 53 HA CYS 53 -4.875 -2.581 10.657
304 HB3 CYS 53 2HB CYS 53 -6.864 -4.596 11.629
305 H THR 54 H THR 54 -4.076 -0.990 11.953
306 HA THR 54 HA THR 54 -4.016 -0.566 14.571
307 HB THR 54 HB THR 54 -4.145 1.180 12.308
308 HG1 THR 54 1HG THR 54 -2.453 0.848 13.971
309 HG21 THR 54 3HG2 THR 54 -5.082 3.178 13.379
310 HG22 THR 54 1HG2 THR 54 -5.571 2.207 14.766
311 HG23 THR 54 2HG2 THR 54 -6.303 1.921 13.186
312 H ALA 55 H ALA 55 -6.946 -0.149 12.622
313 HA ALA 55 HA ALA 55 -8.668 0.884 14.511
314 HB1 ALA 55 3HB ALA 55 -10.157 0.632 12.881
315 HB2 ALA 55 1HB ALA 55 -8.900 -0.180 11.945
316 HB3 ALA 55 2HB ALA 55 -10.011 -1.125 12.938
317 H CYS 56 H CYS 56 -8.954 -2.535 13.612
318 HA CYS 56 HA CYS 56 -9.391 -3.154 16.459
319 HB3 CYS 56 2HB CYS 56 -11.387 -3.520 15.110
320 H GLN 57 H GLN 57 -7.621 -3.959 13.583
321 HA GLN 57 HA GLN 57 -5.603 -5.062 13.425
322 HB3 GLN 57 2HB GLN 57 -4.490 -5.906 15.289
323 HG3 GLN 57 2HG GLN 57 -5.926 -4.436 17.235
324 HE21 GLN 57 1HE2 GLN 57 -3.731 -3.587 14.575
325 HE22 GLN 57 2HE2 GLN 57 -2.384 -3.200 15.585
326 H GLU 58 H GLU 58 -6.259 -6.416 11.825
327 HA GLU 58 HA GLU 58 -7.179 -9.075 12.673
328 HB3 GLU 58 2HB GLU 58 -8.256 -8.694 10.128
329 HG3 GLU 58 2HG GLU 58 -10.418 -8.259 11.627
330 H SER 59 H SER 59 -6.235 -7.417 9.658
331 HA SER 59 HA SER 59 -3.758 -8.604 9.314
332 HB3 SER 59 2HB SER 59 -5.058 -10.155 7.338
333 HG SER 59 HG SER 59 -3.391 -11.196 8.091
334 H ILE 60 H ILE 60 -2.925 -7.057 8.088
335 HA ILE 60 HA ILE 60 -4.519 -6.000 5.852
336 HB ILE 60 HB ILE 60 -2.041 -4.597 6.649
337 HG13 ILE 60 2HG1 ILE 60 -3.114 -5.313 8.818
338 HG21 ILE 60 1HG2 ILE 60 -3.821 -2.683 6.460
339 HG22 ILE 60 2HG2 ILE 60 -3.181 -3.461 5.013
340 HG23 ILE 60 3HG2 ILE 60 -4.762 -3.927 5.639
341 HD11 ILE 60 3HD1 ILE 60 -2.079 -2.841 8.172
342 HD12 ILE 60 1HD1 ILE 60 -3.600 -2.467 8.984
343 HD13 ILE 60 2HD1 ILE 60 -2.388 -3.461 9.794
344 H VAL 61 H VAL 61 -4.028 -6.937 3.982
345 HA VAL 61 HA VAL 61 -1.186 -7.305 3.312
346 HB VAL 61 HB VAL 61 -3.401 -9.235 2.607
347 HG11 VAL 61 1HG1 VAL 61 -2.058 -9.813 0.926
348 HG12 VAL 61 2HG1 VAL 61 -0.751 -8.789 1.523
349 HG13 VAL 61 3HG1 VAL 61 -0.943 -10.429 2.144
350 HG21 VAL 61 3HG2 VAL 61 -1.659 -10.706 4.011
351 HG22 VAL 61 1HG2 VAL 61 -1.419 -9.145 4.798
352 HG23 VAL 61 2HG2 VAL 61 -3.026 -9.872 4.750
353 H LYS 62 H LYS 62 -0.672 -6.115 1.609
354 HA LYS 62 HA LYS 62 -2.247 -4.537 0.084
355 HB3 LYS 62 2HB LYS 62 0.109 -4.343 -0.143
356 HG3 LYS 62 2HG LYS 62 0.531 -6.776 -1.743
357 HD3 LYS 62 2HD LYS 62 2.457 -6.509 0.252
358 HE3 LYS 62 2HE LYS 62 2.422 -6.743 -2.429
359 HZ1 LYS 62 3HZ LYS 62 2.049 -4.413 -2.839
360 HZ2 LYS 62 1HZ LYS 62 3.615 -4.822 -3.330
361 HZ3 LYS 62 2HZ LYS 62 3.375 -3.985 -1.880
362 H ASP 63 H ASP 63 -1.580 -7.957 -0.497
363 HA ASP 63 HA ASP 63 -2.960 -8.104 -2.975
364 HB3 ASP 63 2HB ASP 63 -2.915 -10.595 -1.460
365 H LYS 64 H LYS 64 -3.881 -8.832 0.369
366 HA LYS 64 HA LYS 64 -6.571 -9.559 -0.398
367 HB3 LYS 64 2HB LYS 64 -6.939 -10.033 1.904
368 HG3 LYS 64 2HG LYS 64 -4.678 -11.127 2.624
369 HD3 LYS 64 2HD LYS 64 -6.108 -12.013 0.116
370 HE3 LYS 64 2HE LYS 64 -3.878 -13.111 1.183
371 HZ1 LYS 64 3HZ LYS 64 -6.015 -14.819 2.280
372 HZ2 LYS 64 1HZ LYS 64 -5.331 -13.598 3.230
373 HZ3 LYS 64 2HZ LYS 64 -4.357 -14.838 2.617
374 H VAL 65 H VAL 65 -4.965 -6.680 0.012
375 HA VAL 65 HA VAL 65 -7.264 -5.233 1.089
376 HB VAL 65 HB VAL 65 -4.457 -4.348 0.431
377 HG11 VAL 65 1HG1 VAL 65 -5.303 -2.207 1.641
378 HG12 VAL 65 2HG1 VAL 65 -5.634 -2.425 -0.078
379 HG13 VAL 65 3HG1 VAL 65 -6.893 -2.756 1.112
380 HG21 VAL 65 3HG2 VAL 65 -4.963 -3.730 3.044
381 HG22 VAL 65 1HG2 VAL 65 -5.864 -5.233 2.839
382 HG23 VAL 65 2HG2 VAL 65 -4.137 -5.186 2.488
383 H PHE 66 H PHE 66 -8.502 -3.840 -0.070
384 HA PHE 66 HA PHE 66 -7.973 -3.709 -2.965
385 HB3 PHE 66 2HB PHE 66 -10.524 -3.180 -3.012
386 HD1 PHE 66 1HD PHE 66 -10.088 -4.552 -4.960
387 HD2 PHE 66 2HD PHE 66 -10.144 -6.231 -1.050
388 HE1 PHE 66 1HE PHE 66 -10.235 -6.806 -5.934
389 HE2 PHE 66 2HE PHE 66 -10.289 -8.488 -2.017
390 HZ PHE 66 HZ PHE 66 -10.334 -8.779 -4.463
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -29.396 -4.026 22.384
2 HA2 GLY 1 1HA GLY 1 -29.203 -3.837 20.099
3 HA3 GLY 1 2HA GLY 1 -30.542 -4.966 19.953
4 H SER 2 H SER 2 -30.192 -2.788 18.237
5 HA SER 2 HA SER 2 -32.246 -0.873 19.102
6 HB3 SER 2 2HB SER 2 -29.981 -0.054 18.285
7 HG SER 2 HG SER 2 -29.958 -1.578 16.469
8 H SER 3 H SER 3 -33.697 -0.074 17.304
9 HA SER 3 HA SER 3 -34.624 -2.386 15.732
10 HB3 SER 3 2HB SER 3 -36.060 -1.127 17.602
11 HG SER 3 HG SER 3 -36.965 0.199 15.292
12 H GLY 4 H GLY 4 -33.609 0.924 15.609
13 HA2 GLY 4 1HA GLY 4 -32.808 2.024 13.702
14 HA3 GLY 4 2HA GLY 4 -33.557 0.789 12.703
15 H SER 5 H SER 5 -33.678 3.579 12.212
16 HA SER 5 HA SER 5 -36.574 4.017 12.521
17 HB3 SER 5 2HB SER 5 -36.205 6.397 12.778
18 HG SER 5 HG SER 5 -35.134 4.582 14.495
19 H SER 6 H SER 6 -35.893 2.695 10.361
20 HA SER 6 HA SER 6 -35.120 4.359 8.159
21 HB3 SER 6 2HB SER 6 -36.043 1.525 8.468
22 HG SER 6 HG SER 6 -37.074 1.905 6.612
23 H GLY 7 H GLY 7 -36.395 5.142 6.483
24 HA2 GLY 7 1HA GLY 7 -39.156 4.681 6.192
25 HA3 GLY 7 2HA GLY 7 -38.929 6.126 7.166
26 H PHE 8 H PHE 8 -36.426 6.810 5.745
27 HA PHE 8 HA PHE 8 -37.304 7.331 3.023
28 HB3 PHE 8 2HB PHE 8 -37.063 9.739 3.185
29 HD1 PHE 8 2HD PHE 8 -38.292 8.829 6.549
30 HD2 PHE 8 1HD PHE 8 -39.321 9.827 2.541
31 HE1 PHE 8 2HE PHE 8 -40.651 9.046 7.212
32 HE2 PHE 8 1HE PHE 8 -41.682 10.046 3.198
33 HZ PHE 8 HZ PHE 8 -42.350 9.655 5.535
34 H VAL 9 H VAL 9 -35.490 5.940 2.616
35 HA VAL 9 HA VAL 9 -32.884 6.297 3.453
36 HB VAL 9 HB VAL 9 -33.816 4.415 2.017
37 HG11 VAL 9 1HG1 VAL 9 -34.702 5.958 0.256
38 HG12 VAL 9 2HG1 VAL 9 -33.034 6.234 -0.253
39 HG13 VAL 9 3HG1 VAL 9 -33.734 4.618 -0.357
40 HG21 VAL 9 3HG2 VAL 9 -31.189 5.530 1.058
41 HG22 VAL 9 1HG2 VAL 9 -31.401 4.782 2.640
42 HG23 VAL 9 2HG2 VAL 9 -31.672 3.838 1.175
43 H LYS 10 H LYS 10 -31.161 7.525 2.822
44 HA LYS 10 HA LYS 10 -31.497 9.416 0.619
45 HB3 LYS 10 2HB LYS 10 -30.556 10.337 3.336
46 HG3 LYS 10 2HG LYS 10 -31.738 12.381 1.759
47 HD3 LYS 10 2HD LYS 10 -28.985 11.803 2.818
48 HE3 LYS 10 2HE LYS 10 -29.707 13.676 0.756
49 HZ1 LYS 10 3HZ LYS 10 -30.041 15.408 2.187
50 HZ2 LYS 10 1HZ LYS 10 -28.362 15.505 2.006
51 HZ3 LYS 10 2HZ LYS 10 -29.024 14.784 3.385
52 H THR 11 H THR 11 -29.791 9.157 -0.646
53 HA THR 11 HA THR 11 -27.564 7.690 -0.291
54 HB THR 11 HB THR 11 -27.452 8.441 -2.408
55 HG1 THR 11 1HG THR 11 -25.941 10.165 -2.651
56 HG21 THR 11 3HG2 THR 11 -28.668 10.989 -1.365
57 HG22 THR 11 1HG2 THR 11 -29.405 9.769 -2.402
58 HG23 THR 11 2HG2 THR 11 -28.134 10.814 -3.037
59 H VAL 12 H VAL 12 -25.298 8.233 0.111
60 HA VAL 12 HA VAL 12 -24.994 10.354 2.136
61 HB VAL 12 HB VAL 12 -23.606 7.671 2.129
62 HG11 VAL 12 1HG1 VAL 12 -22.078 8.946 3.224
63 HG12 VAL 12 2HG1 VAL 12 -23.267 10.158 3.704
64 HG13 VAL 12 3HG1 VAL 12 -23.165 8.628 4.577
65 HG21 VAL 12 3HG2 VAL 12 -25.683 8.690 4.060
66 HG22 VAL 12 1HG2 VAL 12 -26.039 7.615 2.708
67 HG23 VAL 12 2HG2 VAL 12 -24.968 7.079 4.002
68 H GLU 13 H GLU 13 -24.432 11.457 -0.022
69 HA GLU 13 HA GLU 13 -22.152 10.904 -1.487
70 HB3 GLU 13 2HB GLU 13 -22.150 13.249 -2.132
71 HG3 GLU 13 2HG GLU 13 -24.851 12.007 -1.805
72 H ASP 14 H ASP 14 -20.319 10.316 -0.455
73 HA ASP 14 HA ASP 14 -18.652 12.302 0.651
74 HB3 ASP 14 2HB ASP 14 -18.678 10.654 2.899
75 H LYS 15 H LYS 15 -16.541 11.485 1.235
76 HA LYS 15 HA LYS 15 -15.943 8.999 -0.180
77 HB3 LYS 15 2HB LYS 15 -13.899 9.870 -0.651
78 HG3 LYS 15 2HG LYS 15 -15.687 11.758 -0.986
79 HD3 LYS 15 2HD LYS 15 -14.613 12.435 1.552
80 HE3 LYS 15 2HE LYS 15 -12.831 13.526 0.086
81 HZ1 LYS 15 3HZ LYS 15 -14.910 14.451 -1.339
82 HZ2 LYS 15 1HZ LYS 15 -13.368 15.146 -1.339
83 HZ3 LYS 15 2HZ LYS 15 -14.581 15.781 -0.346
84 H TYR 16 H TYR 16 -13.622 8.189 0.976
85 HA TYR 16 HA TYR 16 -14.574 7.175 3.552
86 HB3 TYR 16 2HB TYR 16 -12.825 5.456 3.287
87 HD1 TYR 16 1HD TYR 16 -15.749 6.587 1.892
88 HD2 TYR 16 2HD TYR 16 -12.757 3.634 1.237
89 HE1 TYR 16 1HE TYR 16 -17.367 5.238 0.622
90 HE2 TYR 16 2HE TYR 16 -14.366 2.277 -0.037
91 HH TYR 16 HH TYR 16 -16.418 2.495 -1.231
92 H LYS 17 H LYS 17 -12.403 6.512 4.912
93 HA LYS 17 HA LYS 17 -10.491 8.683 4.997
94 HB3 LYS 17 2HB LYS 17 -12.671 8.362 7.016
95 HG3 LYS 17 2HG LYS 17 -10.879 10.062 8.235
96 HD3 LYS 17 2HD LYS 17 -10.543 7.826 9.681
97 HE3 LYS 17 2HE LYS 17 -12.480 9.957 9.566
98 HZ1 LYS 17 3HZ LYS 17 -14.190 8.892 10.896
99 HZ2 LYS 17 1HZ LYS 17 -13.434 7.388 10.714
100 HZ3 LYS 17 2HZ LYS 17 -14.095 8.171 9.368
101 H CYS 18 H CYS 18 -8.593 8.108 5.968
102 HA CYS 18 HA CYS 18 -8.018 5.380 6.294
103 HB3 CYS 18 2HB CYS 18 -6.522 7.874 7.094
104 H GLU 19 H GLU 19 -7.815 4.071 8.060
105 HA GLU 19 HA GLU 19 -9.225 4.912 10.443
106 HB3 GLU 19 2HB GLU 19 -8.562 2.452 11.101
107 HG3 GLU 19 2HG GLU 19 -10.510 1.598 10.167
108 H LYS 20 H LYS 20 -6.599 6.085 9.815
109 HA LYS 20 HA LYS 20 -5.288 5.447 12.362
110 HB3 LYS 20 2HB LYS 20 -3.320 6.189 10.400
111 HG3 LYS 20 2HG LYS 20 -3.781 3.769 12.110
112 HD3 LYS 20 2HD LYS 20 -1.420 4.275 10.299
113 HE3 LYS 20 2HE LYS 20 -0.644 2.117 11.024
114 HZ1 LYS 20 3HZ LYS 20 -0.144 2.570 13.300
115 HZ2 LYS 20 1HZ LYS 20 -1.448 3.638 13.443
116 HZ3 LYS 20 2HZ LYS 20 -0.128 4.041 12.465
117 H CYS 21 H CYS 21 -4.743 7.647 9.606
118 HA CYS 21 HA CYS 21 -4.395 9.851 11.493
119 HB3 CYS 21 2HB CYS 21 -2.651 9.719 9.873
120 H HIS 22 H HIS 22 -6.920 8.469 9.984
121 HA HIS 22 HA HIS 22 -9.036 9.122 9.467
122 HB3 HIS 22 2HB HIS 22 -9.905 10.485 11.022
123 HD2 HIS 22 2HD HIS 22 -7.793 8.618 12.465
124 HE1 HIS 22 1HE HIS 22 -6.406 12.110 14.434
125 HE2 HIS 22 2HE HIS 22 -6.370 9.592 14.392
126 H LEU 23 H LEU 23 -6.787 9.725 7.657
127 HA LEU 23 HA LEU 23 -7.301 12.236 6.400
128 HB3 LEU 23 2HB LEU 23 -6.061 10.718 4.492
129 HG LEU 23 HG LEU 23 -4.880 12.332 6.721
130 HD11 LEU 23 1HD1 LEU 23 -2.866 11.439 6.489
131 HD12 LEU 23 2HD1 LEU 23 -2.913 11.739 4.752
132 HD13 LEU 23 3HD1 LEU 23 -3.537 10.223 5.401
133 HD21 LEU 23 3HD2 LEU 23 -4.414 13.897 5.037
134 HD22 LEU 23 1HD2 LEU 23 -6.035 13.309 4.670
135 HD23 LEU 23 2HD2 LEU 23 -4.653 12.714 3.750
136 H VAL 24 H VAL 24 -9.008 12.715 5.204
137 HA VAL 24 HA VAL 24 -10.874 10.775 4.306
138 HB VAL 24 HB VAL 24 -10.573 13.724 3.836
139 HG11 VAL 24 1HG1 VAL 24 -12.939 13.392 2.747
140 HG12 VAL 24 2HG1 VAL 24 -11.471 13.242 1.779
141 HG13 VAL 24 3HG1 VAL 24 -12.298 11.795 2.358
142 HG21 VAL 24 3HG2 VAL 24 -12.267 13.963 5.340
143 HG22 VAL 24 1HG2 VAL 24 -13.024 12.433 4.897
144 HG23 VAL 24 2HG2 VAL 24 -11.593 12.443 5.928
145 H LEU 25 H LEU 25 -10.523 9.416 2.683
146 HA LEU 25 HA LEU 25 -9.076 10.404 0.313
147 HB3 LEU 25 2HB LEU 25 -7.819 8.570 0.294
148 HG LEU 25 HG LEU 25 -9.010 8.258 3.015
149 HD11 LEU 25 1HD1 LEU 25 -6.845 6.425 2.611
150 HD12 LEU 25 2HD1 LEU 25 -8.161 6.060 1.497
151 HD13 LEU 25 3HD1 LEU 25 -8.467 6.121 3.232
152 HD21 LEU 25 3HD2 LEU 25 -6.353 8.964 1.832
153 HD22 LEU 25 1HD2 LEU 25 -6.475 8.396 3.497
154 HD23 LEU 25 2HD2 LEU 25 -7.330 9.857 2.999
155 H CYS 26 H CYS 26 -9.618 8.587 -1.545
156 HA CYS 26 HA CYS 26 -12.561 8.527 -1.722
157 HB3 CYS 26 2HB CYS 26 -12.083 10.106 -3.329
158 H SER 27 H SER 27 -9.741 6.726 -1.666
159 HA SER 27 HA SER 27 -11.108 4.280 -2.139
160 HB3 SER 27 2HB SER 27 -10.833 4.954 -4.485
161 HG SER 27 HG SER 27 -9.083 6.114 -4.779
162 HA PRO 28 HA PRO 28 -7.390 4.047 0.571
163 HB3 PRO 28 2HB PRO 28 -8.712 4.303 2.433
164 HG3 PRO 28 2HG PRO 28 -10.974 3.763 2.381
165 HD3 PRO 28 2HD PRO 28 -10.838 5.086 0.498
166 H LYS 29 H LYS 29 -6.980 1.727 1.939
167 HA LYS 29 HA LYS 29 -6.918 -0.302 -0.199
168 HB3 LYS 29 2HB LYS 29 -4.841 -1.124 0.755
169 HG3 LYS 29 2HG LYS 29 -3.340 0.769 0.442
170 HD3 LYS 29 2HD LYS 29 -5.670 0.680 -1.472
171 HE3 LYS 29 2HE LYS 29 -2.924 1.556 -2.241
172 HZ1 LYS 29 3HZ LYS 29 -5.655 1.846 -3.297
173 HZ2 LYS 29 1HZ LYS 29 -4.251 1.327 -4.086
174 HZ3 LYS 29 2HZ LYS 29 -4.466 2.968 -3.735
175 H GLN 30 H GLN 30 -9.182 -0.417 1.099
176 HA GLN 30 HA GLN 30 -9.649 -1.475 3.493
177 HB3 GLN 30 2HB GLN 30 -10.904 -3.148 1.436
178 HG3 GLN 30 2HG GLN 30 -11.949 -1.186 3.459
179 HE21 GLN 30 1HE2 GLN 30 -14.239 -2.799 3.889
180 HE22 GLN 30 2HE2 GLN 30 -15.307 -2.561 2.552
181 H THR 31 H THR 31 -8.911 -3.081 4.706
182 HA THR 31 HA THR 31 -7.138 -5.058 3.574
183 HB THR 31 HB THR 31 -6.565 -5.660 5.775
184 HG1 THR 31 1HG THR 31 -8.867 -4.290 6.744
185 HG21 THR 31 3HG2 THR 31 -5.668 -3.708 6.461
186 HG22 THR 31 1HG2 THR 31 -7.232 -2.898 6.534
187 HG23 THR 31 2HG2 THR 31 -6.394 -3.062 4.990
188 H GLU 32 H GLU 32 -7.809 -7.101 5.560
189 HA GLU 32 HA GLU 32 -10.049 -8.316 4.113
190 HB3 GLU 32 2HB GLU 32 -8.547 -9.960 6.043
191 HG3 GLU 32 2HG GLU 32 -8.289 -11.104 3.572
192 H CYS 33 H CYS 33 -9.971 -6.376 6.550
193 HA CYS 33 HA CYS 33 -11.729 -7.977 8.292
194 HB3 CYS 33 2HB CYS 33 -9.597 -7.017 9.288
195 H GLY 34 H GLY 34 -11.396 -5.040 6.435
196 HA2 GLY 34 1HA GLY 34 -13.649 -4.361 5.495
197 HA3 GLY 34 2HA GLY 34 -14.154 -4.291 7.177
198 H HIS 35 H HIS 35 -11.941 -3.080 8.331
199 HA HIS 35 HA HIS 35 -12.465 -0.393 8.035
200 HB3 HIS 35 2HB HIS 35 -10.176 -0.048 9.082
201 HD2 HIS 35 2HD HIS 35 -12.215 0.786 10.913
202 HE1 HIS 35 1HE HIS 35 -12.380 -2.962 12.892
203 HE2 HIS 35 2HE HIS 35 -13.126 -0.557 12.926
204 H ARG 36 H ARG 36 -10.404 1.156 7.530
205 HA ARG 36 HA ARG 36 -9.207 0.419 4.975
206 HB3 ARG 36 2HB ARG 36 -9.937 2.585 3.963
207 HG3 ARG 36 2HG ARG 36 -11.859 0.432 4.636
208 HD3 ARG 36 2HD ARG 36 -12.697 2.868 3.083
209 HE ARG 36 HE ARG 36 -13.874 0.362 3.308
210 HH11 ARG 36 1HH1 ARG 36 -14.749 3.697 3.794
211 HH12 ARG 36 2HH1 ARG 36 -16.422 3.448 3.419
212 HH21 ARG 36 1HH2 ARG 36 -16.073 0.022 2.811
213 HH22 ARG 36 2HH2 ARG 36 -17.174 1.357 2.861
214 H PHE 37 H PHE 37 -7.480 1.851 4.322
215 HA PHE 37 HA PHE 37 -6.540 3.774 6.293
216 HB3 PHE 37 2HB PHE 37 -4.224 2.652 6.175
217 HD1 PHE 37 2HD PHE 37 -6.727 0.098 7.049
218 HD2 PHE 37 1HD PHE 37 -4.273 3.276 8.462
219 HE1 PHE 37 2HE PHE 37 -7.215 -0.561 9.369
220 HE2 PHE 37 1HE PHE 37 -4.757 2.622 10.784
221 HZ PHE 37 HZ PHE 37 -6.232 0.702 11.240
222 H CYS 38 H CYS 38 -4.584 4.949 5.509
223 HA CYS 38 HA CYS 38 -4.905 5.527 2.679
224 HB3 CYS 38 2HB CYS 38 -4.794 7.338 4.412
225 H GLU 39 H GLU 39 -2.840 6.041 1.434
226 HA GLU 39 HA GLU 39 -1.389 3.756 0.966
227 HB3 GLU 39 2HB GLU 39 0.396 5.572 0.131
228 HG3 GLU 39 2HG GLU 39 -2.182 5.630 -1.344
229 H SER 40 H SER 40 -0.111 6.629 2.656
230 HA SER 40 HA SER 40 2.291 5.610 3.497
231 HB3 SER 40 2HB SER 40 1.936 7.172 5.541
232 HG SER 40 HG SER 40 2.556 8.798 4.281
233 H CYS 41 H CYS 41 -0.208 6.031 5.959
234 HA CYS 41 HA CYS 41 0.613 4.368 7.869
235 HB3 CYS 41 2HB CYS 41 -1.792 3.852 8.386
236 H MET 42 H MET 42 -1.307 3.248 5.087
237 HA MET 42 HA MET 42 -1.456 0.564 5.677
238 HB3 MET 42 2HB MET 42 -1.173 1.949 3.012
239 HG3 MET 42 2HG MET 42 -0.651 -0.658 3.205
240 HE1 MET 42 3HE MET 42 -3.380 0.144 5.147
241 HE2 MET 42 1HE MET 42 -4.064 -1.473 5.315
242 HE3 MET 42 2HE MET 42 -2.329 -1.225 5.511
243 H ALA 43 H ALA 43 1.120 2.216 3.858
244 HA ALA 43 HA ALA 43 2.717 -0.078 3.472
245 HB1 ALA 43 3HB ALA 43 4.223 2.405 3.637
246 HB2 ALA 43 1HB ALA 43 4.001 1.301 2.278
247 HB3 ALA 43 2HB ALA 43 2.791 2.540 2.617
248 H ALA 44 H ALA 44 2.294 2.053 6.165
249 HA ALA 44 HA ALA 44 4.753 1.436 7.487
250 HB1 ALA 44 3HB ALA 44 2.199 2.569 8.622
251 HB2 ALA 44 1HB ALA 44 3.778 2.566 9.409
252 HB3 ALA 44 2HB ALA 44 3.527 3.506 7.937
253 H LEU 45 H LEU 45 1.376 0.432 8.032
254 HA LEU 45 HA LEU 45 1.862 -1.352 10.119
255 HB3 LEU 45 2HB LEU 45 -0.282 -2.381 9.513
256 HG LEU 45 HG LEU 45 -0.387 0.623 9.253
257 HD11 LEU 45 1HD1 LEU 45 -2.666 0.556 9.424
258 HD12 LEU 45 2HD1 LEU 45 -2.674 -1.028 10.199
259 HD13 LEU 45 3HD1 LEU 45 -2.384 -0.897 8.464
260 HD21 LEU 45 3HD2 LEU 45 0.359 0.424 11.374
261 HD22 LEU 45 1HD2 LEU 45 -0.161 -1.256 11.516
262 HD23 LEU 45 2HD2 LEU 45 -1.333 0.050 11.704
263 H LEU 46 H LEU 46 1.504 -2.067 6.643
264 HA LEU 46 HA LEU 46 1.977 -4.781 6.706
265 HB3 LEU 46 2HB LEU 46 2.725 -4.574 4.389
266 HG LEU 46 HG LEU 46 0.399 -2.795 5.078
267 HD11 LEU 46 1HD1 LEU 46 1.141 -3.693 2.306
268 HD12 LEU 46 2HD1 LEU 46 1.561 -2.105 2.946
269 HD13 LEU 46 3HD1 LEU 46 -0.131 -2.571 2.788
270 HD21 LEU 46 3HD2 LEU 46 0.723 -5.561 4.972
271 HD22 LEU 46 1HD2 LEU 46 -0.110 -5.138 3.475
272 HD23 LEU 46 2HD2 LEU 46 -0.797 -4.668 5.030
273 H SER 47 H SER 47 4.251 -2.148 6.984
274 HA SER 47 HA SER 47 6.550 -3.905 6.751
275 HB3 SER 47 2HB SER 47 6.484 -0.974 7.505
276 HG SER 47 HG SER 47 8.521 -1.457 7.788
277 H SER 48 H SER 48 4.518 -4.116 8.961
278 HA SER 48 HA SER 48 6.283 -3.654 11.268
279 HB3 SER 48 2HB SER 48 3.296 -4.153 11.216
280 HG SER 48 HG SER 48 3.926 -3.069 13.451
281 H SER 49 H SER 49 5.951 -5.976 9.195
282 HA SER 49 HA SER 49 6.472 -8.201 9.260
283 HB3 SER 49 2HB SER 49 6.347 -8.296 12.248
284 HG SER 49 HG SER 49 8.081 -9.681 11.920
285 H SER 50 H SER 50 4.363 -7.568 12.070
286 HA SER 50 HA SER 50 2.495 -9.575 10.993
287 HB3 SER 50 2HB SER 50 2.201 -8.788 13.822
288 HG SER 50 HG SER 50 1.581 -10.831 13.965
289 HA PRO 51 HA PRO 51 0.429 -5.387 10.827
290 HB3 PRO 51 2HB PRO 51 1.193 -4.960 8.703
291 HG3 PRO 51 2HG PRO 51 1.855 -6.688 7.295
292 HD3 PRO 51 2HD PRO 51 3.047 -7.241 9.189
293 H LYS 52 H LYS 52 -1.529 -5.411 11.716
294 HA LYS 52 HA LYS 52 -3.429 -7.508 10.895
295 HB3 LYS 52 2HB LYS 52 -4.336 -7.536 13.063
296 HG3 LYS 52 2HG LYS 52 -1.370 -7.321 13.104
297 HD3 LYS 52 2HD LYS 52 -2.904 -7.954 15.602
298 HE3 LYS 52 2HE LYS 52 -0.295 -6.716 15.830
299 HZ1 LYS 52 3HZ LYS 52 -0.675 -9.473 16.622
300 HZ2 LYS 52 1HZ LYS 52 -1.778 -8.384 17.300
301 HZ3 LYS 52 2HZ LYS 52 -0.119 -8.153 17.523
302 H CYS 53 H CYS 53 -3.706 -4.356 12.535
303 HA CYS 53 HA CYS 53 -4.745 -2.751 10.655
304 HB3 CYS 53 2HB CYS 53 -6.786 -4.781 11.483
305 H THR 54 H THR 54 -4.073 -1.143 11.991
306 HA THR 54 HA THR 54 -4.176 -0.737 14.615
307 HB THR 54 HB THR 54 -4.171 1.017 12.355
308 HG1 THR 54 1HG THR 54 -2.552 0.749 14.035
309 HG21 THR 54 3HG2 THR 54 -6.358 1.787 13.013
310 HG22 THR 54 1HG2 THR 54 -5.172 3.014 13.455
311 HG23 THR 54 2HG2 THR 54 -5.842 1.949 14.691
312 H ALA 55 H ALA 55 -6.981 -0.507 12.489
313 HA ALA 55 HA ALA 55 -8.840 0.558 14.257
314 HB1 ALA 55 3HB ALA 55 -10.295 0.196 12.602
315 HB2 ALA 55 1HB ALA 55 -8.907 -0.391 11.686
316 HB3 ALA 55 2HB ALA 55 -9.943 -1.530 12.548
317 H CYS 56 H CYS 56 -8.912 -2.882 13.370
318 HA CYS 56 HA CYS 56 -9.571 -3.497 16.175
319 HB3 CYS 56 2HB CYS 56 -11.444 -3.962 14.713
320 H GLN 57 H GLN 57 -7.536 -4.241 13.466
321 HA GLN 57 HA GLN 57 -5.475 -5.270 13.478
322 HB3 GLN 57 2HB GLN 57 -4.484 -6.061 15.435
323 HG3 GLN 57 2HG GLN 57 -6.100 -4.610 17.243
324 HE21 GLN 57 1HE2 GLN 57 -4.870 -2.075 16.734
325 HE22 GLN 57 2HE2 GLN 57 -3.180 -2.260 17.045
326 H GLU 58 H GLU 58 -6.185 -6.588 11.807
327 HA GLU 58 HA GLU 58 -6.931 -9.315 12.625
328 HB3 GLU 58 2HB GLU 58 -7.946 -8.896 10.031
329 HG3 GLU 58 2HG GLU 58 -10.017 -8.626 11.981
330 H SER 59 H SER 59 -6.070 -7.645 9.594
331 HA SER 59 HA SER 59 -3.512 -8.755 9.335
332 HB3 SER 59 2HB SER 59 -4.712 -10.195 7.226
333 HG SER 59 HG SER 59 -4.071 -11.923 9.011
334 H ILE 60 H ILE 60 -2.518 -7.362 8.049
335 HA ILE 60 HA ILE 60 -4.062 -6.113 5.870
336 HB ILE 60 HB ILE 60 -1.618 -4.778 6.907
337 HG13 ILE 60 2HG1 ILE 60 -2.952 -5.509 8.922
338 HG21 ILE 60 1HG2 ILE 60 -3.793 -3.023 6.581
339 HG22 ILE 60 2HG2 ILE 60 -2.394 -3.223 5.528
340 HG23 ILE 60 3HG2 ILE 60 -3.858 -4.164 5.239
341 HD11 ILE 60 3HD1 ILE 60 -3.397 -2.685 9.172
342 HD12 ILE 60 1HD1 ILE 60 -2.222 -3.715 9.988
343 HD13 ILE 60 2HD1 ILE 60 -1.835 -3.007 8.420
344 H VAL 61 H VAL 61 -3.442 -6.725 3.915
345 HA VAL 61 HA VAL 61 -0.596 -7.074 3.348
346 HB VAL 61 HB VAL 61 -2.697 -9.151 2.721
347 HG11 VAL 61 1HG1 VAL 61 -0.178 -8.509 1.405
348 HG12 VAL 61 2HG1 VAL 61 -0.269 -10.185 1.951
349 HG13 VAL 61 3HG1 VAL 61 -1.505 -9.540 0.871
350 HG21 VAL 61 3HG2 VAL 61 -0.488 -8.937 4.679
351 HG22 VAL 61 1HG2 VAL 61 -2.038 -9.769 4.801
352 HG23 VAL 61 2HG2 VAL 61 -0.713 -10.503 3.899
353 H LYS 62 H LYS 62 -0.008 -6.295 1.406
354 HA LYS 62 HA LYS 62 -1.706 -4.664 -0.084
355 HB3 LYS 62 2HB LYS 62 0.646 -4.309 -0.226
356 HG3 LYS 62 2HG LYS 62 1.251 -6.718 -1.817
357 HD3 LYS 62 2HD LYS 62 2.616 -4.735 -0.139
358 HE3 LYS 62 2HE LYS 62 3.720 -7.534 -0.244
359 HZ1 LYS 62 3HZ LYS 62 4.520 -5.155 1.344
360 HZ2 LYS 62 1HZ LYS 62 5.326 -5.725 -0.030
361 HZ3 LYS 62 2HZ LYS 62 5.272 -6.670 1.372
362 H ASP 63 H ASP 63 -0.563 -7.957 -0.793
363 HA ASP 63 HA ASP 63 -1.818 -8.311 -3.244
364 HB3 ASP 63 2HB ASP 63 -1.964 -10.805 -2.018
365 H LYS 64 H LYS 64 -3.080 -8.763 0.023
366 HA LYS 64 HA LYS 64 -5.666 -9.617 -0.990
367 HB3 LYS 64 2HB LYS 64 -6.249 -10.073 1.257
368 HG3 LYS 64 2HG LYS 64 -3.739 -10.802 2.156
369 HD3 LYS 64 2HD LYS 64 -5.672 -12.268 0.361
370 HE3 LYS 64 2HE LYS 64 -3.238 -13.161 1.856
371 HZ1 LYS 64 3HZ LYS 64 -4.419 -15.464 1.220
372 HZ2 LYS 64 1HZ LYS 64 -5.771 -14.558 1.681
373 HZ3 LYS 64 2HZ LYS 64 -4.489 -14.771 2.762
374 H VAL 65 H VAL 65 -4.144 -6.715 -0.577
375 HA VAL 65 HA VAL 65 -6.507 -5.247 0.306
376 HB VAL 65 HB VAL 65 -3.664 -4.739 0.314
377 HG11 VAL 65 1HG1 VAL 65 -3.699 -2.385 -0.297
378 HG12 VAL 65 2HG1 VAL 65 -4.165 -3.387 -1.672
379 HG13 VAL 65 3HG1 VAL 65 -5.395 -2.513 -0.759
380 HG21 VAL 65 3HG2 VAL 65 -6.117 -3.771 1.691
381 HG22 VAL 65 1HG2 VAL 65 -4.649 -4.483 2.361
382 HG23 VAL 65 2HG2 VAL 65 -4.648 -2.804 1.822
383 H PHE 66 H PHE 66 -7.431 -3.548 -0.931
384 HA PHE 66 HA PHE 66 -6.809 -3.568 -3.798
385 HB3 PHE 66 2HB PHE 66 -8.805 -4.387 -4.401
386 HD1 PHE 66 1HD PHE 66 -10.087 -3.844 -0.989
387 HD2 PHE 66 2HD PHE 66 -8.497 -6.646 -3.770
388 HE1 PHE 66 1HE PHE 66 -10.714 -5.687 0.515
389 HE2 PHE 66 2HE PHE 66 -9.121 -8.494 -2.271
390 HZ PHE 66 HZ PHE 66 -10.232 -8.016 -0.126
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -56.358 24.955 4.208
2 HA2 GLY 1 1HA GLY 1 -57.301 22.759 3.521
3 HA3 GLY 1 2HA GLY 1 -55.886 23.185 2.570
4 H SER 2 H SER 2 -55.731 20.855 2.225
5 HA SER 2 HA SER 2 -54.371 19.530 4.478
6 HB3 SER 2 2HB SER 2 -55.533 17.591 4.173
7 HG SER 2 HG SER 2 -57.120 19.350 4.313
8 H SER 3 H SER 3 -52.622 18.163 3.965
9 HA SER 3 HA SER 3 -51.692 18.032 1.220
10 HB3 SER 3 2HB SER 3 -49.629 19.049 3.095
11 HG SER 3 HG SER 3 -48.897 19.984 1.236
12 H GLY 4 H GLY 4 -49.455 16.878 1.203
13 HA2 GLY 4 1HA GLY 4 -49.544 14.737 3.239
14 HA3 GLY 4 2HA GLY 4 -49.179 14.440 1.546
15 H SER 5 H SER 5 -47.448 13.501 3.387
16 HA SER 5 HA SER 5 -45.378 15.278 4.121
17 HB3 SER 5 2HB SER 5 -45.104 12.302 3.654
18 HG SER 5 HG SER 5 -43.657 14.257 5.045
19 H SER 6 H SER 6 -44.727 16.515 2.382
20 HA SER 6 HA SER 6 -43.389 15.058 0.196
21 HB3 SER 6 2HB SER 6 -45.074 17.512 0.218
22 HG SER 6 HG SER 6 -42.864 17.130 -1.522
23 H GLY 7 H GLY 7 -41.456 14.934 1.459
24 HA2 GLY 7 1HA GLY 7 -40.158 17.411 2.243
25 HA3 GLY 7 2HA GLY 7 -39.536 15.784 2.480
26 H PHE 8 H PHE 8 -37.838 15.245 1.292
27 HA PHE 8 HA PHE 8 -37.584 16.228 -1.434
28 HB3 PHE 8 2HB PHE 8 -35.005 16.581 -0.432
29 HD1 PHE 8 1HD PHE 8 -36.183 17.185 -2.936
30 HD2 PHE 8 2HD PHE 8 -36.085 19.573 0.587
31 HE1 PHE 8 1HE PHE 8 -36.408 19.214 -4.309
32 HE2 PHE 8 2HE PHE 8 -36.311 21.605 -0.781
33 HZ PHE 8 HZ PHE 8 -36.473 21.428 -3.231
34 H VAL 9 H VAL 9 -36.161 15.005 -2.722
35 HA VAL 9 HA VAL 9 -34.881 12.680 -1.500
36 HB VAL 9 HB VAL 9 -37.124 11.899 -2.121
37 HG11 VAL 9 1HG1 VAL 9 -36.664 12.064 -5.010
38 HG12 VAL 9 2HG1 VAL 9 -38.136 12.334 -4.077
39 HG13 VAL 9 3HG1 VAL 9 -36.937 13.619 -4.226
40 HG21 VAL 9 3HG2 VAL 9 -34.829 10.615 -2.526
41 HG22 VAL 9 1HG2 VAL 9 -36.390 9.906 -2.936
42 HG23 VAL 9 2HG2 VAL 9 -35.404 10.654 -4.192
43 H LYS 10 H LYS 10 -32.853 13.298 -2.076
44 HA LYS 10 HA LYS 10 -32.317 13.495 -4.964
45 HB3 LYS 10 2HB LYS 10 -30.544 15.116 -4.497
46 HG3 LYS 10 2HG LYS 10 -32.084 16.899 -3.257
47 HD3 LYS 10 2HD LYS 10 -32.276 15.806 -6.045
48 HE3 LYS 10 2HE LYS 10 -34.472 16.782 -5.426
49 HZ1 LYS 10 3HZ LYS 10 -34.421 19.299 -5.245
50 HZ2 LYS 10 1HZ LYS 10 -32.792 19.137 -4.815
51 HZ3 LYS 10 2HZ LYS 10 -33.994 18.425 -3.861
52 H THR 11 H THR 11 -29.612 13.504 -4.977
53 HA THR 11 HA THR 11 -28.961 10.887 -3.796
54 HB THR 11 HB THR 11 -27.147 11.875 -5.876
55 HG1 THR 11 1HG THR 11 -29.431 10.928 -7.057
56 HG21 THR 11 3HG2 THR 11 -27.143 9.581 -4.951
57 HG22 THR 11 1HG2 THR 11 -27.379 9.605 -6.698
58 HG23 THR 11 2HG2 THR 11 -28.752 9.329 -5.625
59 H VAL 12 H VAL 12 -27.096 10.599 -2.633
60 HA VAL 12 HA VAL 12 -25.384 12.953 -2.210
61 HB VAL 12 HB VAL 12 -26.910 12.826 -0.310
62 HG11 VAL 12 1HG1 VAL 12 -27.006 10.192 -0.656
63 HG12 VAL 12 2HG1 VAL 12 -25.786 10.245 0.618
64 HG13 VAL 12 3HG1 VAL 12 -27.379 10.953 0.890
65 HG21 VAL 12 3HG2 VAL 12 -24.554 11.825 1.070
66 HG22 VAL 12 1HG2 VAL 12 -24.159 12.983 -0.201
67 HG23 VAL 12 2HG2 VAL 12 -25.277 13.434 1.087
68 H GLU 13 H GLU 13 -23.330 12.495 -2.606
69 HA GLU 13 HA GLU 13 -22.442 9.818 -3.044
70 HB3 GLU 13 2HB GLU 13 -20.335 10.778 -3.633
71 HG3 GLU 13 2HG GLU 13 -22.482 12.750 -4.380
72 H ASP 14 H ASP 14 -19.855 9.836 -2.014
73 HA ASP 14 HA ASP 14 -19.953 10.241 0.838
74 HB3 ASP 14 2HB ASP 14 -20.859 8.217 1.268
75 H LYS 15 H LYS 15 -17.896 8.699 1.681
76 HA LYS 15 HA LYS 15 -15.672 8.636 -0.079
77 HB3 LYS 15 2HB LYS 15 -15.490 10.955 0.006
78 HG3 LYS 15 2HG LYS 15 -15.822 11.110 2.974
79 HD3 LYS 15 2HD LYS 15 -16.756 13.197 1.097
80 HE3 LYS 15 2HE LYS 15 -15.479 14.593 2.804
81 HZ1 LYS 15 3HZ LYS 15 -17.843 12.955 3.430
82 HZ2 LYS 15 1HZ LYS 15 -17.740 14.620 3.142
83 HZ3 LYS 15 2HZ LYS 15 -17.198 13.981 4.612
84 H TYR 16 H TYR 16 -13.592 8.258 1.172
85 HA TYR 16 HA TYR 16 -14.215 6.744 3.622
86 HB3 TYR 16 2HB TYR 16 -12.494 5.190 3.058
87 HD1 TYR 16 2HD TYR 16 -13.249 6.529 -0.307
88 HD2 TYR 16 1HD TYR 16 -14.241 3.639 2.654
89 HE1 TYR 16 2HE TYR 16 -14.666 5.353 -1.937
90 HE2 TYR 16 1HE TYR 16 -15.660 2.455 1.032
91 HH TYR 16 HH TYR 16 -15.757 3.392 -2.351
92 H LYS 17 H LYS 17 -12.230 6.446 5.052
93 HA LYS 17 HA LYS 17 -10.344 8.652 4.997
94 HB3 LYS 17 2HB LYS 17 -12.537 8.393 7.013
95 HG3 LYS 17 2HG LYS 17 -10.821 10.246 8.115
96 HD3 LYS 17 2HD LYS 17 -10.410 8.127 9.714
97 HE3 LYS 17 2HE LYS 17 -12.476 10.146 9.420
98 HZ1 LYS 17 3HZ LYS 17 -13.617 7.766 9.668
99 HZ2 LYS 17 1HZ LYS 17 -14.242 9.167 10.383
100 HZ3 LYS 17 2HZ LYS 17 -13.311 8.092 11.299
101 H CYS 18 H CYS 18 -8.449 8.203 6.045
102 HA CYS 18 HA CYS 18 -7.829 5.505 6.573
103 HB3 CYS 18 2HB CYS 18 -6.347 8.060 7.209
104 H GLU 19 H GLU 19 -7.627 4.354 8.440
105 HA GLU 19 HA GLU 19 -9.018 5.395 10.754
106 HB3 GLU 19 2HB GLU 19 -8.189 2.954 11.551
107 HG3 GLU 19 2HG GLU 19 -10.269 2.062 10.942
108 H LYS 20 H LYS 20 -6.340 6.435 9.952
109 HA LYS 20 HA LYS 20 -5.012 6.022 12.544
110 HB3 LYS 20 2HB LYS 20 -3.119 6.657 10.450
111 HG3 LYS 20 2HG LYS 20 -3.418 4.465 12.467
112 HD3 LYS 20 2HD LYS 20 -1.149 4.728 10.500
113 HE3 LYS 20 2HE LYS 20 -0.123 3.042 11.600
114 HZ1 LYS 20 3HZ LYS 20 -0.607 3.047 14.003
115 HZ2 LYS 20 1HZ LYS 20 -1.981 3.992 13.712
116 HZ3 LYS 20 2HZ LYS 20 -0.443 4.606 13.366
117 H CYS 21 H CYS 21 -4.682 8.060 9.631
118 HA CYS 21 HA CYS 21 -4.313 10.384 11.380
119 HB3 CYS 21 2HB CYS 21 -2.547 10.193 9.799
120 H HIS 22 H HIS 22 -6.810 8.865 10.008
121 HA HIS 22 HA HIS 22 -8.931 9.440 9.419
122 HB3 HIS 22 2HB HIS 22 -9.807 10.884 10.890
123 HD2 HIS 22 2HD HIS 22 -7.608 9.258 12.466
124 HE1 HIS 22 1HE HIS 22 -6.308 12.975 14.042
125 HE2 HIS 22 2HE HIS 22 -6.183 10.468 14.253
126 H LEU 23 H LEU 23 -6.640 9.982 7.600
127 HA LEU 23 HA LEU 23 -7.169 12.362 6.145
128 HB3 LEU 23 2HB LEU 23 -5.973 10.656 4.352
129 HG LEU 23 HG LEU 23 -4.760 12.498 6.378
130 HD11 LEU 23 1HD1 LEU 23 -2.752 11.580 6.216
131 HD12 LEU 23 2HD1 LEU 23 -2.818 11.704 4.459
132 HD13 LEU 23 3HD1 LEU 23 -3.432 10.261 5.265
133 HD21 LEU 23 3HD2 LEU 23 -5.720 13.644 4.568
134 HD22 LEU 23 1HD2 LEU 23 -5.123 12.468 3.396
135 HD23 LEU 23 2HD2 LEU 23 -3.999 13.568 4.193
136 H VAL 24 H VAL 24 -8.916 12.766 4.978
137 HA VAL 24 HA VAL 24 -10.798 10.787 4.224
138 HB VAL 24 HB VAL 24 -10.500 13.654 3.326
139 HG11 VAL 24 1HG1 VAL 24 -11.709 12.439 1.627
140 HG12 VAL 24 2HG1 VAL 24 -12.755 11.710 2.847
141 HG13 VAL 24 3HG1 VAL 24 -12.835 13.445 2.539
142 HG21 VAL 24 3HG2 VAL 24 -11.799 12.301 5.603
143 HG22 VAL 24 1HG2 VAL 24 -11.145 13.934 5.472
144 HG23 VAL 24 2HG2 VAL 24 -12.741 13.568 4.817
145 H LEU 25 H LEU 25 -10.447 9.309 2.707
146 HA LEU 25 HA LEU 25 -9.077 10.138 0.233
147 HB3 LEU 25 2HB LEU 25 -7.714 8.400 0.400
148 HG LEU 25 HG LEU 25 -9.001 8.133 3.075
149 HD11 LEU 25 1HD1 LEU 25 -6.831 6.318 2.920
150 HD12 LEU 25 2HD1 LEU 25 -7.972 5.911 1.639
151 HD13 LEU 25 3HD1 LEU 25 -8.517 5.986 3.315
152 HD21 LEU 25 3HD2 LEU 25 -6.611 8.437 3.759
153 HD22 LEU 25 1HD2 LEU 25 -7.303 9.792 2.867
154 HD23 LEU 25 2HD2 LEU 25 -6.217 8.665 2.054
155 H CYS 26 H CYS 26 -9.688 8.797 -1.690
156 HA CYS 26 HA CYS 26 -12.591 8.314 -1.654
157 HB3 CYS 26 2HB CYS 26 -11.268 8.558 -4.271
158 H SER 27 H SER 27 -9.545 6.832 -2.056
159 HA SER 27 HA SER 27 -10.847 4.298 -2.679
160 HB3 SER 27 2HB SER 27 -8.355 4.993 -4.203
161 HG SER 27 HG SER 27 -10.056 3.578 -5.598
162 HA PRO 28 HA PRO 28 -7.595 4.044 0.623
163 HB3 PRO 28 2HB PRO 28 -9.149 4.397 2.278
164 HG3 PRO 28 2HG PRO 28 -11.404 3.959 1.919
165 HD3 PRO 28 2HD PRO 28 -10.946 5.235 0.055
166 H LYS 29 H LYS 29 -7.478 1.740 2.065
167 HA LYS 29 HA LYS 29 -7.370 -0.385 0.025
168 HB3 LYS 29 2HB LYS 29 -5.250 -1.050 0.698
169 HG3 LYS 29 2HG LYS 29 -3.795 0.903 0.954
170 HD3 LYS 29 2HD LYS 29 -6.046 1.063 -1.031
171 HE3 LYS 29 2HE LYS 29 -3.521 2.639 -1.323
172 HZ1 LYS 29 3HZ LYS 29 -5.039 2.285 -3.220
173 HZ2 LYS 29 1HZ LYS 29 -4.849 3.918 -2.820
174 HZ3 LYS 29 2HZ LYS 29 -6.258 3.097 -2.373
175 H GLN 30 H GLN 30 -9.613 -0.503 1.224
176 HA GLN 30 HA GLN 30 -10.154 -1.313 3.703
177 HB3 GLN 30 2HB GLN 30 -11.286 -3.234 1.806
178 HG3 GLN 30 2HG GLN 30 -12.479 -1.041 3.483
179 HE21 GLN 30 1HE2 GLN 30 -14.810 -1.997 4.067
180 HE22 GLN 30 2HE2 GLN 30 -15.789 -2.288 2.675
181 H THR 31 H THR 31 -9.345 -2.715 5.102
182 HA THR 31 HA THR 31 -7.511 -4.764 4.245
183 HB THR 31 HB THR 31 -7.072 -5.165 6.558
184 HG1 THR 31 1HG THR 31 -9.584 -3.947 6.907
185 HG21 THR 31 3HG2 THR 31 -6.111 -3.167 7.062
186 HG22 THR 31 1HG2 THR 31 -7.592 -2.257 6.766
187 HG23 THR 31 2HG2 THR 31 -6.599 -2.789 5.410
188 H GLU 32 H GLU 32 -7.961 -6.779 6.095
189 HA GLU 32 HA GLU 32 -10.231 -8.118 4.859
190 HB3 GLU 32 2HB GLU 32 -8.571 -9.510 6.887
191 HG3 GLU 32 2HG GLU 32 -8.673 -10.685 4.261
192 H CYS 33 H CYS 33 -10.215 -6.019 7.162
193 HA CYS 33 HA CYS 33 -11.988 -7.553 8.951
194 HB3 CYS 33 2HB CYS 33 -9.815 -6.704 9.960
195 H GLY 34 H GLY 34 -11.511 -4.666 7.062
196 HA2 GLY 34 1HA GLY 34 -13.748 -3.890 6.141
197 HA3 GLY 34 2HA GLY 34 -14.204 -3.734 7.831
198 H HIS 35 H HIS 35 -11.929 -2.613 8.913
199 HA HIS 35 HA HIS 35 -12.284 0.089 8.504
200 HB3 HIS 35 2HB HIS 35 -9.990 0.342 9.546
201 HD2 HIS 35 2HD HIS 35 -12.086 1.304 11.293
202 HE1 HIS 35 1HE HIS 35 -12.249 -2.323 13.489
203 HE2 HIS 35 2HE HIS 35 -13.001 0.078 13.379
204 H ARG 36 H ARG 36 -10.361 1.590 7.829
205 HA ARG 36 HA ARG 36 -9.064 0.640 5.389
206 HB3 ARG 36 2HB ARG 36 -9.789 2.784 4.238
207 HG3 ARG 36 2HG ARG 36 -11.509 0.458 4.771
208 HD3 ARG 36 2HD ARG 36 -12.946 2.159 3.010
209 HE ARG 36 HE ARG 36 -13.667 0.330 4.812
210 HH11 ARG 36 1HH1 ARG 36 -14.456 3.709 4.541
211 HH12 ARG 36 2HH1 ARG 36 -16.013 3.539 5.283
212 HH21 ARG 36 1HH2 ARG 36 -15.713 0.093 5.791
213 HH22 ARG 36 2HH2 ARG 36 -16.727 1.482 5.994
214 H PHE 37 H PHE 37 -7.329 2.012 4.663
215 HA PHE 37 HA PHE 37 -6.440 4.067 6.542
216 HB3 PHE 37 2HB PHE 37 -4.094 3.012 6.384
217 HD1 PHE 37 1HD PHE 37 -6.575 0.470 7.388
218 HD2 PHE 37 2HD PHE 37 -4.023 3.632 8.656
219 HE1 PHE 37 1HE PHE 37 -6.984 -0.146 9.735
220 HE2 PHE 37 2HE PHE 37 -4.426 3.021 11.004
221 HZ PHE 37 HZ PHE 37 -5.908 1.129 11.547
222 H CYS 38 H CYS 38 -4.334 5.095 5.666
223 HA CYS 38 HA CYS 38 -4.802 5.671 2.837
224 HB3 CYS 38 2HB CYS 38 -4.706 7.537 4.500
225 H GLU 39 H GLU 39 -2.824 6.123 1.495
226 HA GLU 39 HA GLU 39 -1.331 3.899 1.037
227 HB3 GLU 39 2HB GLU 39 0.445 5.655 0.162
228 HG3 GLU 39 2HG GLU 39 -2.300 5.688 -1.058
229 H SER 40 H SER 40 -0.047 6.753 2.754
230 HA SER 40 HA SER 40 2.354 5.703 3.579
231 HB3 SER 40 2HB SER 40 2.031 7.281 5.616
232 HG SER 40 HG SER 40 1.719 8.374 3.015
233 H CYS 41 H CYS 41 -0.053 6.210 6.101
234 HA CYS 41 HA CYS 41 0.753 4.496 7.972
235 HB3 CYS 41 2HB CYS 41 -1.612 4.155 8.641
236 H MET 42 H MET 42 -1.297 3.505 5.236
237 HA MET 42 HA MET 42 -1.587 0.827 5.826
238 HB3 MET 42 2HB MET 42 -1.343 2.246 3.179
239 HG3 MET 42 2HG MET 42 -0.711 -0.102 2.836
240 HE1 MET 42 3HE MET 42 -3.474 0.213 5.576
241 HE2 MET 42 1HE MET 42 -4.317 0.408 4.040
242 HE3 MET 42 2HE MET 42 -4.626 -1.010 5.041
243 H ALA 43 H ALA 43 0.964 2.277 3.796
244 HA ALA 43 HA ALA 43 2.430 -0.067 3.380
245 HB1 ALA 43 3HB ALA 43 2.705 2.070 2.128
246 HB2 ALA 43 1HB ALA 43 3.561 2.721 3.526
247 HB3 ALA 43 2HB ALA 43 4.223 1.340 2.651
248 H ALA 44 H ALA 44 2.319 2.114 6.092
249 HA ALA 44 HA ALA 44 4.743 1.314 7.328
250 HB1 ALA 44 3HB ALA 44 2.380 2.903 8.089
251 HB2 ALA 44 1HB ALA 44 3.280 2.171 9.417
252 HB3 ALA 44 2HB ALA 44 4.098 3.252 8.286
253 H LEU 45 H LEU 45 1.358 0.487 8.108
254 HA LEU 45 HA LEU 45 1.861 -1.400 10.069
255 HB3 LEU 45 2HB LEU 45 -0.350 -2.242 9.670
256 HG LEU 45 HG LEU 45 -0.360 0.706 9.026
257 HD11 LEU 45 1HD1 LEU 45 -2.448 -0.759 8.529
258 HD12 LEU 45 2HD1 LEU 45 -2.632 0.754 9.415
259 HD13 LEU 45 3HD1 LEU 45 -2.624 -0.780 10.284
260 HD21 LEU 45 3HD2 LEU 45 0.037 1.093 11.179
261 HD22 LEU 45 1HD2 LEU 45 0.454 -0.614 11.337
262 HD23 LEU 45 2HD2 LEU 45 -1.190 -0.072 11.679
263 H LEU 46 H LEU 46 1.269 -2.026 6.607
264 HA LEU 46 HA LEU 46 1.657 -4.753 6.588
265 HB3 LEU 46 2HB LEU 46 2.207 -4.548 4.240
266 HG LEU 46 HG LEU 46 0.149 -2.500 5.050
267 HD11 LEU 46 1HD1 LEU 46 0.874 -3.543 2.320
268 HD12 LEU 46 2HD1 LEU 46 0.915 -1.870 2.877
269 HD13 LEU 46 3HD1 LEU 46 -0.630 -2.700 2.692
270 HD21 LEU 46 3HD2 LEU 46 -1.440 -4.219 4.429
271 HD22 LEU 46 1HD2 LEU 46 -0.328 -4.839 5.649
272 HD23 LEU 46 2HD2 LEU 46 -0.126 -5.299 3.959
273 H SER 47 H SER 47 4.029 -2.207 6.798
274 HA SER 47 HA SER 47 6.237 -4.080 6.444
275 HB3 SER 47 2HB SER 47 6.600 -1.193 7.180
276 HG SER 47 HG SER 47 8.418 -2.577 6.891
277 H SER 48 H SER 48 4.388 -4.181 8.765
278 HA SER 48 HA SER 48 6.293 -3.625 10.940
279 HB3 SER 48 2HB SER 48 3.313 -4.120 11.153
280 HG SER 48 HG SER 48 3.671 -4.043 13.213
281 H SER 49 H SER 49 5.870 -6.025 9.013
282 HA SER 49 HA SER 49 6.387 -8.248 9.167
283 HB3 SER 49 2HB SER 49 6.301 -8.633 12.040
284 HG SER 49 HG SER 49 7.862 -9.846 11.366
285 H SER 50 H SER 50 4.251 -7.390 11.894
286 HA SER 50 HA SER 50 2.351 -9.417 10.909
287 HB3 SER 50 2HB SER 50 2.120 -8.648 13.741
288 HG SER 50 HG SER 50 1.002 -10.412 13.295
289 HA PRO 51 HA PRO 51 0.353 -5.214 10.753
290 HB3 PRO 51 2HB PRO 51 0.979 -4.893 8.567
291 HG3 PRO 51 2HG PRO 51 1.497 -6.695 7.190
292 HD3 PRO 51 2HD PRO 51 2.803 -7.205 9.019
293 H LYS 52 H LYS 52 -1.535 -5.151 11.780
294 HA LYS 52 HA LYS 52 -3.546 -7.217 11.169
295 HB3 LYS 52 2HB LYS 52 -4.273 -7.182 13.392
296 HG3 LYS 52 2HG LYS 52 -1.309 -6.921 13.254
297 HD3 LYS 52 2HD LYS 52 -2.540 -7.689 15.842
298 HE3 LYS 52 2HE LYS 52 -0.209 -5.904 15.686
299 HZ1 LYS 52 3HZ LYS 52 -0.640 -8.532 17.002
300 HZ2 LYS 52 1HZ LYS 52 -0.906 -7.025 17.724
301 HZ3 LYS 52 2HZ LYS 52 0.658 -7.482 17.274
302 H CYS 53 H CYS 53 -3.616 -4.010 12.719
303 HA CYS 53 HA CYS 53 -4.736 -2.424 10.875
304 HB3 CYS 53 2HB CYS 53 -6.770 -4.384 11.868
305 H THR 54 H THR 54 -3.864 -0.864 12.183
306 HA THR 54 HA THR 54 -3.852 -0.403 14.794
307 HB THR 54 HB THR 54 -3.837 1.312 12.505
308 HG1 THR 54 1HG THR 54 -2.991 2.363 14.902
309 HG21 THR 54 3HG2 THR 54 -5.357 2.377 14.886
310 HG22 THR 54 1HG2 THR 54 -5.952 2.215 13.236
311 HG23 THR 54 2HG2 THR 54 -4.681 3.381 13.603
312 H ALA 55 H ALA 55 -6.722 -0.068 12.776
313 HA ALA 55 HA ALA 55 -8.456 1.148 14.563
314 HB1 ALA 55 3HB ALA 55 -9.701 -0.978 12.989
315 HB2 ALA 55 1HB ALA 55 -10.012 0.759 13.002
316 HB3 ALA 55 2HB ALA 55 -8.679 0.108 12.047
317 H CYS 56 H CYS 56 -8.701 -2.327 13.854
318 HA CYS 56 HA CYS 56 -9.262 -2.773 16.713
319 HB3 CYS 56 2HB CYS 56 -11.231 -3.198 15.364
320 H GLN 57 H GLN 57 -7.354 -3.678 13.984
321 HA GLN 57 HA GLN 57 -5.344 -4.808 13.973
322 HB3 GLN 57 2HB GLN 57 -4.372 -5.654 15.917
323 HG3 GLN 57 2HG GLN 57 -6.009 -4.061 17.662
324 HE21 GLN 57 1HE2 GLN 57 -3.748 -2.275 15.904
325 HE22 GLN 57 2HE2 GLN 57 -2.400 -2.465 16.967
326 H GLU 58 H GLU 58 -6.099 -6.101 12.315
327 HA GLU 58 HA GLU 58 -6.959 -8.789 13.141
328 HB3 GLU 58 2HB GLU 58 -8.178 -6.995 11.071
329 HG3 GLU 58 2HG GLU 58 -7.680 -9.809 10.706
330 H SER 59 H SER 59 -6.370 -7.333 9.959
331 HA SER 59 HA SER 59 -3.787 -8.462 9.624
332 HB3 SER 59 2HB SER 59 -5.202 -10.531 9.522
333 HG SER 59 HG SER 59 -6.913 -10.482 8.325
334 H ILE 60 H ILE 60 -2.755 -7.483 7.974
335 HA ILE 60 HA ILE 60 -4.364 -6.136 5.917
336 HB ILE 60 HB ILE 60 -1.946 -4.693 6.816
337 HG13 ILE 60 2HG1 ILE 60 -3.074 -5.440 8.943
338 HG21 ILE 60 1HG2 ILE 60 -4.383 -4.201 5.365
339 HG22 ILE 60 2HG2 ILE 60 -4.163 -3.005 6.642
340 HG23 ILE 60 3HG2 ILE 60 -2.903 -3.243 5.431
341 HD11 ILE 60 3HD1 ILE 60 -3.571 -2.536 8.891
342 HD12 ILE 60 1HD1 ILE 60 -2.648 -3.515 10.031
343 HD13 ILE 60 2HD1 ILE 60 -1.941 -3.068 8.478
344 H VAL 61 H VAL 61 -3.736 -6.803 3.983
345 HA VAL 61 HA VAL 61 -0.880 -7.184 3.454
346 HB VAL 61 HB VAL 61 -3.020 -9.204 2.776
347 HG11 VAL 61 1HG1 VAL 61 -0.511 -10.237 2.129
348 HG12 VAL 61 2HG1 VAL 61 -1.781 -9.740 1.008
349 HG13 VAL 61 3HG1 VAL 61 -0.520 -8.599 1.475
350 HG21 VAL 61 3HG2 VAL 61 -0.515 -9.547 4.417
351 HG22 VAL 61 1HG2 VAL 61 -2.109 -9.227 5.104
352 HG23 VAL 61 2HG2 VAL 61 -1.821 -10.711 4.194
353 H LYS 62 H LYS 62 -0.278 -6.188 1.648
354 HA LYS 62 HA LYS 62 -1.870 -4.583 0.102
355 HB3 LYS 62 2HB LYS 62 0.497 -4.347 -0.035
356 HG3 LYS 62 2HG LYS 62 0.830 -6.899 -1.547
357 HD3 LYS 62 2HD LYS 62 3.129 -6.672 -0.565
358 HE3 LYS 62 2HE LYS 62 2.670 -4.118 -1.978
359 HZ1 LYS 62 3HZ LYS 62 4.803 -5.633 -1.642
360 HZ2 LYS 62 1HZ LYS 62 4.591 -4.657 -3.007
361 HZ3 LYS 62 2HZ LYS 62 4.238 -6.309 -3.087
362 H ASP 63 H ASP 63 -1.012 -7.967 -0.503
363 HA ASP 63 HA ASP 63 -2.346 -8.174 -2.992
364 HB3 ASP 63 2HB ASP 63 -1.756 -10.397 -2.956
365 H LYS 64 H LYS 64 -3.375 -8.589 0.334
366 HA LYS 64 HA LYS 64 -6.000 -9.549 -0.491
367 HB3 LYS 64 2HB LYS 64 -6.439 -9.869 1.865
368 HG3 LYS 64 2HG LYS 64 -4.402 -11.194 2.594
369 HD3 LYS 64 2HD LYS 64 -5.297 -11.929 -0.175
370 HE3 LYS 64 2HE LYS 64 -4.043 -13.260 2.046
371 HZ1 LYS 64 3HZ LYS 64 -6.533 -13.801 2.362
372 HZ2 LYS 64 1HZ LYS 64 -5.406 -15.063 2.389
373 HZ3 LYS 64 2HZ LYS 64 -6.331 -14.787 1.002
374 H VAL 65 H VAL 65 -4.550 -6.622 -0.304
375 HA VAL 65 HA VAL 65 -6.803 -5.174 0.844
376 HB VAL 65 HB VAL 65 -4.018 -4.620 0.478
377 HG11 VAL 65 1HG1 VAL 65 -4.120 -2.343 -0.365
378 HG12 VAL 65 2HG1 VAL 65 -4.722 -3.474 -1.577
379 HG13 VAL 65 3HG1 VAL 65 -5.855 -2.502 -0.637
380 HG21 VAL 65 3HG2 VAL 65 -6.329 -3.425 1.946
381 HG22 VAL 65 1HG2 VAL 65 -4.878 -4.201 2.578
382 HG23 VAL 65 2HG2 VAL 65 -4.784 -2.575 1.903
383 H PHE 66 H PHE 66 -7.985 -3.587 -0.299
384 HA PHE 66 HA PHE 66 -8.335 -4.241 -3.116
385 HB3 PHE 66 2HB PHE 66 -10.272 -2.487 -2.755
386 HD1 PHE 66 2HD PHE 66 -9.542 -5.557 -0.758
387 HD2 PHE 66 1HD PHE 66 -12.112 -3.601 -3.529
388 HE1 PHE 66 2HE PHE 66 -10.936 -7.581 -0.888
389 HE2 PHE 66 1HE PHE 66 -13.511 -5.621 -3.663
390 HZ PHE 66 HZ PHE 66 -12.922 -7.615 -2.343
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -47.562 -6.829 -1.622
2 HA2 GLY 1 1HA GLY 1 -49.315 -8.204 -3.238
3 HA3 GLY 1 2HA GLY 1 -49.344 -6.554 -3.839
4 H SER 2 H SER 2 -47.254 -5.596 -4.454
5 HA SER 2 HA SER 2 -45.021 -7.342 -4.919
6 HB3 SER 2 2HB SER 2 -45.629 -6.349 -7.527
7 HG SER 2 HG SER 2 -45.808 -8.756 -7.820
8 H SER 3 H SER 3 -43.162 -6.214 -5.160
9 HA SER 3 HA SER 3 -43.347 -3.321 -4.948
10 HB3 SER 3 2HB SER 3 -41.709 -5.133 -3.738
11 HG SER 3 HG SER 3 -39.968 -5.432 -4.860
12 H GLY 4 H GLY 4 -41.302 -2.218 -6.109
13 HA2 GLY 4 1HA GLY 4 -40.308 -3.029 -8.529
14 HA3 GLY 4 2HA GLY 4 -41.902 -2.393 -8.909
15 H SER 5 H SER 5 -42.077 -0.279 -9.283
16 HA SER 5 HA SER 5 -40.106 1.453 -9.766
17 HB3 SER 5 2HB SER 5 -42.207 2.863 -8.312
18 HG SER 5 HG SER 5 -42.237 3.990 -10.146
19 H SER 6 H SER 6 -38.307 1.587 -8.544
20 HA SER 6 HA SER 6 -38.391 3.115 -6.137
21 HB3 SER 6 2HB SER 6 -39.011 0.964 -5.164
22 HG SER 6 HG SER 6 -37.976 -0.843 -5.620
23 H GLY 7 H GLY 7 -36.882 4.471 -6.979
24 HA2 GLY 7 1HA GLY 7 -34.159 3.436 -7.131
25 HA3 GLY 7 2HA GLY 7 -34.794 4.187 -8.588
26 H PHE 8 H PHE 8 -32.545 5.198 -7.409
27 HA PHE 8 HA PHE 8 -33.354 7.478 -5.783
28 HB3 PHE 8 2HB PHE 8 -30.888 7.934 -5.696
29 HD1 PHE 8 2HD PHE 8 -32.115 7.634 -3.463
30 HD2 PHE 8 1HD PHE 8 -30.408 4.418 -5.668
31 HE1 PHE 8 2HE PHE 8 -32.086 6.257 -1.424
32 HE2 PHE 8 1HE PHE 8 -30.376 3.036 -3.632
33 HZ PHE 8 HZ PHE 8 -31.215 3.955 -1.507
34 H VAL 9 H VAL 9 -32.932 9.642 -6.370
35 HA VAL 9 HA VAL 9 -32.339 10.124 -9.206
36 HB VAL 9 HB VAL 9 -34.830 10.131 -8.791
37 HG11 VAL 9 1HG1 VAL 9 -34.139 12.613 -7.221
38 HG12 VAL 9 2HG1 VAL 9 -35.768 12.131 -7.701
39 HG13 VAL 9 3HG1 VAL 9 -34.844 11.128 -6.582
40 HG21 VAL 9 3HG2 VAL 9 -34.595 12.824 -9.660
41 HG22 VAL 9 1HG2 VAL 9 -33.193 11.932 -10.254
42 HG23 VAL 9 2HG2 VAL 9 -34.822 11.371 -10.633
43 H LYS 10 H LYS 10 -30.935 10.485 -6.564
44 HA LYS 10 HA LYS 10 -30.179 13.283 -7.001
45 HB3 LYS 10 2HB LYS 10 -29.932 13.460 -4.453
46 HG3 LYS 10 2HG LYS 10 -32.566 13.425 -5.861
47 HD3 LYS 10 2HD LYS 10 -32.693 12.779 -3.335
48 HE3 LYS 10 2HE LYS 10 -33.012 15.354 -2.368
49 HZ1 LYS 10 3HZ LYS 10 -30.499 14.392 -1.594
50 HZ2 LYS 10 1HZ LYS 10 -31.535 13.064 -1.748
51 HZ3 LYS 10 2HZ LYS 10 -31.950 14.347 -0.727
52 H THR 11 H THR 11 -28.030 13.784 -6.479
53 HA THR 11 HA THR 11 -26.127 11.828 -6.991
54 HB THR 11 HB THR 11 -24.820 13.779 -5.435
55 HG1 THR 11 1HG THR 11 -25.730 15.680 -6.579
56 HG21 THR 11 3HG2 THR 11 -25.190 14.022 -8.398
57 HG22 THR 11 1HG2 THR 11 -24.302 12.658 -7.719
58 HG23 THR 11 2HG2 THR 11 -23.745 14.306 -7.427
59 H VAL 12 H VAL 12 -24.217 11.407 -5.427
60 HA VAL 12 HA VAL 12 -25.214 10.822 -2.724
61 HB VAL 12 HB VAL 12 -23.710 8.895 -4.500
62 HG11 VAL 12 1HG1 VAL 12 -24.663 8.360 -1.701
63 HG12 VAL 12 2HG1 VAL 12 -23.558 7.402 -2.688
64 HG13 VAL 12 3HG1 VAL 12 -23.042 8.962 -2.045
65 HG21 VAL 12 3HG2 VAL 12 -26.219 8.068 -3.228
66 HG22 VAL 12 1HG2 VAL 12 -26.393 9.359 -4.418
67 HG23 VAL 12 2HG2 VAL 12 -25.650 7.828 -4.880
68 H GLU 13 H GLU 13 -24.007 12.374 -1.714
69 HA GLU 13 HA GLU 13 -21.179 12.640 -2.273
70 HB3 GLU 13 2HB GLU 13 -21.209 14.491 -0.757
71 HG3 GLU 13 2HG GLU 13 -23.918 15.033 -1.642
72 H ASP 14 H ASP 14 -19.725 11.346 -1.387
73 HA ASP 14 HA ASP 14 -19.604 10.849 1.403
74 HB3 ASP 14 2HB ASP 14 -21.361 9.239 0.954
75 H LYS 15 H LYS 15 -17.750 9.461 1.983
76 HA LYS 15 HA LYS 15 -15.875 8.701 -0.045
77 HB3 LYS 15 2HB LYS 15 -15.051 10.810 -0.275
78 HG3 LYS 15 2HG LYS 15 -16.719 11.889 1.173
79 HD3 LYS 15 2HD LYS 15 -14.919 10.820 3.296
80 HE3 LYS 15 2HE LYS 15 -14.812 13.261 3.570
81 HZ1 LYS 15 3HZ LYS 15 -16.988 13.751 2.524
82 HZ2 LYS 15 1HZ LYS 15 -16.771 14.519 4.016
83 HZ3 LYS 15 2HZ LYS 15 -17.759 13.152 3.906
84 H TYR 16 H TYR 16 -13.625 8.294 1.143
85 HA TYR 16 HA TYR 16 -14.291 6.838 3.612
86 HB3 TYR 16 2HB TYR 16 -12.494 5.304 3.073
87 HD1 TYR 16 1HD TYR 16 -13.362 6.333 -0.345
88 HD2 TYR 16 2HD TYR 16 -14.394 3.826 2.933
89 HE1 TYR 16 1HE TYR 16 -14.860 5.045 -1.810
90 HE2 TYR 16 2HE TYR 16 -15.894 2.529 1.477
91 HH TYR 16 HH TYR 16 -15.815 2.666 -1.832
92 H LYS 17 H LYS 17 -12.300 6.483 5.044
93 HA LYS 17 HA LYS 17 -10.400 8.679 5.029
94 HB3 LYS 17 2HB LYS 17 -12.592 8.388 7.043
95 HG3 LYS 17 2HG LYS 17 -10.863 10.209 8.178
96 HD3 LYS 17 2HD LYS 17 -10.467 8.059 9.738
97 HE3 LYS 17 2HE LYS 17 -12.453 10.135 9.515
98 HZ1 LYS 17 3HZ LYS 17 -13.570 8.214 11.297
99 HZ2 LYS 17 1HZ LYS 17 -13.611 7.659 9.700
100 HZ3 LYS 17 2HZ LYS 17 -14.331 9.137 10.100
101 H CYS 18 H CYS 18 -8.506 8.197 6.063
102 HA CYS 18 HA CYS 18 -7.894 5.489 6.530
103 HB3 CYS 18 2HB CYS 18 -6.413 8.029 7.215
104 H GLU 19 H GLU 19 -7.693 4.292 8.370
105 HA GLU 19 HA GLU 19 -9.090 5.275 10.706
106 HB3 GLU 19 2HB GLU 19 -8.283 2.819 11.452
107 HG3 GLU 19 2HG GLU 19 -10.351 1.948 10.806
108 H LYS 20 H LYS 20 -6.429 6.358 9.954
109 HA LYS 20 HA LYS 20 -5.105 5.875 12.535
110 HB3 LYS 20 2HB LYS 20 -3.183 6.554 10.496
111 HG3 LYS 20 2HG LYS 20 -3.557 4.283 12.406
112 HD3 LYS 20 2HD LYS 20 -1.262 4.555 10.471
113 HE3 LYS 20 2HE LYS 20 -0.284 2.835 11.542
114 HZ1 LYS 20 3HZ LYS 20 -0.934 4.401 13.357
115 HZ2 LYS 20 1HZ LYS 20 -0.639 2.815 13.866
116 HZ3 LYS 20 2HZ LYS 20 -2.229 3.373 13.714
117 H CYS 21 H CYS 21 -4.726 7.972 9.669
118 HA CYS 21 HA CYS 21 -4.370 10.258 11.469
119 HB3 CYS 21 2HB CYS 21 -2.601 10.095 9.887
120 H HIS 22 H HIS 22 -6.863 8.774 10.040
121 HA HIS 22 HA HIS 22 -8.983 9.369 9.464
122 HB3 HIS 22 2HB HIS 22 -9.865 10.794 10.952
123 HD2 HIS 22 2HD HIS 22 -7.693 9.102 12.505
124 HE1 HIS 22 1HE HIS 22 -6.379 12.765 14.195
125 HE2 HIS 22 2HE HIS 22 -6.276 10.252 14.338
126 H LEU 23 H LEU 23 -6.694 9.928 7.657
127 HA LEU 23 HA LEU 23 -7.225 12.342 6.248
128 HB3 LEU 23 2HB LEU 23 -5.992 10.692 4.434
129 HG LEU 23 HG LEU 23 -4.814 12.486 6.523
130 HD11 LEU 23 1HD1 LEU 23 -2.843 11.760 4.610
131 HD12 LEU 23 2HD1 LEU 23 -3.458 10.288 5.361
132 HD13 LEU 23 3HD1 LEU 23 -2.801 11.581 6.364
133 HD21 LEU 23 3HD2 LEU 23 -4.818 12.564 3.507
134 HD22 LEU 23 1HD2 LEU 23 -4.197 13.810 4.590
135 HD23 LEU 23 2HD2 LEU 23 -5.924 13.455 4.553
136 H VAL 24 H VAL 24 -8.930 12.758 5.025
137 HA VAL 24 HA VAL 24 -10.784 10.757 4.222
138 HB VAL 24 HB VAL 24 -10.527 13.691 3.637
139 HG11 VAL 24 1HG1 VAL 24 -12.203 11.678 2.233
140 HG12 VAL 24 2HG1 VAL 24 -12.918 13.249 2.604
141 HG13 VAL 24 3HG1 VAL 24 -11.456 13.153 1.621
142 HG21 VAL 24 3HG2 VAL 24 -11.555 12.395 5.766
143 HG22 VAL 24 1HG2 VAL 24 -12.124 13.968 5.208
144 HG23 VAL 24 2HG2 VAL 24 -12.987 12.502 4.744
145 H LEU 25 H LEU 25 -10.465 9.363 2.626
146 HA LEU 25 HA LEU 25 -9.101 10.306 0.190
147 HB3 LEU 25 2HB LEU 25 -7.605 8.690 0.404
148 HG LEU 25 HG LEU 25 -9.050 8.133 2.939
149 HD11 LEU 25 1HD1 LEU 25 -6.790 6.341 2.442
150 HD12 LEU 25 2HD1 LEU 25 -8.232 5.978 1.494
151 HD13 LEU 25 3HD1 LEU 25 -8.325 6.039 3.254
152 HD21 LEU 25 3HD2 LEU 25 -6.193 8.712 2.173
153 HD22 LEU 25 1HD2 LEU 25 -6.744 8.411 3.821
154 HD23 LEU 25 2HD2 LEU 25 -7.340 9.816 2.935
155 H CYS 26 H CYS 26 -9.626 8.870 -1.738
156 HA CYS 26 HA CYS 26 -12.527 8.421 -1.765
157 HB3 CYS 26 2HB CYS 26 -10.587 8.834 -4.050
158 H SER 27 H SER 27 -9.443 6.901 -2.499
159 HA SER 27 HA SER 27 -10.846 4.321 -2.712
160 HB3 SER 27 2HB SER 27 -8.572 5.344 -4.420
161 HG SER 27 HG SER 27 -9.557 2.708 -4.084
162 HA PRO 28 HA PRO 28 -7.707 4.148 0.673
163 HB3 PRO 28 2HB PRO 28 -9.339 4.494 2.253
164 HG3 PRO 28 2HG PRO 28 -11.566 3.997 1.806
165 HD3 PRO 28 2HD PRO 28 -11.056 5.250 -0.061
166 H LYS 29 H LYS 29 -7.608 1.870 2.164
167 HA LYS 29 HA LYS 29 -7.356 -0.285 0.168
168 HB3 LYS 29 2HB LYS 29 -5.290 -0.974 1.106
169 HG3 LYS 29 2HG LYS 29 -3.816 0.921 0.960
170 HD3 LYS 29 2HD LYS 29 -5.977 1.678 -0.950
171 HE3 LYS 29 2HE LYS 29 -3.024 1.531 -0.878
172 HZ1 LYS 29 3HZ LYS 29 -3.381 0.029 -2.664
173 HZ2 LYS 29 1HZ LYS 29 -2.994 1.527 -3.351
174 HZ3 LYS 29 2HZ LYS 29 -4.599 0.993 -3.333
175 H GLN 30 H GLN 30 -9.672 -0.220 1.443
176 HA GLN 30 HA GLN 30 -10.166 -1.131 3.905
177 HB3 GLN 30 2HB GLN 30 -11.502 -2.786 1.856
178 HG3 GLN 30 2HG GLN 30 -12.559 -0.809 3.865
179 HE21 GLN 30 1HE2 GLN 30 -14.680 -2.625 4.472
180 HE22 GLN 30 2HE2 GLN 30 -15.802 -2.557 3.161
181 H THR 31 H THR 31 -8.911 -2.464 5.054
182 HA THR 31 HA THR 31 -7.401 -4.597 4.072
183 HB THR 31 HB THR 31 -6.959 -5.208 6.307
184 HG1 THR 31 1HG THR 31 -9.334 -3.822 7.071
185 HG21 THR 31 3HG2 THR 31 -6.172 -3.237 7.180
186 HG22 THR 31 1HG2 THR 31 -7.659 -2.358 6.824
187 HG23 THR 31 2HG2 THR 31 -6.518 -2.721 5.529
188 H GLU 32 H GLU 32 -8.177 -6.637 6.021
189 HA GLU 32 HA GLU 32 -10.391 -7.814 4.492
190 HB3 GLU 32 2HB GLU 32 -8.615 -9.331 6.382
191 HG3 GLU 32 2HG GLU 32 -8.955 -10.978 4.344
192 H CYS 33 H CYS 33 -10.308 -5.956 6.996
193 HA CYS 33 HA CYS 33 -12.106 -7.597 8.657
194 HB3 CYS 33 2HB CYS 33 -9.995 -6.812 9.762
195 H GLY 34 H GLY 34 -11.661 -4.561 6.983
196 HA2 GLY 34 1HA GLY 34 -13.956 -3.827 6.092
197 HA3 GLY 34 2HA GLY 34 -14.362 -3.713 7.799
198 H HIS 35 H HIS 35 -12.073 -2.591 8.840
199 HA HIS 35 HA HIS 35 -12.463 0.117 8.480
200 HB3 HIS 35 2HB HIS 35 -10.208 0.399 9.540
201 HD2 HIS 35 2HD HIS 35 -12.252 1.160 11.405
202 HE1 HIS 35 1HE HIS 35 -12.309 -2.626 13.318
203 HE2 HIS 35 2HE HIS 35 -13.108 -0.239 13.406
204 H ARG 36 H ARG 36 -10.382 1.562 7.883
205 HA ARG 36 HA ARG 36 -9.203 0.677 5.369
206 HB3 ARG 36 2HB ARG 36 -9.882 2.836 4.271
207 HG3 ARG 36 2HG ARG 36 -11.852 0.722 4.975
208 HD3 ARG 36 2HD ARG 36 -12.635 2.884 3.077
209 HE ARG 36 HE ARG 36 -14.556 1.511 4.749
210 HH11 ARG 36 1HH1 ARG 36 -12.819 1.550 1.732
211 HH12 ARG 36 2HH1 ARG 36 -13.956 0.530 0.915
212 HH21 ARG 36 1HH2 ARG 36 -16.060 0.167 3.683
213 HH22 ARG 36 2HH2 ARG 36 -15.800 -0.255 2.024
214 H PHE 37 H PHE 37 -7.493 2.125 4.612
215 HA PHE 37 HA PHE 37 -6.494 4.061 6.542
216 HB3 PHE 37 2HB PHE 37 -4.181 2.932 6.341
217 HD1 PHE 37 1HD PHE 37 -6.552 0.326 7.349
218 HD2 PHE 37 2HD PHE 37 -4.246 3.669 8.623
219 HE1 PHE 37 1HE PHE 37 -6.950 -0.297 9.695
220 HE2 PHE 37 2HE PHE 37 -4.641 3.051 10.971
221 HZ PHE 37 HZ PHE 37 -5.993 1.065 11.510
222 H CYS 38 H CYS 38 -4.395 5.069 5.672
223 HA CYS 38 HA CYS 38 -4.844 5.668 2.844
224 HB3 CYS 38 2HB CYS 38 -4.747 7.524 4.518
225 H GLU 39 H GLU 39 -2.872 6.090 1.502
226 HA GLU 39 HA GLU 39 -1.385 3.863 1.054
227 HB3 GLU 39 2HB GLU 39 0.415 5.697 0.255
228 HG3 GLU 39 2HG GLU 39 -2.091 5.809 -1.303
229 H SER 40 H SER 40 -0.063 6.713 2.751
230 HA SER 40 HA SER 40 2.318 5.647 3.592
231 HB3 SER 40 2HB SER 40 1.844 7.207 5.697
232 HG SER 40 HG SER 40 1.881 8.697 3.377
233 H CYS 41 H CYS 41 -0.118 6.153 6.091
234 HA CYS 41 HA CYS 41 0.674 4.448 7.977
235 HB3 CYS 41 2HB CYS 41 -1.715 4.068 8.586
236 H MET 42 H MET 42 -1.277 3.445 5.178
237 HA MET 42 HA MET 42 -1.576 0.763 5.777
238 HB3 MET 42 2HB MET 42 -1.245 2.139 3.112
239 HG3 MET 42 2HG MET 42 -0.872 -0.496 3.303
240 HE1 MET 42 3HE MET 42 -3.487 0.401 5.312
241 HE2 MET 42 1HE MET 42 -4.271 -1.173 5.450
242 HE3 MET 42 2HE MET 42 -2.518 -1.043 5.601
243 H ALA 43 H ALA 43 0.959 2.158 3.685
244 HA ALA 43 HA ALA 43 2.459 -0.184 3.407
245 HB1 ALA 43 3HB ALA 43 2.801 2.636 2.803
246 HB2 ALA 43 1HB ALA 43 4.317 1.848 3.237
247 HB3 ALA 43 2HB ALA 43 3.342 1.214 1.912
248 H ALA 44 H ALA 44 2.173 1.994 6.055
249 HA ALA 44 HA ALA 44 4.677 1.378 7.299
250 HB1 ALA 44 3HB ALA 44 2.211 2.512 8.607
251 HB2 ALA 44 1HB ALA 44 3.879 2.635 9.166
252 HB3 ALA 44 2HB ALA 44 3.377 3.473 7.696
253 H LEU 45 H LEU 45 1.309 0.394 7.909
254 HA LEU 45 HA LEU 45 1.847 -1.344 10.040
255 HB3 LEU 45 2HB LEU 45 -0.341 -2.309 9.587
256 HG LEU 45 HG LEU 45 -0.392 0.673 9.137
257 HD11 LEU 45 1HD1 LEU 45 -2.452 -0.635 8.426
258 HD12 LEU 45 2HD1 LEU 45 -2.691 0.649 9.610
259 HD13 LEU 45 3HD1 LEU 45 -2.653 -1.034 10.133
260 HD21 LEU 45 3HD2 LEU 45 0.032 0.873 11.306
261 HD22 LEU 45 1HD2 LEU 45 0.304 -0.867 11.390
262 HD23 LEU 45 2HD2 LEU 45 -1.303 -0.211 11.700
263 H LEU 46 H LEU 46 1.644 -1.941 6.552
264 HA LEU 46 HA LEU 46 1.884 -4.702 6.547
265 HB3 LEU 46 2HB LEU 46 2.798 -4.471 4.290
266 HG LEU 46 HG LEU 46 0.605 -2.469 4.821
267 HD11 LEU 46 1HD1 LEU 46 1.473 -1.799 2.761
268 HD12 LEU 46 2HD1 LEU 46 0.159 -2.894 2.334
269 HD13 LEU 46 3HD1 LEU 46 1.829 -3.455 2.266
270 HD21 LEU 46 3HD2 LEU 46 -0.512 -4.370 5.232
271 HD22 LEU 46 1HD2 LEU 46 0.728 -5.379 4.487
272 HD23 LEU 46 2HD2 LEU 46 -0.478 -4.576 3.480
273 H SER 47 H SER 47 4.294 -2.255 7.121
274 HA SER 47 HA SER 47 6.463 -4.202 7.003
275 HB3 SER 47 2HB SER 47 6.769 -1.316 7.803
276 HG SER 47 HG SER 47 8.808 -1.670 7.294
277 H SER 48 H SER 48 4.392 -4.416 9.044
278 HA SER 48 HA SER 48 5.959 -3.865 11.474
279 HB3 SER 48 2HB SER 48 3.010 -4.512 11.336
280 HG SER 48 HG SER 48 3.177 -4.378 13.414
281 H SER 49 H SER 49 6.388 -6.118 9.672
282 HA SER 49 HA SER 49 6.457 -8.420 9.633
283 HB3 SER 49 2HB SER 49 7.001 -8.676 12.485
284 HG SER 49 HG SER 49 8.984 -8.713 10.523
285 H SER 50 H SER 50 3.812 -7.266 10.324
286 HA SER 50 HA SER 50 2.255 -9.444 10.606
287 HB3 SER 50 2HB SER 50 1.742 -9.032 13.242
288 HG SER 50 HG SER 50 3.559 -10.845 13.310
289 HA PRO 51 HA PRO 51 0.268 -5.210 10.454
290 HB3 PRO 51 2HB PRO 51 0.878 -4.850 8.269
291 HG3 PRO 51 2HG PRO 51 1.406 -6.627 6.864
292 HD3 PRO 51 2HD PRO 51 2.727 -7.151 8.679
293 H LYS 52 H LYS 52 -1.618 -5.175 11.486
294 HA LYS 52 HA LYS 52 -3.615 -7.248 10.851
295 HB3 LYS 52 2HB LYS 52 -4.347 -7.237 13.085
296 HG3 LYS 52 2HG LYS 52 -1.395 -7.128 12.849
297 HD3 LYS 52 2HD LYS 52 -2.531 -7.672 15.541
298 HE3 LYS 52 2HE LYS 52 0.045 -6.478 14.519
299 HZ1 LYS 52 3HZ LYS 52 -1.090 -6.317 17.072
300 HZ2 LYS 52 1HZ LYS 52 0.448 -5.817 16.576
301 HZ3 LYS 52 2HZ LYS 52 0.217 -7.388 17.159
302 H CYS 53 H CYS 53 -3.699 -4.077 12.474
303 HA CYS 53 HA CYS 53 -4.844 -2.459 10.671
304 HB3 CYS 53 2HB CYS 53 -6.856 -4.453 11.640
305 H THR 54 H THR 54 -4.029 -0.879 11.967
306 HA THR 54 HA THR 54 -3.955 -0.467 14.589
307 HB THR 54 HB THR 54 -4.078 1.292 12.329
308 HG1 THR 54 1HG THR 54 -2.374 0.913 13.977
309 HG21 THR 54 3HG2 THR 54 -5.473 2.303 14.810
310 HG22 THR 54 1HG2 THR 54 -6.201 2.082 13.219
311 HG23 THR 54 2HG2 THR 54 -4.951 3.304 13.455
312 H ALA 55 H ALA 55 -6.887 -0.161 12.651
313 HA ALA 55 HA ALA 55 -8.603 0.947 14.530
314 HB1 ALA 55 3HB ALA 55 -8.862 -0.018 11.977
315 HB2 ALA 55 1HB ALA 55 -9.856 -1.135 12.913
316 HB3 ALA 55 2HB ALA 55 -10.175 0.599 12.980
317 H CYS 56 H CYS 56 -8.799 -2.500 13.681
318 HA CYS 56 HA CYS 56 -9.282 -3.076 16.531
319 HB3 CYS 56 2HB CYS 56 -11.263 -3.508 15.205
320 H GLN 57 H GLN 57 -7.439 -3.866 13.705
321 HA GLN 57 HA GLN 57 -5.403 -4.939 13.596
322 HB3 GLN 57 2HB GLN 57 -4.325 -5.774 15.486
323 HG3 GLN 57 2HG GLN 57 -5.929 -4.265 17.328
324 HE21 GLN 57 1HE2 GLN 57 -3.580 -2.896 15.131
325 HE22 GLN 57 2HE2 GLN 57 -2.271 -2.842 16.257
326 H GLU 58 H GLU 58 -6.237 -6.220 11.953
327 HA GLU 58 HA GLU 58 -6.989 -8.941 12.783
328 HB3 GLU 58 2HB GLU 58 -8.301 -7.153 10.766
329 HG3 GLU 58 2HG GLU 58 -7.676 -9.280 9.604
330 H SER 59 H SER 59 -6.395 -7.330 9.664
331 HA SER 59 HA SER 59 -3.849 -8.491 9.245
332 HB3 SER 59 2HB SER 59 -5.305 -10.536 9.069
333 HG SER 59 HG SER 59 -6.695 -10.710 7.372
334 H ILE 60 H ILE 60 -2.823 -7.471 7.613
335 HA ILE 60 HA ILE 60 -4.432 -6.027 5.627
336 HB ILE 60 HB ILE 60 -2.012 -4.626 6.595
337 HG13 ILE 60 2HG1 ILE 60 -3.170 -5.445 8.678
338 HG21 ILE 60 1HG2 ILE 60 -4.332 -3.000 6.438
339 HG22 ILE 60 2HG2 ILE 60 -2.937 -3.036 5.359
340 HG23 ILE 60 3HG2 ILE 60 -4.323 -4.079 5.043
341 HD11 ILE 60 3HD1 ILE 60 -2.606 -3.605 9.795
342 HD12 ILE 60 1HD1 ILE 60 -2.107 -2.975 8.226
343 HD13 ILE 60 2HD1 ILE 60 -3.705 -2.588 8.865
344 H VAL 61 H VAL 61 -3.863 -7.133 3.842
345 HA VAL 61 HA VAL 61 -0.984 -7.323 3.232
346 HB VAL 61 HB VAL 61 -3.150 -9.313 2.547
347 HG11 VAL 61 1HG1 VAL 61 -1.212 -10.601 1.544
348 HG12 VAL 61 2HG1 VAL 61 -1.776 -9.201 0.630
349 HG13 VAL 61 3HG1 VAL 61 -0.306 -9.089 1.597
350 HG21 VAL 61 3HG2 VAL 61 -2.412 -9.649 4.777
351 HG22 VAL 61 1HG2 VAL 61 -1.594 -10.861 3.790
352 HG23 VAL 61 2HG2 VAL 61 -0.723 -9.424 4.326
353 H LYS 62 H LYS 62 -0.428 -6.127 1.547
354 HA LYS 62 HA LYS 62 -1.962 -4.532 0.005
355 HB3 LYS 62 2HB LYS 62 0.394 -4.342 -0.184
356 HG3 LYS 62 2HG LYS 62 0.761 -6.842 -1.734
357 HD3 LYS 62 2HD LYS 62 2.926 -6.687 -0.292
358 HE3 LYS 62 2HE LYS 62 2.125 -4.980 -2.607
359 HZ1 LYS 62 3HZ LYS 62 3.700 -3.524 -1.926
360 HZ2 LYS 62 1HZ LYS 62 4.732 -4.649 -2.656
361 HZ3 LYS 62 2HZ LYS 62 4.524 -4.656 -0.977
362 H ASP 63 H ASP 63 -1.151 -7.903 -0.765
363 HA ASP 63 HA ASP 63 -2.492 -8.047 -3.219
364 HB3 ASP 63 2HB ASP 63 -2.361 -10.410 -1.380
365 H LYS 64 H LYS 64 -3.618 -8.651 0.078
366 HA LYS 64 HA LYS 64 -6.294 -9.287 -0.853
367 HB3 LYS 64 2HB LYS 64 -6.800 -9.831 1.405
368 HG3 LYS 64 2HG LYS 64 -4.391 -10.881 2.128
369 HD3 LYS 64 2HD LYS 64 -5.999 -12.183 -0.034
370 HE3 LYS 64 2HE LYS 64 -5.155 -13.322 2.608
371 HZ1 LYS 64 3HZ LYS 64 -4.899 -15.160 0.608
372 HZ2 LYS 64 1HZ LYS 64 -6.302 -14.313 0.187
373 HZ3 LYS 64 2HZ LYS 64 -6.184 -15.054 1.703
374 H VAL 65 H VAL 65 -4.568 -6.509 -0.229
375 HA VAL 65 HA VAL 65 -6.849 -4.989 0.776
376 HB VAL 65 HB VAL 65 -4.045 -4.717 1.040
377 HG11 VAL 65 1HG1 VAL 65 -3.750 -2.345 0.411
378 HG12 VAL 65 2HG1 VAL 65 -3.999 -3.398 -0.983
379 HG13 VAL 65 3HG1 VAL 65 -5.320 -2.388 -0.391
380 HG21 VAL 65 3HG2 VAL 65 -5.146 -4.194 2.949
381 HG22 VAL 65 1HG2 VAL 65 -5.010 -2.558 2.305
382 HG23 VAL 65 2HG2 VAL 65 -6.506 -3.466 2.094
383 H PHE 66 H PHE 66 -8.006 -3.568 -0.409
384 HA PHE 66 HA PHE 66 -7.178 -2.314 -2.770
385 HB3 PHE 66 2HB PHE 66 -7.215 -4.284 -4.008
386 HD1 PHE 66 2HD PHE 66 -10.778 -4.619 -3.162
387 HD2 PHE 66 1HD PHE 66 -6.891 -6.320 -2.822
388 HE1 PHE 66 2HE PHE 66 -11.771 -6.714 -2.341
389 HE2 PHE 66 1HE PHE 66 -7.878 -8.419 -2.002
390 HZ PHE 66 HZ PHE 66 -10.320 -8.618 -1.758
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -59.470 11.484 -1.700
2 HA2 GLY 1 1HA GLY 1 -57.382 10.866 -0.811
3 HA3 GLY 1 2HA GLY 1 -57.560 9.738 -2.148
4 H SER 2 H SER 2 -55.124 10.834 -0.963
5 HA SER 2 HA SER 2 -53.960 11.920 -3.427
6 HB3 SER 2 2HB SER 2 -52.911 12.976 -0.845
7 HG SER 2 HG SER 2 -53.106 13.775 -3.519
8 H SER 3 H SER 3 -53.352 9.628 -3.590
9 HA SER 3 HA SER 3 -51.115 8.901 -1.824
10 HB3 SER 3 2HB SER 3 -52.329 6.932 -3.715
11 HG SER 3 HG SER 3 -50.922 5.907 -2.503
12 H GLY 4 H GLY 4 -49.618 10.247 -2.952
13 HA2 GLY 4 1HA GLY 4 -47.832 9.172 -4.596
14 HA3 GLY 4 2HA GLY 4 -49.081 9.618 -5.749
15 H SER 5 H SER 5 -46.361 10.661 -4.052
16 HA SER 5 HA SER 5 -46.730 13.372 -5.097
17 HB3 SER 5 2HB SER 5 -46.867 12.720 -2.342
18 HG SER 5 HG SER 5 -45.123 14.112 -1.628
19 H SER 6 H SER 6 -44.592 14.629 -4.866
20 HA SER 6 HA SER 6 -42.626 13.345 -6.359
21 HB3 SER 6 2HB SER 6 -42.676 15.858 -4.723
22 HG SER 6 HG SER 6 -40.424 15.518 -6.240
23 H GLY 7 H GLY 7 -41.968 11.397 -5.505
24 HA2 GLY 7 1HA GLY 7 -41.132 11.085 -2.794
25 HA3 GLY 7 2HA GLY 7 -40.885 9.931 -4.097
26 H PHE 8 H PHE 8 -39.261 11.584 -1.879
27 HA PHE 8 HA PHE 8 -36.952 12.110 -3.630
28 HB3 PHE 8 2HB PHE 8 -36.239 13.337 -1.346
29 HD1 PHE 8 1HD PHE 8 -38.199 13.522 -4.385
30 HD2 PHE 8 2HD PHE 8 -36.143 15.797 -1.433
31 HE1 PHE 8 1HE PHE 8 -38.201 15.468 -5.889
32 HE2 PHE 8 2HE PHE 8 -36.142 17.748 -2.932
33 HZ PHE 8 HZ PHE 8 -37.172 17.585 -5.163
34 H VAL 9 H VAL 9 -35.190 10.890 -3.413
35 HA VAL 9 HA VAL 9 -35.172 8.809 -1.385
36 HB VAL 9 HB VAL 9 -34.621 8.268 -3.739
37 HG11 VAL 9 1HG1 VAL 9 -32.989 9.266 -4.924
38 HG12 VAL 9 2HG1 VAL 9 -33.178 10.563 -3.743
39 HG13 VAL 9 3HG1 VAL 9 -31.901 9.364 -3.540
40 HG21 VAL 9 3HG2 VAL 9 -32.932 7.661 -1.418
41 HG22 VAL 9 1HG2 VAL 9 -33.727 6.578 -2.561
42 HG23 VAL 9 2HG2 VAL 9 -32.185 7.325 -2.979
43 H LYS 10 H LYS 10 -33.838 8.704 0.330
44 HA LYS 10 HA LYS 10 -32.247 11.053 0.948
45 HB3 LYS 10 2HB LYS 10 -31.876 9.478 3.091
46 HG3 LYS 10 2HG LYS 10 -33.108 11.712 2.918
47 HD3 LYS 10 2HD LYS 10 -35.647 10.382 3.411
48 HE3 LYS 10 2HE LYS 10 -34.785 12.888 2.745
49 HZ1 LYS 10 3HZ LYS 10 -34.478 12.310 0.434
50 HZ2 LYS 10 1HZ LYS 10 -35.798 13.358 0.589
51 HZ3 LYS 10 2HZ LYS 10 -36.055 11.706 0.334
52 H THR 11 H THR 11 -30.069 11.152 1.028
53 HA THR 11 HA THR 11 -28.363 8.896 1.225
54 HB THR 11 HB THR 11 -27.556 9.885 -1.311
55 HG1 THR 11 1HG THR 11 -29.854 10.439 -1.478
56 HG21 THR 11 3HG2 THR 11 -26.913 7.734 -1.018
57 HG22 THR 11 1HG2 THR 11 -28.441 7.389 -1.825
58 HG23 THR 11 2HG2 THR 11 -28.340 7.325 -0.066
59 H VAL 12 H VAL 12 -26.064 9.489 1.004
60 HA VAL 12 HA VAL 12 -25.576 12.381 1.184
61 HB VAL 12 HB VAL 12 -25.721 11.111 3.463
62 HG11 VAL 12 1HG1 VAL 12 -23.728 10.045 4.202
63 HG12 VAL 12 2HG1 VAL 12 -24.169 9.304 2.663
64 HG13 VAL 12 3HG1 VAL 12 -22.868 10.492 2.730
65 HG21 VAL 12 3HG2 VAL 12 -23.225 12.564 3.572
66 HG22 VAL 12 1HG2 VAL 12 -24.415 13.399 2.573
67 HG23 VAL 12 2HG2 VAL 12 -24.801 12.983 4.244
68 H GLU 13 H GLU 13 -23.938 13.020 -0.053
69 HA GLU 13 HA GLU 13 -22.234 10.995 -1.282
70 HB3 GLU 13 2HB GLU 13 -21.457 13.083 -2.619
71 HG3 GLU 13 2HG GLU 13 -24.182 11.863 -2.827
72 H ASP 14 H ASP 14 -20.219 10.631 -0.647
73 HA ASP 14 HA ASP 14 -18.460 12.685 0.247
74 HB3 ASP 14 2HB ASP 14 -18.315 11.021 2.491
75 H LYS 15 H LYS 15 -16.577 11.265 1.607
76 HA LYS 15 HA LYS 15 -15.949 9.005 -0.174
77 HB3 LYS 15 2HB LYS 15 -13.871 9.802 -0.659
78 HG3 LYS 15 2HG LYS 15 -15.715 11.792 -0.831
79 HD3 LYS 15 2HD LYS 15 -14.275 12.518 1.397
80 HE3 LYS 15 2HE LYS 15 -12.314 12.913 -0.124
81 HZ1 LYS 15 3HZ LYS 15 -14.082 15.060 -1.162
82 HZ2 LYS 15 1HZ LYS 15 -13.405 13.785 -2.046
83 HZ3 LYS 15 2HZ LYS 15 -12.410 14.999 -1.414
84 H TYR 16 H TYR 16 -13.591 8.192 0.969
85 HA TYR 16 HA TYR 16 -14.544 7.167 3.541
86 HB3 TYR 16 2HB TYR 16 -12.772 5.461 3.271
87 HD1 TYR 16 2HD TYR 16 -15.716 6.581 1.880
88 HD2 TYR 16 1HD TYR 16 -12.734 3.609 1.264
89 HE1 TYR 16 2HE TYR 16 -17.344 5.214 0.644
90 HE2 TYR 16 1HE TYR 16 -14.353 2.234 0.025
91 HH TYR 16 HH TYR 16 -16.591 1.951 -0.393
92 H LYS 17 H LYS 17 -12.410 6.522 4.931
93 HA LYS 17 HA LYS 17 -10.489 8.689 5.018
94 HB3 LYS 17 2HB LYS 17 -12.671 8.352 7.033
95 HG3 LYS 17 2HG LYS 17 -10.888 10.066 8.250
96 HD3 LYS 17 2HD LYS 17 -10.543 7.837 9.700
97 HE3 LYS 17 2HE LYS 17 -12.494 9.956 9.577
98 HZ1 LYS 17 3HZ LYS 17 -13.711 7.519 9.622
99 HZ2 LYS 17 1HZ LYS 17 -14.384 8.974 10.163
100 HZ3 LYS 17 2HZ LYS 17 -13.620 7.937 11.259
101 H CYS 18 H CYS 18 -8.593 8.121 6.000
102 HA CYS 18 HA CYS 18 -8.018 5.389 6.323
103 HB3 CYS 18 2HB CYS 18 -6.522 7.890 7.096
104 H GLU 19 H GLU 19 -7.809 4.087 8.092
105 HA GLU 19 HA GLU 19 -9.213 4.936 10.478
106 HB3 GLU 19 2HB GLU 19 -8.528 2.472 11.134
107 HG3 GLU 19 2HG GLU 19 -10.498 1.620 10.240
108 H LYS 20 H LYS 20 -6.602 6.122 9.853
109 HA LYS 20 HA LYS 20 -5.280 5.483 12.392
110 HB3 LYS 20 2HB LYS 20 -3.314 6.228 10.430
111 HG3 LYS 20 2HG LYS 20 -3.776 3.802 12.133
112 HD3 LYS 20 2HD LYS 20 -1.421 4.309 10.314
113 HE3 LYS 20 2HE LYS 20 -0.651 2.141 11.032
114 HZ1 LYS 20 3HZ LYS 20 0.026 2.666 13.176
115 HZ2 LYS 20 1HZ LYS 20 -1.398 3.502 13.544
116 HZ3 LYS 20 2HZ LYS 20 -0.266 4.183 12.487
117 H CYS 21 H CYS 21 -4.759 7.683 9.632
118 HA CYS 21 HA CYS 21 -4.408 9.889 11.517
119 HB3 CYS 21 2HB CYS 21 -2.665 9.764 9.897
120 H HIS 22 H HIS 22 -6.924 8.499 9.988
121 HA HIS 22 HA HIS 22 -9.046 9.146 9.483
122 HB3 HIS 22 2HB HIS 22 -9.915 10.515 11.033
123 HD2 HIS 22 2HD HIS 22 -7.797 8.658 12.480
124 HE1 HIS 22 1HE HIS 22 -6.419 12.161 14.436
125 HE2 HIS 22 2HE HIS 22 -6.374 9.643 14.402
126 H LEU 23 H LEU 23 -6.794 9.750 7.672
127 HA LEU 23 HA LEU 23 -7.324 12.251 6.402
128 HB3 LEU 23 2HB LEU 23 -6.063 10.740 4.505
129 HG LEU 23 HG LEU 23 -4.903 12.363 6.738
130 HD11 LEU 23 1HD1 LEU 23 -3.540 10.261 5.428
131 HD12 LEU 23 2HD1 LEU 23 -2.886 11.477 6.523
132 HD13 LEU 23 3HD1 LEU 23 -2.918 11.782 4.787
133 HD21 LEU 23 3HD2 LEU 23 -5.976 13.519 4.875
134 HD22 LEU 23 1HD2 LEU 23 -4.931 12.667 3.736
135 HD23 LEU 23 2HD2 LEU 23 -4.235 13.810 4.886
136 H VAL 24 H VAL 24 -9.032 12.709 5.199
137 HA VAL 24 HA VAL 24 -10.870 10.739 4.299
138 HB VAL 24 HB VAL 24 -10.618 13.692 3.781
139 HG11 VAL 24 1HG1 VAL 24 -12.569 11.744 2.578
140 HG12 VAL 24 2HG1 VAL 24 -12.903 13.471 2.711
141 HG13 VAL 24 3HG1 VAL 24 -11.535 12.908 1.750
142 HG21 VAL 24 3HG2 VAL 24 -11.676 12.229 5.876
143 HG22 VAL 24 1HG2 VAL 24 -12.006 13.923 5.513
144 HG23 VAL 24 2HG2 VAL 24 -13.089 12.667 4.914
145 H LEU 25 H LEU 25 -10.488 9.392 2.672
146 HA LEU 25 HA LEU 25 -9.052 10.413 0.310
147 HB3 LEU 25 2HB LEU 25 -7.771 8.598 0.289
148 HG LEU 25 HG LEU 25 -8.991 8.221 2.992
149 HD11 LEU 25 1HD1 LEU 25 -6.748 6.459 2.452
150 HD12 LEU 25 2HD1 LEU 25 -8.176 6.051 1.504
151 HD13 LEU 25 3HD1 LEU 25 -8.279 6.130 3.262
152 HD21 LEU 25 3HD2 LEU 25 -6.491 8.449 3.539
153 HD22 LEU 25 1HD2 LEU 25 -7.358 9.884 2.991
154 HD23 LEU 25 2HD2 LEU 25 -6.322 8.999 1.872
155 H CYS 26 H CYS 26 -9.568 8.645 -1.580
156 HA CYS 26 HA CYS 26 -12.509 8.546 -1.763
157 HB3 CYS 26 2HB CYS 26 -11.664 8.589 -4.371
158 H SER 27 H SER 27 -9.749 6.727 -1.577
159 HA SER 27 HA SER 27 -11.078 4.290 -2.102
160 HB3 SER 27 2HB SER 27 -10.883 4.644 -4.416
161 HG SER 27 HG SER 27 -9.597 6.260 -4.872
162 HA PRO 28 HA PRO 28 -7.369 4.077 0.626
163 HB3 PRO 28 2HB PRO 28 -8.699 4.338 2.481
164 HG3 PRO 28 2HG PRO 28 -10.959 3.794 2.423
165 HD3 PRO 28 2HD PRO 28 -10.819 5.109 0.535
166 H LYS 29 H LYS 29 -6.959 1.763 2.003
167 HA LYS 29 HA LYS 29 -6.856 -0.262 -0.134
168 HB3 LYS 29 2HB LYS 29 -4.812 -1.093 0.868
169 HG3 LYS 29 2HG LYS 29 -3.303 0.820 0.668
170 HD3 LYS 29 2HD LYS 29 -5.494 0.999 -1.397
171 HE3 LYS 29 2HE LYS 29 -2.558 1.616 -1.359
172 HZ1 LYS 29 3HZ LYS 29 -4.227 0.832 -3.655
173 HZ2 LYS 29 1HZ LYS 29 -2.623 0.416 -3.308
174 HZ3 LYS 29 2HZ LYS 29 -2.994 1.972 -3.860
175 H GLN 30 H GLN 30 -9.162 -0.396 1.065
176 HA GLN 30 HA GLN 30 -9.726 -1.457 3.437
177 HB3 GLN 30 2HB GLN 30 -10.884 -3.134 1.327
178 HG3 GLN 30 2HG GLN 30 -12.037 -1.170 3.291
179 HE21 GLN 30 1HE2 GLN 30 -14.207 -3.211 3.496
180 HE22 GLN 30 2HE2 GLN 30 -15.263 -2.868 2.173
181 H THR 31 H THR 31 -8.880 -2.976 4.681
182 HA THR 31 HA THR 31 -7.114 -4.975 3.613
183 HB THR 31 HB THR 31 -6.606 -5.564 5.839
184 HG1 THR 31 1HG THR 31 -8.875 -4.131 6.777
185 HG21 THR 31 3HG2 THR 31 -5.943 -3.535 6.801
186 HG22 THR 31 1HG2 THR 31 -7.354 -2.676 6.186
187 HG23 THR 31 2HG2 THR 31 -6.069 -3.164 5.081
188 H GLU 32 H GLU 32 -7.817 -7.007 5.601
189 HA GLU 32 HA GLU 32 -10.031 -8.240 4.123
190 HB3 GLU 32 2HB GLU 32 -8.755 -10.048 5.948
191 HG3 GLU 32 2HG GLU 32 -8.055 -11.197 3.853
192 H CYS 33 H CYS 33 -9.972 -6.317 6.576
193 HA CYS 33 HA CYS 33 -11.730 -7.941 8.294
194 HB3 CYS 33 2HB CYS 33 -9.600 -6.997 9.310
195 H GLY 34 H GLY 34 -11.397 -4.999 6.454
196 HA2 GLY 34 1HA GLY 34 -13.653 -4.308 5.532
197 HA3 GLY 34 2HA GLY 34 -14.146 -4.237 7.216
198 H HIS 35 H HIS 35 -11.948 -3.031 8.374
199 HA HIS 35 HA HIS 35 -12.452 -0.343 8.070
200 HB3 HIS 35 2HB HIS 35 -10.167 -0.005 9.123
201 HD2 HIS 35 2HD HIS 35 -12.206 0.827 10.954
202 HE1 HIS 35 1HE HIS 35 -12.381 -2.926 12.922
203 HE2 HIS 35 2HE HIS 35 -13.122 -0.520 12.963
204 H ARG 36 H ARG 36 -10.416 1.211 7.553
205 HA ARG 36 HA ARG 36 -9.209 0.461 5.003
206 HB3 ARG 36 2HB ARG 36 -9.923 2.658 4.013
207 HG3 ARG 36 2HG ARG 36 -11.772 0.429 4.567
208 HD3 ARG 36 2HD ARG 36 -12.962 2.579 2.962
209 HE ARG 36 HE ARG 36 -14.431 1.240 5.063
210 HH11 ARG 36 1HH1 ARG 36 -13.359 1.165 1.753
211 HH12 ARG 36 2HH1 ARG 36 -14.593 0.061 1.240
212 HH21 ARG 36 1HH2 ARG 36 -16.060 -0.213 4.403
213 HH22 ARG 36 2HH2 ARG 36 -16.130 -0.721 2.749
214 H PHE 37 H PHE 37 -7.466 1.866 4.356
215 HA PHE 37 HA PHE 37 -6.514 3.787 6.324
216 HB3 PHE 37 2HB PHE 37 -4.206 2.647 6.198
217 HD1 PHE 37 1HD PHE 37 -6.683 0.087 7.093
218 HD2 PHE 37 2HD PHE 37 -4.285 3.316 8.484
219 HE1 PHE 37 1HE PHE 37 -7.169 -0.558 9.418
220 HE2 PHE 37 2HE PHE 37 -4.766 2.676 10.811
221 HZ PHE 37 HZ PHE 37 -6.209 0.737 11.280
222 H CYS 38 H CYS 38 -4.599 4.990 5.541
223 HA CYS 38 HA CYS 38 -4.897 5.547 2.707
224 HB3 CYS 38 2HB CYS 38 -4.800 7.364 4.437
225 H GLU 39 H GLU 39 -2.885 5.996 1.419
226 HA GLU 39 HA GLU 39 -1.408 3.737 0.988
227 HB3 GLU 39 2HB GLU 39 0.373 5.611 0.176
228 HG3 GLU 39 2HG GLU 39 -2.181 5.379 -1.354
229 H SER 40 H SER 40 -0.141 6.628 2.654
230 HA SER 40 HA SER 40 2.268 5.628 3.496
231 HB3 SER 40 2HB SER 40 0.392 7.646 4.688
232 HG SER 40 HG SER 40 2.734 6.591 5.847
233 H CYS 41 H CYS 41 -0.219 6.057 5.967
234 HA CYS 41 HA CYS 41 0.612 4.412 7.884
235 HB3 CYS 41 2HB CYS 41 -1.795 3.880 8.402
236 H MET 42 H MET 42 -1.313 3.262 5.116
237 HA MET 42 HA MET 42 -1.450 0.583 5.724
238 HB3 MET 42 2HB MET 42 -1.171 1.951 3.049
239 HG3 MET 42 2HG MET 42 -0.634 -0.652 3.258
240 HE1 MET 42 3HE MET 42 -2.309 -1.216 5.569
241 HE2 MET 42 1HE MET 42 -3.368 0.145 5.196
242 HE3 MET 42 2HE MET 42 -4.043 -1.474 5.373
243 H ALA 43 H ALA 43 1.088 2.176 3.791
244 HA ALA 43 HA ALA 43 2.699 -0.094 3.452
245 HB1 ALA 43 3HB ALA 43 3.363 1.521 2.009
246 HB2 ALA 43 1HB ALA 43 3.067 2.826 3.157
247 HB3 ALA 43 2HB ALA 43 4.527 1.846 3.294
248 H ALA 44 H ALA 44 2.290 2.048 6.142
249 HA ALA 44 HA ALA 44 4.749 1.428 7.458
250 HB1 ALA 44 3HB ALA 44 4.146 3.063 8.842
251 HB2 ALA 44 1HB ALA 44 2.735 3.296 7.809
252 HB3 ALA 44 2HB ALA 44 2.623 2.267 9.236
253 H LEU 45 H LEU 45 1.372 0.428 8.017
254 HA LEU 45 HA LEU 45 1.863 -1.352 10.104
255 HB3 LEU 45 2HB LEU 45 -0.283 -2.373 9.521
256 HG LEU 45 HG LEU 45 -0.367 0.627 9.220
257 HD11 LEU 45 1HD1 LEU 45 -2.688 0.549 9.568
258 HD12 LEU 45 2HD1 LEU 45 -2.653 -1.162 9.989
259 HD13 LEU 45 3HD1 LEU 45 -2.365 -0.658 8.323
260 HD21 LEU 45 3HD2 LEU 45 0.337 0.431 11.357
261 HD22 LEU 45 1HD2 LEU 45 -0.211 -1.239 11.500
262 HD23 LEU 45 2HD2 LEU 45 -1.367 0.084 11.655
263 H LEU 46 H LEU 46 1.520 -2.061 6.627
264 HA LEU 46 HA LEU 46 1.974 -4.779 6.683
265 HB3 LEU 46 2HB LEU 46 2.731 -4.576 4.376
266 HG LEU 46 HG LEU 46 0.475 -2.678 5.003
267 HD11 LEU 46 1HD1 LEU 46 1.535 -3.632 2.353
268 HD12 LEU 46 2HD1 LEU 46 1.322 -1.971 2.903
269 HD13 LEU 46 3HD1 LEU 46 -0.088 -2.977 2.573
270 HD21 LEU 46 3HD2 LEU 46 0.635 -5.554 4.136
271 HD22 LEU 46 1HD2 LEU 46 -0.839 -4.594 4.007
272 HD23 LEU 46 2HD2 LEU 46 -0.115 -4.890 5.589
273 H SER 47 H SER 47 4.279 -2.156 6.938
274 HA SER 47 HA SER 47 6.562 -3.930 6.741
275 HB3 SER 47 2HB SER 47 6.725 -1.076 7.661
276 HG SER 47 HG SER 47 8.697 -1.198 6.712
277 H SER 48 H SER 48 4.501 -4.121 8.936
278 HA SER 48 HA SER 48 6.252 -3.693 11.260
279 HB3 SER 48 2HB SER 48 3.285 -4.273 11.302
280 HG SER 48 HG SER 48 4.566 -2.813 13.279
281 H SER 49 H SER 49 5.930 -6.001 9.175
282 HA SER 49 HA SER 49 6.424 -8.231 9.230
283 HB3 SER 49 2HB SER 49 6.281 -8.380 12.209
284 HG SER 49 HG SER 49 7.141 -10.177 11.459
285 H SER 50 H SER 50 4.335 -7.638 12.063
286 HA SER 50 HA SER 50 2.440 -9.599 10.951
287 HB3 SER 50 2HB SER 50 2.851 -10.569 12.968
288 HG SER 50 HG SER 50 3.467 -7.994 13.999
289 HA PRO 51 HA PRO 51 0.407 -5.397 10.857
290 HB3 PRO 51 2HB PRO 51 1.154 -4.953 8.730
291 HG3 PRO 51 2HG PRO 51 1.786 -6.671 7.298
292 HD3 PRO 51 2HD PRO 51 2.992 -7.255 9.174
293 H LYS 52 H LYS 52 -1.541 -5.415 11.768
294 HA LYS 52 HA LYS 52 -3.464 -7.494 10.955
295 HB3 LYS 52 2HB LYS 52 -4.355 -7.511 13.127
296 HG3 LYS 52 2HG LYS 52 -1.458 -7.569 12.968
297 HD3 LYS 52 2HD LYS 52 -2.383 -7.484 15.774
298 HE3 LYS 52 2HE LYS 52 0.010 -7.828 14.605
299 HZ1 LYS 52 3HZ LYS 52 0.029 -5.546 13.732
300 HZ2 LYS 52 1HZ LYS 52 1.297 -5.827 14.817
301 HZ3 LYS 52 2HZ LYS 52 -0.058 -4.944 15.311
302 H CYS 53 H CYS 53 -3.716 -4.332 12.578
303 HA CYS 53 HA CYS 53 -4.752 -2.728 10.695
304 HB3 CYS 53 2HB CYS 53 -6.800 -4.747 11.530
305 H THR 54 H THR 54 -4.078 -1.115 12.019
306 HA THR 54 HA THR 54 -4.172 -0.701 14.644
307 HB THR 54 HB THR 54 -4.137 1.038 12.384
308 HG1 THR 54 1HG THR 54 -3.540 1.978 14.949
309 HG21 THR 54 3HG2 THR 54 -6.348 1.800 12.978
310 HG22 THR 54 1HG2 THR 54 -5.180 3.043 13.427
311 HG23 THR 54 2HG2 THR 54 -5.872 1.993 14.665
312 H ALA 55 H ALA 55 -6.981 -0.465 12.524
313 HA ALA 55 HA ALA 55 -8.832 0.609 14.294
314 HB1 ALA 55 3HB ALA 55 -8.909 -0.352 11.725
315 HB2 ALA 55 1HB ALA 55 -9.947 -1.481 12.596
316 HB3 ALA 55 2HB ALA 55 -10.292 0.247 12.642
317 H CYS 56 H CYS 56 -8.918 -2.832 13.417
318 HA CYS 56 HA CYS 56 -9.575 -3.436 16.225
319 HB3 CYS 56 2HB CYS 56 -11.448 -3.905 14.762
320 H GLN 57 H GLN 57 -7.549 -4.205 13.513
321 HA GLN 57 HA GLN 57 -5.490 -5.238 13.523
322 HB3 GLN 57 2HB GLN 57 -4.492 -6.022 15.484
323 HG3 GLN 57 2HG GLN 57 -6.247 -4.447 17.157
324 HE21 GLN 57 1HE2 GLN 57 -3.580 -3.349 15.150
325 HE22 GLN 57 2HE2 GLN 57 -2.421 -3.239 16.426
326 H GLU 58 H GLU 58 -6.211 -6.576 11.873
327 HA GLU 58 HA GLU 58 -6.943 -9.294 12.730
328 HB3 GLU 58 2HB GLU 58 -8.244 -7.541 10.699
329 HG3 GLU 58 2HG GLU 58 -7.540 -9.361 9.291
330 H SER 59 H SER 59 -6.101 -7.615 9.697
331 HA SER 59 HA SER 59 -3.559 -8.749 9.403
332 HB3 SER 59 2HB SER 59 -5.008 -10.140 7.326
333 HG SER 59 HG SER 59 -2.838 -10.464 8.545
334 H ILE 60 H ILE 60 -2.516 -7.531 7.967
335 HA ILE 60 HA ILE 60 -4.081 -6.223 5.840
336 HB ILE 60 HB ILE 60 -1.656 -4.855 6.876
337 HG13 ILE 60 2HG1 ILE 60 -2.977 -5.588 8.898
338 HG21 ILE 60 1HG2 ILE 60 -3.761 -4.287 5.111
339 HG22 ILE 60 2HG2 ILE 60 -3.990 -3.229 6.502
340 HG23 ILE 60 3HG2 ILE 60 -2.462 -3.210 5.622
341 HD11 ILE 60 3HD1 ILE 60 -3.413 -2.705 8.967
342 HD12 ILE 60 1HD1 ILE 60 -2.437 -3.736 10.013
343 HD13 ILE 60 2HD1 ILE 60 -1.788 -3.177 8.471
344 H VAL 61 H VAL 61 -3.451 -6.890 3.907
345 HA VAL 61 HA VAL 61 -0.592 -7.220 3.367
346 HB VAL 61 HB VAL 61 -2.691 -9.290 2.713
347 HG11 VAL 61 1HG1 VAL 61 -0.075 -8.706 1.507
348 HG12 VAL 61 2HG1 VAL 61 -0.341 -10.395 1.947
349 HG13 VAL 61 3HG1 VAL 61 -1.459 -9.579 0.852
350 HG21 VAL 61 3HG2 VAL 61 -2.052 -9.819 4.849
351 HG22 VAL 61 1HG2 VAL 61 -0.821 -10.688 3.933
352 HG23 VAL 61 2HG2 VAL 61 -0.442 -9.125 4.657
353 H LYS 62 H LYS 62 -0.027 -6.194 1.567
354 HA LYS 62 HA LYS 62 -1.658 -4.630 0.028
355 HB3 LYS 62 2HB LYS 62 0.733 -4.395 -0.084
356 HG3 LYS 62 2HG LYS 62 1.028 -6.837 -1.770
357 HD3 LYS 62 2HD LYS 62 2.735 -4.869 -1.352
358 HE3 LYS 62 2HE LYS 62 2.451 -5.754 1.236
359 HZ1 LYS 62 3HZ LYS 62 5.185 -6.519 0.754
360 HZ2 LYS 62 1HZ LYS 62 4.056 -7.628 0.154
361 HZ3 LYS 62 2HZ LYS 62 4.037 -7.204 1.791
362 H ASP 63 H ASP 63 -0.572 -7.926 -0.772
363 HA ASP 63 HA ASP 63 -1.886 -8.214 -3.197
364 HB3 ASP 63 2HB ASP 63 -1.636 -10.580 -2.920
365 H LYS 64 H LYS 64 -3.090 -8.757 0.082
366 HA LYS 64 HA LYS 64 -5.707 -9.536 -0.902
367 HB3 LYS 64 2HB LYS 64 -6.248 -10.065 1.329
368 HG3 LYS 64 2HG LYS 64 -4.233 -11.193 2.306
369 HD3 LYS 64 2HD LYS 64 -4.827 -11.679 -0.614
370 HE3 LYS 64 2HE LYS 64 -4.265 -14.101 0.421
371 HZ1 LYS 64 3HZ LYS 64 -1.828 -13.391 -0.398
372 HZ2 LYS 64 1HZ LYS 64 -2.748 -12.157 -1.100
373 HZ3 LYS 64 2HZ LYS 64 -3.096 -13.775 -1.451
374 H VAL 65 H VAL 65 -4.170 -6.670 -0.572
375 HA VAL 65 HA VAL 65 -6.543 -5.206 0.350
376 HB VAL 65 HB VAL 65 -3.731 -4.778 0.675
377 HG11 VAL 65 1HG1 VAL 65 -5.192 -2.469 -0.603
378 HG12 VAL 65 2HG1 VAL 65 -3.558 -2.433 0.063
379 HG13 VAL 65 3HG1 VAL 65 -3.910 -3.413 -1.360
380 HG21 VAL 65 3HG2 VAL 65 -4.882 -2.746 1.997
381 HG22 VAL 65 1HG2 VAL 65 -6.291 -3.780 1.760
382 HG23 VAL 65 2HG2 VAL 65 -4.869 -4.404 2.596
383 H PHE 66 H PHE 66 -7.491 -3.591 -0.889
384 HA PHE 66 HA PHE 66 -7.039 -3.853 -3.761
385 HB3 PHE 66 2HB PHE 66 -9.178 -2.169 -3.513
386 HD1 PHE 66 1HD PHE 66 -7.995 -5.619 -3.425
387 HD2 PHE 66 2HD PHE 66 -11.246 -3.054 -4.408
388 HE1 PHE 66 1HE PHE 66 -9.037 -7.439 -4.711
389 HE2 PHE 66 2HE PHE 66 -12.295 -4.871 -5.694
390 HZ PHE 66 HZ PHE 66 -11.191 -7.067 -5.846
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -35.369 14.993 -28.671
2 HA2 GLY 1 1HA GLY 1 -37.489 13.818 -27.026
3 HA3 GLY 1 2HA GLY 1 -35.812 13.297 -27.077
4 H SER 2 H SER 2 -34.741 13.693 -25.271
5 HA SER 2 HA SER 2 -35.415 16.125 -23.747
6 HB3 SER 2 2HB SER 2 -34.915 14.890 -21.680
7 HG SER 2 HG SER 2 -37.038 14.646 -23.072
8 H SER 3 H SER 3 -33.625 16.833 -22.279
9 HA SER 3 HA SER 3 -30.975 16.212 -23.396
10 HB3 SER 3 2HB SER 3 -30.712 18.303 -24.153
11 HG SER 3 HG SER 3 -32.590 19.017 -24.728
12 H GLY 4 H GLY 4 -30.518 14.909 -21.600
13 HA2 GLY 4 1HA GLY 4 -29.037 15.171 -19.653
14 HA3 GLY 4 2HA GLY 4 -30.136 16.421 -19.089
15 H SER 5 H SER 5 -30.328 15.277 -17.100
16 HA SER 5 HA SER 5 -31.925 12.809 -17.277
17 HB3 SER 5 2HB SER 5 -30.964 12.047 -15.304
18 HG SER 5 HG SER 5 -28.660 12.859 -15.406
19 H SER 6 H SER 6 -32.976 12.704 -14.767
20 HA SER 6 HA SER 6 -34.754 15.054 -14.729
21 HB3 SER 6 2HB SER 6 -35.275 12.158 -14.044
22 HG SER 6 HG SER 6 -37.482 13.136 -13.672
23 H GLY 7 H GLY 7 -35.871 15.248 -12.474
24 HA2 GLY 7 1HA GLY 7 -35.626 15.833 -10.268
25 HA3 GLY 7 2HA GLY 7 -34.582 14.425 -10.132
26 H PHE 8 H PHE 8 -33.720 16.141 -8.510
27 HA PHE 8 HA PHE 8 -31.583 17.637 -9.878
28 HB3 PHE 8 2HB PHE 8 -31.696 19.166 -7.811
29 HD1 PHE 8 1HD PHE 8 -31.325 20.366 -9.998
30 HD2 PHE 8 2HD PHE 8 -35.176 19.149 -8.653
31 HE1 PHE 8 1HE PHE 8 -32.370 21.961 -11.553
32 HE2 PHE 8 2HE PHE 8 -36.226 20.741 -10.207
33 HZ PHE 8 HZ PHE 8 -34.822 22.150 -11.660
34 H VAL 9 H VAL 9 -30.375 15.622 -9.605
35 HA VAL 9 HA VAL 9 -29.049 15.571 -6.995
36 HB VAL 9 HB VAL 9 -30.833 13.734 -7.188
37 HG11 VAL 9 1HG1 VAL 9 -30.190 11.734 -8.407
38 HG12 VAL 9 2HG1 VAL 9 -30.319 13.107 -9.509
39 HG13 VAL 9 3HG1 VAL 9 -28.731 12.536 -8.991
40 HG21 VAL 9 3HG2 VAL 9 -29.321 12.061 -6.129
41 HG22 VAL 9 1HG2 VAL 9 -27.953 13.081 -6.580
42 HG23 VAL 9 2HG2 VAL 9 -29.172 13.686 -5.457
43 H LYS 10 H LYS 10 -26.902 15.514 -7.173
44 HA LYS 10 HA LYS 10 -25.724 14.547 -9.691
45 HB3 LYS 10 2HB LYS 10 -24.017 16.351 -9.480
46 HG3 LYS 10 2HG LYS 10 -26.677 17.710 -9.497
47 HD3 LYS 10 2HD LYS 10 -24.223 18.644 -10.041
48 HE3 LYS 10 2HE LYS 10 -24.221 16.877 -11.970
49 HZ1 LYS 10 3HZ LYS 10 -26.307 18.599 -12.783
50 HZ2 LYS 10 1HZ LYS 10 -25.731 17.198 -13.538
51 HZ3 LYS 10 2HZ LYS 10 -25.033 18.697 -13.893
52 H THR 11 H THR 11 -25.359 15.075 -6.237
53 HA THR 11 HA THR 11 -23.344 12.940 -6.186
54 HB THR 11 HB THR 11 -21.727 14.299 -5.486
55 HG1 THR 11 1HG THR 11 -22.407 15.603 -3.423
56 HG21 THR 11 3HG2 THR 11 -22.809 16.066 -6.785
57 HG22 THR 11 1HG2 THR 11 -22.044 16.727 -5.340
58 HG23 THR 11 2HG2 THR 11 -23.793 16.501 -5.388
59 H VAL 12 H VAL 12 -22.913 12.405 -3.718
60 HA VAL 12 HA VAL 12 -25.363 12.561 -2.143
61 HB VAL 12 HB VAL 12 -25.329 10.448 -3.648
62 HG11 VAL 12 1HG1 VAL 12 -23.919 8.730 -3.178
63 HG12 VAL 12 2HG1 VAL 12 -22.872 10.063 -2.687
64 HG13 VAL 12 3HG1 VAL 12 -23.782 9.162 -1.474
65 HG21 VAL 12 3HG2 VAL 12 -26.493 9.185 -1.959
66 HG22 VAL 12 1HG2 VAL 12 -25.725 10.120 -0.677
67 HG23 VAL 12 2HG2 VAL 12 -26.880 10.894 -1.763
68 H GLU 13 H GLU 13 -22.666 13.642 -1.889
69 HA GLU 13 HA GLU 13 -20.823 13.618 -0.482
70 HB3 GLU 13 2HB GLU 13 -21.465 14.386 1.611
71 HG3 GLU 13 2HG GLU 13 -23.857 15.316 1.412
72 H ASP 14 H ASP 14 -19.775 11.669 -0.906
73 HA ASP 14 HA ASP 14 -19.893 9.756 1.276
74 HB3 ASP 14 2HB ASP 14 -19.705 8.105 -0.982
75 H LYS 15 H LYS 15 -17.897 9.227 1.869
76 HA LYS 15 HA LYS 15 -15.787 8.834 -0.048
77 HB3 LYS 15 2HB LYS 15 -15.391 11.118 -0.003
78 HG3 LYS 15 2HG LYS 15 -17.081 11.515 1.879
79 HD3 LYS 15 2HD LYS 15 -14.530 11.146 3.434
80 HE3 LYS 15 2HE LYS 15 -15.487 13.311 4.043
81 HZ1 LYS 15 3HZ LYS 15 -17.876 12.340 3.456
82 HZ2 LYS 15 1HZ LYS 15 -17.655 13.655 4.498
83 HZ3 LYS 15 2HZ LYS 15 -17.903 12.106 5.131
84 H TYR 16 H TYR 16 -13.649 8.414 1.180
85 HA TYR 16 HA TYR 16 -14.299 6.862 3.598
86 HB3 TYR 16 2HB TYR 16 -12.563 5.315 3.004
87 HD1 TYR 16 1HD TYR 16 -13.337 6.631 -0.355
88 HD2 TYR 16 2HD TYR 16 -14.389 3.818 2.658
89 HE1 TYR 16 1HE TYR 16 -14.792 5.465 -1.959
90 HE2 TYR 16 2HE TYR 16 -15.846 2.644 1.064
91 HH TYR 16 HH TYR 16 -16.178 3.768 -2.293
92 H LYS 17 H LYS 17 -12.316 6.495 5.021
93 HA LYS 17 HA LYS 17 -10.408 8.682 5.033
94 HB3 LYS 17 2HB LYS 17 -12.604 8.384 7.041
95 HG3 LYS 17 2HG LYS 17 -10.866 10.188 8.193
96 HD3 LYS 17 2HD LYS 17 -10.485 8.016 9.732
97 HE3 LYS 17 2HE LYS 17 -12.450 10.114 9.534
98 HZ1 LYS 17 3HZ LYS 17 -13.728 7.777 9.573
99 HZ2 LYS 17 1HZ LYS 17 -14.317 9.177 10.320
100 HZ3 LYS 17 2HZ LYS 17 -13.499 8.012 11.232
101 H CYS 18 H CYS 18 -8.518 8.183 6.064
102 HA CYS 18 HA CYS 18 -7.920 5.466 6.506
103 HB3 CYS 18 2HB CYS 18 -6.421 7.985 7.242
104 H GLU 19 H GLU 19 -7.734 4.248 8.331
105 HA GLU 19 HA GLU 19 -9.129 5.216 10.675
106 HB3 GLU 19 2HB GLU 19 -8.311 2.742 11.386
107 HG3 GLU 19 2HG GLU 19 -10.400 1.895 10.774
108 H LYS 20 H LYS 20 -6.434 6.261 9.917
109 HA LYS 20 HA LYS 20 -5.126 5.754 12.501
110 HB3 LYS 20 2HB LYS 20 -3.182 6.443 10.501
111 HG3 LYS 20 2HG LYS 20 -3.630 4.135 12.344
112 HD3 LYS 20 2HD LYS 20 -1.308 4.336 10.436
113 HE3 LYS 20 2HE LYS 20 -0.741 2.161 11.198
114 HZ1 LYS 20 3HZ LYS 20 -1.456 3.050 13.829
115 HZ2 LYS 20 1HZ LYS 20 -0.746 4.274 12.902
116 HZ3 LYS 20 2HZ LYS 20 0.074 2.815 13.149
117 H CYS 21 H CYS 21 -4.732 7.880 9.661
118 HA CYS 21 HA CYS 21 -4.362 10.143 11.485
119 HB3 CYS 21 2HB CYS 21 -2.592 9.981 9.899
120 H HIS 22 H HIS 22 -6.869 8.694 10.055
121 HA HIS 22 HA HIS 22 -8.981 9.308 9.473
122 HB3 HIS 22 2HB HIS 22 -9.853 10.702 10.994
123 HD2 HIS 22 2HD HIS 22 -7.681 9.002 12.525
124 HE1 HIS 22 1HE HIS 22 -6.345 12.649 14.232
125 HE2 HIS 22 2HE HIS 22 -6.250 10.135 14.357
126 H LEU 23 H LEU 23 -6.714 9.856 7.662
127 HA LEU 23 HA LEU 23 -7.226 12.308 6.298
128 HB3 LEU 23 2HB LEU 23 -5.987 10.689 4.463
129 HG LEU 23 HG LEU 23 -4.814 12.444 6.588
130 HD11 LEU 23 1HD1 LEU 23 -2.840 11.758 4.664
131 HD12 LEU 23 2HD1 LEU 23 -3.457 10.270 5.382
132 HD13 LEU 23 3HD1 LEU 23 -2.801 11.541 6.415
133 HD21 LEU 23 3HD2 LEU 23 -5.516 12.621 3.739
134 HD22 LEU 23 1HD2 LEU 23 -3.968 13.342 4.180
135 HD23 LEU 23 2HD2 LEU 23 -5.447 13.878 4.975
136 H VAL 24 H VAL 24 -8.922 12.744 5.069
137 HA VAL 24 HA VAL 24 -10.781 10.761 4.238
138 HB VAL 24 HB VAL 24 -10.502 13.693 3.628
139 HG11 VAL 24 1HG1 VAL 24 -11.482 13.085 1.645
140 HG12 VAL 24 2HG1 VAL 24 -12.277 11.672 2.343
141 HG13 VAL 24 3HG1 VAL 24 -12.909 13.289 2.660
142 HG21 VAL 24 3HG2 VAL 24 -11.495 13.696 5.648
143 HG22 VAL 24 1HG2 VAL 24 -12.950 13.301 4.732
144 HG23 VAL 24 2HG2 VAL 24 -12.019 12.018 5.507
145 H LEU 25 H LEU 25 -10.459 9.375 2.634
146 HA LEU 25 HA LEU 25 -9.071 10.325 0.215
147 HB3 LEU 25 2HB LEU 25 -7.599 8.686 0.415
148 HG LEU 25 HG LEU 25 -9.049 8.141 2.952
149 HD11 LEU 25 1HD1 LEU 25 -8.431 6.018 3.197
150 HD12 LEU 25 2HD1 LEU 25 -6.815 6.334 2.566
151 HD13 LEU 25 3HD1 LEU 25 -8.144 6.001 1.457
152 HD21 LEU 25 3HD2 LEU 25 -7.325 9.809 2.954
153 HD22 LEU 25 1HD2 LEU 25 -6.189 8.702 2.181
154 HD23 LEU 25 2HD2 LEU 25 -6.735 8.395 3.831
155 H CYS 26 H CYS 26 -9.592 8.889 -1.723
156 HA CYS 26 HA CYS 26 -12.498 8.470 -1.775
157 HB3 CYS 26 2HB CYS 26 -11.779 8.388 -4.384
158 H SER 27 H SER 27 -9.421 6.924 -2.394
159 HA SER 27 HA SER 27 -10.836 4.364 -2.694
160 HB3 SER 27 2HB SER 27 -8.685 5.515 -4.443
161 HG SER 27 HG SER 27 -8.990 2.975 -5.050
162 HA PRO 28 HA PRO 28 -7.725 4.147 0.719
163 HB3 PRO 28 2HB PRO 28 -9.365 4.500 2.288
164 HG3 PRO 28 2HG PRO 28 -11.594 4.028 1.822
165 HD3 PRO 28 2HD PRO 28 -11.058 5.285 -0.034
166 H LYS 29 H LYS 29 -7.659 1.860 2.197
167 HA LYS 29 HA LYS 29 -7.438 -0.295 0.201
168 HB3 LYS 29 2HB LYS 29 -5.350 -0.970 1.046
169 HG3 LYS 29 2HG LYS 29 -3.886 0.956 1.027
170 HD3 LYS 29 2HD LYS 29 -5.954 1.857 -0.888
171 HE3 LYS 29 2HE LYS 29 -3.243 0.773 -1.534
172 HZ1 LYS 29 3HZ LYS 29 -4.720 1.525 -3.315
173 HZ2 LYS 29 1HZ LYS 29 -3.325 2.477 -3.217
174 HZ3 LYS 29 2HZ LYS 29 -4.793 3.064 -2.616
175 H GLN 30 H GLN 30 -9.727 -0.334 1.402
176 HA GLN 30 HA GLN 30 -10.213 -1.188 3.907
177 HB3 GLN 30 2HB GLN 30 -11.492 -2.808 1.760
178 HG3 GLN 30 2HG GLN 30 -12.658 -1.128 3.968
179 HE21 GLN 30 1HE2 GLN 30 -14.869 -1.595 4.395
180 HE22 GLN 30 2HE2 GLN 30 -15.911 -2.142 3.131
181 H THR 31 H THR 31 -9.027 -2.532 5.100
182 HA THR 31 HA THR 31 -7.488 -4.667 4.108
183 HB THR 31 HB THR 31 -7.052 -5.270 6.374
184 HG1 THR 31 1HG THR 31 -8.983 -3.547 7.440
185 HG21 THR 31 3HG2 THR 31 -7.535 -2.302 6.501
186 HG22 THR 31 1HG2 THR 31 -6.247 -3.008 5.527
187 HG23 THR 31 2HG2 THR 31 -6.257 -3.237 7.276
188 H GLU 32 H GLU 32 -8.010 -6.807 5.803
189 HA GLU 32 HA GLU 32 -10.321 -7.967 4.466
190 HB3 GLU 32 2HB GLU 32 -8.803 -9.635 6.358
191 HG3 GLU 32 2HG GLU 32 -8.927 -10.194 3.454
192 H CYS 33 H CYS 33 -10.237 -6.061 6.928
193 HA CYS 33 HA CYS 33 -12.018 -7.684 8.625
194 HB3 CYS 33 2HB CYS 33 -9.846 -6.866 9.661
195 H GLY 34 H GLY 34 -11.560 -4.671 6.920
196 HA2 GLY 34 1HA GLY 34 -13.845 -3.904 6.051
197 HA3 GLY 34 2HA GLY 34 -14.246 -3.791 7.759
198 H HIS 35 H HIS 35 -12.039 -2.657 8.854
199 HA HIS 35 HA HIS 35 -12.378 0.043 8.458
200 HB3 HIS 35 2HB HIS 35 -10.146 0.315 9.564
201 HD2 HIS 35 2HD HIS 35 -12.238 1.090 11.378
202 HE1 HIS 35 1HE HIS 35 -12.332 -2.684 13.314
203 HE2 HIS 35 2HE HIS 35 -13.136 -0.297 13.368
204 H ARG 36 H ARG 36 -10.626 1.611 7.725
205 HA ARG 36 HA ARG 36 -9.283 0.661 5.291
206 HB3 ARG 36 2HB ARG 36 -9.954 2.933 4.280
207 HG3 ARG 36 2HG ARG 36 -11.617 0.525 4.542
208 HD3 ARG 36 2HD ARG 36 -13.056 2.349 2.905
209 HE ARG 36 HE ARG 36 -13.771 0.323 4.485
210 HH11 ARG 36 1HH1 ARG 36 -14.666 3.687 4.534
211 HH12 ARG 36 2HH1 ARG 36 -16.239 3.393 5.200
212 HH21 ARG 36 1HH2 ARG 36 -15.838 -0.077 5.363
213 HH22 ARG 36 2HH2 ARG 36 -16.904 1.253 5.671
214 H PHE 37 H PHE 37 -7.536 2.040 4.567
215 HA PHE 37 HA PHE 37 -6.559 4.003 6.493
216 HB3 PHE 37 2HB PHE 37 -4.244 2.875 6.280
217 HD1 PHE 37 1HD PHE 37 -6.731 0.356 7.292
218 HD2 PHE 37 2HD PHE 37 -4.183 3.521 8.560
219 HE1 PHE 37 1HE PHE 37 -7.124 -0.272 9.639
220 HE2 PHE 37 2HE PHE 37 -4.571 2.898 10.908
221 HZ PHE 37 HZ PHE 37 -6.042 0.999 11.451
222 H CYS 38 H CYS 38 -4.431 4.988 5.623
223 HA CYS 38 HA CYS 38 -4.895 5.625 2.804
224 HB3 CYS 38 2HB CYS 38 -4.769 7.464 4.492
225 H GLU 39 H GLU 39 -2.860 6.121 1.514
226 HA GLU 39 HA GLU 39 -1.417 3.853 1.015
227 HB3 GLU 39 2HB GLU 39 0.387 5.775 0.292
228 HG3 GLU 39 2HG GLU 39 -2.088 5.524 -1.346
229 H SER 40 H SER 40 -0.078 6.682 2.733
230 HA SER 40 HA SER 40 2.302 5.595 3.556
231 HB3 SER 40 2HB SER 40 1.738 7.138 5.705
232 HG SER 40 HG SER 40 2.516 7.774 3.084
233 H CYS 41 H CYS 41 -0.142 6.090 6.053
234 HA CYS 41 HA CYS 41 0.645 4.379 7.935
235 HB3 CYS 41 2HB CYS 41 -1.753 3.980 8.521
236 H MET 42 H MET 42 -1.329 3.374 5.149
237 HA MET 42 HA MET 42 -1.601 0.691 5.730
238 HB3 MET 42 2HB MET 42 -1.286 2.079 3.069
239 HG3 MET 42 2HG MET 42 -0.898 -0.554 3.249
240 HE1 MET 42 3HE MET 42 -2.576 -1.065 5.568
241 HE2 MET 42 1HE MET 42 -3.541 0.373 5.233
242 HE3 MET 42 2HE MET 42 -4.327 -1.198 5.392
243 H ALA 43 H ALA 43 0.998 2.217 3.828
244 HA ALA 43 HA ALA 43 2.494 -0.156 3.476
245 HB1 ALA 43 3HB ALA 43 3.054 1.460 1.941
246 HB2 ALA 43 1HB ALA 43 3.055 2.754 3.141
247 HB3 ALA 43 2HB ALA 43 4.389 1.602 3.084
248 H ALA 44 H ALA 44 2.178 2.031 6.115
249 HA ALA 44 HA ALA 44 4.681 1.435 7.373
250 HB1 ALA 44 3HB ALA 44 3.179 2.373 9.401
251 HB2 ALA 44 1HB ALA 44 3.986 3.405 8.221
252 HB3 ALA 44 2HB ALA 44 2.278 3.011 8.025
253 H LEU 45 H LEU 45 1.327 0.372 7.868
254 HA LEU 45 HA LEU 45 1.866 -1.339 10.045
255 HB3 LEU 45 2HB LEU 45 -0.318 -2.345 9.534
256 HG LEU 45 HG LEU 45 -0.361 0.662 9.292
257 HD11 LEU 45 1HD1 LEU 45 -2.418 -0.493 8.433
258 HD12 LEU 45 2HD1 LEU 45 -2.680 0.591 9.798
259 HD13 LEU 45 3HD1 LEU 45 -2.638 -1.154 10.054
260 HD21 LEU 45 3HD2 LEU 45 -0.048 -1.225 11.506
261 HD22 LEU 45 1HD2 LEU 45 -1.310 -0.019 11.758
262 HD23 LEU 45 2HD2 LEU 45 0.342 0.492 11.411
263 H LEU 46 H LEU 46 1.694 -1.917 6.554
264 HA LEU 46 HA LEU 46 1.960 -4.690 6.571
265 HB3 LEU 46 2HB LEU 46 2.856 -4.438 4.288
266 HG LEU 46 HG LEU 46 0.488 -2.688 4.913
267 HD11 LEU 46 1HD1 LEU 46 0.177 -3.127 2.317
268 HD12 LEU 46 2HD1 LEU 46 1.939 -3.113 2.363
269 HD13 LEU 46 3HD1 LEU 46 1.032 -1.713 2.934
270 HD21 LEU 46 3HD2 LEU 46 -0.600 -4.619 4.944
271 HD22 LEU 46 1HD2 LEU 46 0.896 -5.491 4.614
272 HD23 LEU 46 2HD2 LEU 46 -0.102 -4.919 3.278
273 H SER 47 H SER 47 4.278 -2.215 7.221
274 HA SER 47 HA SER 47 6.515 -4.085 6.988
275 HB3 SER 47 2HB SER 47 7.042 -1.345 7.956
276 HG SER 47 HG SER 47 8.614 -2.931 7.183
277 H SER 48 H SER 48 4.470 -4.358 9.066
278 HA SER 48 HA SER 48 6.071 -3.814 11.473
279 HB3 SER 48 2HB SER 48 3.127 -4.499 11.347
280 HG SER 48 HG SER 48 3.153 -4.127 13.448
281 H SER 49 H SER 49 6.330 -6.076 9.531
282 HA SER 49 HA SER 49 6.517 -8.356 9.494
283 HB3 SER 49 2HB SER 49 7.220 -7.822 12.392
284 HG SER 49 HG SER 49 7.657 -10.041 10.692
285 H SER 50 H SER 50 3.874 -7.169 10.367
286 HA SER 50 HA SER 50 2.345 -9.414 10.575
287 HB3 SER 50 2HB SER 50 3.353 -8.519 13.262
288 HG SER 50 HG SER 50 1.603 -9.467 14.228
289 HA PRO 51 HA PRO 51 0.292 -5.210 10.441
290 HB3 PRO 51 2HB PRO 51 0.889 -4.836 8.254
291 HG3 PRO 51 2HG PRO 51 1.439 -6.601 6.842
292 HD3 PRO 51 2HD PRO 51 2.774 -7.109 8.651
293 H LYS 52 H LYS 52 -1.585 -5.217 11.491
294 HA LYS 52 HA LYS 52 -3.557 -7.309 10.847
295 HB3 LYS 52 2HB LYS 52 -4.221 -7.404 13.074
296 HG3 LYS 52 2HG LYS 52 -1.407 -7.427 12.661
297 HD3 LYS 52 2HD LYS 52 -2.303 -6.332 15.327
298 HE3 LYS 52 2HE LYS 52 0.553 -6.808 14.766
299 HZ1 LYS 52 3HZ LYS 52 -0.851 -7.657 17.193
300 HZ2 LYS 52 1HZ LYS 52 -0.685 -5.999 16.907
301 HZ3 LYS 52 2HZ LYS 52 0.688 -6.978 17.020
302 H CYS 53 H CYS 53 -3.666 -4.154 12.501
303 HA CYS 53 HA CYS 53 -4.849 -2.537 10.724
304 HB3 CYS 53 2HB CYS 53 -6.823 -4.568 11.691
305 H THR 54 H THR 54 -4.053 -0.948 12.017
306 HA THR 54 HA THR 54 -3.945 -0.551 14.638
307 HB THR 54 HB THR 54 -4.097 1.209 12.401
308 HG1 THR 54 1HG THR 54 -3.180 2.494 14.497
309 HG21 THR 54 3HG2 THR 54 -5.625 2.148 14.830
310 HG22 THR 54 1HG2 THR 54 -6.255 1.956 13.195
311 HG23 THR 54 2HG2 THR 54 -5.053 3.201 13.535
312 H ALA 55 H ALA 55 -6.912 -0.079 12.750
313 HA ALA 55 HA ALA 55 -8.603 0.899 14.684
314 HB1 ALA 55 3HB ALA 55 -8.879 -0.162 12.111
315 HB2 ALA 55 1HB ALA 55 -9.990 -1.079 13.129
316 HB3 ALA 55 2HB ALA 55 -10.103 0.679 13.062
317 H CYS 56 H CYS 56 -8.911 -2.504 13.744
318 HA CYS 56 HA CYS 56 -9.292 -3.164 16.590
319 HB3 CYS 56 2HB CYS 56 -11.302 -3.519 15.245
320 H GLN 57 H GLN 57 -7.594 -3.963 13.657
321 HA GLN 57 HA GLN 57 -5.577 -5.055 13.440
322 HB3 GLN 57 2HB GLN 57 -4.400 -5.893 15.274
323 HG3 GLN 57 2HG GLN 57 -5.665 -4.379 17.266
324 HE21 GLN 57 1HE2 GLN 57 -4.046 -2.868 14.559
325 HE22 GLN 57 2HE2 GLN 57 -2.513 -2.677 15.333
326 H GLU 58 H GLU 58 -6.272 -6.436 11.880
327 HA GLU 58 HA GLU 58 -7.114 -9.099 12.789
328 HB3 GLU 58 2HB GLU 58 -8.334 -8.677 10.285
329 HG3 GLU 58 2HG GLU 58 -10.377 -8.384 12.079
330 H SER 59 H SER 59 -6.228 -7.322 9.823
331 HA SER 59 HA SER 59 -3.822 -8.577 9.327
332 HB3 SER 59 2HB SER 59 -5.470 -9.942 7.366
333 HG SER 59 HG SER 59 -4.247 -11.740 8.518
334 H ILE 60 H ILE 60 -2.840 -7.388 7.826
335 HA ILE 60 HA ILE 60 -4.495 -6.084 5.766
336 HB ILE 60 HB ILE 60 -2.038 -4.689 6.663
337 HG13 ILE 60 2HG1 ILE 60 -3.208 -5.434 8.770
338 HG21 ILE 60 1HG2 ILE 60 -4.220 -4.150 5.015
339 HG22 ILE 60 2HG2 ILE 60 -4.447 -3.126 6.432
340 HG23 ILE 60 3HG2 ILE 60 -2.951 -3.028 5.503
341 HD11 ILE 60 3HD1 ILE 60 -2.642 -3.566 9.850
342 HD12 ILE 60 1HD1 ILE 60 -2.073 -3.021 8.274
343 HD13 ILE 60 2HD1 ILE 60 -3.674 -2.550 8.845
344 H VAL 61 H VAL 61 -3.926 -6.705 3.799
345 HA VAL 61 HA VAL 61 -1.088 -7.092 3.178
346 HB VAL 61 HB VAL 61 -3.258 -9.090 2.527
347 HG11 VAL 61 1HG1 VAL 61 -0.887 -10.207 1.738
348 HG12 VAL 61 2HG1 VAL 61 -2.069 -9.456 0.665
349 HG13 VAL 61 3HG1 VAL 61 -0.691 -8.524 1.251
350 HG21 VAL 61 3HG2 VAL 61 -1.308 -10.516 3.687
351 HG22 VAL 61 1HG2 VAL 61 -1.064 -8.972 4.504
352 HG23 VAL 61 2HG2 VAL 61 -2.630 -9.779 4.592
353 H LYS 62 H LYS 62 -0.571 -5.941 1.448
354 HA LYS 62 HA LYS 62 -2.213 -4.356 -0.039
355 HB3 LYS 62 2HB LYS 62 0.160 -4.090 -0.197
356 HG3 LYS 62 2HG LYS 62 0.546 -6.484 -1.908
357 HD3 LYS 62 2HD LYS 62 2.432 -5.510 0.180
358 HE3 LYS 62 2HE LYS 62 4.090 -6.212 -1.342
359 HZ1 LYS 62 3HZ LYS 62 3.200 -8.466 -2.114
360 HZ2 LYS 62 1HZ LYS 62 1.773 -8.040 -1.309
361 HZ3 LYS 62 2HZ LYS 62 3.226 -8.154 -0.451
362 H ASP 63 H ASP 63 -1.228 -7.673 -0.843
363 HA ASP 63 HA ASP 63 -2.586 -7.859 -3.290
364 HB3 ASP 63 2HB ASP 63 -1.802 -9.978 -1.284
365 H LYS 64 H LYS 64 -3.626 -8.584 0.012
366 HA LYS 64 HA LYS 64 -6.264 -9.384 -0.885
367 HB3 LYS 64 2HB LYS 64 -6.703 -9.972 1.370
368 HG3 LYS 64 2HG LYS 64 -4.535 -11.081 2.171
369 HD3 LYS 64 2HD LYS 64 -5.893 -11.628 -0.447
370 HE3 LYS 64 2HE LYS 64 -4.252 -13.774 0.717
371 HZ1 LYS 64 3HZ LYS 64 -5.453 -14.139 -1.304
372 HZ2 LYS 64 1HZ LYS 64 -3.799 -14.147 -1.664
373 HZ3 LYS 64 2HZ LYS 64 -4.739 -12.794 -2.042
374 H VAL 65 H VAL 65 -4.743 -6.493 -0.364
375 HA VAL 65 HA VAL 65 -6.953 -5.087 0.863
376 HB VAL 65 HB VAL 65 -4.180 -4.508 0.281
377 HG11 VAL 65 1HG1 VAL 65 -6.159 -2.326 -0.368
378 HG12 VAL 65 2HG1 VAL 65 -4.407 -2.146 -0.267
379 HG13 VAL 65 3HG1 VAL 65 -5.121 -3.149 -1.530
380 HG21 VAL 65 3HG2 VAL 65 -5.777 -4.388 2.429
381 HG22 VAL 65 1HG2 VAL 65 -4.281 -3.462 2.288
382 HG23 VAL 65 2HG2 VAL 65 -5.830 -2.695 1.936
383 H PHE 66 H PHE 66 -8.348 -3.667 -0.127
384 HA PHE 66 HA PHE 66 -8.227 -3.498 -3.060
385 HB3 PHE 66 2HB PHE 66 -10.740 -3.677 -3.063
386 HD1 PHE 66 1HD PHE 66 -9.679 -6.294 -0.726
387 HD2 PHE 66 2HD PHE 66 -10.106 -5.186 -4.814
388 HE1 PHE 66 1HE PHE 66 -9.338 -8.639 -1.394
389 HE2 PHE 66 2HE PHE 66 -9.766 -7.528 -5.488
390 HZ PHE 66 HZ PHE 66 -9.382 -9.258 -3.777
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -48.264 19.127 -15.103
2 HA2 GLY 1 1HA GLY 1 -46.488 19.672 -13.749
3 HA3 GLY 1 2HA GLY 1 -47.483 20.959 -13.083
4 H SER 2 H SER 2 -48.561 17.655 -12.982
5 HA SER 2 HA SER 2 -48.553 17.756 -10.080
6 HB3 SER 2 2HB SER 2 -50.577 16.899 -10.870
7 HG SER 2 HG SER 2 -50.592 15.203 -12.488
8 H SER 3 H SER 3 -45.997 17.593 -11.375
9 HA SER 3 HA SER 3 -44.980 14.954 -11.359
10 HB3 SER 3 2HB SER 3 -43.004 16.997 -10.702
11 HG SER 3 HG SER 3 -43.037 16.008 -13.238
12 H GLY 4 H GLY 4 -43.095 14.355 -9.852
13 HA2 GLY 4 1HA GLY 4 -43.966 13.746 -7.353
14 HA3 GLY 4 2HA GLY 4 -42.265 13.975 -7.730
15 H SER 5 H SER 5 -43.840 14.586 -5.288
16 HA SER 5 HA SER 5 -43.659 17.502 -5.175
17 HB3 SER 5 2HB SER 5 -45.698 16.563 -4.265
18 HG SER 5 HG SER 5 -44.023 14.698 -3.286
19 H SER 6 H SER 6 -41.200 16.517 -5.473
20 HA SER 6 HA SER 6 -40.031 16.521 -2.768
21 HB3 SER 6 2HB SER 6 -39.698 14.520 -4.443
22 HG SER 6 HG SER 6 -38.922 15.781 -6.172
23 H GLY 7 H GLY 7 -38.074 17.707 -2.440
24 HA2 GLY 7 1HA GLY 7 -38.099 20.278 -3.616
25 HA3 GLY 7 2HA GLY 7 -36.846 19.644 -2.560
26 H PHE 8 H PHE 8 -35.455 20.939 -4.007
27 HA PHE 8 HA PHE 8 -35.093 20.371 -6.719
28 HB3 PHE 8 2HB PHE 8 -33.647 21.811 -4.631
29 HD1 PHE 8 1HD PHE 8 -32.504 20.371 -7.883
30 HD2 PHE 8 2HD PHE 8 -31.469 21.657 -3.961
31 HE1 PHE 8 1HE PHE 8 -30.159 19.761 -8.306
32 HE2 PHE 8 2HE PHE 8 -29.121 21.050 -4.378
33 HZ PHE 8 HZ PHE 8 -28.464 20.102 -6.553
34 H VAL 9 H VAL 9 -34.365 18.625 -7.724
35 HA VAL 9 HA VAL 9 -33.683 16.238 -6.597
36 HB VAL 9 HB VAL 9 -34.100 16.229 -8.913
37 HG11 VAL 9 1HG1 VAL 9 -32.052 17.429 -10.280
38 HG12 VAL 9 2HG1 VAL 9 -33.643 18.136 -9.990
39 HG13 VAL 9 3HG1 VAL 9 -32.295 18.523 -8.919
40 HG21 VAL 9 3HG2 VAL 9 -31.130 15.768 -8.674
41 HG22 VAL 9 1HG2 VAL 9 -32.363 14.628 -8.138
42 HG23 VAL 9 2HG2 VAL 9 -32.228 15.043 -9.847
43 H LYS 10 H LYS 10 -32.234 16.043 -4.992
44 HA LYS 10 HA LYS 10 -29.473 16.904 -5.553
45 HB3 LYS 10 2HB LYS 10 -30.909 18.132 -3.693
46 HG3 LYS 10 2HG LYS 10 -29.574 16.145 -1.927
47 HD3 LYS 10 2HD LYS 10 -31.713 16.877 -0.594
48 HE3 LYS 10 2HE LYS 10 -29.340 18.672 -1.083
49 HZ1 LYS 10 3HZ LYS 10 -30.173 19.027 1.478
50 HZ2 LYS 10 1HZ LYS 10 -31.627 19.010 0.611
51 HZ3 LYS 10 2HZ LYS 10 -30.413 20.116 0.205
52 H THR 11 H THR 11 -27.835 15.673 -4.289
53 HA THR 11 HA THR 11 -28.712 12.924 -3.712
54 HB THR 11 HB THR 11 -26.004 13.175 -4.846
55 HG1 THR 11 1HG THR 11 -28.111 13.218 -6.710
56 HG21 THR 11 3HG2 THR 11 -26.383 10.984 -4.977
57 HG22 THR 11 1HG2 THR 11 -27.592 11.300 -6.221
58 HG23 THR 11 2HG2 THR 11 -28.072 11.213 -4.526
59 H VAL 12 H VAL 12 -26.509 11.747 -2.847
60 HA VAL 12 HA VAL 12 -25.437 13.496 -0.731
61 HB VAL 12 HB VAL 12 -26.350 10.631 -0.479
62 HG11 VAL 12 1HG1 VAL 12 -25.571 10.784 1.866
63 HG12 VAL 12 2HG1 VAL 12 -24.253 10.844 0.693
64 HG13 VAL 12 3HG1 VAL 12 -24.804 12.324 1.479
65 HG21 VAL 12 3HG2 VAL 12 -27.271 13.242 0.685
66 HG22 VAL 12 1HG2 VAL 12 -28.202 12.046 -0.216
67 HG23 VAL 12 2HG2 VAL 12 -27.673 11.696 1.430
68 H GLU 13 H GLU 13 -23.312 13.706 -0.888
69 HA GLU 13 HA GLU 13 -21.770 11.587 -2.217
70 HB3 GLU 13 2HB GLU 13 -20.012 13.324 -2.473
71 HG3 GLU 13 2HG GLU 13 -22.611 14.425 -3.492
72 H ASP 14 H ASP 14 -20.277 10.440 -1.148
73 HA ASP 14 HA ASP 14 -19.523 11.322 1.560
74 HB3 ASP 14 2HB ASP 14 -21.183 9.401 1.496
75 H LYS 15 H LYS 15 -17.745 9.249 2.114
76 HA LYS 15 HA LYS 15 -15.878 8.671 0.121
77 HB3 LYS 15 2HB LYS 15 -15.158 10.830 -0.188
78 HG3 LYS 15 2HG LYS 15 -16.544 12.050 1.288
79 HD3 LYS 15 2HD LYS 15 -14.957 10.750 3.496
80 HE3 LYS 15 2HE LYS 15 -15.535 13.314 3.660
81 HZ1 LYS 15 3HZ LYS 15 -17.851 12.950 5.064
82 HZ2 LYS 15 1HZ LYS 15 -18.107 12.078 3.637
83 HZ3 LYS 15 2HZ LYS 15 -17.703 13.718 3.564
84 H TYR 16 H TYR 16 -13.686 8.068 1.105
85 HA TYR 16 HA TYR 16 -14.215 6.737 3.662
86 HB3 TYR 16 2HB TYR 16 -12.433 5.217 3.088
87 HD1 TYR 16 2HD TYR 16 -13.301 6.288 -0.319
88 HD2 TYR 16 1HD TYR 16 -14.312 3.720 2.920
89 HE1 TYR 16 2HE TYR 16 -14.786 5.009 -1.805
90 HE2 TYR 16 1HE TYR 16 -15.800 2.433 1.442
91 HH TYR 16 HH TYR 16 -16.733 2.310 -0.578
92 H LYS 17 H LYS 17 -12.247 6.460 5.096
93 HA LYS 17 HA LYS 17 -10.346 8.655 5.008
94 HB3 LYS 17 2HB LYS 17 -12.532 8.419 7.036
95 HG3 LYS 17 2HG LYS 17 -10.802 10.274 8.115
96 HD3 LYS 17 2HD LYS 17 -10.394 8.168 9.731
97 HE3 LYS 17 2HE LYS 17 -12.466 10.184 9.421
98 HZ1 LYS 17 3HZ LYS 17 -13.135 7.662 10.833
99 HZ2 LYS 17 1HZ LYS 17 -13.999 8.389 9.574
100 HZ3 LYS 17 2HZ LYS 17 -13.938 9.128 11.094
101 H CYS 18 H CYS 18 -8.447 8.207 6.049
102 HA CYS 18 HA CYS 18 -7.832 5.513 6.594
103 HB3 CYS 18 2HB CYS 18 -6.344 8.070 7.201
104 H GLU 19 H GLU 19 -7.622 4.373 8.468
105 HA GLU 19 HA GLU 19 -9.006 5.430 10.780
106 HB3 GLU 19 2HB GLU 19 -8.258 3.021 11.630
107 HG3 GLU 19 2HG GLU 19 -10.268 2.086 10.869
108 H LYS 20 H LYS 20 -6.335 6.473 9.967
109 HA LYS 20 HA LYS 20 -4.997 6.075 12.556
110 HB3 LYS 20 2HB LYS 20 -3.087 6.700 10.493
111 HG3 LYS 20 2HG LYS 20 -3.460 4.487 12.465
112 HD3 LYS 20 2HD LYS 20 -1.179 4.652 10.502
113 HE3 LYS 20 2HE LYS 20 -0.287 2.849 11.548
114 HZ1 LYS 20 3HZ LYS 20 -2.015 3.955 13.693
115 HZ2 LYS 20 1HZ LYS 20 -0.431 4.421 13.325
116 HZ3 LYS 20 2HZ LYS 20 -0.734 2.883 13.961
117 H CYS 21 H CYS 21 -4.654 8.092 9.630
118 HA CYS 21 HA CYS 21 -4.287 10.428 11.362
119 HB3 CYS 21 2HB CYS 21 -2.528 10.225 9.774
120 H HIS 22 H HIS 22 -6.788 8.900 9.999
121 HA HIS 22 HA HIS 22 -8.911 9.473 9.418
122 HB3 HIS 22 2HB HIS 22 -9.784 10.929 10.879
123 HD2 HIS 22 2HD HIS 22 -7.591 9.303 12.463
124 HE1 HIS 22 1HE HIS 22 -6.273 13.024 14.016
125 HE2 HIS 22 2HE HIS 22 -6.159 10.518 14.241
126 H LEU 23 H LEU 23 -6.622 10.009 7.592
127 HA LEU 23 HA LEU 23 -7.156 12.377 6.123
128 HB3 LEU 23 2HB LEU 23 -5.970 10.661 4.334
129 HG LEU 23 HG LEU 23 -4.744 12.509 6.347
130 HD11 LEU 23 1HD1 LEU 23 -3.426 10.263 5.244
131 HD12 LEU 23 2HD1 LEU 23 -2.738 11.588 6.183
132 HD13 LEU 23 3HD1 LEU 23 -2.811 11.700 4.425
133 HD21 LEU 23 3HD2 LEU 23 -5.570 13.762 4.613
134 HD22 LEU 23 1HD2 LEU 23 -5.304 12.489 3.421
135 HD23 LEU 23 2HD2 LEU 23 -3.939 13.431 4.025
136 H VAL 24 H VAL 24 -8.890 12.783 4.937
137 HA VAL 24 HA VAL 24 -10.775 10.790 4.200
138 HB VAL 24 HB VAL 24 -10.487 13.699 3.494
139 HG11 VAL 24 1HG1 VAL 24 -11.429 12.698 1.528
140 HG12 VAL 24 2HG1 VAL 24 -12.570 11.761 2.496
141 HG13 VAL 24 3HG1 VAL 24 -12.719 13.517 2.409
142 HG21 VAL 24 3HG2 VAL 24 -12.885 13.445 4.660
143 HG22 VAL 24 1HG2 VAL 24 -12.054 12.079 5.404
144 HG23 VAL 24 2HG2 VAL 24 -11.397 13.707 5.568
145 H LEU 25 H LEU 25 -10.453 9.336 2.655
146 HA LEU 25 HA LEU 25 -9.117 10.200 0.175
147 HB3 LEU 25 2HB LEU 25 -7.673 8.535 0.370
148 HG LEU 25 HG LEU 25 -9.022 8.133 2.993
149 HD11 LEU 25 1HD1 LEU 25 -8.098 5.939 1.555
150 HD12 LEU 25 2HD1 LEU 25 -8.408 6.021 3.289
151 HD13 LEU 25 3HD1 LEU 25 -6.789 6.338 2.667
152 HD21 LEU 25 3HD2 LEU 25 -6.667 8.445 3.757
153 HD22 LEU 25 1HD2 LEU 25 -7.330 9.815 2.865
154 HD23 LEU 25 2HD2 LEU 25 -6.211 8.707 2.073
155 H CYS 26 H CYS 26 -9.714 8.821 -1.736
156 HA CYS 26 HA CYS 26 -12.594 8.212 -1.637
157 HB3 CYS 26 2HB CYS 26 -11.024 8.894 -4.121
158 H SER 27 H SER 27 -9.576 6.815 -1.881
159 HA SER 27 HA SER 27 -10.734 4.288 -2.716
160 HB3 SER 27 2HB SER 27 -10.015 5.228 -4.851
161 HG SER 27 HG SER 27 -8.405 6.641 -4.203
162 HA PRO 28 HA PRO 28 -7.567 4.069 0.688
163 HB3 PRO 28 2HB PRO 28 -9.155 4.413 2.312
164 HG3 PRO 28 2HG PRO 28 -11.401 3.969 1.907
165 HD3 PRO 28 2HD PRO 28 -10.910 5.250 0.055
166 H LYS 29 H LYS 29 -7.478 1.760 2.128
167 HA LYS 29 HA LYS 29 -7.324 -0.361 0.088
168 HB3 LYS 29 2HB LYS 29 -5.220 -1.042 0.828
169 HG3 LYS 29 2HG LYS 29 -3.751 0.844 0.885
170 HD3 LYS 29 2HD LYS 29 -5.879 2.065 -0.751
171 HE3 LYS 29 2HE LYS 29 -3.009 1.421 -0.909
172 HZ1 LYS 29 3HZ LYS 29 -4.572 0.438 -2.925
173 HZ2 LYS 29 1HZ LYS 29 -2.914 0.767 -3.014
174 HZ3 LYS 29 2HZ LYS 29 -4.036 1.927 -3.522
175 H GLN 30 H GLN 30 -9.596 -0.368 1.355
176 HA GLN 30 HA GLN 30 -10.098 -1.250 3.819
177 HB3 GLN 30 2HB GLN 30 -11.389 -3.039 1.900
178 HG3 GLN 30 2HG GLN 30 -12.412 -0.831 3.667
179 HE21 GLN 30 1HE2 GLN 30 -14.639 -2.696 4.216
180 HE22 GLN 30 2HE2 GLN 30 -15.724 -2.516 2.884
181 H THR 31 H THR 31 -9.107 -2.644 5.105
182 HA THR 31 HA THR 31 -7.444 -4.742 4.144
183 HB THR 31 HB THR 31 -6.956 -5.245 6.396
184 HG1 THR 31 1HG THR 31 -9.244 -3.776 7.236
185 HG21 THR 31 3HG2 THR 31 -7.601 -2.443 6.989
186 HG22 THR 31 1HG2 THR 31 -6.735 -2.690 5.474
187 HG23 THR 31 2HG2 THR 31 -6.046 -3.272 6.990
188 H GLU 32 H GLU 32 -8.170 -6.694 6.200
189 HA GLU 32 HA GLU 32 -10.388 -7.965 4.759
190 HB3 GLU 32 2HB GLU 32 -9.006 -9.640 6.697
191 HG3 GLU 32 2HG GLU 32 -8.426 -10.697 4.280
192 H CYS 33 H CYS 33 -10.319 -5.963 7.146
193 HA CYS 33 HA CYS 33 -12.133 -7.509 8.881
194 HB3 CYS 33 2HB CYS 33 -9.977 -6.711 9.934
195 H GLY 34 H GLY 34 -11.620 -4.568 7.075
196 HA2 GLY 34 1HA GLY 34 -13.876 -3.791 6.158
197 HA3 GLY 34 2HA GLY 34 -14.303 -3.627 7.855
198 H HIS 35 H HIS 35 -12.083 -2.497 8.946
199 HA HIS 35 HA HIS 35 -12.385 0.194 8.508
200 HB3 HIS 35 2HB HIS 35 -10.132 0.457 9.581
201 HD2 HIS 35 2HD HIS 35 -12.295 1.275 11.336
202 HE1 HIS 35 1HE HIS 35 -12.254 -2.397 13.460
203 HE2 HIS 35 2HE HIS 35 -13.139 -0.041 13.398
204 H ARG 36 H ARG 36 -10.349 1.629 7.870
205 HA ARG 36 HA ARG 36 -9.107 0.664 5.415
206 HB3 ARG 36 2HB ARG 36 -9.783 2.832 4.269
207 HG3 ARG 36 2HG ARG 36 -11.644 0.594 4.844
208 HD3 ARG 36 2HD ARG 36 -12.565 2.677 2.947
209 HE ARG 36 HE ARG 36 -14.159 1.024 3.043
210 HH11 ARG 36 1HH1 ARG 36 -13.295 2.013 6.266
211 HH12 ARG 36 2HH1 ARG 36 -14.587 1.139 7.021
212 HH21 ARG 36 1HH2 ARG 36 -15.864 -0.130 4.025
213 HH22 ARG 36 2HH2 ARG 36 -16.048 -0.080 5.745
214 H PHE 37 H PHE 37 -7.384 2.076 4.648
215 HA PHE 37 HA PHE 37 -6.436 4.082 6.542
216 HB3 PHE 37 2HB PHE 37 -4.107 2.981 6.367
217 HD1 PHE 37 2HD PHE 37 -6.443 0.357 7.404
218 HD2 PHE 37 1HD PHE 37 -4.193 3.754 8.636
219 HE1 PHE 37 2HE PHE 37 -6.842 -0.236 9.759
220 HE2 PHE 37 1HE PHE 37 -4.588 3.165 10.992
221 HZ PHE 37 HZ PHE 37 -5.915 1.170 11.556
222 H CYS 38 H CYS 38 -4.361 5.121 5.669
223 HA CYS 38 HA CYS 38 -4.808 5.681 2.835
224 HB3 CYS 38 2HB CYS 38 -4.705 7.550 4.496
225 H GLU 39 H GLU 39 -2.816 6.131 1.504
226 HA GLU 39 HA GLU 39 -1.339 3.898 1.044
227 HB3 GLU 39 2HB GLU 39 0.465 5.757 0.276
228 HG3 GLU 39 2HG GLU 39 -2.098 5.647 -1.247
229 H SER 40 H SER 40 -0.014 6.739 2.754
230 HA SER 40 HA SER 40 2.362 5.657 3.596
231 HB3 SER 40 2HB SER 40 1.589 7.224 5.757
232 HG SER 40 HG SER 40 3.340 8.037 4.939
233 H CYS 41 H CYS 41 -0.059 6.194 6.100
234 HA CYS 41 HA CYS 41 0.718 4.477 7.982
235 HB3 CYS 41 2HB CYS 41 -1.659 4.152 8.626
236 H MET 42 H MET 42 -1.303 3.498 5.222
237 HA MET 42 HA MET 42 -1.635 0.827 5.812
238 HB3 MET 42 2HB MET 42 -1.327 2.246 3.172
239 HG3 MET 42 2HG MET 42 -0.688 -0.101 2.833
240 HE1 MET 42 3HE MET 42 -4.651 -1.021 4.947
241 HE2 MET 42 1HE MET 42 -3.510 0.201 5.512
242 HE3 MET 42 2HE MET 42 -4.319 0.402 3.957
243 H ALA 43 H ALA 43 0.955 2.212 3.784
244 HA ALA 43 HA ALA 43 2.403 -0.151 3.435
245 HB1 ALA 43 3HB ALA 43 4.303 1.311 2.863
246 HB2 ALA 43 1HB ALA 43 2.806 1.804 2.069
247 HB3 ALA 43 2HB ALA 43 3.397 2.696 3.472
248 H ALA 44 H ALA 44 2.377 2.159 6.069
249 HA ALA 44 HA ALA 44 4.744 1.339 7.359
250 HB1 ALA 44 3HB ALA 44 2.823 2.197 9.283
251 HB2 ALA 44 1HB ALA 44 4.227 3.061 8.655
252 HB3 ALA 44 2HB ALA 44 2.670 3.194 7.837
253 H LEU 45 H LEU 45 1.348 0.456 8.003
254 HA LEU 45 HA LEU 45 1.864 -1.402 10.028
255 HB3 LEU 45 2HB LEU 45 -0.364 -2.257 9.601
256 HG LEU 45 HG LEU 45 -0.300 0.734 9.211
257 HD11 LEU 45 1HD1 LEU 45 -2.631 0.706 9.914
258 HD12 LEU 45 2HD1 LEU 45 -2.610 -1.056 9.954
259 HD13 LEU 45 3HD1 LEU 45 -2.412 -0.208 8.421
260 HD21 LEU 45 3HD2 LEU 45 0.125 0.859 11.384
261 HD22 LEU 45 1HD2 LEU 45 0.317 -0.893 11.424
262 HD23 LEU 45 2HD2 LEU 45 -1.260 -0.172 11.748
263 H LEU 46 H LEU 46 1.512 -1.868 6.525
264 HA LEU 46 HA LEU 46 1.686 -4.626 6.411
265 HB3 LEU 46 2HB LEU 46 2.631 -4.293 4.135
266 HG LEU 46 HG LEU 46 0.330 -2.429 4.718
267 HD11 LEU 46 1HD1 LEU 46 1.582 -3.407 2.187
268 HD12 LEU 46 2HD1 LEU 46 1.021 -1.790 2.611
269 HD13 LEU 46 3HD1 LEU 46 -0.147 -3.060 2.248
270 HD21 LEU 46 3HD2 LEU 46 -0.599 -4.408 5.305
271 HD22 LEU 46 1HD2 LEU 46 0.572 -5.356 4.387
272 HD23 LEU 46 2HD2 LEU 46 -0.774 -4.574 3.558
273 H SER 47 H SER 47 4.201 -2.256 6.920
274 HA SER 47 HA SER 47 6.296 -4.273 6.696
275 HB3 SER 47 2HB SER 47 7.174 -1.677 7.661
276 HG SER 47 HG SER 47 7.641 -2.827 5.124
277 H SER 48 H SER 48 4.289 -4.409 8.825
278 HA SER 48 HA SER 48 5.968 -3.944 11.195
279 HB3 SER 48 2HB SER 48 2.987 -4.468 11.072
280 HG SER 48 HG SER 48 4.003 -3.189 13.250
281 H SER 49 H SER 49 6.291 -6.182 9.352
282 HA SER 49 HA SER 49 6.319 -8.484 9.284
283 HB3 SER 49 2HB SER 49 7.281 -9.406 11.492
284 HG SER 49 HG SER 49 8.373 -7.615 9.713
285 H SER 50 H SER 50 3.720 -7.293 10.086
286 HA SER 50 HA SER 50 2.137 -9.448 10.398
287 HB3 SER 50 2HB SER 50 2.843 -10.311 12.392
288 HG SER 50 HG SER 50 3.501 -7.675 13.218
289 HA PRO 51 HA PRO 51 0.221 -5.178 10.376
290 HB3 PRO 51 2HB PRO 51 0.763 -4.795 8.176
291 HG3 PRO 51 2HG PRO 51 1.210 -6.558 6.727
292 HD3 PRO 51 2HD PRO 51 2.583 -7.133 8.487
293 H LYS 52 H LYS 52 -1.614 -5.146 11.495
294 HA LYS 52 HA LYS 52 -3.661 -7.185 10.914
295 HB3 LYS 52 2HB LYS 52 -4.314 -7.165 13.163
296 HG3 LYS 52 2HG LYS 52 -1.356 -6.945 12.906
297 HD3 LYS 52 2HD LYS 52 -2.527 -7.651 15.551
298 HE3 LYS 52 2HE LYS 52 -0.059 -6.051 15.171
299 HZ1 LYS 52 3HZ LYS 52 -0.637 -8.446 16.829
300 HZ2 LYS 52 1HZ LYS 52 -0.815 -6.849 17.359
301 HZ3 LYS 52 2HZ LYS 52 0.716 -7.439 16.947
302 H CYS 53 H CYS 53 -3.667 -3.991 12.497
303 HA CYS 53 HA CYS 53 -4.842 -2.379 10.719
304 HB3 CYS 53 2HB CYS 53 -6.849 -4.357 11.729
305 H THR 54 H THR 54 -3.936 -0.841 12.029
306 HA THR 54 HA THR 54 -3.854 -0.425 14.646
307 HB THR 54 HB THR 54 -3.979 1.353 12.378
308 HG1 THR 54 1HG THR 54 -2.227 0.844 13.975
309 HG21 THR 54 3HG2 THR 54 -5.211 2.364 14.944
310 HG22 THR 54 1HG2 THR 54 -6.000 2.247 13.372
311 HG23 THR 54 2HG2 THR 54 -4.675 3.387 13.611
312 H ALA 55 H ALA 55 -6.778 -0.066 12.714
313 HA ALA 55 HA ALA 55 -8.464 1.119 14.568
314 HB1 ALA 55 3HB ALA 55 -10.064 0.749 13.048
315 HB2 ALA 55 1HB ALA 55 -8.755 0.129 12.042
316 HB3 ALA 55 2HB ALA 55 -9.743 -0.983 12.989
317 H CYS 56 H CYS 56 -8.720 -2.344 13.807
318 HA CYS 56 HA CYS 56 -9.208 -2.840 16.671
319 HB3 CYS 56 2HB CYS 56 -11.206 -3.250 15.359
320 H GLN 57 H GLN 57 -7.368 -3.696 13.878
321 HA GLN 57 HA GLN 57 -5.357 -4.819 13.795
322 HB3 GLN 57 2HB GLN 57 -4.327 -5.690 15.700
323 HG3 GLN 57 2HG GLN 57 -5.926 -4.098 17.491
324 HE21 GLN 57 1HE2 GLN 57 -3.437 -2.816 15.416
325 HE22 GLN 57 2HE2 GLN 57 -2.168 -2.845 16.588
326 H GLU 58 H GLU 58 -6.187 -6.087 12.143
327 HA GLU 58 HA GLU 58 -7.001 -8.791 12.964
328 HB3 GLU 58 2HB GLU 58 -8.338 -6.930 11.062
329 HG3 GLU 58 2HG GLU 58 -7.998 -8.547 9.449
330 H SER 59 H SER 59 -6.512 -7.294 9.785
331 HA SER 59 HA SER 59 -3.938 -8.406 9.355
332 HB3 SER 59 2HB SER 59 -5.343 -10.483 9.282
333 HG SER 59 HG SER 59 -6.348 -10.311 6.885
334 H ILE 60 H ILE 60 -2.967 -7.408 7.680
335 HA ILE 60 HA ILE 60 -4.647 -6.060 5.684
336 HB ILE 60 HB ILE 60 -2.226 -4.588 6.509
337 HG13 ILE 60 2HG1 ILE 60 -3.250 -5.383 8.674
338 HG21 ILE 60 1HG2 ILE 60 -4.934 -4.043 5.444
339 HG22 ILE 60 2HG2 ILE 60 -4.178 -2.776 6.410
340 HG23 ILE 60 3HG2 ILE 60 -3.370 -3.382 4.965
341 HD11 ILE 60 3HD1 ILE 60 -2.150 -3.008 8.210
342 HD12 ILE 60 1HD1 ILE 60 -3.770 -2.477 8.658
343 HD13 ILE 60 2HD1 ILE 60 -2.823 -3.461 9.776
344 H VAL 61 H VAL 61 -4.111 -7.240 3.933
345 HA VAL 61 HA VAL 61 -1.247 -7.428 3.258
346 HB VAL 61 HB VAL 61 -3.437 -9.422 2.676
347 HG11 VAL 61 1HG1 VAL 61 -0.734 -9.053 1.478
348 HG12 VAL 61 2HG1 VAL 61 -1.345 -10.690 1.725
349 HG13 VAL 61 3HG1 VAL 61 -2.245 -9.554 0.719
350 HG21 VAL 61 3HG2 VAL 61 -2.735 -10.410 4.537
351 HG22 VAL 61 1HG2 VAL 61 -1.140 -10.604 3.809
352 HG23 VAL 61 2HG2 VAL 61 -1.505 -9.168 4.767
353 H LYS 62 H LYS 62 -0.695 -6.333 1.502
354 HA LYS 62 HA LYS 62 -2.266 -4.742 -0.033
355 HB3 LYS 62 2HB LYS 62 0.047 -4.490 -0.313
356 HG3 LYS 62 2HG LYS 62 0.558 -7.084 -1.632
357 HD3 LYS 62 2HD LYS 62 2.641 -6.752 -0.102
358 HE3 LYS 62 2HE LYS 62 1.937 -5.821 -2.694
359 HZ1 LYS 62 3HZ LYS 62 2.376 -3.649 -2.513
360 HZ2 LYS 62 1HZ LYS 62 4.000 -4.118 -2.452
361 HZ3 LYS 62 2HZ LYS 62 3.155 -3.809 -1.020
362 H ASP 63 H ASP 63 -1.577 -8.162 -0.604
363 HA ASP 63 HA ASP 63 -2.917 -8.355 -3.085
364 HB3 ASP 63 2HB ASP 63 -1.357 -10.039 -1.581
365 H LYS 64 H LYS 64 -3.972 -8.827 0.252
366 HA LYS 64 HA LYS 64 -6.658 -9.539 -0.586
367 HB3 LYS 64 2HB LYS 64 -7.122 -9.892 1.741
368 HG3 LYS 64 2HG LYS 64 -4.776 -11.050 2.423
369 HD3 LYS 64 2HD LYS 64 -6.661 -12.177 0.357
370 HE3 LYS 64 2HE LYS 64 -5.486 -13.726 2.608
371 HZ1 LYS 64 3HZ LYS 64 -5.850 -15.512 1.241
372 HZ2 LYS 64 1HZ LYS 64 -5.715 -14.611 -0.184
373 HZ3 LYS 64 2HZ LYS 64 -7.114 -14.498 0.759
374 H VAL 65 H VAL 65 -4.944 -6.710 -0.108
375 HA VAL 65 HA VAL 65 -7.133 -5.135 0.945
376 HB VAL 65 HB VAL 65 -4.307 -4.771 0.630
377 HG11 VAL 65 1HG1 VAL 65 -4.927 -3.514 -1.396
378 HG12 VAL 65 2HG1 VAL 65 -5.972 -2.483 -0.416
379 HG13 VAL 65 3HG1 VAL 65 -4.228 -2.479 -0.150
380 HG21 VAL 65 3HG2 VAL 65 -4.969 -4.248 2.725
381 HG22 VAL 65 1HG2 VAL 65 -5.142 -2.632 2.040
382 HG23 VAL 65 2HG2 VAL 65 -6.552 -3.679 2.199
383 H PHE 66 H PHE 66 -8.330 -3.613 -0.169
384 HA PHE 66 HA PHE 66 -7.894 -3.190 -2.998
385 HB3 PHE 66 2HB PHE 66 -9.235 -4.919 -3.577
386 HD1 PHE 66 2HD PHE 66 -10.231 -3.867 -0.170
387 HD2 PHE 66 1HD PHE 66 -10.191 -6.990 -3.061
388 HE1 PHE 66 2HE PHE 66 -11.016 -5.453 1.538
389 HE2 PHE 66 1HE PHE 66 -10.978 -8.582 -1.357
390 HZ PHE 66 HZ PHE 66 -11.390 -7.814 0.946
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -23.169 27.560 -3.004
2 HA2 GLY 1 1HA GLY 1 -22.780 29.955 -1.345
3 HA3 GLY 1 2HA GLY 1 -21.591 29.571 -2.580
4 H SER 2 H SER 2 -21.861 30.517 -4.482
5 HA SER 2 HA SER 2 -23.945 32.276 -5.046
6 HB3 SER 2 2HB SER 2 -22.637 31.076 -7.403
7 HG SER 2 HG SER 2 -22.843 33.686 -6.310
8 H SER 3 H SER 3 -23.361 29.060 -6.475
9 HA SER 3 HA SER 3 -26.114 29.021 -7.456
10 HB3 SER 3 2HB SER 3 -24.781 26.615 -8.136
11 HG SER 3 HG SER 3 -24.815 27.679 -10.245
12 H GLY 4 H GLY 4 -23.922 27.122 -5.409
13 HA2 GLY 4 1HA GLY 4 -24.476 25.916 -3.496
14 HA3 GLY 4 2HA GLY 4 -26.175 26.220 -3.828
15 H SER 5 H SER 5 -23.663 23.959 -3.951
16 HA SER 5 HA SER 5 -24.148 22.279 -6.021
17 HB3 SER 5 2HB SER 5 -23.628 21.531 -3.136
18 HG SER 5 HG SER 5 -23.049 19.529 -3.908
19 H SER 6 H SER 6 -25.895 21.337 -6.819
20 HA SER 6 HA SER 6 -28.241 20.992 -5.104
21 HB3 SER 6 2HB SER 6 -29.556 20.971 -7.069
22 HG SER 6 HG SER 6 -28.920 22.837 -8.107
23 H GLY 7 H GLY 7 -28.690 19.067 -4.277
24 HA2 GLY 7 1HA GLY 7 -28.509 16.660 -5.807
25 HA3 GLY 7 2HA GLY 7 -27.226 16.761 -4.611
26 H PHE 8 H PHE 8 -30.123 15.429 -5.131
27 HA PHE 8 HA PHE 8 -31.702 15.944 -2.915
28 HB3 PHE 8 2HB PHE 8 -31.958 13.192 -3.380
29 HD1 PHE 8 2HD PHE 8 -32.957 15.535 -6.022
30 HD2 PHE 8 1HD PHE 8 -34.079 13.644 -2.377
31 HE1 PHE 8 2HE PHE 8 -35.282 16.264 -6.364
32 HE2 PHE 8 1HE PHE 8 -36.406 14.369 -2.713
33 HZ PHE 8 HZ PHE 8 -37.010 15.681 -4.708
34 H VAL 9 H VAL 9 -32.136 13.905 -1.321
35 HA VAL 9 HA VAL 9 -29.611 13.605 0.151
36 HB VAL 9 HB VAL 9 -31.469 14.733 1.338
37 HG11 VAL 9 1HG1 VAL 9 -33.548 13.959 1.249
38 HG12 VAL 9 2HG1 VAL 9 -32.991 12.620 0.243
39 HG13 VAL 9 3HG1 VAL 9 -33.042 12.446 1.998
40 HG21 VAL 9 3HG2 VAL 9 -31.248 12.241 2.874
41 HG22 VAL 9 1HG2 VAL 9 -29.713 12.897 2.304
42 HG23 VAL 9 2HG2 VAL 9 -30.778 13.886 3.303
43 H LYS 10 H LYS 10 -30.621 11.912 -2.117
44 HA LYS 10 HA LYS 10 -30.898 9.335 -0.733
45 HB3 LYS 10 2HB LYS 10 -31.290 9.873 -3.678
46 HG3 LYS 10 2HG LYS 10 -31.920 7.586 -1.869
47 HD3 LYS 10 2HD LYS 10 -33.361 6.788 -3.859
48 HE3 LYS 10 2HE LYS 10 -33.977 7.990 -1.436
49 HZ1 LYS 10 3HZ LYS 10 -35.053 9.553 -3.587
50 HZ2 LYS 10 1HZ LYS 10 -34.997 9.889 -1.929
51 HZ3 LYS 10 2HZ LYS 10 -36.253 8.948 -2.560
52 H THR 11 H THR 11 -28.893 11.140 -2.961
53 HA THR 11 HA THR 11 -27.239 8.998 -3.794
54 HB THR 11 HB THR 11 -27.453 11.689 -4.446
55 HG1 THR 11 1HG THR 11 -25.900 11.101 -6.024
56 HG21 THR 11 3HG2 THR 11 -25.379 12.735 -4.078
57 HG22 THR 11 1HG2 THR 11 -24.619 11.235 -3.548
58 HG23 THR 11 2HG2 THR 11 -25.806 12.034 -2.517
59 H VAL 12 H VAL 12 -24.771 9.155 -3.338
60 HA VAL 12 HA VAL 12 -24.413 9.318 -0.416
61 HB VAL 12 HB VAL 12 -24.138 7.058 -0.900
62 HG11 VAL 12 1HG1 VAL 12 -22.572 7.831 -3.359
63 HG12 VAL 12 2HG1 VAL 12 -22.914 6.183 -2.828
64 HG13 VAL 12 3HG1 VAL 12 -24.233 7.241 -3.331
65 HG21 VAL 12 3HG2 VAL 12 -22.035 8.418 0.054
66 HG22 VAL 12 1HG2 VAL 12 -22.040 6.665 -0.140
67 HG23 VAL 12 2HG2 VAL 12 -21.286 7.685 -1.364
68 H GLU 13 H GLU 13 -23.844 11.577 -0.712
69 HA GLU 13 HA GLU 13 -21.404 12.168 -2.163
70 HB3 GLU 13 2HB GLU 13 -21.803 14.494 -1.381
71 HG3 GLU 13 2HG GLU 13 -24.502 13.921 -2.269
72 H ASP 14 H ASP 14 -19.908 10.901 -0.982
73 HA ASP 14 HA ASP 14 -18.486 12.246 0.996
74 HB3 ASP 14 2HB ASP 14 -19.100 10.206 2.723
75 H LYS 15 H LYS 15 -16.515 11.291 1.384
76 HA LYS 15 HA LYS 15 -16.007 8.819 -0.120
77 HB3 LYS 15 2HB LYS 15 -13.924 9.605 -0.631
78 HG3 LYS 15 2HG LYS 15 -15.740 11.481 -1.054
79 HD3 LYS 15 2HD LYS 15 -14.528 12.347 1.355
80 HE3 LYS 15 2HE LYS 15 -12.827 13.242 -0.402
81 HZ1 LYS 15 3HZ LYS 15 -13.867 15.669 -0.834
82 HZ2 LYS 15 1HZ LYS 15 -15.237 14.702 -1.056
83 HZ3 LYS 15 2HZ LYS 15 -13.851 14.429 -1.984
84 H TYR 16 H TYR 16 -13.600 8.077 1.008
85 HA TYR 16 HA TYR 16 -14.510 7.051 3.594
86 HB3 TYR 16 2HB TYR 16 -12.655 5.410 3.324
87 HD1 TYR 16 2HD TYR 16 -15.678 6.420 1.945
88 HD2 TYR 16 1HD TYR 16 -12.661 3.457 1.470
89 HE1 TYR 16 2HE TYR 16 -17.303 4.954 0.824
90 HE2 TYR 16 1HE TYR 16 -14.278 1.982 0.347
91 HH TYR 16 HH TYR 16 -16.350 2.054 -0.796
92 H LYS 17 H LYS 17 -12.291 6.446 4.926
93 HA LYS 17 HA LYS 17 -10.426 8.645 4.989
94 HB3 LYS 17 2HB LYS 17 -12.620 8.368 6.999
95 HG3 LYS 17 2HG LYS 17 -10.851 10.114 8.184
96 HD3 LYS 17 2HD LYS 17 -10.504 7.921 9.691
97 HE3 LYS 17 2HE LYS 17 -12.488 10.017 9.491
98 HZ1 LYS 17 3HZ LYS 17 -13.475 7.901 11.215
99 HZ2 LYS 17 1HZ LYS 17 -13.733 7.668 9.558
100 HZ3 LYS 17 2HZ LYS 17 -14.328 9.057 10.320
101 H CYS 18 H CYS 18 -8.530 8.109 5.985
102 HA CYS 18 HA CYS 18 -7.944 5.396 6.400
103 HB3 CYS 18 2HB CYS 18 -6.460 7.917 7.140
104 H GLU 19 H GLU 19 -7.753 4.144 8.206
105 HA GLU 19 HA GLU 19 -9.172 5.059 10.558
106 HB3 GLU 19 2HB GLU 19 -8.538 2.630 11.303
107 HG3 GLU 19 2HG GLU 19 -10.440 1.716 10.297
108 H LYS 20 H LYS 20 -6.533 6.200 9.892
109 HA LYS 20 HA LYS 20 -5.224 5.629 12.459
110 HB3 LYS 20 2HB LYS 20 -3.294 6.361 10.432
111 HG3 LYS 20 2HG LYS 20 -3.635 4.045 12.305
112 HD3 LYS 20 2HD LYS 20 -1.330 4.484 10.406
113 HE3 LYS 20 2HE LYS 20 -0.245 2.799 11.448
114 HZ1 LYS 20 3HZ LYS 20 -2.135 3.298 13.675
115 HZ2 LYS 20 1HZ LYS 20 -0.917 4.390 13.243
116 HZ3 LYS 20 2HZ LYS 20 -0.511 2.837 13.776
117 H CYS 21 H CYS 21 -4.715 7.794 9.668
118 HA CYS 21 HA CYS 21 -4.398 10.031 11.525
119 HB3 CYS 21 2HB CYS 21 -2.630 9.899 9.938
120 H HIS 22 H HIS 22 -6.886 8.599 9.999
121 HA HIS 22 HA HIS 22 -9.005 9.221 9.455
122 HB3 HIS 22 2HB HIS 22 -9.895 10.620 10.966
123 HD2 HIS 22 2HD HIS 22 -7.776 8.826 12.484
124 HE1 HIS 22 1HE HIS 22 -6.431 12.396 14.339
125 HE2 HIS 22 2HE HIS 22 -6.373 9.878 14.384
126 H LEU 23 H LEU 23 -6.701 9.830 7.679
127 HA LEU 23 HA LEU 23 -7.225 12.283 6.337
128 HB3 LEU 23 2HB LEU 23 -5.971 10.706 4.481
129 HG LEU 23 HG LEU 23 -4.811 12.402 6.661
130 HD11 LEU 23 1HD1 LEU 23 -2.825 11.744 4.735
131 HD12 LEU 23 2HD1 LEU 23 -3.451 10.250 5.430
132 HD13 LEU 23 3HD1 LEU 23 -2.795 11.504 6.482
133 HD21 LEU 23 3HD2 LEU 23 -5.930 13.376 4.641
134 HD22 LEU 23 1HD2 LEU 23 -4.659 12.641 3.663
135 HD23 LEU 23 2HD2 LEU 23 -4.250 13.863 4.866
136 H VAL 24 H VAL 24 -8.918 12.730 5.107
137 HA VAL 24 HA VAL 24 -10.786 10.775 4.257
138 HB VAL 24 HB VAL 24 -10.453 13.697 3.625
139 HG11 VAL 24 1HG1 VAL 24 -12.316 11.710 2.386
140 HG12 VAL 24 2HG1 VAL 24 -12.812 13.390 2.598
141 HG13 VAL 24 3HG1 VAL 24 -11.393 13.004 1.623
142 HG21 VAL 24 3HG2 VAL 24 -11.729 13.974 5.421
143 HG22 VAL 24 1HG2 VAL 24 -12.979 12.943 4.723
144 HG23 VAL 24 2HG2 VAL 24 -11.691 12.232 5.697
145 H LEU 25 H LEU 25 -10.513 9.386 2.648
146 HA LEU 25 HA LEU 25 -8.973 10.247 0.288
147 HB3 LEU 25 2HB LEU 25 -7.820 8.341 0.299
148 HG LEU 25 HG LEU 25 -8.972 8.225 3.054
149 HD11 LEU 25 1HD1 LEU 25 -8.694 6.028 3.197
150 HD12 LEU 25 2HD1 LEU 25 -6.968 6.291 2.949
151 HD13 LEU 25 3HD1 LEU 25 -8.015 5.947 1.570
152 HD21 LEU 25 3HD2 LEU 25 -6.204 8.539 1.901
153 HD22 LEU 25 1HD2 LEU 25 -6.562 8.430 3.625
154 HD23 LEU 25 2HD2 LEU 25 -7.185 9.782 2.678
155 H CYS 26 H CYS 26 -9.576 8.268 -1.466
156 HA CYS 26 HA CYS 26 -12.509 8.336 -1.702
157 HB3 CYS 26 2HB CYS 26 -12.463 9.260 -3.773
158 H SER 27 H SER 27 -9.791 6.467 -1.500
159 HA SER 27 HA SER 27 -11.141 4.049 -1.985
160 HB3 SER 27 2HB SER 27 -10.945 4.699 -4.347
161 HG SER 27 HG SER 27 -8.839 4.847 -5.249
162 HA PRO 28 HA PRO 28 -7.322 3.826 0.587
163 HB3 PRO 28 2HB PRO 28 -8.568 4.127 2.494
164 HG3 PRO 28 2HG PRO 28 -10.834 3.612 2.541
165 HD3 PRO 28 2HD PRO 28 -10.759 4.900 0.631
166 H LYS 29 H LYS 29 -6.880 1.525 1.976
167 HA LYS 29 HA LYS 29 -6.920 -0.538 -0.129
168 HB3 LYS 29 2HB LYS 29 -4.776 -1.202 0.448
169 HG3 LYS 29 2HG LYS 29 -3.348 0.642 0.484
170 HD3 LYS 29 2HD LYS 29 -5.515 2.313 -0.503
171 HE3 LYS 29 2HE LYS 29 -2.940 2.043 -1.102
172 HZ1 LYS 29 3HZ LYS 29 -3.454 0.927 -3.550
173 HZ2 LYS 29 1HZ LYS 29 -4.185 -0.135 -2.453
174 HZ3 LYS 29 2HZ LYS 29 -2.541 0.237 -2.303
175 H GLN 30 H GLN 30 -9.132 -0.754 1.101
176 HA GLN 30 HA GLN 30 -9.621 -1.690 3.545
177 HB3 GLN 30 2HB GLN 30 -10.797 -3.589 1.714
178 HG3 GLN 30 2HG GLN 30 -11.793 -1.317 3.380
179 HE21 GLN 30 1HE2 GLN 30 -14.006 -3.726 2.889
180 HE22 GLN 30 2HE2 GLN 30 -15.037 -2.931 1.753
181 H THR 31 H THR 31 -9.154 -3.376 4.839
182 HA THR 31 HA THR 31 -7.179 -5.297 3.863
183 HB THR 31 HB THR 31 -6.602 -5.731 6.108
184 HG1 THR 31 1HG THR 31 -8.969 -4.348 6.898
185 HG21 THR 31 3HG2 THR 31 -7.312 -2.894 6.557
186 HG22 THR 31 1HG2 THR 31 -6.362 -3.248 5.115
187 HG23 THR 31 2HG2 THR 31 -5.756 -3.710 6.705
188 H GLU 32 H GLU 32 -7.800 -7.202 5.998
189 HA GLU 32 HA GLU 32 -9.999 -8.581 4.645
190 HB3 GLU 32 2HB GLU 32 -8.252 -9.835 6.734
191 HG3 GLU 32 2HG GLU 32 -8.470 -11.635 4.752
192 H CYS 33 H CYS 33 -10.008 -6.431 6.900
193 HA CYS 33 HA CYS 33 -11.840 -7.894 8.686
194 HB3 CYS 33 2HB CYS 33 -9.688 -7.023 9.719
195 H GLY 34 H GLY 34 -11.299 -5.063 6.728
196 HA2 GLY 34 1HA GLY 34 -13.467 -4.276 5.704
197 HA3 GLY 34 2HA GLY 34 -14.033 -4.141 7.362
198 H HIS 35 H HIS 35 -11.934 -2.973 8.640
199 HA HIS 35 HA HIS 35 -12.266 -0.294 8.266
200 HB3 HIS 35 2HB HIS 35 -9.996 -0.028 9.365
201 HD2 HIS 35 2HD HIS 35 -12.113 0.867 11.107
202 HE1 HIS 35 1HE HIS 35 -12.329 -2.834 13.170
203 HE2 HIS 35 2HE HIS 35 -13.075 -0.429 13.128
204 H ARG 36 H ARG 36 -10.475 1.306 7.623
205 HA ARG 36 HA ARG 36 -9.123 0.444 5.164
206 HB3 ARG 36 2HB ARG 36 -9.806 2.591 4.090
207 HG3 ARG 36 2HG ARG 36 -11.767 0.488 4.796
208 HD3 ARG 36 2HD ARG 36 -13.044 2.157 2.941
209 HE ARG 36 HE ARG 36 -13.784 0.853 5.244
210 HH11 ARG 36 1HH1 ARG 36 -14.448 3.940 3.778
211 HH12 ARG 36 2HH1 ARG 36 -16.034 4.070 4.461
212 HH21 ARG 36 1HH2 ARG 36 -15.871 1.013 6.150
213 HH22 ARG 36 2HH2 ARG 36 -16.843 2.405 5.812
214 H PHE 37 H PHE 37 -7.507 2.089 4.414
215 HA PHE 37 HA PHE 37 -6.517 3.931 6.411
216 HB3 PHE 37 2HB PHE 37 -4.196 2.824 6.272
217 HD1 PHE 37 1HD PHE 37 -6.725 0.290 7.159
218 HD2 PHE 37 2HD PHE 37 -4.183 3.402 8.561
219 HE1 PHE 37 1HE PHE 37 -7.193 -0.378 9.480
220 HE2 PHE 37 2HE PHE 37 -4.646 2.739 10.884
221 HZ PHE 37 HZ PHE 37 -6.151 0.846 11.347
222 H CYS 38 H CYS 38 -4.458 5.012 5.605
223 HA CYS 38 HA CYS 38 -4.831 5.615 2.773
224 HB3 CYS 38 2HB CYS 38 -4.765 7.449 4.475
225 H GLU 39 H GLU 39 -2.870 6.013 1.442
226 HA GLU 39 HA GLU 39 -1.358 3.802 1.022
227 HB3 GLU 39 2HB GLU 39 0.430 5.714 0.276
228 HG3 GLU 39 2HG GLU 39 -2.041 5.497 -1.365
229 H SER 40 H SER 40 -0.085 6.672 2.722
230 HA SER 40 HA SER 40 2.306 5.649 3.581
231 HB3 SER 40 2HB SER 40 1.457 7.180 5.748
232 HG SER 40 HG SER 40 2.528 8.884 4.489
233 H CYS 41 H CYS 41 -0.158 6.095 6.063
234 HA CYS 41 HA CYS 41 0.651 4.398 7.948
235 HB3 CYS 41 2HB CYS 41 -1.742 3.957 8.524
236 H MET 42 H MET 42 -1.349 3.347 5.193
237 HA MET 42 HA MET 42 -1.555 0.665 5.767
238 HB3 MET 42 2HB MET 42 -1.278 2.060 3.106
239 HG3 MET 42 2HG MET 42 -0.677 -0.304 2.826
240 HE1 MET 42 3HE MET 42 -3.463 0.115 5.524
241 HE2 MET 42 1HE MET 42 -4.290 0.285 3.974
242 HE3 MET 42 2HE MET 42 -4.628 -1.103 5.008
243 H ALA 43 H ALA 43 0.988 2.196 3.789
244 HA ALA 43 HA ALA 43 2.527 -0.115 3.409
245 HB1 ALA 43 3HB ALA 43 2.840 2.744 2.959
246 HB2 ALA 43 1HB ALA 43 4.358 1.936 3.351
247 HB3 ALA 43 2HB ALA 43 3.386 1.377 1.989
248 H ALA 44 H ALA 44 2.323 2.116 6.077
249 HA ALA 44 HA ALA 44 4.761 1.402 7.347
250 HB1 ALA 44 3HB ALA 44 4.199 3.188 8.535
251 HB2 ALA 44 1HB ALA 44 2.573 3.170 7.851
252 HB3 ALA 44 2HB ALA 44 2.927 2.246 9.312
253 H LEU 45 H LEU 45 1.383 0.492 8.054
254 HA LEU 45 HA LEU 45 1.904 -1.322 10.092
255 HB3 LEU 45 2HB LEU 45 -0.281 -2.262 9.630
256 HG LEU 45 HG LEU 45 -0.300 0.719 9.169
257 HD11 LEU 45 1HD1 LEU 45 -2.551 -1.197 9.742
258 HD12 LEU 45 2HD1 LEU 45 -2.364 -0.147 8.339
259 HD13 LEU 45 3HD1 LEU 45 -2.669 0.554 9.928
260 HD21 LEU 45 3HD2 LEU 45 0.167 0.845 11.333
261 HD22 LEU 45 1HD2 LEU 45 0.184 -0.913 11.465
262 HD23 LEU 45 2HD2 LEU 45 -1.326 -0.027 11.685
263 H LEU 46 H LEU 46 1.471 -1.985 6.618
264 HA LEU 46 HA LEU 46 1.884 -4.725 6.674
265 HB3 LEU 46 2HB LEU 46 2.496 -4.541 4.325
266 HG LEU 46 HG LEU 46 0.253 -2.729 5.160
267 HD11 LEU 46 1HD1 LEU 46 1.088 -3.395 2.341
268 HD12 LEU 46 2HD1 LEU 46 1.152 -1.804 3.097
269 HD13 LEU 46 3HD1 LEU 46 -0.405 -2.582 2.810
270 HD21 LEU 46 3HD2 LEU 46 0.492 -5.468 4.959
271 HD22 LEU 46 1HD2 LEU 46 -0.290 -5.012 3.445
272 HD23 LEU 46 2HD2 LEU 46 -1.017 -4.554 4.986
273 H SER 47 H SER 47 4.223 -2.099 6.643
274 HA SER 47 HA SER 47 6.525 -3.650 6.150
275 HB3 SER 47 2HB SER 47 6.488 -1.132 7.813
276 HG SER 47 HG SER 47 8.544 -1.309 7.485
277 H SER 48 H SER 48 4.459 -3.646 8.776
278 HA SER 48 HA SER 48 6.380 -4.105 10.857
279 HB3 SER 48 2HB SER 48 3.410 -4.701 10.822
280 HG SER 48 HG SER 48 4.898 -4.081 13.114
281 H SER 49 H SER 49 6.407 -6.134 12.130
282 HA SER 49 HA SER 49 6.900 -8.360 10.400
283 HB3 SER 49 2HB SER 49 7.269 -9.528 12.699
284 HG SER 49 HG SER 49 9.265 -8.269 12.938
285 H SER 50 H SER 50 4.095 -7.150 11.550
286 HA SER 50 HA SER 50 2.569 -9.423 10.871
287 HB3 SER 50 2HB SER 50 1.668 -9.276 13.496
288 HG SER 50 HG SER 50 2.741 -11.371 13.620
289 HA PRO 51 HA PRO 51 0.442 -5.313 10.808
290 HB3 PRO 51 2HB PRO 51 1.111 -4.946 8.640
291 HG3 PRO 51 2HG PRO 51 1.690 -6.716 7.248
292 HD3 PRO 51 2HD PRO 51 2.963 -7.235 9.098
293 H LYS 52 H LYS 52 -1.468 -5.300 11.795
294 HA LYS 52 HA LYS 52 -3.423 -7.399 11.121
295 HB3 LYS 52 2HB LYS 52 -4.234 -7.345 13.326
296 HG3 LYS 52 2HG LYS 52 -1.277 -7.196 13.193
297 HD3 LYS 52 2HD LYS 52 -2.463 -7.722 15.856
298 HE3 LYS 52 2HE LYS 52 0.075 -6.474 14.820
299 HZ1 LYS 52 3HZ LYS 52 0.558 -5.712 16.836
300 HZ2 LYS 52 1HZ LYS 52 0.023 -7.123 17.602
301 HZ3 LYS 52 2HZ LYS 52 -1.079 -5.898 17.223
302 H CYS 53 H CYS 53 -3.611 -4.193 12.664
303 HA CYS 53 HA CYS 53 -4.704 -2.626 10.792
304 HB3 CYS 53 2HB CYS 53 -6.725 -4.641 11.694
305 H THR 54 H THR 54 -3.971 -1.018 12.103
306 HA THR 54 HA THR 54 -4.034 -0.567 14.720
307 HB THR 54 HB THR 54 -4.114 1.171 12.421
308 HG1 THR 54 1HG THR 54 -2.505 0.730 14.279
309 HG21 THR 54 3HG2 THR 54 -5.606 2.094 14.873
310 HG22 THR 54 1HG2 THR 54 -6.190 2.048 13.211
311 HG23 THR 54 2HG2 THR 54 -4.932 3.195 13.672
312 H ALA 55 H ALA 55 -6.867 -0.350 12.634
313 HA ALA 55 HA ALA 55 -8.691 0.773 14.399
314 HB1 ALA 55 3HB ALA 55 -9.816 -1.366 12.759
315 HB2 ALA 55 1HB ALA 55 -10.189 0.357 12.790
316 HB3 ALA 55 2HB ALA 55 -8.812 -0.230 11.859
317 H CYS 56 H CYS 56 -8.786 -2.693 13.620
318 HA CYS 56 HA CYS 56 -9.411 -3.216 16.451
319 HB3 CYS 56 2HB CYS 56 -11.307 -3.715 15.030
320 H GLN 57 H GLN 57 -7.401 -4.031 13.750
321 HA GLN 57 HA GLN 57 -5.344 -5.066 13.775
322 HB3 GLN 57 2HB GLN 57 -4.356 -5.842 15.741
323 HG3 GLN 57 2HG GLN 57 -6.093 -4.294 17.437
324 HE21 GLN 57 1HE2 GLN 57 -3.206 -4.275 15.389
325 HE22 GLN 57 2HE2 GLN 57 -2.131 -3.690 16.608
326 H GLU 58 H GLU 58 -6.113 -6.387 12.117
327 HA GLU 58 HA GLU 58 -6.829 -9.110 12.975
328 HB3 GLU 58 2HB GLU 58 -8.092 -7.398 10.862
329 HG3 GLU 58 2HG GLU 58 -7.378 -9.551 9.793
330 H SER 59 H SER 59 -6.155 -7.565 9.841
331 HA SER 59 HA SER 59 -3.564 -8.659 9.551
332 HB3 SER 59 2HB SER 59 -4.947 -10.752 9.381
333 HG SER 59 HG SER 59 -6.652 -10.617 8.174
334 H ILE 60 H ILE 60 -2.506 -7.666 7.919
335 HA ILE 60 HA ILE 60 -4.084 -6.314 5.844
336 HB ILE 60 HB ILE 60 -1.720 -4.840 6.836
337 HG13 ILE 60 2HG1 ILE 60 -2.916 -5.625 8.912
338 HG21 ILE 60 1HG2 ILE 60 -4.197 -4.353 5.385
339 HG22 ILE 60 2HG2 ILE 60 -3.849 -3.120 6.596
340 HG23 ILE 60 3HG2 ILE 60 -2.666 -3.480 5.339
341 HD11 ILE 60 3HD1 ILE 60 -3.239 -2.663 8.567
342 HD12 ILE 60 1HD1 ILE 60 -2.910 -3.565 10.046
343 HD13 ILE 60 2HD1 ILE 60 -1.670 -3.435 8.798
344 H VAL 61 H VAL 61 -3.395 -6.963 3.925
345 HA VAL 61 HA VAL 61 -0.516 -7.279 3.469
346 HB VAL 61 HB VAL 61 -2.600 -9.323 2.691
347 HG11 VAL 61 1HG1 VAL 61 -1.256 -9.570 0.897
348 HG12 VAL 61 2HG1 VAL 61 0.110 -8.769 1.674
349 HG13 VAL 61 3HG1 VAL 61 -0.246 -10.458 2.037
350 HG21 VAL 61 3HG2 VAL 61 -0.240 -9.454 4.563
351 HG22 VAL 61 1HG2 VAL 61 -1.947 -9.549 4.997
352 HG23 VAL 61 2HG2 VAL 61 -1.200 -10.845 4.062
353 H LYS 62 H LYS 62 0.163 -6.462 1.577
354 HA LYS 62 HA LYS 62 -1.433 -4.793 0.034
355 HB3 LYS 62 2HB LYS 62 0.880 -4.424 -0.096
356 HG3 LYS 62 2HG LYS 62 1.201 -7.294 -0.945
357 HD3 LYS 62 2HD LYS 62 2.963 -4.930 -1.201
358 HE3 LYS 62 2HE LYS 62 3.808 -6.709 0.621
359 HZ1 LYS 62 3HZ LYS 62 3.898 -8.169 -1.740
360 HZ2 LYS 62 1HZ LYS 62 4.544 -8.596 -0.236
361 HZ3 LYS 62 2HZ LYS 62 5.498 -7.774 -1.364
362 H ASP 63 H ASP 63 -0.634 -8.194 -0.402
363 HA ASP 63 HA ASP 63 -1.740 -8.461 -2.997
364 HB3 ASP 63 2HB ASP 63 -1.608 -10.711 -1.006
365 H LYS 64 H LYS 64 -3.045 -8.982 0.251
366 HA LYS 64 HA LYS 64 -5.637 -9.747 -0.796
367 HB3 LYS 64 2HB LYS 64 -6.262 -10.179 1.450
368 HG3 LYS 64 2HG LYS 64 -4.483 -11.519 2.403
369 HD3 LYS 64 2HD LYS 64 -4.322 -11.731 -0.599
370 HE3 LYS 64 2HE LYS 64 -3.915 -13.588 1.707
371 HZ1 LYS 64 3HZ LYS 64 -4.223 -14.736 -0.961
372 HZ2 LYS 64 1HZ LYS 64 -5.638 -14.377 -0.107
373 HZ3 LYS 64 2HZ LYS 64 -4.497 -15.435 0.555
374 H VAL 65 H VAL 65 -4.093 -6.882 -0.477
375 HA VAL 65 HA VAL 65 -6.376 -5.349 0.489
376 HB VAL 65 HB VAL 65 -3.547 -4.903 0.358
377 HG11 VAL 65 1HG1 VAL 65 -5.242 -2.768 -0.933
378 HG12 VAL 65 2HG1 VAL 65 -3.573 -2.555 -0.402
379 HG13 VAL 65 3HG1 VAL 65 -3.948 -3.692 -1.697
380 HG21 VAL 65 3HG2 VAL 65 -4.452 -2.800 1.706
381 HG22 VAL 65 1HG2 VAL 65 -5.929 -3.764 1.712
382 HG23 VAL 65 2HG2 VAL 65 -4.444 -4.422 2.397
383 H PHE 66 H PHE 66 -7.518 -3.863 -0.740
384 HA PHE 66 HA PHE 66 -6.899 -3.435 -3.518
385 HB3 PHE 66 2HB PHE 66 -8.025 -5.283 -4.198
386 HD1 PHE 66 2HD PHE 66 -10.806 -4.536 -1.918
387 HD2 PHE 66 1HD PHE 66 -7.556 -7.143 -2.785
388 HE1 PHE 66 2HE PHE 66 -11.674 -6.155 -0.282
389 HE2 PHE 66 1HE PHE 66 -8.418 -8.767 -1.150
390 HZ PHE 66 HZ PHE 66 -10.479 -8.274 0.105
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -26.200 23.921 -4.250
2 HA2 GLY 1 1HA GLY 1 -28.836 24.266 -5.024
3 HA3 GLY 1 2HA GLY 1 -28.039 25.208 -3.772
4 H SER 2 H SER 2 -28.779 27.219 -4.164
5 HA SER 2 HA SER 2 -29.063 29.233 -5.182
6 HB3 SER 2 2HB SER 2 -27.285 29.086 -7.398
7 HG SER 2 HG SER 2 -27.635 30.847 -5.894
8 H SER 3 H SER 3 -29.717 30.311 -7.250
9 HA SER 3 HA SER 3 -31.796 28.882 -8.476
10 HB3 SER 3 2HB SER 3 -30.472 31.517 -8.965
11 HG SER 3 HG SER 3 -31.780 31.845 -10.773
12 H GLY 4 H GLY 4 -31.387 27.098 -9.642
13 HA2 GLY 4 1HA GLY 4 -29.482 27.369 -11.883
14 HA3 GLY 4 2HA GLY 4 -29.569 25.904 -10.916
15 H SER 5 H SER 5 -29.864 25.089 -13.219
16 HA SER 5 HA SER 5 -32.444 25.509 -14.418
17 HB3 SER 5 2HB SER 5 -30.206 23.571 -15.039
18 HG SER 5 HG SER 5 -31.367 23.133 -16.933
19 H SER 6 H SER 6 -30.901 22.440 -13.483
20 HA SER 6 HA SER 6 -33.141 21.663 -11.853
21 HB3 SER 6 2HB SER 6 -33.870 21.246 -14.261
22 HG SER 6 HG SER 6 -32.506 20.170 -15.428
23 H GLY 7 H GLY 7 -32.762 19.738 -10.664
24 HA2 GLY 7 1HA GLY 7 -31.330 17.754 -10.351
25 HA3 GLY 7 2HA GLY 7 -29.975 18.765 -10.830
26 H PHE 8 H PHE 8 -28.709 19.137 -9.144
27 HA PHE 8 HA PHE 8 -28.045 19.316 -6.948
28 HB3 PHE 8 2HB PHE 8 -28.281 21.488 -6.397
29 HD1 PHE 8 2HD PHE 8 -27.280 21.448 -8.838
30 HD2 PHE 8 1HD PHE 8 -31.276 22.540 -7.859
31 HE1 PHE 8 2HE PHE 8 -27.450 22.704 -10.946
32 HE2 PHE 8 1HE PHE 8 -31.453 23.796 -9.967
33 HZ PHE 8 HZ PHE 8 -29.538 23.880 -11.513
34 H VAL 9 H VAL 9 -30.111 17.332 -7.328
35 HA VAL 9 HA VAL 9 -31.076 17.219 -4.579
36 HB VAL 9 HB VAL 9 -32.898 18.232 -6.014
37 HG11 VAL 9 1HG1 VAL 9 -33.612 17.239 -7.873
38 HG12 VAL 9 2HG1 VAL 9 -32.238 16.141 -7.725
39 HG13 VAL 9 3HG1 VAL 9 -33.805 15.691 -7.049
40 HG21 VAL 9 3HG2 VAL 9 -33.574 15.580 -4.746
41 HG22 VAL 9 1HG2 VAL 9 -33.282 17.071 -3.850
42 HG23 VAL 9 2HG2 VAL 9 -34.648 16.962 -4.960
43 H LYS 10 H LYS 10 -31.885 15.059 -3.998
44 HA LYS 10 HA LYS 10 -31.619 12.805 -3.853
45 HB3 LYS 10 2HB LYS 10 -31.136 12.254 -6.671
46 HG3 LYS 10 2HG LYS 10 -32.168 10.687 -5.021
47 HD3 LYS 10 2HD LYS 10 -34.584 12.453 -5.417
48 HE3 LYS 10 2HE LYS 10 -35.321 10.209 -5.279
49 HZ1 LYS 10 3HZ LYS 10 -33.545 8.937 -4.583
50 HZ2 LYS 10 1HZ LYS 10 -34.557 8.883 -3.228
51 HZ3 LYS 10 2HZ LYS 10 -33.215 9.912 -3.241
52 H THR 11 H THR 11 -30.106 10.933 -4.991
53 HA THR 11 HA THR 11 -27.997 10.092 -5.185
54 HB THR 11 HB THR 11 -26.544 12.591 -5.594
55 HG1 THR 11 1HG THR 11 -27.674 12.741 -7.773
56 HG21 THR 11 3HG2 THR 11 -26.886 9.946 -6.920
57 HG22 THR 11 1HG2 THR 11 -25.413 10.762 -6.397
58 HG23 THR 11 2HG2 THR 11 -26.233 11.280 -7.870
59 H VAL 12 H VAL 12 -26.150 9.770 -3.916
60 HA VAL 12 HA VAL 12 -25.903 11.533 -1.567
61 HB VAL 12 HB VAL 12 -27.037 9.264 -1.153
62 HG11 VAL 12 1HG1 VAL 12 -25.181 8.132 -2.576
63 HG12 VAL 12 2HG1 VAL 12 -24.252 8.178 -1.076
64 HG13 VAL 12 3HG1 VAL 12 -25.791 7.318 -1.136
65 HG21 VAL 12 3HG2 VAL 12 -24.572 9.768 0.494
66 HG22 VAL 12 1HG2 VAL 12 -25.979 10.829 0.545
67 HG23 VAL 12 2HG2 VAL 12 -26.132 9.138 1.023
68 H GLU 13 H GLU 13 -23.917 12.285 -1.219
69 HA GLU 13 HA GLU 13 -21.680 10.997 -2.634
70 HB3 GLU 13 2HB GLU 13 -20.552 13.235 -2.374
71 HG3 GLU 13 2HG GLU 13 -22.249 14.462 -3.942
72 H ASP 14 H ASP 14 -20.263 9.940 -1.430
73 HA ASP 14 HA ASP 14 -19.795 10.842 1.331
74 HB3 ASP 14 2HB ASP 14 -19.345 8.041 1.211
75 H LYS 15 H LYS 15 -17.838 9.013 2.013
76 HA LYS 15 HA LYS 15 -15.813 8.674 0.087
77 HB3 LYS 15 2HB LYS 15 -15.448 10.987 -0.001
78 HG3 LYS 15 2HG LYS 15 -15.263 11.332 2.955
79 HD3 LYS 15 2HD LYS 15 -16.222 13.227 0.821
80 HE3 LYS 15 2HE LYS 15 -14.997 14.709 2.710
81 HZ1 LYS 15 3HZ LYS 15 -17.064 15.469 2.331
82 HZ2 LYS 15 1HZ LYS 15 -17.446 14.622 3.746
83 HZ3 LYS 15 2HZ LYS 15 -17.750 13.925 2.235
84 H TYR 16 H TYR 16 -13.650 8.190 1.170
85 HA TYR 16 HA TYR 16 -14.194 6.775 3.690
86 HB3 TYR 16 2HB TYR 16 -12.451 5.240 3.102
87 HD1 TYR 16 2HD TYR 16 -13.183 6.383 -0.310
88 HD2 TYR 16 1HD TYR 16 -14.361 3.789 2.850
89 HE1 TYR 16 2HE TYR 16 -14.642 5.160 -1.866
90 HE2 TYR 16 1HE TYR 16 -15.824 2.558 1.301
91 HH TYR 16 HH TYR 16 -16.543 3.715 -1.859
92 H LYS 17 H LYS 17 -12.234 6.517 5.124
93 HA LYS 17 HA LYS 17 -10.328 8.706 5.019
94 HB3 LYS 17 2HB LYS 17 -12.516 8.495 7.047
95 HG3 LYS 17 2HG LYS 17 -10.782 10.353 8.112
96 HD3 LYS 17 2HD LYS 17 -10.382 8.259 9.746
97 HE3 LYS 17 2HE LYS 17 -12.393 10.312 9.442
98 HZ1 LYS 17 3HZ LYS 17 -13.220 7.750 10.678
99 HZ2 LYS 17 1HZ LYS 17 -14.033 8.641 9.492
100 HZ3 LYS 17 2HZ LYS 17 -13.938 9.229 11.074
101 H CYS 18 H CYS 18 -8.431 8.262 6.066
102 HA CYS 18 HA CYS 18 -7.825 5.571 6.636
103 HB3 CYS 18 2HB CYS 18 -6.327 8.128 7.224
104 H GLU 19 H GLU 19 -7.619 4.449 8.521
105 HA GLU 19 HA GLU 19 -8.999 5.532 10.823
106 HB3 GLU 19 2HB GLU 19 -8.171 3.099 11.652
107 HG3 GLU 19 2HG GLU 19 -10.257 2.188 11.019
108 H LYS 20 H LYS 20 -6.322 6.552 9.998
109 HA LYS 20 HA LYS 20 -4.994 6.184 12.595
110 HB3 LYS 20 2HB LYS 20 -3.064 6.756 10.540
111 HG3 LYS 20 2HG LYS 20 -3.488 4.558 12.521
112 HD3 LYS 20 2HD LYS 20 -1.181 4.685 10.586
113 HE3 LYS 20 2HE LYS 20 -0.282 2.976 11.727
114 HZ1 LYS 20 3HZ LYS 20 -2.304 3.735 13.765
115 HZ2 LYS 20 1HZ LYS 20 -0.801 4.481 13.541
116 HZ3 LYS 20 2HZ LYS 20 -0.878 2.875 14.064
117 H CYS 21 H CYS 21 -4.660 8.148 9.631
118 HA CYS 21 HA CYS 21 -4.261 10.510 11.323
119 HB3 CYS 21 2HB CYS 21 -2.505 10.254 9.734
120 H HIS 22 H HIS 22 -6.779 8.981 10.011
121 HA HIS 22 HA HIS 22 -8.900 9.560 9.427
122 HB3 HIS 22 2HB HIS 22 -9.757 11.083 10.830
123 HD2 HIS 22 2HD HIS 22 -7.585 9.431 12.443
124 HE1 HIS 22 1HE HIS 22 -6.244 13.154 13.972
125 HE2 HIS 22 2HE HIS 22 -6.154 10.650 14.221
126 H LEU 23 H LEU 23 -6.607 10.025 7.578
127 HA LEU 23 HA LEU 23 -7.150 12.349 6.036
128 HB3 LEU 23 2HB LEU 23 -5.916 10.707 4.279
129 HG LEU 23 HG LEU 23 -3.694 11.363 5.603
130 HD11 LEU 23 1HD1 LEU 23 -5.484 13.222 4.049
131 HD12 LEU 23 2HD1 LEU 23 -4.231 12.162 3.405
132 HD13 LEU 23 3HD1 LEU 23 -3.788 13.538 4.415
133 HD21 LEU 23 3HD2 LEU 23 -3.888 13.073 7.112
134 HD22 LEU 23 1HD2 LEU 23 -5.352 12.163 7.485
135 HD23 LEU 23 2HD2 LEU 23 -5.444 13.607 6.476
136 H VAL 24 H VAL 24 -8.948 12.682 4.921
137 HA VAL 24 HA VAL 24 -10.749 10.613 4.184
138 HB VAL 24 HB VAL 24 -10.628 13.510 3.341
139 HG11 VAL 24 1HG1 VAL 24 -12.711 11.403 2.805
140 HG12 VAL 24 2HG1 VAL 24 -13.017 13.135 2.662
141 HG13 VAL 24 3HG1 VAL 24 -11.815 12.362 1.628
142 HG21 VAL 24 3HG2 VAL 24 -11.290 12.383 5.775
143 HG22 VAL 24 1HG2 VAL 24 -11.737 13.994 5.215
144 HG23 VAL 24 2HG2 VAL 24 -12.852 12.645 4.999
145 H LEU 25 H LEU 25 -10.437 9.213 2.591
146 HA LEU 25 HA LEU 25 -9.140 10.162 0.121
147 HB3 LEU 25 2HB LEU 25 -7.646 8.538 0.271
148 HG LEU 25 HG LEU 25 -8.960 8.041 2.896
149 HD11 LEU 25 1HD1 LEU 25 -8.263 5.948 3.155
150 HD12 LEU 25 2HD1 LEU 25 -6.673 6.321 2.493
151 HD13 LEU 25 3HD1 LEU 25 -8.000 5.902 1.411
152 HD21 LEU 25 3HD2 LEU 25 -6.617 8.417 3.653
153 HD22 LEU 25 1HD2 LEU 25 -7.318 9.778 2.778
154 HD23 LEU 25 2HD2 LEU 25 -6.169 8.709 1.973
155 H CYS 26 H CYS 26 -9.711 8.794 -1.809
156 HA CYS 26 HA CYS 26 -12.600 8.301 -1.779
157 HB3 CYS 26 2HB CYS 26 -10.690 8.722 -4.087
158 H SER 27 H SER 27 -9.533 6.798 -2.670
159 HA SER 27 HA SER 27 -10.931 4.208 -2.793
160 HB3 SER 27 2HB SER 27 -8.647 5.156 -4.540
161 HG SER 27 HG SER 27 -8.601 3.124 -5.362
162 HA PRO 28 HA PRO 28 -7.670 4.074 0.486
163 HB3 PRO 28 2HB PRO 28 -9.236 4.464 2.122
164 HG3 PRO 28 2HG PRO 28 -11.484 3.984 1.769
165 HD3 PRO 28 2HD PRO 28 -11.034 5.199 -0.138
166 H LYS 29 H LYS 29 -7.536 1.821 2.010
167 HA LYS 29 HA LYS 29 -7.376 -0.367 0.043
168 HB3 LYS 29 2HB LYS 29 -5.254 -0.956 0.730
169 HG3 LYS 29 2HG LYS 29 -3.828 0.969 0.946
170 HD3 LYS 29 2HD LYS 29 -5.839 2.270 -0.722
171 HE3 LYS 29 2HE LYS 29 -3.037 1.358 -0.862
172 HZ1 LYS 29 3HZ LYS 29 -4.847 1.272 -3.169
173 HZ2 LYS 29 1HZ LYS 29 -3.507 0.300 -2.814
174 HZ3 LYS 29 2HZ LYS 29 -3.282 1.873 -3.395
175 H GLN 30 H GLN 30 -9.637 -0.491 1.191
176 HA GLN 30 HA GLN 30 -10.155 -1.252 3.719
177 HB3 GLN 30 2HB GLN 30 -11.368 -3.106 1.787
178 HG3 GLN 30 2HG GLN 30 -12.475 -0.997 3.624
179 HE21 GLN 30 1HE2 GLN 30 -14.434 -3.490 3.763
180 HE22 GLN 30 2HE2 GLN 30 -15.604 -3.077 2.560
181 H THR 31 H THR 31 -8.949 -2.490 5.002
182 HA THR 31 HA THR 31 -7.288 -4.592 4.157
183 HB THR 31 HB THR 31 -6.850 -5.039 6.431
184 HG1 THR 31 1HG THR 31 -9.426 -3.934 6.889
185 HG21 THR 31 3HG2 THR 31 -6.516 -2.584 5.494
186 HG22 THR 31 1HG2 THR 31 -6.147 -2.987 7.171
187 HG23 THR 31 2HG2 THR 31 -7.672 -2.197 6.770
188 H GLU 32 H GLU 32 -7.991 -6.541 6.214
189 HA GLU 32 HA GLU 32 -10.127 -7.912 4.743
190 HB3 GLU 32 2HB GLU 32 -8.348 -9.226 6.772
191 HG3 GLU 32 2HG GLU 32 -8.564 -10.946 4.714
192 H CYS 33 H CYS 33 -10.181 -5.881 7.109
193 HA CYS 33 HA CYS 33 -11.994 -7.468 8.807
194 HB3 CYS 33 2HB CYS 33 -9.866 -6.610 9.894
195 H GLY 34 H GLY 34 -11.502 -4.531 6.997
196 HA2 GLY 34 1HA GLY 34 -13.751 -3.795 6.035
197 HA3 GLY 34 2HA GLY 34 -14.214 -3.630 7.722
198 H HIS 35 H HIS 35 -12.015 -2.464 8.842
199 HA HIS 35 HA HIS 35 -12.363 0.222 8.396
200 HB3 HIS 35 2HB HIS 35 -10.091 0.506 9.467
201 HD2 HIS 35 2HD HIS 35 -12.165 1.443 11.227
202 HE1 HIS 35 1HE HIS 35 -12.381 -2.218 13.360
203 HE2 HIS 35 2HE HIS 35 -13.109 0.192 13.285
204 H ARG 36 H ARG 36 -10.396 1.713 7.753
205 HA ARG 36 HA ARG 36 -9.083 0.761 5.328
206 HB3 ARG 36 2HB ARG 36 -9.809 2.897 4.155
207 HG3 ARG 36 2HG ARG 36 -11.549 0.571 4.690
208 HD3 ARG 36 2HD ARG 36 -12.728 2.504 2.835
209 HE ARG 36 HE ARG 36 -14.245 0.840 3.286
210 HH11 ARG 36 1HH1 ARG 36 -13.033 2.155 6.274
211 HH12 ARG 36 2HH1 ARG 36 -14.188 1.321 7.260
212 HH21 ARG 36 1HH2 ARG 36 -15.771 -0.262 4.574
213 HH22 ARG 36 2HH2 ARG 36 -15.744 -0.054 6.292
214 H PHE 37 H PHE 37 -7.272 2.001 4.701
215 HA PHE 37 HA PHE 37 -6.447 4.125 6.547
216 HB3 PHE 37 2HB PHE 37 -4.094 3.069 6.415
217 HD1 PHE 37 2HD PHE 37 -6.599 0.552 7.432
218 HD2 PHE 37 1HD PHE 37 -4.029 3.709 8.678
219 HE1 PHE 37 2HE PHE 37 -7.025 -0.034 9.783
220 HE2 PHE 37 1HE PHE 37 -4.451 3.126 11.031
221 HZ PHE 37 HZ PHE 37 -5.952 1.254 11.587
222 H CYS 38 H CYS 38 -4.351 5.176 5.702
223 HA CYS 38 HA CYS 38 -4.782 5.754 2.872
224 HB3 CYS 38 2HB CYS 38 -4.653 7.593 4.586
225 H GLU 39 H GLU 39 -2.799 6.183 1.534
226 HA GLU 39 HA GLU 39 -1.332 3.942 1.070
227 HB3 GLU 39 2HB GLU 39 0.466 5.681 0.206
228 HG3 GLU 39 2HG GLU 39 -2.294 5.666 -0.989
229 H SER 40 H SER 40 -0.045 6.768 2.831
230 HA SER 40 HA SER 40 2.351 5.683 3.648
231 HB3 SER 40 2HB SER 40 1.631 7.242 5.811
232 HG SER 40 HG SER 40 2.774 8.848 4.709
233 H CYS 41 H CYS 41 -0.057 6.221 6.162
234 HA CYS 41 HA CYS 41 0.717 4.490 8.032
235 HB3 CYS 41 2HB CYS 41 -1.644 4.192 8.704
236 H MET 42 H MET 42 -1.217 3.551 5.207
237 HA MET 42 HA MET 42 -1.590 0.868 5.810
238 HB3 MET 42 2HB MET 42 -1.268 2.267 3.157
239 HG3 MET 42 2HG MET 42 -0.752 -0.075 2.789
240 HE1 MET 42 3HE MET 42 -3.485 0.247 5.660
241 HE2 MET 42 1HE MET 42 -4.268 0.512 4.101
242 HE3 MET 42 2HE MET 42 -4.650 -0.927 5.045
243 H ALA 43 H ALA 43 0.968 2.252 3.739
244 HA ALA 43 HA ALA 43 2.419 -0.092 3.357
245 HB1 ALA 43 3HB ALA 43 2.865 2.757 2.971
246 HB2 ALA 43 1HB ALA 43 4.344 1.874 3.348
247 HB3 ALA 43 2HB ALA 43 3.352 1.388 1.972
248 H ALA 44 H ALA 44 2.391 2.146 6.047
249 HA ALA 44 HA ALA 44 4.768 1.308 7.309
250 HB1 ALA 44 3HB ALA 44 3.547 2.211 9.399
251 HB2 ALA 44 1HB ALA 44 3.938 3.327 8.090
252 HB3 ALA 44 2HB ALA 44 2.296 2.703 8.258
253 H LEU 45 H LEU 45 1.396 0.506 8.172
254 HA LEU 45 HA LEU 45 1.933 -1.433 10.064
255 HB3 LEU 45 2HB LEU 45 -0.301 -2.278 9.658
256 HG LEU 45 HG LEU 45 -0.258 0.717 9.298
257 HD11 LEU 45 1HD1 LEU 45 -2.566 0.662 10.081
258 HD12 LEU 45 2HD1 LEU 45 -2.526 -1.101 10.099
259 HD13 LEU 45 3HD1 LEU 45 -2.386 -0.232 8.570
260 HD21 LEU 45 3HD2 LEU 45 0.647 -0.705 11.418
261 HD22 LEU 45 1HD2 LEU 45 -1.050 -0.502 11.851
262 HD23 LEU 45 2HD2 LEU 45 -0.048 0.912 11.527
263 H LEU 46 H LEU 46 1.261 -1.967 6.602
264 HA LEU 46 HA LEU 46 1.564 -4.692 6.484
265 HB3 LEU 46 2HB LEU 46 2.230 -4.396 4.144
266 HG LEU 46 HG LEU 46 0.110 -2.392 4.917
267 HD11 LEU 46 1HD1 LEU 46 0.715 -3.662 2.250
268 HD12 LEU 46 2HD1 LEU 46 0.993 -1.975 2.680
269 HD13 LEU 46 3HD1 LEU 46 -0.652 -2.608 2.613
270 HD21 LEU 46 3HD2 LEU 46 0.170 -5.314 4.705
271 HD22 LEU 46 1HD2 LEU 46 -1.146 -4.543 3.820
272 HD23 LEU 46 2HD2 LEU 46 -0.961 -4.257 5.550
273 H SER 47 H SER 47 4.073 -2.227 6.587
274 HA SER 47 HA SER 47 6.186 -4.192 6.276
275 HB3 SER 47 2HB SER 47 7.171 -1.631 7.120
276 HG SER 47 HG SER 47 7.978 -1.704 4.916
277 H SER 48 H SER 48 4.356 -4.303 8.589
278 HA SER 48 HA SER 48 6.260 -3.822 10.780
279 HB3 SER 48 2HB SER 48 3.282 -4.316 10.997
280 HG SER 48 HG SER 48 3.571 -3.987 13.077
281 H SER 49 H SER 49 5.787 -6.176 8.792
282 HA SER 49 HA SER 49 6.280 -8.408 8.891
283 HB3 SER 49 2HB SER 49 6.201 -8.642 11.836
284 HG SER 49 HG SER 49 8.528 -9.275 10.950
285 H SER 50 H SER 50 4.180 -7.571 11.653
286 HA SER 50 HA SER 50 2.208 -9.493 10.604
287 HB3 SER 50 2HB SER 50 2.549 -8.907 13.542
288 HG SER 50 HG SER 50 1.743 -11.357 13.039
289 HA PRO 51 HA PRO 51 0.324 -5.258 10.914
290 HB3 PRO 51 2HB PRO 51 0.799 -4.803 8.712
291 HG3 PRO 51 2HG PRO 51 1.154 -6.517 7.182
292 HD3 PRO 51 2HD PRO 51 2.572 -7.191 8.869
293 H LYS 52 H LYS 52 -1.625 -4.989 11.811
294 HA LYS 52 HA LYS 52 -3.645 -7.099 11.406
295 HB3 LYS 52 2HB LYS 52 -4.404 -6.768 13.656
296 HG3 LYS 52 2HG LYS 52 -1.703 -7.522 13.147
297 HD3 LYS 52 2HD LYS 52 -1.924 -6.686 15.977
298 HE3 LYS 52 2HE LYS 52 0.497 -6.187 14.383
299 HZ1 LYS 52 3HZ LYS 52 -0.211 -7.280 17.008
300 HZ2 LYS 52 1HZ LYS 52 0.922 -6.090 16.604
301 HZ3 LYS 52 2HZ LYS 52 1.278 -7.722 16.335
302 H CYS 53 H CYS 53 -3.717 -3.838 12.829
303 HA CYS 53 HA CYS 53 -4.826 -2.298 10.950
304 HB3 CYS 53 2HB CYS 53 -6.863 -4.264 11.926
305 H THR 54 H THR 54 -3.949 -0.753 12.298
306 HA THR 54 HA THR 54 -4.058 -0.269 14.905
307 HB THR 54 HB THR 54 -3.926 1.437 12.594
308 HG1 THR 54 1HG THR 54 -3.087 1.852 15.289
309 HG21 THR 54 3HG2 THR 54 -5.470 2.507 14.954
310 HG22 THR 54 1HG2 THR 54 -5.985 2.450 13.268
311 HG23 THR 54 2HG2 THR 54 -4.680 3.532 13.755
312 H ALA 55 H ALA 55 -6.815 0.024 12.748
313 HA ALA 55 HA ALA 55 -8.620 1.344 14.389
314 HB1 ALA 55 3HB ALA 55 -9.771 -0.861 12.831
315 HB2 ALA 55 1HB ALA 55 -10.133 0.865 12.801
316 HB3 ALA 55 2HB ALA 55 -8.742 0.240 11.914
317 H CYS 56 H CYS 56 -8.837 -2.164 13.837
318 HA CYS 56 HA CYS 56 -9.564 -2.469 16.677
319 HB3 CYS 56 2HB CYS 56 -11.453 -2.959 15.235
320 H GLN 57 H GLN 57 -7.466 -3.455 14.137
321 HA GLN 57 HA GLN 57 -5.479 -4.602 14.281
322 HB3 GLN 57 2HB GLN 57 -5.918 -5.914 16.858
323 HG3 GLN 57 2HG GLN 57 -3.790 -4.344 15.528
324 HE21 GLN 57 1HE2 GLN 57 -4.308 -2.454 16.987
325 HE22 GLN 57 2HE2 GLN 57 -3.494 -2.407 18.509
326 H GLU 58 H GLU 58 -6.309 -5.928 12.633
327 HA GLU 58 HA GLU 58 -7.143 -8.595 13.563
328 HB3 GLU 58 2HB GLU 58 -8.312 -8.596 11.183
329 HG3 GLU 58 2HG GLU 58 -9.982 -8.932 12.608
330 H SER 59 H SER 59 -6.643 -7.555 10.247
331 HA SER 59 HA SER 59 -3.963 -8.522 10.051
332 HB3 SER 59 2HB SER 59 -5.228 -10.246 8.217
333 HG SER 59 HG SER 59 -4.498 -11.580 10.392
334 H ILE 60 H ILE 60 -3.092 -7.225 8.591
335 HA ILE 60 HA ILE 60 -4.776 -6.245 6.385
336 HB ILE 60 HB ILE 60 -2.171 -4.950 7.019
337 HG13 ILE 60 2HG1 ILE 60 -3.369 -5.334 9.210
338 HG21 ILE 60 1HG2 ILE 60 -2.986 -3.574 5.477
339 HG22 ILE 60 2HG2 ILE 60 -4.545 -4.395 5.498
340 HG23 ILE 60 3HG2 ILE 60 -4.222 -3.088 6.636
341 HD11 ILE 60 3HD1 ILE 60 -2.112 -3.036 8.334
342 HD12 ILE 60 1HD1 ILE 60 -3.613 -2.460 9.057
343 HD13 ILE 60 2HD1 ILE 60 -2.505 -3.454 10.002
344 H VAL 61 H VAL 61 -4.251 -6.691 4.331
345 HA VAL 61 HA VAL 61 -1.549 -7.469 3.615
346 HB VAL 61 HB VAL 61 -3.876 -9.367 3.304
347 HG11 VAL 61 1HG1 VAL 61 -2.485 -10.776 1.977
348 HG12 VAL 61 2HG1 VAL 61 -2.451 -9.168 1.251
349 HG13 VAL 61 3HG1 VAL 61 -1.089 -9.727 2.222
350 HG21 VAL 61 3HG2 VAL 61 -3.035 -9.851 5.378
351 HG22 VAL 61 1HG2 VAL 61 -1.991 -10.865 4.381
352 HG23 VAL 61 2HG2 VAL 61 -1.408 -9.308 4.966
353 H LYS 62 H LYS 62 -1.071 -6.542 1.743
354 HA LYS 62 HA LYS 62 -2.778 -4.987 0.239
355 HB3 LYS 62 2HB LYS 62 -0.461 -4.667 -0.073
356 HG3 LYS 62 2HG LYS 62 0.103 -7.212 -1.445
357 HD3 LYS 62 2HD LYS 62 2.260 -6.930 -0.383
358 HE3 LYS 62 2HE LYS 62 2.725 -4.490 -1.102
359 HZ1 LYS 62 3HZ LYS 62 3.361 -5.751 -2.811
360 HZ2 LYS 62 1HZ LYS 62 1.882 -5.338 -3.523
361 HZ3 LYS 62 2HZ LYS 62 2.037 -6.795 -2.679
362 H ASP 63 H ASP 63 -1.694 -8.296 -0.521
363 HA ASP 63 HA ASP 63 -3.063 -8.722 -2.860
364 HB3 ASP 63 2HB ASP 63 -2.457 -10.617 -0.592
365 H LYS 64 H LYS 64 -4.307 -8.762 0.421
366 HA LYS 64 HA LYS 64 -6.967 -9.509 -0.547
367 HB3 LYS 64 2HB LYS 64 -7.518 -10.082 1.639
368 HG3 LYS 64 2HG LYS 64 -5.662 -11.286 2.668
369 HD3 LYS 64 2HD LYS 64 -4.949 -11.921 -0.058
370 HE3 LYS 64 2HE LYS 64 -5.101 -13.427 1.980
371 HZ1 LYS 64 3HZ LYS 64 -7.425 -14.491 2.049
372 HZ2 LYS 64 1HZ LYS 64 -7.964 -13.018 1.417
373 HZ3 LYS 64 2HZ LYS 64 -7.167 -13.057 2.908
374 H VAL 65 H VAL 65 -5.146 -6.766 0.187
375 HA VAL 65 HA VAL 65 -7.367 -5.125 1.059
376 HB VAL 65 HB VAL 65 -4.547 -4.915 1.183
377 HG11 VAL 65 1HG1 VAL 65 -4.192 -2.619 0.388
378 HG12 VAL 65 2HG1 VAL 65 -4.605 -3.716 -0.932
379 HG13 VAL 65 3HG1 VAL 65 -5.821 -2.610 -0.290
380 HG21 VAL 65 3HG2 VAL 65 -6.930 -3.603 2.301
381 HG22 VAL 65 1HG2 VAL 65 -5.487 -4.219 3.106
382 HG23 VAL 65 2HG2 VAL 65 -5.456 -2.635 2.331
383 H PHE 66 H PHE 66 -8.552 -3.763 -0.160
384 HA PHE 66 HA PHE 66 -8.379 -4.021 -3.028
385 HB3 PHE 66 2HB PHE 66 -10.379 -2.432 -2.937
386 HD1 PHE 66 1HD PHE 66 -10.317 -4.973 -0.219
387 HD2 PHE 66 2HD PHE 66 -11.642 -3.951 -4.133
388 HE1 PHE 66 1HE PHE 66 -11.662 -7.032 -0.298
389 HE2 PHE 66 2HE PHE 66 -12.989 -6.008 -4.218
390 HZ PHE 66 HZ PHE 66 -13.001 -7.551 -2.298
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -26.342 28.860 3.443
2 HA2 GLY 1 1HA GLY 1 -26.937 26.199 4.433
3 HA3 GLY 1 2HA GLY 1 -25.889 27.388 5.194
4 H SER 2 H SER 2 -27.366 26.125 6.921
5 HA SER 2 HA SER 2 -28.713 26.599 8.716
6 HB3 SER 2 2HB SER 2 -29.595 28.730 9.056
7 HG SER 2 HG SER 2 -27.237 28.607 8.006
8 H SER 3 H SER 3 -30.487 27.761 5.844
9 HA SER 3 HA SER 3 -32.834 26.274 6.640
10 HB3 SER 3 2HB SER 3 -32.560 27.649 3.986
11 HG SER 3 HG SER 3 -34.718 27.999 4.302
12 H GLY 4 H GLY 4 -30.085 25.736 4.693
13 HA2 GLY 4 1HA GLY 4 -31.407 23.676 3.089
14 HA3 GLY 4 2HA GLY 4 -29.766 24.262 2.871
15 H SER 5 H SER 5 -30.768 21.512 3.062
16 HA SER 5 HA SER 5 -29.377 20.640 5.507
17 HB3 SER 5 2HB SER 5 -30.893 18.561 4.147
18 HG SER 5 HG SER 5 -31.815 18.456 6.281
19 H SER 6 H SER 6 -29.600 20.272 2.032
20 HA SER 6 HA SER 6 -27.637 18.164 1.916
21 HB3 SER 6 2HB SER 6 -29.599 18.782 0.238
22 HG SER 6 HG SER 6 -28.570 20.838 -0.263
23 H GLY 7 H GLY 7 -25.535 18.321 1.065
24 HA2 GLY 7 1HA GLY 7 -24.321 20.958 1.486
25 HA3 GLY 7 2HA GLY 7 -23.470 19.421 1.479
26 H PHE 8 H PHE 8 -22.895 18.467 -0.497
27 HA PHE 8 HA PHE 8 -22.660 20.394 -2.675
28 HB3 PHE 8 2HB PHE 8 -21.410 17.652 -2.550
29 HD1 PHE 8 2HD PHE 8 -20.361 21.145 -3.320
30 HD2 PHE 8 1HD PHE 8 -20.783 17.141 -4.702
31 HE1 PHE 8 2HE PHE 8 -19.256 21.759 -5.431
32 HE2 PHE 8 1HE PHE 8 -19.679 17.750 -6.814
33 HZ PHE 8 HZ PHE 8 -18.916 20.062 -7.182
34 H VAL 9 H VAL 9 -24.921 20.237 -3.267
35 HA VAL 9 HA VAL 9 -26.407 19.615 -4.911
36 HB VAL 9 HB VAL 9 -24.154 18.257 -5.740
37 HG11 VAL 9 1HG1 VAL 9 -25.163 16.276 -4.474
38 HG12 VAL 9 2HG1 VAL 9 -26.366 16.229 -5.764
39 HG13 VAL 9 3HG1 VAL 9 -24.657 16.008 -6.142
40 HG21 VAL 9 3HG2 VAL 9 -25.508 19.467 -7.255
41 HG22 VAL 9 1HG2 VAL 9 -25.552 17.790 -7.799
42 HG23 VAL 9 2HG2 VAL 9 -26.918 18.465 -6.912
43 H LYS 10 H LYS 10 -27.900 17.618 -5.377
44 HA LYS 10 HA LYS 10 -29.220 16.976 -3.004
45 HB3 LYS 10 2HB LYS 10 -30.083 15.019 -4.680
46 HG3 LYS 10 2HG LYS 10 -31.398 16.942 -3.714
47 HD3 LYS 10 2HD LYS 10 -31.796 18.663 -5.693
48 HE3 LYS 10 2HE LYS 10 -29.424 19.588 -4.394
49 HZ1 LYS 10 3HZ LYS 10 -31.788 20.612 -4.947
50 HZ2 LYS 10 1HZ LYS 10 -30.786 21.251 -3.743
51 HZ3 LYS 10 2HZ LYS 10 -32.060 20.220 -3.325
52 H THR 11 H THR 11 -29.462 14.997 -1.881
53 HA THR 11 HA THR 11 -28.731 13.111 -0.837
54 HB THR 11 HB THR 11 -26.936 12.133 -2.923
55 HG1 THR 11 1HG THR 11 -28.179 12.445 -4.606
56 HG21 THR 11 3HG2 THR 11 -29.250 11.189 -1.318
57 HG22 THR 11 1HG2 THR 11 -27.673 10.444 -1.571
58 HG23 THR 11 2HG2 THR 11 -28.905 10.348 -2.829
59 H VAL 12 H VAL 12 -26.987 12.344 0.385
60 HA VAL 12 HA VAL 12 -24.813 14.211 0.659
61 HB VAL 12 HB VAL 12 -25.687 11.777 2.171
62 HG11 VAL 12 1HG1 VAL 12 -23.579 12.651 3.638
63 HG12 VAL 12 2HG1 VAL 12 -23.526 11.273 2.537
64 HG13 VAL 12 3HG1 VAL 12 -22.962 12.856 1.999
65 HG21 VAL 12 3HG2 VAL 12 -25.650 13.421 4.050
66 HG22 VAL 12 1HG2 VAL 12 -25.233 14.671 2.877
67 HG23 VAL 12 2HG2 VAL 12 -26.777 13.828 2.757
68 H GLU 13 H GLU 13 -23.064 14.114 -0.579
69 HA GLU 13 HA GLU 13 -22.085 11.466 -1.424
70 HB3 GLU 13 2HB GLU 13 -21.012 12.695 -3.332
71 HG3 GLU 13 2HG GLU 13 -23.542 13.503 -4.126
72 H ASP 14 H ASP 14 -20.503 10.942 -0.042
73 HA ASP 14 HA ASP 14 -18.342 12.903 0.356
74 HB3 ASP 14 2HB ASP 14 -18.481 11.012 2.530
75 H LYS 15 H LYS 15 -16.536 11.337 1.671
76 HA LYS 15 HA LYS 15 -16.076 9.063 -0.140
77 HB3 LYS 15 2HB LYS 15 -13.912 9.698 -0.613
78 HG3 LYS 15 2HG LYS 15 -15.754 11.767 -0.866
79 HD3 LYS 15 2HD LYS 15 -13.900 13.651 -0.701
80 HE3 LYS 15 2HE LYS 15 -14.946 13.240 1.974
81 HZ1 LYS 15 3HZ LYS 15 -14.645 15.300 0.161
82 HZ2 LYS 15 1HZ LYS 15 -15.281 15.401 1.725
83 HZ3 LYS 15 2HZ LYS 15 -16.312 15.159 0.406
84 H TYR 16 H TYR 16 -13.646 8.247 0.978
85 HA TYR 16 HA TYR 16 -14.603 7.176 3.529
86 HB3 TYR 16 2HB TYR 16 -12.800 5.498 3.245
87 HD1 TYR 16 1HD TYR 16 -15.761 6.605 1.853
88 HD2 TYR 16 2HD TYR 16 -12.762 3.644 1.260
89 HE1 TYR 16 1HE TYR 16 -17.378 5.222 0.618
90 HE2 TYR 16 2HE TYR 16 -14.370 2.255 0.022
91 HH TYR 16 HH TYR 16 -17.757 3.036 -0.105
92 H LYS 17 H LYS 17 -12.354 6.482 4.822
93 HA LYS 17 HA LYS 17 -10.490 8.673 4.977
94 HB3 LYS 17 2HB LYS 17 -12.678 8.322 6.983
95 HG3 LYS 17 2HG LYS 17 -10.896 10.029 8.215
96 HD3 LYS 17 2HD LYS 17 -10.563 7.789 9.654
97 HE3 LYS 17 2HE LYS 17 -12.483 9.928 9.550
98 HZ1 LYS 17 3HZ LYS 17 -13.947 8.448 11.195
99 HZ2 LYS 17 1HZ LYS 17 -13.530 7.265 10.058
100 HZ3 LYS 17 2HZ LYS 17 -14.333 8.669 9.562
101 H CYS 18 H CYS 18 -8.597 8.097 5.961
102 HA CYS 18 HA CYS 18 -8.020 5.365 6.264
103 HB3 CYS 18 2HB CYS 18 -6.528 7.856 7.084
104 H GLU 19 H GLU 19 -7.816 4.047 8.024
105 HA GLU 19 HA GLU 19 -9.237 4.869 10.408
106 HB3 GLU 19 2HB GLU 19 -8.599 2.417 11.064
107 HG3 GLU 19 2HG GLU 19 -10.513 1.557 10.080
108 H LYS 20 H LYS 20 -6.612 6.054 9.794
109 HA LYS 20 HA LYS 20 -5.308 5.408 12.343
110 HB3 LYS 20 2HB LYS 20 -3.334 6.162 10.392
111 HG3 LYS 20 2HG LYS 20 -3.799 3.734 12.090
112 HD3 LYS 20 2HD LYS 20 -1.434 4.249 10.286
113 HE3 LYS 20 2HE LYS 20 -0.389 2.503 11.261
114 HZ1 LYS 20 3HZ LYS 20 -0.987 2.221 13.627
115 HZ2 LYS 20 1HZ LYS 20 -2.368 3.167 13.371
116 HZ3 LYS 20 2HZ LYS 20 -0.831 3.843 13.170
117 H CYS 21 H CYS 21 -4.757 7.620 9.598
118 HA CYS 21 HA CYS 21 -4.422 9.818 11.493
119 HB3 CYS 21 2HB CYS 21 -2.671 9.696 9.879
120 H HIS 22 H HIS 22 -6.938 8.436 9.974
121 HA HIS 22 HA HIS 22 -9.054 9.085 9.449
122 HB3 HIS 22 2HB HIS 22 -9.931 10.441 11.005
123 HD2 HIS 22 2HD HIS 22 -7.823 8.572 12.448
124 HE1 HIS 22 1HE HIS 22 -6.452 12.059 14.439
125 HE2 HIS 22 2HE HIS 22 -6.409 9.541 14.387
126 H LEU 23 H LEU 23 -6.787 9.713 7.658
127 HA LEU 23 HA LEU 23 -7.293 12.224 6.409
128 HB3 LEU 23 2HB LEU 23 -6.069 10.700 4.491
129 HG LEU 23 HG LEU 23 -4.873 12.309 6.718
130 HD11 LEU 23 1HD1 LEU 23 -2.864 11.409 6.479
131 HD12 LEU 23 2HD1 LEU 23 -2.916 11.704 4.742
132 HD13 LEU 23 3HD1 LEU 23 -3.544 10.193 5.398
133 HD21 LEU 23 3HD2 LEU 23 -4.017 13.396 4.429
134 HD22 LEU 23 1HD2 LEU 23 -5.561 13.812 5.172
135 HD23 LEU 23 2HD2 LEU 23 -5.505 12.646 3.849
136 H VAL 24 H VAL 24 -9.010 12.719 5.231
137 HA VAL 24 HA VAL 24 -10.887 10.800 4.322
138 HB VAL 24 HB VAL 24 -10.562 13.748 3.842
139 HG11 VAL 24 1HG1 VAL 24 -12.985 13.363 2.824
140 HG12 VAL 24 2HG1 VAL 24 -11.531 13.330 1.824
141 HG13 VAL 24 3HG1 VAL 24 -12.265 11.820 2.364
142 HG21 VAL 24 3HG2 VAL 24 -13.083 12.741 4.884
143 HG22 VAL 24 1HG2 VAL 24 -11.701 12.276 5.877
144 HG23 VAL 24 2HG2 VAL 24 -12.006 13.978 5.531
145 H LEU 25 H LEU 25 -10.488 9.423 2.719
146 HA LEU 25 HA LEU 25 -9.064 10.418 0.339
147 HB3 LEU 25 2HB LEU 25 -7.795 8.596 0.335
148 HG LEU 25 HG LEU 25 -9.033 8.240 3.031
149 HD11 LEU 25 1HD1 LEU 25 -6.836 6.424 2.559
150 HD12 LEU 25 2HD1 LEU 25 -8.217 6.055 1.526
151 HD13 LEU 25 3HD1 LEU 25 -8.418 6.120 3.276
152 HD21 LEU 25 3HD2 LEU 25 -6.560 8.435 3.619
153 HD22 LEU 25 1HD2 LEU 25 -7.350 9.876 2.979
154 HD23 LEU 25 2HD2 LEU 25 -6.315 8.902 1.935
155 H CYS 26 H CYS 26 -9.608 8.663 -1.545
156 HA CYS 26 HA CYS 26 -12.550 8.616 -1.723
157 HB3 CYS 26 2HB CYS 26 -10.830 8.693 -4.169
158 H SER 27 H SER 27 -9.737 6.766 -1.675
159 HA SER 27 HA SER 27 -11.156 4.329 -2.035
160 HB3 SER 27 2HB SER 27 -9.665 5.455 -4.339
161 HG SER 27 HG SER 27 -8.758 3.599 -4.931
162 HA PRO 28 HA PRO 28 -7.383 4.069 0.576
163 HB3 PRO 28 2HB PRO 28 -8.678 4.286 2.462
164 HG3 PRO 28 2HG PRO 28 -10.934 3.723 2.439
165 HD3 PRO 28 2HD PRO 28 -10.843 5.069 0.571
166 H LYS 29 H LYS 29 -6.926 1.735 1.908
167 HA LYS 29 HA LYS 29 -6.873 -0.263 -0.258
168 HB3 LYS 29 2HB LYS 29 -4.774 -1.071 0.641
169 HG3 LYS 29 2HG LYS 29 -3.298 0.835 0.355
170 HD3 LYS 29 2HD LYS 29 -5.681 0.849 -1.496
171 HE3 LYS 29 2HE LYS 29 -2.925 2.027 -1.827
172 HZ1 LYS 29 3HZ LYS 29 -4.539 2.607 -4.003
173 HZ2 LYS 29 1HZ LYS 29 -4.655 0.934 -3.772
174 HZ3 LYS 29 2HZ LYS 29 -3.140 1.656 -3.985
175 H GLN 30 H GLN 30 -9.119 -0.443 1.042
176 HA GLN 30 HA GLN 30 -9.564 -1.523 3.429
177 HB3 GLN 30 2HB GLN 30 -10.787 -3.222 1.379
178 HG3 GLN 30 2HG GLN 30 -11.897 -1.230 3.340
179 HE21 GLN 30 1HE2 GLN 30 -14.146 -2.742 3.889
180 HE22 GLN 30 2HE2 GLN 30 -15.206 -2.693 2.527
181 H THR 31 H THR 31 -8.882 -3.170 4.632
182 HA THR 31 HA THR 31 -7.042 -5.094 3.487
183 HB THR 31 HB THR 31 -6.415 -5.659 5.668
184 HG1 THR 31 1HG THR 31 -8.909 -4.563 6.512
185 HG21 THR 31 3HG2 THR 31 -5.584 -3.678 6.325
186 HG22 THR 31 1HG2 THR 31 -7.186 -2.970 6.528
187 HG23 THR 31 2HG2 THR 31 -6.440 -3.020 4.931
188 H GLU 32 H GLU 32 -7.670 -7.145 5.483
189 HA GLU 32 HA GLU 32 -9.893 -8.401 4.049
190 HB3 GLU 32 2HB GLU 32 -8.522 -10.112 5.945
191 HG3 GLU 32 2HG GLU 32 -8.294 -10.368 2.985
192 H CYS 33 H CYS 33 -9.847 -6.441 6.472
193 HA CYS 33 HA CYS 33 -11.580 -8.052 8.226
194 HB3 CYS 33 2HB CYS 33 -9.469 -7.039 9.212
195 H GLY 34 H GLY 34 -11.284 -5.095 6.380
196 HA2 GLY 34 1HA GLY 34 -13.543 -4.470 5.407
197 HA3 GLY 34 2HA GLY 34 -14.071 -4.418 7.082
198 H HIS 35 H HIS 35 -11.866 -3.169 8.247
199 HA HIS 35 HA HIS 35 -12.455 -0.492 7.971
200 HB3 HIS 35 2HB HIS 35 -10.171 -0.103 9.019
201 HD2 HIS 35 2HD HIS 35 -12.183 0.702 10.875
202 HE1 HIS 35 1HE HIS 35 -12.363 -3.075 12.799
203 HE2 HIS 35 2HE HIS 35 -13.098 -0.667 12.870
204 H ARG 36 H ARG 36 -10.388 1.086 7.495
205 HA ARG 36 HA ARG 36 -9.205 0.399 4.920
206 HB3 ARG 36 2HB ARG 36 -9.969 2.495 3.884
207 HG3 ARG 36 2HG ARG 36 -11.976 0.508 4.804
208 HD3 ARG 36 2HD ARG 36 -12.722 2.877 3.106
209 HE ARG 36 HE ARG 36 -14.821 1.433 4.360
210 HH11 ARG 36 1HH1 ARG 36 -12.586 1.317 1.693
211 HH12 ARG 36 2HH1 ARG 36 -13.609 0.322 0.710
212 HH21 ARG 36 1HH2 ARG 36 -16.176 0.124 3.075
213 HH22 ARG 36 2HH2 ARG 36 -15.651 -0.356 1.496
214 H PHE 37 H PHE 37 -7.491 1.856 4.279
215 HA PHE 37 HA PHE 37 -6.549 3.758 6.265
216 HB3 PHE 37 2HB PHE 37 -4.232 2.637 6.147
217 HD1 PHE 37 1HD PHE 37 -6.746 0.091 7.018
218 HD2 PHE 37 2HD PHE 37 -4.276 3.255 8.434
219 HE1 PHE 37 1HE PHE 37 -7.238 -0.569 9.337
220 HE2 PHE 37 2HE PHE 37 -4.762 2.600 10.755
221 HZ PHE 37 HZ PHE 37 -6.244 0.686 11.209
222 H CYS 38 H CYS 38 -4.586 4.932 5.490
223 HA CYS 38 HA CYS 38 -4.901 5.522 2.662
224 HB3 CYS 38 2HB CYS 38 -4.794 7.328 4.400
225 H GLU 39 H GLU 39 -2.842 6.030 1.417
226 HA GLU 39 HA GLU 39 -1.388 3.747 0.949
227 HB3 GLU 39 2HB GLU 39 0.397 5.669 0.193
228 HG3 GLU 39 2HG GLU 39 -2.088 5.351 -1.427
229 H SER 40 H SER 40 -0.123 6.618 2.653
230 HA SER 40 HA SER 40 2.283 5.601 3.490
231 HB3 SER 40 2HB SER 40 0.440 7.685 4.534
232 HG SER 40 HG SER 40 2.039 8.030 6.257
233 H CYS 41 H CYS 41 -0.216 6.016 5.953
234 HA CYS 41 HA CYS 41 0.604 4.351 7.860
235 HB3 CYS 41 2HB CYS 41 -1.802 3.828 8.371
236 H MET 42 H MET 42 -1.315 3.232 5.076
237 HA MET 42 HA MET 42 -1.463 0.548 5.660
238 HB3 MET 42 2HB MET 42 -1.169 1.941 3.000
239 HG3 MET 42 2HG MET 42 -0.632 -0.663 3.184
240 HE1 MET 42 3HE MET 42 -4.054 -1.508 5.272
241 HE2 MET 42 1HE MET 42 -2.322 -1.247 5.481
242 HE3 MET 42 2HE MET 42 -3.378 0.115 5.113
243 H ALA 43 H ALA 43 1.124 2.200 3.855
244 HA ALA 43 HA ALA 43 2.721 -0.104 3.493
245 HB1 ALA 43 3HB ALA 43 3.738 1.317 2.127
246 HB2 ALA 43 1HB ALA 43 2.868 2.675 2.843
247 HB3 ALA 43 2HB ALA 43 4.407 2.154 3.529
248 H ALA 44 H ALA 44 2.271 2.043 6.163
249 HA ALA 44 HA ALA 44 4.737 1.478 7.493
250 HB1 ALA 44 3HB ALA 44 2.241 2.435 8.855
251 HB2 ALA 44 1HB ALA 44 3.924 2.767 9.267
252 HB3 ALA 44 2HB ALA 44 3.207 3.498 7.831
253 H LEU 45 H LEU 45 1.377 0.420 8.048
254 HA LEU 45 HA LEU 45 1.913 -1.354 10.137
255 HB3 LEU 45 2HB LEU 45 -0.233 -2.396 9.573
256 HG LEU 45 HG LEU 45 -0.347 0.608 9.317
257 HD11 LEU 45 1HD1 LEU 45 -2.628 0.546 9.494
258 HD12 LEU 45 2HD1 LEU 45 -2.640 -1.051 10.244
259 HD13 LEU 45 3HD1 LEU 45 -2.347 -0.892 8.512
260 HD21 LEU 45 3HD2 LEU 45 0.159 -1.174 11.511
261 HD22 LEU 45 1HD2 LEU 45 -1.346 -0.292 11.777
262 HD23 LEU 45 2HD2 LEU 45 0.153 0.590 11.480
263 H LEU 46 H LEU 46 1.528 -2.052 6.662
264 HA LEU 46 HA LEU 46 1.989 -4.763 6.688
265 HB3 LEU 46 2HB LEU 46 2.764 -4.530 4.383
266 HG LEU 46 HG LEU 46 0.455 -2.725 5.065
267 HD11 LEU 46 1HD1 LEU 46 1.524 -1.949 2.988
268 HD12 LEU 46 2HD1 LEU 46 -0.076 -2.633 2.710
269 HD13 LEU 46 3HD1 LEU 46 1.363 -3.573 2.318
270 HD21 LEU 46 3HD2 LEU 46 -0.069 -5.057 3.448
271 HD22 LEU 46 1HD2 LEU 46 -0.770 -4.578 4.995
272 HD23 LEU 46 2HD2 LEU 46 0.737 -5.494 4.955
273 H SER 47 H SER 47 4.274 -2.161 7.075
274 HA SER 47 HA SER 47 6.548 -3.978 6.884
275 HB3 SER 47 2HB SER 47 7.257 -1.320 7.751
276 HG SER 47 HG SER 47 7.607 -2.474 5.191
277 H SER 48 H SER 48 4.596 -4.250 9.040
278 HA SER 48 HA SER 48 6.291 -3.605 11.361
279 HB3 SER 48 2HB SER 48 3.323 -4.202 11.349
280 HG SER 48 HG SER 48 4.021 -2.828 13.448
281 H SER 49 H SER 49 6.132 -5.994 9.401
282 HA SER 49 HA SER 49 6.718 -8.197 9.584
283 HB3 SER 49 2HB SER 49 6.358 -8.101 12.568
284 HG SER 49 HG SER 49 6.972 -10.074 11.662
285 H SER 50 H SER 50 4.322 -7.470 12.128
286 HA SER 50 HA SER 50 2.579 -9.521 10.927
287 HB3 SER 50 2HB SER 50 1.645 -9.782 13.280
288 HG SER 50 HG SER 50 3.983 -10.713 13.868
289 HA PRO 51 HA PRO 51 0.455 -5.382 10.807
290 HB3 PRO 51 2HB PRO 51 1.219 -4.948 8.685
291 HG3 PRO 51 2HG PRO 51 1.891 -6.672 7.276
292 HD3 PRO 51 2HD PRO 51 3.084 -7.220 9.170
293 H LYS 52 H LYS 52 -1.512 -5.401 11.677
294 HA LYS 52 HA LYS 52 -3.400 -7.510 10.855
295 HB3 LYS 52 2HB LYS 52 -4.306 -7.551 13.021
296 HG3 LYS 52 2HG LYS 52 -1.341 -7.295 13.083
297 HD3 LYS 52 2HD LYS 52 -2.841 -8.042 15.560
298 HE3 LYS 52 2HE LYS 52 -0.200 -6.655 15.401
299 HZ1 LYS 52 3HZ LYS 52 -1.233 -7.110 17.559
300 HZ2 LYS 52 1HZ LYS 52 0.224 -7.950 17.373
301 HZ3 LYS 52 2HZ LYS 52 -1.248 -8.765 17.209
302 H CYS 53 H CYS 53 -3.691 -4.364 12.502
303 HA CYS 53 HA CYS 53 -4.733 -2.756 10.625
304 HB3 CYS 53 2HB CYS 53 -6.767 -4.797 11.440
305 H THR 54 H THR 54 -4.078 -1.147 11.966
306 HA THR 54 HA THR 54 -4.188 -0.752 14.593
307 HB THR 54 HB THR 54 -4.199 1.013 12.337
308 HG1 THR 54 1HG THR 54 -2.603 0.692 14.087
309 HG21 THR 54 3HG2 THR 54 -5.209 2.996 13.421
310 HG22 THR 54 1HG2 THR 54 -5.827 1.953 14.701
311 HG23 THR 54 2HG2 THR 54 -6.398 1.749 13.045
312 H ALA 55 H ALA 55 -6.989 -0.523 12.460
313 HA ALA 55 HA ALA 55 -8.857 0.520 14.232
314 HB1 ALA 55 3HB ALA 55 -10.299 0.173 12.564
315 HB2 ALA 55 1HB ALA 55 -8.910 -0.422 11.653
316 HB3 ALA 55 2HB ALA 55 -9.955 -1.556 12.510
317 H CYS 56 H CYS 56 -8.921 -2.910 13.316
318 HA CYS 56 HA CYS 56 -9.592 -3.550 16.113
319 HB3 CYS 56 2HB CYS 56 -11.439 -4.021 14.608
320 H GLN 57 H GLN 57 -7.534 -4.279 13.410
321 HA GLN 57 HA GLN 57 -5.463 -5.288 13.432
322 HB3 GLN 57 2HB GLN 57 -4.471 -6.063 15.397
323 HG3 GLN 57 2HG GLN 57 -6.070 -4.618 17.207
324 HE21 GLN 57 1HE2 GLN 57 -4.124 -3.041 14.768
325 HE22 GLN 57 2HE2 GLN 57 -2.729 -2.801 15.760
326 H GLU 58 H GLU 58 -6.169 -6.618 11.765
327 HA GLU 58 HA GLU 58 -6.876 -9.351 12.598
328 HB3 GLU 58 2HB GLU 58 -7.909 -8.925 10.000
329 HG3 GLU 58 2HG GLU 58 -10.113 -8.855 11.580
330 H SER 59 H SER 59 -6.041 -7.661 9.570
331 HA SER 59 HA SER 59 -3.477 -8.757 9.295
332 HB3 SER 59 2HB SER 59 -4.854 -10.162 7.194
333 HG SER 59 HG SER 59 -2.740 -10.572 8.197
334 H ILE 60 H ILE 60 -2.484 -7.376 7.996
335 HA ILE 60 HA ILE 60 -4.041 -6.103 5.842
336 HB ILE 60 HB ILE 60 -1.590 -4.779 6.884
337 HG13 ILE 60 2HG1 ILE 60 -2.935 -5.518 8.892
338 HG21 ILE 60 1HG2 ILE 60 -3.861 -4.144 5.243
339 HG22 ILE 60 2HG2 ILE 60 -3.720 -2.992 6.569
340 HG23 ILE 60 3HG2 ILE 60 -2.361 -3.247 5.474
341 HD11 ILE 60 3HD1 ILE 60 -2.255 -3.724 9.998
342 HD12 ILE 60 1HD1 ILE 60 -1.752 -3.064 8.442
343 HD13 ILE 60 2HD1 ILE 60 -3.341 -2.666 9.097
344 H VAL 61 H VAL 61 -3.448 -6.771 3.897
345 HA VAL 61 HA VAL 61 -0.601 -7.077 3.294
346 HB VAL 61 HB VAL 61 -2.689 -9.190 2.765
347 HG11 VAL 61 1HG1 VAL 61 -0.084 -8.645 1.442
348 HG12 VAL 61 2HG1 VAL 61 -0.530 -10.324 1.750
349 HG13 VAL 61 3HG1 VAL 61 -1.578 -9.297 0.771
350 HG21 VAL 61 3HG2 VAL 61 -0.334 -10.289 3.804
351 HG22 VAL 61 1HG2 VAL 61 -0.638 -8.831 4.749
352 HG23 VAL 61 2HG2 VAL 61 -1.877 -10.080 4.634
353 H LYS 62 H LYS 62 -0.055 -6.242 1.373
354 HA LYS 62 HA LYS 62 -1.787 -4.666 -0.117
355 HB3 LYS 62 2HB LYS 62 0.540 -4.260 -0.319
356 HG3 LYS 62 2HG LYS 62 0.834 -7.067 -1.371
357 HD3 LYS 62 2HD LYS 62 2.585 -4.672 -1.475
358 HE3 LYS 62 2HE LYS 62 3.448 -7.365 -0.557
359 HZ1 LYS 62 3HZ LYS 62 5.647 -7.007 -1.489
360 HZ2 LYS 62 1HZ LYS 62 5.100 -5.642 -2.325
361 HZ3 LYS 62 2HZ LYS 62 4.501 -7.173 -2.723
362 H ASP 63 H ASP 63 -0.876 -8.040 -0.548
363 HA ASP 63 HA ASP 63 -2.026 -8.436 -3.082
364 HB3 ASP 63 2HB ASP 63 -2.022 -10.633 -1.054
365 H LYS 64 H LYS 64 -3.349 -8.917 0.178
366 HA LYS 64 HA LYS 64 -5.952 -9.618 -0.868
367 HB3 LYS 64 2HB LYS 64 -6.555 -10.137 1.321
368 HG3 LYS 64 2HG LYS 64 -4.668 -11.215 2.450
369 HD3 LYS 64 2HD LYS 64 -4.084 -11.775 -0.398
370 HE3 LYS 64 2HE LYS 64 -4.375 -13.195 2.138
371 HZ1 LYS 64 3HZ LYS 64 -5.283 -14.610 -0.301
372 HZ2 LYS 64 1HZ LYS 64 -6.362 -13.972 0.836
373 HZ3 LYS 64 2HZ LYS 64 -5.270 -15.182 1.290
374 H VAL 65 H VAL 65 -4.319 -6.767 -0.388
375 HA VAL 65 HA VAL 65 -6.596 -5.192 0.483
376 HB VAL 65 HB VAL 65 -3.740 -4.784 0.303
377 HG11 VAL 65 1HG1 VAL 65 -4.317 -3.474 -1.687
378 HG12 VAL 65 2HG1 VAL 65 -5.464 -2.534 -0.729
379 HG13 VAL 65 3HG1 VAL 65 -3.738 -2.448 -0.375
380 HG21 VAL 65 3HG2 VAL 65 -4.689 -2.726 1.765
381 HG22 VAL 65 1HG2 VAL 65 -6.060 -3.832 1.848
382 HG23 VAL 65 2HG2 VAL 65 -4.468 -4.358 2.397
383 H PHE 66 H PHE 66 -7.652 -3.633 -0.757
384 HA PHE 66 HA PHE 66 -7.048 -3.464 -3.602
385 HB3 PHE 66 2HB PHE 66 -9.679 -3.754 -3.893
386 HD1 PHE 66 2HD PHE 66 -8.447 -4.348 -5.971
387 HD2 PHE 66 1HD PHE 66 -8.518 -6.898 -2.563
388 HE1 PHE 66 2HE PHE 66 -7.717 -6.233 -7.371
389 HE2 PHE 66 1HE PHE 66 -7.786 -8.787 -3.958
390 HZ PHE 66 HZ PHE 66 -7.385 -8.458 -6.366
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -50.790 27.091 -5.128
2 HA2 GLY 1 1HA GLY 1 -51.388 28.536 -3.258
3 HA3 GLY 1 2HA GLY 1 -52.727 27.441 -3.570
4 H SER 2 H SER 2 -52.436 25.237 -2.404
5 HA SER 2 HA SER 2 -51.096 25.425 0.158
6 HB3 SER 2 2HB SER 2 -53.345 24.803 1.304
7 HG SER 2 HG SER 2 -52.089 27.014 1.069
8 H SER 3 H SER 3 -50.650 23.715 -1.979
9 HA SER 3 HA SER 3 -51.068 21.160 -0.696
10 HB3 SER 3 2HB SER 3 -52.324 21.824 -3.357
11 HG SER 3 HG SER 3 -52.754 19.419 -3.230
12 H GLY 4 H GLY 4 -49.410 19.794 -1.077
13 HA2 GLY 4 1HA GLY 4 -47.443 20.643 -3.109
14 HA3 GLY 4 2HA GLY 4 -47.024 19.850 -1.597
15 H SER 5 H SER 5 -46.933 19.299 -4.709
16 HA SER 5 HA SER 5 -46.857 16.484 -4.476
17 HB3 SER 5 2HB SER 5 -49.018 17.178 -6.389
18 HG SER 5 HG SER 5 -49.688 15.165 -5.837
19 H SER 6 H SER 6 -45.103 16.186 -5.678
20 HA SER 6 HA SER 6 -45.142 16.642 -8.486
21 HB3 SER 6 2HB SER 6 -42.816 18.103 -7.527
22 HG SER 6 HG SER 6 -43.225 18.723 -9.492
23 H GLY 7 H GLY 7 -42.411 16.654 -9.013
24 HA2 GLY 7 1HA GLY 7 -41.538 14.146 -7.714
25 HA3 GLY 7 2HA GLY 7 -41.317 14.461 -9.429
26 H PHE 8 H PHE 8 -39.403 13.903 -7.180
27 HA PHE 8 HA PHE 8 -37.249 15.406 -8.041
28 HB3 PHE 8 2HB PHE 8 -38.896 16.763 -6.009
29 HD1 PHE 8 1HD PHE 8 -38.107 15.858 -3.855
30 HD2 PHE 8 2HD PHE 8 -35.491 17.860 -6.549
31 HE1 PHE 8 1HE PHE 8 -36.474 16.158 -2.040
32 HE2 PHE 8 2HE PHE 8 -33.853 18.163 -4.739
33 HZ PHE 8 HZ PHE 8 -34.342 17.311 -2.481
34 H VAL 9 H VAL 9 -35.433 14.442 -7.350
35 HA VAL 9 HA VAL 9 -35.549 12.864 -4.868
36 HB VAL 9 HB VAL 9 -35.734 11.242 -6.599
37 HG11 VAL 9 1HG1 VAL 9 -35.062 11.712 -8.662
38 HG12 VAL 9 2HG1 VAL 9 -34.142 13.101 -8.082
39 HG13 VAL 9 3HG1 VAL 9 -33.391 11.505 -8.138
40 HG21 VAL 9 3HG2 VAL 9 -34.126 10.758 -4.776
41 HG22 VAL 9 1HG2 VAL 9 -33.741 9.921 -6.280
42 HG23 VAL 9 2HG2 VAL 9 -32.825 11.352 -5.806
43 H LYS 10 H LYS 10 -33.575 12.602 -3.757
44 HA LYS 10 HA LYS 10 -31.377 14.340 -4.657
45 HB3 LYS 10 2HB LYS 10 -31.432 14.273 -1.806
46 HG3 LYS 10 2HG LYS 10 -31.979 16.755 -2.137
47 HD3 LYS 10 2HD LYS 10 -29.555 15.840 -3.655
48 HE3 LYS 10 2HE LYS 10 -30.104 18.289 -3.254
49 HZ1 LYS 10 3HZ LYS 10 -29.266 18.970 -0.948
50 HZ2 LYS 10 1HZ LYS 10 -29.650 17.389 -0.481
51 HZ3 LYS 10 2HZ LYS 10 -30.857 18.411 -1.082
52 H THR 11 H THR 11 -29.281 13.746 -3.927
53 HA THR 11 HA THR 11 -29.076 11.015 -2.845
54 HB THR 11 HB THR 11 -26.866 11.674 -4.608
55 HG1 THR 11 1HG THR 11 -27.959 11.847 -6.503
56 HG21 THR 11 3HG2 THR 11 -27.448 9.473 -5.565
57 HG22 THR 11 1HG2 THR 11 -28.909 9.449 -4.578
58 HG23 THR 11 2HG2 THR 11 -27.324 9.427 -3.807
59 H VAL 12 H VAL 12 -27.081 10.537 -1.747
60 HA VAL 12 HA VAL 12 -25.493 12.875 -0.953
61 HB VAL 12 HB VAL 12 -26.688 10.887 0.984
62 HG11 VAL 12 1HG1 VAL 12 -24.467 12.808 1.196
63 HG12 VAL 12 2HG1 VAL 12 -25.632 12.838 2.521
64 HG13 VAL 12 3HG1 VAL 12 -24.793 11.340 2.117
65 HG21 VAL 12 3HG2 VAL 12 -27.165 13.776 1.297
66 HG22 VAL 12 1HG2 VAL 12 -27.944 13.021 -0.093
67 HG23 VAL 12 2HG2 VAL 12 -28.258 12.412 1.531
68 H GLU 13 H GLU 13 -23.452 12.430 -1.432
69 HA GLU 13 HA GLU 13 -22.504 9.658 -1.117
70 HB3 GLU 13 2HB GLU 13 -20.676 10.474 -2.760
71 HG3 GLU 13 2HG GLU 13 -23.487 10.220 -3.805
72 H ASP 14 H ASP 14 -20.860 9.276 0.236
73 HA ASP 14 HA ASP 14 -19.293 11.566 1.218
74 HB3 ASP 14 2HB ASP 14 -19.274 10.337 3.462
75 H LYS 15 H LYS 15 -17.193 11.295 0.915
76 HA LYS 15 HA LYS 15 -16.077 8.926 -0.124
77 HB3 LYS 15 2HB LYS 15 -15.010 10.993 -0.637
78 HG3 LYS 15 2HG LYS 15 -13.912 11.555 2.021
79 HD3 LYS 15 2HD LYS 15 -14.346 13.858 1.325
80 HE3 LYS 15 2HE LYS 15 -12.571 12.101 0.135
81 HZ1 LYS 15 3HZ LYS 15 -14.340 13.092 -1.860
82 HZ2 LYS 15 1HZ LYS 15 -13.073 11.981 -2.008
83 HZ3 LYS 15 2HZ LYS 15 -12.762 13.639 -2.130
84 H TYR 16 H TYR 16 -13.780 8.335 1.113
85 HA TYR 16 HA TYR 16 -14.685 7.211 3.672
86 HB3 TYR 16 2HB TYR 16 -12.988 5.496 3.361
87 HD1 TYR 16 2HD TYR 16 -15.922 6.496 2.142
88 HD2 TYR 16 1HD TYR 16 -12.725 3.949 0.962
89 HE1 TYR 16 2HE TYR 16 -17.477 5.205 0.740
90 HE2 TYR 16 1HE TYR 16 -14.270 2.652 -0.444
91 HH TYR 16 HH TYR 16 -16.804 3.459 -1.623
92 H LYS 17 H LYS 17 -12.325 6.544 4.840
93 HA LYS 17 HA LYS 17 -10.482 8.735 4.909
94 HB3 LYS 17 2HB LYS 17 -12.660 8.529 6.933
95 HG3 LYS 17 2HG LYS 17 -10.846 10.161 8.177
96 HD3 LYS 17 2HD LYS 17 -10.540 7.898 9.593
97 HE3 LYS 17 2HE LYS 17 -12.430 10.068 9.513
98 HZ1 LYS 17 3HZ LYS 17 -14.357 9.119 10.013
99 HZ2 LYS 17 1HZ LYS 17 -13.651 8.084 11.151
100 HZ3 LYS 17 2HZ LYS 17 -13.703 7.639 9.520
101 H CYS 18 H CYS 18 -8.567 8.145 5.809
102 HA CYS 18 HA CYS 18 -7.980 5.454 6.205
103 HB3 CYS 18 2HB CYS 18 -6.523 7.960 7.042
104 H GLU 19 H GLU 19 -7.837 4.134 7.960
105 HA GLU 19 HA GLU 19 -9.269 4.972 10.331
106 HB3 GLU 19 2HB GLU 19 -8.562 2.481 10.952
107 HG3 GLU 19 2HG GLU 19 -10.572 1.663 10.098
108 H LYS 20 H LYS 20 -6.628 6.129 9.749
109 HA LYS 20 HA LYS 20 -5.354 5.454 12.306
110 HB3 LYS 20 2HB LYS 20 -3.352 6.204 10.385
111 HG3 LYS 20 2HG LYS 20 -3.865 3.754 12.038
112 HD3 LYS 20 2HD LYS 20 -1.471 4.281 10.277
113 HE3 LYS 20 2HE LYS 20 -0.744 2.076 10.967
114 HZ1 LYS 20 3HZ LYS 20 0.031 2.643 13.027
115 HZ2 LYS 20 1HZ LYS 20 -1.431 3.328 13.532
116 HZ3 LYS 20 2HZ LYS 20 -0.428 4.169 12.460
117 H CYS 21 H CYS 21 -4.738 7.678 9.586
118 HA CYS 21 HA CYS 21 -4.388 9.858 11.494
119 HB3 CYS 21 2HB CYS 21 -2.653 9.732 9.864
120 H HIS 22 H HIS 22 -6.904 8.517 9.873
121 HA HIS 22 HA HIS 22 -9.029 9.190 9.417
122 HB3 HIS 22 2HB HIS 22 -9.885 10.569 10.968
123 HD2 HIS 22 2HD HIS 22 -7.811 8.642 12.397
124 HE1 HIS 22 1HE HIS 22 -6.384 12.087 14.422
125 HE2 HIS 22 2HE HIS 22 -6.386 9.569 14.346
126 H LEU 23 H LEU 23 -6.767 9.787 7.610
127 HA LEU 23 HA LEU 23 -7.306 12.301 6.353
128 HB3 LEU 23 2HB LEU 23 -5.988 10.854 4.464
129 HG LEU 23 HG LEU 23 -4.883 12.406 6.774
130 HD11 LEU 23 1HD1 LEU 23 -2.853 11.891 4.850
131 HD12 LEU 23 2HD1 LEU 23 -3.482 10.350 5.431
132 HD13 LEU 23 3HD1 LEU 23 -2.858 11.535 6.577
133 HD21 LEU 23 3HD2 LEU 23 -5.821 13.742 5.054
134 HD22 LEU 23 1HD2 LEU 23 -5.047 12.784 3.792
135 HD23 LEU 23 2HD2 LEU 23 -4.071 13.810 4.844
136 H VAL 24 H VAL 24 -9.005 12.735 5.130
137 HA VAL 24 HA VAL 24 -10.864 10.815 4.253
138 HB VAL 24 HB VAL 24 -10.430 13.709 3.600
139 HG11 VAL 24 1HG1 VAL 24 -12.843 13.185 2.459
140 HG12 VAL 24 2HG1 VAL 24 -11.326 13.353 1.571
141 HG13 VAL 24 3HG1 VAL 24 -11.922 11.750 2.007
142 HG21 VAL 24 3HG2 VAL 24 -12.011 14.067 5.140
143 HG22 VAL 24 1HG2 VAL 24 -13.049 12.798 4.492
144 HG23 VAL 24 2HG2 VAL 24 -11.755 12.389 5.619
145 H LEU 25 H LEU 25 -10.686 9.396 2.660
146 HA LEU 25 HA LEU 25 -9.106 10.128 0.285
147 HB3 LEU 25 2HB LEU 25 -7.887 8.263 0.393
148 HG LEU 25 HG LEU 25 -8.991 8.287 3.169
149 HD11 LEU 25 1HD1 LEU 25 -8.761 6.041 3.199
150 HD12 LEU 25 2HD1 LEU 25 -7.059 6.450 3.412
151 HD13 LEU 25 3HD1 LEU 25 -7.670 6.021 1.813
152 HD21 LEU 25 3HD2 LEU 25 -7.242 9.879 2.511
153 HD22 LEU 25 1HD2 LEU 25 -6.201 8.532 2.047
154 HD23 LEU 25 2HD2 LEU 25 -6.672 8.741 3.734
155 H CYS 26 H CYS 26 -9.662 8.622 -1.611
156 HA CYS 26 HA CYS 26 -12.594 8.391 -1.741
157 HB3 CYS 26 2HB CYS 26 -11.034 8.355 -4.253
158 H SER 27 H SER 27 -9.578 6.715 -2.222
159 HA SER 27 HA SER 27 -11.017 4.191 -2.382
160 HB3 SER 27 2HB SER 27 -10.636 4.990 -4.750
161 HG SER 27 HG SER 27 -8.031 4.213 -4.768
162 HA PRO 28 HA PRO 28 -7.311 4.027 0.351
163 HB3 PRO 28 2HB PRO 28 -8.644 4.311 2.201
164 HG3 PRO 28 2HG PRO 28 -10.902 3.760 2.148
165 HD3 PRO 28 2HD PRO 28 -10.762 5.048 0.242
166 H LYS 29 H LYS 29 -6.897 1.734 1.764
167 HA LYS 29 HA LYS 29 -6.755 -0.309 -0.353
168 HB3 LYS 29 2HB LYS 29 -4.732 -1.115 0.655
169 HG3 LYS 29 2HG LYS 29 -3.231 0.793 0.593
170 HD3 LYS 29 2HD LYS 29 -5.371 1.272 -1.465
171 HE3 LYS 29 2HE LYS 29 -2.474 1.074 -2.069
172 HZ1 LYS 29 3HZ LYS 29 -3.741 1.604 -3.909
173 HZ2 LYS 29 1HZ LYS 29 -3.217 3.129 -3.395
174 HZ3 LYS 29 2HZ LYS 29 -4.789 2.613 -3.046
175 H GLN 30 H GLN 30 -9.095 -0.456 0.749
176 HA GLN 30 HA GLN 30 -9.754 -1.492 3.108
177 HB3 GLN 30 2HB GLN 30 -10.847 -3.239 1.053
178 HG3 GLN 30 2HG GLN 30 -11.954 -1.136 2.877
179 HE21 GLN 30 1HE2 GLN 30 -14.455 -2.376 3.041
180 HE22 GLN 30 2HE2 GLN 30 -15.328 -2.041 1.589
181 H THR 31 H THR 31 -8.816 -2.919 4.397
182 HA THR 31 HA THR 31 -7.034 -4.934 3.434
183 HB THR 31 HB THR 31 -6.617 -5.491 5.687
184 HG1 THR 31 1HG THR 31 -8.648 -4.050 6.868
185 HG21 THR 31 3HG2 THR 31 -7.433 -2.603 5.910
186 HG22 THR 31 1HG2 THR 31 -6.041 -3.117 4.957
187 HG23 THR 31 2HG2 THR 31 -6.082 -3.424 6.693
188 H GLU 32 H GLU 32 -7.797 -6.956 5.411
189 HA GLU 32 HA GLU 32 -9.937 -8.229 3.856
190 HB3 GLU 32 2HB GLU 32 -8.271 -9.716 5.842
191 HG3 GLU 32 2HG GLU 32 -8.761 -10.731 3.121
192 H CYS 33 H CYS 33 -9.981 -6.307 6.309
193 HA CYS 33 HA CYS 33 -11.787 -7.954 7.956
194 HB3 CYS 33 2HB CYS 33 -9.684 -7.047 9.057
195 H GLY 34 H GLY 34 -11.356 -4.947 6.229
196 HA2 GLY 34 1HA GLY 34 -13.602 -4.248 5.240
197 HA3 GLY 34 2HA GLY 34 -14.116 -4.172 6.919
198 H HIS 35 H HIS 35 -12.008 -2.971 8.154
199 HA HIS 35 HA HIS 35 -12.438 -0.287 7.811
200 HB3 HIS 35 2HB HIS 35 -10.214 0.040 8.954
201 HD2 HIS 35 2HD HIS 35 -12.262 0.814 10.775
202 HE1 HIS 35 1HE HIS 35 -12.528 -3.005 12.602
203 HE2 HIS 35 2HE HIS 35 -13.245 -0.593 12.709
204 H ARG 36 H ARG 36 -10.499 1.299 7.290
205 HA ARG 36 HA ARG 36 -9.165 0.504 4.809
206 HB3 ARG 36 2HB ARG 36 -9.857 2.676 3.764
207 HG3 ARG 36 2HG ARG 36 -11.763 0.486 4.337
208 HD3 ARG 36 2HD ARG 36 -12.779 2.611 2.566
209 HE ARG 36 HE ARG 36 -13.883 0.385 3.719
210 HH11 ARG 36 1HH1 ARG 36 -14.632 3.785 3.646
211 HH12 ARG 36 2HH1 ARG 36 -16.340 3.544 3.801
212 HH21 ARG 36 1HH2 ARG 36 -16.131 0.056 3.922
213 HH22 ARG 36 2HH2 ARG 36 -17.192 1.424 3.958
214 H PHE 37 H PHE 37 -7.399 1.894 4.208
215 HA PHE 37 HA PHE 37 -6.519 3.841 6.190
216 HB3 PHE 37 2HB PHE 37 -4.206 2.726 6.144
217 HD1 PHE 37 1HD PHE 37 -6.749 0.170 6.905
218 HD2 PHE 37 2HD PHE 37 -4.306 3.300 8.435
219 HE1 PHE 37 1HE PHE 37 -7.312 -0.518 9.199
220 HE2 PHE 37 2HE PHE 37 -4.864 2.618 10.732
221 HZ PHE 37 HZ PHE 37 -6.368 0.706 11.116
222 H CYS 38 H CYS 38 -4.588 5.051 5.454
223 HA CYS 38 HA CYS 38 -4.835 5.631 2.624
224 HB3 CYS 38 2HB CYS 38 -4.722 7.419 4.393
225 H GLU 39 H GLU 39 -2.713 6.176 1.450
226 HA GLU 39 HA GLU 39 -1.288 3.864 0.968
227 HB3 GLU 39 2HB GLU 39 0.522 5.792 0.266
228 HG3 GLU 39 2HG GLU 39 -1.780 5.691 -1.544
229 H SER 40 H SER 40 0.001 6.714 2.689
230 HA SER 40 HA SER 40 2.375 5.663 3.562
231 HB3 SER 40 2HB SER 40 0.511 7.662 4.826
232 HG SER 40 HG SER 40 3.145 7.155 5.723
233 H CYS 41 H CYS 41 -0.175 6.090 5.974
234 HA CYS 41 HA CYS 41 0.596 4.423 7.901
235 HB3 CYS 41 2HB CYS 41 -1.826 3.903 8.350
236 H MET 42 H MET 42 -1.248 3.312 5.063
237 HA MET 42 HA MET 42 -1.412 0.626 5.648
238 HB3 MET 42 2HB MET 42 -1.079 2.023 2.996
239 HG3 MET 42 2HG MET 42 -0.535 -0.579 3.182
240 HE1 MET 42 3HE MET 42 -3.319 0.183 5.067
241 HE2 MET 42 1HE MET 42 -3.985 -1.443 5.213
242 HE3 MET 42 2HE MET 42 -2.258 -1.174 5.449
243 H ALA 43 H ALA 43 1.159 2.216 3.756
244 HA ALA 43 HA ALA 43 2.776 -0.047 3.435
245 HB1 ALA 43 3HB ALA 43 3.164 2.877 3.192
246 HB2 ALA 43 1HB ALA 43 4.613 1.882 3.335
247 HB3 ALA 43 2HB ALA 43 3.469 1.589 2.027
248 H ALA 44 H ALA 44 2.246 1.974 6.170
249 HA ALA 44 HA ALA 44 4.700 1.362 7.524
250 HB1 ALA 44 3HB ALA 44 2.551 2.160 9.282
251 HB2 ALA 44 1HB ALA 44 4.064 2.984 8.904
252 HB3 ALA 44 2HB ALA 44 2.653 3.210 7.869
253 H LEU 45 H LEU 45 1.307 0.391 8.058
254 HA LEU 45 HA LEU 45 1.750 -1.440 10.095
255 HB3 LEU 45 2HB LEU 45 -0.383 -2.442 9.461
256 HG LEU 45 HG LEU 45 -0.457 0.558 9.152
257 HD11 LEU 45 1HD1 LEU 45 -2.456 -1.170 8.446
258 HD12 LEU 45 2HD1 LEU 45 -2.681 0.502 8.956
259 HD13 LEU 45 3HD1 LEU 45 -2.846 -0.806 10.127
260 HD21 LEU 45 3HD2 LEU 45 -0.375 -1.306 11.443
261 HD22 LEU 45 1HD2 LEU 45 -1.506 0.042 11.562
262 HD23 LEU 45 2HD2 LEU 45 0.210 0.352 11.303
263 H LEU 46 H LEU 46 1.493 -2.092 6.599
264 HA LEU 46 HA LEU 46 1.935 -4.807 6.611
265 HB3 LEU 46 2HB LEU 46 2.771 -4.564 4.337
266 HG LEU 46 HG LEU 46 0.551 -2.590 4.868
267 HD11 LEU 46 1HD1 LEU 46 0.039 -3.111 2.422
268 HD12 LEU 46 2HD1 LEU 46 1.705 -3.680 2.323
269 HD13 LEU 46 3HD1 LEU 46 1.371 -2.004 2.757
270 HD21 LEU 46 3HD2 LEU 46 0.648 -5.405 5.029
271 HD22 LEU 46 1HD2 LEU 46 -0.240 -4.999 3.560
272 HD23 LEU 46 2HD2 LEU 46 -0.767 -4.355 5.115
273 H SER 47 H SER 47 4.272 -2.204 6.919
274 HA SER 47 HA SER 47 6.533 -4.006 6.807
275 HB3 SER 47 2HB SER 47 6.880 -1.236 7.819
276 HG SER 47 HG SER 47 8.136 -2.527 5.642
277 H SER 48 H SER 48 4.399 -4.170 8.938
278 HA SER 48 HA SER 48 6.078 -3.765 11.317
279 HB3 SER 48 2HB SER 48 3.113 -4.356 11.269
280 HG SER 48 HG SER 48 3.225 -3.974 13.356
281 H SER 49 H SER 49 5.826 -6.065 9.214
282 HA SER 49 HA SER 49 6.320 -8.294 9.277
283 HB3 SER 49 2HB SER 49 6.116 -8.862 12.099
284 HG SER 49 HG SER 49 7.540 -9.713 10.297
285 H SER 50 H SER 50 4.132 -7.705 12.035
286 HA SER 50 HA SER 50 2.270 -9.653 10.843
287 HB3 SER 50 2HB SER 50 1.568 -10.282 13.018
288 HG SER 50 HG SER 50 3.422 -11.295 13.035
289 HA PRO 51 HA PRO 51 0.246 -5.449 10.776
290 HB3 PRO 51 2HB PRO 51 1.025 -4.986 8.664
291 HG3 PRO 51 2HG PRO 51 1.670 -6.692 7.223
292 HD3 PRO 51 2HD PRO 51 2.847 -7.301 9.109
293 H LYS 52 H LYS 52 -1.719 -5.462 11.650
294 HA LYS 52 HA LYS 52 -3.638 -7.526 10.790
295 HB3 LYS 52 2HB LYS 52 -4.563 -7.559 12.950
296 HG3 LYS 52 2HG LYS 52 -1.594 -7.347 13.041
297 HD3 LYS 52 2HD LYS 52 -3.131 -8.101 15.492
298 HE3 LYS 52 2HE LYS 52 -0.710 -6.726 15.996
299 HZ1 LYS 52 3HZ LYS 52 -1.050 -9.662 16.068
300 HZ2 LYS 52 1HZ LYS 52 -1.815 -8.655 17.192
301 HZ3 LYS 52 2HZ LYS 52 -0.127 -8.683 17.094
302 H CYS 53 H CYS 53 -3.895 -4.380 12.444
303 HA CYS 53 HA CYS 53 -4.902 -2.755 10.561
304 HB3 CYS 53 2HB CYS 53 -6.971 -4.765 11.367
305 H THR 54 H THR 54 -4.220 -1.161 11.908
306 HA THR 54 HA THR 54 -4.336 -0.763 14.532
307 HB THR 54 HB THR 54 -4.219 0.980 12.301
308 HG1 THR 54 1HG THR 54 -2.659 0.922 13.923
309 HG21 THR 54 3HG2 THR 54 -5.979 2.063 14.503
310 HG22 THR 54 1HG2 THR 54 -6.531 1.637 12.883
311 HG23 THR 54 2HG2 THR 54 -5.378 2.954 13.105
312 H ALA 55 H ALA 55 -7.125 -0.477 12.388
313 HA ALA 55 HA ALA 55 -8.983 0.591 14.154
314 HB1 ALA 55 3HB ALA 55 -10.116 -1.462 12.431
315 HB2 ALA 55 1HB ALA 55 -10.420 0.275 12.477
316 HB3 ALA 55 2HB ALA 55 -9.042 -0.356 11.574
317 H CYS 56 H CYS 56 -9.104 -2.837 13.234
318 HA CYS 56 HA CYS 56 -9.797 -3.467 16.028
319 HB3 CYS 56 2HB CYS 56 -11.641 -3.904 14.506
320 H GLN 57 H GLN 57 -7.738 -4.228 13.335
321 HA GLN 57 HA GLN 57 -5.681 -5.268 13.369
322 HB3 GLN 57 2HB GLN 57 -4.711 -6.050 15.336
323 HG3 GLN 57 2HG GLN 57 -6.341 -4.609 17.136
324 HE21 GLN 57 1HE2 GLN 57 -4.359 -2.919 14.834
325 HE22 GLN 57 2HE2 GLN 57 -2.966 -2.760 15.844
326 H GLU 58 H GLU 58 -6.412 -6.578 11.692
327 HA GLU 58 HA GLU 58 -7.164 -9.303 12.513
328 HB3 GLU 58 2HB GLU 58 -8.524 -7.473 10.658
329 HG3 GLU 58 2HG GLU 58 -7.734 -10.201 9.786
330 H SER 59 H SER 59 -6.293 -7.627 9.487
331 HA SER 59 HA SER 59 -3.743 -8.766 9.227
332 HB3 SER 59 2HB SER 59 -5.044 -10.144 7.098
333 HG SER 59 HG SER 59 -3.057 -10.589 8.462
334 H ILE 60 H ILE 60 -2.679 -7.513 7.845
335 HA ILE 60 HA ILE 60 -4.204 -6.176 5.706
336 HB ILE 60 HB ILE 60 -1.769 -4.856 6.781
337 HG13 ILE 60 2HG1 ILE 60 -3.125 -5.593 8.778
338 HG21 ILE 60 1HG2 ILE 60 -4.117 -3.229 6.379
339 HG22 ILE 60 2HG2 ILE 60 -2.544 -3.148 5.588
340 HG23 ILE 60 3HG2 ILE 60 -3.788 -4.235 4.968
341 HD11 ILE 60 3HD1 ILE 60 -3.555 -2.752 8.998
342 HD12 ILE 60 1HD1 ILE 60 -2.440 -3.798 9.877
343 HD13 ILE 60 2HD1 ILE 60 -1.968 -3.118 8.320
344 H VAL 61 H VAL 61 -3.620 -7.159 3.874
345 HA VAL 61 HA VAL 61 -0.743 -7.401 3.305
346 HB VAL 61 HB VAL 61 -2.874 -9.469 2.785
347 HG11 VAL 61 1HG1 VAL 61 -1.849 -9.799 0.815
348 HG12 VAL 61 2HG1 VAL 61 -0.418 -8.882 1.290
349 HG13 VAL 61 3HG1 VAL 61 -0.596 -10.564 1.790
350 HG21 VAL 61 3HG2 VAL 61 -2.030 -10.059 4.810
351 HG22 VAL 61 1HG2 VAL 61 -0.803 -10.817 3.794
352 HG23 VAL 61 2HG2 VAL 61 -0.491 -9.245 4.529
353 H LYS 62 H LYS 62 -0.153 -6.452 1.469
354 HA LYS 62 HA LYS 62 -1.773 -4.878 -0.092
355 HB3 LYS 62 2HB LYS 62 0.562 -4.567 -0.272
356 HG3 LYS 62 2HG LYS 62 1.176 -7.064 -1.708
357 HD3 LYS 62 2HD LYS 62 3.218 -6.841 -0.214
358 HE3 LYS 62 2HE LYS 62 2.841 -4.313 -1.754
359 HZ1 LYS 62 3HZ LYS 62 5.032 -4.563 -1.197
360 HZ2 LYS 62 1HZ LYS 62 5.019 -5.336 -2.700
361 HZ3 LYS 62 2HZ LYS 62 4.994 -6.252 -1.279
362 H ASP 63 H ASP 63 -0.985 -8.288 -0.527
363 HA ASP 63 HA ASP 63 -2.127 -8.633 -3.069
364 HB3 ASP 63 2HB ASP 63 -2.434 -10.961 -1.349
365 H LYS 64 H LYS 64 -3.507 -9.119 0.171
366 HA LYS 64 HA LYS 64 -6.107 -9.767 -0.855
367 HB3 LYS 64 2HB LYS 64 -6.782 -9.994 1.395
368 HG3 LYS 64 2HG LYS 64 -4.430 -10.782 2.516
369 HD3 LYS 64 2HD LYS 64 -5.963 -12.356 0.449
370 HE3 LYS 64 2HE LYS 64 -5.367 -13.978 2.590
371 HZ1 LYS 64 3HZ LYS 64 -3.524 -14.778 1.027
372 HZ2 LYS 64 1HZ LYS 64 -4.094 -13.598 -0.044
373 HZ3 LYS 64 2HZ LYS 64 -5.120 -14.841 0.469
374 H VAL 65 H VAL 65 -4.420 -6.878 -0.109
375 HA VAL 65 HA VAL 65 -6.602 -5.193 0.520
376 HB VAL 65 HB VAL 65 -3.771 -4.823 -0.193
377 HG11 VAL 65 1HG1 VAL 65 -4.755 -3.443 -1.927
378 HG12 VAL 65 2HG1 VAL 65 -5.780 -2.639 -0.736
379 HG13 VAL 65 3HG1 VAL 65 -4.029 -2.426 -0.682
380 HG21 VAL 65 3HG2 VAL 65 -5.371 -4.537 2.043
381 HG22 VAL 65 1HG2 VAL 65 -3.702 -3.989 1.876
382 HG23 VAL 65 2HG2 VAL 65 -5.032 -2.875 1.556
383 H PHE 66 H PHE 66 -8.115 -4.294 -0.721
384 HA PHE 66 HA PHE 66 -8.896 -5.016 -3.163
385 HB3 PHE 66 2HB PHE 66 -9.620 -2.987 -1.485
386 HD1 PHE 66 1HD PHE 66 -7.003 -1.873 -2.248
387 HD2 PHE 66 2HD PHE 66 -10.882 -1.170 -3.853
388 HE1 PHE 66 1HE PHE 66 -6.286 0.360 -2.992
389 HE2 PHE 66 2HE PHE 66 -10.172 1.064 -4.600
390 HZ PHE 66 HZ PHE 66 -7.871 1.832 -4.170
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -46.550 -0.461 2.427
2 HA2 GLY 1 1HA GLY 1 -45.075 1.101 0.679
3 HA3 GLY 1 2HA GLY 1 -46.759 0.663 0.436
4 H SER 2 H SER 2 -44.553 3.135 1.436
5 HA SER 2 HA SER 2 -46.281 4.977 2.600
6 HB3 SER 2 2HB SER 2 -44.584 6.549 2.338
7 HG SER 2 HG SER 2 -43.839 4.152 2.896
8 H SER 3 H SER 3 -48.189 5.512 1.741
9 HA SER 3 HA SER 3 -48.479 5.868 -1.127
10 HB3 SER 3 2HB SER 3 -50.858 6.064 -0.683
11 HG SER 3 HG SER 3 -49.933 4.075 1.096
12 H GLY 4 H GLY 4 -47.957 7.777 1.672
13 HA2 GLY 4 1HA GLY 4 -49.067 10.214 0.608
14 HA3 GLY 4 2HA GLY 4 -48.096 10.057 2.064
15 H SER 5 H SER 5 -46.411 11.374 1.901
16 HA SER 5 HA SER 5 -44.524 11.030 -0.246
17 HB3 SER 5 2HB SER 5 -44.649 13.731 -0.436
18 HG SER 5 HG SER 5 -45.856 13.317 -2.381
19 H SER 6 H SER 6 -44.626 10.762 2.658
20 HA SER 6 HA SER 6 -42.905 12.912 3.618
21 HB3 SER 6 2HB SER 6 -43.171 11.882 5.822
22 HG SER 6 HG SER 6 -45.086 12.725 5.958
23 H GLY 7 H GLY 7 -42.005 10.950 1.594
24 HA2 GLY 7 1HA GLY 7 -39.644 9.976 3.069
25 HA3 GLY 7 2HA GLY 7 -40.477 8.930 1.927
26 H PHE 8 H PHE 8 -39.181 12.255 1.994
27 HA PHE 8 HA PHE 8 -38.296 11.905 -0.772
28 HB3 PHE 8 2HB PHE 8 -37.817 14.503 0.521
29 HD1 PHE 8 2HD PHE 8 -36.827 13.346 -2.009
30 HD2 PHE 8 1HD PHE 8 -40.434 15.430 -1.136
31 HE1 PHE 8 2HE PHE 8 -36.958 14.093 -4.350
32 HE2 PHE 8 1HE PHE 8 -40.572 16.179 -3.476
33 HZ PHE 8 HZ PHE 8 -38.832 15.511 -5.085
34 H VAL 9 H VAL 9 -36.300 11.213 -1.112
35 HA VAL 9 HA VAL 9 -34.275 11.499 0.961
36 HB VAL 9 HB VAL 9 -34.649 9.339 -0.306
37 HG11 VAL 9 1HG1 VAL 9 -34.440 10.974 -2.524
38 HG12 VAL 9 2HG1 VAL 9 -32.900 10.112 -2.491
39 HG13 VAL 9 3HG1 VAL 9 -34.416 9.211 -2.520
40 HG21 VAL 9 3HG2 VAL 9 -31.823 10.079 -0.763
41 HG22 VAL 9 1HG2 VAL 9 -32.449 10.314 0.869
42 HG23 VAL 9 2HG2 VAL 9 -32.512 8.718 0.122
43 H LYS 10 H LYS 10 -32.140 12.299 0.485
44 HA LYS 10 HA LYS 10 -32.077 14.254 -1.719
45 HB3 LYS 10 2HB LYS 10 -30.377 15.259 0.237
46 HG3 LYS 10 2HG LYS 10 -32.707 16.102 -1.124
47 HD3 LYS 10 2HD LYS 10 -32.804 17.333 1.557
48 HE3 LYS 10 2HE LYS 10 -35.343 16.851 0.843
49 HZ1 LYS 10 3HZ LYS 10 -35.133 19.030 -0.473
50 HZ2 LYS 10 1HZ LYS 10 -33.516 19.012 0.022
51 HZ3 LYS 10 2HZ LYS 10 -34.753 19.045 1.174
52 H THR 11 H THR 11 -30.620 11.617 -0.204
53 HA THR 11 HA THR 11 -28.773 10.392 -0.754
54 HB THR 11 HB THR 11 -27.740 12.339 -2.744
55 HG1 THR 11 1HG THR 11 -29.544 12.408 -3.834
56 HG21 THR 11 3HG2 THR 11 -27.792 10.052 -4.040
57 HG22 THR 11 1HG2 THR 11 -27.970 9.380 -2.420
58 HG23 THR 11 2HG2 THR 11 -26.560 10.363 -2.817
59 H VAL 12 H VAL 12 -26.382 10.480 -0.610
60 HA VAL 12 HA VAL 12 -25.312 12.944 0.541
61 HB VAL 12 HB VAL 12 -25.092 10.293 1.972
62 HG11 VAL 12 1HG1 VAL 12 -23.210 11.321 2.691
63 HG12 VAL 12 2HG1 VAL 12 -23.806 12.933 2.292
64 HG13 VAL 12 3HG1 VAL 12 -24.341 12.134 3.772
65 HG21 VAL 12 3HG2 VAL 12 -26.808 12.707 2.513
66 HG22 VAL 12 1HG2 VAL 12 -27.321 11.035 2.276
67 HG23 VAL 12 2HG2 VAL 12 -26.446 11.491 3.738
68 H GLU 13 H GLU 13 -23.720 13.293 -0.893
69 HA GLU 13 HA GLU 13 -22.066 11.063 -1.797
70 HB3 GLU 13 2HB GLU 13 -22.790 12.515 -3.552
71 HG3 GLU 13 2HG GLU 13 -22.504 14.592 -1.658
72 H ASP 14 H ASP 14 -20.217 10.587 -0.833
73 HA ASP 14 HA ASP 14 -18.470 12.670 0.155
74 HB3 ASP 14 2HB ASP 14 -20.037 12.185 2.055
75 H LYS 15 H LYS 15 -16.660 11.228 1.558
76 HA LYS 15 HA LYS 15 -15.897 9.017 -0.228
77 HB3 LYS 15 2HB LYS 15 -13.847 9.883 -0.671
78 HG3 LYS 15 2HG LYS 15 -15.611 11.774 -1.045
79 HD3 LYS 15 2HD LYS 15 -14.502 12.466 1.516
80 HE3 LYS 15 2HE LYS 15 -12.874 13.712 0.080
81 HZ1 LYS 15 3HZ LYS 15 -13.705 15.671 -1.071
82 HZ2 LYS 15 1HZ LYS 15 -15.301 15.216 -0.740
83 HZ3 LYS 15 2HZ LYS 15 -14.342 14.260 -1.753
84 H TYR 16 H TYR 16 -13.596 8.204 0.967
85 HA TYR 16 HA TYR 16 -14.592 7.196 3.529
86 HB3 TYR 16 2HB TYR 16 -12.825 5.482 3.296
87 HD1 TYR 16 2HD TYR 16 -15.741 6.606 1.852
88 HD2 TYR 16 1HD TYR 16 -12.760 3.622 1.297
89 HE1 TYR 16 2HE TYR 16 -17.352 5.240 0.594
90 HE2 TYR 16 1HE TYR 16 -14.363 2.246 0.037
91 HH TYR 16 HH TYR 16 -17.149 3.378 -1.240
92 H LYS 17 H LYS 17 -12.370 6.500 4.860
93 HA LYS 17 HA LYS 17 -10.493 8.687 4.997
94 HB3 LYS 17 2HB LYS 17 -12.676 8.330 7.009
95 HG3 LYS 17 2HG LYS 17 -10.897 10.056 8.222
96 HD3 LYS 17 2HD LYS 17 -10.553 7.825 9.676
97 HE3 LYS 17 2HE LYS 17 -12.460 9.969 9.575
98 HZ1 LYS 17 3HZ LYS 17 -14.317 8.710 9.555
99 HZ2 LYS 17 1HZ LYS 17 -13.959 8.521 11.198
100 HZ3 LYS 17 2HZ LYS 17 -13.532 7.313 10.096
101 H CYS 18 H CYS 18 -8.598 8.119 5.982
102 HA CYS 18 HA CYS 18 -8.018 5.386 6.290
103 HB3 CYS 18 2HB CYS 18 -6.525 7.881 7.095
104 H GLU 19 H GLU 19 -7.800 4.077 8.056
105 HA GLU 19 HA GLU 19 -9.218 4.907 10.441
106 HB3 GLU 19 2HB GLU 19 -8.548 2.453 11.099
107 HG3 GLU 19 2HG GLU 19 -10.484 1.587 10.155
108 H LYS 20 H LYS 20 -6.595 6.093 9.812
109 HA LYS 20 HA LYS 20 -5.284 5.464 12.361
110 HB3 LYS 20 2HB LYS 20 -3.317 6.211 10.398
111 HG3 LYS 20 2HG LYS 20 -3.769 3.793 12.113
112 HD3 LYS 20 2HD LYS 20 -1.412 4.302 10.298
113 HE3 LYS 20 2HE LYS 20 -0.641 2.134 11.025
114 HZ1 LYS 20 3HZ LYS 20 -0.553 4.313 12.571
115 HZ2 LYS 20 1HZ LYS 20 0.237 2.862 12.939
116 HZ3 LYS 20 2HZ LYS 20 -1.263 3.210 13.640
117 H CYS 21 H CYS 21 -4.746 7.662 9.601
118 HA CYS 21 HA CYS 21 -4.410 9.871 11.484
119 HB3 CYS 21 2HB CYS 21 -2.662 9.743 9.868
120 H HIS 22 H HIS 22 -6.927 8.476 9.983
121 HA HIS 22 HA HIS 22 -9.045 9.118 9.455
122 HB3 HIS 22 2HB HIS 22 -9.922 10.479 11.007
123 HD2 HIS 22 2HD HIS 22 -7.806 8.624 12.457
124 HE1 HIS 22 1HE HIS 22 -6.436 12.125 14.424
125 HE2 HIS 22 2HE HIS 22 -6.390 9.607 14.385
126 H LEU 23 H LEU 23 -6.792 9.732 7.652
127 HA LEU 23 HA LEU 23 -7.308 12.238 6.391
128 HB3 LEU 23 2HB LEU 23 -6.073 10.713 4.483
129 HG LEU 23 HG LEU 23 -4.888 12.338 6.703
130 HD11 LEU 23 1HD1 LEU 23 -2.875 11.448 6.469
131 HD12 LEU 23 2HD1 LEU 23 -2.926 11.739 4.731
132 HD13 LEU 23 3HD1 LEU 23 -3.546 10.225 5.390
133 HD21 LEU 23 3HD2 LEU 23 -4.498 13.925 5.055
134 HD22 LEU 23 1HD2 LEU 23 -6.057 13.246 4.586
135 HD23 LEU 23 2HD2 LEU 23 -4.589 12.740 3.751
136 H VAL 24 H VAL 24 -9.030 12.715 5.213
137 HA VAL 24 HA VAL 24 -10.892 10.775 4.311
138 HB VAL 24 HB VAL 24 -10.593 13.721 3.788
139 HG11 VAL 24 1HG1 VAL 24 -12.510 11.781 2.538
140 HG12 VAL 24 2HG1 VAL 24 -12.927 13.483 2.752
141 HG13 VAL 24 3HG1 VAL 24 -11.537 13.031 1.765
142 HG21 VAL 24 3HG2 VAL 24 -11.912 12.085 5.746
143 HG22 VAL 24 1HG2 VAL 24 -11.731 13.839 5.693
144 HG23 VAL 24 2HG2 VAL 24 -13.092 13.067 4.879
145 H LEU 25 H LEU 25 -10.498 9.403 2.705
146 HA LEU 25 HA LEU 25 -9.077 10.401 0.324
147 HB3 LEU 25 2HB LEU 25 -7.801 8.582 0.317
148 HG LEU 25 HG LEU 25 -9.014 8.244 3.025
149 HD11 LEU 25 1HD1 LEU 25 -6.826 6.426 2.585
150 HD12 LEU 25 2HD1 LEU 25 -8.178 6.052 1.518
151 HD13 LEU 25 3HD1 LEU 25 -8.424 6.119 3.263
152 HD21 LEU 25 3HD2 LEU 25 -6.516 8.425 3.566
153 HD22 LEU 25 1HD2 LEU 25 -7.339 9.870 2.980
154 HD23 LEU 25 2HD2 LEU 25 -6.324 8.929 1.886
155 H CYS 26 H CYS 26 -9.610 8.650 -1.560
156 HA CYS 26 HA CYS 26 -12.552 8.600 -1.744
157 HB3 CYS 26 2HB CYS 26 -10.440 9.215 -3.790
158 H SER 27 H SER 27 -9.727 6.743 -1.709
159 HA SER 27 HA SER 27 -11.166 4.304 -2.010
160 HB3 SER 27 2HB SER 27 -9.685 5.393 -4.337
161 HG SER 27 HG SER 27 -9.736 2.613 -4.123
162 HA PRO 28 HA PRO 28 -7.390 4.057 0.594
163 HB3 PRO 28 2HB PRO 28 -8.683 4.292 2.479
164 HG3 PRO 28 2HG PRO 28 -10.939 3.730 2.464
165 HD3 PRO 28 2HD PRO 28 -10.849 5.060 0.585
166 H LYS 29 H LYS 29 -6.934 1.735 1.945
167 HA LYS 29 HA LYS 29 -6.873 -0.277 -0.206
168 HB3 LYS 29 2HB LYS 29 -4.787 -1.090 0.727
169 HG3 LYS 29 2HG LYS 29 -3.303 0.822 0.449
170 HD3 LYS 29 2HD LYS 29 -5.630 0.670 -1.459
171 HE3 LYS 29 2HE LYS 29 -2.952 1.825 -2.147
172 HZ1 LYS 29 3HZ LYS 29 -4.343 1.239 -3.983
173 HZ2 LYS 29 1HZ LYS 29 -4.322 2.927 -3.861
174 HZ3 LYS 29 2HZ LYS 29 -5.668 2.056 -3.322
175 H GLN 30 H GLN 30 -9.133 -0.429 1.087
176 HA GLN 30 HA GLN 30 -9.593 -1.507 3.473
177 HB3 GLN 30 2HB GLN 30 -10.838 -3.192 1.429
178 HG3 GLN 30 2HG GLN 30 -11.853 -1.222 3.454
179 HE21 GLN 30 1HE2 GLN 30 -14.166 -1.340 3.828
180 HE22 GLN 30 2HE2 GLN 30 -15.228 -1.549 2.483
181 H THR 31 H THR 31 -8.888 -3.139 4.676
182 HA THR 31 HA THR 31 -7.089 -5.093 3.523
183 HB THR 31 HB THR 31 -6.446 -5.653 5.698
184 HG1 THR 31 1HG THR 31 -8.921 -4.540 6.579
185 HG21 THR 31 3HG2 THR 31 -5.723 -3.657 6.546
186 HG22 THR 31 1HG2 THR 31 -7.300 -2.888 6.381
187 HG23 THR 31 2HG2 THR 31 -6.272 -3.105 4.964
188 H GLU 32 H GLU 32 -7.724 -7.134 5.525
189 HA GLU 32 HA GLU 32 -9.976 -8.365 4.111
190 HB3 GLU 32 2HB GLU 32 -8.450 -9.991 6.036
191 HG3 GLU 32 2HG GLU 32 -8.474 -10.734 3.208
192 H CYS 33 H CYS 33 -9.883 -6.408 6.535
193 HA CYS 33 HA CYS 33 -11.610 -8.006 8.307
194 HB3 CYS 33 2HB CYS 33 -9.478 -7.016 9.271
195 H GLY 34 H GLY 34 -11.316 -5.068 6.438
196 HA2 GLY 34 1HA GLY 34 -13.577 -4.414 5.502
197 HA3 GLY 34 2HA GLY 34 -14.082 -4.353 7.185
198 H HIS 35 H HIS 35 -11.872 -3.122 8.334
199 HA HIS 35 HA HIS 35 -12.431 -0.440 8.050
200 HB3 HIS 35 2HB HIS 35 -10.143 -0.068 9.088
201 HD2 HIS 35 2HD HIS 35 -12.112 0.749 10.973
202 HE1 HIS 35 1HE HIS 35 -12.344 -3.040 12.866
203 HE2 HIS 35 2HE HIS 35 -13.034 -0.620 12.964
204 H ARG 36 H ARG 36 -10.383 1.131 7.545
205 HA ARG 36 HA ARG 36 -9.198 0.420 4.977
206 HB3 ARG 36 2HB ARG 36 -9.969 2.508 3.924
207 HG3 ARG 36 2HG ARG 36 -11.946 0.495 4.836
208 HD3 ARG 36 2HD ARG 36 -12.937 2.591 3.002
209 HE ARG 36 HE ARG 36 -14.769 1.334 3.482
210 HH11 ARG 36 1HH1 ARG 36 -12.863 1.637 6.378
211 HH12 ARG 36 2HH1 ARG 36 -13.995 0.777 7.369
212 HH21 ARG 36 1HH2 ARG 36 -16.267 0.200 4.775
213 HH22 ARG 36 2HH2 ARG 36 -15.931 -0.040 6.457
214 H PHE 37 H PHE 37 -7.473 1.844 4.332
215 HA PHE 37 HA PHE 37 -6.539 3.777 6.297
216 HB3 PHE 37 2HB PHE 37 -4.219 2.662 6.175
217 HD1 PHE 37 2HD PHE 37 -6.717 0.110 7.070
218 HD2 PHE 37 1HD PHE 37 -4.257 3.293 8.459
219 HE1 PHE 37 2HE PHE 37 -7.196 -0.539 9.394
220 HE2 PHE 37 1HE PHE 37 -4.733 2.649 10.786
221 HZ PHE 37 HZ PHE 37 -6.205 0.732 11.256
222 H CYS 38 H CYS 38 -4.579 4.949 5.508
223 HA CYS 38 HA CYS 38 -4.908 5.526 2.679
224 HB3 CYS 38 2HB CYS 38 -4.801 7.341 4.405
225 H GLU 39 H GLU 39 -2.851 6.037 1.427
226 HA GLU 39 HA GLU 39 -1.393 3.756 0.963
227 HB3 GLU 39 2HB GLU 39 0.385 5.575 0.118
228 HG3 GLU 39 2HG GLU 39 -2.309 5.211 -1.172
229 H SER 40 H SER 40 -0.128 6.637 2.650
230 HA SER 40 HA SER 40 2.281 5.630 3.484
231 HB3 SER 40 2HB SER 40 1.900 7.192 5.539
232 HG SER 40 HG SER 40 1.530 8.730 3.299
233 H CYS 41 H CYS 41 -0.212 6.049 5.953
234 HA CYS 41 HA CYS 41 0.619 4.394 7.864
235 HB3 CYS 41 2HB CYS 41 -1.784 3.869 8.386
236 H MET 42 H MET 42 -1.307 3.260 5.091
237 HA MET 42 HA MET 42 -1.448 0.578 5.686
238 HB3 MET 42 2HB MET 42 -1.167 1.959 3.019
239 HG3 MET 42 2HG MET 42 -0.626 -0.643 3.212
240 HE1 MET 42 3HE MET 42 -4.036 -1.483 5.320
241 HE2 MET 42 1HE MET 42 -2.303 -1.221 5.520
242 HE3 MET 42 2HE MET 42 -3.364 0.140 5.151
243 H ALA 43 H ALA 43 1.114 2.208 3.821
244 HA ALA 43 HA ALA 43 2.719 -0.063 3.433
245 HB1 ALA 43 3HB ALA 43 4.495 2.038 3.476
246 HB2 ALA 43 1HB ALA 43 3.590 1.473 2.072
247 HB3 ALA 43 2HB ALA 43 2.969 2.808 3.044
248 H ALA 44 H ALA 44 2.323 2.053 6.157
249 HA ALA 44 HA ALA 44 4.755 1.385 7.485
250 HB1 ALA 44 3HB ALA 44 4.136 3.060 8.801
251 HB2 ALA 44 1HB ALA 44 2.624 3.176 7.899
252 HB3 ALA 44 2HB ALA 44 2.717 2.159 9.337
253 H LEU 45 H LEU 45 1.375 0.464 8.183
254 HA LEU 45 HA LEU 45 1.859 -1.394 10.162
255 HB3 LEU 45 2HB LEU 45 -0.287 -2.396 9.570
256 HG LEU 45 HG LEU 45 -0.385 0.603 9.251
257 HD11 LEU 45 1HD1 LEU 45 -2.697 -0.921 10.278
258 HD12 LEU 45 2HD1 LEU 45 -2.385 -1.028 8.546
259 HD13 LEU 45 3HD1 LEU 45 -2.644 0.545 9.299
260 HD21 LEU 45 3HD2 LEU 45 -0.178 -1.232 11.552
261 HD22 LEU 45 1HD2 LEU 45 -1.337 0.088 11.708
262 HD23 LEU 45 2HD2 LEU 45 0.359 0.439 11.376
263 H LEU 46 H LEU 46 1.534 -2.041 6.672
264 HA LEU 46 HA LEU 46 2.002 -4.764 6.702
265 HB3 LEU 46 2HB LEU 46 2.720 -4.533 4.385
266 HG LEU 46 HG LEU 46 0.427 -2.725 5.106
267 HD11 LEU 46 1HD1 LEU 46 -0.134 -2.548 2.794
268 HD12 LEU 46 2HD1 LEU 46 1.206 -3.597 2.331
269 HD13 LEU 46 3HD1 LEU 46 1.528 -1.992 2.991
270 HD21 LEU 46 3HD2 LEU 46 -0.204 -4.920 5.513
271 HD22 LEU 46 1HD2 LEU 46 0.737 -5.548 4.159
272 HD23 LEU 46 2HD2 LEU 46 -0.755 -4.656 3.857
273 H SER 47 H SER 47 4.326 -2.107 6.702
274 HA SER 47 HA SER 47 6.663 -3.579 6.296
275 HB3 SER 47 2HB SER 47 6.286 -1.075 7.959
276 HG SER 47 HG SER 47 8.321 -2.073 8.280
277 H SER 48 H SER 48 4.522 -3.612 8.920
278 HA SER 48 HA SER 48 6.375 -4.233 10.999
279 HB3 SER 48 2HB SER 48 3.399 -4.767 10.821
280 HG SER 48 HG SER 48 3.997 -4.460 13.277
281 H SER 49 H SER 49 6.397 -6.319 12.158
282 HA SER 49 HA SER 49 6.886 -8.461 10.311
283 HB3 SER 49 2HB SER 49 7.130 -8.163 13.297
284 HG SER 49 HG SER 49 6.856 -10.249 13.394
285 H SER 50 H SER 50 4.093 -7.310 11.473
286 HA SER 50 HA SER 50 2.575 -9.573 10.773
287 HB3 SER 50 2HB SER 50 1.709 -9.456 13.427
288 HG SER 50 HG SER 50 3.493 -11.370 12.337
289 HA PRO 51 HA PRO 51 0.447 -5.453 10.847
290 HB3 PRO 51 2HB PRO 51 1.158 -4.977 8.715
291 HG3 PRO 51 2HG PRO 51 1.777 -6.673 7.250
292 HD3 PRO 51 2HD PRO 51 3.014 -7.276 9.098
293 H LYS 52 H LYS 52 -1.551 -5.374 11.644
294 HA LYS 52 HA LYS 52 -3.452 -7.497 10.889
295 HB3 LYS 52 2HB LYS 52 -4.330 -7.526 13.067
296 HG3 LYS 52 2HG LYS 52 -1.364 -7.295 13.081
297 HD3 LYS 52 2HD LYS 52 -2.821 -7.978 15.600
298 HE3 LYS 52 2HE LYS 52 -0.050 -7.206 14.790
299 HZ1 LYS 52 3HZ LYS 52 -0.143 -5.770 16.543
300 HZ2 LYS 52 1HZ LYS 52 0.259 -7.191 17.368
301 HZ3 LYS 52 2HZ LYS 52 -1.341 -6.641 17.361
302 H CYS 53 H CYS 53 -3.696 -4.341 12.528
303 HA CYS 53 HA CYS 53 -4.744 -2.730 10.659
304 HB3 CYS 53 2HB CYS 53 -6.788 -4.752 11.499
305 H THR 54 H THR 54 -4.061 -1.124 11.989
306 HA THR 54 HA THR 54 -4.140 -0.721 14.614
307 HB THR 54 HB THR 54 -4.148 1.035 12.359
308 HG1 THR 54 1HG THR 54 -2.610 0.684 14.218
309 HG21 THR 54 3HG2 THR 54 -5.152 3.030 13.442
310 HG22 THR 54 1HG2 THR 54 -5.798 1.981 14.705
311 HG23 THR 54 2HG2 THR 54 -6.341 1.793 13.037
312 H ALA 55 H ALA 55 -6.963 -0.462 12.512
313 HA ALA 55 HA ALA 55 -8.802 0.593 14.308
314 HB1 ALA 55 3HB ALA 55 -9.950 -1.468 12.604
315 HB2 ALA 55 1HB ALA 55 -10.258 0.268 12.649
316 HB3 ALA 55 2HB ALA 55 -8.892 -0.361 11.727
317 H CYS 56 H CYS 56 -8.918 -2.836 13.387
318 HA CYS 56 HA CYS 56 -9.567 -3.471 16.189
319 HB3 CYS 56 2HB CYS 56 -11.419 -3.929 14.677
320 H GLN 57 H GLN 57 -7.535 -4.223 13.470
321 HA GLN 57 HA GLN 57 -5.468 -5.241 13.482
322 HB3 GLN 57 2HB GLN 57 -4.463 -6.010 15.440
323 HG3 GLN 57 2HG GLN 57 -6.187 -4.513 17.176
324 HE21 GLN 57 1HE2 GLN 57 -3.726 -3.277 14.988
325 HE22 GLN 57 2HE2 GLN 57 -2.492 -3.092 16.184
326 H GLU 58 H GLU 58 -6.199 -6.570 11.824
327 HA GLU 58 HA GLU 58 -6.908 -9.299 12.671
328 HB3 GLU 58 2HB GLU 58 -7.984 -8.936 10.106
329 HG3 GLU 58 2HG GLU 58 -10.158 -8.686 11.717
330 H SER 59 H SER 59 -6.103 -7.621 9.628
331 HA SER 59 HA SER 59 -3.549 -8.744 9.331
332 HB3 SER 59 2HB SER 59 -4.832 -10.127 7.212
333 HG SER 59 HG SER 59 -2.975 -10.928 8.055
334 H ILE 60 H ILE 60 -2.521 -7.437 7.975
335 HA ILE 60 HA ILE 60 -4.077 -6.117 5.848
336 HB ILE 60 HB ILE 60 -1.638 -4.791 6.912
337 HG13 ILE 60 2HG1 ILE 60 -2.995 -5.536 8.908
338 HG21 ILE 60 1HG2 ILE 60 -3.849 -4.166 5.218
339 HG22 ILE 60 2HG2 ILE 60 -3.820 -3.040 6.576
340 HG23 ILE 60 3HG2 ILE 60 -2.399 -3.217 5.547
341 HD11 ILE 60 3HD1 ILE 60 -3.409 -2.683 9.110
342 HD12 ILE 60 1HD1 ILE 60 -2.335 -3.740 10.025
343 HD13 ILE 60 2HD1 ILE 60 -1.814 -3.081 8.475
344 H VAL 61 H VAL 61 -3.398 -6.507 3.852
345 HA VAL 61 HA VAL 61 -0.565 -6.935 3.318
346 HB VAL 61 HB VAL 61 -2.682 -8.968 2.611
347 HG11 VAL 61 1HG1 VAL 61 -1.189 -8.574 0.710
348 HG12 VAL 61 2HG1 VAL 61 0.208 -8.870 1.749
349 HG13 VAL 61 3HG1 VAL 61 -0.935 -10.171 1.413
350 HG21 VAL 61 3HG2 VAL 61 -1.245 -10.513 3.863
351 HG22 VAL 61 1HG2 VAL 61 -0.161 -9.179 4.252
352 HG23 VAL 61 2HG2 VAL 61 -1.810 -9.184 4.874
353 H LYS 62 H LYS 62 0.059 -6.163 1.373
354 HA LYS 62 HA LYS 62 -1.588 -4.433 -0.069
355 HB3 LYS 62 2HB LYS 62 0.786 -4.162 -0.184
356 HG3 LYS 62 2HG LYS 62 1.137 -6.646 -1.801
357 HD3 LYS 62 2HD LYS 62 2.944 -4.917 -0.116
358 HE3 LYS 62 2HE LYS 62 3.297 -7.559 -0.341
359 HZ1 LYS 62 3HZ LYS 62 3.448 -7.785 -2.643
360 HZ2 LYS 62 1HZ LYS 62 5.062 -7.771 -2.134
361 HZ3 LYS 62 2HZ LYS 62 4.381 -6.387 -2.828
362 H ASP 63 H ASP 63 -0.481 -7.706 -0.935
363 HA ASP 63 HA ASP 63 -1.770 -7.959 -3.370
364 HB3 ASP 63 2HB ASP 63 -1.269 -10.204 -3.258
365 H LYS 64 H LYS 64 -3.006 -8.805 -0.144
366 HA LYS 64 HA LYS 64 -5.611 -9.470 -1.171
367 HB3 LYS 64 2HB LYS 64 -6.174 -10.073 1.024
368 HG3 LYS 64 2HG LYS 64 -4.354 -11.330 1.949
369 HD3 LYS 64 2HD LYS 64 -3.601 -11.473 -0.909
370 HE3 LYS 64 2HE LYS 64 -3.190 -13.176 1.002
371 HZ1 LYS 64 3HZ LYS 64 -5.047 -14.868 0.969
372 HZ2 LYS 64 1HZ LYS 64 -6.041 -13.641 0.361
373 HZ3 LYS 64 2HZ LYS 64 -5.325 -13.472 1.884
374 H VAL 65 H VAL 65 -4.134 -6.607 -0.886
375 HA VAL 65 HA VAL 65 -6.424 -5.141 0.196
376 HB VAL 65 HB VAL 65 -3.577 -4.618 -0.011
377 HG11 VAL 65 1HG1 VAL 65 -4.257 -3.202 -1.886
378 HG12 VAL 65 2HG1 VAL 65 -5.439 -2.397 -0.851
379 HG13 VAL 65 3HG1 VAL 65 -3.715 -2.235 -0.514
380 HG21 VAL 65 3HG2 VAL 65 -5.908 -3.661 1.596
381 HG22 VAL 65 1HG2 VAL 65 -4.451 -4.505 2.122
382 HG23 VAL 65 2HG2 VAL 65 -4.372 -2.799 1.681
383 H PHE 66 H PHE 66 -7.576 -3.620 -0.980
384 HA PHE 66 HA PHE 66 -6.946 -3.036 -3.718
385 HB3 PHE 66 2HB PHE 66 -7.927 -5.024 -4.374
386 HD1 PHE 66 1HD PHE 66 -10.637 -3.802 -2.122
387 HD2 PHE 66 2HD PHE 66 -8.141 -7.042 -3.301
388 HE1 PHE 66 1HE PHE 66 -11.830 -5.285 -0.563
389 HE2 PHE 66 2HE PHE 66 -9.331 -8.530 -1.745
390 HZ PHE 66 HZ PHE 66 -11.179 -7.652 -0.373
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -34.431 -4.898 -13.323
2 HA2 GLY 1 1HA GLY 1 -32.300 -3.896 -13.077
3 HA3 GLY 1 2HA GLY 1 -32.951 -2.405 -13.738
4 H SER 2 H SER 2 -35.309 -2.496 -11.975
5 HA SER 2 HA SER 2 -34.664 -0.784 -10.008
6 HB3 SER 2 2HB SER 2 -36.541 -1.995 -8.632
7 HG SER 2 HG SER 2 -37.129 -1.058 -11.244
8 H SER 3 H SER 3 -33.554 -0.753 -8.155
9 HA SER 3 HA SER 3 -32.572 -3.326 -7.105
10 HB3 SER 3 2HB SER 3 -30.668 -2.175 -7.879
11 HG SER 3 HG SER 3 -30.863 0.186 -6.598
12 H GLY 4 H GLY 4 -34.620 -0.782 -6.483
13 HA2 GLY 4 1HA GLY 4 -35.117 -1.645 -3.810
14 HA3 GLY 4 2HA GLY 4 -34.278 -0.101 -3.832
15 H SER 5 H SER 5 -35.346 1.349 -5.737
16 HA SER 5 HA SER 5 -38.090 1.199 -6.202
17 HB3 SER 5 2HB SER 5 -37.330 2.759 -3.726
18 HG SER 5 HG SER 5 -39.926 2.752 -4.783
19 H SER 6 H SER 6 -35.441 3.416 -5.428
20 HA SER 6 HA SER 6 -35.973 4.840 -7.925
21 HB3 SER 6 2HB SER 6 -36.958 6.493 -6.718
22 HG SER 6 HG SER 6 -36.649 6.737 -4.475
23 H GLY 7 H GLY 7 -33.918 2.955 -6.783
24 HA2 GLY 7 1HA GLY 7 -31.516 4.524 -6.516
25 HA3 GLY 7 2HA GLY 7 -31.617 2.771 -6.585
26 H PHE 8 H PHE 8 -31.297 5.707 -8.426
27 HA PHE 8 HA PHE 8 -30.025 4.270 -10.568
28 HB3 PHE 8 2HB PHE 8 -32.432 5.913 -11.329
29 HD1 PHE 8 2HD PHE 8 -31.281 2.592 -12.453
30 HD2 PHE 8 1HD PHE 8 -31.576 6.740 -13.365
31 HE1 PHE 8 2HE PHE 8 -30.597 2.128 -14.770
32 HE2 PHE 8 1HE PHE 8 -30.892 6.281 -15.683
33 HZ PHE 8 HZ PHE 8 -30.401 3.974 -16.389
34 H VAL 9 H VAL 9 -28.263 5.572 -9.991
35 HA VAL 9 HA VAL 9 -28.193 8.120 -11.312
36 HB VAL 9 HB VAL 9 -29.152 8.517 -8.935
37 HG11 VAL 9 1HG1 VAL 9 -26.222 8.194 -8.286
38 HG12 VAL 9 2HG1 VAL 9 -27.471 8.792 -7.192
39 HG13 VAL 9 3HG1 VAL 9 -27.519 7.122 -7.757
40 HG21 VAL 9 3HG2 VAL 9 -27.771 10.623 -8.740
41 HG22 VAL 9 1HG2 VAL 9 -26.828 10.029 -10.108
42 HG23 VAL 9 2HG2 VAL 9 -28.549 10.361 -10.301
43 H LYS 10 H LYS 10 -26.065 8.948 -11.548
44 HA LYS 10 HA LYS 10 -24.009 6.894 -11.198
45 HB3 LYS 10 2HB LYS 10 -23.892 9.440 -12.824
46 HG3 LYS 10 2HG LYS 10 -21.798 7.850 -12.123
47 HD3 LYS 10 2HD LYS 10 -23.120 6.701 -14.528
48 HE3 LYS 10 2HE LYS 10 -20.331 6.013 -14.482
49 HZ1 LYS 10 3HZ LYS 10 -21.509 5.573 -16.417
50 HZ2 LYS 10 1HZ LYS 10 -20.581 6.922 -16.840
51 HZ3 LYS 10 2HZ LYS 10 -22.221 7.107 -16.470
52 H THR 11 H THR 11 -24.695 10.270 -10.444
53 HA THR 11 HA THR 11 -22.353 11.214 -9.461
54 HB THR 11 HB THR 11 -24.631 11.680 -7.634
55 HG1 THR 11 1HG THR 11 -25.972 12.451 -9.129
56 HG21 THR 11 3HG2 THR 11 -22.439 12.983 -7.800
57 HG22 THR 11 1HG2 THR 11 -23.930 13.923 -7.760
58 HG23 THR 11 2HG2 THR 11 -23.092 13.662 -9.291
59 H VAL 12 H VAL 12 -21.373 11.310 -7.367
60 HA VAL 12 HA VAL 12 -21.930 8.944 -5.696
61 HB VAL 12 HB VAL 12 -19.836 8.589 -6.829
62 HG11 VAL 12 1HG1 VAL 12 -19.581 11.354 -6.710
63 HG12 VAL 12 2HG1 VAL 12 -18.283 10.741 -5.685
64 HG13 VAL 12 3HG1 VAL 12 -18.408 10.210 -7.362
65 HG21 VAL 12 3HG2 VAL 12 -18.606 7.952 -5.006
66 HG22 VAL 12 1HG2 VAL 12 -18.885 9.469 -4.151
67 HG23 VAL 12 2HG2 VAL 12 -20.161 8.255 -4.233
68 H GLU 13 H GLU 13 -22.472 9.376 -3.664
69 HA GLU 13 HA GLU 13 -21.651 11.960 -2.511
70 HB3 GLU 13 2HB GLU 13 -23.790 11.805 -1.164
71 HG3 GLU 13 2HG GLU 13 -25.155 12.008 -3.568
72 H ASP 14 H ASP 14 -19.798 10.836 -1.659
73 HA ASP 14 HA ASP 14 -19.863 10.225 0.983
74 HB3 ASP 14 2HB ASP 14 -19.489 7.548 0.469
75 H LYS 15 H LYS 15 -17.890 9.064 1.772
76 HA LYS 15 HA LYS 15 -15.767 8.625 -0.127
77 HB3 LYS 15 2HB LYS 15 -15.663 11.044 0.027
78 HG3 LYS 15 2HG LYS 15 -14.946 10.996 2.905
79 HD3 LYS 15 2HD LYS 15 -16.538 13.044 1.397
80 HE3 LYS 15 2HE LYS 15 -15.121 14.508 2.976
81 HZ1 LYS 15 3HZ LYS 15 -17.100 14.639 3.931
82 HZ2 LYS 15 1HZ LYS 15 -16.716 13.290 4.875
83 HZ3 LYS 15 2HZ LYS 15 -17.529 13.090 3.406
84 H TYR 16 H TYR 16 -13.606 8.362 1.220
85 HA TYR 16 HA TYR 16 -14.286 6.799 3.626
86 HB3 TYR 16 2HB TYR 16 -12.515 5.254 3.077
87 HD1 TYR 16 1HD TYR 16 -13.326 6.351 -0.337
88 HD2 TYR 16 2HD TYR 16 -14.409 3.783 2.878
89 HE1 TYR 16 1HE TYR 16 -14.809 5.096 -1.846
90 HE2 TYR 16 2HE TYR 16 -15.894 2.521 1.377
91 HH TYR 16 HH TYR 16 -15.841 2.908 -2.015
92 H LYS 17 H LYS 17 -12.304 6.458 5.060
93 HA LYS 17 HA LYS 17 -10.405 8.657 5.033
94 HB3 LYS 17 2HB LYS 17 -12.589 8.357 7.052
95 HG3 LYS 17 2HG LYS 17 -10.867 10.172 8.199
96 HD3 LYS 17 2HD LYS 17 -10.448 8.015 9.739
97 HE3 LYS 17 2HE LYS 17 -12.549 10.012 9.488
98 HZ1 LYS 17 3HZ LYS 17 -13.316 7.932 11.363
99 HZ2 LYS 17 1HZ LYS 17 -13.626 7.597 9.734
100 HZ3 LYS 17 2HZ LYS 17 -14.282 8.980 10.451
101 H CYS 18 H CYS 18 -8.504 8.184 6.060
102 HA CYS 18 HA CYS 18 -7.877 5.478 6.518
103 HB3 CYS 18 2HB CYS 18 -6.404 8.022 7.209
104 H GLU 19 H GLU 19 -7.683 4.272 8.349
105 HA GLU 19 HA GLU 19 -9.063 5.253 10.697
106 HB3 GLU 19 2HB GLU 19 -8.278 2.795 11.434
107 HG3 GLU 19 2HG GLU 19 -10.340 1.924 10.748
108 H LYS 20 H LYS 20 -6.397 6.322 9.933
109 HA LYS 20 HA LYS 20 -5.061 5.820 12.504
110 HB3 LYS 20 2HB LYS 20 -3.168 6.500 10.423
111 HG3 LYS 20 2HG LYS 20 -3.475 4.253 12.379
112 HD3 LYS 20 2HD LYS 20 -1.202 4.574 10.422
113 HE3 LYS 20 2HE LYS 20 -0.437 2.469 11.279
114 HZ1 LYS 20 3HZ LYS 20 -1.136 3.846 13.774
115 HZ2 LYS 20 1HZ LYS 20 -0.158 4.648 12.651
116 HZ3 LYS 20 2HZ LYS 20 0.338 3.166 13.297
117 H CYS 21 H CYS 21 -4.747 7.936 9.645
118 HA CYS 21 HA CYS 21 -4.355 10.210 11.457
119 HB3 CYS 21 2HB CYS 21 -2.589 10.054 9.874
120 H HIS 22 H HIS 22 -6.857 8.740 10.040
121 HA HIS 22 HA HIS 22 -8.976 9.341 9.469
122 HB3 HIS 22 2HB HIS 22 -9.846 10.760 10.969
123 HD2 HIS 22 2HD HIS 22 -7.657 9.074 12.504
124 HE1 HIS 22 1HE HIS 22 -6.342 12.740 14.186
125 HE2 HIS 22 2HE HIS 22 -6.231 10.227 14.327
126 H LEU 23 H LEU 23 -6.692 9.900 7.657
127 HA LEU 23 HA LEU 23 -7.219 12.318 6.255
128 HB3 LEU 23 2HB LEU 23 -6.000 10.663 4.432
129 HG LEU 23 HG LEU 23 -4.810 12.460 6.512
130 HD11 LEU 23 1HD1 LEU 23 -2.847 11.729 4.595
131 HD12 LEU 23 2HD1 LEU 23 -3.463 10.258 5.347
132 HD13 LEU 23 3HD1 LEU 23 -2.799 11.549 6.348
133 HD21 LEU 23 3HD2 LEU 23 -5.795 13.613 4.699
134 HD22 LEU 23 1HD2 LEU 23 -5.101 12.502 3.519
135 HD23 LEU 23 2HD2 LEU 23 -4.057 13.621 4.396
136 H VAL 24 H VAL 24 -8.928 12.743 5.042
137 HA VAL 24 HA VAL 24 -10.794 10.753 4.241
138 HB VAL 24 HB VAL 24 -10.525 13.681 3.610
139 HG11 VAL 24 1HG1 VAL 24 -12.622 11.774 2.579
140 HG12 VAL 24 2HG1 VAL 24 -12.715 13.533 2.478
141 HG13 VAL 24 3HG1 VAL 24 -11.443 12.665 1.618
142 HG21 VAL 24 3HG2 VAL 24 -12.235 14.003 5.124
143 HG22 VAL 24 1HG2 VAL 24 -12.857 12.364 4.931
144 HG23 VAL 24 2HG2 VAL 24 -11.379 12.644 5.852
145 H LEU 25 H LEU 25 -10.475 9.355 2.647
146 HA LEU 25 HA LEU 25 -9.123 10.297 0.204
147 HB3 LEU 25 2HB LEU 25 -7.631 8.678 0.403
148 HG LEU 25 HG LEU 25 -9.051 8.132 2.957
149 HD11 LEU 25 1HD1 LEU 25 -6.796 6.350 2.547
150 HD12 LEU 25 2HD1 LEU 25 -8.147 5.991 1.471
151 HD13 LEU 25 3HD1 LEU 25 -8.393 6.020 3.217
152 HD21 LEU 25 3HD2 LEU 25 -7.351 9.819 2.937
153 HD22 LEU 25 1HD2 LEU 25 -6.207 8.727 2.156
154 HD23 LEU 25 2HD2 LEU 25 -6.731 8.418 3.812
155 H CYS 26 H CYS 26 -9.649 8.830 -1.713
156 HA CYS 26 HA CYS 26 -12.554 8.399 -1.734
157 HB3 CYS 26 2HB CYS 26 -11.205 8.281 -4.320
158 H SER 27 H SER 27 -9.490 6.891 -2.654
159 HA SER 27 HA SER 27 -10.896 4.303 -2.772
160 HB3 SER 27 2HB SER 27 -10.269 4.811 -5.022
161 HG SER 27 HG SER 27 -8.066 5.334 -5.507
162 HA PRO 28 HA PRO 28 -7.690 4.129 0.552
163 HB3 PRO 28 2HB PRO 28 -9.286 4.488 2.164
164 HG3 PRO 28 2HG PRO 28 -11.525 4.000 1.764
165 HD3 PRO 28 2HD PRO 28 -11.048 5.244 -0.117
166 H LYS 29 H LYS 29 -7.570 1.856 2.047
167 HA LYS 29 HA LYS 29 -7.350 -0.299 0.048
168 HB3 LYS 29 2HB LYS 29 -5.293 -1.015 1.005
169 HG3 LYS 29 2HG LYS 29 -3.809 0.923 0.901
170 HD3 LYS 29 2HD LYS 29 -6.015 0.981 -1.159
171 HE3 LYS 29 2HE LYS 29 -3.208 1.652 -1.821
172 HZ1 LYS 29 3HZ LYS 29 -4.816 1.672 -3.558
173 HZ2 LYS 29 1HZ LYS 29 -4.396 3.279 -3.243
174 HZ3 LYS 29 2HZ LYS 29 -5.864 2.663 -2.675
175 H GLN 30 H GLN 30 -9.663 -0.299 1.255
176 HA GLN 30 HA GLN 30 -10.228 -1.161 3.711
177 HB3 GLN 30 2HB GLN 30 -11.401 -2.929 1.653
178 HG3 GLN 30 2HG GLN 30 -12.596 -0.988 3.617
179 HE21 GLN 30 1HE2 GLN 30 -14.857 -2.156 4.174
180 HE22 GLN 30 2HE2 GLN 30 -15.872 -2.333 2.787
181 H THR 31 H THR 31 -9.063 -2.442 4.990
182 HA THR 31 HA THR 31 -7.433 -4.566 4.104
183 HB THR 31 HB THR 31 -7.042 -5.081 6.403
184 HG1 THR 31 1HG THR 31 -9.527 -3.800 6.783
185 HG21 THR 31 3HG2 THR 31 -7.569 -2.120 6.420
186 HG22 THR 31 1HG2 THR 31 -6.262 -2.833 5.475
187 HG23 THR 31 2HG2 THR 31 -6.280 -3.010 7.229
188 H GLU 32 H GLU 32 -7.934 -6.662 5.845
189 HA GLU 32 HA GLU 32 -10.216 -7.902 4.525
190 HB3 GLU 32 2HB GLU 32 -8.508 -9.401 6.449
191 HG3 GLU 32 2HG GLU 32 -10.063 -10.766 5.367
192 H CYS 33 H CYS 33 -10.159 -5.955 6.958
193 HA CYS 33 HA CYS 33 -11.891 -7.591 8.693
194 HB3 CYS 33 2HB CYS 33 -9.734 -6.701 9.698
195 H GLY 34 H GLY 34 -11.544 -4.642 6.878
196 HA2 GLY 34 1HA GLY 34 -13.837 -3.930 6.027
197 HA3 GLY 34 2HA GLY 34 -14.242 -3.806 7.732
198 H HIS 35 H HIS 35 -11.981 -2.627 8.763
199 HA HIS 35 HA HIS 35 -12.423 0.070 8.351
200 HB3 HIS 35 2HB HIS 35 -10.172 0.401 9.432
201 HD2 HIS 35 2HD HIS 35 -12.256 1.241 11.222
202 HE1 HIS 35 1HE HIS 35 -12.364 -2.468 13.279
203 HE2 HIS 35 2HE HIS 35 -13.157 -0.078 13.257
204 H ARG 36 H ARG 36 -10.431 1.575 7.734
205 HA ARG 36 HA ARG 36 -9.153 0.655 5.276
206 HB3 ARG 36 2HB ARG 36 -9.868 2.848 4.175
207 HG3 ARG 36 2HG ARG 36 -11.628 0.510 4.632
208 HD3 ARG 36 2HD ARG 36 -12.654 2.599 2.808
209 HE ARG 36 HE ARG 36 -14.204 0.913 2.883
210 HH11 ARG 36 1HH1 ARG 36 -13.237 1.731 6.125
211 HH12 ARG 36 2HH1 ARG 36 -14.453 0.750 6.875
212 HH21 ARG 36 1HH2 ARG 36 -15.809 -0.382 3.857
213 HH22 ARG 36 2HH2 ARG 36 -15.915 -0.453 5.583
214 H PHE 37 H PHE 37 -7.382 1.977 4.599
215 HA PHE 37 HA PHE 37 -6.500 4.028 6.490
216 HB3 PHE 37 2HB PHE 37 -4.158 2.958 6.322
217 HD1 PHE 37 1HD PHE 37 -6.704 0.471 7.321
218 HD2 PHE 37 2HD PHE 37 -4.035 3.532 8.594
219 HE1 PHE 37 1HE PHE 37 -7.116 -0.152 9.665
220 HE2 PHE 37 2HE PHE 37 -4.440 2.913 10.941
221 HZ PHE 37 HZ PHE 37 -5.982 1.069 11.479
222 H CYS 38 H CYS 38 -4.393 5.061 5.636
223 HA CYS 38 HA CYS 38 -4.846 5.674 2.814
224 HB3 CYS 38 2HB CYS 38 -4.735 7.515 4.505
225 H GLU 39 H GLU 39 -2.865 6.125 1.478
226 HA GLU 39 HA GLU 39 -1.389 3.890 1.000
227 HB3 GLU 39 2HB GLU 39 0.405 5.708 0.187
228 HG3 GLU 39 2HG GLU 39 -2.160 5.852 -1.292
229 H SER 40 H SER 40 -0.058 6.728 2.710
230 HA SER 40 HA SER 40 2.329 5.658 3.529
231 HB3 SER 40 2HB SER 40 2.034 7.221 5.574
232 HG SER 40 HG SER 40 2.014 9.089 4.050
233 H CYS 41 H CYS 41 -0.088 6.142 6.050
234 HA CYS 41 HA CYS 41 0.717 4.419 7.913
235 HB3 CYS 41 2HB CYS 41 -1.662 4.046 8.550
236 H MET 42 H MET 42 -1.224 3.452 5.099
237 HA MET 42 HA MET 42 -1.539 0.763 5.681
238 HB3 MET 42 2HB MET 42 -1.223 2.166 3.029
239 HG3 MET 42 2HG MET 42 -0.854 -0.472 3.190
240 HE1 MET 42 3HE MET 42 -3.453 0.379 5.246
241 HE2 MET 42 1HE MET 42 -4.206 -1.211 5.362
242 HE3 MET 42 2HE MET 42 -2.453 -1.056 5.483
243 H ALA 43 H ALA 43 1.103 2.331 3.888
244 HA ALA 43 HA ALA 43 2.574 -0.033 3.414
245 HB1 ALA 43 3HB ALA 43 3.149 2.881 3.265
246 HB2 ALA 43 1HB ALA 43 4.505 1.753 3.240
247 HB3 ALA 43 2HB ALA 43 3.243 1.643 2.013
248 H ALA 44 H ALA 44 2.334 2.092 6.151
249 HA ALA 44 HA ALA 44 4.752 1.328 7.437
250 HB1 ALA 44 3HB ALA 44 2.714 3.186 7.900
251 HB2 ALA 44 1HB ALA 44 2.715 2.121 9.306
252 HB3 ALA 44 2HB ALA 44 4.193 2.960 8.835
253 H LEU 45 H LEU 45 1.371 0.504 8.242
254 HA LEU 45 HA LEU 45 1.875 -1.425 10.146
255 HB3 LEU 45 2HB LEU 45 -0.336 -2.273 9.722
256 HG LEU 45 HG LEU 45 -0.294 0.703 9.234
257 HD11 LEU 45 1HD1 LEU 45 -2.380 -0.512 8.464
258 HD12 LEU 45 2HD1 LEU 45 -2.608 0.762 9.661
259 HD13 LEU 45 3HD1 LEU 45 -2.642 -0.930 10.157
260 HD21 LEU 45 3HD2 LEU 45 -1.274 0.276 11.733
261 HD22 LEU 45 1HD2 LEU 45 0.408 0.658 11.364
262 HD23 LEU 45 2HD2 LEU 45 -0.084 -1.019 11.598
263 H LEU 46 H LEU 46 1.305 -1.985 6.671
264 HA LEU 46 HA LEU 46 1.687 -4.719 6.617
265 HB3 LEU 46 2HB LEU 46 2.296 -4.449 4.260
266 HG LEU 46 HG LEU 46 0.079 -2.585 5.099
267 HD11 LEU 46 1HD1 LEU 46 0.512 -3.688 2.340
268 HD12 LEU 46 2HD1 LEU 46 1.119 -2.107 2.830
269 HD13 LEU 46 3HD1 LEU 46 -0.613 -2.434 2.861
270 HD21 LEU 46 3HD2 LEU 46 -1.296 -4.505 4.185
271 HD22 LEU 46 1HD2 LEU 46 -0.458 -4.802 5.708
272 HD23 LEU 46 2HD2 LEU 46 0.191 -5.455 4.203
273 H SER 47 H SER 47 4.051 -2.163 6.836
274 HA SER 47 HA SER 47 6.272 -3.995 6.412
275 HB3 SER 47 2HB SER 47 6.348 -1.062 7.157
276 HG SER 47 HG SER 47 8.336 -2.395 5.711
277 H SER 48 H SER 48 4.361 -4.050 8.779
278 HA SER 48 HA SER 48 6.291 -3.659 10.956
279 HB3 SER 48 2HB SER 48 3.303 -4.141 11.095
280 HG SER 48 HG SER 48 3.749 -3.285 13.287
281 H SER 49 H SER 49 5.791 -5.984 8.909
282 HA SER 49 HA SER 49 6.311 -8.211 8.947
283 HB3 SER 49 2HB SER 49 6.347 -8.572 11.863
284 HG SER 49 HG SER 49 8.160 -8.986 9.725
285 H SER 50 H SER 50 4.317 -7.474 11.815
286 HA SER 50 HA SER 50 2.360 -9.447 10.832
287 HB3 SER 50 2HB SER 50 2.323 -8.816 13.716
288 HG SER 50 HG SER 50 2.142 -11.140 13.745
289 HA PRO 51 HA PRO 51 0.374 -5.242 11.007
290 HB3 PRO 51 2HB PRO 51 0.868 -4.816 8.803
291 HG3 PRO 51 2HG PRO 51 1.293 -6.550 7.313
292 HD3 PRO 51 2HD PRO 51 2.706 -7.150 9.033
293 H LYS 52 H LYS 52 -1.666 -4.924 11.713
294 HA LYS 52 HA LYS 52 -3.610 -7.107 11.342
295 HB3 LYS 52 2HB LYS 52 -4.402 -6.820 13.586
296 HG3 LYS 52 2HG LYS 52 -1.642 -7.459 13.120
297 HD3 LYS 52 2HD LYS 52 -2.042 -6.845 15.983
298 HE3 LYS 52 2HE LYS 52 0.400 -6.126 14.474
299 HZ1 LYS 52 3HZ LYS 52 1.125 -7.701 16.494
300 HZ2 LYS 52 1HZ LYS 52 -0.333 -7.098 17.106
301 HZ3 LYS 52 2HZ LYS 52 0.898 -6.031 16.649
302 H CYS 53 H CYS 53 -3.743 -3.863 12.805
303 HA CYS 53 HA CYS 53 -4.850 -2.318 10.929
304 HB3 CYS 53 2HB CYS 53 -6.875 -4.315 11.870
305 H THR 54 H THR 54 -4.002 -0.779 12.302
306 HA THR 54 HA THR 54 -4.149 -0.325 14.915
307 HB THR 54 HB THR 54 -3.885 1.371 12.653
308 HG1 THR 54 1HG THR 54 -2.280 1.479 14.092
309 HG21 THR 54 3HG2 THR 54 -4.862 3.460 13.579
310 HG22 THR 54 1HG2 THR 54 -5.690 2.492 14.799
311 HG23 THR 54 2HG2 THR 54 -6.079 2.279 13.092
312 H ALA 55 H ALA 55 -6.878 -0.047 12.724
313 HA ALA 55 HA ALA 55 -8.715 1.249 14.351
314 HB1 ALA 55 3HB ALA 55 -10.201 0.778 12.735
315 HB2 ALA 55 1HB ALA 55 -8.792 0.170 11.864
316 HB3 ALA 55 2HB ALA 55 -9.829 -0.946 12.755
317 H CYS 56 H CYS 56 -8.902 -2.253 13.758
318 HA CYS 56 HA CYS 56 -9.668 -2.593 16.584
319 HB3 CYS 56 2HB CYS 56 -11.526 -3.083 15.098
320 H GLN 57 H GLN 57 -7.514 -3.528 14.074
321 HA GLN 57 HA GLN 57 -5.520 -4.659 14.240
322 HB3 GLN 57 2HB GLN 57 -5.987 -6.009 16.790
323 HG3 GLN 57 2HG GLN 57 -3.859 -4.419 15.502
324 HE21 GLN 57 1HE2 GLN 57 -4.163 -2.466 16.768
325 HE22 GLN 57 2HE2 GLN 57 -3.488 -2.380 18.357
326 H GLU 58 H GLU 58 -6.290 -5.979 12.563
327 HA GLU 58 HA GLU 58 -7.104 -8.665 13.445
328 HB3 GLU 58 2HB GLU 58 -8.161 -8.456 10.914
329 HG3 GLU 58 2HG GLU 58 -9.926 -7.588 13.122
330 H SER 59 H SER 59 -6.599 -7.549 10.151
331 HA SER 59 HA SER 59 -3.911 -8.515 9.965
332 HB3 SER 59 2HB SER 59 -5.554 -10.090 8.114
333 HG SER 59 HG SER 59 -3.841 -11.284 8.295
334 H ILE 60 H ILE 60 -2.937 -7.347 8.451
335 HA ILE 60 HA ILE 60 -4.584 -6.209 6.288
336 HB ILE 60 HB ILE 60 -2.018 -4.916 7.071
337 HG13 ILE 60 2HG1 ILE 60 -3.311 -5.375 9.192
338 HG21 ILE 60 1HG2 ILE 60 -2.802 -3.188 5.874
339 HG22 ILE 60 2HG2 ILE 60 -3.933 -4.370 5.219
340 HG23 ILE 60 3HG2 ILE 60 -4.424 -3.327 6.553
341 HD11 ILE 60 3HD1 ILE 60 -3.598 -2.534 9.225
342 HD12 ILE 60 1HD1 ILE 60 -2.401 -3.547 10.030
343 HD13 ILE 60 2HD1 ILE 60 -2.110 -2.975 8.388
344 H VAL 61 H VAL 61 -4.125 -6.981 4.346
345 HA VAL 61 HA VAL 61 -1.344 -7.538 3.633
346 HB VAL 61 HB VAL 61 -3.597 -9.526 3.391
347 HG11 VAL 61 1HG1 VAL 61 -1.200 -9.161 1.722
348 HG12 VAL 61 2HG1 VAL 61 -1.483 -10.805 2.299
349 HG13 VAL 61 3HG1 VAL 61 -2.724 -9.972 1.362
350 HG21 VAL 61 3HG2 VAL 61 -1.203 -10.699 4.281
351 HG22 VAL 61 1HG2 VAL 61 -1.379 -9.188 5.174
352 HG23 VAL 61 2HG2 VAL 61 -2.668 -10.392 5.214
353 H LYS 62 H LYS 62 -0.976 -6.303 1.920
354 HA LYS 62 HA LYS 62 -2.595 -4.880 0.352
355 HB3 LYS 62 2HB LYS 62 -0.297 -4.669 -0.078
356 HG3 LYS 62 2HG LYS 62 -0.214 -7.563 -0.909
357 HD3 LYS 62 2HD LYS 62 2.237 -7.162 -0.987
358 HE3 LYS 62 2HE LYS 62 1.392 -5.161 -2.914
359 HZ1 LYS 62 3HZ LYS 62 3.238 -6.987 -2.933
360 HZ2 LYS 62 1HZ LYS 62 2.477 -6.520 -4.370
361 HZ3 LYS 62 2HZ LYS 62 2.010 -7.946 -3.592
362 H ASP 63 H ASP 63 -1.838 -8.299 -0.248
363 HA ASP 63 HA ASP 63 -3.297 -8.652 -2.585
364 HB3 ASP 63 2HB ASP 63 -3.471 -10.936 -0.767
365 H LYS 64 H LYS 64 -4.360 -8.941 0.785
366 HA LYS 64 HA LYS 64 -7.107 -9.401 -0.070
367 HB3 LYS 64 2HB LYS 64 -7.568 -10.058 2.110
368 HG3 LYS 64 2HG LYS 64 -5.724 -11.391 2.987
369 HD3 LYS 64 2HD LYS 64 -5.354 -11.699 0.063
370 HE3 LYS 64 2HE LYS 64 -6.245 -13.535 2.286
371 HZ1 LYS 64 3HZ LYS 64 -6.864 -14.908 0.680
372 HZ2 LYS 64 1HZ LYS 64 -5.260 -14.968 0.147
373 HZ3 LYS 64 2HZ LYS 64 -6.333 -13.851 -0.530
374 H VAL 65 H VAL 65 -5.606 -6.801 -0.410
375 HA VAL 65 HA VAL 65 -7.339 -5.038 1.180
376 HB VAL 65 HB VAL 65 -4.591 -4.831 0.263
377 HG11 VAL 65 1HG1 VAL 65 -5.508 -3.424 -1.480
378 HG12 VAL 65 2HG1 VAL 65 -6.425 -2.500 -0.288
379 HG13 VAL 65 3HG1 VAL 65 -4.663 -2.431 -0.293
380 HG21 VAL 65 3HG2 VAL 65 -6.355 -3.694 2.361
381 HG22 VAL 65 1HG2 VAL 65 -4.787 -4.488 2.505
382 HG23 VAL 65 2HG2 VAL 65 -4.880 -2.811 1.965
383 H PHE 66 H PHE 66 -8.779 -3.686 0.237
384 HA PHE 66 HA PHE 66 -8.742 -2.788 -2.406
385 HB3 PHE 66 2HB PHE 66 -9.199 -4.848 -3.344
386 HD1 PHE 66 2HD PHE 66 -10.947 -4.647 -0.103
387 HD2 PHE 66 1HD PHE 66 -9.681 -7.158 -3.297
388 HE1 PHE 66 2HE PHE 66 -11.511 -6.631 1.238
389 HE2 PHE 66 1HE PHE 66 -10.245 -9.146 -1.961
390 HZ PHE 66 HZ PHE 66 -11.160 -8.884 0.310
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -49.679 16.221 17.303
2 HA2 GLY 1 1HA GLY 1 -50.597 14.531 15.101
3 HA3 GLY 1 2HA GLY 1 -49.924 16.099 14.679
4 H SER 2 H SER 2 -47.896 15.962 14.021
5 HA SER 2 HA SER 2 -46.180 13.870 15.183
6 HB3 SER 2 2HB SER 2 -45.471 15.294 12.646
7 HG SER 2 HG SER 2 -44.841 12.991 12.244
8 H SER 3 H SER 3 -43.937 14.388 15.551
9 HA SER 3 HA SER 3 -43.529 16.679 17.055
10 HB3 SER 3 2HB SER 3 -41.078 15.688 15.796
11 HG SER 3 HG SER 3 -41.152 15.011 18.287
12 H GLY 4 H GLY 4 -42.221 18.556 16.688
13 HA2 GLY 4 1HA GLY 4 -42.811 19.876 14.256
14 HA3 GLY 4 2HA GLY 4 -41.729 20.465 15.509
15 H SER 5 H SER 5 -39.635 18.928 15.579
16 HA SER 5 HA SER 5 -37.930 19.619 13.649
17 HB3 SER 5 2HB SER 5 -36.852 17.241 14.027
18 HG SER 5 HG SER 5 -36.968 18.399 16.474
19 H SER 6 H SER 6 -37.570 19.270 11.548
20 HA SER 6 HA SER 6 -38.287 16.869 10.194
21 HB3 SER 6 2HB SER 6 -39.842 19.251 9.224
22 HG SER 6 HG SER 6 -40.923 17.738 8.121
23 H GLY 7 H GLY 7 -35.916 17.458 10.012
24 HA2 GLY 7 1HA GLY 7 -35.007 19.600 8.453
25 HA3 GLY 7 2HA GLY 7 -34.150 18.084 8.688
26 H PHE 8 H PHE 8 -34.578 19.877 6.303
27 HA PHE 8 HA PHE 8 -36.267 18.699 4.429
28 HB3 PHE 8 2HB PHE 8 -35.049 19.888 2.763
29 HD1 PHE 8 1HD PHE 8 -36.967 20.641 5.034
30 HD2 PHE 8 2HD PHE 8 -33.265 22.274 3.711
31 HE1 PHE 8 1HE PHE 8 -37.624 22.839 5.921
32 HE2 PHE 8 2HE PHE 8 -33.916 24.475 4.598
33 HZ PHE 8 HZ PHE 8 -36.097 24.759 5.704
34 H VAL 9 H VAL 9 -35.995 17.127 2.860
35 HA VAL 9 HA VAL 9 -34.329 14.929 3.565
36 HB VAL 9 HB VAL 9 -36.465 14.502 2.527
37 HG11 VAL 9 1HG1 VAL 9 -35.987 15.180 -0.190
38 HG12 VAL 9 2HG1 VAL 9 -37.248 15.779 0.890
39 HG13 VAL 9 3HG1 VAL 9 -35.696 16.613 0.794
40 HG21 VAL 9 3HG2 VAL 9 -34.192 13.200 1.926
41 HG22 VAL 9 1HG2 VAL 9 -35.778 12.709 1.333
42 HG23 VAL 9 2HG2 VAL 9 -34.710 13.664 0.306
43 H LYS 10 H LYS 10 -32.180 15.501 3.452
44 HA LYS 10 HA LYS 10 -31.105 15.754 0.742
45 HB3 LYS 10 2HB LYS 10 -29.410 17.415 1.689
46 HG3 LYS 10 2HG LYS 10 -32.221 18.476 1.674
47 HD3 LYS 10 2HD LYS 10 -29.621 19.674 0.720
48 HE3 LYS 10 2HE LYS 10 -32.357 20.358 0.284
49 HZ1 LYS 10 3HZ LYS 10 -31.599 21.634 2.500
50 HZ2 LYS 10 1HZ LYS 10 -32.684 22.278 1.372
51 HZ3 LYS 10 2HZ LYS 10 -31.054 22.727 1.329
52 H THR 11 H THR 11 -29.316 14.560 0.392
53 HA THR 11 HA THR 11 -28.262 13.044 2.673
54 HB THR 11 HB THR 11 -27.431 12.294 -0.066
55 HG1 THR 11 1HG THR 11 -29.543 12.633 -0.585
56 HG21 THR 11 3HG2 THR 11 -28.634 10.203 1.456
57 HG22 THR 11 1HG2 THR 11 -27.569 11.129 2.513
58 HG23 THR 11 2HG2 THR 11 -26.938 10.418 1.027
59 H VAL 12 H VAL 12 -25.931 12.549 2.672
60 HA VAL 12 HA VAL 12 -24.346 14.781 1.577
61 HB VAL 12 HB VAL 12 -24.043 13.380 4.233
62 HG11 VAL 12 1HG1 VAL 12 -21.846 13.707 3.977
63 HG12 VAL 12 2HG1 VAL 12 -22.074 14.763 2.581
64 HG13 VAL 12 3HG1 VAL 12 -22.209 15.416 4.214
65 HG21 VAL 12 3HG2 VAL 12 -25.547 15.030 4.682
66 HG22 VAL 12 1HG2 VAL 12 -24.064 15.972 4.833
67 HG23 VAL 12 2HG2 VAL 12 -25.005 16.041 3.343
68 H GLU 13 H GLU 13 -23.448 13.827 -0.183
69 HA GLU 13 HA GLU 13 -22.284 11.170 0.029
70 HB3 GLU 13 2HB GLU 13 -21.958 11.292 -2.348
71 HG3 GLU 13 2HG GLU 13 -24.469 12.755 -2.452
72 H ASP 14 H ASP 14 -20.392 11.132 1.083
73 HA ASP 14 HA ASP 14 -18.329 13.073 0.264
74 HB3 ASP 14 2HB ASP 14 -19.124 13.259 2.650
75 H LYS 15 H LYS 15 -16.178 11.804 1.542
76 HA LYS 15 HA LYS 15 -15.949 9.334 -0.049
77 HB3 LYS 15 2HB LYS 15 -13.896 9.951 -0.785
78 HG3 LYS 15 2HG LYS 15 -15.376 11.969 -1.189
79 HD3 LYS 15 2HD LYS 15 -14.424 12.607 1.430
80 HE3 LYS 15 2HE LYS 15 -12.579 13.721 0.175
81 HZ1 LYS 15 3HZ LYS 15 -12.983 15.018 -1.559
82 HZ2 LYS 15 1HZ LYS 15 -14.131 15.926 -0.711
83 HZ3 LYS 15 2HZ LYS 15 -14.597 14.515 -1.519
84 H TYR 16 H TYR 16 -13.822 8.117 0.861
85 HA TYR 16 HA TYR 16 -14.583 7.309 3.528
86 HB3 TYR 16 2HB TYR 16 -12.920 5.531 3.235
87 HD1 TYR 16 2HD TYR 16 -15.814 6.734 1.894
88 HD2 TYR 16 1HD TYR 16 -12.875 3.764 1.096
89 HE1 TYR 16 2HE TYR 16 -17.467 5.455 0.601
90 HE2 TYR 16 1HE TYR 16 -14.520 2.475 -0.200
91 HH TYR 16 HH TYR 16 -17.015 2.256 -0.307
92 H LYS 17 H LYS 17 -12.552 6.694 4.972
93 HA LYS 17 HA LYS 17 -10.537 8.794 4.955
94 HB3 LYS 17 2HB LYS 17 -12.688 8.517 7.010
95 HG3 LYS 17 2HG LYS 17 -10.826 10.188 8.184
96 HD3 LYS 17 2HD LYS 17 -10.556 7.955 9.654
97 HE3 LYS 17 2HE LYS 17 -12.182 10.236 9.683
98 HZ1 LYS 17 3HZ LYS 17 -14.213 9.356 9.341
99 HZ2 LYS 17 1HZ LYS 17 -14.077 8.908 10.966
100 HZ3 LYS 17 2HZ LYS 17 -13.744 7.783 9.749
101 H CYS 18 H CYS 18 -8.631 8.197 5.898
102 HA CYS 18 HA CYS 18 -8.071 5.471 6.203
103 HB3 CYS 18 2HB CYS 18 -6.560 7.936 7.071
104 H GLU 19 H GLU 19 -7.841 4.140 7.958
105 HA GLU 19 HA GLU 19 -9.275 4.934 10.344
106 HB3 GLU 19 2HB GLU 19 -8.535 2.466 10.961
107 HG3 GLU 19 2HG GLU 19 -10.504 1.599 10.072
108 H LYS 20 H LYS 20 -6.630 6.115 9.711
109 HA LYS 20 HA LYS 20 -5.359 5.526 12.287
110 HB3 LYS 20 2HB LYS 20 -3.306 6.164 10.419
111 HG3 LYS 20 2HG LYS 20 -3.990 3.708 11.996
112 HD3 LYS 20 2HD LYS 20 -1.523 4.148 10.314
113 HE3 LYS 20 2HE LYS 20 -0.638 2.264 11.220
114 HZ1 LYS 20 3HZ LYS 20 -0.975 3.688 13.120
115 HZ2 LYS 20 1HZ LYS 20 -1.165 2.072 13.585
116 HZ3 LYS 20 2HZ LYS 20 -2.524 3.058 13.372
117 H CYS 21 H CYS 21 -4.678 7.618 9.480
118 HA CYS 21 HA CYS 21 -4.322 9.875 11.289
119 HB3 CYS 21 2HB CYS 21 -2.590 9.627 9.653
120 H HIS 22 H HIS 22 -6.901 8.507 9.940
121 HA HIS 22 HA HIS 22 -9.008 9.182 9.412
122 HB3 HIS 22 2HB HIS 22 -9.840 10.743 10.812
123 HD2 HIS 22 2HD HIS 22 -7.881 8.683 12.313
124 HE1 HIS 22 1HE HIS 22 -6.432 12.080 14.402
125 HE2 HIS 22 2HE HIS 22 -6.512 9.564 14.324
126 H LEU 23 H LEU 23 -6.646 9.756 7.608
127 HA LEU 23 HA LEU 23 -7.129 12.140 6.185
128 HB3 LEU 23 2HB LEU 23 -6.023 10.548 4.308
129 HG LEU 23 HG LEU 23 -3.745 10.975 5.635
130 HD11 LEU 23 1HD1 LEU 23 -3.723 13.228 4.589
131 HD12 LEU 23 2HD1 LEU 23 -5.436 13.028 4.220
132 HD13 LEU 23 3HD1 LEU 23 -4.248 11.941 3.501
133 HD21 LEU 23 3HD2 LEU 23 -5.456 13.191 6.703
134 HD22 LEU 23 1HD2 LEU 23 -3.824 12.714 7.176
135 HD23 LEU 23 2HD2 LEU 23 -5.202 11.711 7.631
136 H VAL 24 H VAL 24 -8.955 12.630 5.171
137 HA VAL 24 HA VAL 24 -10.899 10.746 4.369
138 HB VAL 24 HB VAL 24 -10.521 13.666 3.753
139 HG11 VAL 24 1HG1 VAL 24 -12.932 13.457 2.860
140 HG12 VAL 24 2HG1 VAL 24 -11.598 12.995 1.802
141 HG13 VAL 24 3HG1 VAL 24 -12.537 11.753 2.631
142 HG21 VAL 24 3HG2 VAL 24 -11.269 13.402 5.946
143 HG22 VAL 24 1HG2 VAL 24 -12.753 13.687 5.037
144 HG23 VAL 24 2HG2 VAL 24 -12.320 12.050 5.527
145 H LEU 25 H LEU 25 -10.504 9.285 2.828
146 HA LEU 25 HA LEU 25 -9.276 10.217 0.316
147 HB3 LEU 25 2HB LEU 25 -7.896 8.480 0.342
148 HG LEU 25 HG LEU 25 -8.991 8.170 3.101
149 HD11 LEU 25 1HD1 LEU 25 -7.982 5.994 1.567
150 HD12 LEU 25 2HD1 LEU 25 -8.458 6.027 3.264
151 HD13 LEU 25 3HD1 LEU 25 -6.799 6.413 2.807
152 HD21 LEU 25 3HD2 LEU 25 -6.326 8.826 1.871
153 HD22 LEU 25 1HD2 LEU 25 -6.533 8.492 3.591
154 HD23 LEU 25 2HD2 LEU 25 -7.362 9.863 2.854
155 H CYS 26 H CYS 26 -9.913 8.774 -1.589
156 HA CYS 26 HA CYS 26 -12.828 8.416 -1.504
157 HB3 CYS 26 2HB CYS 26 -12.923 8.999 -3.753
158 H SER 27 H SER 27 -9.811 6.810 -2.164
159 HA SER 27 HA SER 27 -11.218 4.259 -2.286
160 HB3 SER 27 2HB SER 27 -10.911 5.021 -4.649
161 HG SER 27 HG SER 27 -8.295 4.461 -4.832
162 HA PRO 28 HA PRO 28 -7.494 4.116 0.416
163 HB3 PRO 28 2HB PRO 28 -8.826 4.325 2.276
164 HG3 PRO 28 2HG PRO 28 -11.069 3.719 2.219
165 HD3 PRO 28 2HD PRO 28 -10.972 5.050 0.341
166 H LYS 29 H LYS 29 -7.015 1.804 1.776
167 HA LYS 29 HA LYS 29 -6.856 -0.199 -0.378
168 HB3 LYS 29 2HB LYS 29 -4.710 -0.677 0.200
169 HG3 LYS 29 2HG LYS 29 -3.422 1.212 0.990
170 HD3 LYS 29 2HD LYS 29 -5.512 2.672 -0.488
171 HE3 LYS 29 2HE LYS 29 -2.672 1.979 -1.225
172 HZ1 LYS 29 3HZ LYS 29 -4.066 2.887 -3.004
173 HZ2 LYS 29 1HZ LYS 29 -2.824 3.953 -2.573
174 HZ3 LYS 29 2HZ LYS 29 -4.407 4.243 -2.052
175 H GLN 30 H GLN 30 -9.122 -0.603 0.617
176 HA GLN 30 HA GLN 30 -9.794 -1.595 2.995
177 HB3 GLN 30 2HB GLN 30 -10.624 -3.522 0.983
178 HG3 GLN 30 2HG GLN 30 -11.987 -1.460 2.668
179 HE21 GLN 30 1HE2 GLN 30 -14.350 -3.140 2.650
180 HE22 GLN 30 2HE2 GLN 30 -15.187 -2.790 1.180
181 H THR 31 H THR 31 -8.882 -2.934 4.390
182 HA THR 31 HA THR 31 -6.856 -4.804 3.583
183 HB THR 31 HB THR 31 -6.466 -5.208 5.873
184 HG1 THR 31 1HG THR 31 -8.466 -3.930 7.111
185 HG21 THR 31 3HG2 THR 31 -7.513 -2.394 5.966
186 HG22 THR 31 1HG2 THR 31 -6.098 -2.818 5.003
187 HG23 THR 31 2HG2 THR 31 -6.083 -3.067 6.749
188 H GLU 32 H GLU 32 -7.506 -6.779 5.642
189 HA GLU 32 HA GLU 32 -9.512 -8.290 4.119
190 HB3 GLU 32 2HB GLU 32 -8.060 -9.842 6.084
191 HG3 GLU 32 2HG GLU 32 -7.211 -10.864 3.802
192 H CYS 33 H CYS 33 -9.724 -6.290 6.498
193 HA CYS 33 HA CYS 33 -11.505 -7.994 8.113
194 HB3 CYS 33 2HB CYS 33 -9.396 -7.218 9.289
195 H GLY 34 H GLY 34 -11.138 -5.203 6.195
196 HA2 GLY 34 1HA GLY 34 -13.313 -4.331 5.358
197 HA3 GLY 34 2HA GLY 34 -13.808 -4.257 7.042
198 H HIS 35 H HIS 35 -11.914 -3.034 8.374
199 HA HIS 35 HA HIS 35 -12.196 -0.376 8.020
200 HB3 HIS 35 2HB HIS 35 -9.965 -0.098 9.163
201 HD2 HIS 35 2HD HIS 35 -12.030 0.679 10.977
202 HE1 HIS 35 1HE HIS 35 -12.298 -3.146 12.792
203 HE2 HIS 35 2HE HIS 35 -13.015 -0.734 12.907
204 H ARG 36 H ARG 36 -10.713 1.317 7.251
205 HA ARG 36 HA ARG 36 -9.243 0.489 4.836
206 HB3 ARG 36 2HB ARG 36 -9.946 2.685 3.841
207 HG3 ARG 36 2HG ARG 36 -11.841 0.488 4.420
208 HD3 ARG 36 2HD ARG 36 -12.765 2.901 2.897
209 HE ARG 36 HE ARG 36 -14.333 1.274 2.477
210 HH11 ARG 36 1HH1 ARG 36 -13.598 1.345 5.879
211 HH12 ARG 36 2HH1 ARG 36 -14.897 0.286 6.314
212 HH21 ARG 36 1HH2 ARG 36 -16.048 -0.121 3.037
213 HH22 ARG 36 2HH2 ARG 36 -16.291 -0.548 4.698
214 H PHE 37 H PHE 37 -7.463 1.832 4.224
215 HA PHE 37 HA PHE 37 -6.522 3.759 6.203
216 HB3 PHE 37 2HB PHE 37 -4.247 2.662 6.178
217 HD1 PHE 37 2HD PHE 37 -6.508 -0.177 6.599
218 HD2 PHE 37 1HD PHE 37 -4.662 3.151 8.505
219 HE1 PHE 37 2HE PHE 37 -7.127 -1.096 8.796
220 HE2 PHE 37 1HE PHE 37 -5.278 2.237 10.705
221 HZ PHE 37 HZ PHE 37 -6.512 0.110 10.852
222 H CYS 38 H CYS 38 -4.572 4.940 5.431
223 HA CYS 38 HA CYS 38 -4.893 5.562 2.611
224 HB3 CYS 38 2HB CYS 38 -4.747 7.327 4.414
225 H GLU 39 H GLU 39 -2.657 6.267 1.558
226 HA GLU 39 HA GLU 39 -1.275 3.927 0.955
227 HB3 GLU 39 2HB GLU 39 0.536 5.719 0.190
228 HG3 GLU 39 2HG GLU 39 -2.170 5.681 -1.121
229 H SER 40 H SER 40 0.012 6.721 2.766
230 HA SER 40 HA SER 40 2.381 5.629 3.613
231 HB3 SER 40 2HB SER 40 1.653 7.118 5.803
232 HG SER 40 HG SER 40 2.844 8.688 4.834
233 H CYS 41 H CYS 41 -0.185 6.022 6.018
234 HA CYS 41 HA CYS 41 0.560 4.319 7.919
235 HB3 CYS 41 2HB CYS 41 -1.840 3.818 8.372
236 H MET 42 H MET 42 -1.196 3.269 5.009
237 HA MET 42 HA MET 42 -1.377 0.565 5.551
238 HB3 MET 42 2HB MET 42 -1.020 2.018 2.932
239 HG3 MET 42 2HG MET 42 -0.462 -0.584 3.070
240 HE1 MET 42 3HE MET 42 -2.202 -1.240 5.309
241 HE2 MET 42 1HE MET 42 -3.262 0.122 4.946
242 HE3 MET 42 2HE MET 42 -3.926 -1.508 5.051
243 H ALA 43 H ALA 43 1.174 2.142 3.614
244 HA ALA 43 HA ALA 43 2.808 -0.113 3.352
245 HB1 ALA 43 3HB ALA 43 4.496 2.134 3.386
246 HB2 ALA 43 1HB ALA 43 3.815 1.312 1.982
247 HB3 ALA 43 2HB ALA 43 2.959 2.673 2.710
248 H ALA 44 H ALA 44 2.229 1.903 6.055
249 HA ALA 44 HA ALA 44 4.722 1.362 7.396
250 HB1 ALA 44 3HB ALA 44 2.432 2.280 9.000
251 HB2 ALA 44 1HB ALA 44 4.077 2.908 8.899
252 HB3 ALA 44 2HB ALA 44 2.894 3.330 7.661
253 H LEU 45 H LEU 45 1.326 0.486 8.064
254 HA LEU 45 HA LEU 45 1.756 -1.282 10.137
255 HB3 LEU 45 2HB LEU 45 -0.366 -2.377 9.407
256 HG LEU 45 HG LEU 45 -0.497 0.638 9.371
257 HD11 LEU 45 1HD1 LEU 45 -2.748 -1.147 10.170
258 HD12 LEU 45 2HD1 LEU 45 -2.472 -0.806 8.462
259 HD13 LEU 45 3HD1 LEU 45 -2.782 0.516 9.587
260 HD21 LEU 45 3HD2 LEU 45 -1.467 -0.306 11.776
261 HD22 LEU 45 1HD2 LEU 45 0.111 0.433 11.504
262 HD23 LEU 45 2HD2 LEU 45 -0.058 -1.322 11.469
263 H LEU 46 H LEU 46 1.451 -2.117 6.682
264 HA LEU 46 HA LEU 46 1.917 -4.822 6.830
265 HB3 LEU 46 2HB LEU 46 2.662 -4.716 4.536
266 HG LEU 46 HG LEU 46 0.546 -2.619 5.010
267 HD11 LEU 46 1HD1 LEU 46 0.114 -2.539 2.753
268 HD12 LEU 46 2HD1 LEU 46 0.902 -4.083 2.435
269 HD13 LEU 46 3HD1 LEU 46 1.875 -2.649 2.763
270 HD21 LEU 46 3HD2 LEU 46 0.308 -5.513 4.194
271 HD22 LEU 46 1HD2 LEU 46 -1.014 -4.383 4.484
272 HD23 LEU 46 2HD2 LEU 46 0.018 -4.893 5.821
273 H SER 47 H SER 47 4.247 -2.191 6.937
274 HA SER 47 HA SER 47 6.511 -3.995 6.904
275 HB3 SER 47 2HB SER 47 7.076 -1.261 7.749
276 HG SER 47 HG SER 47 7.817 -2.947 5.604
277 H SER 48 H SER 48 4.538 -4.262 9.043
278 HA SER 48 HA SER 48 6.211 -3.588 11.372
279 HB3 SER 48 2HB SER 48 3.236 -4.150 11.303
280 HG SER 48 HG SER 48 3.789 -2.905 13.463
281 H SER 49 H SER 49 5.856 -6.030 9.396
282 HA SER 49 HA SER 49 6.412 -8.242 9.576
283 HB3 SER 49 2HB SER 49 7.327 -9.107 11.548
284 HG SER 49 HG SER 49 7.829 -6.627 12.506
285 H SER 50 H SER 50 4.243 -7.358 12.267
286 HA SER 50 HA SER 50 2.394 -9.453 11.330
287 HB3 SER 50 2HB SER 50 2.647 -10.341 13.381
288 HG SER 50 HG SER 50 3.454 -8.327 14.951
289 HA PRO 51 HA PRO 51 0.347 -5.262 11.060
290 HB3 PRO 51 2HB PRO 51 1.088 -4.902 8.915
291 HG3 PRO 51 2HG PRO 51 1.726 -6.675 7.553
292 HD3 PRO 51 2HD PRO 51 2.937 -7.176 9.448
293 H LYS 52 H LYS 52 -1.593 -5.264 11.989
294 HA LYS 52 HA LYS 52 -3.514 -7.373 11.250
295 HB3 LYS 52 2HB LYS 52 -4.344 -7.394 13.422
296 HG3 LYS 52 2HG LYS 52 -1.405 -6.857 13.531
297 HD3 LYS 52 2HD LYS 52 -3.032 -7.703 15.917
298 HE3 LYS 52 2HE LYS 52 -0.172 -7.018 15.378
299 HZ1 LYS 52 3HZ LYS 52 0.172 -6.821 17.771
300 HZ2 LYS 52 1HZ LYS 52 -1.500 -6.853 18.029
301 HZ3 LYS 52 2HZ LYS 52 -0.799 -5.564 17.188
302 H CYS 53 H CYS 53 -3.767 -4.167 12.784
303 HA CYS 53 HA CYS 53 -4.813 -2.613 10.872
304 HB3 CYS 53 2HB CYS 53 -6.848 -4.629 11.739
305 H THR 54 H THR 54 -4.160 -0.963 12.158
306 HA THR 54 HA THR 54 -4.251 -0.488 14.770
307 HB THR 54 HB THR 54 -4.180 1.184 12.495
308 HG1 THR 54 1HG THR 54 -3.768 1.909 15.219
309 HG21 THR 54 3HG2 THR 54 -6.082 2.188 14.614
310 HG22 THR 54 1HG2 THR 54 -6.465 1.865 12.925
311 HG23 THR 54 2HG2 THR 54 -5.371 3.183 13.343
312 H ALA 55 H ALA 55 -7.074 -0.116 12.650
313 HA ALA 55 HA ALA 55 -8.916 0.884 14.435
314 HB1 ALA 55 3HB ALA 55 -10.264 0.639 12.690
315 HB2 ALA 55 1HB ALA 55 -8.983 -0.249 11.866
316 HB3 ALA 55 2HB ALA 55 -10.184 -1.117 12.823
317 H CYS 56 H CYS 56 -9.152 -2.530 13.522
318 HA CYS 56 HA CYS 56 -9.783 -3.150 16.329
319 HB3 CYS 56 2HB CYS 56 -11.582 -3.601 14.695
320 H GLN 57 H GLN 57 -7.773 -4.017 13.603
321 HA GLN 57 HA GLN 57 -5.701 -5.029 13.641
322 HB3 GLN 57 2HB GLN 57 -4.670 -5.707 15.620
323 HG3 GLN 57 2HG GLN 57 -6.223 -4.154 17.383
324 HE21 GLN 57 1HE2 GLN 57 -4.422 -2.486 14.957
325 HE22 GLN 57 2HE2 GLN 57 -2.962 -2.304 15.863
326 H GLU 58 H GLU 58 -6.304 -6.484 12.081
327 HA GLU 58 HA GLU 58 -7.064 -9.147 13.066
328 HB3 GLU 58 2HB GLU 58 -8.417 -7.482 11.013
329 HG3 GLU 58 2HG GLU 58 -7.547 -9.358 9.672
330 H SER 59 H SER 59 -6.146 -7.524 10.022
331 HA SER 59 HA SER 59 -3.636 -8.690 9.756
332 HB3 SER 59 2HB SER 59 -5.001 -10.172 7.714
333 HG SER 59 HG SER 59 -3.998 -11.922 9.026
334 H ILE 60 H ILE 60 -2.582 -7.560 8.252
335 HA ILE 60 HA ILE 60 -4.144 -6.330 6.078
336 HB ILE 60 HB ILE 60 -1.731 -4.907 7.062
337 HG13 ILE 60 2HG1 ILE 60 -3.039 -5.572 9.115
338 HG21 ILE 60 1HG2 ILE 60 -4.105 -3.339 6.624
339 HG22 ILE 60 2HG2 ILE 60 -2.559 -3.292 5.780
340 HG23 ILE 60 3HG2 ILE 60 -3.811 -4.421 5.264
341 HD11 ILE 60 3HD1 ILE 60 -2.318 -3.721 10.078
342 HD12 ILE 60 1HD1 ILE 60 -2.008 -3.052 8.477
343 HD13 ILE 60 2HD1 ILE 60 -3.558 -2.764 9.268
344 H VAL 61 H VAL 61 -3.544 -7.387 4.295
345 HA VAL 61 HA VAL 61 -0.661 -7.641 3.752
346 HB VAL 61 HB VAL 61 -2.803 -9.713 3.346
347 HG11 VAL 61 1HG1 VAL 61 -0.364 -9.223 1.745
348 HG12 VAL 61 2HG1 VAL 61 -0.693 -10.894 2.209
349 HG13 VAL 61 3HG1 VAL 61 -1.890 -9.981 1.289
350 HG21 VAL 61 3HG2 VAL 61 -1.856 -10.484 5.215
351 HG22 VAL 61 1HG2 VAL 61 -0.461 -10.897 4.217
352 HG23 VAL 61 2HG2 VAL 61 -0.502 -9.361 5.083
353 H LYS 62 H LYS 62 -0.039 -6.779 1.881
354 HA LYS 62 HA LYS 62 -1.535 -5.179 0.276
355 HB3 LYS 62 2HB LYS 62 0.786 -5.088 -0.043
356 HG3 LYS 62 2HG LYS 62 0.782 -7.991 -0.849
357 HD3 LYS 62 2HD LYS 62 2.686 -5.816 -1.173
358 HE3 LYS 62 2HE LYS 62 3.337 -7.315 0.979
359 HZ1 LYS 62 3HZ LYS 62 5.287 -8.648 -0.291
360 HZ2 LYS 62 1HZ LYS 62 3.994 -8.888 -1.354
361 HZ3 LYS 62 2HZ LYS 62 3.856 -9.357 0.264
362 H ASP 63 H ASP 63 -0.998 -8.653 -0.174
363 HA ASP 63 HA ASP 63 -2.309 -8.977 -2.607
364 HB3 ASP 63 2HB ASP 63 -2.872 -11.261 -1.022
365 H LYS 64 H LYS 64 -3.638 -9.344 0.678
366 HA LYS 64 HA LYS 64 -6.313 -9.715 -0.243
367 HB3 LYS 64 2HB LYS 64 -6.933 -9.802 2.030
368 HG3 LYS 64 2HG LYS 64 -5.305 -11.163 3.165
369 HD3 LYS 64 2HD LYS 64 -5.027 -11.752 0.226
370 HE3 LYS 64 2HE LYS 64 -3.803 -13.259 1.652
371 HZ1 LYS 64 3HZ LYS 64 -4.787 -13.046 3.750
372 HZ2 LYS 64 1HZ LYS 64 -5.152 -14.628 3.274
373 HZ3 LYS 64 2HZ LYS 64 -6.333 -13.421 3.177
374 H VAL 65 H VAL 65 -4.428 -7.059 -0.363
375 HA VAL 65 HA VAL 65 -6.653 -5.200 0.156
376 HB VAL 65 HB VAL 65 -3.743 -4.459 -0.129
377 HG11 VAL 65 1HG1 VAL 65 -5.084 -2.566 -0.504
378 HG12 VAL 65 2HG1 VAL 65 -6.212 -3.006 0.779
379 HG13 VAL 65 3HG1 VAL 65 -4.589 -2.446 1.184
380 HG21 VAL 65 3HG2 VAL 65 -4.804 -4.284 2.558
381 HG22 VAL 65 1HG2 VAL 65 -4.837 -5.940 1.950
382 HG23 VAL 65 2HG2 VAL 65 -3.320 -5.041 1.980
383 H PHE 66 H PHE 66 -6.960 -3.433 -1.331
384 HA PHE 66 HA PHE 66 -7.182 -2.492 -3.392
385 HB3 PHE 66 2HB PHE 66 -5.393 -2.682 -4.999
386 HD1 PHE 66 2HD PHE 66 -3.524 -3.983 -2.142
387 HD2 PHE 66 1HD PHE 66 -5.001 -0.488 -4.071
388 HE1 PHE 66 2HE PHE 66 -2.046 -2.594 -0.750
389 HE2 PHE 66 1HE PHE 66 -3.524 0.906 -2.682
390 HZ PHE 66 HZ PHE 66 -2.044 -0.147 -1.018
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -39.078 37.546 -2.797
2 HA2 GLY 1 1HA GLY 1 -41.400 37.924 -2.465
3 HA3 GLY 1 2HA GLY 1 -41.668 37.608 -4.173
4 H SER 2 H SER 2 -42.608 35.740 -4.627
5 HA SER 2 HA SER 2 -42.228 33.492 -2.760
6 HB3 SER 2 2HB SER 2 -44.457 33.133 -2.600
7 HG SER 2 HG SER 2 -45.352 35.402 -3.741
8 H SER 3 H SER 3 -42.072 31.430 -3.640
9 HA SER 3 HA SER 3 -42.268 31.035 -6.495
10 HB3 SER 3 2HB SER 3 -39.835 30.071 -6.449
11 HG SER 3 HG SER 3 -39.816 32.858 -6.354
12 H GLY 4 H GLY 4 -40.099 29.203 -4.450
13 HA2 GLY 4 1HA GLY 4 -41.584 27.359 -3.184
14 HA3 GLY 4 2HA GLY 4 -41.729 26.835 -4.855
15 H SER 5 H SER 5 -40.481 25.497 -2.556
16 HA SER 5 HA SER 5 -38.330 24.284 -3.765
17 HB3 SER 5 2HB SER 5 -36.975 26.196 -3.757
18 HG SER 5 HG SER 5 -36.870 27.619 -2.009
19 H SER 6 H SER 6 -38.086 22.426 -2.719
20 HA SER 6 HA SER 6 -38.940 22.287 0.088
21 HB3 SER 6 2HB SER 6 -39.565 20.694 -2.138
22 HG SER 6 HG SER 6 -38.712 18.717 -0.628
23 H GLY 7 H GLY 7 -36.174 22.435 -1.746
24 HA2 GLY 7 1HA GLY 7 -34.290 22.322 0.143
25 HA3 GLY 7 2HA GLY 7 -34.592 20.612 -0.124
26 H PHE 8 H PHE 8 -32.526 20.216 -0.916
27 HA PHE 8 HA PHE 8 -32.154 20.991 -3.699
28 HB3 PHE 8 2HB PHE 8 -29.613 21.310 -2.992
29 HD1 PHE 8 2HD PHE 8 -30.852 22.454 -5.092
30 HD2 PHE 8 1HD PHE 8 -30.729 23.992 -1.125
31 HE1 PHE 8 2HE PHE 8 -31.269 24.717 -5.960
32 HE2 PHE 8 1HE PHE 8 -31.146 26.258 -1.987
33 HZ PHE 8 HZ PHE 8 -31.415 26.624 -4.408
34 H VAL 9 H VAL 9 -31.045 19.494 -4.915
35 HA VAL 9 HA VAL 9 -29.687 17.278 -3.636
36 HB VAL 9 HB VAL 9 -31.872 16.364 -3.516
37 HG11 VAL 9 1HG1 VAL 9 -33.004 16.186 -5.981
38 HG12 VAL 9 2HG1 VAL 9 -33.399 17.420 -4.782
39 HG13 VAL 9 3HG1 VAL 9 -32.239 17.773 -6.064
40 HG21 VAL 9 3HG2 VAL 9 -31.012 15.146 -6.094
41 HG22 VAL 9 1HG2 VAL 9 -29.918 15.064 -4.713
42 HG23 VAL 9 2HG2 VAL 9 -31.536 14.372 -4.598
43 H LYS 10 H LYS 10 -27.877 17.121 -4.771
44 HA LYS 10 HA LYS 10 -27.805 16.470 -7.499
45 HB3 LYS 10 2HB LYS 10 -27.623 19.349 -6.831
46 HG3 LYS 10 2HG LYS 10 -25.726 18.021 -8.738
47 HD3 LYS 10 2HD LYS 10 -25.277 20.495 -9.387
48 HE3 LYS 10 2HE LYS 10 -27.568 20.166 -10.891
49 HZ1 LYS 10 3HZ LYS 10 -25.247 20.435 -11.670
50 HZ2 LYS 10 1HZ LYS 10 -26.116 19.268 -12.534
51 HZ3 LYS 10 2HZ LYS 10 -24.983 18.790 -11.372
52 H THR 11 H THR 11 -26.111 17.919 -4.773
53 HA THR 11 HA THR 11 -23.493 17.229 -5.634
54 HB THR 11 HB THR 11 -23.976 17.427 -2.722
55 HG1 THR 11 1HG THR 11 -24.129 19.858 -3.220
56 HG21 THR 11 3HG2 THR 11 -21.839 18.053 -2.791
57 HG22 THR 11 1HG2 THR 11 -22.232 19.404 -3.854
58 HG23 THR 11 2HG2 THR 11 -21.859 17.822 -4.539
59 H VAL 12 H VAL 12 -22.079 15.787 -4.192
60 HA VAL 12 HA VAL 12 -23.517 13.366 -3.359
61 HB VAL 12 HB VAL 12 -22.758 12.896 -5.609
62 HG11 VAL 12 1HG1 VAL 12 -19.908 12.940 -5.179
63 HG12 VAL 12 2HG1 VAL 12 -20.861 13.683 -6.465
64 HG13 VAL 12 3HG1 VAL 12 -20.606 14.542 -4.946
65 HG21 VAL 12 3HG2 VAL 12 -22.632 11.118 -3.888
66 HG22 VAL 12 1HG2 VAL 12 -21.463 10.907 -5.191
67 HG23 VAL 12 2HG2 VAL 12 -20.938 11.532 -3.627
68 H GLU 13 H GLU 13 -23.109 13.547 -1.210
69 HA GLU 13 HA GLU 13 -20.367 14.048 -0.323
70 HB3 GLU 13 2HB GLU 13 -21.292 14.411 1.870
71 HG3 GLU 13 2HG GLU 13 -21.985 15.996 -0.280
72 H ASP 14 H ASP 14 -19.281 12.151 -0.619
73 HA ASP 14 HA ASP 14 -19.686 10.094 1.308
74 HB3 ASP 14 2HB ASP 14 -19.813 8.859 -1.363
75 H LYS 15 H LYS 15 -17.751 9.301 1.807
76 HA LYS 15 HA LYS 15 -15.764 8.658 -0.128
77 HB3 LYS 15 2HB LYS 15 -15.299 10.982 -0.236
78 HG3 LYS 15 2HG LYS 15 -14.643 11.506 2.544
79 HD3 LYS 15 2HD LYS 15 -15.807 13.580 2.092
80 HE3 LYS 15 2HE LYS 15 -13.710 12.539 0.417
81 HZ1 LYS 15 3HZ LYS 15 -14.245 14.751 -1.053
82 HZ2 LYS 15 1HZ LYS 15 -15.768 14.025 -0.927
83 HZ3 LYS 15 2HZ LYS 15 -14.468 13.156 -1.571
84 H TYR 16 H TYR 16 -13.573 8.244 1.106
85 HA TYR 16 HA TYR 16 -14.282 6.826 3.586
86 HB3 TYR 16 2HB TYR 16 -12.541 5.244 3.090
87 HD1 TYR 16 1HD TYR 16 -13.254 6.402 -0.338
88 HD2 TYR 16 2HD TYR 16 -14.393 3.760 2.797
89 HE1 TYR 16 1HE TYR 16 -14.701 5.176 -1.905
90 HE2 TYR 16 2HE TYR 16 -15.841 2.526 1.239
91 HH TYR 16 HH TYR 16 -15.963 2.152 -1.258
92 H LYS 17 H LYS 17 -12.265 6.456 5.015
93 HA LYS 17 HA LYS 17 -10.373 8.653 5.001
94 HB3 LYS 17 2HB LYS 17 -12.580 8.386 7.002
95 HG3 LYS 17 2HG LYS 17 -10.856 10.199 8.150
96 HD3 LYS 17 2HD LYS 17 -10.470 8.052 9.713
97 HE3 LYS 17 2HE LYS 17 -12.497 10.097 9.450
98 HZ1 LYS 17 3HZ LYS 17 -14.266 9.131 10.549
99 HZ2 LYS 17 1HZ LYS 17 -13.365 7.799 11.077
100 HZ3 LYS 17 2HZ LYS 17 -13.830 7.916 9.455
101 H CYS 18 H CYS 18 -8.485 8.177 6.049
102 HA CYS 18 HA CYS 18 -7.881 5.471 6.541
103 HB3 CYS 18 2HB CYS 18 -6.399 8.016 7.208
104 H GLU 19 H GLU 19 -7.703 4.284 8.386
105 HA GLU 19 HA GLU 19 -9.103 5.293 10.710
106 HB3 GLU 19 2HB GLU 19 -8.382 2.857 11.504
107 HG3 GLU 19 2HG GLU 19 -10.363 1.906 10.507
108 H LYS 20 H LYS 20 -6.436 6.361 9.969
109 HA LYS 20 HA LYS 20 -5.124 5.878 12.555
110 HB3 LYS 20 2HB LYS 20 -3.205 6.534 10.492
111 HG3 LYS 20 2HG LYS 20 -3.546 4.302 12.458
112 HD3 LYS 20 2HD LYS 20 -1.255 4.595 10.519
113 HE3 LYS 20 2HE LYS 20 -0.229 2.915 11.616
114 HZ1 LYS 20 3HZ LYS 20 -2.161 3.673 13.741
115 HZ2 LYS 20 1HZ LYS 20 -0.703 4.465 13.405
116 HZ3 LYS 20 2HZ LYS 20 -0.689 2.876 13.986
117 H CYS 21 H CYS 21 -4.761 7.963 9.678
118 HA CYS 21 HA CYS 21 -4.384 10.254 11.469
119 HB3 CYS 21 2HB CYS 21 -2.610 10.078 9.896
120 H HIS 22 H HIS 22 -6.877 8.774 10.028
121 HA HIS 22 HA HIS 22 -8.993 9.375 9.451
122 HB3 HIS 22 2HB HIS 22 -9.871 10.816 10.926
123 HD2 HIS 22 2HD HIS 22 -7.703 9.128 12.492
124 HE1 HIS 22 1HE HIS 22 -6.389 12.799 14.162
125 HE2 HIS 22 2HE HIS 22 -6.289 10.287 14.321
126 H LEU 23 H LEU 23 -6.678 9.932 7.659
127 HA LEU 23 HA LEU 23 -7.190 12.329 6.227
128 HB3 LEU 23 2HB LEU 23 -5.979 10.650 4.423
129 HG LEU 23 HG LEU 23 -4.782 12.452 6.495
130 HD11 LEU 23 1HD1 LEU 23 -3.449 10.228 5.362
131 HD12 LEU 23 2HD1 LEU 23 -2.776 11.526 6.346
132 HD13 LEU 23 3HD1 LEU 23 -2.817 11.682 4.589
133 HD21 LEU 23 3HD2 LEU 23 -4.475 12.596 3.520
134 HD22 LEU 23 1HD2 LEU 23 -4.388 13.888 4.718
135 HD23 LEU 23 2HD2 LEU 23 -5.946 13.175 4.302
136 H VAL 24 H VAL 24 -8.917 12.753 5.036
137 HA VAL 24 HA VAL 24 -10.781 10.767 4.231
138 HB VAL 24 HB VAL 24 -10.519 13.669 3.447
139 HG11 VAL 24 1HG1 VAL 24 -13.142 12.867 3.010
140 HG12 VAL 24 2HG1 VAL 24 -11.931 13.237 1.780
141 HG13 VAL 24 3HG1 VAL 24 -12.162 11.573 2.319
142 HG21 VAL 24 3HG2 VAL 24 -12.300 14.056 5.003
143 HG22 VAL 24 1HG2 VAL 24 -12.500 12.326 5.277
144 HG23 VAL 24 2HG2 VAL 24 -11.039 13.142 5.829
145 H LEU 25 H LEU 25 -10.442 9.357 2.651
146 HA LEU 25 HA LEU 25 -9.080 10.289 0.209
147 HB3 LEU 25 2HB LEU 25 -7.630 8.628 0.383
148 HG LEU 25 HG LEU 25 -9.014 8.146 2.972
149 HD11 LEU 25 1HD1 LEU 25 -8.102 5.988 1.502
150 HD12 LEU 25 2HD1 LEU 25 -8.366 6.037 3.244
151 HD13 LEU 25 3HD1 LEU 25 -6.763 6.366 2.586
152 HD21 LEU 25 3HD2 LEU 25 -6.674 8.445 3.781
153 HD22 LEU 25 1HD2 LEU 25 -7.324 9.836 2.913
154 HD23 LEU 25 2HD2 LEU 25 -6.189 8.749 2.112
155 H CYS 26 H CYS 26 -9.607 8.784 -1.702
156 HA CYS 26 HA CYS 26 -12.517 8.344 -1.713
157 HB3 CYS 26 2HB CYS 26 -12.620 9.172 -3.830
158 H SER 27 H SER 27 -9.416 6.895 -2.323
159 HA SER 27 HA SER 27 -10.756 4.316 -2.752
160 HB3 SER 27 2HB SER 27 -8.365 5.309 -4.324
161 HG SER 27 HG SER 27 -9.612 3.104 -5.260
162 HA PRO 28 HA PRO 28 -7.607 4.111 0.643
163 HB3 PRO 28 2HB PRO 28 -9.218 4.474 2.240
164 HG3 PRO 28 2HG PRO 28 -11.457 4.016 1.811
165 HD3 PRO 28 2HD PRO 28 -10.944 5.271 -0.052
166 H LYS 29 H LYS 29 -7.530 1.823 2.119
167 HA LYS 29 HA LYS 29 -7.361 -0.334 0.119
168 HB3 LYS 29 2HB LYS 29 -5.222 -0.879 0.713
169 HG3 LYS 29 2HG LYS 29 -3.815 1.026 1.108
170 HD3 LYS 29 2HD LYS 29 -5.670 2.603 -0.390
171 HE3 LYS 29 2HE LYS 29 -3.256 0.936 -1.046
172 HZ1 LYS 29 3HZ LYS 29 -4.030 0.969 -3.140
173 HZ2 LYS 29 1HZ LYS 29 -3.500 2.576 -3.128
174 HZ3 LYS 29 2HZ LYS 29 -5.130 2.220 -2.849
175 H GLN 30 H GLN 30 -9.566 -0.690 1.114
176 HA GLN 30 HA GLN 30 -10.104 -1.406 3.694
177 HB3 GLN 30 2HB GLN 30 -11.267 -3.231 1.689
178 HG3 GLN 30 2HG GLN 30 -12.474 -1.243 3.598
179 HE21 GLN 30 1HE2 GLN 30 -14.586 -3.048 4.167
180 HE22 GLN 30 2HE2 GLN 30 -15.658 -3.042 2.812
181 H THR 31 H THR 31 -8.792 -2.601 4.931
182 HA THR 31 HA THR 31 -7.126 -4.674 4.080
183 HB THR 31 HB THR 31 -6.696 -5.149 6.348
184 HG1 THR 31 1HG THR 31 -9.349 -4.298 6.715
185 HG21 THR 31 3HG2 THR 31 -7.618 -2.291 6.499
186 HG22 THR 31 1HG2 THR 31 -6.214 -2.773 5.547
187 HG23 THR 31 2HG2 THR 31 -6.230 -3.040 7.290
188 H GLU 32 H GLU 32 -7.815 -6.670 6.103
189 HA GLU 32 HA GLU 32 -9.901 -8.062 4.581
190 HB3 GLU 32 2HB GLU 32 -8.357 -9.547 6.613
191 HG3 GLU 32 2HG GLU 32 -8.858 -10.085 3.695
192 H CYS 33 H CYS 33 -10.037 -6.066 6.970
193 HA CYS 33 HA CYS 33 -11.825 -7.719 8.631
194 HB3 CYS 33 2HB CYS 33 -9.742 -6.788 9.748
195 H GLY 34 H GLY 34 -11.407 -4.747 6.851
196 HA2 GLY 34 1HA GLY 34 -13.656 -4.080 5.848
197 HA3 GLY 34 2HA GLY 34 -14.170 -3.965 7.525
198 H HIS 35 H HIS 35 -11.917 -2.776 8.652
199 HA HIS 35 HA HIS 35 -12.400 -0.085 8.307
200 HB3 HIS 35 2HB HIS 35 -10.076 0.226 9.324
201 HD2 HIS 35 2HD HIS 35 -12.149 1.209 11.074
202 HE1 HIS 35 1HE HIS 35 -12.352 -2.410 13.282
203 HE2 HIS 35 2HE HIS 35 -13.077 -0.001 13.165
204 H ARG 36 H ARG 36 -10.379 1.450 7.742
205 HA ARG 36 HA ARG 36 -9.139 0.634 5.233
206 HB3 ARG 36 2HB ARG 36 -9.885 2.854 4.213
207 HG3 ARG 36 2HG ARG 36 -11.663 0.513 4.639
208 HD3 ARG 36 2HD ARG 36 -12.585 2.723 2.867
209 HE ARG 36 HE ARG 36 -14.085 0.989 2.660
210 HH11 ARG 36 1HH1 ARG 36 -13.491 1.642 6.028
211 HH12 ARG 36 2HH1 ARG 36 -14.781 0.629 6.586
212 HH21 ARG 36 1HH2 ARG 36 -15.786 -0.348 3.382
213 HH22 ARG 36 2HH2 ARG 36 -16.085 -0.503 5.080
214 H PHE 37 H PHE 37 -7.384 1.987 4.584
215 HA PHE 37 HA PHE 37 -6.511 4.014 6.497
216 HB3 PHE 37 2HB PHE 37 -4.166 2.929 6.360
217 HD1 PHE 37 2HD PHE 37 -6.711 0.453 7.375
218 HD2 PHE 37 1HD PHE 37 -4.089 3.564 8.625
219 HE1 PHE 37 2HE PHE 37 -7.147 -0.129 9.725
220 HE2 PHE 37 1HE PHE 37 -4.519 2.987 10.977
221 HZ PHE 37 HZ PHE 37 -6.051 1.139 11.530
222 H CYS 38 H CYS 38 -4.425 5.077 5.678
223 HA CYS 38 HA CYS 38 -4.819 5.664 2.845
224 HB3 CYS 38 2HB CYS 38 -4.721 7.509 4.536
225 H GLU 39 H GLU 39 -2.848 6.064 1.510
226 HA GLU 39 HA GLU 39 -1.366 3.832 1.073
227 HB3 GLU 39 2HB GLU 39 0.418 5.513 0.155
228 HG3 GLU 39 2HG GLU 39 -2.387 5.651 -0.925
229 H SER 40 H SER 40 -0.073 6.680 2.796
230 HA SER 40 HA SER 40 2.316 5.620 3.636
231 HB3 SER 40 2HB SER 40 1.663 7.167 5.786
232 HG SER 40 HG SER 40 2.725 7.648 3.269
233 H CYS 41 H CYS 41 -0.111 6.123 6.141
234 HA CYS 41 HA CYS 41 0.679 4.403 8.013
235 HB3 CYS 41 2HB CYS 41 -1.700 4.050 8.649
236 H MET 42 H MET 42 -1.306 3.428 5.228
237 HA MET 42 HA MET 42 -1.622 0.747 5.813
238 HB3 MET 42 2HB MET 42 -1.315 2.158 3.166
239 HG3 MET 42 2HG MET 42 -0.731 -0.207 2.851
240 HE1 MET 42 3HE MET 42 -4.697 -1.009 5.007
241 HE2 MET 42 1HE MET 42 -3.525 0.193 5.547
242 HE3 MET 42 2HE MET 42 -4.342 0.393 3.996
243 H ALA 43 H ALA 43 0.924 2.143 3.734
244 HA ALA 43 HA ALA 43 2.401 -0.208 3.416
245 HB1 ALA 43 3HB ALA 43 4.316 1.695 3.211
246 HB2 ALA 43 1HB ALA 43 3.183 1.280 1.924
247 HB3 ALA 43 2HB ALA 43 2.859 2.660 2.974
248 H ALA 44 H ALA 44 2.382 2.165 5.989
249 HA ALA 44 HA ALA 44 4.789 1.397 7.250
250 HB1 ALA 44 3HB ALA 44 4.067 2.693 9.108
251 HB2 ALA 44 1HB ALA 44 3.513 3.521 7.651
252 HB3 ALA 44 2HB ALA 44 2.378 2.573 8.614
253 H LEU 45 H LEU 45 1.405 0.501 7.907
254 HA LEU 45 HA LEU 45 1.948 -1.265 10.021
255 HB3 LEU 45 2HB LEU 45 -0.289 -2.162 9.606
256 HG LEU 45 HG LEU 45 -0.189 0.836 9.312
257 HD11 LEU 45 1HD1 LEU 45 -2.305 -0.167 8.448
258 HD12 LEU 45 2HD1 LEU 45 -2.514 0.896 9.839
259 HD13 LEU 45 3HD1 LEU 45 -2.570 -0.853 10.051
260 HD21 LEU 45 3HD2 LEU 45 -1.216 -0.215 11.787
261 HD22 LEU 45 1HD2 LEU 45 0.130 0.890 11.509
262 HD23 LEU 45 2HD2 LEU 45 0.396 -0.853 11.460
263 H LEU 46 H LEU 46 1.530 -1.860 6.545
264 HA LEU 46 HA LEU 46 1.725 -4.626 6.548
265 HB3 LEU 46 2HB LEU 46 2.567 -4.389 4.225
266 HG LEU 46 HG LEU 46 0.238 -2.610 4.924
267 HD11 LEU 46 1HD1 LEU 46 1.175 -3.494 2.198
268 HD12 LEU 46 2HD1 LEU 46 1.233 -1.849 2.829
269 HD13 LEU 46 3HD1 LEU 46 -0.323 -2.632 2.551
270 HD21 LEU 46 3HD2 LEU 46 -0.580 -4.804 3.435
271 HD22 LEU 46 1HD2 LEU 46 -0.774 -4.575 5.174
272 HD23 LEU 46 2HD2 LEU 46 0.623 -5.453 4.550
273 H SER 47 H SER 47 4.190 -2.222 6.992
274 HA SER 47 HA SER 47 6.326 -4.195 6.709
275 HB3 SER 47 2HB SER 47 7.224 -1.600 7.613
276 HG SER 47 HG SER 47 8.161 -1.767 5.384
277 H SER 48 H SER 48 4.385 -4.356 8.890
278 HA SER 48 HA SER 48 6.107 -3.807 11.211
279 HB3 SER 48 2HB SER 48 3.124 -4.297 11.037
280 HG SER 48 HG SER 48 4.062 -3.379 13.408
281 H SER 49 H SER 49 6.413 -6.069 9.366
282 HA SER 49 HA SER 49 6.532 -8.364 9.334
283 HB3 SER 49 2HB SER 49 7.568 -9.229 11.534
284 HG SER 49 HG SER 49 8.971 -7.007 10.544
285 H SER 50 H SER 50 3.920 -7.224 10.212
286 HA SER 50 HA SER 50 2.398 -9.417 10.562
287 HB3 SER 50 2HB SER 50 2.071 -9.030 13.241
288 HG SER 50 HG SER 50 4.071 -10.802 12.377
289 HA PRO 51 HA PRO 51 0.383 -5.192 10.619
290 HB3 PRO 51 2HB PRO 51 0.846 -4.790 8.405
291 HG3 PRO 51 2HG PRO 51 1.288 -6.538 6.936
292 HD3 PRO 51 2HD PRO 51 2.729 -7.086 8.649
293 H LYS 52 H LYS 52 -1.586 -4.980 11.490
294 HA LYS 52 HA LYS 52 -3.529 -7.162 11.100
295 HB3 LYS 52 2HB LYS 52 -4.267 -6.913 13.369
296 HG3 LYS 52 2HG LYS 52 -1.381 -7.291 12.921
297 HD3 LYS 52 2HD LYS 52 -2.203 -7.401 15.756
298 HE3 LYS 52 2HE LYS 52 0.300 -6.149 14.758
299 HZ1 LYS 52 3HZ LYS 52 -0.515 -7.855 17.017
300 HZ2 LYS 52 1HZ LYS 52 0.283 -6.363 17.039
301 HZ3 LYS 52 2HZ LYS 52 1.114 -7.760 16.574
302 H CYS 53 H CYS 53 -3.661 -3.942 12.611
303 HA CYS 53 HA CYS 53 -4.841 -2.385 10.792
304 HB3 CYS 53 2HB CYS 53 -6.812 -4.423 11.756
305 H THR 54 H THR 54 -3.969 -0.861 12.172
306 HA THR 54 HA THR 54 -4.058 -0.451 14.794
307 HB THR 54 HB THR 54 -3.980 1.321 12.527
308 HG1 THR 54 1HG THR 54 -2.999 1.303 15.186
309 HG21 THR 54 3HG2 THR 54 -6.036 2.292 13.261
310 HG22 THR 54 1HG2 THR 54 -4.738 3.372 13.768
311 HG23 THR 54 2HG2 THR 54 -5.502 2.299 14.941
312 H ALA 55 H ALA 55 -6.839 -0.159 12.672
313 HA ALA 55 HA ALA 55 -8.649 1.097 14.358
314 HB1 ALA 55 3HB ALA 55 -10.166 0.630 12.771
315 HB2 ALA 55 1HB ALA 55 -8.776 0.040 11.862
316 HB3 ALA 55 2HB ALA 55 -9.783 -1.091 12.766
317 H CYS 56 H CYS 56 -8.828 -2.398 13.730
318 HA CYS 56 HA CYS 56 -9.513 -2.777 16.572
319 HB3 CYS 56 2HB CYS 56 -11.411 -3.261 15.136
320 H GLN 57 H GLN 57 -7.412 -3.652 14.003
321 HA GLN 57 HA GLN 57 -5.410 -4.775 14.103
322 HB3 GLN 57 2HB GLN 57 -5.799 -6.180 16.632
323 HG3 GLN 57 2HG GLN 57 -3.726 -4.566 15.309
324 HE21 GLN 57 1HE2 GLN 57 -4.841 -2.833 17.013
325 HE22 GLN 57 2HE2 GLN 57 -3.834 -2.588 18.396
326 H GLU 58 H GLU 58 -6.173 -6.080 12.423
327 HA GLU 58 HA GLU 58 -6.966 -8.783 13.273
328 HB3 GLU 58 2HB GLU 58 -8.088 -8.588 10.794
329 HG3 GLU 58 2HG GLU 58 -10.220 -7.851 12.197
330 H SER 59 H SER 59 -6.553 -7.650 9.979
331 HA SER 59 HA SER 59 -3.849 -8.561 9.726
332 HB3 SER 59 2HB SER 59 -5.231 -10.192 7.835
333 HG SER 59 HG SER 59 -4.232 -11.738 9.634
334 H ILE 60 H ILE 60 -2.938 -7.372 8.191
335 HA ILE 60 HA ILE 60 -4.660 -6.272 6.066
336 HB ILE 60 HB ILE 60 -2.109 -4.914 6.772
337 HG13 ILE 60 2HG1 ILE 60 -3.305 -5.420 8.939
338 HG21 ILE 60 1HG2 ILE 60 -4.447 -3.266 6.414
339 HG22 ILE 60 2HG2 ILE 60 -2.954 -3.318 5.478
340 HG23 ILE 60 3HG2 ILE 60 -4.276 -4.419 5.091
341 HD11 ILE 60 3HD1 ILE 60 -1.977 -3.194 8.314
342 HD12 ILE 60 1HD1 ILE 60 -3.559 -2.497 8.659
343 HD13 ILE 60 2HD1 ILE 60 -2.733 -3.458 9.885
344 H VAL 61 H VAL 61 -4.098 -6.640 4.009
345 HA VAL 61 HA VAL 61 -1.363 -7.286 3.294
346 HB VAL 61 HB VAL 61 -3.599 -9.280 2.923
347 HG11 VAL 61 1HG1 VAL 61 -2.612 -9.918 1.038
348 HG12 VAL 61 2HG1 VAL 61 -1.303 -8.758 1.271
349 HG13 VAL 61 3HG1 VAL 61 -1.197 -10.366 1.988
350 HG21 VAL 61 3HG2 VAL 61 -1.665 -10.722 3.978
351 HG22 VAL 61 1HG2 VAL 61 -1.136 -9.155 4.591
352 HG23 VAL 61 2HG2 VAL 61 -2.741 -9.764 4.993
353 H LYS 62 H LYS 62 -0.988 -6.056 1.583
354 HA LYS 62 HA LYS 62 -2.668 -4.587 0.082
355 HB3 LYS 62 2HB LYS 62 -0.380 -4.269 -0.319
356 HG3 LYS 62 2HG LYS 62 -0.059 -7.037 -1.434
357 HD3 LYS 62 2HD LYS 62 1.512 -4.900 -1.781
358 HE3 LYS 62 2HE LYS 62 2.323 -6.116 0.849
359 HZ1 LYS 62 3HZ LYS 62 4.226 -4.316 0.276
360 HZ2 LYS 62 1HZ LYS 62 3.984 -5.021 -1.244
361 HZ3 LYS 62 2HZ LYS 62 4.405 -5.987 0.079
362 H ASP 63 H ASP 63 -1.843 -7.974 -0.551
363 HA ASP 63 HA ASP 63 -3.282 -8.269 -2.939
364 HB3 ASP 63 2HB ASP 63 -3.433 -10.756 -1.793
365 H LYS 64 H LYS 64 -4.256 -8.745 0.433
366 HA LYS 64 HA LYS 64 -6.971 -9.410 -0.361
367 HB3 LYS 64 2HB LYS 64 -7.370 -9.925 1.915
368 HG3 LYS 64 2HG LYS 64 -4.947 -10.929 2.599
369 HD3 LYS 64 2HD LYS 64 -6.978 -11.997 0.645
370 HE3 LYS 64 2HE LYS 64 -4.528 -13.244 1.817
371 HZ1 LYS 64 3HZ LYS 64 -5.411 -15.365 1.749
372 HZ2 LYS 64 1HZ LYS 64 -6.761 -14.902 0.838
373 HZ3 LYS 64 2HZ LYS 64 -6.660 -14.483 2.474
374 H VAL 65 H VAL 65 -5.219 -6.619 0.124
375 HA VAL 65 HA VAL 65 -7.283 -5.039 1.368
376 HB VAL 65 HB VAL 65 -4.520 -4.703 0.828
377 HG11 VAL 65 1HG1 VAL 65 -4.409 -2.499 -0.134
378 HG12 VAL 65 2HG1 VAL 65 -5.264 -3.568 -1.247
379 HG13 VAL 65 3HG1 VAL 65 -6.167 -2.421 -0.254
380 HG21 VAL 65 3HG2 VAL 65 -6.645 -3.447 2.439
381 HG22 VAL 65 1HG2 VAL 65 -5.045 -4.019 2.913
382 HG23 VAL 65 2HG2 VAL 65 -5.224 -2.449 2.130
383 H PHE 66 H PHE 66 -8.714 -3.674 0.410
384 HA PHE 66 HA PHE 66 -9.431 -4.162 -2.294
385 HB3 PHE 66 2HB PHE 66 -10.989 -2.147 -1.855
386 HD1 PHE 66 2HD PHE 66 -10.119 -5.416 -0.641
387 HD2 PHE 66 1HD PHE 66 -13.235 -2.522 -0.820
388 HE1 PHE 66 2HE PHE 66 -11.766 -7.160 -0.095
389 HE2 PHE 66 1HE PHE 66 -14.887 -4.261 -0.273
390 HZ PHE 66 HZ PHE 66 -14.153 -6.584 0.089