Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
617874 | 5lg0 RC | 25249 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H1 MET 1 -14.615 36.921 -13.675
2 H2 MET 1 H2 MET 1 -13.674 37.075 -15.026
3 H3 MET 1 H3 MET 1 -14.328 35.612 -14.632
4 HA MET 1 HA MET 1 -12.012 35.626 -14.080
5 HB2 MET 1 2HB MET 1 -12.808 38.219 -12.784
6 HB3 MET 1 3HB MET 1 -11.613 37.234 -11.955
7 HG2 MET 1 2HG MET 1 -10.324 38.584 -13.382
8 HG3 MET 1 3HG MET 1 -10.374 37.003 -14.159
9 HE1 MET 1 1HE MET 1 -12.232 40.958 -15.558
10 HE2 MET 1 2HE MET 1 -12.645 40.279 -13.966
11 HE3 MET 1 3HE MET 1 -10.961 40.704 -14.343
12 H LYS 2 H LYS 2 -12.525 33.650 -13.330
13 HA LYS 2 HA LYS 2 -11.919 32.547 -11.070
14 HB2 LYS 2 3HB LYS 2 -11.715 35.063 -10.135
15 HB3 LYS 2 2HB LYS 2 -10.564 33.846 -9.725
16 HG2 LYS 2 2HG LYS 2 -8.915 34.634 -11.269
17 HG3 LYS 2 3HG LYS 2 -10.056 35.708 -12.054
18 HD2 LYS 2 2HD LYS 2 -8.507 36.913 -10.623
19 HD3 LYS 2 3HD LYS 2 -10.152 37.122 -10.019
20 HE2 LYS 2 2HE LYS 2 -8.424 34.886 -8.925
21 HE3 LYS 2 3HE LYS 2 -8.096 36.542 -8.405
22 HZ1 LYS 2 1HZ LYS 2 -10.285 36.701 -7.517
23 HZ2 LYS 2 2HZ LYS 2 -9.609 35.277 -6.986
24 HZ3 LYS 2 3HZ LYS 2 -10.720 35.229 -8.150
25 H GLN 3 H GLN 3 -8.934 31.944 -13.179
26 HA GLN 3 HA GLN 3 -8.756 30.399 -11.713
27 HB2 GLN 3 2HB GLN 3 -8.014 31.117 -9.871
28 HB3 GLN 3 3HB GLN 3 -8.718 32.667 -10.139
29 HG2 GLN 3 3HG GLN 3 -10.727 31.922 -8.764
30 HG3 GLN 3 2HG GLN 3 -9.844 30.402 -8.452
31 HE21 GLN 3 1HE2 GLN 3 -7.649 31.783 -6.090
32 HE22 GLN 3 2HE2 GLN 3 -7.977 30.423 -7.157
33 H ASP 4 H ASP 4 -11.363 30.403 -9.524
34 HA ASP 4 HA ASP 4 -12.524 28.182 -10.965
35 HB2 ASP 4 2HB ASP 4 -10.682 27.841 -8.559
36 HB3 ASP 4 3HB ASP 4 -11.279 26.596 -9.649
37 H GLY 5 H GLY 5 -13.343 26.859 -8.840
38 HA2 GLY 5 2HA GLY 5 -13.375 28.491 -6.425
39 HA3 GLY 5 3HA GLY 5 -14.891 27.626 -6.827
40 H GLU 6 H GLU 6 -14.757 25.989 -5.335
41 HA GLU 6 HA GLU 6 -14.078 23.926 -4.543
42 HB2 GLU 6 3HB GLU 6 -14.559 22.417 -6.615
43 HB3 GLU 6 2HB GLU 6 -15.736 23.460 -5.908
44 HG2 GLU 6 3HG GLU 6 -15.981 23.547 -8.259
45 HG3 GLU 6 2HG GLU 6 -15.521 25.124 -7.658
46 H GLU 7 H GLU 7 -12.639 22.632 -7.308
47 HA GLU 7 HA GLU 7 -10.683 21.137 -5.978
48 HB2 GLU 7 2HB GLU 7 -13.443 21.370 -4.704
49 HB3 GLU 7 3HB GLU 7 -12.693 19.803 -4.870
50 HG2 GLU 7 2HG GLU 7 -10.728 20.549 -3.572
51 HG3 GLU 7 3HG GLU 7 -11.551 22.080 -3.246
52 H GLY 8 H GLY 8 -10.464 19.709 -7.768
53 HA2 GLY 8 2HA GLY 8 -12.829 18.889 -9.316
54 HA3 GLY 8 3HA GLY 8 -11.201 18.186 -9.402
55 H THR 9 H THR 9 -14.204 18.323 -7.548
56 HA THR 9 HA THR 9 -13.689 15.651 -6.394
57 HB THR 9 HB THR 9 -14.548 16.267 -4.269
58 HG1 THR 9 1HG THR 9 -12.822 17.832 -3.742
59 HG21 THR 9 1HG2 THR 9 -16.082 18.024 -4.699
60 HG22 THR 9 2HG2 THR 9 -14.797 18.743 -3.725
61 HG23 THR 9 3HG2 THR 9 -14.843 19.023 -5.488
62 H GLU 10 H GLU 10 -16.779 14.829 -7.618
63 HA GLU 10 HA GLU 10 -15.560 13.095 -8.021
64 HB2 GLU 10 3HB GLU 10 -13.018 14.710 -8.115
65 HB3 GLU 10 2HB GLU 10 -13.334 13.126 -8.787
66 HG2 GLU 10 2HG GLU 10 -14.939 14.037 -10.377
67 HG3 GLU 10 3HG GLU 10 -14.778 15.656 -9.682
68 H GLU 11 H GLU 11 -13.152 12.083 -7.059
69 HA GLU 11 HA GLU 11 -14.218 11.445 -4.383
70 HB2 GLU 11 2HB GLU 11 -14.838 10.319 -7.120
71 HB3 GLU 11 3HB GLU 11 -14.775 9.173 -5.797
72 HG2 GLU 11 2HG GLU 11 -16.707 9.854 -4.879
73 HG3 GLU 11 3HG GLU 11 -16.353 11.556 -5.076
74 H ASP 12 H ASP 12 -13.469 8.776 -4.447
75 HA ASP 12 HA ASP 12 -11.859 7.508 -3.805
76 HB2 ASP 12 2HB ASP 12 -10.713 7.958 -5.894
77 HB3 ASP 12 3HB ASP 12 -9.878 9.310 -5.133
78 H THR 13 H THR 13 -12.357 7.817 -1.810
79 HA THR 13 HA THR 13 -10.014 8.784 -0.336
80 HB THR 13 HB THR 13 -12.878 9.233 0.502
81 HG1 THR 13 1HG THR 13 -11.539 10.721 -0.923
82 HG21 THR 13 1HG2 THR 13 -10.331 9.788 2.102
83 HG22 THR 13 2HG2 THR 13 -11.951 10.380 2.530
84 HG23 THR 13 3HG2 THR 13 -11.619 8.645 2.555
85 H GLU 14 H GLU 14 -10.248 6.657 -1.577
86 HA GLU 14 HA GLU 14 -11.460 4.409 -0.052
87 HB2 GLU 14 2HB GLU 14 -11.725 5.341 -2.937
88 HB3 GLU 14 3HB GLU 14 -12.152 3.704 -2.437
89 HG2 GLU 14 2HG GLU 14 -13.888 4.487 -0.967
90 HG3 GLU 14 3HG GLU 14 -13.339 6.158 -1.076
91 H GLU 15 H GLU 15 -9.300 5.216 -2.951
92 HA GLU 15 HA GLU 15 -7.548 3.051 -1.989
93 HB2 GLU 15 2HB GLU 15 -7.202 2.297 -4.281
94 HB3 GLU 15 3HB GLU 15 -8.769 1.911 -3.581
95 HG2 GLU 15 2HG GLU 15 -9.825 3.703 -4.918
96 HG3 GLU 15 3HG GLU 15 -8.254 4.085 -5.645
97 H LYS 16 H LYS 16 -6.584 4.855 -1.027
98 HA LYS 16 HA LYS 16 -4.745 6.246 -2.911
99 HB2 LYS 16 2HB LYS 16 -4.482 7.653 -0.565
100 HB3 LYS 16 3HB LYS 16 -5.418 8.151 -1.963
101 HG2 LYS 16 2HG LYS 16 -7.478 7.302 -1.020
102 HG3 LYS 16 3HG LYS 16 -6.578 6.541 0.295
103 HD2 LYS 16 2HD LYS 16 -7.661 8.575 1.090
104 HD3 LYS 16 3HD LYS 16 -5.895 8.786 1.125
105 HE2 LYS 16 2HE LYS 16 -5.957 10.010 -0.986
106 HE3 LYS 16 3HE LYS 16 -7.695 9.681 -1.172
107 HZ1 LYS 16 1HZ LYS 16 -8.096 11.031 0.769
108 HZ2 LYS 16 2HZ LYS 16 -6.479 11.344 0.940
109 HZ3 LYS 16 3HZ LYS 16 -7.303 11.889 -0.379
110 H CYS 17 H CYS 17 -2.707 5.883 -2.657
111 HA CYS 17 HA CYS 17 -1.421 3.745 -1.144
112 HB2 CYS 17 2HB CYS 17 -0.691 4.902 -3.283
113 HB3 CYS 17 3HB CYS 17 -0.400 6.332 -2.358
114 H THR 18 H THR 18 -1.685 3.866 1.132
115 HA THR 18 HA THR 18 -1.757 6.345 2.492
116 HB THR 18 HB THR 18 -2.486 4.037 3.333
117 HG1 THR 18 1HG THR 18 -1.095 5.945 4.897
118 HG21 THR 18 1HG2 THR 18 -0.937 2.813 4.684
119 HG22 THR 18 2HG2 THR 18 -0.124 3.059 3.113
120 HG23 THR 18 3HG2 THR 18 0.320 4.048 4.514
121 H ILE 19 H ILE 19 0.980 4.725 1.088
122 HA ILE 19 HA ILE 19 2.955 5.752 2.920
123 HB ILE 19 HB ILE 19 2.963 4.321 0.258
124 HG12 ILE 19 2HG1 ILE 19 4.135 3.317 2.857
125 HG13 ILE 19 3HG1 ILE 19 2.382 3.278 2.655
126 HG21 ILE 19 1HG2 ILE 19 4.920 5.679 0.195
127 HG22 ILE 19 2HG2 ILE 19 5.298 5.336 1.900
128 HG23 ILE 19 3HG2 ILE 19 5.447 4.054 0.675
129 HD11 ILE 19 1HD1 ILE 19 3.380 1.161 1.942
130 HD12 ILE 19 2HD1 ILE 19 2.577 1.995 0.594
131 HD13 ILE 19 3HD1 ILE 19 4.349 2.018 0.719
132 H CYS 20 H CYS 20 1.848 6.516 -0.437
133 HA CYS 20 HA CYS 20 3.430 9.051 -0.601
134 HB2 CYS 20 2HB CYS 20 1.141 8.021 -2.309
135 HB3 CYS 20 3HB CYS 20 2.212 9.386 -2.640
136 H LEU 21 H LEU 21 0.505 8.015 0.931
137 HA LEU 21 HA LEU 21 -1.474 8.927 1.415
138 HB2 LEU 21 2HB LEU 21 0.262 11.376 1.860
139 HB3 LEU 21 3HB LEU 21 -1.402 11.213 2.433
140 HG LEU 21 HG LEU 21 0.789 9.225 3.182
141 HD11 LEU 21 1HD1 LEU 21 -0.135 11.693 4.669
142 HD12 LEU 21 2HD1 LEU 21 0.965 10.429 5.292
143 HD13 LEU 21 3HD1 LEU 21 1.455 11.419 3.905
144 HD21 LEU 21 1HD2 LEU 21 -1.524 8.408 3.474
145 HD22 LEU 21 2HD2 LEU 21 -0.771 8.710 5.041
146 HD23 LEU 21 3HD2 LEU 21 -1.947 9.875 4.385
147 H SER 22 H SER 22 -1.242 8.591 -1.217
148 HA SER 22 HA SER 22 -2.495 11.017 -2.397
149 HB2 SER 22 2HB SER 22 -0.136 9.480 -3.557
150 HB3 SER 22 3HB SER 22 -1.105 10.665 -4.445
151 HG SER 22 HG SER 22 0.286 11.237 -2.020
152 H ILE 23 H ILE 23 -3.717 10.530 -4.324
153 HA ILE 23 HA ILE 23 -5.399 8.248 -4.088
154 HB ILE 23 HB ILE 23 -4.865 10.317 -6.276
155 HG12 ILE 23 2HG1 ILE 23 -5.439 11.548 -4.265
156 HG13 ILE 23 3HG1 ILE 23 -6.768 11.618 -5.407
157 HG21 ILE 23 1HG2 ILE 23 -6.137 8.921 -7.428
158 HG22 ILE 23 2HG2 ILE 23 -6.965 8.244 -6.011
159 HG23 ILE 23 3HG2 ILE 23 -7.448 9.825 -6.669
160 HD11 ILE 23 1HD1 ILE 23 -7.599 11.239 -3.132
161 HD12 ILE 23 2HD1 ILE 23 -7.945 9.827 -4.147
162 HD13 ILE 23 3HD1 ILE 23 -6.603 9.775 -2.999
163 H LEU 24 H LEU 24 -5.539 6.447 -5.566
164 HA LEU 24 HA LEU 24 -3.271 6.026 -7.420
165 HB2 LEU 24 2HB LEU 24 -5.483 4.190 -6.409
166 HB3 LEU 24 3HB LEU 24 -4.108 3.687 -7.388
167 HG LEU 24 HG LEU 24 -3.792 4.907 -4.586
168 HD11 LEU 24 1HD1 LEU 24 -3.802 2.033 -5.483
169 HD12 LEU 24 2HD1 LEU 24 -3.490 2.653 -3.818
170 HD13 LEU 24 3HD1 LEU 24 -5.083 2.878 -4.584
171 HD21 LEU 24 1HD2 LEU 24 -1.601 3.625 -4.827
172 HD22 LEU 24 2HD2 LEU 24 -1.964 3.544 -6.563
173 HD23 LEU 24 3HD2 LEU 24 -1.808 5.139 -5.781
174 H GLU 25 H GLU 25 -4.276 4.615 -9.335
175 HA GLU 25 HA GLU 25 -6.987 5.632 -10.025
176 HB2 GLU 25 2HB GLU 25 -6.544 6.259 -12.246
177 HB3 GLU 25 3HB GLU 25 -5.390 7.117 -11.218
178 HG2 GLU 25 2HG GLU 25 -3.622 5.532 -11.837
179 HG3 GLU 25 3HG GLU 25 -4.780 4.565 -12.780
180 H GLU 26 H GLU 26 -8.002 4.462 -11.918
181 HA GLU 26 HA GLU 26 -8.027 1.740 -11.139
182 HB2 GLU 26 2HB GLU 26 -10.025 2.972 -11.900
183 HB3 GLU 26 3HB GLU 26 -9.334 3.118 -13.526
184 HG2 GLU 26 2HG GLU 26 -9.344 0.637 -13.748
185 HG3 GLU 26 3HG GLU 26 -9.957 0.491 -12.098
186 H GLY 27 H GLY 27 -6.321 0.465 -11.562
187 HA2 GLY 27 2HA GLY 27 -5.400 -1.132 -13.088
188 HA3 GLY 27 3HA GLY 27 -5.646 -0.002 -14.426
189 H GLU 28 H GLU 28 -4.345 1.616 -11.652
190 HA GLU 28 HA GLU 28 -1.800 2.036 -12.866
191 HB2 GLU 28 2HB GLU 28 -3.150 3.471 -11.232
192 HB3 GLU 28 3HB GLU 28 -2.616 2.383 -9.955
193 HG2 GLU 28 2HG GLU 28 -0.249 3.013 -10.465
194 HG3 GLU 28 3HG GLU 28 -0.820 4.051 -11.782
195 H ASP 29 H ASP 29 0.256 1.456 -11.745
196 HA ASP 29 HA ASP 29 0.493 -1.341 -11.094
197 HB2 ASP 29 2HB ASP 29 2.376 0.994 -10.644
198 HB3 ASP 29 3HB ASP 29 2.795 -0.699 -10.398
199 H VAL 30 H VAL 30 -0.426 -2.126 -9.245
200 HA VAL 30 HA VAL 30 -0.022 -0.668 -6.719
201 HB VAL 30 HB VAL 30 -2.354 -1.178 -6.069
202 HG11 VAL 30 1HG1 VAL 30 -3.431 0.599 -7.343
203 HG12 VAL 30 2HG1 VAL 30 -1.762 1.050 -6.935
204 HG13 VAL 30 3HG1 VAL 30 -2.171 0.521 -8.578
205 HG21 VAL 30 1HG2 VAL 30 -2.780 -1.933 -8.990
206 HG22 VAL 30 2HG2 VAL 30 -2.833 -3.053 -7.610
207 HG23 VAL 30 3HG2 VAL 30 -4.033 -1.758 -7.755
208 H ARG 31 H ARG 31 -0.948 -2.265 -4.932
209 HA ARG 31 HA ARG 31 -0.387 -5.062 -5.515
210 HB2 ARG 31 2HB ARG 31 1.376 -3.168 -4.007
211 HB3 ARG 31 3HB ARG 31 1.075 -4.681 -3.157
212 HG2 ARG 31 2HG ARG 31 2.095 -4.632 -6.019
213 HG3 ARG 31 3HG ARG 31 3.166 -4.534 -4.610
214 HD2 ARG 31 2HD ARG 31 2.175 -6.645 -3.740
215 HD3 ARG 31 3HD ARG 31 1.250 -6.809 -5.251
216 HE ARG 31 HE ARG 31 3.757 -6.494 -6.191
217 HH11 ARG 31 1HH1 ARG 31 5.421 -9.513 -5.492
218 HH12 ARG 31 2HH1 ARG 31 5.437 -8.068 -6.429
219 HH21 ARG 31 1HH2 ARG 31 3.691 -9.868 -3.904
220 HH22 ARG 31 2HH2 ARG 31 2.453 -8.676 -3.734
221 H ARG 32 H ARG 32 -1.044 -6.371 -3.555
222 HA ARG 32 HA ARG 32 -2.851 -4.919 -1.719
223 HB2 ARG 32 2HB ARG 32 -4.375 -6.077 -3.152
224 HB3 ARG 32 3HB ARG 32 -3.294 -7.458 -3.327
225 HG2 ARG 32 2HG ARG 32 -5.195 -8.119 -1.997
226 HG3 ARG 32 3HG ARG 32 -3.738 -8.169 -1.022
227 HD2 ARG 32 2HD ARG 32 -5.021 -7.078 0.493
228 HD3 ARG 32 3HD ARG 32 -4.550 -5.656 -0.415
229 HE ARG 32 HE ARG 32 -6.670 -5.487 -1.333
230 HH11 ARG 32 1HH1 ARG 32 -9.592 -7.058 -0.119
231 HH12 ARG 32 2HH1 ARG 32 -8.973 -5.729 -1.027
232 HH21 ARG 32 1HH2 ARG 32 -8.115 -8.621 0.853
233 HH22 ARG 32 2HH2 ARG 32 -6.418 -8.459 0.575
234 H LEU 33 H LEU 33 -2.618 -5.585 0.429
235 HA LEU 33 HA LEU 33 -0.569 -7.627 1.017
236 HB2 LEU 33 2HB LEU 33 -0.224 -6.031 3.077
237 HB3 LEU 33 3HB LEU 33 0.628 -5.729 1.576
238 HG LEU 33 HG LEU 33 -2.025 -4.346 1.954
239 HD11 LEU 33 1HD1 LEU 33 -0.863 -2.567 3.267
240 HD12 LEU 33 2HD1 LEU 33 -1.002 -4.095 4.144
241 HD13 LEU 33 3HD1 LEU 33 0.551 -3.625 3.413
242 HD21 LEU 33 1HD2 LEU 33 -0.901 -2.535 0.801
243 HD22 LEU 33 2HD2 LEU 33 0.655 -3.381 0.920
244 HD23 LEU 33 3HD2 LEU 33 -0.632 -4.020 -0.118
245 HA PRO 34 HA PRO 34 -3.427 -9.808 2.959
246 HB2 PRO 34 2HB PRO 34 -2.327 -10.855 5.271
247 HB3 PRO 34 3HB PRO 34 -1.872 -11.331 3.607
248 HG2 PRO 34 2HG PRO 34 -0.481 -9.392 5.447
249 HG3 PRO 34 3HG PRO 34 0.235 -10.640 4.369
250 HD2 PRO 34 2HD PRO 34 0.086 -7.975 3.744
251 HD3 PRO 34 3HD PRO 34 0.054 -9.221 2.499
252 H CYS 35 H CYS 35 -2.192 -7.333 5.181
253 HA CYS 35 HA CYS 35 -4.923 -7.086 6.479
254 HB2 CYS 35 2HB CYS 35 -3.254 -6.760 8.094
255 HB3 CYS 35 3HB CYS 35 -2.287 -5.738 7.010
256 H MET 36 H MET 36 -5.156 -7.158 3.928
257 HA MET 36 HA MET 36 -6.179 -6.013 2.254
258 HB2 MET 36 2HB MET 36 -7.816 -5.488 4.763
259 HB3 MET 36 3HB MET 36 -8.406 -5.531 3.087
260 HG2 MET 36 2HG MET 36 -7.247 -7.908 3.060
261 HG3 MET 36 3HG MET 36 -7.409 -7.801 4.808
262 HE1 MET 36 1HE MET 36 -11.300 -7.548 5.264
263 HE2 MET 36 2HE MET 36 -9.714 -7.595 6.068
264 HE3 MET 36 3HE MET 36 -10.182 -6.176 5.100
265 H HIS 37 H HIS 37 -4.249 -4.456 2.303
266 HA HIS 37 HA HIS 37 -5.716 -1.960 1.903
267 HB2 HIS 37 1HB HIS 37 -3.070 -2.168 3.365
268 HB3 HIS 37 2HB HIS 37 -3.553 -0.694 2.522
269 HD2 HIS 37 2HD HIS 37 -5.884 0.515 3.345
270 HE1 HIS 37 1HE HIS 37 -5.816 -1.175 7.258
271 HE2 HIS 37 2HE HIS 37 -6.873 0.626 5.770
272 H LEU 38 H LEU 38 -4.550 -0.564 0.226
273 HA LEU 38 HA LEU 38 -3.325 -2.328 -1.809
274 HB2 LEU 38 2HB LEU 38 -5.679 -2.384 -2.200
275 HB3 LEU 38 3HB LEU 38 -5.855 -0.660 -1.942
276 HG LEU 38 HG LEU 38 -3.952 -1.124 -4.106
277 HD11 LEU 38 1HD1 LEU 38 -5.518 -2.142 -5.729
278 HD12 LEU 38 2HD1 LEU 38 -5.096 -3.285 -4.436
279 HD13 LEU 38 3HD1 LEU 38 -6.678 -2.456 -4.428
280 HD21 LEU 38 1HD2 LEU 38 -5.536 0.324 -5.289
281 HD22 LEU 38 2HD2 LEU 38 -5.363 0.891 -3.609
282 HD23 LEU 38 3HD2 LEU 38 -6.800 -0.025 -4.104
283 H PHE 39 H PHE 39 -1.484 -1.387 -2.310
284 HA PHE 39 HA PHE 39 -1.225 1.603 -2.147
285 HB2 PHE 39 2HB PHE 39 0.710 -0.627 -1.407
286 HB3 PHE 39 3HB PHE 39 1.151 1.064 -1.403
287 HD1 PHE 39 1HD PHE 39 -1.862 1.720 -0.078
288 HD2 PHE 39 2HD PHE 39 1.541 -0.734 0.897
289 HE1 PHE 39 1HE PHE 39 -2.561 1.685 2.275
290 HE2 PHE 39 2HE PHE 39 0.861 -0.733 3.269
291 HZ PHE 39 HZ PHE 39 -1.220 0.443 3.967
292 H HIS 40 H HIS 40 0.710 2.405 -3.470
293 HA HIS 40 HA HIS 40 0.685 1.370 -6.181
294 HB2 HIS 40 1HB HIS 40 2.784 2.972 -4.691
295 HB3 HIS 40 2HB HIS 40 2.893 2.571 -6.395
296 HD2 HIS 40 2HD HIS 40 0.623 3.532 -7.923
297 HE1 HIS 40 1HE HIS 40 0.696 7.167 -5.701
298 HE2 HIS 40 2HE HIS 40 -0.120 6.000 -7.874
299 H GLN 41 H GLN 41 2.167 -0.041 -7.155
300 HA GLN 41 HA GLN 41 3.315 -2.091 -5.576
301 HB2 GLN 41 2HB GLN 41 2.588 -2.141 -7.990
302 HB3 GLN 41 3HB GLN 41 4.087 -1.312 -8.424
303 HG2 GLN 41 2HG GLN 41 5.437 -3.142 -7.704
304 HG3 GLN 41 3HG GLN 41 4.129 -3.869 -6.778
305 HE21 GLN 41 1HE2 GLN 41 1.952 -4.042 -8.570
306 HE22 GLN 41 2HE2 GLN 41 2.494 -4.975 -9.953
307 H VAL 42 H VAL 42 4.798 0.779 -7.132
308 HA VAL 42 HA VAL 42 7.473 0.276 -6.362
309 HB VAL 42 HB VAL 42 6.057 2.942 -6.811
310 HG11 VAL 42 1HG1 VAL 42 8.239 3.277 -5.704
311 HG12 VAL 42 2HG1 VAL 42 9.023 2.217 -6.895
312 HG13 VAL 42 3HG1 VAL 42 8.330 3.776 -7.396
313 HG21 VAL 42 1HG2 VAL 42 5.839 1.472 -8.781
314 HG22 VAL 42 2HG2 VAL 42 7.003 2.755 -9.109
315 HG23 VAL 42 3HG2 VAL 42 7.580 1.120 -8.728
316 H CYS 43 H CYS 43 5.054 2.428 -4.716
317 HA CYS 43 HA CYS 43 6.702 3.186 -2.529
318 HB2 CYS 43 2HB CYS 43 3.706 2.704 -2.487
319 HB3 CYS 43 3HB CYS 43 4.654 3.714 -1.404
320 H VAL 44 H VAL 44 4.477 0.295 -2.798
321 HA VAL 44 HA VAL 44 5.160 -0.363 -0.107
322 HB VAL 44 HB VAL 44 2.967 -0.770 -1.260
323 HG11 VAL 44 1HG1 VAL 44 2.700 -2.929 -2.317
324 HG12 VAL 44 2HG1 VAL 44 3.856 -1.946 -3.249
325 HG13 VAL 44 3HG1 VAL 44 4.450 -3.256 -2.194
326 HG21 VAL 44 1HG2 VAL 44 4.277 -3.090 0.192
327 HG22 VAL 44 2HG2 VAL 44 3.620 -1.635 0.971
328 HG23 VAL 44 3HG2 VAL 44 2.544 -2.742 0.079
329 H ASP 45 H ASP 45 6.688 -1.121 -3.171
330 HA ASP 45 HA ASP 45 8.162 -3.423 -2.278
331 HB2 ASP 45 2HB ASP 45 8.448 -2.807 -4.574
332 HB3 ASP 45 3HB ASP 45 8.882 -1.148 -4.165
333 H GLN 46 H GLN 46 8.941 0.076 -2.140
334 HA GLN 46 HA GLN 46 11.166 -0.262 -0.391
335 HB2 GLN 46 2HB GLN 46 9.315 2.130 -0.851
336 HB3 GLN 46 3HB GLN 46 10.838 2.224 0.042
337 HG2 GLN 46 2HG GLN 46 10.602 1.339 -2.878
338 HG3 GLN 46 3HG GLN 46 11.012 2.967 -2.341
339 HE21 GLN 46 1HE2 GLN 46 12.349 -0.169 -3.090
340 HE22 GLN 46 2HE2 GLN 46 13.958 0.239 -2.519
341 H ALA 47 H ALA 47 7.729 0.074 0.351
342 HA ALA 47 HA ALA 47 8.070 0.472 3.156
343 HB1 ALA 47 1HB ALA 47 5.874 -1.079 1.746
344 HB2 ALA 47 2HB ALA 47 5.772 -0.281 3.330
345 HB3 ALA 47 3HB ALA 47 5.952 0.700 1.849
346 H LEU 48 H LEU 48 7.544 -2.554 1.297
347 HA LEU 48 HA LEU 48 7.683 -4.345 3.451
348 HB2 LEU 48 2HB LEU 48 6.775 -4.758 1.184
349 HB3 LEU 48 3HB LEU 48 8.398 -4.783 0.508
350 HG LEU 48 HG LEU 48 7.582 -6.672 2.750
351 HD11 LEU 48 1HD1 LEU 48 5.906 -6.902 0.961
352 HD12 LEU 48 2HD1 LEU 48 7.201 -7.101 -0.240
353 HD13 LEU 48 3HD1 LEU 48 6.955 -8.325 1.028
354 HD21 LEU 48 1HD2 LEU 48 9.260 -8.176 1.608
355 HD22 LEU 48 2HD2 LEU 48 9.648 -6.849 0.498
356 HD23 LEU 48 3HD2 LEU 48 9.996 -6.707 2.233
357 H ILE 49 H ILE 49 10.282 -3.473 1.097
358 HA ILE 49 HA ILE 49 12.294 -4.995 2.392
359 HB ILE 49 HB ILE 49 13.887 -3.806 1.081
360 HG12 ILE 49 2HG1 ILE 49 12.601 -1.918 -0.460
361 HG13 ILE 49 3HG1 ILE 49 11.990 -1.628 1.189
362 HG21 ILE 49 1HG2 ILE 49 13.048 -4.218 -1.146
363 HG22 ILE 49 2HG2 ILE 49 12.477 -5.483 -0.043
364 HG23 ILE 49 3HG2 ILE 49 11.377 -4.199 -0.581
365 HD11 ILE 49 1HD1 ILE 49 14.909 -1.785 0.380
366 HD12 ILE 49 2HD1 ILE 49 14.006 -0.316 0.818
367 HD13 ILE 49 3HD1 ILE 49 14.308 -1.573 2.040
368 H THR 50 H THR 50 10.971 -1.802 3.248
369 HA THR 50 HA THR 50 13.199 -1.250 4.998
370 HB THR 50 HB THR 50 10.407 -0.061 4.831
371 HG1 THR 50 1HG THR 50 11.791 0.491 3.180
372 HG21 THR 50 1HG2 THR 50 11.317 1.742 6.293
373 HG22 THR 50 2HG2 THR 50 11.155 0.207 7.160
374 HG23 THR 50 3HG2 THR 50 12.757 0.748 6.599
375 H ASN 51 H ASN 51 9.834 -2.551 5.504
376 HA ASN 51 HA ASN 51 10.730 -4.338 7.546
377 HB2 ASN 51 2HB ASN 51 9.973 -1.697 8.445
378 HB3 ASN 51 3HB ASN 51 8.645 -2.763 8.851
379 HD21 ASN 51 1HD2 ASN 51 12.278 -3.091 8.878
380 HD22 ASN 51 2HD2 ASN 51 12.330 -3.657 10.536
381 H LYS 52 H LYS 52 9.418 -6.115 7.139
382 HA LYS 52 HA LYS 52 7.158 -5.839 5.349
383 HB2 LYS 52 2HB LYS 52 8.168 -8.263 6.911
384 HB3 LYS 52 3HB LYS 52 7.009 -8.290 5.581
385 HG2 LYS 52 2HG LYS 52 8.676 -8.369 4.080
386 HG3 LYS 52 3HG LYS 52 9.267 -6.817 4.643
387 HD2 LYS 52 2HD LYS 52 11.122 -8.205 4.874
388 HD3 LYS 52 3HD LYS 52 10.475 -8.181 6.529
389 HE2 LYS 52 2HE LYS 52 9.218 -10.302 6.026
390 HE3 LYS 52 3HE LYS 52 9.862 -10.262 4.378
391 HZ1 LYS 52 1HZ LYS 52 11.056 -11.755 5.607
392 HZ2 LYS 52 2HZ LYS 52 12.067 -10.487 5.311
393 HZ3 LYS 52 3HZ LYS 52 11.414 -10.698 6.822
394 H LYS 53 H LYS 53 5.816 -4.348 6.665
395 HA LYS 53 HA LYS 53 3.702 -6.022 7.689
396 HB2 LYS 53 2HB LYS 53 3.422 -4.603 9.809
397 HB3 LYS 53 3HB LYS 53 4.595 -5.915 9.798
398 HG2 LYS 53 2HG LYS 53 6.381 -4.171 9.250
399 HG3 LYS 53 3HG LYS 53 5.173 -2.932 9.619
400 HD2 LYS 53 2HD LYS 53 5.099 -3.606 11.926
401 HD3 LYS 53 3HD LYS 53 5.813 -5.201 11.553
402 HE2 LYS 53 2HE LYS 53 7.834 -4.010 10.656
403 HE3 LYS 53 3HE LYS 53 7.215 -2.500 11.325
404 HZ1 LYS 53 1HZ LYS 53 7.831 -4.937 12.876
405 HZ2 LYS 53 2HZ LYS 53 8.852 -3.677 12.650
406 HZ3 LYS 53 3HZ LYS 53 7.447 -3.447 13.502
407 H CYS 54 H CYS 54 1.728 -4.898 7.696
408 HA CYS 54 HA CYS 54 1.348 -2.689 5.805
409 HB2 CYS 54 2HB CYS 54 -0.314 -4.464 6.307
410 HB3 CYS 54 3HB CYS 54 -0.354 -3.951 7.991
411 HA PRO 55 HA PRO 55 3.363 -0.211 8.797
412 HB2 PRO 55 2HB PRO 55 2.838 2.376 7.907
413 HB3 PRO 55 3HB PRO 55 4.021 1.250 7.178
414 HG2 PRO 55 2HG PRO 55 1.175 1.788 6.300
415 HG3 PRO 55 3HG PRO 55 2.647 1.661 5.285
416 HD2 PRO 55 2HD PRO 55 0.932 -0.428 5.564
417 HD3 PRO 55 3HD PRO 55 2.706 -0.703 5.514
418 H ILE 56 H ILE 56 0.060 0.958 8.050
419 HA ILE 56 HA ILE 56 -0.363 2.088 10.683
420 HB ILE 56 HB ILE 56 -2.179 1.263 8.388
421 HG12 ILE 56 3HG1 ILE 56 -1.386 3.595 9.643
422 HG13 ILE 56 2HG1 ILE 56 -2.364 3.165 7.918
423 HG21 ILE 56 1HG2 ILE 56 -3.011 2.657 10.966
424 HG22 ILE 56 2HG2 ILE 56 -4.000 2.603 9.488
425 HG23 ILE 56 3HG2 ILE 56 -3.591 1.106 10.326
426 HD11 ILE 56 1HD1 ILE 56 -1.367 5.473 9.045
427 HD12 ILE 56 2HD1 ILE 56 -2.167 5.126 7.524
428 HD13 ILE 56 3HD1 ILE 56 -3.033 4.853 9.052
429 H CYS 57 H CYS 57 -1.134 -1.078 9.148
430 HA CYS 57 HA CYS 57 -2.860 -1.836 11.366
431 HB2 CYS 57 2HB CYS 57 -1.900 -3.936 9.538
432 HB3 CYS 57 3HB CYS 57 -3.512 -3.481 10.068
433 H ARG 58 H ARG 58 0.545 -2.190 10.809
434 HA ARG 58 HA ARG 58 2.206 -3.115 11.961
435 HB2 ARG 58 2HB ARG 58 0.641 -2.413 13.946
436 HB3 ARG 58 3HB ARG 58 0.404 -4.157 14.145
437 HG2 ARG 58 2HG ARG 58 2.896 -4.427 14.335
438 HG3 ARG 58 3HG ARG 58 3.066 -2.667 14.135
439 HD2 ARG 58 2HD ARG 58 1.532 -2.399 16.148
440 HD3 ARG 58 3HD ARG 58 1.667 -4.155 16.391
441 HE ARG 58 HE ARG 58 4.257 -2.968 16.158
442 HH11 ARG 58 1HH1 ARG 58 4.817 -2.547 19.618
443 HH12 ARG 58 2HH1 ARG 58 5.548 -2.546 18.058
444 HH21 ARG 58 1HH2 ARG 58 2.485 -2.946 19.833
445 HH22 ARG 58 2HH2 ARG 58 1.558 -3.238 18.404
446 H VAL 59 H VAL 59 -0.505 -5.146 11.139
447 HA VAL 59 HA VAL 59 0.573 -7.690 11.712
448 HB VAL 59 HB VAL 59 -1.169 -6.956 9.325
449 HG11 VAL 59 1HG1 VAL 59 -0.969 -9.512 10.980
450 HG12 VAL 59 2HG1 VAL 59 -2.116 -9.223 9.655
451 HG13 VAL 59 3HG1 VAL 59 -0.391 -9.296 9.311
452 HG21 VAL 59 1HG2 VAL 59 -3.115 -7.473 10.845
453 HG22 VAL 59 2HG2 VAL 59 -1.991 -7.464 12.219
454 HG23 VAL 59 3HG2 VAL 59 -2.283 -5.987 11.274
455 H ASP 60 H ASP 60 1.864 -9.113 10.524
456 HA ASP 60 HA ASP 60 3.876 -7.960 8.821
457 HB2 ASP 60 2HB ASP 60 4.018 -9.960 10.458
458 HB3 ASP 60 3HB ASP 60 3.305 -10.915 9.161
459 H ILE 61 H ILE 61 4.280 -8.673 6.576
460 HA ILE 61 HA ILE 61 1.802 -9.408 5.113
461 HB ILE 61 HB ILE 61 2.416 -7.875 3.368
462 HG12 ILE 61 2HG1 ILE 61 4.690 -6.978 5.191
463 HG13 ILE 61 3HG1 ILE 61 4.893 -7.923 3.706
464 HG21 ILE 61 1HG2 ILE 61 1.676 -5.893 4.445
465 HG22 ILE 61 2HG2 ILE 61 1.052 -7.204 5.467
466 HG23 ILE 61 3HG2 ILE 61 2.523 -6.344 5.947
467 HD11 ILE 61 1HD1 ILE 61 5.277 -5.653 3.175
468 HD12 ILE 61 2HD1 ILE 61 3.722 -6.161 2.451
469 HD13 ILE 61 3HD1 ILE 61 3.739 -5.136 3.921
470 H GLU 62 H GLU 62 5.075 -10.157 5.577
471 HA GLU 62 HA GLU 62 5.840 -11.217 3.079
472 HB2 GLU 62 2HB GLU 62 7.351 -10.895 4.948
473 HB3 GLU 62 3HB GLU 62 6.559 -12.173 5.881
474 HG2 GLU 62 2HG GLU 62 7.347 -13.884 4.380
475 HG3 GLU 62 3HG GLU 62 7.746 -12.694 3.132
476 H ALA 63 H ALA 63 3.970 -12.090 2.146
477 HA ALA 63 HA ALA 63 2.366 -13.979 3.494
478 HB1 ALA 63 1HB ALA 63 2.435 -13.184 0.553
479 HB2 ALA 63 2HB ALA 63 1.112 -14.049 1.366
480 HB3 ALA 63 3HB ALA 63 1.506 -12.383 1.843
481 H GLN 64 H GLN 64 3.330 -15.864 4.034
482 HA GLN 64 HA GLN 64 3.918 -18.053 3.801
483 HB2 GLN 64 2HB GLN 64 1.645 -17.901 2.719
484 HB3 GLN 64 3HB GLN 64 2.449 -17.815 1.156
485 HG2 GLN 64 2HG GLN 64 3.607 -20.087 2.371
486 HG3 GLN 64 3HG GLN 64 1.941 -20.130 2.931
487 HE21 GLN 64 1HE2 GLN 64 3.811 -19.522 -0.103
488 HE22 GLN 64 2HE2 GLN 64 2.698 -20.427 -1.137
489 H LEU 65 H LEU 65 6.123 -16.659 3.353
490 HA LEU 65 HA LEU 65 7.460 -18.485 1.513
491 HB2 LEU 65 2HB LEU 65 7.101 -15.837 0.755
492 HB3 LEU 65 3HB LEU 65 8.635 -15.745 1.616
493 HG LEU 65 HG LEU 65 9.534 -17.533 0.121
494 HD11 LEU 65 1HD1 LEU 65 7.535 -18.767 -0.554
495 HD12 LEU 65 2HD1 LEU 65 8.271 -18.056 -1.987
496 HD13 LEU 65 3HD1 LEU 65 6.831 -17.302 -1.263
497 HD21 LEU 65 1HD2 LEU 65 9.717 -15.073 -0.420
498 HD22 LEU 65 2HD2 LEU 65 8.273 -15.237 -1.437
499 HD23 LEU 65 3HD2 LEU 65 9.760 -16.125 -1.846
500 HA PRO 66 HA PRO 66 9.022 -19.780 1.634
501 HB2 PRO 66 2HB PRO 66 9.845 -21.761 2.504
502 HB3 PRO 66 3HB PRO 66 11.154 -20.922 3.393
503 HG2 PRO 66 2HG PRO 66 8.236 -21.146 4.179
504 HG3 PRO 66 3HG PRO 66 9.688 -21.472 5.189
505 HD2 PRO 66 2HD PRO 66 8.503 -19.104 5.406
506 HD3 PRO 66 3HD PRO 66 10.281 -19.115 5.183
507 H SER 67 H SER 67 10.919 -17.224 2.777
508 HA SER 67 HA SER 67 13.420 -17.906 1.559
509 HB2 SER 67 2HB SER 67 11.770 -15.753 0.167
510 HB3 SER 67 3HB SER 67 13.419 -16.265 -0.230
511 HG SER 67 HG SER 67 12.195 -18.451 -0.418
512 H GLU 68 H GLU 68 13.674 -14.759 1.069
513 HA GLU 68 HA GLU 68 13.832 -13.917 3.874
514 HB2 GLU 68 2HB GLU 68 16.114 -14.193 1.865
515 HB3 GLU 68 3HB GLU 68 16.212 -13.133 3.277
516 HG2 GLU 68 2HG GLU 68 15.918 -15.009 4.798
517 HG3 GLU 68 3HG GLU 68 15.692 -16.128 3.445
518 H SER 69 H SER 69 14.789 -11.511 3.701
519 HA SER 69 HA SER 69 12.820 -10.054 2.227
520 HB2 SER 69 2HB SER 69 14.396 -10.275 0.378
521 HB3 SER 69 3HB SER 69 14.481 -8.619 1.014
522 HG SER 69 HG SER 69 16.258 -9.331 2.278
Start of MODEL 2
1 H1 MET 1 H1 MET 1 -19.821 35.760 -23.993
2 H2 MET 1 H2 MET 1 -20.557 36.998 -24.798
3 H3 MET 1 H3 MET 1 -21.055 35.444 -25.034
4 HA MET 1 HA MET 1 -19.794 36.180 -26.895
5 HB2 MET 1 2HB MET 1 -17.675 36.689 -24.789
6 HB3 MET 1 3HB MET 1 -17.280 36.438 -26.503
7 HG2 MET 1 2HG MET 1 -18.713 38.282 -27.171
8 HG3 MET 1 3HG MET 1 -19.221 38.550 -25.497
9 HE1 MET 1 1HE MET 1 -17.922 40.723 -27.647
10 HE2 MET 1 2HE MET 1 -18.668 41.096 -26.074
11 HE3 MET 1 3HE MET 1 -17.037 41.696 -26.450
12 H LYS 2 H LYS 2 -17.317 34.461 -24.884
13 HA LYS 2 HA LYS 2 -18.287 31.913 -26.035
14 HB2 LYS 2 2HB LYS 2 -16.613 32.852 -27.551
15 HB3 LYS 2 3HB LYS 2 -15.484 33.124 -26.229
16 HG2 LYS 2 2HG LYS 2 -16.489 30.333 -26.911
17 HG3 LYS 2 3HG LYS 2 -15.170 31.091 -27.804
18 HD2 LYS 2 2HD LYS 2 -13.921 31.395 -25.615
19 HD3 LYS 2 3HD LYS 2 -15.175 30.426 -24.837
20 HE2 LYS 2 2HE LYS 2 -13.583 28.829 -25.278
21 HE3 LYS 2 3HE LYS 2 -14.716 28.626 -26.602
22 HZ1 LYS 2 1HZ LYS 2 -13.211 29.987 -27.971
23 HZ2 LYS 2 2HZ LYS 2 -12.153 30.098 -26.709
24 HZ3 LYS 2 3HZ LYS 2 -12.464 28.637 -27.391
25 H GLN 3 H GLN 3 -18.151 30.259 -24.480
26 HA GLN 3 HA GLN 3 -16.100 30.209 -22.566
27 HB2 GLN 3 2HB GLN 3 -18.413 31.721 -21.753
28 HB3 GLN 3 3HB GLN 3 -18.534 30.181 -20.925
29 HG2 GLN 3 2HG GLN 3 -16.757 30.614 -19.561
30 HG3 GLN 3 3HG GLN 3 -15.789 31.336 -20.846
31 HE21 GLN 3 1HE2 GLN 3 -16.492 33.541 -21.644
32 HE22 GLN 3 2HE2 GLN 3 -17.004 34.659 -20.367
33 H ASP 4 H ASP 4 -16.189 28.194 -21.339
34 HA ASP 4 HA ASP 4 -18.119 26.163 -21.898
35 HB2 ASP 4 2HB ASP 4 -16.475 24.746 -23.190
36 HB3 ASP 4 3HB ASP 4 -17.157 26.090 -24.088
37 H GLY 5 H GLY 5 -17.273 24.071 -20.844
38 HA2 GLY 5 2HA GLY 5 -15.059 23.838 -19.191
39 HA3 GLY 5 3HA GLY 5 -16.286 24.730 -18.257
40 H GLU 6 H GLU 6 -15.623 22.183 -17.351
41 HA GLU 6 HA GLU 6 -18.119 20.869 -17.393
42 HB2 GLU 6 2HB GLU 6 -17.175 20.115 -19.736
43 HB3 GLU 6 3HB GLU 6 -16.040 19.147 -18.795
44 HG2 GLU 6 2HG GLU 6 -18.244 18.349 -17.526
45 HG3 GLU 6 3HG GLU 6 -19.061 18.957 -18.962
46 H GLU 7 H GLU 7 -14.605 20.309 -17.206
47 HA GLU 7 HA GLU 7 -13.218 19.397 -15.765
48 HB2 GLU 7 2HB GLU 7 -15.361 20.267 -13.817
49 HB3 GLU 7 3HB GLU 7 -13.882 19.483 -13.281
50 HG2 GLU 7 2HG GLU 7 -13.808 22.012 -13.280
51 HG3 GLU 7 3HG GLU 7 -12.490 21.194 -14.117
52 H GLY 8 H GLY 8 -16.117 17.753 -16.345
53 HA2 GLY 8 2HA GLY 8 -16.526 15.509 -16.458
54 HA3 GLY 8 3HA GLY 8 -14.781 15.251 -16.253
55 H THR 9 H THR 9 -14.862 13.543 -14.733
56 HA THR 9 HA THR 9 -15.195 14.397 -12.053
57 HB THR 9 HB THR 9 -17.579 13.935 -12.595
58 HG1 THR 9 1HG THR 9 -17.020 13.670 -10.512
59 HG21 THR 9 1HG2 THR 9 -16.623 11.077 -12.927
60 HG22 THR 9 2HG2 THR 9 -18.307 11.646 -12.954
61 HG23 THR 9 3HG2 THR 9 -17.181 12.137 -14.241
62 H GLU 10 H GLU 10 -14.414 12.587 -10.549
63 HA GLU 10 HA GLU 10 -13.277 10.261 -11.717
64 HB2 GLU 10 2HB GLU 10 -11.640 12.553 -11.939
65 HB3 GLU 10 3HB GLU 10 -11.020 11.723 -10.504
66 HG2 GLU 10 2HG GLU 10 -10.869 9.609 -11.797
67 HG3 GLU 10 3HG GLU 10 -11.518 10.424 -13.225
68 H GLU 11 H GLU 11 -11.767 9.257 -9.773
69 HA GLU 11 HA GLU 11 -13.495 9.471 -7.385
70 HB2 GLU 11 2HB GLU 11 -11.670 7.415 -8.566
71 HB3 GLU 11 3HB GLU 11 -11.715 7.498 -6.794
72 HG2 GLU 11 2HG GLU 11 -14.099 7.230 -6.730
73 HG3 GLU 11 3HG GLU 11 -14.246 7.434 -8.479
74 H ASP 12 H ASP 12 -12.683 9.960 -5.302
75 HA ASP 12 HA ASP 12 -9.900 10.661 -4.938
76 HB2 ASP 12 2HB ASP 12 -10.852 12.804 -5.772
77 HB3 ASP 12 3HB ASP 12 -12.133 12.709 -4.556
78 H THR 13 H THR 13 -9.477 10.414 -2.779
79 HA THR 13 HA THR 13 -9.630 9.489 -0.691
80 HB THR 13 HB THR 13 -12.089 11.256 -0.839
81 HG1 THR 13 1HG THR 13 -10.156 12.237 -1.325
82 HG21 THR 13 1HG2 THR 13 -12.374 10.057 1.232
83 HG22 THR 13 2HG2 THR 13 -10.639 10.157 1.608
84 HG23 THR 13 3HG2 THR 13 -11.651 11.623 1.616
85 H GLU 14 H GLU 14 -11.506 8.062 -2.940
86 HA GLU 14 HA GLU 14 -12.517 5.993 -1.085
87 HB2 GLU 14 2HB GLU 14 -12.431 6.345 -4.110
88 HB3 GLU 14 3HB GLU 14 -12.855 4.793 -3.374
89 HG2 GLU 14 2HG GLU 14 -14.304 7.393 -2.713
90 HG3 GLU 14 3HG GLU 14 -14.807 6.304 -4.004
91 H GLU 15 H GLU 15 -10.097 6.144 -3.824
92 HA GLU 15 HA GLU 15 -8.518 4.133 -2.327
93 HB2 GLU 15 2HB GLU 15 -7.700 3.413 -4.534
94 HB3 GLU 15 3HB GLU 15 -9.383 3.057 -4.207
95 HG2 GLU 15 2HG GLU 15 -10.184 4.569 -5.764
96 HG3 GLU 15 3HG GLU 15 -8.736 5.571 -5.743
97 H LYS 16 H LYS 16 -6.938 5.135 -1.334
98 HA LYS 16 HA LYS 16 -5.064 6.718 -2.965
99 HB2 LYS 16 2HB LYS 16 -4.811 8.317 -0.938
100 HB3 LYS 16 3HB LYS 16 -6.175 8.547 -2.044
101 HG2 LYS 16 2HG LYS 16 -7.737 7.586 -0.601
102 HG3 LYS 16 3HG LYS 16 -6.476 6.938 0.459
103 HD2 LYS 16 2HD LYS 16 -7.675 8.904 1.409
104 HD3 LYS 16 3HD LYS 16 -5.927 9.168 1.269
105 HE2 LYS 16 2HE LYS 16 -6.141 10.648 -0.526
106 HE3 LYS 16 3HE LYS 16 -7.721 10.019 -1.008
107 HZ1 LYS 16 1HZ LYS 16 -8.702 11.101 0.878
108 HZ2 LYS 16 2HZ LYS 16 -7.232 11.672 1.395
109 HZ3 LYS 16 3HZ LYS 16 -7.932 12.169 -0.024
110 H CYS 17 H CYS 17 -3.042 6.326 -2.596
111 HA CYS 17 HA CYS 17 -2.044 4.017 -1.137
112 HB2 CYS 17 2HB CYS 17 -1.160 5.123 -3.262
113 HB3 CYS 17 3HB CYS 17 -0.641 6.468 -2.264
114 H THR 18 H THR 18 -1.789 3.982 1.062
115 HA THR 18 HA THR 18 -1.784 6.413 2.589
116 HB THR 18 HB THR 18 -2.496 3.938 3.179
117 HG1 THR 18 1HG THR 18 -2.464 4.659 5.336
118 HG21 THR 18 1HG2 THR 18 -0.090 3.121 3.176
119 HG22 THR 18 2HG2 THR 18 0.186 4.147 4.597
120 HG23 THR 18 3HG2 THR 18 -0.994 2.825 4.682
121 H ILE 19 H ILE 19 0.847 4.620 1.025
122 HA ILE 19 HA ILE 19 2.883 5.648 2.799
123 HB ILE 19 HB ILE 19 2.819 4.110 0.203
124 HG12 ILE 19 2HG1 ILE 19 4.069 3.229 2.816
125 HG13 ILE 19 3HG1 ILE 19 2.310 3.178 2.659
126 HG21 ILE 19 1HG2 ILE 19 4.815 5.423 0.027
127 HG22 ILE 19 2HG2 ILE 19 5.208 5.179 1.747
128 HG23 ILE 19 3HG2 ILE 19 5.329 3.828 0.601
129 HD11 ILE 19 1HD1 ILE 19 4.202 1.863 0.680
130 HD12 ILE 19 2HD1 ILE 19 3.373 1.035 2.018
131 HD13 ILE 19 3HD1 ILE 19 2.433 1.778 0.701
132 H CYS 20 H CYS 20 1.796 6.347 -0.581
133 HA CYS 20 HA CYS 20 3.594 8.726 -0.813
134 HB2 CYS 20 2HB CYS 20 1.275 7.937 -2.596
135 HB3 CYS 20 3HB CYS 20 2.608 9.046 -2.931
136 H LEU 21 H LEU 21 0.606 8.071 0.749
137 HA LEU 21 HA LEU 21 -1.304 9.167 1.110
138 HB2 LEU 21 2HB LEU 21 0.720 11.347 1.684
139 HB3 LEU 21 3HB LEU 21 -0.977 11.420 2.179
140 HG LEU 21 HG LEU 21 0.888 9.144 2.967
141 HD11 LEU 21 1HD1 LEU 21 0.157 11.639 4.529
142 HD12 LEU 21 2HD1 LEU 21 1.045 10.227 5.161
143 HD13 LEU 21 3HD1 LEU 21 1.761 11.214 3.875
144 HD21 LEU 21 1HD2 LEU 21 -1.562 8.628 3.118
145 HD22 LEU 21 2HD2 LEU 21 -0.808 8.705 4.701
146 HD23 LEU 21 3HD2 LEU 21 -1.788 10.073 4.126
147 H SER 22 H SER 22 -1.308 8.825 -1.403
148 HA SER 22 HA SER 22 -2.297 11.332 -2.622
149 HB2 SER 22 2HB SER 22 -0.115 9.557 -3.808
150 HB3 SER 22 3HB SER 22 -0.995 10.807 -4.702
151 HG SER 22 HG SER 22 0.543 11.283 -2.345
152 H ILE 23 H ILE 23 -3.995 10.871 -4.196
153 HA ILE 23 HA ILE 23 -5.383 8.472 -3.965
154 HB ILE 23 HB ILE 23 -5.385 10.883 -5.822
155 HG12 ILE 23 2HG1 ILE 23 -7.385 11.514 -4.657
156 HG13 ILE 23 3HG1 ILE 23 -7.399 9.999 -3.736
157 HG21 ILE 23 1HG2 ILE 23 -7.268 8.496 -5.855
158 HG22 ILE 23 2HG2 ILE 23 -7.717 10.101 -6.485
159 HG23 ILE 23 3HG2 ILE 23 -6.364 9.235 -7.183
160 HD11 ILE 23 1HD1 ILE 23 -5.311 12.180 -3.459
161 HD12 ILE 23 2HD1 ILE 23 -6.733 11.983 -2.417
162 HD13 ILE 23 3HD1 ILE 23 -5.500 10.716 -2.446
163 H LEU 24 H LEU 24 -5.716 6.954 -5.546
164 HA LEU 24 HA LEU 24 -3.416 6.261 -7.295
165 HB2 LEU 24 2HB LEU 24 -5.890 4.747 -6.339
166 HB3 LEU 24 3HB LEU 24 -4.561 4.022 -7.251
167 HG LEU 24 HG LEU 24 -4.168 5.359 -4.526
168 HD11 LEU 24 1HD1 LEU 24 -4.574 2.468 -5.246
169 HD12 LEU 24 2HD1 LEU 24 -4.005 3.071 -3.656
170 HD13 LEU 24 3HD1 LEU 24 -5.611 3.516 -4.245
171 HD21 LEU 24 1HD2 LEU 24 -2.441 3.781 -6.428
172 HD22 LEU 24 2HD2 LEU 24 -2.139 5.348 -5.635
173 HD23 LEU 24 3HD2 LEU 24 -2.100 3.814 -4.693
174 H GLU 25 H GLU 25 -5.024 4.618 -9.084
175 HA GLU 25 HA GLU 25 -7.271 6.095 -9.953
176 HB2 GLU 25 2HB GLU 25 -6.649 6.517 -12.257
177 HB3 GLU 25 3HB GLU 25 -5.493 7.330 -11.197
178 HG2 GLU 25 2HG GLU 25 -3.864 5.528 -11.542
179 HG3 GLU 25 3HG GLU 25 -5.004 4.656 -12.578
180 H GLU 26 H GLU 26 -8.238 4.904 -11.964
181 HA GLU 26 HA GLU 26 -8.648 2.217 -11.248
182 HB2 GLU 26 2HB GLU 26 -10.313 3.480 -12.478
183 HB3 GLU 26 3HB GLU 26 -9.194 3.768 -13.809
184 HG2 GLU 26 2HG GLU 26 -10.840 2.095 -14.431
185 HG3 GLU 26 3HG GLU 26 -9.232 1.388 -14.423
186 H GLY 27 H GLY 27 -7.605 0.413 -11.675
187 HA2 GLY 27 2HA GLY 27 -6.121 -1.119 -12.532
188 HA3 GLY 27 3HA GLY 27 -6.251 -0.208 -14.043
189 H GLU 28 H GLU 28 -4.918 1.544 -11.257
190 HA GLU 28 HA GLU 28 -2.428 1.874 -12.615
191 HB2 GLU 28 2HB GLU 28 -3.752 3.287 -10.755
192 HB3 GLU 28 3HB GLU 28 -2.712 2.382 -9.665
193 HG2 GLU 28 2HG GLU 28 -0.757 3.238 -11.161
194 HG3 GLU 28 3HG GLU 28 -1.938 4.291 -11.917
195 H ASP 29 H ASP 29 -0.306 1.382 -11.511
196 HA ASP 29 HA ASP 29 -0.025 -1.397 -10.898
197 HB2 ASP 29 2HB ASP 29 2.020 0.768 -10.311
198 HB3 ASP 29 3HB ASP 29 2.284 -0.940 -10.534
199 H VAL 30 H VAL 30 -1.147 -2.036 -9.050
200 HA VAL 30 HA VAL 30 -0.288 -0.840 -6.492
201 HB VAL 30 HB VAL 30 -2.537 -0.925 -5.624
202 HG11 VAL 30 1HG1 VAL 30 -1.778 1.143 -6.816
203 HG12 VAL 30 2HG1 VAL 30 -2.604 0.554 -8.272
204 HG13 VAL 30 3HG1 VAL 30 -3.538 0.921 -6.822
205 HG21 VAL 30 1HG2 VAL 30 -3.423 -1.830 -8.400
206 HG22 VAL 30 2HG2 VAL 30 -3.487 -2.798 -6.908
207 HG23 VAL 30 3HG2 VAL 30 -4.498 -1.356 -7.076
208 H ARG 31 H ARG 31 -1.109 -2.392 -4.699
209 HA ARG 31 HA ARG 31 -0.801 -5.175 -5.480
210 HB2 ARG 31 2HB ARG 31 1.330 -3.456 -4.333
211 HB3 ARG 31 3HB ARG 31 0.999 -4.842 -3.301
212 HG2 ARG 31 2HG ARG 31 1.437 -6.398 -5.129
213 HG3 ARG 31 3HG ARG 31 1.679 -5.044 -6.263
214 HD2 ARG 31 2HD ARG 31 3.543 -4.206 -4.942
215 HD3 ARG 31 3HD ARG 31 3.259 -5.418 -3.680
216 HE ARG 31 HE ARG 31 3.729 -6.890 -5.980
217 HH11 ARG 31 1HH1 ARG 31 7.273 -6.923 -5.693
218 HH12 ARG 31 2HH1 ARG 31 5.914 -7.788 -6.340
219 HH21 ARG 31 1HH2 ARG 31 7.012 -5.026 -4.450
220 HH22 ARG 31 2HH2 ARG 31 5.460 -4.348 -4.182
221 H ARG 32 H ARG 32 -0.947 -6.489 -3.255
222 HA ARG 32 HA ARG 32 -2.808 -5.082 -1.443
223 HB2 ARG 32 2HB ARG 32 -3.765 -6.556 -3.501
224 HB3 ARG 32 3HB ARG 32 -3.417 -7.886 -2.400
225 HG2 ARG 32 2HG ARG 32 -5.254 -5.500 -1.949
226 HG3 ARG 32 3HG ARG 32 -5.711 -7.195 -2.174
227 HD2 ARG 32 2HD ARG 32 -4.134 -7.502 -0.008
228 HD3 ARG 32 3HD ARG 32 -4.583 -5.836 0.270
229 HE ARG 32 HE ARG 32 -6.184 -8.167 0.625
230 HH11 ARG 32 1HH1 ARG 32 -9.316 -6.537 0.754
231 HH12 ARG 32 2HH1 ARG 32 -8.484 -8.029 0.980
232 HH21 ARG 32 1HH2 ARG 32 -8.117 -4.625 -0.013
233 HH22 ARG 32 2HH2 ARG 32 -6.416 -4.770 -0.289
234 H LEU 33 H LEU 33 -2.478 -5.772 0.726
235 HA LEU 33 HA LEU 33 -0.467 -7.910 1.114
236 HB2 LEU 33 2HB LEU 33 -0.837 -6.141 3.384
237 HB3 LEU 33 3HB LEU 33 0.652 -6.567 2.534
238 HG LEU 33 HG LEU 33 -1.288 -4.432 1.605
239 HD11 LEU 33 1HD1 LEU 33 1.319 -4.097 3.159
240 HD12 LEU 33 2HD1 LEU 33 0.191 -2.830 2.632
241 HD13 LEU 33 3HD1 LEU 33 -0.293 -3.985 3.881
242 HD21 LEU 33 1HD2 LEU 33 1.676 -4.820 0.951
243 HD22 LEU 33 2HD2 LEU 33 0.393 -5.380 -0.114
244 HD23 LEU 33 3HD2 LEU 33 0.542 -3.651 0.221
245 HA PRO 34 HA PRO 34 -3.187 -10.367 3.267
246 HB2 PRO 34 2HB PRO 34 -2.007 -11.000 5.697
247 HB3 PRO 34 3HB PRO 34 -1.506 -11.671 4.117
248 HG2 PRO 34 2HG PRO 34 -0.215 -9.468 5.710
249 HG3 PRO 34 3HG PRO 34 0.544 -10.733 4.695
250 HD2 PRO 34 2HD PRO 34 0.084 -8.096 3.978
251 HD3 PRO 34 3HD PRO 34 0.343 -9.386 2.793
252 H CYS 35 H CYS 35 -1.923 -7.692 5.251
253 HA CYS 35 HA CYS 35 -4.295 -7.535 7.019
254 HB2 CYS 35 2HB CYS 35 -2.919 -5.992 8.117
255 HB3 CYS 35 3HB CYS 35 -1.820 -7.284 7.611
256 H MET 36 H MET 36 -4.830 -7.301 4.262
257 HA MET 36 HA MET 36 -5.822 -6.142 2.694
258 HB2 MET 36 2HB MET 36 -8.094 -5.485 3.347
259 HB3 MET 36 3HB MET 36 -7.598 -7.079 3.917
260 HG2 MET 36 2HG MET 36 -7.178 -6.194 6.158
261 HG3 MET 36 3HG MET 36 -7.628 -4.566 5.629
262 HE1 MET 36 1HE MET 36 -10.439 -6.122 8.069
263 HE2 MET 36 2HE MET 36 -8.795 -6.792 7.981
264 HE3 MET 36 3HE MET 36 -9.037 -5.027 7.993
265 H HIS 37 H HIS 37 -3.910 -4.760 2.717
266 HA HIS 37 HA HIS 37 -4.940 -1.972 2.698
267 HB2 HIS 37 1HB HIS 37 -2.347 -3.104 3.681
268 HB3 HIS 37 2HB HIS 37 -2.262 -1.591 2.782
269 HD2 HIS 37 2HD HIS 37 -3.992 0.406 3.652
270 HE1 HIS 37 1HE HIS 37 -3.965 -0.842 7.716
271 HE2 HIS 37 2HE HIS 37 -4.519 1.079 6.126
272 H LEU 38 H LEU 38 -4.369 -0.719 0.812
273 HA LEU 38 HA LEU 38 -3.609 -2.338 -1.566
274 HB2 LEU 38 2HB LEU 38 -6.062 -1.781 -1.352
275 HB3 LEU 38 3HB LEU 38 -5.669 -0.077 -1.409
276 HG LEU 38 HG LEU 38 -4.745 -1.953 -3.617
277 HD11 LEU 38 1HD1 LEU 38 -7.164 -2.382 -3.320
278 HD12 LEU 38 2HD1 LEU 38 -7.489 -0.632 -3.402
279 HD13 LEU 38 3HD1 LEU 38 -6.860 -1.489 -4.819
280 HD21 LEU 38 1HD2 LEU 38 -5.082 0.079 -5.021
281 HD22 LEU 38 2HD2 LEU 38 -5.600 0.979 -3.591
282 HD23 LEU 38 3HD2 LEU 38 -3.922 0.394 -3.725
283 H PHE 39 H PHE 39 -1.566 -1.611 -2.001
284 HA PHE 39 HA PHE 39 -0.950 1.297 -1.624
285 HB2 PHE 39 2HB PHE 39 0.682 -1.177 -0.919
286 HB3 PHE 39 3HB PHE 39 1.359 0.435 -0.982
287 HD1 PHE 39 1HD PHE 39 -1.659 1.277 0.467
288 HD2 PHE 39 2HD PHE 39 1.864 -1.024 1.369
289 HE1 PHE 39 1HE PHE 39 -2.157 1.450 2.852
290 HE2 PHE 39 2HE PHE 39 1.412 -0.761 3.784
291 HZ PHE 39 HZ PHE 39 -0.638 0.425 4.541
292 H HIS 40 H HIS 40 0.670 2.086 -3.181
293 HA HIS 40 HA HIS 40 0.467 0.982 -5.825
294 HB2 HIS 40 1HB HIS 40 2.574 2.714 -4.538
295 HB3 HIS 40 2HB HIS 40 2.715 2.197 -6.200
296 HD2 HIS 40 2HD HIS 40 0.497 2.957 -7.859
297 HE1 HIS 40 1HE HIS 40 0.341 6.715 -5.861
298 HE2 HIS 40 2HE HIS 40 -0.358 5.408 -7.961
299 H GLN 41 H GLN 41 2.059 -0.152 -7.046
300 HA GLN 41 HA GLN 41 3.576 -2.223 -5.824
301 HB2 GLN 41 2HB GLN 41 3.363 -0.935 -8.532
302 HB3 GLN 41 3HB GLN 41 4.756 -1.974 -8.235
303 HG2 GLN 41 2HG GLN 41 3.363 -3.816 -7.534
304 HG3 GLN 41 3HG GLN 41 1.915 -2.792 -7.545
305 HE21 GLN 41 1HE2 GLN 41 0.616 -3.716 -9.134
306 HE22 GLN 41 2HE2 GLN 41 1.187 -3.899 -10.799
307 H VAL 42 H VAL 42 4.780 0.891 -7.241
308 HA VAL 42 HA VAL 42 7.414 0.391 -6.396
309 HB VAL 42 HB VAL 42 6.051 3.067 -6.944
310 HG11 VAL 42 1HG1 VAL 42 8.169 3.454 -5.755
311 HG12 VAL 42 2HG1 VAL 42 9.012 2.327 -6.839
312 HG13 VAL 42 3HG1 VAL 42 8.368 3.863 -7.462
313 HG21 VAL 42 1HG2 VAL 42 5.927 1.529 -8.874
314 HG22 VAL 42 2HG2 VAL 42 7.109 2.801 -9.192
315 HG23 VAL 42 3HG2 VAL 42 7.661 1.180 -8.723
316 H CYS 43 H CYS 43 4.913 2.448 -4.770
317 HA CYS 43 HA CYS 43 6.438 3.245 -2.508
318 HB2 CYS 43 2HB CYS 43 3.500 2.485 -2.547
319 HB3 CYS 43 3HB CYS 43 4.336 3.498 -1.392
320 H VAL 44 H VAL 44 4.463 0.192 -2.947
321 HA VAL 44 HA VAL 44 5.119 -0.520 -0.280
322 HB VAL 44 HB VAL 44 2.996 -1.082 -1.535
323 HG11 VAL 44 1HG1 VAL 44 2.904 -3.198 -2.645
324 HG12 VAL 44 2HG1 VAL 44 4.158 -2.235 -3.460
325 HG13 VAL 44 3HG1 VAL 44 4.630 -3.518 -2.321
326 HG21 VAL 44 1HG2 VAL 44 4.409 -3.314 -0.044
327 HG22 VAL 44 2HG2 VAL 44 3.739 -1.876 0.733
328 HG23 VAL 44 3HG2 VAL 44 2.665 -3.000 -0.139
329 H ASP 45 H ASP 45 6.752 -1.039 -3.305
330 HA ASP 45 HA ASP 45 8.336 -3.311 -2.495
331 HB2 ASP 45 2HB ASP 45 8.600 -1.113 -4.523
332 HB3 ASP 45 3HB ASP 45 10.108 -1.826 -3.967
333 H GLN 46 H GLN 46 9.075 0.211 -2.317
334 HA GLN 46 HA GLN 46 11.254 -0.180 -0.487
335 HB2 GLN 46 2HB GLN 46 9.480 2.192 -1.206
336 HB3 GLN 46 3HB GLN 46 10.708 2.347 0.051
337 HG2 GLN 46 2HG GLN 46 11.478 1.285 -2.682
338 HG3 GLN 46 3HG GLN 46 11.296 3.021 -2.405
339 HE21 GLN 46 1HE2 GLN 46 13.170 4.098 -1.755
340 HE22 GLN 46 2HE2 GLN 46 14.476 3.279 -0.907
341 H ALA 47 H ALA 47 7.779 0.104 0.132
342 HA ALA 47 HA ALA 47 8.040 0.554 2.935
343 HB1 ALA 47 1HB ALA 47 5.916 -1.097 1.533
344 HB2 ALA 47 2HB ALA 47 5.761 -0.234 3.078
345 HB3 ALA 47 3HB ALA 47 5.950 0.689 1.563
346 H LEU 48 H LEU 48 7.643 -2.524 1.125
347 HA LEU 48 HA LEU 48 7.719 -4.220 3.366
348 HB2 LEU 48 2HB LEU 48 6.786 -4.667 1.097
349 HB3 LEU 48 3HB LEU 48 8.414 -4.837 0.452
350 HG LEU 48 HG LEU 48 7.462 -6.535 2.794
351 HD11 LEU 48 1HD1 LEU 48 5.750 -6.743 1.035
352 HD12 LEU 48 2HD1 LEU 48 7.011 -7.090 -0.169
353 HD13 LEU 48 3HD1 LEU 48 6.698 -8.232 1.159
354 HD21 LEU 48 1HD2 LEU 48 9.468 -7.021 0.538
355 HD22 LEU 48 2HD2 LEU 48 9.865 -6.746 2.246
356 HD23 LEU 48 3HD2 LEU 48 9.016 -8.214 1.771
357 H ILE 49 H ILE 49 10.354 -3.290 1.043
358 HA ILE 49 HA ILE 49 12.318 -4.868 2.365
359 HB ILE 49 HB ILE 49 13.969 -3.679 1.135
360 HG12 ILE 49 2HG1 ILE 49 12.978 -1.708 -0.402
361 HG13 ILE 49 3HG1 ILE 49 12.066 -1.464 1.092
362 HG21 ILE 49 1HG2 ILE 49 12.524 -5.273 -0.081
363 HG22 ILE 49 2HG2 ILE 49 11.544 -3.914 -0.661
364 HG23 ILE 49 3HG2 ILE 49 13.247 -4.034 -1.117
365 HD11 ILE 49 1HD1 ILE 49 15.074 -1.456 0.716
366 HD12 ILE 49 2HD1 ILE 49 14.039 -0.143 1.318
367 HD13 ILE 49 3HD1 ILE 49 14.339 -1.563 2.325
368 H THR 50 H THR 50 11.176 -1.496 2.991
369 HA THR 50 HA THR 50 13.184 -0.910 4.895
370 HB THR 50 HB THR 50 10.381 0.122 4.367
371 HG1 THR 50 1HG THR 50 13.032 1.068 4.103
372 HG21 THR 50 1HG2 THR 50 10.818 1.963 5.975
373 HG22 THR 50 2HG2 THR 50 10.540 0.408 6.760
374 HG23 THR 50 3HG2 THR 50 12.199 1.045 6.622
375 H ASN 51 H ASN 51 9.881 -2.323 5.303
376 HA ASN 51 HA ASN 51 10.862 -4.022 7.364
377 HB2 ASN 51 2HB ASN 51 10.247 -1.631 8.459
378 HB3 ASN 51 3HB ASN 51 8.607 -2.270 8.379
379 HD21 ASN 51 1HD2 ASN 51 8.874 -5.001 9.072
380 HD22 ASN 51 2HD2 ASN 51 9.777 -5.088 10.583
381 H LYS 52 H LYS 52 9.737 -5.881 6.823
382 HA LYS 52 HA LYS 52 7.310 -5.771 5.276
383 HB2 LYS 52 2HB LYS 52 7.427 -8.195 5.339
384 HB3 LYS 52 3HB LYS 52 8.947 -7.434 4.898
385 HG2 LYS 52 2HG LYS 52 9.314 -7.771 7.637
386 HG3 LYS 52 3HG LYS 52 8.297 -9.160 7.227
387 HD2 LYS 52 2HD LYS 52 9.890 -9.510 5.229
388 HD3 LYS 52 3HD LYS 52 10.977 -8.377 6.015
389 HE2 LYS 52 2HE LYS 52 9.860 -10.897 7.341
390 HE3 LYS 52 3HE LYS 52 11.360 -10.887 6.419
391 HZ1 LYS 52 1HZ LYS 52 12.285 -9.316 7.926
392 HZ2 LYS 52 2HZ LYS 52 10.888 -9.255 8.815
393 HZ3 LYS 52 3HZ LYS 52 11.769 -10.647 8.744
394 H LYS 53 H LYS 53 6.340 -4.292 7.208
395 HA LYS 53 HA LYS 53 4.361 -6.019 8.504
396 HB2 LYS 53 2HB LYS 53 6.136 -3.978 9.920
397 HB3 LYS 53 3HB LYS 53 4.558 -4.426 10.542
398 HG2 LYS 53 2HG LYS 53 6.281 -6.786 10.009
399 HG3 LYS 53 3HG LYS 53 6.975 -5.639 11.152
400 HD2 LYS 53 2HD LYS 53 4.694 -5.685 12.363
401 HD3 LYS 53 3HD LYS 53 4.293 -7.052 11.312
402 HE2 LYS 53 2HE LYS 53 5.074 -7.897 13.422
403 HE3 LYS 53 3HE LYS 53 6.294 -8.267 12.191
404 HZ1 LYS 53 1HZ LYS 53 7.270 -7.394 14.224
405 HZ2 LYS 53 2HZ LYS 53 7.555 -6.368 12.972
406 HZ3 LYS 53 3HZ LYS 53 6.402 -5.999 14.082
407 H CYS 54 H CYS 54 2.312 -4.892 8.431
408 HA CYS 54 HA CYS 54 2.423 -2.405 6.793
409 HB2 CYS 54 2HB CYS 54 0.487 -2.976 5.976
410 HB3 CYS 54 3HB CYS 54 0.904 -4.558 6.632
411 HA PRO 55 HA PRO 55 2.596 0.343 9.813
412 HB2 PRO 55 2HB PRO 55 1.042 2.511 9.073
413 HB3 PRO 55 3HB PRO 55 2.520 1.983 8.214
414 HG2 PRO 55 2HG PRO 55 -0.360 1.319 7.533
415 HG3 PRO 55 3HG PRO 55 0.935 1.896 6.435
416 HD2 PRO 55 2HD PRO 55 0.333 -0.740 6.619
417 HD3 PRO 55 3HD PRO 55 2.039 -0.201 6.491
418 H ILE 56 H ILE 56 -0.935 0.030 9.186
419 HA ILE 56 HA ILE 56 -1.341 0.141 12.123
420 HB ILE 56 HB ILE 56 -1.945 2.272 11.120
421 HG12 ILE 56 2HG1 ILE 56 -2.887 1.707 13.203
422 HG13 ILE 56 3HG1 ILE 56 -4.094 2.537 12.232
423 HG21 ILE 56 1HG2 ILE 56 -4.251 0.912 9.703
424 HG22 ILE 56 2HG2 ILE 56 -3.857 2.634 9.753
425 HG23 ILE 56 3HG2 ILE 56 -2.770 1.511 8.920
426 HD11 ILE 56 1HD1 ILE 56 -5.175 0.775 13.450
427 HD12 ILE 56 2HD1 ILE 56 -5.161 0.291 11.749
428 HD13 ILE 56 3HD1 ILE 56 -4.008 -0.430 12.909
429 H CYS 57 H CYS 57 -0.819 -1.954 11.721
430 HA CYS 57 HA CYS 57 -3.001 -3.686 12.173
431 HB2 CYS 57 2HB CYS 57 -2.412 -5.294 10.220
432 HB3 CYS 57 3HB CYS 57 -3.640 -4.041 10.043
433 H ARG 58 H ARG 58 0.399 -3.438 10.997
434 HA ARG 58 HA ARG 58 2.314 -4.051 12.056
435 HB2 ARG 58 2HB ARG 58 0.912 -3.230 14.128
436 HB3 ARG 58 3HB ARG 58 0.824 -4.945 14.543
437 HG2 ARG 58 2HG ARG 58 3.345 -5.021 14.549
438 HG3 ARG 58 3HG ARG 58 3.349 -3.293 14.151
439 HD2 ARG 58 2HD ARG 58 1.701 -3.262 16.317
440 HD3 ARG 58 3HD ARG 58 2.664 -4.669 16.738
441 HE ARG 58 HE ARG 58 3.467 -1.849 16.508
442 HH11 ARG 58 1HH1 ARG 58 6.692 -2.359 17.794
443 HH12 ARG 58 2HH1 ARG 58 5.528 -1.195 17.289
444 HH21 ARG 58 1HH2 ARG 58 6.149 -4.667 17.705
445 HH22 ARG 58 2HH2 ARG 58 4.595 -5.142 17.103
446 H VAL 59 H VAL 59 0.434 -5.951 10.596
447 HA VAL 59 HA VAL 59 1.285 -8.574 11.691
448 HB VAL 59 HB VAL 59 -0.623 -7.793 9.440
449 HG11 VAL 59 1HG1 VAL 59 -1.379 -10.165 9.556
450 HG12 VAL 59 2HG1 VAL 59 0.292 -10.035 9.022
451 HG13 VAL 59 3HG1 VAL 59 -0.064 -10.520 10.697
452 HG21 VAL 59 1HG2 VAL 59 -1.181 -8.823 12.257
453 HG22 VAL 59 2HG2 VAL 59 -1.547 -7.199 11.648
454 HG23 VAL 59 3HG2 VAL 59 -2.403 -8.589 10.987
455 H ASP 60 H ASP 60 2.480 -9.973 10.275
456 HA ASP 60 HA ASP 60 4.531 -8.659 8.714
457 HB2 ASP 60 2HB ASP 60 4.807 -10.742 10.097
458 HB3 ASP 60 3HB ASP 60 3.782 -11.601 8.941
459 H ILE 61 H ILE 61 4.702 -8.669 6.473
460 HA ILE 61 HA ILE 61 2.299 -9.588 4.957
461 HB ILE 61 HB ILE 61 2.610 -7.797 3.444
462 HG12 ILE 61 2HG1 ILE 61 4.939 -6.858 5.179
463 HG13 ILE 61 3HG1 ILE 61 5.101 -7.615 3.585
464 HG21 ILE 61 1HG2 ILE 61 1.378 -7.478 5.713
465 HG22 ILE 61 2HG2 ILE 61 2.778 -6.488 6.165
466 HG23 ILE 61 3HG2 ILE 61 1.758 -6.034 4.767
467 HD11 ILE 61 1HD1 ILE 61 3.751 -4.999 4.225
468 HD12 ILE 61 2HD1 ILE 61 5.198 -5.293 3.221
469 HD13 ILE 61 3HD1 ILE 61 3.590 -5.866 2.668
470 H GLU 62 H GLU 62 5.675 -9.933 5.328
471 HA GLU 62 HA GLU 62 6.487 -10.542 2.692
472 HB2 GLU 62 2HB GLU 62 7.860 -10.470 4.948
473 HB3 GLU 62 3HB GLU 62 7.455 -12.188 5.039
474 HG2 GLU 62 2HG GLU 62 8.275 -12.175 2.493
475 HG3 GLU 62 3HG GLU 62 9.100 -10.695 2.977
476 H ALA 63 H ALA 63 6.086 -12.287 1.318
477 HA ALA 63 HA ALA 63 4.926 -14.751 2.427
478 HB1 ALA 63 1HB ALA 63 2.953 -13.324 2.141
479 HB2 ALA 63 2HB ALA 63 3.432 -12.946 0.472
480 HB3 ALA 63 3HB ALA 63 2.963 -14.606 0.909
481 H GLN 64 H GLN 64 6.990 -15.443 1.696
482 HA GLN 64 HA GLN 64 8.182 -16.783 0.316
483 HB2 GLN 64 2HB GLN 64 5.938 -17.215 -0.897
484 HB3 GLN 64 3HB GLN 64 6.500 -16.037 -2.099
485 HG2 GLN 64 2HG GLN 64 8.468 -17.411 -2.572
486 HG3 GLN 64 3HG GLN 64 8.028 -18.537 -1.275
487 HE21 GLN 64 1HE2 GLN 64 6.817 -20.350 -1.910
488 HE22 GLN 64 2HE2 GLN 64 5.883 -20.376 -3.400
489 H LEU 65 H LEU 65 10.105 -16.380 -0.914
490 HA LEU 65 HA LEU 65 10.436 -13.586 -1.850
491 HB2 LEU 65 2HB LEU 65 11.018 -13.955 0.612
492 HB3 LEU 65 3HB LEU 65 12.375 -14.927 0.071
493 HG LEU 65 HG LEU 65 12.217 -12.358 -1.382
494 HD11 LEU 65 1HD1 LEU 65 11.127 -11.601 0.690
495 HD12 LEU 65 2HD1 LEU 65 12.458 -12.274 1.657
496 HD13 LEU 65 3HD1 LEU 65 12.757 -10.914 0.562
497 HD21 LEU 65 1HD2 LEU 65 14.246 -13.780 -1.292
498 HD22 LEU 65 2HD2 LEU 65 14.550 -12.151 -0.646
499 HD23 LEU 65 3HD2 LEU 65 14.344 -13.515 0.467
500 HA PRO 66 HA PRO 66 12.161 -16.707 -4.720
501 HB2 PRO 66 2HB PRO 66 11.671 -15.372 -7.078
502 HB3 PRO 66 3HB PRO 66 10.425 -16.301 -6.190
503 HG2 PRO 66 2HG PRO 66 10.894 -13.312 -6.154
504 HG3 PRO 66 3HG PRO 66 9.345 -14.195 -6.281
505 HD2 PRO 66 2HD PRO 66 10.290 -13.167 -3.921
506 HD3 PRO 66 3HD PRO 66 9.312 -14.666 -3.979
507 H SER 67 H SER 67 12.648 -13.149 -5.053
508 HA SER 67 HA SER 67 15.372 -13.389 -4.339
509 HB2 SER 67 2HB SER 67 16.160 -12.088 -6.451
510 HB3 SER 67 3HB SER 67 15.970 -13.846 -6.567
511 HG SER 67 HG SER 67 13.902 -13.485 -7.457
512 H GLU 68 H GLU 68 16.146 -11.201 -3.763
513 HA GLU 68 HA GLU 68 13.909 -9.284 -3.429
514 HB2 GLU 68 2HB GLU 68 16.236 -10.036 -1.837
515 HB3 GLU 68 3HB GLU 68 16.305 -8.310 -2.227
516 HG2 GLU 68 2HG GLU 68 14.041 -7.970 -1.372
517 HG3 GLU 68 3HG GLU 68 13.840 -9.706 -1.114
518 H SER 69 H SER 69 14.462 -6.947 -3.908
519 HA SER 69 HA SER 69 16.599 -6.309 -5.705
520 HB2 SER 69 2HB SER 69 13.706 -6.443 -6.673
521 HB3 SER 69 3HB SER 69 14.941 -5.425 -7.438
522 HG SER 69 HG SER 69 15.573 -8.109 -7.006
Start of MODEL 3
1 H1 MET 1 H1 MET 1 2.246 39.587 -14.947
2 H2 MET 1 H2 MET 1 2.309 41.234 -15.077
3 H3 MET 1 H3 MET 1 1.030 40.395 -15.695
4 HA MET 1 HA MET 1 2.417 41.091 -17.469
5 HB2 MET 1 2HB MET 1 4.554 39.910 -15.735
6 HB3 MET 1 3HB MET 1 4.705 39.684 -17.489
7 HG2 MET 1 2HG MET 1 4.482 42.059 -17.896
8 HG3 MET 1 3HG MET 1 4.310 42.384 -16.164
9 HE1 MET 1 1HE MET 1 6.548 43.334 -18.639
10 HE2 MET 1 2HE MET 1 6.278 44.204 -17.109
11 HE3 MET 1 3HE MET 1 7.914 43.663 -17.553
12 H LYS 2 H LYS 2 3.683 37.782 -16.738
13 HA LYS 2 HA LYS 2 1.372 36.644 -18.150
14 HB2 LYS 2 2HB LYS 2 3.383 37.110 -19.757
15 HB3 LYS 2 3HB LYS 2 4.250 35.897 -18.812
16 HG2 LYS 2 2HG LYS 2 3.376 34.464 -20.365
17 HG3 LYS 2 3HG LYS 2 1.949 34.507 -19.321
18 HD2 LYS 2 2HD LYS 2 1.098 36.450 -20.753
19 HD3 LYS 2 3HD LYS 2 2.479 36.152 -21.828
20 HE2 LYS 2 2HE LYS 2 1.355 33.603 -21.439
21 HE3 LYS 2 3HE LYS 2 -0.059 34.660 -21.512
22 HZ1 LYS 2 1HZ LYS 2 2.066 34.448 -23.552
23 HZ2 LYS 2 2HZ LYS 2 0.530 33.878 -23.682
24 HZ3 LYS 2 3HZ LYS 2 0.800 35.501 -23.631
25 H GLN 3 H GLN 3 0.908 34.605 -17.210
26 HA GLN 3 HA GLN 3 2.677 33.223 -15.441
27 HB2 GLN 3 2HB GLN 3 1.418 33.681 -13.328
28 HB3 GLN 3 3HB GLN 3 2.356 35.040 -13.922
29 HG2 GLN 3 2HG GLN 3 0.059 35.806 -15.028
30 HG3 GLN 3 3HG GLN 3 -0.642 34.724 -13.816
31 HE21 GLN 3 1HE2 GLN 3 -0.219 35.231 -11.515
32 HE22 GLN 3 2HE2 GLN 3 0.225 36.872 -11.080
33 H ASP 4 H ASP 4 -0.791 34.061 -15.922
34 HA ASP 4 HA ASP 4 -2.558 32.874 -16.566
35 HB2 ASP 4 2HB ASP 4 -0.688 32.047 -18.277
36 HB3 ASP 4 3HB ASP 4 -0.968 30.497 -17.473
37 H GLY 5 H GLY 5 -3.235 30.041 -16.303
38 HA2 GLY 5 2HA GLY 5 -2.353 28.913 -13.888
39 HA3 GLY 5 3HA GLY 5 -3.717 29.982 -13.501
40 H GLU 6 H GLU 6 -3.648 27.014 -13.315
41 HA GLU 6 HA GLU 6 -5.918 26.375 -15.076
42 HB2 GLU 6 2HB GLU 6 -3.186 25.104 -15.074
43 HB3 GLU 6 3HB GLU 6 -4.589 24.025 -15.160
44 HG2 GLU 6 2HG GLU 6 -5.456 25.213 -17.114
45 HG3 GLU 6 3HG GLU 6 -4.090 26.340 -17.072
46 H GLU 7 H GLU 7 -7.137 24.498 -14.195
47 HA GLU 7 HA GLU 7 -6.400 23.350 -11.726
48 HB2 GLU 7 2HB GLU 7 -7.467 25.485 -10.940
49 HB3 GLU 7 3HB GLU 7 -8.930 25.069 -11.851
50 HG2 GLU 7 2HG GLU 7 -9.251 23.059 -10.485
51 HG3 GLU 7 3HG GLU 7 -7.684 23.295 -9.703
52 H GLY 8 H GLY 8 -7.535 21.418 -11.661
53 HA2 GLY 8 2HA GLY 8 -9.447 20.755 -13.845
54 HA3 GLY 8 3HA GLY 8 -7.978 19.774 -13.635
55 H THR 9 H THR 9 -9.664 17.983 -13.257
56 HA THR 9 HA THR 9 -10.466 17.954 -10.408
57 HB THR 9 HB THR 9 -12.492 16.681 -11.219
58 HG1 THR 9 1HG THR 9 -12.972 16.733 -13.354
59 HG21 THR 9 1HG2 THR 9 -12.304 19.522 -12.319
60 HG22 THR 9 2HG2 THR 9 -13.778 18.655 -11.848
61 HG23 THR 9 3HG2 THR 9 -12.590 19.119 -10.612
62 H GLU 10 H GLU 10 -10.968 15.569 -9.796
63 HA GLU 10 HA GLU 10 -9.200 13.655 -11.149
64 HB2 GLU 10 2HB GLU 10 -9.091 14.503 -8.220
65 HB3 GLU 10 3HB GLU 10 -8.453 12.952 -8.799
66 HG2 GLU 10 2HG GLU 10 -6.898 14.082 -10.303
67 HG3 GLU 10 3HG GLU 10 -7.545 15.664 -9.845
68 H GLU 11 H GLU 11 -9.718 11.421 -9.890
69 HA GLU 11 HA GLU 11 -12.490 11.334 -8.991
70 HB2 GLU 11 2HB GLU 11 -11.757 10.526 -11.658
71 HB3 GLU 11 3HB GLU 11 -12.020 9.053 -10.712
72 HG2 GLU 11 2HG GLU 11 -14.210 9.959 -9.938
73 HG3 GLU 11 3HG GLU 11 -13.949 11.410 -10.913
74 H ASP 12 H ASP 12 -12.886 9.143 -8.073
75 HA ASP 12 HA ASP 12 -12.502 7.735 -6.405
76 HB2 ASP 12 2HB ASP 12 -10.851 6.730 -7.920
77 HB3 ASP 12 3HB ASP 12 -9.601 7.745 -7.207
78 H THR 13 H THR 13 -12.157 7.827 -4.295
79 HA THR 13 HA THR 13 -10.291 9.772 -3.118
80 HB THR 13 HB THR 13 -12.981 10.433 -3.695
81 HG1 THR 13 1HG THR 13 -11.193 11.702 -3.798
82 HG21 THR 13 1HG2 THR 13 -12.615 10.557 -0.693
83 HG22 THR 13 2HG2 THR 13 -13.925 11.250 -1.665
84 HG23 THR 13 3HG2 THR 13 -13.750 9.492 -1.570
85 H GLU 14 H GLU 14 -11.259 6.713 -3.080
86 HA GLU 14 HA GLU 14 -11.464 6.369 -0.147
87 HB2 GLU 14 2HB GLU 14 -12.834 5.020 -2.504
88 HB3 GLU 14 3HB GLU 14 -12.717 4.248 -0.911
89 HG2 GLU 14 2HG GLU 14 -13.886 6.091 0.158
90 HG3 GLU 14 3HG GLU 14 -13.875 7.036 -1.334
91 H GLU 15 H GLU 15 -10.266 4.957 -3.333
92 HA GLU 15 HA GLU 15 -8.546 3.192 -1.728
93 HB2 GLU 15 2HB GLU 15 -8.727 3.433 -4.749
94 HB3 GLU 15 3HB GLU 15 -7.868 2.224 -3.795
95 HG2 GLU 15 2HG GLU 15 -10.307 1.948 -2.666
96 HG3 GLU 15 3HG GLU 15 -10.827 2.550 -4.238
97 H LYS 16 H LYS 16 -7.150 4.500 -0.662
98 HA LYS 16 HA LYS 16 -5.262 6.061 -2.362
99 HB2 LYS 16 2HB LYS 16 -5.134 7.712 -0.419
100 HB3 LYS 16 3HB LYS 16 -6.574 7.751 -1.453
101 HG2 LYS 16 2HG LYS 16 -7.936 6.689 0.089
102 HG3 LYS 16 3HG LYS 16 -6.560 6.173 1.088
103 HD2 LYS 16 2HD LYS 16 -7.770 8.011 2.168
104 HD3 LYS 16 3HD LYS 16 -6.137 8.520 1.717
105 HE2 LYS 16 2HE LYS 16 -6.954 10.210 0.512
106 HE3 LYS 16 3HE LYS 16 -7.804 9.068 -0.539
107 HZ1 LYS 16 1HZ LYS 16 -9.700 9.165 0.832
108 HZ2 LYS 16 2HZ LYS 16 -8.943 10.113 1.967
109 HZ3 LYS 16 3HZ LYS 16 -9.282 10.685 0.456
110 H CYS 17 H CYS 17 -3.219 6.031 -1.926
111 HA CYS 17 HA CYS 17 -1.929 3.782 -0.600
112 HB2 CYS 17 2HB CYS 17 -1.285 5.010 -2.713
113 HB3 CYS 17 3HB CYS 17 -0.892 6.394 -1.725
114 H THR 18 H THR 18 -1.788 3.728 1.678
115 HA THR 18 HA THR 18 -1.938 6.136 3.189
116 HB THR 18 HB THR 18 -2.487 3.735 3.945
117 HG1 THR 18 1HG THR 18 -1.126 5.654 5.517
118 HG21 THR 18 1HG2 THR 18 -0.784 2.611 5.211
119 HG22 THR 18 2HG2 THR 18 -0.104 2.898 3.581
120 HG23 THR 18 3HG2 THR 18 0.388 3.905 4.955
121 H ILE 19 H ILE 19 0.778 4.733 1.507
122 HA ILE 19 HA ILE 19 2.763 5.725 3.379
123 HB ILE 19 HB ILE 19 2.770 4.256 0.742
124 HG12 ILE 19 2HG1 ILE 19 3.937 3.385 3.407
125 HG13 ILE 19 3HG1 ILE 19 2.206 3.227 3.108
126 HG21 ILE 19 1HG2 ILE 19 4.726 5.691 0.686
127 HG22 ILE 19 2HG2 ILE 19 5.129 5.284 2.369
128 HG23 ILE 19 3HG2 ILE 19 5.267 4.055 1.093
129 HD11 ILE 19 1HD1 ILE 19 3.368 1.157 2.559
130 HD12 ILE 19 2HD1 ILE 19 2.607 1.872 1.118
131 HD13 ILE 19 3HD1 ILE 19 4.363 2.010 1.360
132 H CYS 20 H CYS 20 1.678 6.466 0.008
133 HA CYS 20 HA CYS 20 3.250 9.002 -0.131
134 HB2 CYS 20 2HB CYS 20 0.932 8.087 -1.854
135 HB3 CYS 20 3HB CYS 20 2.118 9.355 -2.182
136 H LEU 21 H LEU 21 0.316 7.966 1.411
137 HA LEU 21 HA LEU 21 -1.686 8.876 1.826
138 HB2 LEU 21 2HB LEU 21 0.103 11.230 2.497
139 HB3 LEU 21 3HB LEU 21 -1.593 11.097 2.983
140 HG LEU 21 HG LEU 21 0.504 9.002 3.702
141 HD11 LEU 21 1HD1 LEU 21 1.152 11.132 4.654
142 HD12 LEU 21 2HD1 LEU 21 -0.480 11.354 5.341
143 HD13 LEU 21 3HD1 LEU 21 0.571 10.030 5.915
144 HD21 LEU 21 1HD2 LEU 21 -2.261 9.620 4.857
145 HD22 LEU 21 2HD2 LEU 21 -1.863 8.229 3.828
146 HD23 LEU 21 3HD2 LEU 21 -1.144 8.362 5.431
147 H SER 22 H SER 22 -1.537 8.619 -0.707
148 HA SER 22 HA SER 22 -2.756 11.057 -1.870
149 HB2 SER 22 2HB SER 22 -0.436 9.502 -3.099
150 HB3 SER 22 3HB SER 22 -1.392 10.737 -3.932
151 HG SER 22 HG SER 22 0.059 11.220 -1.519
152 H ILE 23 H ILE 23 -4.408 10.505 -3.407
153 HA ILE 23 HA ILE 23 -5.601 7.998 -3.231
154 HB ILE 23 HB ILE 23 -5.786 10.470 -4.995
155 HG12 ILE 23 2HG1 ILE 23 -7.794 10.946 -3.793
156 HG13 ILE 23 3HG1 ILE 23 -7.754 9.376 -2.971
157 HG21 ILE 23 1HG2 ILE 23 -6.687 8.917 -6.457
158 HG22 ILE 23 2HG2 ILE 23 -7.508 7.977 -5.196
159 HG23 ILE 23 3HG2 ILE 23 -8.085 9.596 -5.670
160 HD11 ILE 23 1HD1 ILE 23 -7.183 11.297 -1.521
161 HD12 ILE 23 2HD1 ILE 23 -5.898 10.083 -1.606
162 HD13 ILE 23 3HD1 ILE 23 -5.762 11.621 -2.521
163 H LEU 24 H LEU 24 -5.924 6.507 -4.891
164 HA LEU 24 HA LEU 24 -3.660 6.019 -6.741
165 HB2 LEU 24 2HB LEU 24 -5.998 4.295 -5.774
166 HB3 LEU 24 3HB LEU 24 -4.642 3.708 -6.741
167 HG LEU 24 HG LEU 24 -4.310 4.928 -3.958
168 HD11 LEU 24 1HD1 LEU 24 -5.567 2.873 -3.851
169 HD12 LEU 24 2HD1 LEU 24 -4.307 2.022 -4.777
170 HD13 LEU 24 3HD1 LEU 24 -3.942 2.695 -3.159
171 HD21 LEU 24 1HD2 LEU 24 -2.340 5.249 -5.120
172 HD22 LEU 24 2HD2 LEU 24 -2.060 3.694 -4.286
173 HD23 LEU 24 3HD2 LEU 24 -2.464 3.717 -6.013
174 H GLU 25 H GLU 25 -5.262 4.350 -8.515
175 HA GLU 25 HA GLU 25 -7.613 5.713 -9.267
176 HB2 GLU 25 2HB GLU 25 -7.045 6.297 -11.560
177 HB3 GLU 25 3HB GLU 25 -5.996 7.168 -10.433
178 HG2 GLU 25 2HG GLU 25 -4.189 5.533 -10.857
179 HG3 GLU 25 3HG GLU 25 -5.250 4.684 -12.007
180 H GLU 26 H GLU 26 -8.435 4.429 -11.455
181 HA GLU 26 HA GLU 26 -8.054 1.591 -10.775
182 HB2 GLU 26 2HB GLU 26 -10.322 2.386 -11.145
183 HB3 GLU 26 3HB GLU 26 -9.902 2.972 -12.767
184 HG2 GLU 26 2HG GLU 26 -9.469 0.708 -13.547
185 HG3 GLU 26 3HG GLU 26 -9.543 0.071 -11.901
186 H GLY 27 H GLY 27 -6.425 0.497 -11.705
187 HA2 GLY 27 2HA GLY 27 -5.492 -0.546 -13.626
188 HA3 GLY 27 3HA GLY 27 -5.952 0.847 -14.615
189 H GLU 28 H GLU 28 -4.186 0.942 -11.481
190 HA GLU 28 HA GLU 28 -1.820 2.006 -12.924
191 HB2 GLU 28 2HB GLU 28 -3.480 3.511 -11.529
192 HB3 GLU 28 3HB GLU 28 -2.626 2.883 -10.136
193 HG2 GLU 28 2HG GLU 28 -0.830 3.864 -12.301
194 HG3 GLU 28 3HG GLU 28 -1.945 5.097 -11.730
195 H ASP 29 H ASP 29 0.130 1.986 -11.073
196 HA ASP 29 HA ASP 29 0.461 -0.886 -10.695
197 HB2 ASP 29 2HB ASP 29 2.229 1.506 -10.123
198 HB3 ASP 29 3HB ASP 29 2.725 -0.161 -9.892
199 H VAL 30 H VAL 30 -0.521 -1.763 -8.931
200 HA VAL 30 HA VAL 30 -0.190 -0.460 -6.305
201 HB VAL 30 HB VAL 30 -2.544 -1.041 -5.729
202 HG11 VAL 30 1HG1 VAL 30 -1.875 1.271 -6.261
203 HG12 VAL 30 2HG1 VAL 30 -2.235 0.992 -7.979
204 HG13 VAL 30 3HG1 VAL 30 -3.538 0.938 -6.780
205 HG21 VAL 30 1HG2 VAL 30 -2.940 -1.323 -8.739
206 HG22 VAL 30 2HG2 VAL 30 -3.023 -2.653 -7.563
207 HG23 VAL 30 3HG2 VAL 30 -4.204 -1.332 -7.501
208 H ARG 31 H ARG 31 -0.311 -1.955 -4.515
209 HA ARG 31 HA ARG 31 -0.074 -4.764 -5.318
210 HB2 ARG 31 2HB ARG 31 2.110 -3.165 -4.369
211 HB3 ARG 31 3HB ARG 31 1.578 -4.124 -2.982
212 HG2 ARG 31 2HG ARG 31 1.573 -6.131 -4.589
213 HG3 ARG 31 3HG ARG 31 2.506 -5.130 -5.690
214 HD2 ARG 31 2HD ARG 31 4.392 -5.078 -4.300
215 HD3 ARG 31 3HD ARG 31 3.464 -5.373 -2.829
216 HE ARG 31 HE ARG 31 4.617 -7.325 -4.584
217 HH11 ARG 31 1HH1 ARG 31 2.744 -10.056 -3.278
218 HH12 ARG 31 2HH1 ARG 31 4.001 -9.599 -4.371
219 HH21 ARG 31 1HH2 ARG 31 1.492 -8.346 -2.100
220 HH22 ARG 31 2HH2 ARG 31 2.033 -6.744 -2.253
221 H ARG 32 H ARG 32 -0.556 -6.218 -3.443
222 HA ARG 32 HA ARG 32 -2.457 -4.956 -1.532
223 HB2 ARG 32 2HB ARG 32 -3.214 -6.496 -3.622
224 HB3 ARG 32 3HB ARG 32 -2.795 -7.791 -2.506
225 HG2 ARG 32 2HG ARG 32 -4.842 -5.567 -2.108
226 HG3 ARG 32 3HG ARG 32 -5.159 -7.274 -2.420
227 HD2 ARG 32 2HD ARG 32 -3.877 -7.697 -0.163
228 HD3 ARG 32 3HD ARG 32 -4.153 -5.992 0.130
229 HE ARG 32 HE ARG 32 -6.097 -8.127 0.171
230 HH11 ARG 32 1HH1 ARG 32 -8.850 -5.968 0.606
231 HH12 ARG 32 2HH1 ARG 32 -8.329 -7.612 0.588
232 HH21 ARG 32 1HH2 ARG 32 -7.291 -4.226 0.216
233 HH22 ARG 32 2HH2 ARG 32 -5.633 -4.625 -0.071
234 H LEU 33 H LEU 33 -2.327 -5.805 0.622
235 HA LEU 33 HA LEU 33 -0.234 -7.762 1.227
236 HB2 LEU 33 2HB LEU 33 0.234 -6.060 3.118
237 HB3 LEU 33 3HB LEU 33 0.910 -5.737 1.536
238 HG LEU 33 HG LEU 33 -1.795 -4.530 2.157
239 HD11 LEU 33 1HD1 LEU 33 -0.434 -4.237 4.182
240 HD12 LEU 33 2HD1 LEU 33 0.876 -3.513 3.232
241 HD13 LEU 33 3HD1 LEU 33 -0.693 -2.688 3.358
242 HD21 LEU 33 1HD2 LEU 33 -0.871 -3.981 -0.042
243 HD22 LEU 33 2HD2 LEU 33 -0.738 -2.562 0.984
244 HD23 LEU 33 3HD2 LEU 33 0.690 -3.580 0.680
245 HA PRO 34 HA PRO 34 -3.316 -9.578 3.461
246 HB2 PRO 34 2HB PRO 34 -2.157 -10.654 5.706
247 HB3 PRO 34 3HB PRO 34 -1.795 -11.182 4.033
248 HG2 PRO 34 2HG PRO 34 -0.232 -9.274 5.771
249 HG3 PRO 34 3HG PRO 34 0.377 -10.612 4.738
250 HD2 PRO 34 2HD PRO 34 0.341 -7.950 4.012
251 HD3 PRO 34 3HD PRO 34 0.273 -9.239 2.816
252 H CYS 35 H CYS 35 -1.952 -6.875 5.072
253 HA CYS 35 HA CYS 35 -3.790 -6.415 7.295
254 HB2 CYS 35 2HB CYS 35 -1.515 -5.431 6.793
255 HB3 CYS 35 3HB CYS 35 -2.276 -4.568 5.457
256 H MET 36 H MET 36 -4.662 -7.010 4.120
257 HA MET 36 HA MET 36 -6.216 -6.395 2.706
258 HB2 MET 36 2HB MET 36 -7.805 -5.581 5.165
259 HB3 MET 36 3HB MET 36 -8.440 -5.843 3.530
260 HG2 MET 36 2HG MET 36 -7.204 -8.167 3.743
261 HG3 MET 36 3HG MET 36 -7.330 -7.867 5.469
262 HE1 MET 36 1HE MET 36 -11.220 -7.720 6.013
263 HE2 MET 36 2HE MET 36 -9.624 -7.737 6.797
264 HE3 MET 36 3HE MET 36 -10.101 -6.361 5.773
265 H HIS 37 H HIS 37 -4.143 -4.584 3.166
266 HA HIS 37 HA HIS 37 -5.447 -1.965 2.708
267 HB2 HIS 37 1HB HIS 37 -2.971 -2.810 4.159
268 HB3 HIS 37 2HB HIS 37 -2.731 -1.482 3.048
269 HD2 HIS 37 2HD HIS 37 -5.587 -0.063 3.509
270 HE1 HIS 37 1HE HIS 37 -4.349 0.625 7.498
271 HE2 HIS 37 2HE HIS 37 -6.009 1.279 5.676
272 H LEU 38 H LEU 38 -4.502 -0.670 0.828
273 HA LEU 38 HA LEU 38 -3.396 -2.367 -1.346
274 HB2 LEU 38 2HB LEU 38 -5.868 -2.365 -1.677
275 HB3 LEU 38 3HB LEU 38 -5.896 -0.619 -1.447
276 HG LEU 38 HG LEU 38 -4.224 -0.568 -3.519
277 HD11 LEU 38 1HD1 LEU 38 -4.637 -2.365 -5.120
278 HD12 LEU 38 2HD1 LEU 38 -3.907 -3.023 -3.646
279 HD13 LEU 38 3HD1 LEU 38 -5.654 -3.219 -3.949
280 HD21 LEU 38 1HD2 LEU 38 -6.486 0.387 -3.491
281 HD22 LEU 38 2HD2 LEU 38 -6.108 -0.375 -5.040
282 HD23 LEU 38 3HD2 LEU 38 -7.171 -1.199 -3.879
283 H PHE 39 H PHE 39 -1.564 -1.252 -1.871
284 HA PHE 39 HA PHE 39 -1.633 1.746 -1.783
285 HB2 PHE 39 2HB PHE 39 0.526 -0.122 -0.808
286 HB3 PHE 39 3HB PHE 39 0.651 1.640 -0.785
287 HD1 PHE 39 1HD PHE 39 -2.374 1.932 0.380
288 HD2 PHE 39 2HD PHE 39 1.122 -0.303 1.516
289 HE1 PHE 39 1HE PHE 39 -3.210 1.804 2.680
290 HE2 PHE 39 2HE PHE 39 0.299 -0.405 3.838
291 HZ PHE 39 HZ PHE 39 -1.867 0.656 4.433
292 H HIS 40 H HIS 40 0.735 2.432 -2.939
293 HA HIS 40 HA HIS 40 0.434 1.436 -5.670
294 HB2 HIS 40 1HB HIS 40 2.568 3.156 -4.381
295 HB3 HIS 40 2HB HIS 40 2.595 2.700 -6.074
296 HD2 HIS 40 2HD HIS 40 0.429 3.537 -7.635
297 HE1 HIS 40 1HE HIS 40 -0.004 7.101 -5.346
298 HE2 HIS 40 2HE HIS 40 -0.559 5.886 -7.593
299 H GLN 41 H GLN 41 1.863 0.118 -6.834
300 HA GLN 41 HA GLN 41 3.663 -1.758 -5.593
301 HB2 GLN 41 2HB GLN 41 2.335 -1.330 -8.116
302 HB3 GLN 41 3HB GLN 41 4.042 -1.512 -8.454
303 HG2 GLN 41 2HG GLN 41 4.006 -3.622 -7.092
304 HG3 GLN 41 3HG GLN 41 2.255 -3.374 -6.886
305 HE21 GLN 41 1HE2 GLN 41 0.865 -4.212 -8.508
306 HE22 GLN 41 2HE2 GLN 41 1.485 -4.754 -10.061
307 H VAL 42 H VAL 42 4.293 1.216 -5.370
308 HA VAL 42 HA VAL 42 7.168 0.909 -6.032
309 HB VAL 42 HB VAL 42 5.614 3.518 -6.352
310 HG11 VAL 42 1HG1 VAL 42 8.545 2.820 -6.851
311 HG12 VAL 42 2HG1 VAL 42 7.772 4.372 -7.235
312 HG13 VAL 42 3HG1 VAL 42 7.931 3.862 -5.548
313 HG21 VAL 42 1HG2 VAL 42 6.849 1.649 -8.422
314 HG22 VAL 42 2HG2 VAL 42 5.128 2.042 -8.242
315 HG23 VAL 42 3HG2 VAL 42 6.262 3.292 -8.764
316 H CYS 43 H CYS 43 4.942 3.178 -4.321
317 HA CYS 43 HA CYS 43 6.336 3.751 -1.999
318 HB2 CYS 43 2HB CYS 43 3.389 3.023 -2.130
319 HB3 CYS 43 3HB CYS 43 4.204 4.078 -0.985
320 H VAL 44 H VAL 44 4.038 0.930 -2.318
321 HA VAL 44 HA VAL 44 4.969 0.015 0.235
322 HB VAL 44 HB VAL 44 2.620 -0.100 -0.752
323 HG11 VAL 44 1HG1 VAL 44 3.442 -1.598 -2.743
324 HG12 VAL 44 2HG1 VAL 44 3.517 -2.888 -1.552
325 HG13 VAL 44 3HG1 VAL 44 1.961 -2.079 -1.879
326 HG21 VAL 44 1HG2 VAL 44 3.369 -0.916 1.446
327 HG22 VAL 44 2HG2 VAL 44 2.192 -2.041 0.727
328 HG23 VAL 44 3HG2 VAL 44 3.917 -2.428 0.709
329 H ASP 45 H ASP 45 5.991 -0.489 -2.970
330 HA ASP 45 HA ASP 45 6.957 -3.190 -2.658
331 HB2 ASP 45 2HB ASP 45 6.682 -1.543 -4.786
332 HB3 ASP 45 3HB ASP 45 8.410 -1.320 -4.503
333 H GLN 46 H GLN 46 8.583 0.021 -2.541
334 HA GLN 46 HA GLN 46 10.906 -0.999 -1.189
335 HB2 GLN 46 2HB GLN 46 9.702 1.808 -1.349
336 HB3 GLN 46 3HB GLN 46 11.250 1.461 -0.569
337 HG2 GLN 46 2HG GLN 46 10.615 0.887 -3.499
338 HG3 GLN 46 3HG GLN 46 11.514 2.285 -2.905
339 HE21 GLN 46 1HE2 GLN 46 13.524 1.696 -1.438
340 HE22 GLN 46 2HE2 GLN 46 14.430 0.305 -2.023
341 H ALA 47 H ALA 47 7.764 0.123 0.087
342 HA ALA 47 HA ALA 47 8.645 0.242 2.777
343 HB1 ALA 47 1HB ALA 47 5.972 -0.813 1.846
344 HB2 ALA 47 2HB ALA 47 6.341 -0.022 3.391
345 HB3 ALA 47 3HB ALA 47 6.409 0.924 1.883
346 H LEU 48 H LEU 48 7.404 -2.593 0.932
347 HA LEU 48 HA LEU 48 7.512 -4.469 3.031
348 HB2 LEU 48 2HB LEU 48 6.224 -4.649 0.926
349 HB3 LEU 48 3HB LEU 48 7.702 -4.866 0.001
350 HG LEU 48 HG LEU 48 6.925 -6.752 2.267
351 HD11 LEU 48 1HD1 LEU 48 6.207 -7.023 -0.681
352 HD12 LEU 48 2HD1 LEU 48 5.839 -8.185 0.617
353 HD13 LEU 48 3HD1 LEU 48 5.059 -6.597 0.604
354 HD21 LEU 48 1HD2 LEU 48 9.214 -7.123 1.526
355 HD22 LEU 48 2HD2 LEU 48 8.210 -8.409 0.877
356 HD23 LEU 48 3HD2 LEU 48 8.713 -7.075 -0.181
357 H ILE 49 H ILE 49 9.865 -3.872 0.321
358 HA ILE 49 HA ILE 49 11.704 -5.793 1.283
359 HB ILE 49 HB ILE 49 13.310 -4.900 -0.195
360 HG12 ILE 49 2HG1 ILE 49 12.427 -2.675 -1.495
361 HG13 ILE 49 3HG1 ILE 49 11.970 -2.333 0.182
362 HG21 ILE 49 1HG2 ILE 49 11.350 -6.084 -1.158
363 HG22 ILE 49 2HG2 ILE 49 10.632 -4.509 -1.552
364 HG23 ILE 49 3HG2 ILE 49 12.165 -4.986 -2.283
365 HD11 ILE 49 1HD1 ILE 49 14.740 -3.062 -0.816
366 HD12 ILE 49 2HD1 ILE 49 14.198 -1.476 -0.226
367 HD13 ILE 49 3HD1 ILE 49 14.311 -2.847 0.895
368 H THR 50 H THR 50 11.300 -2.360 2.208
369 HA THR 50 HA THR 50 13.668 -2.315 3.802
370 HB THR 50 HB THR 50 11.157 -0.604 3.697
371 HG1 THR 50 1HG THR 50 13.865 -0.295 2.895
372 HG21 THR 50 1HG2 THR 50 12.434 1.078 5.032
373 HG22 THR 50 2HG2 THR 50 11.947 -0.337 5.973
374 HG23 THR 50 3HG2 THR 50 13.632 -0.179 5.420
375 H ASN 51 H ASN 51 10.265 -3.228 4.468
376 HA ASN 51 HA ASN 51 11.091 -4.702 6.728
377 HB2 ASN 51 2HB ASN 51 9.858 -3.635 8.519
378 HB3 ASN 51 3HB ASN 51 11.158 -2.622 7.935
379 HD21 ASN 51 1HD2 ASN 51 8.707 -2.123 5.625
380 HD22 ASN 51 2HD2 ASN 51 7.989 -0.746 6.419
381 H LYS 52 H LYS 52 9.847 -6.423 6.803
382 HA LYS 52 HA LYS 52 7.387 -6.657 5.285
383 HB2 LYS 52 2HB LYS 52 7.444 -8.928 6.037
384 HB3 LYS 52 3HB LYS 52 8.978 -8.431 5.334
385 HG2 LYS 52 2HG LYS 52 10.153 -8.704 7.285
386 HG3 LYS 52 3HG LYS 52 8.880 -8.005 8.290
387 HD2 LYS 52 2HD LYS 52 7.541 -10.140 7.846
388 HD3 LYS 52 3HD LYS 52 9.031 -10.794 7.166
389 HE2 LYS 52 2HE LYS 52 9.116 -11.549 9.377
390 HE3 LYS 52 3HE LYS 52 10.104 -10.073 9.450
391 HZ1 LYS 52 1HZ LYS 52 8.531 -10.067 11.238
392 HZ2 LYS 52 2HZ LYS 52 7.964 -8.958 10.128
393 HZ3 LYS 52 3HZ LYS 52 7.295 -10.444 10.228
394 H LYS 53 H LYS 53 6.475 -4.711 6.730
395 HA LYS 53 HA LYS 53 4.604 -5.972 8.590
396 HB2 LYS 53 2HB LYS 53 5.125 -4.397 10.431
397 HB3 LYS 53 3HB LYS 53 6.465 -5.472 10.060
398 HG2 LYS 53 2HG LYS 53 7.722 -3.597 10.107
399 HG3 LYS 53 3HG LYS 53 7.169 -3.387 8.462
400 HD2 LYS 53 2HD LYS 53 6.486 -1.345 9.129
401 HD3 LYS 53 3HD LYS 53 5.120 -2.159 9.905
402 HE2 LYS 53 2HE LYS 53 6.485 -2.409 11.985
403 HE3 LYS 53 3HE LYS 53 7.848 -1.618 11.170
404 HZ1 LYS 53 1HZ LYS 53 6.522 0.356 10.961
405 HZ2 LYS 53 2HZ LYS 53 5.242 -0.355 11.723
406 HZ3 LYS 53 3HZ LYS 53 6.646 -0.074 12.541
407 H CYS 54 H CYS 54 2.616 -5.085 8.101
408 HA CYS 54 HA CYS 54 2.402 -2.890 6.190
409 HB2 CYS 54 2HB CYS 54 0.755 -4.709 6.365
410 HB3 CYS 54 3HB CYS 54 0.298 -4.169 7.980
411 HA PRO 55 HA PRO 55 2.321 0.276 9.378
412 HB2 PRO 55 2HB PRO 55 1.544 2.432 7.897
413 HB3 PRO 55 3HB PRO 55 3.197 1.745 7.827
414 HG2 PRO 55 2HG PRO 55 0.878 1.175 5.962
415 HG3 PRO 55 3HG PRO 55 2.557 1.637 5.522
416 HD2 PRO 55 2HD PRO 55 1.724 -0.955 5.554
417 HD3 PRO 55 3HD PRO 55 3.376 -0.515 6.084
418 H ILE 56 H ILE 56 0.840 1.532 10.341
419 HA ILE 56 HA ILE 56 -0.890 1.402 11.781
420 HB ILE 56 HB ILE 56 -2.288 2.248 9.225
421 HG12 ILE 56 2HG1 ILE 56 -0.206 3.554 9.619
422 HG13 ILE 56 3HG1 ILE 56 -1.659 4.519 9.759
423 HG21 ILE 56 1HG2 ILE 56 -2.946 2.743 12.164
424 HG22 ILE 56 2HG2 ILE 56 -3.661 3.656 10.815
425 HG23 ILE 56 3HG2 ILE 56 -3.946 1.918 10.956
426 HD11 ILE 56 1HD1 ILE 56 -1.497 4.513 12.213
427 HD12 ILE 56 2HD1 ILE 56 -0.075 3.443 12.139
428 HD13 ILE 56 3HD1 ILE 56 0.006 5.087 11.488
429 H CYS 57 H CYS 57 -0.332 -0.876 11.718
430 HA CYS 57 HA CYS 57 -2.581 -2.773 11.691
431 HB2 CYS 57 2HB CYS 57 -0.376 -2.882 9.608
432 HB3 CYS 57 3HB CYS 57 -1.237 -4.316 10.188
433 H ARG 58 H ARG 58 0.977 -2.689 11.219
434 HA ARG 58 HA ARG 58 2.677 -3.785 12.213
435 HB2 ARG 58 2HB ARG 58 1.927 -2.506 14.303
436 HB3 ARG 58 3HB ARG 58 1.076 -3.979 14.785
437 HG2 ARG 58 2HG ARG 58 3.372 -5.182 14.477
438 HG3 ARG 58 3HG ARG 58 4.063 -3.554 14.422
439 HD2 ARG 58 2HD ARG 58 3.068 -3.074 16.649
440 HD3 ARG 58 3HD ARG 58 2.343 -4.699 16.663
441 HE ARG 58 HE ARG 58 5.149 -4.907 16.241
442 HH11 ARG 58 1HH1 ARG 58 5.967 -5.578 19.604
443 HH12 ARG 58 2HH1 ARG 58 6.522 -5.640 17.974
444 HH21 ARG 58 1HH2 ARG 58 3.801 -4.736 20.086
445 HH22 ARG 58 2HH2 ARG 58 2.810 -4.193 18.779
446 H VAL 59 H VAL 59 1.381 -5.235 10.506
447 HA VAL 59 HA VAL 59 1.160 -7.904 11.781
448 HB VAL 59 HB VAL 59 -0.579 -6.809 9.521
449 HG11 VAL 59 1HG1 VAL 59 -1.762 -9.005 9.726
450 HG12 VAL 59 2HG1 VAL 59 -0.111 -9.186 9.142
451 HG13 VAL 59 3HG1 VAL 59 -0.498 -9.566 10.839
452 HG21 VAL 59 1HG2 VAL 59 -1.312 -6.015 11.773
453 HG22 VAL 59 2HG2 VAL 59 -2.445 -7.204 11.130
454 HG23 VAL 59 3HG2 VAL 59 -1.269 -7.679 12.375
455 H ASP 60 H ASP 60 2.022 -9.573 10.456
456 HA ASP 60 HA ASP 60 4.347 -8.781 8.924
457 HB2 ASP 60 2HB ASP 60 4.077 -10.847 10.399
458 HB3 ASP 60 3HB ASP 60 3.026 -11.523 9.145
459 H ILE 61 H ILE 61 4.574 -8.786 6.680
460 HA ILE 61 HA ILE 61 2.188 -9.587 5.087
461 HB ILE 61 HB ILE 61 2.738 -7.854 3.535
462 HG12 ILE 61 2HG1 ILE 61 4.917 -6.954 5.473
463 HG13 ILE 61 3HG1 ILE 61 5.255 -7.878 3.997
464 HG21 ILE 61 1HG2 ILE 61 1.872 -6.047 4.757
465 HG22 ILE 61 2HG2 ILE 61 1.387 -7.427 5.757
466 HG23 ILE 61 3HG2 ILE 61 2.801 -6.483 6.224
467 HD11 ILE 61 1HD1 ILE 61 5.527 -5.560 3.522
468 HD12 ILE 61 2HD1 ILE 61 4.079 -6.208 2.675
469 HD13 ILE 61 3HD1 ILE 61 3.894 -5.192 4.129
470 H GLU 62 H GLU 62 5.404 -10.251 5.652
471 HA GLU 62 HA GLU 62 6.394 -11.125 3.084
472 HB2 GLU 62 2HB GLU 62 7.151 -11.304 5.897
473 HB3 GLU 62 3HB GLU 62 7.330 -12.881 5.158
474 HG2 GLU 62 2HG GLU 62 8.463 -10.362 3.875
475 HG3 GLU 62 3HG GLU 62 9.356 -11.285 5.085
476 H ALA 63 H ALA 63 4.482 -12.639 5.669
477 HA ALA 63 HA ALA 63 3.035 -14.408 5.670
478 HB1 ALA 63 1HB ALA 63 1.924 -12.890 4.068
479 HB2 ALA 63 2HB ALA 63 2.732 -13.725 2.723
480 HB3 ALA 63 3HB ALA 63 1.566 -14.598 3.732
481 H GLN 64 H GLN 64 5.863 -15.001 4.989
482 HA GLN 64 HA GLN 64 6.667 -17.168 5.491
483 HB2 GLN 64 2HB GLN 64 4.614 -18.409 4.885
484 HB3 GLN 64 3HB GLN 64 5.015 -18.229 3.158
485 HG2 GLN 64 2HG GLN 64 6.901 -19.626 3.321
486 HG3 GLN 64 3HG GLN 64 7.028 -19.425 5.074
487 HE21 GLN 64 1HE2 GLN 64 5.643 -20.658 6.495
488 HE22 GLN 64 2HE2 GLN 64 4.745 -22.022 5.843
489 H LEU 65 H LEU 65 8.721 -17.415 4.810
490 HA LEU 65 HA LEU 65 9.869 -15.602 3.153
491 HB2 LEU 65 2HB LEU 65 11.034 -17.008 4.843
492 HB3 LEU 65 3HB LEU 65 10.880 -18.399 3.764
493 HG LEU 65 HG LEU 65 12.188 -16.974 2.024
494 HD11 LEU 65 1HD1 LEU 65 12.919 -15.454 4.570
495 HD12 LEU 65 2HD1 LEU 65 13.651 -15.246 2.963
496 HD13 LEU 65 3HD1 LEU 65 11.961 -14.789 3.233
497 HD21 LEU 65 1HD2 LEU 65 13.141 -18.911 3.174
498 HD22 LEU 65 2HD2 LEU 65 14.344 -17.622 3.038
499 HD23 LEU 65 3HD2 LEU 65 13.530 -17.909 4.596
500 HA PRO 66 HA PRO 66 8.587 -17.398 -0.778
501 HB2 PRO 66 2HB PRO 66 9.181 -15.285 -2.425
502 HB3 PRO 66 3HB PRO 66 7.767 -15.305 -1.326
503 HG2 PRO 66 2HG PRO 66 10.459 -13.993 -0.865
504 HG3 PRO 66 3HG PRO 66 8.828 -13.314 -0.583
505 HD2 PRO 66 2HD PRO 66 10.330 -14.428 1.413
506 HD3 PRO 66 3HD PRO 66 8.544 -14.548 1.389
507 H SER 67 H SER 67 11.714 -15.663 -0.391
508 HA SER 67 HA SER 67 13.189 -17.968 -1.189
509 HB2 SER 67 2HB SER 67 12.534 -17.248 -3.457
510 HB3 SER 67 3HB SER 67 13.193 -15.634 -3.156
511 HG SER 67 HG SER 67 14.710 -16.916 -4.230
512 H GLU 68 H GLU 68 14.360 -14.628 -1.900
513 HA GLU 68 HA GLU 68 15.234 -14.220 0.830
514 HB2 GLU 68 2HB GLU 68 17.598 -13.876 0.092
515 HB3 GLU 68 3HB GLU 68 17.081 -15.555 0.108
516 HG2 GLU 68 2HG GLU 68 17.601 -15.843 -2.045
517 HG3 GLU 68 3HG GLU 68 16.595 -14.505 -2.559
518 H SER 69 H SER 69 15.345 -12.039 1.211
519 HA SER 69 HA SER 69 14.654 -9.913 0.945
520 HB2 SER 69 2HB SER 69 15.874 -8.751 -1.129
521 HB3 SER 69 3HB SER 69 16.704 -9.186 0.365
522 HG SER 69 HG SER 69 16.575 -10.964 -1.825
Start of MODEL 4
1 H1 MET 1 H1 MET 1 -15.615 40.225 -21.694
2 H2 MET 1 H2 MET 1 -14.906 40.867 -23.040
3 H3 MET 1 H3 MET 1 -14.059 40.753 -21.630
4 HA MET 1 HA MET 1 -14.703 42.992 -22.010
5 HB2 MET 1 2HB MET 1 -17.502 41.829 -22.072
6 HB3 MET 1 3HB MET 1 -17.165 43.537 -21.713
7 HG2 MET 1 2HG MET 1 -15.925 43.762 -23.827
8 HG3 MET 1 3HG MET 1 -16.284 42.079 -24.233
9 HE1 MET 1 1HE MET 1 -18.409 44.253 -26.755
10 HE2 MET 1 2HE MET 1 -16.841 44.707 -26.052
11 HE3 MET 1 3HE MET 1 -17.124 43.034 -26.595
12 H LYS 2 H LYS 2 -17.336 41.856 -19.790
13 HA LYS 2 HA LYS 2 -15.420 42.291 -17.566
14 HB2 LYS 2 2HB LYS 2 -16.625 44.445 -18.455
15 HB3 LYS 2 3HB LYS 2 -18.053 43.792 -17.657
16 HG2 LYS 2 2HG LYS 2 -16.545 43.587 -15.539
17 HG3 LYS 2 3HG LYS 2 -15.358 44.538 -16.456
18 HD2 LYS 2 2HD LYS 2 -17.287 46.226 -16.849
19 HD3 LYS 2 3HD LYS 2 -18.146 45.348 -15.564
20 HE2 LYS 2 2HE LYS 2 -16.232 45.771 -14.024
21 HE3 LYS 2 3HE LYS 2 -15.379 46.618 -15.324
22 HZ1 LYS 2 1HZ LYS 2 -17.940 47.458 -14.120
23 HZ2 LYS 2 2HZ LYS 2 -16.476 48.170 -13.880
24 HZ3 LYS 2 3HZ LYS 2 -17.183 48.228 -15.363
25 H GLN 3 H GLN 3 -15.960 39.799 -17.730
26 HA GLN 3 HA GLN 3 -17.705 39.347 -15.498
27 HB2 GLN 3 2HB GLN 3 -19.049 39.068 -17.886
28 HB3 GLN 3 3HB GLN 3 -18.283 37.479 -17.781
29 HG2 GLN 3 2HG GLN 3 -19.198 37.542 -15.284
30 HG3 GLN 3 3HG GLN 3 -20.288 38.779 -15.922
31 HE21 GLN 3 1HE2 GLN 3 -21.426 38.007 -18.163
32 HE22 GLN 3 2HE2 GLN 3 -21.952 36.328 -18.088
33 H ASP 4 H ASP 4 -16.845 37.477 -14.363
34 HA ASP 4 HA ASP 4 -15.326 35.445 -15.613
35 HB2 ASP 4 2HB ASP 4 -13.833 37.832 -15.048
36 HB3 ASP 4 3HB ASP 4 -13.494 36.763 -13.701
37 H GLY 5 H GLY 5 -14.745 33.784 -13.822
38 HA2 GLY 5 2HA GLY 5 -14.630 33.999 -11.222
39 HA3 GLY 5 3HA GLY 5 -16.368 34.279 -11.385
40 H GLU 6 H GLU 6 -14.001 31.874 -10.960
41 HA GLU 6 HA GLU 6 -16.007 29.767 -11.428
42 HB2 GLU 6 2HB GLU 6 -13.097 29.658 -12.367
43 HB3 GLU 6 3HB GLU 6 -14.223 28.306 -12.336
44 HG2 GLU 6 2HG GLU 6 -14.597 28.816 -14.471
45 HG3 GLU 6 3HG GLU 6 -15.708 30.013 -13.831
46 H GLU 7 H GLU 7 -15.068 27.677 -10.396
47 HA GLU 7 HA GLU 7 -13.278 28.101 -8.129
48 HB2 GLU 7 2HB GLU 7 -15.482 28.770 -7.251
49 HB3 GLU 7 3HB GLU 7 -16.165 27.220 -7.734
50 HG2 GLU 7 2HG GLU 7 -14.572 26.074 -6.161
51 HG3 GLU 7 3HG GLU 7 -13.884 27.641 -5.737
52 H GLY 8 H GLY 8 -15.382 25.418 -7.972
53 HA2 GLY 8 2HA GLY 8 -15.235 23.383 -9.398
54 HA3 GLY 8 3HA GLY 8 -13.495 23.703 -9.550
55 H THR 9 H THR 9 -14.626 21.230 -8.461
56 HA THR 9 HA THR 9 -13.141 21.227 -5.992
57 HB THR 9 HB THR 9 -15.310 21.954 -5.140
58 HG1 THR 9 1HG THR 9 -15.594 19.936 -3.820
59 HG21 THR 9 1HG2 THR 9 -16.359 19.362 -6.336
60 HG22 THR 9 2HG2 THR 9 -17.272 20.501 -5.317
61 HG23 THR 9 3HG2 THR 9 -16.723 20.996 -6.929
62 H GLU 10 H GLU 10 -12.756 18.955 -5.302
63 HA GLU 10 HA GLU 10 -13.783 16.807 -6.848
64 HB2 GLU 10 2HB GLU 10 -11.837 17.793 -8.310
65 HB3 GLU 10 3HB GLU 10 -10.766 17.144 -7.060
66 HG2 GLU 10 2HG GLU 10 -11.820 14.881 -7.417
67 HG3 GLU 10 3HG GLU 10 -12.835 15.587 -8.680
68 H GLU 11 H GLU 11 -13.434 14.821 -5.558
69 HA GLU 11 HA GLU 11 -11.605 14.930 -3.316
70 HB2 GLU 11 2HB GLU 11 -13.352 14.641 -1.616
71 HB3 GLU 11 3HB GLU 11 -13.515 16.193 -2.433
72 HG2 GLU 11 2HG GLU 11 -15.276 15.000 -3.952
73 HG3 GLU 11 3HG GLU 11 -15.255 13.723 -2.730
74 H ASP 12 H ASP 12 -11.064 12.759 -2.712
75 HA ASP 12 HA ASP 12 -12.734 10.521 -3.376
76 HB2 ASP 12 2HB ASP 12 -11.594 11.095 -5.593
77 HB3 ASP 12 3HB ASP 12 -10.046 10.810 -4.802
78 H THR 13 H THR 13 -12.096 8.878 -1.883
79 HA THR 13 HA THR 13 -9.336 8.908 -0.914
80 HB THR 13 HB THR 13 -11.473 8.860 1.236
81 HG1 THR 13 1HG THR 13 -10.351 11.064 -0.054
82 HG21 THR 13 1HG2 THR 13 -9.607 9.595 2.665
83 HG22 THR 13 2HG2 THR 13 -9.142 8.109 1.827
84 HG23 THR 13 3HG2 THR 13 -8.531 9.676 1.258
85 H GLU 14 H GLU 14 -11.364 7.168 -2.510
86 HA GLU 14 HA GLU 14 -11.876 4.940 -0.731
87 HB2 GLU 14 2HB GLU 14 -12.370 5.590 -3.657
88 HB3 GLU 14 3HB GLU 14 -12.434 3.916 -3.112
89 HG2 GLU 14 2HG GLU 14 -14.633 4.607 -2.973
90 HG3 GLU 14 3HG GLU 14 -14.070 4.605 -1.312
91 H GLU 15 H GLU 15 -9.853 5.417 -3.661
92 HA GLU 15 HA GLU 15 -8.225 3.062 -2.802
93 HB2 GLU 15 2HB GLU 15 -7.458 3.100 -5.197
94 HB3 GLU 15 3HB GLU 15 -9.121 2.600 -4.900
95 HG2 GLU 15 2HG GLU 15 -10.045 4.595 -5.756
96 HG3 GLU 15 3HG GLU 15 -8.537 5.493 -5.604
97 H LYS 16 H LYS 16 -7.212 4.459 -1.186
98 HA LYS 16 HA LYS 16 -5.240 6.290 -2.459
99 HB2 LYS 16 2HB LYS 16 -7.014 6.808 -0.310
100 HB3 LYS 16 3HB LYS 16 -5.411 6.665 0.426
101 HG2 LYS 16 2HG LYS 16 -4.621 8.168 -1.550
102 HG3 LYS 16 3HG LYS 16 -6.338 8.510 -1.784
103 HD2 LYS 16 2HD LYS 16 -6.352 9.290 0.658
104 HD3 LYS 16 3HD LYS 16 -4.573 9.169 0.583
105 HE2 LYS 16 2HE LYS 16 -4.706 10.564 -1.565
106 HE3 LYS 16 3HE LYS 16 -6.413 10.836 -1.205
107 HZ1 LYS 16 1HZ LYS 16 -5.659 11.829 0.923
108 HZ2 LYS 16 2HZ LYS 16 -4.088 11.655 0.423
109 HZ3 LYS 16 3HZ LYS 16 -5.097 12.643 -0.397
110 H CYS 17 H CYS 17 -3.210 6.209 -2.051
111 HA CYS 17 HA CYS 17 -1.890 3.744 -1.024
112 HB2 CYS 17 2HB CYS 17 -1.245 5.057 -3.109
113 HB3 CYS 17 3HB CYS 17 -0.776 6.364 -2.045
114 H THR 18 H THR 18 -1.464 3.624 1.217
115 HA THR 18 HA THR 18 -1.776 5.989 2.834
116 HB THR 18 HB THR 18 -2.180 3.535 3.490
117 HG1 THR 18 1HG THR 18 -2.445 5.174 4.947
118 HG21 THR 18 1HG2 THR 18 -0.381 2.415 4.615
119 HG22 THR 18 2HG2 THR 18 0.200 2.803 2.979
120 HG23 THR 18 3HG2 THR 18 0.715 3.777 4.382
121 H ILE 19 H ILE 19 0.983 4.542 1.162
122 HA ILE 19 HA ILE 19 2.942 5.776 2.865
123 HB ILE 19 HB ILE 19 2.960 4.305 0.226
124 HG12 ILE 19 2HG1 ILE 19 4.327 3.211 2.645
125 HG13 ILE 19 3HG1 ILE 19 2.578 3.333 2.793
126 HG21 ILE 19 1HG2 ILE 19 5.463 4.124 0.647
127 HG22 ILE 19 2HG2 ILE 19 4.878 5.734 0.165
128 HG23 ILE 19 3HG2 ILE 19 5.263 5.400 1.870
129 HD11 ILE 19 1HD1 ILE 19 4.011 1.969 0.488
130 HD12 ILE 19 2HD1 ILE 19 3.237 1.150 1.867
131 HD13 ILE 19 3HD1 ILE 19 2.251 2.081 0.720
132 H CYS 20 H CYS 20 1.778 6.367 -0.511
133 HA CYS 20 HA CYS 20 3.306 8.935 -0.734
134 HB2 CYS 20 2HB CYS 20 1.104 7.903 -2.540
135 HB3 CYS 20 3HB CYS 20 2.326 9.138 -2.862
136 H LEU 21 H LEU 21 0.359 7.894 0.717
137 HA LEU 21 HA LEU 21 -1.622 8.822 1.185
138 HB2 LEU 21 2HB LEU 21 0.181 11.206 1.637
139 HB3 LEU 21 3HB LEU 21 -1.487 11.102 2.216
140 HG LEU 21 HG LEU 21 0.626 9.020 2.902
141 HD11 LEU 21 1HD1 LEU 21 1.392 11.142 3.759
142 HD12 LEU 21 2HD1 LEU 21 -0.194 11.446 4.518
143 HD13 LEU 21 3HD1 LEU 21 0.835 10.103 5.079
144 HD21 LEU 21 1HD2 LEU 21 -1.735 8.278 3.198
145 HD22 LEU 21 2HD2 LEU 21 -0.929 8.471 4.748
146 HD23 LEU 21 3HD2 LEU 21 -2.062 9.722 4.187
147 H SER 22 H SER 22 -1.155 8.624 -1.553
148 HA SER 22 HA SER 22 -2.715 10.905 -2.652
149 HB2 SER 22 2HB SER 22 -0.309 11.142 -3.240
150 HB3 SER 22 3HB SER 22 -0.344 9.530 -3.985
151 HG SER 22 HG SER 22 -1.630 10.278 -5.580
152 H ILE 23 H ILE 23 -4.018 10.301 -4.503
153 HA ILE 23 HA ILE 23 -5.280 7.745 -4.224
154 HB ILE 23 HB ILE 23 -5.503 10.190 -5.997
155 HG12 ILE 23 2HG1 ILE 23 -6.341 10.191 -3.591
156 HG13 ILE 23 3HG1 ILE 23 -7.506 10.655 -4.825
157 HG21 ILE 23 1HG2 ILE 23 -6.171 8.550 -7.525
158 HG22 ILE 23 2HG2 ILE 23 -7.124 7.656 -6.319
159 HG23 ILE 23 3HG2 ILE 23 -7.650 9.260 -6.880
160 HD11 ILE 23 1HD1 ILE 23 -8.597 8.486 -4.737
161 HD12 ILE 23 2HD1 ILE 23 -7.362 7.840 -3.655
162 HD13 ILE 23 3HD1 ILE 23 -8.452 9.115 -3.093
163 H LEU 24 H LEU 24 -5.552 6.236 -5.893
164 HA LEU 24 HA LEU 24 -3.160 5.632 -7.517
165 HB2 LEU 24 2HB LEU 24 -5.557 3.980 -6.568
166 HB3 LEU 24 3HB LEU 24 -4.103 3.333 -7.345
167 HG LEU 24 HG LEU 24 -4.094 4.788 -4.649
168 HD11 LEU 24 1HD1 LEU 24 -3.810 1.846 -5.269
169 HD12 LEU 24 2HD1 LEU 24 -3.675 2.642 -3.668
170 HD13 LEU 24 3HD1 LEU 24 -5.226 2.634 -4.534
171 HD21 LEU 24 1HD2 LEU 24 -1.764 3.649 -4.686
172 HD22 LEU 24 2HD2 LEU 24 -2.014 3.546 -6.444
173 HD23 LEU 24 3HD2 LEU 24 -2.034 5.136 -5.646
174 H GLU 25 H GLU 25 -4.961 3.720 -9.089
175 HA GLU 25 HA GLU 25 -7.090 5.237 -10.081
176 HB2 GLU 25 2HB GLU 25 -6.583 5.780 -12.247
177 HB3 GLU 25 3HB GLU 25 -5.090 6.182 -11.419
178 HG2 GLU 25 2HG GLU 25 -4.318 3.787 -12.184
179 HG3 GLU 25 3HG GLU 25 -5.692 3.850 -13.254
180 H GLU 26 H GLU 26 -8.124 3.911 -12.047
181 HA GLU 26 HA GLU 26 -8.739 1.333 -11.056
182 HB2 GLU 26 2HB GLU 26 -10.217 2.732 -12.504
183 HB3 GLU 26 3HB GLU 26 -9.093 2.523 -13.843
184 HG2 GLU 26 2HG GLU 26 -10.784 0.974 -14.293
185 HG3 GLU 26 3HG GLU 26 -9.508 -0.025 -13.610
186 H GLY 27 H GLY 27 -7.305 -0.342 -10.996
187 HA2 GLY 27 2HA GLY 27 -6.001 -2.073 -11.862
188 HA3 GLY 27 3HA GLY 27 -6.296 -1.415 -13.479
189 H GLU 28 H GLU 28 -4.832 0.568 -10.916
190 HA GLU 28 HA GLU 28 -2.631 1.205 -12.561
191 HB2 GLU 28 2HB GLU 28 -3.916 2.421 -10.580
192 HB3 GLU 28 3HB GLU 28 -2.727 1.672 -9.567
193 HG2 GLU 28 2HG GLU 28 -1.450 2.946 -11.892
194 HG3 GLU 28 3HG GLU 28 -2.539 4.085 -11.089
195 H ASP 29 H ASP 29 -0.287 1.234 -11.321
196 HA ASP 29 HA ASP 29 0.453 -1.612 -11.156
197 HB2 ASP 29 2HB ASP 29 2.033 0.957 -11.159
198 HB3 ASP 29 3HB ASP 29 2.759 -0.635 -10.969
199 H VAL 30 H VAL 30 -0.531 -2.134 -9.224
200 HA VAL 30 HA VAL 30 0.597 -0.920 -6.745
201 HB VAL 30 HB VAL 30 -1.633 -1.246 -5.698
202 HG11 VAL 30 1HG1 VAL 30 -2.813 0.588 -6.978
203 HG12 VAL 30 2HG1 VAL 30 -1.165 0.963 -6.460
204 HG13 VAL 30 3HG1 VAL 30 -1.487 0.536 -8.144
205 HG21 VAL 30 1HG2 VAL 30 -2.514 -3.043 -7.133
206 HG22 VAL 30 2HG2 VAL 30 -3.610 -1.658 -7.038
207 HG23 VAL 30 3HG2 VAL 30 -2.633 -1.897 -8.488
208 H ARG 31 H ARG 31 -0.391 -2.647 -4.897
209 HA ARG 31 HA ARG 31 -0.026 -5.368 -5.796
210 HB2 ARG 31 2HB ARG 31 2.025 -3.823 -4.304
211 HB3 ARG 31 3HB ARG 31 1.591 -5.307 -3.459
212 HG2 ARG 31 2HG ARG 31 2.396 -5.236 -6.389
213 HG3 ARG 31 3HG ARG 31 3.561 -5.438 -5.076
214 HD2 ARG 31 2HD ARG 31 2.727 -7.524 -4.438
215 HD3 ARG 31 3HD ARG 31 1.144 -7.240 -5.190
216 HE ARG 31 HE ARG 31 3.037 -7.186 -7.246
217 HH11 ARG 31 1HH1 ARG 31 2.467 -10.523 -8.249
218 HH12 ARG 31 2HH1 ARG 31 2.970 -8.951 -8.750
219 HH21 ARG 31 1HH2 ARG 31 1.757 -10.856 -5.976
220 HH22 ARG 31 2HH2 ARG 31 1.919 -9.539 -4.873
221 H ARG 32 H ARG 32 -0.392 -6.808 -3.692
222 HA ARG 32 HA ARG 32 -2.388 -5.509 -1.957
223 HB2 ARG 32 2HB ARG 32 -3.720 -6.747 -3.539
224 HB3 ARG 32 3HB ARG 32 -2.588 -8.103 -3.539
225 HG2 ARG 32 2HG ARG 32 -4.586 -8.735 -2.324
226 HG3 ARG 32 3HG ARG 32 -3.216 -8.687 -1.232
227 HD2 ARG 32 2HD ARG 32 -4.715 -7.549 0.070
228 HD3 ARG 32 3HD ARG 32 -4.066 -6.181 -0.794
229 HE ARG 32 HE ARG 32 -6.058 -5.934 -1.961
230 HH11 ARG 32 1HH1 ARG 32 -9.070 -7.747 -1.642
231 HH12 ARG 32 2HH1 ARG 32 -8.335 -6.330 -2.288
232 HH21 ARG 32 1HH2 ARG 32 -7.775 -9.294 -0.402
233 HH22 ARG 32 2HH2 ARG 32 -6.092 -8.989 -0.174
234 H LEU 33 H LEU 33 -2.245 -6.222 0.200
235 HA LEU 33 HA LEU 33 -0.161 -8.169 0.898
236 HB2 LEU 33 2HB LEU 33 -0.296 -6.439 3.032
237 HB3 LEU 33 3HB LEU 33 0.964 -6.406 1.810
238 HG LEU 33 HG LEU 33 -1.597 -4.794 1.565
239 HD11 LEU 33 1HD1 LEU 33 -0.435 -2.947 2.668
240 HD12 LEU 33 2HD1 LEU 33 -0.548 -4.321 3.765
241 HD13 LEU 33 3HD1 LEU 33 0.995 -3.967 2.952
242 HD21 LEU 33 1HD2 LEU 33 0.037 -3.211 0.359
243 HD22 LEU 33 2HD2 LEU 33 1.249 -4.505 0.449
244 HD23 LEU 33 3HD2 LEU 33 -0.234 -4.713 -0.496
245 HA PRO 34 HA PRO 34 -3.065 -10.396 2.826
246 HB2 PRO 34 2HB PRO 34 -2.321 -10.858 5.496
247 HB3 PRO 34 3HB PRO 34 -1.693 -11.690 4.044
248 HG2 PRO 34 2HG PRO 34 -0.443 -9.454 5.611
249 HG3 PRO 34 3HG PRO 34 0.337 -10.815 4.746
250 HD2 PRO 34 2HD PRO 34 0.178 -8.233 3.832
251 HD3 PRO 34 3HD PRO 34 0.351 -9.612 2.746
252 H CYS 35 H CYS 35 -2.443 -7.567 4.984
253 HA CYS 35 HA CYS 35 -5.176 -7.659 6.133
254 HB2 CYS 35 2HB CYS 35 -4.451 -5.647 7.235
255 HB3 CYS 35 3HB CYS 35 -3.248 -6.924 7.447
256 H MET 36 H MET 36 -4.975 -7.494 3.138
257 HA MET 36 HA MET 36 -5.971 -6.430 1.434
258 HB2 MET 36 2HB MET 36 -8.341 -5.938 1.847
259 HB3 MET 36 3HB MET 36 -7.814 -7.479 2.521
260 HG2 MET 36 2HG MET 36 -7.719 -6.555 4.758
261 HG3 MET 36 3HG MET 36 -8.063 -4.928 4.156
262 HE1 MET 36 1HE MET 36 -9.504 -6.770 6.535
263 HE2 MET 36 2HE MET 36 -9.699 -5.024 6.255
264 HE3 MET 36 3HE MET 36 -11.132 -6.076 6.359
265 H HIS 37 H HIS 37 -4.039 -4.720 2.406
266 HA HIS 37 HA HIS 37 -5.360 -2.075 2.032
267 HB2 HIS 37 1HB HIS 37 -2.973 -2.935 3.713
268 HB3 HIS 37 2HB HIS 37 -3.271 -1.256 3.281
269 HD2 HIS 37 2HD HIS 37 -6.404 -1.095 3.642
270 HE1 HIS 37 1HE HIS 37 -5.764 -2.147 7.705
271 HE2 HIS 37 2HE HIS 37 -7.405 -1.118 6.039
272 H LEU 38 H LEU 38 -5.296 -2.124 -0.264
273 HA LEU 38 HA LEU 38 -2.944 -2.935 -1.681
274 HB2 LEU 38 2HB LEU 38 -3.951 -2.293 -3.661
275 HB3 LEU 38 3HB LEU 38 -5.284 -2.875 -2.688
276 HG LEU 38 HG LEU 38 -4.649 0.104 -3.073
277 HD11 LEU 38 1HD1 LEU 38 -6.508 -1.669 -4.670
278 HD12 LEU 38 2HD1 LEU 38 -6.429 0.106 -4.747
279 HD13 LEU 38 3HD1 LEU 38 -5.032 -0.851 -5.238
280 HD21 LEU 38 1HD2 LEU 38 -6.114 -0.385 -1.129
281 HD22 LEU 38 2HD2 LEU 38 -7.005 0.405 -2.427
282 HD23 LEU 38 3HD2 LEU 38 -7.189 -1.343 -2.189
283 H PHE 39 H PHE 39 -1.238 -1.772 -2.568
284 HA PHE 39 HA PHE 39 -1.142 1.165 -2.224
285 HB2 PHE 39 2HB PHE 39 0.808 -0.852 -1.044
286 HB3 PHE 39 3HB PHE 39 1.169 0.858 -1.179
287 HD1 PHE 39 1HD PHE 39 -1.682 1.826 -0.304
288 HD2 PHE 39 2HD PHE 39 1.009 -1.084 1.358
289 HE1 PHE 39 1HE PHE 39 -2.837 2.018 1.849
290 HE2 PHE 39 2HE PHE 39 -0.080 -0.798 3.568
291 HZ PHE 39 HZ PHE 39 -2.021 0.727 3.811
292 H HIS 40 H HIS 40 0.649 2.123 -3.514
293 HA HIS 40 HA HIS 40 0.978 1.118 -6.140
294 HB2 HIS 40 1HB HIS 40 2.814 2.824 -4.448
295 HB3 HIS 40 2HB HIS 40 3.183 2.439 -6.117
296 HD2 HIS 40 2HD HIS 40 1.052 3.113 -7.910
297 HE1 HIS 40 1HE HIS 40 0.281 6.703 -5.748
298 HE2 HIS 40 2HE HIS 40 -0.173 5.360 -7.938
299 H GLN 41 H GLN 41 2.665 -0.019 -7.189
300 HA GLN 41 HA GLN 41 4.035 -2.026 -5.723
301 HB2 GLN 41 2HB GLN 41 3.375 -1.933 -8.197
302 HB3 GLN 41 3HB GLN 41 4.812 -0.954 -8.471
303 HG2 GLN 41 2HG GLN 41 6.282 -2.710 -7.951
304 HG3 GLN 41 3HG GLN 41 5.119 -3.534 -6.914
305 HE21 GLN 41 1HE2 GLN 41 2.836 -3.989 -8.456
306 HE22 GLN 41 2HE2 GLN 41 3.338 -4.860 -9.895
307 H VAL 42 H VAL 42 5.256 1.050 -7.202
308 HA VAL 42 HA VAL 42 7.863 0.823 -6.184
309 HB VAL 42 HB VAL 42 6.284 3.373 -6.740
310 HG11 VAL 42 1HG1 VAL 42 8.470 3.735 -5.504
311 HG12 VAL 42 2HG1 VAL 42 9.300 2.928 -6.851
312 HG13 VAL 42 3HG1 VAL 42 8.422 4.450 -7.118
313 HG21 VAL 42 1HG2 VAL 42 8.000 1.610 -8.547
314 HG22 VAL 42 2HG2 VAL 42 6.260 1.924 -8.723
315 HG23 VAL 42 3HG2 VAL 42 7.417 3.229 -8.984
316 H CYS 43 H CYS 43 5.136 2.715 -4.682
317 HA CYS 43 HA CYS 43 6.568 3.569 -2.362
318 HB2 CYS 43 2HB CYS 43 3.643 2.771 -2.463
319 HB3 CYS 43 3HB CYS 43 4.445 3.828 -1.329
320 H VAL 44 H VAL 44 4.617 0.562 -2.887
321 HA VAL 44 HA VAL 44 5.031 -0.164 -0.155
322 HB VAL 44 HB VAL 44 2.984 -0.580 -1.651
323 HG11 VAL 44 1HG1 VAL 44 4.398 -3.237 -2.068
324 HG12 VAL 44 2HG1 VAL 44 2.824 -2.675 -2.699
325 HG13 VAL 44 3HG1 VAL 44 4.346 -1.995 -3.324
326 HG21 VAL 44 1HG2 VAL 44 3.222 -1.206 0.694
327 HG22 VAL 44 2HG2 VAL 44 2.395 -2.495 -0.222
328 HG23 VAL 44 3HG2 VAL 44 4.107 -2.674 0.226
329 H ASP 45 H ASP 45 6.733 -0.753 -3.075
330 HA ASP 45 HA ASP 45 8.212 -3.094 -2.295
331 HB2 ASP 45 2HB ASP 45 8.846 -0.739 -4.128
332 HB3 ASP 45 3HB ASP 45 10.061 -1.942 -3.735
333 H GLN 46 H GLN 46 8.999 0.421 -2.125
334 HA GLN 46 HA GLN 46 11.160 0.039 -0.284
335 HB2 GLN 46 2HB GLN 46 9.377 2.439 -0.927
336 HB3 GLN 46 3HB GLN 46 10.766 2.566 0.152
337 HG2 GLN 46 2HG GLN 46 11.097 1.458 -2.663
338 HG3 GLN 46 3HG GLN 46 11.042 3.197 -2.361
339 HE21 GLN 46 1HE2 GLN 46 13.265 3.510 -3.029
340 HE22 GLN 46 2HE2 GLN 46 14.555 2.969 -1.963
341 H ALA 47 H ALA 47 7.696 0.340 0.310
342 HA ALA 47 HA ALA 47 7.930 0.795 3.122
343 HB1 ALA 47 1HB ALA 47 5.773 -0.774 1.679
344 HB2 ALA 47 2HB ALA 47 5.637 0.060 3.239
345 HB3 ALA 47 3HB ALA 47 5.859 1.008 1.744
346 H LEU 48 H LEU 48 7.276 -2.289 1.391
347 HA LEU 48 HA LEU 48 7.473 -4.036 3.521
348 HB2 LEU 48 2HB LEU 48 6.514 -4.461 1.300
349 HB3 LEU 48 3HB LEU 48 8.112 -4.484 0.570
350 HG LEU 48 HG LEU 48 7.305 -6.417 2.793
351 HD11 LEU 48 1HD1 LEU 48 5.685 -6.586 0.914
352 HD12 LEU 48 2HD1 LEU 48 7.034 -6.808 -0.218
353 HD13 LEU 48 3HD1 LEU 48 6.702 -8.026 1.037
354 HD21 LEU 48 1HD2 LEU 48 9.663 -6.566 2.467
355 HD22 LEU 48 2HD2 LEU 48 9.002 -7.876 1.500
356 HD23 LEU 48 3HD2 LEU 48 9.516 -6.377 0.702
357 H ILE 49 H ILE 49 10.127 -3.080 1.220
358 HA ILE 49 HA ILE 49 12.062 -4.688 2.551
359 HB ILE 49 HB ILE 49 13.730 -3.574 1.348
360 HG12 ILE 49 2HG1 ILE 49 12.933 -1.545 -0.173
361 HG13 ILE 49 3HG1 ILE 49 11.941 -1.248 1.268
362 HG21 ILE 49 1HG2 ILE 49 13.106 -3.971 -0.859
363 HG22 ILE 49 2HG2 ILE 49 12.071 -5.035 0.112
364 HG23 ILE 49 3HG2 ILE 49 11.422 -3.540 -0.580
365 HD11 ILE 49 1HD1 ILE 49 14.946 -1.696 1.407
366 HD12 ILE 49 2HD1 ILE 49 14.212 -0.097 1.210
367 HD13 ILE 49 3HD1 ILE 49 13.889 -1.035 2.669
368 H THR 50 H THR 50 10.876 -1.377 3.245
369 HA THR 50 HA THR 50 12.981 -0.862 5.134
370 HB THR 50 HB THR 50 10.272 0.414 4.619
371 HG1 THR 50 1HG THR 50 11.788 0.911 3.134
372 HG21 THR 50 1HG2 THR 50 12.366 1.234 6.669
373 HG22 THR 50 2HG2 THR 50 11.043 2.273 6.087
374 HG23 THR 50 3HG2 THR 50 10.667 0.798 6.990
375 H ASN 51 H ASN 51 9.761 -2.404 5.263
376 HA ASN 51 HA ASN 51 10.349 -3.708 7.715
377 HB2 ASN 51 2HB ASN 51 9.406 -1.137 8.143
378 HB3 ASN 51 3HB ASN 51 7.889 -2.033 8.077
379 HD21 ASN 51 1HD2 ASN 51 9.751 -0.800 10.308
380 HD22 ASN 51 2HD2 ASN 51 9.862 -2.104 11.475
381 H LYS 52 H LYS 52 9.280 -5.649 7.434
382 HA LYS 52 HA LYS 52 7.259 -5.872 5.312
383 HB2 LYS 52 2HB LYS 52 7.488 -8.166 5.537
384 HB3 LYS 52 3HB LYS 52 9.093 -7.428 5.566
385 HG2 LYS 52 2HG LYS 52 8.828 -7.571 8.211
386 HG3 LYS 52 3HG LYS 52 7.559 -8.741 7.820
387 HD2 LYS 52 2HD LYS 52 9.409 -9.641 6.137
388 HD3 LYS 52 3HD LYS 52 10.487 -8.863 7.297
389 HE2 LYS 52 2HE LYS 52 9.557 -10.254 9.125
390 HE3 LYS 52 3HE LYS 52 8.221 -10.767 8.094
391 HZ1 LYS 52 1HZ LYS 52 9.870 -11.886 6.670
392 HZ2 LYS 52 2HZ LYS 52 11.042 -11.595 7.785
393 HZ3 LYS 52 3HZ LYS 52 9.718 -12.546 8.101
394 H LYS 53 H LYS 53 6.167 -4.165 7.210
395 HA LYS 53 HA LYS 53 4.070 -5.865 8.401
396 HB2 LYS 53 2HB LYS 53 5.611 -3.673 9.853
397 HB3 LYS 53 3HB LYS 53 4.187 -4.502 10.502
398 HG2 LYS 53 2HG LYS 53 5.366 -6.549 10.829
399 HG3 LYS 53 3HG LYS 53 6.626 -6.121 9.681
400 HD2 LYS 53 2HD LYS 53 7.836 -5.767 11.505
401 HD3 LYS 53 3HD LYS 53 7.134 -4.152 11.364
402 HE2 LYS 53 2HE LYS 53 5.347 -4.840 12.984
403 HE3 LYS 53 3HE LYS 53 6.166 -6.408 13.154
404 HZ1 LYS 53 1HZ LYS 53 7.322 -3.766 13.783
405 HZ2 LYS 53 2HZ LYS 53 6.898 -4.930 14.876
406 HZ3 LYS 53 3HZ LYS 53 8.152 -5.181 13.842
407 H CYS 54 H CYS 54 2.138 -4.934 8.008
408 HA CYS 54 HA CYS 54 1.867 -3.027 5.917
409 HB2 CYS 54 2HB CYS 54 0.226 -4.747 6.663
410 HB3 CYS 54 3HB CYS 54 -0.039 -3.795 8.123
411 HA PRO 55 HA PRO 55 2.476 0.616 8.588
412 HB2 PRO 55 2HB PRO 55 2.704 2.538 6.679
413 HB3 PRO 55 3HB PRO 55 3.961 1.290 6.917
414 HG2 PRO 55 2HG PRO 55 1.699 1.251 4.890
415 HG3 PRO 55 3HG PRO 55 3.450 1.004 4.593
416 HD2 PRO 55 2HD PRO 55 1.711 -1.074 4.950
417 HD3 PRO 55 3HD PRO 55 3.397 -1.151 5.549
418 H ILE 56 H ILE 56 0.226 -0.131 9.109
419 HA ILE 56 HA ILE 56 -1.691 2.017 9.043
420 HB ILE 56 HB ILE 56 -2.436 -0.691 7.809
421 HG12 ILE 56 2HG1 ILE 56 -1.646 0.915 6.116
422 HG13 ILE 56 3HG1 ILE 56 -3.319 0.426 5.920
423 HG21 ILE 56 1HG2 ILE 56 -4.188 1.482 8.985
424 HG22 ILE 56 2HG2 ILE 56 -4.805 0.340 7.779
425 HG23 ILE 56 3HG2 ILE 56 -4.203 -0.252 9.332
426 HD11 ILE 56 1HD1 ILE 56 -2.403 3.075 7.116
427 HD12 ILE 56 2HD1 ILE 56 -3.116 2.806 5.508
428 HD13 ILE 56 3HD1 ILE 56 -4.098 2.555 6.945
429 H CYS 57 H CYS 57 -1.121 -1.473 9.455
430 HA CYS 57 HA CYS 57 -2.364 -1.513 12.192
431 HB2 CYS 57 2HB CYS 57 -3.032 -3.788 11.517
432 HB3 CYS 57 3HB CYS 57 -3.850 -2.507 10.665
433 H ARG 58 H ARG 58 -1.093 -4.381 12.029
434 HA ARG 58 HA ARG 58 1.742 -3.647 12.264
435 HB2 ARG 58 2HB ARG 58 0.592 -3.096 14.524
436 HB3 ARG 58 3HB ARG 58 0.344 -4.833 14.692
437 HG2 ARG 58 2HG ARG 58 3.079 -4.686 14.119
438 HG3 ARG 58 3HG ARG 58 2.796 -3.186 15.006
439 HD2 ARG 58 2HD ARG 58 1.560 -4.635 16.748
440 HD3 ARG 58 3HD ARG 58 2.231 -6.039 15.890
441 HE ARG 58 HE ARG 58 4.229 -4.068 16.629
442 HH11 ARG 58 1HH1 ARG 58 5.319 -5.816 19.502
443 HH12 ARG 58 2HH1 ARG 58 5.676 -4.521 18.425
444 HH21 ARG 58 1HH2 ARG 58 3.348 -7.089 19.228
445 HH22 ARG 58 2HH2 ARG 58 2.304 -6.737 17.899
446 H VAL 59 H VAL 59 0.094 -5.367 10.558
447 HA VAL 59 HA VAL 59 0.582 -8.099 11.585
448 HB VAL 59 HB VAL 59 -0.940 -7.223 9.099
449 HG11 VAL 59 1HG1 VAL 59 -1.018 -9.778 10.768
450 HG12 VAL 59 2HG1 VAL 59 -2.034 -9.428 9.354
451 HG13 VAL 59 3HG1 VAL 59 -0.289 -9.606 9.153
452 HG21 VAL 59 1HG2 VAL 59 -1.913 -7.607 11.965
453 HG22 VAL 59 2HG2 VAL 59 -2.099 -6.164 10.942
454 HG23 VAL 59 3HG2 VAL 59 -2.999 -7.629 10.560
455 H ASP 60 H ASP 60 1.964 -9.472 10.466
456 HA ASP 60 HA ASP 60 4.061 -8.192 8.893
457 HB2 ASP 60 2HB ASP 60 4.367 -10.055 10.622
458 HB3 ASP 60 3HB ASP 60 3.675 -11.159 9.428
459 H ILE 61 H ILE 61 4.369 -8.538 6.661
460 HA ILE 61 HA ILE 61 1.985 -9.574 5.210
461 HB ILE 61 HB ILE 61 2.459 -8.017 3.469
462 HG12 ILE 61 2HG1 ILE 61 4.786 -7.033 5.166
463 HG13 ILE 61 3HG1 ILE 61 4.933 -7.927 3.655
464 HG21 ILE 61 1HG2 ILE 61 1.168 -7.359 5.622
465 HG22 ILE 61 2HG2 ILE 61 2.623 -6.394 6.012
466 HG23 ILE 61 3HG2 ILE 61 1.676 -6.064 4.532
467 HD11 ILE 61 1HD1 ILE 61 3.708 -5.195 4.049
468 HD12 ILE 61 2HD1 ILE 61 5.188 -5.607 3.168
469 HD13 ILE 61 3HD1 ILE 61 3.600 -6.149 2.541
470 H GLU 62 H GLU 62 5.329 -10.007 5.727
471 HA GLU 62 HA GLU 62 6.160 -11.066 3.236
472 HB2 GLU 62 2HB GLU 62 7.552 -10.303 5.148
473 HB3 GLU 62 3HB GLU 62 7.172 -11.772 6.032
474 HG2 GLU 62 2HG GLU 62 8.245 -12.033 3.218
475 HG3 GLU 62 3HG GLU 62 9.348 -11.443 4.460
476 H ALA 63 H ALA 63 4.506 -12.367 2.454
477 HA ALA 63 HA ALA 63 4.518 -15.155 3.466
478 HB1 ALA 63 1HB ALA 63 2.038 -13.440 3.007
479 HB2 ALA 63 2HB ALA 63 2.037 -15.182 3.376
480 HB3 ALA 63 3HB ALA 63 2.630 -14.020 4.583
481 H GLN 64 H GLN 64 5.900 -14.242 1.295
482 HA GLN 64 HA GLN 64 4.458 -15.530 -0.936
483 HB2 GLN 64 2HB GLN 64 3.943 -13.103 -1.124
484 HB3 GLN 64 3HB GLN 64 5.676 -12.738 -1.165
485 HG2 GLN 64 2HG GLN 64 5.914 -14.043 -3.249
486 HG3 GLN 64 3HG GLN 64 4.208 -14.511 -3.166
487 HE21 GLN 64 1HE2 GLN 64 4.469 -13.507 -5.486
488 HE22 GLN 64 2HE2 GLN 64 4.234 -11.763 -5.564
489 H LEU 65 H LEU 65 5.815 -17.106 -1.438
490 HA LEU 65 HA LEU 65 7.636 -18.349 -1.827
491 HB2 LEU 65 2HB LEU 65 7.390 -16.761 -3.808
492 HB3 LEU 65 3HB LEU 65 8.750 -15.866 -3.135
493 HG LEU 65 HG LEU 65 9.948 -18.239 -3.099
494 HD11 LEU 65 1HD1 LEU 65 7.901 -19.542 -3.679
495 HD12 LEU 65 2HD1 LEU 65 7.776 -18.651 -5.209
496 HD13 LEU 65 3HD1 LEU 65 9.157 -19.722 -4.914
497 HD21 LEU 65 1HD2 LEU 65 10.669 -16.379 -4.511
498 HD22 LEU 65 2HD2 LEU 65 10.704 -17.886 -5.436
499 HD23 LEU 65 3HD2 LEU 65 9.375 -16.724 -5.684
500 HA PRO 66 HA PRO 66 10.199 -16.824 1.656
501 HB2 PRO 66 2HB PRO 66 10.571 -19.196 2.969
502 HB3 PRO 66 3HB PRO 66 9.051 -18.256 3.074
503 HG2 PRO 66 2HG PRO 66 9.656 -20.602 1.246
504 HG3 PRO 66 3HG PRO 66 8.232 -20.375 2.312
505 HD2 PRO 66 2HD PRO 66 8.160 -19.754 -0.332
506 HD3 PRO 66 3HD PRO 66 7.305 -18.736 0.871
507 H SER 67 H SER 67 10.824 -19.358 -0.744
508 HA SER 67 HA SER 67 13.548 -19.824 -0.054
509 HB2 SER 67 2HB SER 67 12.157 -20.212 -2.734
510 HB3 SER 67 3HB SER 67 13.586 -21.069 -2.114
511 HG SER 67 HG SER 67 11.686 -22.287 -1.829
512 H GLU 68 H GLU 68 14.438 -17.741 0.150
513 HA GLU 68 HA GLU 68 16.397 -16.760 -0.819
514 HB2 GLU 68 2HB GLU 68 15.870 -17.489 -3.169
515 HB3 GLU 68 3HB GLU 68 14.769 -16.092 -3.298
516 HG2 GLU 68 2HG GLU 68 16.681 -14.584 -2.767
517 HG3 GLU 68 3HG GLU 68 17.744 -15.991 -2.650
518 H SER 69 H SER 69 16.544 -14.989 0.526
519 HA SER 69 HA SER 69 15.000 -12.659 0.071
520 HB2 SER 69 2HB SER 69 13.307 -14.040 1.336
521 HB3 SER 69 3HB SER 69 14.481 -14.188 2.662
522 HG SER 69 HG SER 69 14.520 -11.795 2.540
Start of MODEL 5
1 H1 MET 1 H1 MET 1 0.953 25.788 -26.852
2 H2 MET 1 H2 MET 1 1.977 26.418 -27.990
3 H3 MET 1 H3 MET 1 2.461 26.242 -26.416
4 HA MET 1 HA MET 1 1.948 28.557 -26.862
5 HB2 MET 1 2HB MET 1 -0.710 27.297 -27.620
6 HB3 MET 1 3HB MET 1 -0.589 28.994 -27.127
7 HG2 MET 1 2HG MET 1 0.769 29.574 -28.971
8 HG3 MET 1 3HG MET 1 1.136 27.889 -29.358
9 HE1 MET 1 1HE MET 1 0.014 30.358 -31.300
10 HE2 MET 1 2HE MET 1 -1.734 30.281 -31.615
11 HE3 MET 1 3HE MET 1 -1.144 30.906 -30.059
12 H LYS 2 H LYS 2 2.577 28.600 -24.674
13 HA LYS 2 HA LYS 2 2.618 28.134 -22.484
14 HB2 LYS 2 2HB LYS 2 -0.397 28.437 -22.741
15 HB3 LYS 2 3HB LYS 2 0.392 28.078 -21.210
16 HG2 LYS 2 2HG LYS 2 1.668 30.090 -21.249
17 HG3 LYS 2 3HG LYS 2 1.235 30.447 -22.931
18 HD2 LYS 2 2HD LYS 2 -1.086 30.868 -22.318
19 HD3 LYS 2 3HD LYS 2 -0.795 30.270 -20.677
20 HE2 LYS 2 2HE LYS 2 -0.554 32.465 -20.174
21 HE3 LYS 2 3HE LYS 2 1.103 32.172 -20.709
22 HZ1 LYS 2 1HZ LYS 2 0.430 33.014 -22.901
23 HZ2 LYS 2 2HZ LYS 2 -1.083 33.329 -22.325
24 HZ3 LYS 2 3HZ LYS 2 0.211 34.136 -21.719
25 H GLN 3 H GLN 3 1.775 26.391 -20.795
26 HA GLN 3 HA GLN 3 0.723 23.933 -21.673
27 HB2 GLN 3 2HB GLN 3 2.770 22.528 -21.470
28 HB3 GLN 3 3HB GLN 3 2.760 23.512 -22.915
29 HG2 GLN 3 2HG GLN 3 4.347 25.086 -21.979
30 HG3 GLN 3 3HG GLN 3 4.261 24.335 -20.384
31 HE21 GLN 3 1HE2 GLN 3 6.518 24.666 -22.602
32 HE22 GLN 3 2HE2 GLN 3 7.159 23.027 -22.604
33 H ASP 4 H ASP 4 0.046 25.559 -19.514
34 HA ASP 4 HA ASP 4 0.906 23.929 -17.251
35 HB2 ASP 4 2HB ASP 4 2.610 25.734 -17.292
36 HB3 ASP 4 3HB ASP 4 1.323 26.951 -17.328
37 H GLY 5 H GLY 5 -0.734 23.841 -15.769
38 HA2 GLY 5 2HA GLY 5 -2.723 24.681 -14.710
39 HA3 GLY 5 3HA GLY 5 -3.145 25.551 -16.191
40 H GLU 6 H GLU 6 -3.257 22.408 -14.519
41 HA GLU 6 HA GLU 6 -5.469 21.673 -16.262
42 HB2 GLU 6 2HB GLU 6 -4.621 19.371 -16.564
43 HB3 GLU 6 3HB GLU 6 -3.652 20.576 -17.419
44 HG2 GLU 6 2HG GLU 6 -1.970 20.488 -15.531
45 HG3 GLU 6 3HG GLU 6 -2.921 19.186 -14.802
46 H GLU 7 H GLU 7 -7.087 20.679 -14.993
47 HA GLU 7 HA GLU 7 -6.410 19.144 -12.701
48 HB2 GLU 7 2HB GLU 7 -6.344 21.535 -11.783
49 HB3 GLU 7 3HB GLU 7 -8.060 21.669 -12.197
50 HG2 GLU 7 2HG GLU 7 -8.532 19.678 -10.761
51 HG3 GLU 7 3HG GLU 7 -6.814 19.559 -10.368
52 H GLY 8 H GLY 8 -7.960 17.504 -12.880
53 HA2 GLY 8 2HA GLY 8 -10.734 18.096 -13.423
54 HA3 GLY 8 3HA GLY 8 -9.904 17.359 -14.812
55 H THR 9 H THR 9 -12.030 16.272 -12.877
56 HA THR 9 HA THR 9 -11.032 13.621 -12.692
57 HB THR 9 HB THR 9 -9.841 14.475 -10.747
58 HG1 THR 9 1HG THR 9 -12.057 13.042 -9.756
59 HG21 THR 9 1HG2 THR 9 -12.578 15.311 -9.729
60 HG22 THR 9 2HG2 THR 9 -11.051 15.361 -8.810
61 HG23 THR 9 3HG2 THR 9 -11.267 16.398 -10.234
62 H GLU 10 H GLU 10 -12.782 12.227 -11.934
63 HA GLU 10 HA GLU 10 -15.480 13.514 -12.012
64 HB2 GLU 10 2HB GLU 10 -16.214 11.115 -12.587
65 HB3 GLU 10 3HB GLU 10 -15.506 12.125 -13.833
66 HG2 GLU 10 2HG GLU 10 -13.837 10.087 -12.308
67 HG3 GLU 10 3HG GLU 10 -14.784 9.669 -13.729
68 H GLU 11 H GLU 11 -13.818 10.648 -10.464
69 HA GLU 11 HA GLU 11 -14.594 11.651 -7.867
70 HB2 GLU 11 2HB GLU 11 -16.643 10.404 -8.356
71 HB3 GLU 11 3HB GLU 11 -15.720 9.040 -8.986
72 HG2 GLU 11 2HG GLU 11 -16.597 8.591 -6.725
73 HG3 GLU 11 3HG GLU 11 -14.841 8.519 -6.767
74 H ASP 12 H ASP 12 -12.797 11.234 -6.655
75 HA ASP 12 HA ASP 12 -11.926 8.659 -6.431
76 HB2 ASP 12 2HB ASP 12 -10.511 9.313 -8.478
77 HB3 ASP 12 3HB ASP 12 -9.595 10.334 -7.381
78 H THR 13 H THR 13 -12.668 9.294 -4.387
79 HA THR 13 HA THR 13 -10.618 10.790 -2.798
80 HB THR 13 HB THR 13 -13.551 11.006 -2.143
81 HG1 THR 13 1HG THR 13 -13.478 11.709 -4.227
82 HG21 THR 13 1HG2 THR 13 -11.162 12.891 -1.825
83 HG22 THR 13 2HG2 THR 13 -12.816 13.215 -1.266
84 HG23 THR 13 3HG2 THR 13 -11.873 11.913 -0.520
85 H GLU 14 H GLU 14 -11.141 7.819 -3.193
86 HA GLU 14 HA GLU 14 -11.312 7.198 -0.285
87 HB2 GLU 14 2HB GLU 14 -12.845 5.938 -2.566
88 HB3 GLU 14 3HB GLU 14 -12.299 4.956 -1.210
89 HG2 GLU 14 2HG GLU 14 -13.365 6.717 0.338
90 HG3 GLU 14 3HG GLU 14 -14.168 7.348 -1.105
91 H GLU 15 H GLU 15 -10.204 5.973 -3.556
92 HA GLU 15 HA GLU 15 -8.579 4.019 -2.185
93 HB2 GLU 15 2HB GLU 15 -8.711 4.801 -5.124
94 HB3 GLU 15 3HB GLU 15 -7.856 3.403 -4.434
95 HG2 GLU 15 2HG GLU 15 -10.170 2.853 -3.313
96 HG3 GLU 15 3HG GLU 15 -10.838 3.909 -4.560
97 H LYS 16 H LYS 16 -7.290 5.257 -0.790
98 HA LYS 16 HA LYS 16 -5.140 6.830 -2.106
99 HB2 LYS 16 2HB LYS 16 -6.571 8.153 -0.605
100 HB3 LYS 16 3HB LYS 16 -6.308 6.983 0.704
101 HG2 LYS 16 2HG LYS 16 -4.024 7.518 0.897
102 HG3 LYS 16 3HG LYS 16 -4.009 8.423 -0.611
103 HD2 LYS 16 2HD LYS 16 -5.768 9.360 1.666
104 HD3 LYS 16 3HD LYS 16 -4.028 9.686 1.674
105 HE2 LYS 16 2HE LYS 16 -4.393 10.520 -0.778
106 HE3 LYS 16 3HE LYS 16 -6.102 10.638 -0.323
107 HZ1 LYS 16 1HZ LYS 16 -3.804 11.969 0.972
108 HZ2 LYS 16 2HZ LYS 16 -4.931 12.703 0.042
109 HZ3 LYS 16 3HZ LYS 16 -5.362 12.090 1.514
110 H CYS 17 H CYS 17 -3.180 6.160 -1.969
111 HA CYS 17 HA CYS 17 -2.205 3.623 -0.848
112 HB2 CYS 17 2HB CYS 17 -1.288 4.915 -2.815
113 HB3 CYS 17 3HB CYS 17 -0.818 6.192 -1.707
114 H THR 18 H THR 18 -2.051 3.334 1.380
115 HA THR 18 HA THR 18 -2.127 5.530 3.163
116 HB THR 18 HB THR 18 -2.606 2.954 3.490
117 HG1 THR 18 1HG THR 18 -3.041 4.657 4.983
118 HG21 THR 18 1HG2 THR 18 -0.948 1.821 4.820
119 HG22 THR 18 2HG2 THR 18 -0.161 2.341 3.305
120 HG23 THR 18 3HG2 THR 18 0.116 3.230 4.821
121 H ILE 19 H ILE 19 0.664 4.096 1.497
122 HA ILE 19 HA ILE 19 2.603 5.116 3.361
123 HB ILE 19 HB ILE 19 2.652 3.873 0.614
124 HG12 ILE 19 2HG1 ILE 19 3.922 2.829 3.158
125 HG13 ILE 19 3HG1 ILE 19 2.186 2.613 2.898
126 HG21 ILE 19 1HG2 ILE 19 4.552 5.323 0.586
127 HG22 ILE 19 2HG2 ILE 19 4.951 4.952 2.283
128 HG23 ILE 19 3HG2 ILE 19 5.186 3.733 1.017
129 HD11 ILE 19 1HD1 ILE 19 3.470 0.672 2.096
130 HD12 ILE 19 2HD1 ILE 19 2.572 1.478 0.783
131 HD13 ILE 19 3HD1 ILE 19 4.321 1.707 0.939
132 H CYS 20 H CYS 20 1.565 6.055 0.018
133 HA CYS 20 HA CYS 20 3.236 8.523 0.040
134 HB2 CYS 20 2HB CYS 20 0.968 7.799 -1.840
135 HB3 CYS 20 3HB CYS 20 2.251 8.993 -2.053
136 H LEU 21 H LEU 21 0.153 7.590 1.325
137 HA LEU 21 HA LEU 21 -1.809 8.570 1.683
138 HB2 LEU 21 2HB LEU 21 0.032 10.805 2.558
139 HB3 LEU 21 3HB LEU 21 -1.685 10.706 2.985
140 HG LEU 21 HG LEU 21 0.317 8.501 3.618
141 HD11 LEU 21 1HD1 LEU 21 0.995 9.498 5.466
142 HD12 LEU 21 2HD1 LEU 21 0.379 11.005 4.769
143 HD13 LEU 21 3HD1 LEU 21 -0.629 10.073 5.898
144 HD21 LEU 21 1HD2 LEU 21 -2.053 7.765 3.609
145 HD22 LEU 21 2HD2 LEU 21 -1.407 7.785 5.245
146 HD23 LEU 21 3HD2 LEU 21 -2.480 9.098 4.703
147 H SER 22 H SER 22 -1.180 8.554 -0.939
148 HA SER 22 HA SER 22 -2.327 11.092 -1.969
149 HB2 SER 22 2HB SER 22 0.203 10.814 -2.369
150 HB3 SER 22 3HB SER 22 -0.238 9.468 -3.449
151 HG SER 22 HG SER 22 -0.161 11.393 -4.623
152 H ILE 23 H ILE 23 -3.696 10.760 -3.845
153 HA ILE 23 HA ILE 23 -5.247 8.349 -3.625
154 HB ILE 23 HB ILE 23 -5.264 10.865 -5.320
155 HG12 ILE 23 2HG1 ILE 23 -5.939 11.008 -2.884
156 HG13 ILE 23 3HG1 ILE 23 -7.152 11.544 -4.040
157 HG21 ILE 23 1HG2 ILE 23 -6.213 9.320 -6.797
158 HG22 ILE 23 2HG2 ILE 23 -7.147 8.515 -5.527
159 HG23 ILE 23 3HG2 ILE 23 -7.567 10.168 -6.052
160 HD11 ILE 23 1HD1 ILE 23 -7.163 8.786 -2.734
161 HD12 ILE 23 2HD1 ILE 23 -8.112 10.181 -2.189
162 HD13 ILE 23 3HD1 ILE 23 -8.420 9.469 -3.777
163 H LEU 24 H LEU 24 -5.643 6.917 -5.332
164 HA LEU 24 HA LEU 24 -3.308 6.289 -7.004
165 HB2 LEU 24 2HB LEU 24 -5.852 4.773 -6.212
166 HB3 LEU 24 3HB LEU 24 -4.483 4.059 -7.079
167 HG LEU 24 HG LEU 24 -4.247 5.252 -4.273
168 HD11 LEU 24 1HD1 LEU 24 -5.676 3.322 -4.254
169 HD12 LEU 24 2HD1 LEU 24 -4.481 2.371 -5.165
170 HD13 LEU 24 3HD1 LEU 24 -4.115 2.945 -3.511
171 HD21 LEU 24 1HD2 LEU 24 -2.108 3.796 -4.459
172 HD22 LEU 24 2HD2 LEU 24 -2.392 3.864 -6.207
173 HD23 LEU 24 3HD2 LEU 24 -2.175 5.375 -5.301
174 H GLU 25 H GLU 25 -5.099 4.720 -8.825
175 HA GLU 25 HA GLU 25 -7.329 6.256 -9.543
176 HB2 GLU 25 2HB GLU 25 -6.885 6.648 -11.875
177 HB3 GLU 25 3HB GLU 25 -5.675 7.492 -10.904
178 HG2 GLU 25 2HG GLU 25 -4.001 5.814 -11.387
179 HG3 GLU 25 3HG GLU 25 -5.167 4.815 -12.265
180 H GLU 26 H GLU 26 -8.339 4.998 -11.634
181 HA GLU 26 HA GLU 26 -8.538 2.220 -10.890
182 HB2 GLU 26 2HB GLU 26 -10.420 3.382 -11.918
183 HB3 GLU 26 3HB GLU 26 -9.454 3.795 -13.335
184 HG2 GLU 26 2HG GLU 26 -10.988 1.964 -13.833
185 HG3 GLU 26 3HG GLU 26 -9.321 1.432 -13.996
186 H GLY 27 H GLY 27 -7.345 0.544 -11.578
187 HA2 GLY 27 2HA GLY 27 -5.811 -0.720 -12.733
188 HA3 GLY 27 3HA GLY 27 -6.090 0.370 -14.099
189 H GLU 28 H GLU 28 -4.809 1.874 -11.162
190 HA GLU 28 HA GLU 28 -2.297 2.433 -12.480
191 HB2 GLU 28 2HB GLU 28 -3.697 3.665 -10.520
192 HB3 GLU 28 3HB GLU 28 -2.635 2.697 -9.512
193 HG2 GLU 28 2HG GLU 28 -0.696 3.707 -10.947
194 HG3 GLU 28 3HG GLU 28 -1.898 4.822 -11.575
195 H ASP 29 H ASP 29 -0.201 1.852 -11.312
196 HA ASP 29 HA ASP 29 0.037 -0.967 -10.900
197 HB2 ASP 29 2HB ASP 29 2.040 1.159 -10.070
198 HB3 ASP 29 3HB ASP 29 2.336 -0.538 -10.470
199 H VAL 30 H VAL 30 -0.967 -1.896 -9.071
200 HA VAL 30 HA VAL 30 -0.402 -0.694 -6.456
201 HB VAL 30 HB VAL 30 -2.776 -1.000 -5.805
202 HG11 VAL 30 1HG1 VAL 30 -2.380 0.923 -8.124
203 HG12 VAL 30 2HG1 VAL 30 -3.629 1.031 -6.880
204 HG13 VAL 30 3HG1 VAL 30 -1.922 1.227 -6.436
205 HG21 VAL 30 1HG2 VAL 30 -3.302 -1.392 -8.775
206 HG22 VAL 30 2HG2 VAL 30 -3.529 -2.606 -7.501
207 HG23 VAL 30 3HG2 VAL 30 -4.527 -1.140 -7.530
208 H ARG 31 H ARG 31 -0.660 -2.127 -4.732
209 HA ARG 31 HA ARG 31 -0.514 -4.959 -5.479
210 HB2 ARG 31 2HB ARG 31 1.431 -3.190 -4.072
211 HB3 ARG 31 3HB ARG 31 1.149 -4.701 -3.226
212 HG2 ARG 31 2HG ARG 31 2.043 -4.519 -6.109
213 HG3 ARG 31 3HG ARG 31 3.114 -4.718 -4.739
214 HD2 ARG 31 2HD ARG 31 2.886 -6.899 -5.522
215 HD3 ARG 31 3HD ARG 31 1.794 -6.832 -4.144
216 HE ARG 31 HE ARG 31 0.083 -7.358 -5.557
217 HH11 ARG 31 1HH1 ARG 31 -0.272 -7.164 -9.049
218 HH12 ARG 31 2HH1 ARG 31 -1.046 -7.598 -7.574
219 HH21 ARG 31 1HH2 ARG 31 1.890 -6.193 -9.021
220 HH22 ARG 31 2HH2 ARG 31 2.652 -5.924 -7.502
221 H ARG 32 H ARG 32 -0.506 -6.231 -3.223
222 HA ARG 32 HA ARG 32 -2.568 -5.141 -1.463
223 HB2 ARG 32 2HB ARG 32 -3.895 -6.323 -3.095
224 HB3 ARG 32 3HB ARG 32 -2.713 -7.631 -3.215
225 HG2 ARG 32 2HG ARG 32 -4.648 -8.423 -2.019
226 HG3 ARG 32 3HG ARG 32 -3.264 -8.395 -0.945
227 HD2 ARG 32 2HD ARG 32 -4.817 -7.426 0.432
228 HD3 ARG 32 3HD ARG 32 -4.159 -5.979 -0.286
229 HE ARG 32 HE ARG 32 -6.141 -5.514 -1.260
230 HH11 ARG 32 1HH1 ARG 32 -9.041 -7.450 -1.815
231 HH12 ARG 32 2HH1 ARG 32 -8.332 -5.886 -1.954
232 HH21 ARG 32 1HH2 ARG 32 -7.757 -9.249 -0.923
233 HH22 ARG 32 2HH2 ARG 32 -6.148 -8.928 -0.378
234 H LEU 33 H LEU 33 -2.378 -6.080 0.647
235 HA LEU 33 HA LEU 33 -0.207 -8.030 1.095
236 HB2 LEU 33 2HB LEU 33 -0.488 -6.580 3.460
237 HB3 LEU 33 3HB LEU 33 0.847 -6.437 2.324
238 HG LEU 33 HG LEU 33 -1.664 -4.755 2.019
239 HD11 LEU 33 1HD1 LEU 33 -0.912 -4.501 4.350
240 HD12 LEU 33 2HD1 LEU 33 0.741 -4.164 3.795
241 HD13 LEU 33 3HD1 LEU 33 -0.576 -3.045 3.405
242 HD21 LEU 33 1HD2 LEU 33 0.225 -4.808 0.229
243 HD22 LEU 33 2HD2 LEU 33 -0.175 -3.222 0.898
244 HD23 LEU 33 3HD2 LEU 33 1.266 -4.098 1.466
245 HA PRO 34 HA PRO 34 -3.115 -10.529 2.983
246 HB2 PRO 34 2HB PRO 34 -2.143 -11.287 5.469
247 HB3 PRO 34 3HB PRO 34 -1.556 -11.905 3.896
248 HG2 PRO 34 2HG PRO 34 -0.354 -9.751 5.626
249 HG3 PRO 34 3HG PRO 34 0.472 -11.052 4.711
250 HD2 PRO 34 2HD PRO 34 0.282 -8.471 3.832
251 HD3 PRO 34 3HD PRO 34 0.349 -9.828 2.708
252 H CYS 35 H CYS 35 -2.144 -7.827 4.975
253 HA CYS 35 HA CYS 35 -4.571 -7.512 6.627
254 HB2 CYS 35 2HB CYS 35 -2.390 -6.861 7.299
255 HB3 CYS 35 3HB CYS 35 -2.154 -5.852 5.895
256 H MET 36 H MET 36 -4.958 -7.874 3.606
257 HA MET 36 HA MET 36 -6.132 -7.007 1.905
258 HB2 MET 36 2HB MET 36 -7.937 -6.305 4.230
259 HB3 MET 36 3HB MET 36 -8.414 -6.446 2.528
260 HG2 MET 36 2HG MET 36 -7.282 -8.812 2.658
261 HG3 MET 36 3HG MET 36 -7.452 -8.610 4.399
262 HE1 MET 36 1HE MET 36 -10.830 -9.146 1.282
263 HE2 MET 36 2HE MET 36 -9.745 -7.740 1.221
264 HE3 MET 36 3HE MET 36 -9.091 -9.384 1.009
265 H HIS 37 H HIS 37 -4.119 -5.127 2.664
266 HA HIS 37 HA HIS 37 -5.511 -2.533 2.393
267 HB2 HIS 37 1HB HIS 37 -3.125 -3.501 3.798
268 HB3 HIS 37 2HB HIS 37 -2.732 -2.132 2.770
269 HD2 HIS 37 2HD HIS 37 -5.272 -0.297 3.107
270 HE1 HIS 37 1HE HIS 37 -4.516 -0.441 7.291
271 HE2 HIS 37 2HE HIS 37 -5.742 0.807 5.431
272 H LEU 38 H LEU 38 -5.256 -1.230 0.595
273 HA LEU 38 HA LEU 38 -3.948 -2.454 -1.758
274 HB2 LEU 38 2HB LEU 38 -6.378 -1.773 -1.848
275 HB3 LEU 38 3HB LEU 38 -5.899 -0.124 -1.443
276 HG LEU 38 HG LEU 38 -4.378 -0.249 -3.571
277 HD11 LEU 38 1HD1 LEU 38 -4.637 -2.741 -3.864
278 HD12 LEU 38 2HD1 LEU 38 -6.364 -2.474 -4.211
279 HD13 LEU 38 3HD1 LEU 38 -5.126 -1.807 -5.285
280 HD21 LEU 38 1HD2 LEU 38 -6.406 1.140 -3.388
281 HD22 LEU 38 2HD2 LEU 38 -6.276 0.420 -4.999
282 HD23 LEU 38 3HD2 LEU 38 -7.416 -0.249 -3.820
283 H PHE 39 H PHE 39 -1.899 -1.717 -2.143
284 HA PHE 39 HA PHE 39 -1.170 1.086 -1.354
285 HB2 PHE 39 2HB PHE 39 0.442 -1.503 -1.216
286 HB3 PHE 39 3HB PHE 39 1.184 0.072 -1.163
287 HD1 PHE 39 1HD PHE 39 2.141 -1.155 0.850
288 HD2 PHE 39 2HD PHE 39 -1.876 0.345 0.774
289 HE1 PHE 39 1HE PHE 39 2.070 -1.234 3.314
290 HE2 PHE 39 2HE PHE 39 -1.971 0.252 3.209
291 HZ PHE 39 HZ PHE 39 -0.004 -0.512 4.516
292 H HIS 40 H HIS 40 0.962 1.673 -2.749
293 HA HIS 40 HA HIS 40 0.372 1.132 -5.620
294 HB2 HIS 40 1HB HIS 40 2.464 2.729 -4.143
295 HB3 HIS 40 2HB HIS 40 2.699 2.339 -5.825
296 HD2 HIS 40 2HD HIS 40 0.520 3.182 -7.531
297 HE1 HIS 40 1HE HIS 40 0.260 6.805 -5.307
298 HE2 HIS 40 2HE HIS 40 -0.355 5.623 -7.514
299 H GLN 41 H GLN 41 2.061 0.237 -6.964
300 HA GLN 41 HA GLN 41 3.608 -1.983 -6.187
301 HB2 GLN 41 2HB GLN 41 3.185 -0.374 -8.522
302 HB3 GLN 41 3HB GLN 41 4.912 -0.421 -8.294
303 HG2 GLN 41 2HG GLN 41 4.537 -2.222 -9.674
304 HG3 GLN 41 3HG GLN 41 4.691 -2.976 -8.083
305 HE21 GLN 41 1HE2 GLN 41 2.924 -3.229 -10.872
306 HE22 GLN 41 2HE2 GLN 41 1.375 -3.682 -10.181
307 H VAL 42 H VAL 42 4.912 1.317 -6.909
308 HA VAL 42 HA VAL 42 7.464 0.581 -5.936
309 HB VAL 42 HB VAL 42 6.285 3.328 -6.527
310 HG11 VAL 42 1HG1 VAL 42 8.275 3.633 -5.128
311 HG12 VAL 42 2HG1 VAL 42 9.184 2.460 -6.107
312 HG13 VAL 42 3HG1 VAL 42 8.687 4.018 -6.803
313 HG21 VAL 42 1HG2 VAL 42 6.315 1.786 -8.474
314 HG22 VAL 42 2HG2 VAL 42 7.540 3.042 -8.663
315 HG23 VAL 42 3HG2 VAL 42 8.021 1.412 -8.157
316 H CYS 43 H CYS 43 4.859 2.513 -4.349
317 HA CYS 43 HA CYS 43 6.289 3.142 -1.955
318 HB2 CYS 43 2HB CYS 43 3.360 2.402 -2.137
319 HB3 CYS 43 3HB CYS 43 4.175 3.358 -0.925
320 H VAL 44 H VAL 44 4.316 0.096 -2.734
321 HA VAL 44 HA VAL 44 4.965 -0.840 -0.141
322 HB VAL 44 HB VAL 44 2.924 -1.427 -1.518
323 HG11 VAL 44 1HG1 VAL 44 4.033 -2.326 -3.531
324 HG12 VAL 44 2HG1 VAL 44 4.860 -3.548 -2.542
325 HG13 VAL 44 3HG1 VAL 44 3.102 -3.582 -2.679
326 HG21 VAL 44 1HG2 VAL 44 3.781 -2.455 0.695
327 HG22 VAL 44 2HG2 VAL 44 2.607 -3.378 -0.284
328 HG23 VAL 44 3HG2 VAL 44 4.347 -3.792 -0.296
329 H ASP 45 H ASP 45 6.654 -1.040 -3.203
330 HA ASP 45 HA ASP 45 8.352 -3.271 -2.629
331 HB2 ASP 45 2HB ASP 45 8.425 -2.254 -4.829
332 HB3 ASP 45 3HB ASP 45 8.898 -0.692 -4.163
333 H GLN 46 H GLN 46 8.967 0.230 -2.146
334 HA GLN 46 HA GLN 46 11.188 -0.262 -0.417
335 HB2 GLN 46 2HB GLN 46 9.410 2.185 -0.850
336 HB3 GLN 46 3HB GLN 46 10.832 2.214 0.204
337 HG2 GLN 46 2HG GLN 46 10.900 1.473 -2.761
338 HG3 GLN 46 3HG GLN 46 11.306 3.058 -2.096
339 HE21 GLN 46 1HE2 GLN 46 12.518 -0.185 -2.722
340 HE22 GLN 46 2HE2 GLN 46 14.075 0.097 -1.942
341 H ALA 47 H ALA 47 7.756 -0.156 0.281
342 HA ALA 47 HA ALA 47 8.010 0.148 3.110
343 HB1 ALA 47 1HB ALA 47 5.945 -1.469 1.568
344 HB2 ALA 47 2HB ALA 47 5.776 -0.797 3.204
345 HB3 ALA 47 3HB ALA 47 5.899 0.295 1.802
346 H LEU 48 H LEU 48 7.511 -2.870 1.219
347 HA LEU 48 HA LEU 48 7.845 -4.678 3.288
348 HB2 LEU 48 2HB LEU 48 6.891 -4.965 0.964
349 HB3 LEU 48 3HB LEU 48 8.528 -5.128 0.345
350 HG LEU 48 HG LEU 48 7.358 -6.926 2.525
351 HD11 LEU 48 1HD1 LEU 48 5.971 -7.019 0.465
352 HD12 LEU 48 2HD1 LEU 48 7.425 -7.392 -0.486
353 HD13 LEU 48 3HD1 LEU 48 6.838 -8.534 0.745
354 HD21 LEU 48 1HD2 LEU 48 9.056 -8.561 1.634
355 HD22 LEU 48 2HD2 LEU 48 9.750 -7.244 0.663
356 HD23 LEU 48 3HD2 LEU 48 9.766 -7.169 2.443
357 H ILE 49 H ILE 49 10.364 -3.515 0.934
358 HA ILE 49 HA ILE 49 12.432 -5.062 2.153
359 HB ILE 49 HB ILE 49 13.988 -3.791 0.902
360 HG12 ILE 49 2HG1 ILE 49 12.775 -1.854 -0.570
361 HG13 ILE 49 3HG1 ILE 49 12.014 -1.649 1.021
362 HG21 ILE 49 1HG2 ILE 49 11.511 -4.083 -0.822
363 HG22 ILE 49 2HG2 ILE 49 13.200 -4.143 -1.329
364 HG23 ILE 49 3HG2 ILE 49 12.547 -5.423 -0.293
365 HD11 ILE 49 1HD1 ILE 49 15.003 -1.697 0.465
366 HD12 ILE 49 2HD1 ILE 49 14.027 -0.266 0.861
367 HD13 ILE 49 3HD1 ILE 49 14.266 -1.541 2.072
368 H THR 50 H THR 50 11.088 -1.849 3.007
369 HA THR 50 HA THR 50 13.221 -1.229 4.819
370 HB THR 50 HB THR 50 10.389 -0.204 4.464
371 HG1 THR 50 1HG THR 50 11.855 0.568 3.051
372 HG21 THR 50 1HG2 THR 50 12.357 0.659 6.610
373 HG22 THR 50 2HG2 THR 50 10.931 1.585 6.090
374 HG23 THR 50 3HG2 THR 50 10.714 0.009 6.859
375 H ASN 51 H ASN 51 10.100 -2.968 5.111
376 HA ASN 51 HA ASN 51 11.031 -4.643 7.159
377 HB2 ASN 51 2HB ASN 51 9.903 -2.155 8.152
378 HB3 ASN 51 3HB ASN 51 8.716 -3.420 8.433
379 HD21 ASN 51 1HD2 ASN 51 12.160 -2.604 8.925
380 HD22 ASN 51 2HD2 ASN 51 12.329 -3.549 10.400
381 H LYS 52 H LYS 52 9.667 -6.483 7.071
382 HA LYS 52 HA LYS 52 7.388 -6.349 5.213
383 HB2 LYS 52 2HB LYS 52 7.286 -8.698 5.457
384 HB3 LYS 52 3HB LYS 52 8.950 -8.221 5.166
385 HG2 LYS 52 2HG LYS 52 8.349 -8.333 8.074
386 HG3 LYS 52 3HG LYS 52 7.888 -9.791 7.215
387 HD2 LYS 52 2HD LYS 52 10.395 -9.433 6.225
388 HD3 LYS 52 3HD LYS 52 10.564 -8.738 7.843
389 HE2 LYS 52 2HE LYS 52 9.714 -11.524 6.988
390 HE3 LYS 52 3HE LYS 52 11.058 -11.115 8.041
391 HZ1 LYS 52 1HZ LYS 52 9.480 -10.706 9.800
392 HZ2 LYS 52 2HZ LYS 52 8.189 -10.775 8.797
393 HZ3 LYS 52 3HZ LYS 52 9.051 -12.126 9.027
394 H LYS 53 H LYS 53 6.656 -4.560 7.088
395 HA LYS 53 HA LYS 53 4.455 -5.995 8.401
396 HB2 LYS 53 2HB LYS 53 6.500 -4.252 9.829
397 HB3 LYS 53 3HB LYS 53 4.828 -4.397 10.419
398 HG2 LYS 53 2HG LYS 53 4.999 -6.807 10.522
399 HG3 LYS 53 3HG LYS 53 6.640 -6.790 9.866
400 HD2 LYS 53 2HD LYS 53 7.556 -5.835 11.815
401 HD3 LYS 53 3HD LYS 53 5.955 -5.438 12.492
402 HE2 LYS 53 2HE LYS 53 6.723 -8.287 11.735
403 HE3 LYS 53 3HE LYS 53 7.145 -7.627 13.327
404 HZ1 LYS 53 1HZ LYS 53 4.843 -7.277 13.778
405 HZ2 LYS 53 2HZ LYS 53 4.386 -7.632 12.269
406 HZ3 LYS 53 3HZ LYS 53 4.993 -8.831 13.229
407 H CYS 54 H CYS 54 2.599 -4.926 8.090
408 HA CYS 54 HA CYS 54 2.417 -2.854 6.073
409 HB2 CYS 54 2HB CYS 54 0.629 -4.452 6.547
410 HB3 CYS 54 3HB CYS 54 0.538 -3.841 8.198
411 HA PRO 55 HA PRO 55 3.940 0.211 8.895
412 HB2 PRO 55 2HB PRO 55 3.644 2.513 7.397
413 HB3 PRO 55 3HB PRO 55 4.868 1.248 7.073
414 HG2 PRO 55 2HG PRO 55 2.139 1.567 5.783
415 HG3 PRO 55 3HG PRO 55 3.728 1.317 4.978
416 HD2 PRO 55 2HD PRO 55 2.047 -0.752 5.447
417 HD3 PRO 55 3HD PRO 55 3.817 -0.952 5.664
418 H ILE 56 H ILE 56 0.619 -0.103 8.324
419 HA ILE 56 HA ILE 56 0.100 1.933 10.411
420 HB ILE 56 HB ILE 56 -0.392 2.782 8.117
421 HG12 ILE 56 2HG1 ILE 56 -2.616 3.683 8.509
422 HG13 ILE 56 3HG1 ILE 56 -2.888 2.569 9.843
423 HG21 ILE 56 1HG2 ILE 56 -2.590 0.692 8.079
424 HG22 ILE 56 2HG2 ILE 56 -2.318 1.962 6.874
425 HG23 ILE 56 3HG2 ILE 56 -1.123 0.672 7.070
426 HD11 ILE 56 1HD1 ILE 56 -0.659 4.655 9.716
427 HD12 ILE 56 2HD1 ILE 56 -2.197 4.849 10.581
428 HD13 ILE 56 3HD1 ILE 56 -1.042 3.620 11.114
429 H CYS 57 H CYS 57 0.409 -1.132 10.185
430 HA CYS 57 HA CYS 57 -2.048 -1.875 11.805
431 HB2 CYS 57 2HB CYS 57 -0.951 -3.610 9.629
432 HB3 CYS 57 3HB CYS 57 -2.459 -3.791 10.513
433 H ARG 58 H ARG 58 1.297 -2.676 10.773
434 HA ARG 58 HA ARG 58 3.030 -3.493 11.895
435 HB2 ARG 58 2HB ARG 58 1.760 -2.424 13.962
436 HB3 ARG 58 3HB ARG 58 1.523 -4.123 14.415
437 HG2 ARG 58 2HG ARG 58 4.053 -4.422 14.150
438 HG3 ARG 58 3HG ARG 58 4.150 -2.670 13.880
439 HD2 ARG 58 2HD ARG 58 2.912 -2.408 16.115
440 HD3 ARG 58 3HD ARG 58 3.204 -4.144 16.364
441 HE ARG 58 HE ARG 58 5.614 -2.710 15.679
442 HH11 ARG 58 1HH1 ARG 58 6.749 -2.337 18.997
443 HH12 ARG 58 2HH1 ARG 58 7.172 -2.199 17.331
444 HH21 ARG 58 1HH2 ARG 58 4.560 -3.028 19.606
445 HH22 ARG 58 2HH2 ARG 58 3.420 -3.381 18.356
446 H VAL 59 H VAL 59 0.123 -5.283 11.515
447 HA VAL 59 HA VAL 59 0.839 -7.934 11.905
448 HB VAL 59 HB VAL 59 -0.651 -8.298 9.944
449 HG11 VAL 59 1HG1 VAL 59 -1.659 -7.812 12.158
450 HG12 VAL 59 2HG1 VAL 59 -1.709 -6.082 11.758
451 HG13 VAL 59 3HG1 VAL 59 -2.660 -7.240 10.816
452 HG21 VAL 59 1HG2 VAL 59 0.046 -5.482 9.405
453 HG22 VAL 59 2HG2 VAL 59 -0.303 -6.796 8.300
454 HG23 VAL 59 3HG2 VAL 59 -1.638 -5.939 9.126
455 H ASP 60 H ASP 60 2.039 -9.422 10.633
456 HA ASP 60 HA ASP 60 4.222 -8.192 9.080
457 HB2 ASP 60 2HB ASP 60 4.485 -9.958 10.955
458 HB3 ASP 60 3HB ASP 60 3.878 -11.121 9.770
459 H ILE 61 H ILE 61 4.631 -8.883 6.924
460 HA ILE 61 HA ILE 61 2.262 -9.959 5.476
461 HB ILE 61 HB ILE 61 2.781 -8.483 3.663
462 HG12 ILE 61 2HG1 ILE 61 4.857 -7.148 5.421
463 HG13 ILE 61 3HG1 ILE 61 5.289 -8.299 4.146
464 HG21 ILE 61 1HG2 ILE 61 1.343 -7.788 5.690
465 HG22 ILE 61 2HG2 ILE 61 2.741 -6.782 6.164
466 HG23 ILE 61 3HG2 ILE 61 1.896 -6.493 4.618
467 HD11 ILE 61 1HD1 ILE 61 3.789 -5.695 3.767
468 HD12 ILE 61 2HD1 ILE 61 5.479 -6.030 3.344
469 HD13 ILE 61 3HD1 ILE 61 4.170 -6.909 2.502
470 H GLU 62 H GLU 62 5.608 -10.350 6.087
471 HA GLU 62 HA GLU 62 6.460 -11.664 3.695
472 HB2 GLU 62 2HB GLU 62 8.034 -11.005 5.375
473 HB3 GLU 62 3HB GLU 62 7.217 -11.955 6.620
474 HG2 GLU 62 2HG GLU 62 8.052 -13.677 4.422
475 HG3 GLU 62 3HG GLU 62 9.399 -12.684 4.968
476 H ALA 63 H ALA 63 5.418 -13.365 2.768
477 HA ALA 63 HA ALA 63 4.669 -15.667 4.423
478 HB1 ALA 63 1HB ALA 63 2.613 -14.315 4.412
479 HB2 ALA 63 2HB ALA 63 2.700 -14.147 2.646
480 HB3 ALA 63 3HB ALA 63 2.406 -15.744 3.374
481 H GLN 64 H GLN 64 6.077 -16.968 3.412
482 HA GLN 64 HA GLN 64 7.260 -18.097 1.883
483 HB2 GLN 64 2HB GLN 64 4.958 -17.448 0.003
484 HB3 GLN 64 3HB GLN 64 6.366 -18.380 -0.488
485 HG2 GLN 64 2HG GLN 64 5.944 -20.077 1.187
486 HG3 GLN 64 3HG GLN 64 4.631 -19.126 1.896
487 HE21 GLN 64 1HE2 GLN 64 5.601 -20.906 -1.121
488 HE22 GLN 64 2HE2 GLN 64 3.929 -21.161 -1.600
489 H LEU 65 H LEU 65 8.448 -17.826 -0.217
490 HA LEU 65 HA LEU 65 10.361 -16.750 -0.897
491 HB2 LEU 65 2HB LEU 65 8.196 -16.733 -2.475
492 HB3 LEU 65 3HB LEU 65 8.495 -15.004 -2.466
493 HG LEU 65 HG LEU 65 10.538 -17.177 -3.144
494 HD11 LEU 65 1HD1 LEU 65 8.983 -15.310 -4.980
495 HD12 LEU 65 2HD1 LEU 65 10.224 -16.483 -5.479
496 HD13 LEU 65 3HD1 LEU 65 8.699 -17.055 -4.782
497 HD21 LEU 65 1HD2 LEU 65 11.884 -15.316 -4.095
498 HD22 LEU 65 2HD2 LEU 65 10.704 -14.148 -3.458
499 HD23 LEU 65 3HD2 LEU 65 11.670 -15.141 -2.349
500 HA PRO 66 HA PRO 66 10.049 -13.060 1.869
501 HB2 PRO 66 2HB PRO 66 12.211 -13.553 3.495
502 HB3 PRO 66 3HB PRO 66 10.615 -14.333 3.727
503 HG2 PRO 66 2HG PRO 66 13.019 -15.454 2.261
504 HG3 PRO 66 3HG PRO 66 12.035 -16.243 3.540
505 HD2 PRO 66 2HD PRO 66 11.571 -16.720 0.913
506 HD3 PRO 66 3HD PRO 66 10.206 -16.552 2.064
507 H SER 67 H SER 67 11.783 -11.289 2.309
508 HA SER 67 HA SER 67 14.054 -11.275 0.487
509 HB2 SER 67 2HB SER 67 11.671 -9.393 0.197
510 HB3 SER 67 3HB SER 67 13.279 -9.045 -0.469
511 HG SER 67 HG SER 67 12.143 -11.539 -1.054
512 H GLU 68 H GLU 68 15.452 -9.409 0.995
513 HA GLU 68 HA GLU 68 15.017 -8.101 3.582
514 HB2 GLU 68 2HB GLU 68 17.285 -10.036 2.912
515 HB3 GLU 68 3HB GLU 68 17.358 -8.868 4.243
516 HG2 GLU 68 2HG GLU 68 15.390 -9.876 5.303
517 HG3 GLU 68 3HG GLU 68 15.226 -11.031 3.974
518 H SER 69 H SER 69 17.511 -6.816 3.762
519 HA SER 69 HA SER 69 18.264 -5.796 1.176
520 HB2 SER 69 2HB SER 69 16.169 -4.481 1.735
521 HB3 SER 69 3HB SER 69 16.973 -3.940 3.225
522 HG SER 69 HG SER 69 18.711 -3.254 1.742
Start of MODEL 6
1 H1 MET 1 H1 MET 1 -21.719 28.068 -34.887
2 H2 MET 1 H2 MET 1 -22.534 29.501 -35.012
3 H3 MET 1 H3 MET 1 -21.014 29.436 -34.347
4 HA MET 1 HA MET 1 -22.536 29.665 -32.582
5 HB2 MET 1 2HB MET 1 -24.262 27.960 -32.174
6 HB3 MET 1 3HB MET 1 -24.554 28.847 -33.666
7 HG2 MET 1 2HG MET 1 -23.239 26.100 -33.560
8 HG3 MET 1 3HG MET 1 -24.967 26.366 -33.771
9 HE1 MET 1 1HE MET 1 -23.884 25.105 -37.301
10 HE2 MET 1 2HE MET 1 -23.207 24.595 -35.737
11 HE3 MET 1 3HE MET 1 -24.960 24.853 -35.909
12 H LYS 2 H LYS 2 -22.584 27.972 -30.577
13 HA LYS 2 HA LYS 2 -20.818 25.750 -30.880
14 HB2 LYS 2 2HB LYS 2 -19.183 26.339 -29.210
15 HB3 LYS 2 3HB LYS 2 -19.068 27.464 -30.548
16 HG2 LYS 2 2HG LYS 2 -20.568 28.103 -27.961
17 HG3 LYS 2 3HG LYS 2 -18.850 28.376 -28.168
18 HD2 LYS 2 2HD LYS 2 -19.230 30.365 -29.078
19 HD3 LYS 2 3HD LYS 2 -20.037 29.598 -30.434
20 HE2 LYS 2 2HE LYS 2 -21.518 31.249 -29.475
21 HE3 LYS 2 3HE LYS 2 -22.192 29.639 -29.156
22 HZ1 LYS 2 1HZ LYS 2 -21.341 29.777 -26.926
23 HZ2 LYS 2 2HZ LYS 2 -20.641 31.240 -27.217
24 HZ3 LYS 2 3HZ LYS 2 -22.278 31.091 -27.229
25 H GLN 3 H GLN 3 -20.818 24.470 -28.792
26 HA GLN 3 HA GLN 3 -22.628 25.291 -26.692
27 HB2 GLN 3 2HB GLN 3 -23.449 23.341 -28.773
28 HB3 GLN 3 3HB GLN 3 -23.442 22.637 -27.155
29 HG2 GLN 3 2HG GLN 3 -24.795 24.579 -26.329
30 HG3 GLN 3 3HG GLN 3 -24.943 25.145 -28.000
31 HE21 GLN 3 1HE2 GLN 3 -25.520 22.893 -29.504
32 HE22 GLN 3 2HE2 GLN 3 -26.948 22.116 -28.833
33 H ASP 4 H ASP 4 -22.389 23.693 -24.839
34 HA ASP 4 HA ASP 4 -20.331 21.706 -24.958
35 HB2 ASP 4 2HB ASP 4 -19.103 23.994 -24.720
36 HB3 ASP 4 3HB ASP 4 -19.830 24.081 -23.113
37 H GLY 5 H GLY 5 -20.195 20.771 -22.509
38 HA2 GLY 5 2HA GLY 5 -21.973 21.620 -20.539
39 HA3 GLY 5 3HA GLY 5 -22.865 20.433 -21.513
40 H GLU 6 H GLU 6 -22.163 20.034 -18.746
41 HA GLU 6 HA GLU 6 -20.258 17.774 -18.936
42 HB2 GLU 6 2HB GLU 6 -20.413 19.730 -16.606
43 HB3 GLU 6 3HB GLU 6 -19.254 18.435 -16.873
44 HG2 GLU 6 2HG GLU 6 -17.921 20.127 -17.538
45 HG3 GLU 6 3HG GLU 6 -18.711 19.899 -19.090
46 H GLU 7 H GLU 7 -20.412 16.502 -16.765
47 HA GLU 7 HA GLU 7 -23.009 16.551 -15.458
48 HB2 GLU 7 2HB GLU 7 -23.487 15.291 -17.502
49 HB3 GLU 7 3HB GLU 7 -22.182 14.160 -17.149
50 HG2 GLU 7 2HG GLU 7 -23.378 13.405 -15.111
51 HG3 GLU 7 3HG GLU 7 -24.598 14.661 -15.339
52 H GLY 8 H GLY 8 -21.343 13.579 -15.437
53 HA2 GLY 8 2HA GLY 8 -19.398 12.939 -14.109
54 HA3 GLY 8 3HA GLY 8 -19.669 14.357 -13.079
55 H THR 9 H THR 9 -19.419 11.751 -11.959
56 HA THR 9 HA THR 9 -21.917 11.604 -10.540
57 HB THR 9 HB THR 9 -22.596 10.179 -12.297
58 HG1 THR 9 1HG THR 9 -21.626 8.324 -10.409
59 HG21 THR 9 1HG2 THR 9 -20.469 9.712 -13.360
60 HG22 THR 9 2HG2 THR 9 -19.945 8.741 -11.963
61 HG23 THR 9 3HG2 THR 9 -21.299 8.191 -12.987
62 H GLU 10 H GLU 10 -21.617 9.934 -8.722
63 HA GLU 10 HA GLU 10 -18.902 9.926 -7.614
64 HB2 GLU 10 2HB GLU 10 -21.591 8.754 -6.856
65 HB3 GLU 10 3HB GLU 10 -20.112 8.058 -6.169
66 HG2 GLU 10 2HG GLU 10 -19.419 10.216 -5.283
67 HG3 GLU 10 3HG GLU 10 -20.790 11.023 -6.055
68 H GLU 11 H GLU 11 -17.485 8.193 -7.707
69 HA GLU 11 HA GLU 11 -18.052 5.638 -8.810
70 HB2 GLU 11 2HB GLU 11 -17.205 7.756 -10.654
71 HB3 GLU 11 3HB GLU 11 -15.894 6.597 -10.474
72 HG2 GLU 11 2HG GLU 11 -18.759 5.823 -11.164
73 HG3 GLU 11 3HG GLU 11 -17.485 6.117 -12.349
74 H ASP 12 H ASP 12 -16.065 4.310 -8.408
75 HA ASP 12 HA ASP 12 -14.737 5.240 -6.020
76 HB2 ASP 12 2HB ASP 12 -15.359 2.847 -6.522
77 HB3 ASP 12 3HB ASP 12 -14.002 2.786 -7.653
78 H THR 13 H THR 13 -13.562 6.912 -6.345
79 HA THR 13 HA THR 13 -11.096 6.694 -8.027
80 HB THR 13 HB THR 13 -12.665 9.275 -7.707
81 HG1 THR 13 1HG THR 13 -13.953 7.684 -8.715
82 HG21 THR 13 1HG2 THR 13 -10.573 8.300 -9.709
83 HG22 THR 13 2HG2 THR 13 -11.514 9.794 -9.909
84 HG23 THR 13 3HG2 THR 13 -10.399 9.632 -8.546
85 H GLU 14 H GLU 14 -11.699 6.241 -5.084
86 HA GLU 14 HA GLU 14 -10.105 8.473 -3.935
87 HB2 GLU 14 2HB GLU 14 -11.826 6.344 -2.593
88 HB3 GLU 14 3HB GLU 14 -10.919 7.631 -1.794
89 HG2 GLU 14 2HG GLU 14 -12.793 8.817 -1.867
90 HG3 GLU 14 3HG GLU 14 -12.348 9.152 -3.536
91 H GLU 15 H GLU 15 -9.894 5.930 -1.885
92 HA GLU 15 HA GLU 15 -8.277 4.683 -1.096
93 HB2 GLU 15 2HB GLU 15 -7.538 4.047 -3.965
94 HB3 GLU 15 3HB GLU 15 -7.270 3.079 -2.506
95 HG2 GLU 15 2HG GLU 15 -9.907 3.342 -2.216
96 HG3 GLU 15 3HG GLU 15 -9.872 3.670 -3.949
97 H LYS 16 H LYS 16 -6.306 5.123 -0.069
98 HA LYS 16 HA LYS 16 -4.403 6.795 -1.600
99 HB2 LYS 16 2HB LYS 16 -3.984 8.105 0.559
100 HB3 LYS 16 3HB LYS 16 -5.364 8.554 -0.440
101 HG2 LYS 16 2HG LYS 16 -6.924 7.487 0.980
102 HG3 LYS 16 3HG LYS 16 -5.630 6.647 1.850
103 HD2 LYS 16 2HD LYS 16 -6.496 8.463 3.220
104 HD3 LYS 16 3HD LYS 16 -4.825 8.828 2.749
105 HE2 LYS 16 2HE LYS 16 -5.563 10.368 1.032
106 HE3 LYS 16 3HE LYS 16 -7.247 9.843 1.205
107 HZ1 LYS 16 1HZ LYS 16 -7.263 10.782 3.413
108 HZ2 LYS 16 2HZ LYS 16 -5.696 11.273 3.270
109 HZ3 LYS 16 3HZ LYS 16 -6.860 11.932 2.312
110 H CYS 17 H CYS 17 -2.452 6.428 -1.345
111 HA CYS 17 HA CYS 17 -1.139 4.100 -0.237
112 HB2 CYS 17 2HB CYS 17 -0.624 5.803 -2.189
113 HB3 CYS 17 3HB CYS 17 -0.054 6.810 -0.901
114 H THR 18 H THR 18 -0.627 3.844 1.972
115 HA THR 18 HA THR 18 -0.830 6.161 3.739
116 HB THR 18 HB THR 18 -1.462 3.720 4.247
117 HG1 THR 18 1HG THR 18 -1.444 5.399 5.785
118 HG21 THR 18 1HG2 THR 18 0.807 2.799 3.614
119 HG22 THR 18 2HG2 THR 18 1.470 3.637 5.047
120 HG23 THR 18 3HG2 THR 18 0.276 2.357 5.244
121 H ILE 19 H ILE 19 1.693 4.575 1.846
122 HA ILE 19 HA ILE 19 3.836 5.384 3.583
123 HB ILE 19 HB ILE 19 3.567 4.070 0.881
124 HG12 ILE 19 2HG1 ILE 19 4.843 2.941 3.389
125 HG13 ILE 19 3HG1 ILE 19 3.088 2.985 3.262
126 HG21 ILE 19 1HG2 ILE 19 5.650 5.336 0.783
127 HG22 ILE 19 2HG2 ILE 19 6.111 4.774 2.403
128 HG23 ILE 19 3HG2 ILE 19 6.042 3.630 1.042
129 HD11 ILE 19 1HD1 ILE 19 3.966 0.836 2.489
130 HD12 ILE 19 2HD1 ILE 19 3.133 1.710 1.185
131 HD13 ILE 19 3HD1 ILE 19 4.906 1.669 1.231
132 H CYS 20 H CYS 20 2.657 6.447 0.298
133 HA CYS 20 HA CYS 20 4.403 8.897 0.489
134 HB2 CYS 20 2HB CYS 20 3.741 9.291 -1.768
135 HB3 CYS 20 3HB CYS 20 4.440 7.680 -1.605
136 H LEU 21 H LEU 21 1.573 8.022 1.877
137 HA LEU 21 HA LEU 21 -0.428 9.015 2.351
138 HB2 LEU 21 2HB LEU 21 1.598 11.174 2.964
139 HB3 LEU 21 3HB LEU 21 -0.070 11.188 3.552
140 HG LEU 21 HG LEU 21 1.872 8.913 4.091
141 HD11 LEU 21 1HD1 LEU 21 2.103 9.839 6.349
142 HD12 LEU 21 2HD1 LEU 21 2.718 10.952 5.116
143 HD13 LEU 21 3HD1 LEU 21 1.134 11.257 5.873
144 HD21 LEU 21 1HD2 LEU 21 0.266 8.310 5.871
145 HD22 LEU 21 2HD2 LEU 21 -0.772 9.686 5.434
146 HD23 LEU 21 3HD2 LEU 21 -0.561 8.319 4.319
147 H SER 22 H SER 22 -0.578 8.878 -0.190
148 HA SER 22 HA SER 22 -1.840 11.426 -0.996
149 HB2 SER 22 2HB SER 22 0.659 10.314 -2.107
150 HB3 SER 22 3HB SER 22 -0.600 10.524 -3.340
151 HG SER 22 HG SER 22 0.318 12.456 -1.471
152 H ILE 23 H ILE 23 -3.434 11.110 -2.702
153 HA ILE 23 HA ILE 23 -4.895 8.644 -2.492
154 HB ILE 23 HB ILE 23 -5.001 11.183 -4.167
155 HG12 ILE 23 2HG1 ILE 23 -5.625 11.176 -1.664
156 HG13 ILE 23 3HG1 ILE 23 -6.756 11.897 -2.802
157 HG21 ILE 23 1HG2 ILE 23 -5.954 9.639 -5.636
158 HG22 ILE 23 2HG2 ILE 23 -6.870 8.810 -4.366
159 HG23 ILE 23 3HG2 ILE 23 -7.305 10.464 -4.878
160 HD11 ILE 23 1HD1 ILE 23 -7.805 10.433 -1.027
161 HD12 ILE 23 2HD1 ILE 23 -8.249 10.022 -2.689
162 HD13 ILE 23 3HD1 ILE 23 -7.060 9.030 -1.824
163 H LEU 24 H LEU 24 -5.264 7.246 -4.336
164 HA LEU 24 HA LEU 24 -2.942 6.796 -6.089
165 HB2 LEU 24 2HB LEU 24 -5.315 5.071 -5.194
166 HB3 LEU 24 3HB LEU 24 -3.914 4.482 -6.104
167 HG LEU 24 HG LEU 24 -3.706 5.677 -3.302
168 HD11 LEU 24 1HD1 LEU 24 -3.614 2.791 -4.159
169 HD12 LEU 24 2HD1 LEU 24 -3.405 3.448 -2.506
170 HD13 LEU 24 3HD1 LEU 24 -4.979 3.585 -3.330
171 HD21 LEU 24 1HD2 LEU 24 -1.484 4.386 -3.542
172 HD22 LEU 24 2HD2 LEU 24 -1.821 4.400 -5.280
173 HD23 LEU 24 3HD2 LEU 24 -1.680 5.950 -4.402
174 H GLU 25 H GLU 25 -4.852 5.075 -7.722
175 HA GLU 25 HA GLU 25 -7.035 6.648 -8.530
176 HB2 GLU 25 2HB GLU 25 -6.446 6.990 -10.872
177 HB3 GLU 25 3HB GLU 25 -5.303 7.832 -9.820
178 HG2 GLU 25 2HG GLU 25 -3.722 5.891 -10.090
179 HG3 GLU 25 3HG GLU 25 -4.822 5.232 -11.317
180 H GLU 26 H GLU 26 -8.148 5.340 -10.448
181 HA GLU 26 HA GLU 26 -7.900 2.478 -9.780
182 HB2 GLU 26 2HB GLU 26 -10.143 3.416 -9.851
183 HB3 GLU 26 3HB GLU 26 -9.862 4.109 -11.446
184 HG2 GLU 26 2HG GLU 26 -11.272 2.108 -11.561
185 HG3 GLU 26 3HG GLU 26 -9.781 1.902 -12.471
186 H GLY 27 H GLY 27 -6.909 1.080 -11.151
187 HA2 GLY 27 2HA GLY 27 -5.973 0.240 -13.107
188 HA3 GLY 27 3HA GLY 27 -6.347 1.758 -13.934
189 H GLU 28 H GLU 28 -4.385 1.343 -10.945
190 HA GLU 28 HA GLU 28 -1.975 2.233 -12.455
191 HB2 GLU 28 2HB GLU 28 -3.347 3.613 -10.433
192 HB3 GLU 28 3HB GLU 28 -2.020 2.888 -9.573
193 HG2 GLU 28 2HG GLU 28 -1.736 4.562 -12.117
194 HG3 GLU 28 3HG GLU 28 -1.582 5.205 -10.476
195 H ASP 29 H ASP 29 0.084 1.615 -11.028
196 HA ASP 29 HA ASP 29 -0.187 -1.293 -10.624
197 HB2 ASP 29 2HB ASP 29 2.160 0.603 -10.719
198 HB3 ASP 29 3HB ASP 29 2.314 -1.085 -10.243
199 H VAL 30 H VAL 30 -1.003 -1.798 -8.716
200 HA VAL 30 HA VAL 30 0.119 -0.606 -6.249
201 HB VAL 30 HB VAL 30 -2.059 -0.286 -5.299
202 HG11 VAL 30 1HG1 VAL 30 -2.842 1.637 -6.519
203 HG12 VAL 30 2HG1 VAL 30 -1.083 1.590 -6.707
204 HG13 VAL 30 3HG1 VAL 30 -2.129 1.050 -8.026
205 HG21 VAL 30 1HG2 VAL 30 -4.144 -0.450 -6.649
206 HG22 VAL 30 2HG2 VAL 30 -3.223 -1.166 -7.980
207 HG23 VAL 30 3HG2 VAL 30 -3.378 -2.030 -6.430
208 H ARG 31 H ARG 31 -0.278 -2.026 -4.335
209 HA ARG 31 HA ARG 31 -0.727 -4.850 -5.142
210 HB2 ARG 31 2HB ARG 31 1.404 -3.556 -3.464
211 HB3 ARG 31 3HB ARG 31 0.782 -5.068 -2.871
212 HG2 ARG 31 2HG ARG 31 1.593 -5.205 -5.723
213 HG3 ARG 31 3HG ARG 31 2.889 -4.726 -4.610
214 HD2 ARG 31 2HD ARG 31 2.103 -6.740 -3.157
215 HD3 ARG 31 3HD ARG 31 1.309 -7.303 -4.640
216 HE ARG 31 HE ARG 31 3.989 -6.674 -5.289
217 HH11 ARG 31 1HH1 ARG 31 5.742 -9.493 -4.087
218 HH12 ARG 31 2HH1 ARG 31 5.848 -8.169 -5.082
219 HH21 ARG 31 1HH2 ARG 31 3.608 -10.083 -3.132
220 HH22 ARG 31 2HH2 ARG 31 2.258 -8.998 -3.272
221 H ARG 32 H ARG 32 -1.929 -6.031 -3.604
222 HA ARG 32 HA ARG 32 -3.329 -4.408 -1.517
223 HB2 ARG 32 2HB ARG 32 -4.567 -5.536 -3.575
224 HB3 ARG 32 3HB ARG 32 -4.281 -7.046 -2.715
225 HG2 ARG 32 2HG ARG 32 -5.901 -4.628 -1.833
226 HG3 ARG 32 3HG ARG 32 -6.461 -6.270 -2.165
227 HD2 ARG 32 2HD ARG 32 -4.840 -6.911 -0.144
228 HD3 ARG 32 3HD ARG 32 -4.963 -5.202 0.238
229 HE ARG 32 HE ARG 32 -7.182 -5.410 0.757
230 HH11 ARG 32 1HH1 ARG 32 -9.155 -8.374 0.918
231 HH12 ARG 32 2HH1 ARG 32 -9.087 -6.690 1.300
232 HH21 ARG 32 1HH2 ARG 32 -7.343 -9.395 -0.225
233 HH22 ARG 32 2HH2 ARG 32 -5.961 -8.437 -0.613
234 H LEU 33 H LEU 33 -2.321 -4.719 0.289
235 HA LEU 33 HA LEU 33 -0.753 -7.148 0.826
236 HB2 LEU 33 2HB LEU 33 -0.124 -5.760 2.890
237 HB3 LEU 33 3HB LEU 33 0.409 -5.137 1.345
238 HG LEU 33 HG LEU 33 -2.269 -4.200 2.216
239 HD11 LEU 33 1HD1 LEU 33 -1.323 -2.585 3.848
240 HD12 LEU 33 2HD1 LEU 33 -1.075 -4.259 4.383
241 HD13 LEU 33 3HD1 LEU 33 0.272 -3.347 3.685
242 HD21 LEU 33 1HD2 LEU 33 0.253 -2.736 1.303
243 HD22 LEU 33 2HD2 LEU 33 -1.018 -3.263 0.205
244 HD23 LEU 33 3HD2 LEU 33 -1.373 -2.030 1.424
245 HA PRO 34 HA PRO 34 -3.841 -9.132 2.913
246 HB2 PRO 34 2HB PRO 34 -2.728 -10.378 5.097
247 HB3 PRO 34 3HB PRO 34 -2.359 -10.802 3.397
248 HG2 PRO 34 2HG PRO 34 -0.756 -9.067 5.279
249 HG3 PRO 34 3HG PRO 34 -0.173 -10.320 4.133
250 HD2 PRO 34 2HD PRO 34 -0.166 -7.621 3.663
251 HD3 PRO 34 3HD PRO 34 -0.236 -8.800 2.352
252 H CYS 35 H CYS 35 -2.423 -6.570 4.750
253 HA CYS 35 HA CYS 35 -4.254 -6.515 7.051
254 HB2 CYS 35 2HB CYS 35 -1.887 -5.502 6.710
255 HB3 CYS 35 3HB CYS 35 -2.752 -4.240 5.796
256 H MET 36 H MET 36 -5.090 -6.349 3.846
257 HA MET 36 HA MET 36 -7.001 -5.847 2.897
258 HB2 MET 36 2HB MET 36 -7.896 -4.154 5.266
259 HB3 MET 36 3HB MET 36 -8.863 -4.745 3.918
260 HG2 MET 36 2HG MET 36 -8.249 -7.101 4.596
261 HG3 MET 36 3HG MET 36 -7.540 -6.440 6.068
262 HE1 MET 36 1HE MET 36 -8.792 -6.768 8.170
263 HE2 MET 36 2HE MET 36 -8.982 -5.021 7.883
264 HE3 MET 36 3HE MET 36 -10.367 -5.992 8.437
265 H HIS 37 H HIS 37 -5.403 -3.195 4.503
266 HA HIS 37 HA HIS 37 -5.897 -1.014 2.859
267 HB2 HIS 37 1HB HIS 37 -3.392 -1.896 4.381
268 HB3 HIS 37 2HB HIS 37 -3.663 -0.260 3.767
269 HD2 HIS 37 2HD HIS 37 -6.575 0.321 4.563
270 HE1 HIS 37 1HE HIS 37 -5.597 -0.622 8.586
271 HE2 HIS 37 2HE HIS 37 -7.286 0.533 7.064
272 H LEU 38 H LEU 38 -4.337 0.041 1.176
273 HA LEU 38 HA LEU 38 -3.023 -1.966 -0.528
274 HB2 LEU 38 2HB LEU 38 -4.648 -2.104 -2.051
275 HB3 LEU 38 3HB LEU 38 -5.713 -1.382 -0.868
276 HG LEU 38 HG LEU 38 -5.026 0.924 -1.899
277 HD11 LEU 38 1HD1 LEU 38 -4.525 0.700 -4.350
278 HD12 LEU 38 2HD1 LEU 38 -3.162 0.161 -3.371
279 HD13 LEU 38 3HD1 LEU 38 -4.245 -1.032 -4.123
280 HD21 LEU 38 1HD2 LEU 38 -6.689 -1.125 -3.395
281 HD22 LEU 38 2HD2 LEU 38 -7.224 -0.055 -2.079
282 HD23 LEU 38 3HD2 LEU 38 -6.726 0.631 -3.627
283 H PHE 39 H PHE 39 -1.351 -1.027 -1.728
284 HA PHE 39 HA PHE 39 -0.951 1.912 -1.465
285 HB2 PHE 39 2HB PHE 39 0.959 -0.276 -0.596
286 HB3 PHE 39 3HB PHE 39 1.329 1.440 -0.571
287 HD1 PHE 39 1HD PHE 39 1.457 -0.743 1.700
288 HD2 PHE 39 2HD PHE 39 -1.455 2.267 0.737
289 HE1 PHE 39 1HE PHE 39 0.528 -0.899 3.978
290 HE2 PHE 39 2HE PHE 39 -2.404 2.086 2.988
291 HZ PHE 39 HZ PHE 39 -1.412 0.489 4.636
292 H HIS 40 H HIS 40 0.887 2.635 -2.960
293 HA HIS 40 HA HIS 40 0.695 1.432 -5.550
294 HB2 HIS 40 1HB HIS 40 2.897 3.160 -4.381
295 HB3 HIS 40 2HB HIS 40 2.814 2.696 -6.068
296 HD2 HIS 40 2HD HIS 40 0.600 3.604 -7.508
297 HE1 HIS 40 1HE HIS 40 0.562 7.242 -5.291
298 HE2 HIS 40 2HE HIS 40 -0.225 6.065 -7.441
299 H GLN 41 H GLN 41 2.152 0.134 -6.742
300 HA GLN 41 HA GLN 41 3.669 -1.880 -5.363
301 HB2 GLN 41 2HB GLN 41 2.817 -1.218 -8.123
302 HB3 GLN 41 3HB GLN 41 4.390 -1.997 -8.065
303 HG2 GLN 41 2HG GLN 41 3.516 -3.784 -6.679
304 HG3 GLN 41 3HG GLN 41 1.905 -3.036 -6.691
305 HE21 GLN 41 1HE2 GLN 41 0.479 -3.906 -8.302
306 HE22 GLN 41 2HE2 GLN 41 1.101 -4.594 -9.793
307 H VAL 42 H VAL 42 4.584 1.200 -5.466
308 HA VAL 42 HA VAL 42 7.445 0.529 -5.976
309 HB VAL 42 HB VAL 42 5.962 3.134 -6.527
310 HG11 VAL 42 1HG1 VAL 42 8.162 3.942 -7.395
311 HG12 VAL 42 2HG1 VAL 42 8.187 3.674 -5.648
312 HG13 VAL 42 3HG1 VAL 42 8.936 2.484 -6.735
313 HG21 VAL 42 1HG2 VAL 42 6.709 2.701 -8.866
314 HG22 VAL 42 2HG2 VAL 42 7.403 1.150 -8.346
315 HG23 VAL 42 3HG2 VAL 42 5.649 1.417 -8.274
316 H CYS 43 H CYS 43 5.339 2.941 -4.295
317 HA CYS 43 HA CYS 43 6.868 3.541 -2.012
318 HB2 CYS 43 2HB CYS 43 3.892 2.920 -2.072
319 HB3 CYS 43 3HB CYS 43 4.771 3.990 -0.983
320 H VAL 44 H VAL 44 4.612 0.756 -2.483
321 HA VAL 44 HA VAL 44 5.353 -0.275 0.087
322 HB VAL 44 HB VAL 44 3.070 -0.260 -1.086
323 HG11 VAL 44 1HG1 VAL 44 2.457 -2.101 -2.352
324 HG12 VAL 44 2HG1 VAL 44 4.046 -1.706 -3.044
325 HG13 VAL 44 3HG1 VAL 44 3.908 -3.048 -1.905
326 HG21 VAL 44 1HG2 VAL 44 4.142 -2.688 0.389
327 HG22 VAL 44 2HG2 VAL 44 3.579 -1.188 1.135
328 HG23 VAL 44 3HG2 VAL 44 2.430 -2.244 0.255
329 H ASP 45 H ASP 45 6.570 -0.742 -3.067
330 HA ASP 45 HA ASP 45 7.617 -3.442 -2.780
331 HB2 ASP 45 2HB ASP 45 7.688 -2.644 -4.976
332 HB3 ASP 45 3HB ASP 45 8.303 -1.056 -4.504
333 H GLN 46 H GLN 46 9.295 -0.261 -2.548
334 HA GLN 46 HA GLN 46 11.425 -1.330 -1.023
335 HB2 GLN 46 2HB GLN 46 10.340 1.481 -1.403
336 HB3 GLN 46 3HB GLN 46 11.700 1.189 -0.312
337 HG2 GLN 46 2HG GLN 46 11.699 0.256 -3.216
338 HG3 GLN 46 3HG GLN 46 12.320 1.828 -2.703
339 HE21 GLN 46 1HE2 GLN 46 14.058 1.777 -0.890
340 HE22 GLN 46 2HE2 GLN 46 15.174 0.420 -0.991
341 H ALA 47 H ALA 47 8.243 -0.260 0.118
342 HA ALA 47 HA ALA 47 8.957 -0.233 2.885
343 HB1 ALA 47 1HB ALA 47 6.811 0.556 1.882
344 HB2 ALA 47 2HB ALA 47 6.340 -1.156 1.668
345 HB3 ALA 47 3HB ALA 47 6.595 -0.503 3.298
346 H LEU 48 H LEU 48 7.717 -2.917 0.832
347 HA LEU 48 HA LEU 48 7.527 -4.849 2.891
348 HB2 LEU 48 2HB LEU 48 6.299 -4.878 0.776
349 HB3 LEU 48 3HB LEU 48 7.776 -5.106 -0.147
350 HG LEU 48 HG LEU 48 6.865 -7.111 1.961
351 HD11 LEU 48 1HD1 LEU 48 5.024 -6.759 0.349
352 HD12 LEU 48 2HD1 LEU 48 6.146 -7.070 -0.996
353 HD13 LEU 48 3HD1 LEU 48 5.752 -8.359 0.165
354 HD21 LEU 48 1HD2 LEU 48 9.096 -7.646 1.278
355 HD22 LEU 48 2HD2 LEU 48 8.077 -8.676 0.276
356 HD23 LEU 48 3HD2 LEU 48 8.771 -7.201 -0.414
357 H ILE 49 H ILE 49 10.075 -4.247 0.403
358 HA ILE 49 HA ILE 49 11.792 -6.301 1.403
359 HB ILE 49 HB ILE 49 13.496 -5.406 0.033
360 HG12 ILE 49 2HG1 ILE 49 12.841 -3.166 -1.256
361 HG13 ILE 49 3HG1 ILE 49 12.100 -2.829 0.318
362 HG21 ILE 49 1HG2 ILE 49 12.442 -5.384 -2.118
363 HG22 ILE 49 2HG2 ILE 49 11.541 -6.499 -1.075
364 HG23 ILE 49 3HG2 ILE 49 10.894 -4.885 -1.442
365 HD11 ILE 49 1HD1 ILE 49 14.259 -3.121 1.441
366 HD12 ILE 49 2HD1 ILE 49 15.004 -3.649 -0.081
367 HD13 ILE 49 3HD1 ILE 49 14.441 -1.977 0.106
368 H THR 50 H THR 50 11.284 -2.922 2.427
369 HA THR 50 HA THR 50 13.642 -2.764 4.013
370 HB THR 50 HB THR 50 11.042 -1.243 3.881
371 HG1 THR 50 1HG THR 50 12.577 -0.671 2.475
372 HG21 THR 50 1HG2 THR 50 11.951 0.362 5.557
373 HG22 THR 50 2HG2 THR 50 11.350 -1.149 6.237
374 HG23 THR 50 3HG2 THR 50 13.116 -0.885 6.061
375 H ASN 51 H ASN 51 10.229 -3.519 4.946
376 HA ASN 51 HA ASN 51 11.084 -5.532 6.836
377 HB2 ASN 51 2HB ASN 51 9.881 -2.892 7.792
378 HB3 ASN 51 3HB ASN 51 9.619 -4.414 8.649
379 HD21 ASN 51 1HD2 ASN 51 12.079 -1.938 7.942
380 HD22 ASN 51 2HD2 ASN 51 13.213 -2.608 9.093
381 H LYS 52 H LYS 52 9.484 -7.104 6.428
382 HA LYS 52 HA LYS 52 7.069 -6.359 5.011
383 HB2 LYS 52 2HB LYS 52 7.739 -8.956 6.468
384 HB3 LYS 52 3HB LYS 52 6.376 -8.667 5.400
385 HG2 LYS 52 2HG LYS 52 7.703 -9.576 3.834
386 HG3 LYS 52 3HG LYS 52 8.318 -7.939 3.679
387 HD2 LYS 52 2HD LYS 52 10.292 -8.476 4.974
388 HD3 LYS 52 3HD LYS 52 9.546 -9.979 5.576
389 HE2 LYS 52 2HE LYS 52 9.421 -10.758 3.168
390 HE3 LYS 52 3HE LYS 52 10.487 -9.398 2.739
391 HZ1 LYS 52 1HZ LYS 52 11.637 -11.511 3.172
392 HZ2 LYS 52 2HZ LYS 52 12.119 -10.362 4.274
393 HZ3 LYS 52 3HZ LYS 52 11.033 -11.549 4.675
394 H LYS 53 H LYS 53 5.892 -4.843 6.165
395 HA LYS 53 HA LYS 53 3.993 -6.017 7.957
396 HB2 LYS 53 2HB LYS 53 4.325 -4.233 9.762
397 HB3 LYS 53 3HB LYS 53 5.444 -5.592 9.775
398 HG2 LYS 53 2HG LYS 53 7.188 -4.247 8.704
399 HG3 LYS 53 3HG LYS 53 6.080 -2.870 8.541
400 HD2 LYS 53 2HD LYS 53 5.915 -2.721 11.014
401 HD3 LYS 53 3HD LYS 53 6.930 -4.166 11.166
402 HE2 LYS 53 2HE LYS 53 8.444 -2.396 11.510
403 HE3 LYS 53 3HE LYS 53 8.721 -2.912 9.844
404 HZ1 LYS 53 1HZ LYS 53 7.148 -0.570 10.702
405 HZ2 LYS 53 2HZ LYS 53 8.616 -0.544 9.966
406 HZ3 LYS 53 3HZ LYS 53 7.293 -1.069 9.138
407 H CYS 54 H CYS 54 2.115 -4.663 8.036
408 HA CYS 54 HA CYS 54 1.765 -2.557 5.982
409 HB2 CYS 54 2HB CYS 54 -0.043 -4.072 6.746
410 HB3 CYS 54 3HB CYS 54 0.103 -3.416 8.378
411 HA PRO 55 HA PRO 55 3.633 0.279 9.057
412 HB2 PRO 55 2HB PRO 55 4.198 2.381 7.441
413 HB3 PRO 55 3HB PRO 55 5.092 0.838 7.314
414 HG2 PRO 55 2HG PRO 55 2.744 1.749 5.629
415 HG3 PRO 55 3HG PRO 55 4.317 1.093 5.072
416 HD2 PRO 55 2HD PRO 55 2.065 -0.442 5.372
417 HD3 PRO 55 3HD PRO 55 3.710 -1.087 5.631
418 H ILE 56 H ILE 56 1.304 -0.044 9.645
419 HA ILE 56 HA ILE 56 0.021 2.453 10.264
420 HB ILE 56 HB ILE 56 -1.560 0.287 8.781
421 HG12 ILE 56 2HG1 ILE 56 -1.050 3.159 7.966
422 HG13 ILE 56 3HG1 ILE 56 -0.437 1.686 7.191
423 HG21 ILE 56 1HG2 ILE 56 -2.607 2.870 10.004
424 HG22 ILE 56 2HG2 ILE 56 -3.565 1.578 9.241
425 HG23 ILE 56 3HG2 ILE 56 -2.767 1.277 10.767
426 HD11 ILE 56 1HD1 ILE 56 -2.795 0.975 6.732
427 HD12 ILE 56 2HD1 ILE 56 -3.340 2.578 7.294
428 HD13 ILE 56 3HD1 ILE 56 -2.297 2.443 5.882
429 H CYS 57 H CYS 57 -0.420 -1.050 9.946
430 HA CYS 57 HA CYS 57 -1.735 -1.314 12.550
431 HB2 CYS 57 2HB CYS 57 -1.190 -3.372 10.379
432 HB3 CYS 57 3HB CYS 57 -2.445 -3.364 11.629
433 H ARG 58 H ARG 58 1.034 -2.810 10.896
434 HA ARG 58 HA ARG 58 3.051 -3.553 11.866
435 HB2 ARG 58 2HB ARG 58 1.439 -4.263 14.360
436 HB3 ARG 58 3HB ARG 58 3.010 -4.922 14.000
437 HG2 ARG 58 2HG ARG 58 4.074 -2.772 13.923
438 HG3 ARG 58 3HG ARG 58 2.534 -1.928 14.188
439 HD2 ARG 58 2HD ARG 58 2.300 -2.940 16.388
440 HD3 ARG 58 3HD ARG 58 3.719 -3.976 16.112
441 HE ARG 58 HE ARG 58 4.519 -1.298 15.774
442 HH11 ARG 58 1HH1 ARG 58 5.619 -0.740 19.077
443 HH12 ARG 58 2HH1 ARG 58 5.721 -0.207 17.442
444 HH21 ARG 58 1HH2 ARG 58 4.260 -2.613 19.626
445 HH22 ARG 58 2HH2 ARG 58 3.391 -3.406 18.360
446 H VAL 59 H VAL 59 -0.032 -5.028 11.377
447 HA VAL 59 HA VAL 59 0.557 -7.736 11.532
448 HB VAL 59 HB VAL 59 -1.064 -6.429 9.324
449 HG11 VAL 59 1HG1 VAL 59 -0.707 -8.831 8.941
450 HG12 VAL 59 2HG1 VAL 59 -1.267 -9.195 10.589
451 HG13 VAL 59 3HG1 VAL 59 -2.383 -8.524 9.380
452 HG21 VAL 59 1HG2 VAL 59 -3.033 -6.779 10.838
453 HG22 VAL 59 2HG2 VAL 59 -1.922 -7.259 12.138
454 HG23 VAL 59 3HG2 VAL 59 -1.908 -5.602 11.498
455 H ASP 60 H ASP 60 1.589 -9.204 10.262
456 HA ASP 60 HA ASP 60 3.757 -8.233 8.597
457 HB2 ASP 60 2HB ASP 60 3.960 -10.200 10.093
458 HB3 ASP 60 3HB ASP 60 2.759 -11.059 9.119
459 H ILE 61 H ILE 61 3.998 -8.613 6.390
460 HA ILE 61 HA ILE 61 1.531 -9.243 4.863
461 HB ILE 61 HB ILE 61 2.206 -7.655 3.217
462 HG12 ILE 61 2HG1 ILE 61 4.613 -7.054 4.997
463 HG13 ILE 61 3HG1 ILE 61 4.675 -7.922 3.450
464 HG21 ILE 61 1HG2 ILE 61 1.704 -5.643 4.421
465 HG22 ILE 61 2HG2 ILE 61 0.939 -6.949 5.343
466 HG23 ILE 61 3HG2 ILE 61 2.470 -6.265 5.903
467 HD11 ILE 61 1HD1 ILE 61 5.250 -5.693 2.996
468 HD12 ILE 61 2HD1 ILE 61 3.599 -5.984 2.365
469 HD13 ILE 61 3HD1 ILE 61 3.838 -5.065 3.883
470 H GLU 62 H GLU 62 4.797 -10.127 5.449
471 HA GLU 62 HA GLU 62 5.571 -11.211 3.000
472 HB2 GLU 62 2HB GLU 62 6.886 -11.175 5.217
473 HB3 GLU 62 3HB GLU 62 5.962 -12.608 5.684
474 HG2 GLU 62 2HG GLU 62 6.774 -13.786 3.639
475 HG3 GLU 62 3HG GLU 62 7.654 -12.334 3.157
476 H ALA 63 H ALA 63 5.088 -13.158 1.917
477 HA ALA 63 HA ALA 63 3.153 -14.996 3.086
478 HB1 ALA 63 1HB ALA 63 1.631 -14.852 1.137
479 HB2 ALA 63 2HB ALA 63 1.713 -13.297 1.986
480 HB3 ALA 63 3HB ALA 63 2.604 -13.520 0.465
481 H GLN 64 H GLN 64 2.892 -16.852 1.348
482 HA GLN 64 HA GLN 64 5.554 -17.807 0.964
483 HB2 GLN 64 2HB GLN 64 3.492 -19.172 1.486
484 HB3 GLN 64 3HB GLN 64 2.960 -18.928 -0.185
485 HG2 GLN 64 2HG GLN 64 5.093 -20.005 -0.971
486 HG3 GLN 64 3HG GLN 64 5.566 -20.238 0.720
487 HE21 GLN 64 1HE2 GLN 64 5.490 -22.524 0.905
488 HE22 GLN 64 2HE2 GLN 64 4.016 -23.416 0.546
489 H LEU 65 H LEU 65 6.665 -16.366 -0.427
490 HA LEU 65 HA LEU 65 5.870 -16.526 -3.284
491 HB2 LEU 65 2HB LEU 65 5.244 -14.378 -1.838
492 HB3 LEU 65 3HB LEU 65 6.939 -13.980 -2.072
493 HG LEU 65 HG LEU 65 6.497 -14.381 -4.605
494 HD11 LEU 65 1HD1 LEU 65 4.272 -15.539 -4.317
495 HD12 LEU 65 2HD1 LEU 65 3.617 -14.050 -3.618
496 HD13 LEU 65 3HD1 LEU 65 4.148 -14.084 -5.314
497 HD21 LEU 65 1HD2 LEU 65 6.811 -12.180 -3.628
498 HD22 LEU 65 2HD2 LEU 65 5.498 -12.092 -4.817
499 HD23 LEU 65 3HD2 LEU 65 5.128 -12.122 -3.072
500 HA PRO 66 HA PRO 66 10.201 -17.755 -2.727
501 HB2 PRO 66 2HB PRO 66 10.448 -19.422 -4.889
502 HB3 PRO 66 3HB PRO 66 9.592 -19.887 -3.385
503 HG2 PRO 66 2HG PRO 66 8.390 -18.845 -5.965
504 HG3 PRO 66 3HG PRO 66 7.865 -20.249 -4.985
505 HD2 PRO 66 2HD PRO 66 6.678 -17.794 -4.792
506 HD3 PRO 66 3HD PRO 66 6.864 -18.860 -3.363
507 H SER 67 H SER 67 8.748 -16.542 -5.770
508 HA SER 67 HA SER 67 11.133 -14.897 -6.263
509 HB2 SER 67 2HB SER 67 9.788 -16.651 -8.374
510 HB3 SER 67 3HB SER 67 11.124 -15.516 -8.641
511 HG SER 67 HG SER 67 11.938 -17.595 -8.431
512 H GLU 68 H GLU 68 10.493 -12.940 -7.527
513 HA GLU 68 HA GLU 68 7.789 -12.839 -8.497
514 HB2 GLU 68 2HB GLU 68 7.192 -10.770 -7.364
515 HB3 GLU 68 3HB GLU 68 7.358 -12.106 -6.232
516 HG2 GLU 68 2HG GLU 68 9.467 -11.245 -5.392
517 HG3 GLU 68 3HG GLU 68 9.527 -10.007 -6.660
518 H SER 69 H SER 69 7.530 -11.079 -9.966
519 HA SER 69 HA SER 69 8.221 -10.145 -11.900
520 HB2 SER 69 2HB SER 69 10.109 -8.739 -9.978
521 HB3 SER 69 3HB SER 69 9.691 -8.174 -11.606
522 HG SER 69 HG SER 69 7.522 -8.017 -10.934
Start of MODEL 7
1 H1 MET 1 H1 MET 1 6.817 30.363 9.846
2 H2 MET 1 H2 MET 1 6.503 31.242 11.197
3 H3 MET 1 H3 MET 1 6.021 31.806 9.728
4 HA MET 1 HA MET 1 7.923 32.968 10.578
5 HB2 MET 1 2HB MET 1 10.013 31.964 10.923
6 HB3 MET 1 3HB MET 1 8.837 30.964 11.772
7 HG2 MET 1 2HG MET 1 8.870 29.579 9.479
8 HG3 MET 1 3HG MET 1 10.427 30.390 9.281
9 HE1 MET 1 1HE MET 1 9.268 27.086 12.261
10 HE2 MET 1 2HE MET 1 8.266 28.532 12.010
11 HE3 MET 1 3HE MET 1 8.545 27.394 10.667
12 H LYS 2 H LYS 2 7.703 30.547 7.813
13 HA LYS 2 HA LYS 2 9.416 32.294 6.277
14 HB2 LYS 2 2HB LYS 2 9.111 29.714 6.024
15 HB3 LYS 2 3HB LYS 2 7.665 30.114 5.082
16 HG2 LYS 2 2HG LYS 2 9.162 31.726 3.743
17 HG3 LYS 2 3HG LYS 2 10.539 31.008 4.594
18 HD2 LYS 2 2HD LYS 2 10.067 28.824 3.639
19 HD3 LYS 2 3HD LYS 2 8.562 29.415 2.904
20 HE2 LYS 2 2HE LYS 2 10.896 31.105 2.266
21 HE3 LYS 2 3HE LYS 2 11.138 29.435 1.740
22 HZ1 LYS 2 1HZ LYS 2 9.119 29.562 0.484
23 HZ2 LYS 2 2HZ LYS 2 8.777 31.072 1.043
24 HZ3 LYS 2 3HZ LYS 2 10.074 30.831 0.060
25 H GLN 3 H GLN 3 6.012 31.284 5.563
26 HA GLN 3 HA GLN 3 5.146 34.029 5.643
27 HB2 GLN 3 2HB GLN 3 6.008 33.885 3.283
28 HB3 GLN 3 3HB GLN 3 4.919 32.535 2.984
29 HG2 GLN 3 2HG GLN 3 3.005 34.133 3.717
30 HG3 GLN 3 3HG GLN 3 4.213 35.422 3.659
31 HE21 GLN 3 1HE2 GLN 3 3.685 36.613 1.767
32 HE22 GLN 3 2HE2 GLN 3 3.405 35.816 0.226
33 H ASP 4 H ASP 4 3.922 31.107 3.902
34 HA ASP 4 HA ASP 4 2.333 30.267 6.172
35 HB2 ASP 4 2HB ASP 4 1.003 31.978 4.668
36 HB3 ASP 4 3HB ASP 4 0.947 30.657 3.495
37 H GLY 5 H GLY 5 1.066 28.077 4.944
38 HA2 GLY 5 2HA GLY 5 2.597 26.946 2.784
39 HA3 GLY 5 3HA GLY 5 3.039 26.223 4.347
40 H GLU 6 H GLU 6 1.838 24.635 2.370
41 HA GLU 6 HA GLU 6 -0.892 24.226 3.460
42 HB2 GLU 6 2HB GLU 6 -1.602 23.605 1.212
43 HB3 GLU 6 3HB GLU 6 -1.141 25.301 1.322
44 HG2 GLU 6 2HG GLU 6 0.695 23.137 0.182
45 HG3 GLU 6 3HG GLU 6 -0.458 24.040 -0.778
46 H GLU 7 H GLU 7 -1.544 22.143 3.807
47 HA GLU 7 HA GLU 7 -0.476 19.971 2.440
48 HB2 GLU 7 2HB GLU 7 0.858 20.552 4.945
49 HB3 GLU 7 3HB GLU 7 -0.181 19.153 5.218
50 HG2 GLU 7 2HG GLU 7 1.799 19.393 2.905
51 HG3 GLU 7 3HG GLU 7 2.154 18.609 4.445
52 H GLY 8 H GLY 8 -2.174 18.467 2.497
53 HA2 GLY 8 2HA GLY 8 -4.449 18.726 4.308
54 HA3 GLY 8 3HA GLY 8 -4.716 19.556 2.760
55 H THR 9 H THR 9 -6.540 17.883 2.500
56 HA THR 9 HA THR 9 -5.424 15.791 0.887
57 HB THR 9 HB THR 9 -5.461 14.898 3.294
58 HG1 THR 9 1HG THR 9 -5.090 13.591 1.650
59 HG21 THR 9 1HG2 THR 9 -7.541 13.972 4.078
60 HG22 THR 9 2HG2 THR 9 -7.765 15.713 3.785
61 HG23 THR 9 3HG2 THR 9 -8.395 14.523 2.620
62 H GLU 10 H GLU 10 -6.977 14.867 -0.526
63 HA GLU 10 HA GLU 10 -9.690 15.874 -0.595
64 HB2 GLU 10 2HB GLU 10 -9.381 16.891 -2.833
65 HB3 GLU 10 3HB GLU 10 -8.459 17.728 -1.586
66 HG2 GLU 10 2HG GLU 10 -6.501 16.058 -2.430
67 HG3 GLU 10 3HG GLU 10 -7.475 16.073 -3.898
68 H GLU 11 H GLU 11 -10.883 14.549 -2.091
69 HA GLU 11 HA GLU 11 -11.578 12.535 -2.741
70 HB2 GLU 11 2HB GLU 11 -9.006 12.799 -4.268
71 HB3 GLU 11 3HB GLU 11 -9.983 11.318 -4.382
72 HG2 GLU 11 2HG GLU 11 -11.945 12.551 -5.056
73 HG3 GLU 11 3HG GLU 11 -11.142 14.101 -4.775
74 H ASP 12 H ASP 12 -11.999 10.902 -1.378
75 HA ASP 12 HA ASP 12 -9.883 9.005 -0.780
76 HB2 ASP 12 2HB ASP 12 -9.748 11.035 0.906
77 HB3 ASP 12 3HB ASP 12 -11.157 10.310 1.654
78 H THR 13 H THR 13 -11.757 8.221 -2.203
79 HA THR 13 HA THR 13 -13.767 6.794 -0.565
80 HB THR 13 HB THR 13 -14.194 9.403 -1.885
81 HG1 THR 13 1HG THR 13 -14.442 8.742 0.376
82 HG21 THR 13 1HG2 THR 13 -15.572 8.188 -3.486
83 HG22 THR 13 2HG2 THR 13 -16.436 7.379 -2.147
84 HG23 THR 13 3HG2 THR 13 -16.559 9.135 -2.363
85 H GLU 14 H GLU 14 -11.552 6.357 -2.748
86 HA GLU 14 HA GLU 14 -13.082 4.475 -4.361
87 HB2 GLU 14 2HB GLU 14 -11.532 6.901 -5.309
88 HB3 GLU 14 3HB GLU 14 -11.393 5.422 -6.244
89 HG2 GLU 14 2HG GLU 14 -14.086 6.651 -5.571
90 HG3 GLU 14 3HG GLU 14 -13.157 7.075 -7.005
91 H GLU 15 H GLU 15 -9.716 5.794 -4.479
92 HA GLU 15 HA GLU 15 -8.677 3.540 -2.906
93 HB2 GLU 15 2HB GLU 15 -7.311 2.994 -5.095
94 HB3 GLU 15 3HB GLU 15 -8.910 2.308 -4.851
95 HG2 GLU 15 2HG GLU 15 -9.946 3.817 -6.335
96 HG3 GLU 15 3HG GLU 15 -8.581 4.922 -6.360
97 H LYS 16 H LYS 16 -6.977 4.480 -1.736
98 HA LYS 16 HA LYS 16 -5.079 6.040 -3.314
99 HB2 LYS 16 2HB LYS 16 -4.719 7.717 -1.547
100 HB3 LYS 16 3HB LYS 16 -6.290 7.872 -2.330
101 HG2 LYS 16 2HG LYS 16 -7.460 7.028 -0.523
102 HG3 LYS 16 3HG LYS 16 -5.999 6.364 0.243
103 HD2 LYS 16 2HD LYS 16 -6.678 8.379 1.422
104 HD3 LYS 16 3HD LYS 16 -5.137 8.677 0.606
105 HE2 LYS 16 2HE LYS 16 -6.257 9.867 -1.223
106 HE3 LYS 16 3HE LYS 16 -7.834 9.367 -0.623
107 HZ1 LYS 16 1HZ LYS 16 -7.502 11.569 -0.043
108 HZ2 LYS 16 2HZ LYS 16 -7.424 10.706 1.360
109 HZ3 LYS 16 3HZ LYS 16 -6.047 11.311 0.696
110 H CYS 17 H CYS 17 -3.059 6.091 -2.517
111 HA CYS 17 HA CYS 17 -1.983 3.695 -1.180
112 HB2 CYS 17 2HB CYS 17 -1.166 4.877 -3.274
113 HB3 CYS 17 3HB CYS 17 -0.742 6.242 -2.256
114 H THR 18 H THR 18 -2.007 3.702 1.117
115 HA THR 18 HA THR 18 -2.204 6.147 2.562
116 HB THR 18 HB THR 18 -2.835 3.791 3.346
117 HG1 THR 18 1HG THR 18 -1.467 5.686 4.947
118 HG21 THR 18 1HG2 THR 18 0.009 3.874 4.440
119 HG22 THR 18 2HG2 THR 18 -1.205 2.610 4.666
120 HG23 THR 18 3HG2 THR 18 -0.474 2.870 3.058
121 H ILE 19 H ILE 19 0.572 4.684 1.067
122 HA ILE 19 HA ILE 19 2.481 5.692 3.010
123 HB ILE 19 HB ILE 19 2.556 4.113 0.446
124 HG12 ILE 19 2HG1 ILE 19 3.660 3.304 3.144
125 HG13 ILE 19 3HG1 ILE 19 1.918 3.235 2.864
126 HG21 ILE 19 1HG2 ILE 19 4.895 5.167 2.088
127 HG22 ILE 19 2HG2 ILE 19 5.039 3.854 0.898
128 HG23 ILE 19 3HG2 ILE 19 4.562 5.477 0.370
129 HD11 ILE 19 1HD1 ILE 19 3.963 1.849 1.103
130 HD12 ILE 19 2HD1 ILE 19 3.006 1.076 2.385
131 HD13 ILE 19 3HD1 ILE 19 2.193 1.762 0.962
132 H CYS 20 H CYS 20 1.676 6.326 -0.475
133 HA CYS 20 HA CYS 20 3.350 8.792 -0.571
134 HB2 CYS 20 2HB CYS 20 1.127 7.986 -2.462
135 HB3 CYS 20 3HB CYS 20 2.447 9.125 -2.714
136 H LEU 21 H LEU 21 0.205 7.928 0.647
137 HA LEU 21 HA LEU 21 -1.746 8.932 0.904
138 HB2 LEU 21 2HB LEU 21 0.060 11.255 1.614
139 HB3 LEU 21 3HB LEU 21 -1.667 11.192 1.980
140 HG LEU 21 HG LEU 21 0.283 9.037 2.910
141 HD11 LEU 21 1HD1 LEU 21 -0.676 11.496 4.402
142 HD12 LEU 21 2HD1 LEU 21 0.271 10.144 5.083
143 HD13 LEU 21 3HD1 LEU 21 0.978 11.173 3.825
144 HD21 LEU 21 1HD2 LEU 21 -1.504 8.553 4.551
145 HD22 LEU 21 2HD2 LEU 21 -2.522 9.824 3.835
146 HD23 LEU 21 3HD2 LEU 21 -2.106 8.369 2.904
147 H SER 22 H SER 22 -1.259 8.618 -1.662
148 HA SER 22 HA SER 22 -2.545 10.996 -2.909
149 HB2 SER 22 2HB SER 22 -0.355 9.257 -4.125
150 HB3 SER 22 3HB SER 22 -1.279 10.504 -4.986
151 HG SER 22 HG SER 22 0.693 11.341 -4.213
152 H ILE 23 H ILE 23 -4.171 10.428 -4.421
153 HA ILE 23 HA ILE 23 -5.505 7.937 -4.230
154 HB ILE 23 HB ILE 23 -5.543 10.394 -5.996
155 HG12 ILE 23 2HG1 ILE 23 -6.500 10.330 -3.605
156 HG13 ILE 23 3HG1 ILE 23 -7.500 11.004 -4.890
157 HG21 ILE 23 1HG2 ILE 23 -6.174 8.849 -7.606
158 HG22 ILE 23 2HG2 ILE 23 -7.210 7.919 -6.510
159 HG23 ILE 23 3HG2 ILE 23 -7.679 9.558 -7.030
160 HD11 ILE 23 1HD1 ILE 23 -8.872 9.027 -5.008
161 HD12 ILE 23 2HD1 ILE 23 -7.761 8.125 -3.964
162 HD13 ILE 23 3HD1 ILE 23 -8.712 9.445 -3.299
163 H LEU 24 H LEU 24 -5.768 6.435 -5.937
164 HA LEU 24 HA LEU 24 -3.392 5.891 -7.607
165 HB2 LEU 24 2HB LEU 24 -5.743 4.229 -6.576
166 HB3 LEU 24 3HB LEU 24 -4.392 3.570 -7.495
167 HG LEU 24 HG LEU 24 -4.006 4.988 -4.807
168 HD11 LEU 24 1HD1 LEU 24 -5.358 3.226 -4.262
169 HD12 LEU 24 2HD1 LEU 24 -4.628 2.153 -5.485
170 HD13 LEU 24 3HD1 LEU 24 -3.731 2.585 -3.992
171 HD21 LEU 24 1HD2 LEU 24 -2.055 4.966 -6.042
172 HD22 LEU 24 2HD2 LEU 24 -1.894 3.607 -4.891
173 HD23 LEU 24 3HD2 LEU 24 -2.272 3.284 -6.594
174 H GLU 25 H GLU 25 -4.499 4.264 -9.462
175 HA GLU 25 HA GLU 25 -7.103 5.318 -10.249
176 HB2 GLU 25 2HB GLU 25 -6.589 5.760 -12.576
177 HB3 GLU 25 3HB GLU 25 -5.539 6.741 -11.545
178 HG2 GLU 25 2HG GLU 25 -3.702 5.111 -11.884
179 HG3 GLU 25 3HG GLU 25 -4.755 4.121 -12.907
180 H GLU 26 H GLU 26 -8.099 3.987 -12.045
181 HA GLU 26 HA GLU 26 -7.947 1.263 -11.250
182 HB2 GLU 26 2HB GLU 26 -10.043 2.258 -12.012
183 HB3 GLU 26 3HB GLU 26 -9.368 2.547 -13.627
184 HG2 GLU 26 2HG GLU 26 -9.164 0.143 -14.033
185 HG3 GLU 26 3HG GLU 26 -9.577 -0.216 -12.354
186 H GLY 27 H GLY 27 -6.425 -0.166 -11.798
187 HA2 GLY 27 2HA GLY 27 -5.369 -1.588 -13.376
188 HA3 GLY 27 3HA GLY 27 -5.557 -0.354 -14.627
189 H GLU 28 H GLU 28 -4.380 1.065 -11.694
190 HA GLU 28 HA GLU 28 -1.853 1.609 -12.880
191 HB2 GLU 28 2HB GLU 28 -3.274 2.996 -11.286
192 HB3 GLU 28 3HB GLU 28 -2.726 1.940 -9.984
193 HG2 GLU 28 2HG GLU 28 -0.379 2.652 -10.449
194 HG3 GLU 28 3HG GLU 28 -0.954 3.636 -11.805
195 H ASP 29 H ASP 29 0.220 1.188 -11.772
196 HA ASP 29 HA ASP 29 0.659 -1.595 -11.129
197 HB2 ASP 29 2HB ASP 29 2.443 0.833 -10.805
198 HB3 ASP 29 3HB ASP 29 2.960 -0.841 -10.630
199 H VAL 30 H VAL 30 -0.311 -2.270 -9.261
200 HA VAL 30 HA VAL 30 0.467 -0.962 -6.727
201 HB VAL 30 HB VAL 30 -1.752 -1.029 -5.845
202 HG11 VAL 30 1HG1 VAL 30 -2.016 0.193 -8.608
203 HG12 VAL 30 2HG1 VAL 30 -2.873 0.659 -7.139
204 HG13 VAL 30 3HG1 VAL 30 -1.135 0.958 -7.274
205 HG21 VAL 30 1HG2 VAL 30 -2.592 -2.287 -8.494
206 HG22 VAL 30 2HG2 VAL 30 -2.672 -3.033 -6.878
207 HG23 VAL 30 3HG2 VAL 30 -3.717 -1.666 -7.280
208 H ARG 31 H ARG 31 0.005 -2.507 -4.848
209 HA ARG 31 HA ARG 31 0.234 -5.313 -5.711
210 HB2 ARG 31 2HB ARG 31 2.274 -3.684 -4.369
211 HB3 ARG 31 3HB ARG 31 1.785 -4.993 -3.309
212 HG2 ARG 31 2HG ARG 31 2.449 -5.600 -6.198
213 HG3 ARG 31 3HG ARG 31 3.758 -5.286 -5.056
214 HD2 ARG 31 2HD ARG 31 1.631 -7.415 -4.618
215 HD3 ARG 31 3HD ARG 31 3.188 -7.691 -5.418
216 HE ARG 31 HE ARG 31 3.463 -6.435 -2.821
217 HH11 ARG 31 1HH1 ARG 31 4.734 -9.361 -1.321
218 HH12 ARG 31 2HH1 ARG 31 4.535 -7.660 -1.153
219 HH21 ARG 31 1HH2 ARG 31 3.934 -10.460 -3.256
220 HH22 ARG 31 2HH2 ARG 31 3.123 -9.539 -4.472
221 H ARG 32 H ARG 32 -0.168 -6.716 -3.669
222 HA ARG 32 HA ARG 32 -2.304 -5.470 -2.029
223 HB2 ARG 32 2HB ARG 32 -3.391 -6.917 -3.669
224 HB3 ARG 32 3HB ARG 32 -2.177 -8.180 -3.439
225 HG2 ARG 32 2HG ARG 32 -4.224 -8.848 -2.343
226 HG3 ARG 32 3HG ARG 32 -2.983 -8.585 -1.138
227 HD2 ARG 32 2HD ARG 32 -4.751 -7.465 -0.135
228 HD3 ARG 32 3HD ARG 32 -4.014 -6.136 -0.992
229 HE ARG 32 HE ARG 32 -5.793 -5.969 -2.400
230 HH11 ARG 32 1HH1 ARG 32 -8.677 -7.972 -2.762
231 HH12 ARG 32 2HH1 ARG 32 -7.902 -6.509 -3.240
232 HH21 ARG 32 1HH2 ARG 32 -7.602 -9.435 -1.238
233 HH22 ARG 32 2HH2 ARG 32 -6.030 -9.025 -0.655
234 H LEU 33 H LEU 33 -2.315 -6.129 0.121
235 HA LEU 33 HA LEU 33 -0.233 -7.964 1.042
236 HB2 LEU 33 2HB LEU 33 -0.237 -6.216 3.053
237 HB3 LEU 33 3HB LEU 33 0.858 -6.031 1.695
238 HG LEU 33 HG LEU 33 -1.846 -4.664 1.664
239 HD11 LEU 33 1HD1 LEU 33 -0.836 -4.145 3.863
240 HD12 LEU 33 2HD1 LEU 33 0.674 -3.662 3.068
241 HD13 LEU 33 3HD1 LEU 33 -0.813 -2.728 2.809
242 HD21 LEU 33 1HD2 LEU 33 0.918 -4.037 0.530
243 HD22 LEU 33 2HD2 LEU 33 -0.539 -4.388 -0.404
244 HD23 LEU 33 3HD2 LEU 33 -0.443 -2.884 0.487
245 HA PRO 34 HA PRO 34 -3.433 -9.965 2.916
246 HB2 PRO 34 2HB PRO 34 -2.534 -10.754 5.407
247 HB3 PRO 34 3HB PRO 34 -1.949 -11.430 3.856
248 HG2 PRO 34 2HG PRO 34 -0.663 -9.300 5.570
249 HG3 PRO 34 3HG PRO 34 0.106 -10.682 4.721
250 HD2 PRO 34 2HD PRO 34 0.045 -8.098 3.807
251 HD3 PRO 34 3HD PRO 34 0.157 -9.468 2.705
252 H CYS 35 H CYS 35 -2.272 -7.197 4.685
253 HA CYS 35 HA CYS 35 -4.534 -6.761 6.502
254 HB2 CYS 35 2HB CYS 35 -2.085 -5.916 6.584
255 HB3 CYS 35 3HB CYS 35 -2.576 -4.811 5.289
256 H MET 36 H MET 36 -5.026 -7.201 3.363
257 HA MET 36 HA MET 36 -6.462 -6.360 1.813
258 HB2 MET 36 2HB MET 36 -7.886 -5.856 4.446
259 HB3 MET 36 3HB MET 36 -8.679 -5.633 2.876
260 HG2 MET 36 2HG MET 36 -7.291 -8.220 3.664
261 HG3 MET 36 3HG MET 36 -8.992 -7.893 3.951
262 HE1 MET 36 1HE MET 36 -9.644 -10.250 1.006
263 HE2 MET 36 2HE MET 36 -8.703 -10.427 2.507
264 HE3 MET 36 3HE MET 36 -10.272 -9.584 2.528
265 H HIS 37 H HIS 37 -4.409 -4.737 2.029
266 HA HIS 37 HA HIS 37 -5.579 -2.039 1.741
267 HB2 HIS 37 1HB HIS 37 -3.311 -3.002 3.472
268 HB3 HIS 37 2HB HIS 37 -2.994 -1.565 2.524
269 HD2 HIS 37 2HD HIS 37 -5.768 -0.091 2.688
270 HE1 HIS 37 1HE HIS 37 -5.175 0.059 6.885
271 HE2 HIS 37 2HE HIS 37 -6.460 1.050 4.918
272 H LEU 38 H LEU 38 -4.755 -0.914 -0.108
273 HA LEU 38 HA LEU 38 -3.287 -2.622 -2.060
274 HB2 LEU 38 2HB LEU 38 -5.691 -2.714 -2.489
275 HB3 LEU 38 3HB LEU 38 -5.831 -0.964 -2.418
276 HG LEU 38 HG LEU 38 -4.159 -2.440 -4.509
277 HD11 LEU 38 1HD1 LEU 38 -6.990 -1.320 -4.732
278 HD12 LEU 38 2HD1 LEU 38 -6.055 -2.066 -6.036
279 HD13 LEU 38 3HD1 LEU 38 -6.580 -3.051 -4.663
280 HD21 LEU 38 1HD2 LEU 38 -5.121 0.418 -4.165
281 HD22 LEU 38 2HD2 LEU 38 -3.468 -0.138 -4.533
282 HD23 LEU 38 3HD2 LEU 38 -4.719 -0.213 -5.766
283 H PHE 39 H PHE 39 -1.421 -1.551 -2.444
284 HA PHE 39 HA PHE 39 -1.388 1.437 -2.376
285 HB2 PHE 39 2HB PHE 39 0.461 -0.534 -0.990
286 HB3 PHE 39 3HB PHE 39 0.743 1.198 -1.063
287 HD1 PHE 39 1HD PHE 39 -2.408 1.789 -0.414
288 HD2 PHE 39 2HD PHE 39 0.700 -0.557 1.432
289 HE1 PHE 39 1HE PHE 39 -3.584 1.941 1.728
290 HE2 PHE 39 2HE PHE 39 -0.466 -0.354 3.606
291 HZ PHE 39 HZ PHE 39 -2.617 0.880 3.761
292 H HIS 40 H HIS 40 0.487 2.314 -3.623
293 HA HIS 40 HA HIS 40 0.800 1.094 -6.125
294 HB2 HIS 40 1HB HIS 40 2.761 2.934 -4.727
295 HB3 HIS 40 2HB HIS 40 2.869 2.489 -6.416
296 HD2 HIS 40 2HD HIS 40 0.686 3.260 -8.026
297 HE1 HIS 40 1HE HIS 40 0.160 6.827 -5.760
298 HE2 HIS 40 2HE HIS 40 -0.353 5.626 -7.991
299 H GLN 41 H GLN 41 2.462 -0.052 -7.164
300 HA GLN 41 HA GLN 41 3.959 -1.972 -5.632
301 HB2 GLN 41 2HB GLN 41 3.121 -1.545 -8.370
302 HB3 GLN 41 3HB GLN 41 4.856 -1.830 -8.378
303 HG2 GLN 41 2HG GLN 41 4.494 -3.851 -6.951
304 HG3 GLN 41 3HG GLN 41 2.750 -3.547 -7.027
305 HE21 GLN 41 1HE2 GLN 41 1.597 -4.468 -8.795
306 HE22 GLN 41 2HE2 GLN 41 2.440 -5.141 -10.184
307 H VAL 42 H VAL 42 4.679 1.071 -5.501
308 HA VAL 42 HA VAL 42 7.628 0.710 -5.747
309 HB VAL 42 HB VAL 42 5.956 3.171 -6.429
310 HG11 VAL 42 1HG1 VAL 42 8.986 2.811 -6.354
311 HG12 VAL 42 2HG1 VAL 42 8.135 4.213 -7.043
312 HG13 VAL 42 3HG1 VAL 42 8.023 3.883 -5.310
313 HG21 VAL 42 1HG2 VAL 42 6.978 2.880 -8.682
314 HG22 VAL 42 2HG2 VAL 42 7.746 1.377 -8.126
315 HG23 VAL 42 3HG2 VAL 42 5.979 1.494 -8.233
316 H CYS 43 H CYS 43 5.100 2.878 -4.347
317 HA CYS 43 HA CYS 43 6.249 3.630 -1.909
318 HB2 CYS 43 2HB CYS 43 3.391 2.725 -2.430
319 HB3 CYS 43 3HB CYS 43 3.971 3.789 -1.160
320 H VAL 44 H VAL 44 4.201 0.669 -2.453
321 HA VAL 44 HA VAL 44 4.848 -0.153 0.215
322 HB VAL 44 HB VAL 44 2.657 -0.423 -1.089
323 HG11 VAL 44 1HG1 VAL 44 3.758 -1.810 -2.946
324 HG12 VAL 44 2HG1 VAL 44 3.927 -3.104 -1.757
325 HG13 VAL 44 3HG1 VAL 44 2.303 -2.514 -2.201
326 HG21 VAL 44 1HG2 VAL 44 3.250 -1.196 1.225
327 HG22 VAL 44 2HG2 VAL 44 2.069 -2.222 0.394
328 HG23 VAL 44 3HG2 VAL 44 3.772 -2.737 0.522
329 H ASP 45 H ASP 45 6.353 -0.627 -2.779
330 HA ASP 45 HA ASP 45 7.681 -3.154 -2.219
331 HB2 ASP 45 2HB ASP 45 7.716 -2.300 -4.488
332 HB3 ASP 45 3HB ASP 45 8.519 -0.809 -3.973
333 H GLN 46 H GLN 46 8.861 0.269 -2.008
334 HA GLN 46 HA GLN 46 11.054 -0.501 -0.355
335 HB2 GLN 46 2HB GLN 46 9.706 2.212 -0.727
336 HB3 GLN 46 3HB GLN 46 11.222 1.975 0.156
337 HG2 GLN 46 2HG GLN 46 10.791 1.265 -2.783
338 HG3 GLN 46 3HG GLN 46 11.605 2.709 -2.178
339 HE21 GLN 46 1HE2 GLN 46 12.047 -0.680 -2.988
340 HE22 GLN 46 2HE2 GLN 46 13.696 -0.751 -2.410
341 H ALA 47 H ALA 47 7.728 0.275 0.526
342 HA ALA 47 HA ALA 47 8.158 0.447 3.336
343 HB1 ALA 47 1HB ALA 47 5.852 -0.921 1.905
344 HB2 ALA 47 2HB ALA 47 5.844 -0.245 3.543
345 HB3 ALA 47 3HB ALA 47 5.993 0.840 2.139
346 H LEU 48 H LEU 48 7.377 -2.459 1.352
347 HA LEU 48 HA LEU 48 7.485 -4.313 3.448
348 HB2 LEU 48 2HB LEU 48 6.393 -4.563 1.241
349 HB3 LEU 48 3HB LEU 48 7.958 -4.748 0.458
350 HG LEU 48 HG LEU 48 7.097 -6.608 2.711
351 HD11 LEU 48 1HD1 LEU 48 5.281 -6.559 1.005
352 HD12 LEU 48 2HD1 LEU 48 6.484 -6.929 -0.254
353 HD13 LEU 48 3HD1 LEU 48 6.128 -8.113 1.034
354 HD21 LEU 48 1HD2 LEU 48 8.893 -7.011 0.268
355 HD22 LEU 48 2HD2 LEU 48 9.452 -6.861 1.942
356 HD23 LEU 48 3HD2 LEU 48 8.486 -8.257 1.468
357 H ILE 49 H ILE 49 10.071 -3.396 1.086
358 HA ILE 49 HA ILE 49 11.924 -5.300 2.113
359 HB ILE 49 HB ILE 49 13.618 -4.193 0.892
360 HG12 ILE 49 2HG1 ILE 49 12.777 -1.968 -0.371
361 HG13 ILE 49 3HG1 ILE 49 11.968 -1.770 1.186
362 HG21 ILE 49 1HG2 ILE 49 11.127 -3.821 -0.783
363 HG22 ILE 49 2HG2 ILE 49 12.745 -4.280 -1.302
364 HG23 ILE 49 3HG2 ILE 49 11.773 -5.412 -0.343
365 HD11 ILE 49 1HD1 ILE 49 14.942 -2.065 0.659
366 HD12 ILE 49 2HD1 ILE 49 14.086 -0.663 1.335
367 HD13 ILE 49 3HD1 ILE 49 14.248 -2.148 2.289
368 H THR 50 H THR 50 11.144 -1.952 3.137
369 HA THR 50 HA THR 50 13.351 -1.734 4.939
370 HB THR 50 HB THR 50 10.650 -0.337 4.771
371 HG1 THR 50 1HG THR 50 11.958 0.284 3.171
372 HG21 THR 50 1HG2 THR 50 11.346 -0.153 7.112
373 HG22 THR 50 2HG2 THR 50 12.993 0.304 6.608
374 HG23 THR 50 3HG2 THR 50 11.619 1.380 6.273
375 H ASN 51 H ASN 51 9.947 -2.885 5.301
376 HA ASN 51 HA ASN 51 10.699 -4.707 7.376
377 HB2 ASN 51 2HB ASN 51 10.071 -2.059 8.246
378 HB3 ASN 51 3HB ASN 51 8.583 -2.956 8.468
379 HD21 ASN 51 1HD2 ASN 51 12.122 -3.588 8.875
380 HD22 ASN 51 2HD2 ASN 51 11.950 -4.258 10.498
381 H LYS 52 H LYS 52 9.159 -6.426 7.209
382 HA LYS 52 HA LYS 52 7.049 -6.012 5.187
383 HB2 LYS 52 2HB LYS 52 7.652 -8.519 6.809
384 HB3 LYS 52 3HB LYS 52 6.648 -8.362 5.375
385 HG2 LYS 52 2HG LYS 52 8.468 -9.152 4.329
386 HG3 LYS 52 3HG LYS 52 8.932 -7.455 4.286
387 HD2 LYS 52 2HD LYS 52 10.470 -7.763 6.147
388 HD3 LYS 52 3HD LYS 52 9.717 -9.314 6.570
389 HE2 LYS 52 2HE LYS 52 11.660 -9.986 5.506
390 HE3 LYS 52 3HE LYS 52 10.405 -10.182 4.301
391 HZ1 LYS 52 1HZ LYS 52 12.313 -7.934 4.449
392 HZ2 LYS 52 2HZ LYS 52 12.294 -9.149 3.335
393 HZ3 LYS 52 3HZ LYS 52 11.077 -8.032 3.366
394 H LYS 53 H LYS 53 6.115 -4.275 6.794
395 HA LYS 53 HA LYS 53 3.920 -5.668 8.150
396 HB2 LYS 53 2HB LYS 53 4.133 -4.219 10.159
397 HB3 LYS 53 3HB LYS 53 5.454 -5.370 9.978
398 HG2 LYS 53 2HG LYS 53 6.949 -3.705 10.091
399 HG3 LYS 53 3HG LYS 53 6.307 -3.004 8.611
400 HD2 LYS 53 2HD LYS 53 6.191 -1.273 10.165
401 HD3 LYS 53 3HD LYS 53 4.526 -1.864 10.064
402 HE2 LYS 53 2HE LYS 53 4.527 -2.380 12.265
403 HE3 LYS 53 3HE LYS 53 5.931 -3.439 12.036
404 HZ1 LYS 53 1HZ LYS 53 7.351 -1.518 12.268
405 HZ2 LYS 53 2HZ LYS 53 6.051 -0.534 12.517
406 HZ3 LYS 53 3HZ LYS 53 6.423 -1.712 13.608
407 H CYS 54 H CYS 54 2.033 -4.532 7.949
408 HA CYS 54 HA CYS 54 1.798 -2.442 5.921
409 HB2 CYS 54 2HB CYS 54 0.039 -4.145 6.864
410 HB3 CYS 54 3HB CYS 54 -0.090 -3.000 8.191
411 HA PRO 55 HA PRO 55 3.122 0.836 8.723
412 HB2 PRO 55 2HB PRO 55 2.378 3.066 7.324
413 HB3 PRO 55 3HB PRO 55 3.717 2.004 6.780
414 HG2 PRO 55 2HG PRO 55 0.820 1.945 5.875
415 HG3 PRO 55 3HG PRO 55 2.291 1.997 4.852
416 HD2 PRO 55 2HD PRO 55 1.026 -0.336 5.411
417 HD3 PRO 55 3HD PRO 55 2.814 -0.262 5.335
418 H ILE 56 H ILE 56 2.154 1.952 10.394
419 HA ILE 56 HA ILE 56 0.658 2.759 11.841
420 HB ILE 56 HB ILE 56 -1.347 2.831 9.564
421 HG12 ILE 56 2HG1 ILE 56 -0.253 5.262 10.951
422 HG13 ILE 56 3HG1 ILE 56 0.854 4.429 9.859
423 HG21 ILE 56 1HG2 ILE 56 -2.653 4.298 11.115
424 HG22 ILE 56 2HG2 ILE 56 -2.576 2.616 11.646
425 HG23 ILE 56 3HG2 ILE 56 -1.550 3.833 12.430
426 HD11 ILE 56 1HD1 ILE 56 -0.424 6.213 8.707
427 HD12 ILE 56 2HD1 ILE 56 -0.712 4.608 8.005
428 HD13 ILE 56 3HD1 ILE 56 -1.937 5.350 9.062
429 H CYS 57 H CYS 57 -0.876 0.190 9.798
430 HA CYS 57 HA CYS 57 -1.939 -1.282 12.118
431 HB2 CYS 57 2HB CYS 57 -1.273 -2.981 9.913
432 HB3 CYS 57 3HB CYS 57 -2.836 -2.577 10.563
433 H ARG 58 H ARG 58 -0.890 -3.619 12.301
434 HA ARG 58 HA ARG 58 2.027 -3.560 12.128
435 HB2 ARG 58 2HB ARG 58 1.473 -2.543 14.405
436 HB3 ARG 58 3HB ARG 58 0.754 -4.105 14.841
437 HG2 ARG 58 2HG ARG 58 3.029 -5.143 14.183
438 HG3 ARG 58 3HG ARG 58 3.664 -3.501 14.133
439 HD2 ARG 58 2HD ARG 58 2.269 -4.632 16.602
440 HD3 ARG 58 3HD ARG 58 3.966 -4.927 16.268
441 HE ARG 58 HE ARG 58 4.544 -2.835 16.838
442 HH11 ARG 58 1HH1 ARG 58 2.658 -0.210 18.216
443 HH12 ARG 58 2HH1 ARG 58 4.246 -0.826 17.952
444 HH21 ARG 58 1HH2 ARG 58 0.771 -1.429 17.461
445 HH22 ARG 58 2HH2 ARG 58 1.026 -2.939 16.660
446 H VAL 59 H VAL 59 0.849 -4.928 10.450
447 HA VAL 59 HA VAL 59 0.410 -7.688 11.476
448 HB VAL 59 HB VAL 59 -0.877 -6.460 9.013
449 HG11 VAL 59 1HG1 VAL 59 -2.401 -8.393 9.163
450 HG12 VAL 59 2HG1 VAL 59 -0.718 -8.910 9.019
451 HG13 VAL 59 3HG1 VAL 59 -1.529 -8.973 10.600
452 HG21 VAL 59 1HG2 VAL 59 -3.023 -6.372 10.285
453 HG22 VAL 59 2HG2 VAL 59 -2.131 -6.743 11.777
454 HG23 VAL 59 3HG2 VAL 59 -1.837 -5.223 10.897
455 H ASP 60 H ASP 60 1.632 -9.156 10.442
456 HA ASP 60 HA ASP 60 3.860 -8.330 8.828
457 HB2 ASP 60 2HB ASP 60 4.028 -10.320 10.217
458 HB3 ASP 60 3HB ASP 60 2.659 -11.067 9.379
459 H ILE 61 H ILE 61 4.140 -8.560 6.647
460 HA ILE 61 HA ILE 61 1.821 -9.507 5.042
461 HB ILE 61 HB ILE 61 2.284 -7.879 3.398
462 HG12 ILE 61 2HG1 ILE 61 4.639 -7.029 5.116
463 HG13 ILE 61 3HG1 ILE 61 4.736 -7.828 3.534
464 HG21 ILE 61 1HG2 ILE 61 0.981 -7.237 5.547
465 HG22 ILE 61 2HG2 ILE 61 2.439 -6.332 6.003
466 HG23 ILE 61 3HG2 ILE 61 1.544 -5.910 4.522
467 HD11 ILE 61 1HD1 ILE 61 5.053 -5.526 3.179
468 HD12 ILE 61 2HD1 ILE 61 3.416 -5.974 2.582
469 HD13 ILE 61 3HD1 ILE 61 3.615 -5.102 4.133
470 H GLU 62 H GLU 62 5.151 -9.943 5.745
471 HA GLU 62 HA GLU 62 6.235 -10.885 3.379
472 HB2 GLU 62 2HB GLU 62 7.360 -10.689 5.678
473 HB3 GLU 62 3HB GLU 62 6.596 -12.221 6.105
474 HG2 GLU 62 2HG GLU 62 7.707 -13.292 4.128
475 HG3 GLU 62 3HG GLU 62 8.468 -11.745 3.742
476 H ALA 63 H ALA 63 4.210 -12.669 5.796
477 HA ALA 63 HA ALA 63 3.193 -14.293 3.547
478 HB1 ALA 63 1HB ALA 63 4.989 -15.668 4.556
479 HB2 ALA 63 2HB ALA 63 4.253 -15.466 6.160
480 HB3 ALA 63 3HB ALA 63 3.392 -16.371 4.891
481 H GLN 64 H GLN 64 1.079 -15.349 4.199
482 HA GLN 64 HA GLN 64 -0.344 -13.627 6.150
483 HB2 GLN 64 2HB GLN 64 -1.374 -14.269 3.928
484 HB3 GLN 64 3HB GLN 64 -1.449 -15.941 4.506
485 HG2 GLN 64 2HG GLN 64 -2.761 -15.055 6.526
486 HG3 GLN 64 3HG GLN 64 -2.796 -13.482 5.724
487 HE21 GLN 64 1HE2 GLN 64 -3.888 -13.405 3.499
488 HE22 GLN 64 2HE2 GLN 64 -5.178 -14.579 3.247
489 H LEU 65 H LEU 65 1.173 -14.409 7.875
490 HA LEU 65 HA LEU 65 0.353 -17.098 8.883
491 HB2 LEU 65 2HB LEU 65 2.984 -15.996 8.404
492 HB3 LEU 65 3HB LEU 65 2.774 -16.158 10.134
493 HG LEU 65 HG LEU 65 3.788 -18.143 9.311
494 HD11 LEU 65 1HD1 LEU 65 2.398 -19.829 10.204
495 HD12 LEU 65 2HD1 LEU 65 1.947 -18.352 11.073
496 HD13 LEU 65 3HD1 LEU 65 0.911 -18.990 9.769
497 HD21 LEU 65 1HD2 LEU 65 3.138 -18.047 6.968
498 HD22 LEU 65 2HD2 LEU 65 2.715 -19.629 7.647
499 HD23 LEU 65 3HD2 LEU 65 1.449 -18.413 7.375
500 HA PRO 66 HA PRO 66 -1.224 -14.187 11.960
501 HB2 PRO 66 2HB PRO 66 -3.124 -15.742 13.124
502 HB3 PRO 66 3HB PRO 66 -3.295 -15.146 11.449
503 HG2 PRO 66 2HG PRO 66 -2.252 -17.859 12.335
504 HG3 PRO 66 3HG PRO 66 -3.542 -17.510 11.137
505 HD2 PRO 66 2HD PRO 66 -0.947 -17.960 10.412
506 HD3 PRO 66 3HD PRO 66 -1.976 -16.796 9.524
507 H SER 67 H SER 67 1.273 -14.855 12.554
508 HA SER 67 HA SER 67 1.214 -15.306 15.401
509 HB2 SER 67 2HB SER 67 1.947 -17.501 13.588
510 HB3 SER 67 3HB SER 67 3.330 -17.012 14.576
511 HG SER 67 HG SER 67 2.049 -17.303 16.421
512 H GLU 68 H GLU 68 2.580 -13.725 16.113
513 HA GLU 68 HA GLU 68 5.171 -13.365 14.846
514 HB2 GLU 68 2HB GLU 68 3.120 -11.143 15.163
515 HB3 GLU 68 3HB GLU 68 4.825 -10.809 15.440
516 HG2 GLU 68 2HG GLU 68 4.973 -12.161 13.046
517 HG3 GLU 68 3HG GLU 68 3.419 -11.340 12.881
518 H SER 69 H SER 69 6.382 -11.730 16.642
519 HA SER 69 HA SER 69 5.557 -12.412 19.328
520 HB2 SER 69 2HB SER 69 6.744 -14.492 18.500
521 HB3 SER 69 3HB SER 69 8.176 -13.484 18.190
522 HG SER 69 HG SER 69 7.914 -12.842 20.467
Start of MODEL 8
1 H1 MET 1 H1 MET 1 -25.875 44.110 -1.761
2 H2 MET 1 H2 MET 1 -26.872 45.154 -0.964
3 H3 MET 1 H3 MET 1 -25.265 45.102 -0.598
4 HA MET 1 HA MET 1 -26.511 44.017 1.105
5 HB2 MET 1 2HB MET 1 -27.531 42.374 -1.233
6 HB3 MET 1 3HB MET 1 -27.544 41.766 0.434
7 HG2 MET 1 2HG MET 1 -28.849 43.709 1.167
8 HG3 MET 1 3HG MET 1 -28.886 44.334 -0.489
9 HE1 MET 1 1HE MET 1 -31.361 43.607 1.622
10 HE2 MET 1 2HE MET 1 -31.578 44.487 0.089
11 HE3 MET 1 3HE MET 1 -32.564 43.049 0.440
12 H LYS 2 H LYS 2 -25.507 41.416 -1.247
13 HA LYS 2 HA LYS 2 -22.841 41.438 -0.142
14 HB2 LYS 2 2HB LYS 2 -24.815 39.761 1.079
15 HB3 LYS 2 3HB LYS 2 -23.978 38.700 -0.028
16 HG2 LYS 2 2HG LYS 2 -22.285 38.500 1.439
17 HG3 LYS 2 3HG LYS 2 -21.919 40.204 1.255
18 HD2 LYS 2 2HD LYS 2 -24.015 40.406 3.010
19 HD3 LYS 2 3HD LYS 2 -23.440 38.779 3.405
20 HE2 LYS 2 2HE LYS 2 -22.242 40.230 4.848
21 HE3 LYS 2 3HE LYS 2 -21.091 39.818 3.565
22 HZ1 LYS 2 1HZ LYS 2 -21.687 41.928 2.498
23 HZ2 LYS 2 2HZ LYS 2 -22.713 42.292 3.716
24 HZ3 LYS 2 3HZ LYS 2 -21.095 42.182 4.015
25 H GLN 3 H GLN 3 -21.705 39.340 -1.264
26 HA GLN 3 HA GLN 3 -23.053 38.448 -3.624
27 HB2 GLN 3 2HB GLN 3 -21.578 40.636 -4.214
28 HB3 GLN 3 3HB GLN 3 -20.252 39.471 -4.108
29 HG2 GLN 3 2HG GLN 3 -21.978 38.029 -5.645
30 HG3 GLN 3 3HG GLN 3 -22.537 39.652 -6.061
31 HE21 GLN 3 1HE2 GLN 3 -21.408 40.624 -7.811
32 HE22 GLN 3 2HE2 GLN 3 -19.811 40.066 -8.297
33 H ASP 4 H ASP 4 -22.294 36.275 -3.984
34 HA ASP 4 HA ASP 4 -19.936 35.305 -2.569
35 HB2 ASP 4 2HB ASP 4 -22.798 34.640 -1.780
36 HB3 ASP 4 3HB ASP 4 -21.505 33.458 -1.576
37 H GLY 5 H GLY 5 -19.983 32.752 -3.070
38 HA2 GLY 5 2HA GLY 5 -21.060 32.278 -5.800
39 HA3 GLY 5 3HA GLY 5 -19.324 32.082 -5.482
40 H GLU 6 H GLU 6 -19.422 29.771 -5.925
41 HA GLU 6 HA GLU 6 -20.362 28.216 -3.626
42 HB2 GLU 6 2HB GLU 6 -21.148 27.721 -6.531
43 HB3 GLU 6 3HB GLU 6 -20.954 26.394 -5.385
44 HG2 GLU 6 2HG GLU 6 -22.559 27.812 -3.850
45 HG3 GLU 6 3HG GLU 6 -23.028 28.579 -5.376
46 H GLU 7 H GLU 7 -19.200 26.056 -3.613
47 HA GLU 7 HA GLU 7 -16.974 25.710 -5.371
48 HB2 GLU 7 2HB GLU 7 -16.150 27.347 -3.570
49 HB3 GLU 7 3HB GLU 7 -16.457 26.078 -2.384
50 HG2 GLU 7 2HG GLU 7 -14.440 25.173 -2.851
51 HG3 GLU 7 3HG GLU 7 -14.970 24.850 -4.502
52 H GLY 8 H GLY 8 -16.860 23.494 -5.519
53 HA2 GLY 8 2HA GLY 8 -18.642 21.861 -3.783
54 HA3 GLY 8 3HA GLY 8 -17.962 21.378 -5.348
55 H THR 9 H THR 9 -17.723 19.497 -3.374
56 HA THR 9 HA THR 9 -14.848 19.565 -2.722
57 HB THR 9 HB THR 9 -15.499 18.511 -0.512
58 HG1 THR 9 1HG THR 9 -17.588 18.685 0.142
59 HG21 THR 9 1HG2 THR 9 -15.981 20.610 0.621
60 HG22 THR 9 2HG2 THR 9 -14.848 20.931 -0.708
61 HG23 THR 9 3HG2 THR 9 -16.566 21.346 -0.882
62 H GLU 10 H GLU 10 -14.152 17.232 -2.066
63 HA GLU 10 HA GLU 10 -15.674 15.130 -3.433
64 HB2 GLU 10 2HB GLU 10 -12.899 16.148 -4.163
65 HB3 GLU 10 3HB GLU 10 -13.374 14.470 -4.460
66 HG2 GLU 10 2HG GLU 10 -15.230 15.173 -5.876
67 HG3 GLU 10 3HG GLU 10 -14.884 16.879 -5.553
68 H GLU 11 H GLU 11 -14.829 12.976 -2.727
69 HA GLU 11 HA GLU 11 -13.091 12.949 -0.357
70 HB2 GLU 11 2HB GLU 11 -16.068 12.508 -0.444
71 HB3 GLU 11 3HB GLU 11 -15.118 11.328 0.470
72 HG2 GLU 11 2HG GLU 11 -14.187 13.014 1.900
73 HG3 GLU 11 3HG GLU 11 -14.846 14.321 0.908
74 H ASP 12 H ASP 12 -11.811 11.072 -0.497
75 HA ASP 12 HA ASP 12 -12.903 8.634 -1.584
76 HB2 ASP 12 2HB ASP 12 -12.121 9.830 -3.654
77 HB3 ASP 12 3HB ASP 12 -10.494 9.882 -2.976
78 H THR 13 H THR 13 -11.989 7.011 -0.455
79 HA THR 13 HA THR 13 -9.326 7.301 0.771
80 HB THR 13 HB THR 13 -11.845 6.635 2.360
81 HG1 THR 13 1HG THR 13 -11.740 8.772 2.111
82 HG21 THR 13 1HG2 THR 13 -10.269 6.912 4.349
83 HG22 THR 13 2HG2 THR 13 -10.092 5.410 3.445
84 HG23 THR 13 3HG2 THR 13 -8.920 6.732 3.202
85 H GLU 14 H GLU 14 -11.062 5.589 -1.371
86 HA GLU 14 HA GLU 14 -11.079 2.984 -0.104
87 HB2 GLU 14 2HB GLU 14 -11.791 4.056 -2.872
88 HB3 GLU 14 3HB GLU 14 -11.726 2.332 -2.514
89 HG2 GLU 14 2HG GLU 14 -13.950 2.775 -2.181
90 HG3 GLU 14 3HG GLU 14 -13.319 2.800 -0.543
91 H GLU 15 H GLU 15 -9.228 4.596 -2.712
92 HA GLU 15 HA GLU 15 -7.203 2.413 -2.446
93 HB2 GLU 15 2HB GLU 15 -6.820 2.688 -4.887
94 HB3 GLU 15 3HB GLU 15 -8.302 1.876 -4.395
95 HG2 GLU 15 2HG GLU 15 -9.657 3.812 -4.928
96 HG3 GLU 15 3HG GLU 15 -8.236 4.808 -5.217
97 H LYS 16 H LYS 16 -6.037 3.641 -0.973
98 HA LYS 16 HA LYS 16 -4.559 5.895 -2.252
99 HB2 LYS 16 2HB LYS 16 -5.672 5.606 0.509
100 HB3 LYS 16 3HB LYS 16 -4.098 6.389 0.358
101 HG2 LYS 16 2HG LYS 16 -4.945 8.023 -1.200
102 HG3 LYS 16 3HG LYS 16 -6.523 7.213 -1.254
103 HD2 LYS 16 2HD LYS 16 -7.013 7.814 1.015
104 HD3 LYS 16 3HD LYS 16 -5.371 8.461 1.268
105 HE2 LYS 16 2HE LYS 16 -5.712 10.269 -0.226
106 HE3 LYS 16 3HE LYS 16 -7.109 9.497 -0.986
107 HZ1 LYS 16 1HZ LYS 16 -8.432 9.920 0.871
108 HZ2 LYS 16 2HZ LYS 16 -7.159 10.465 1.789
109 HZ3 LYS 16 3HZ LYS 16 -7.699 11.323 0.487
110 H CYS 17 H CYS 17 -2.586 5.636 -2.415
111 HA CYS 17 HA CYS 17 -0.726 3.570 -1.326
112 HB2 CYS 17 2HB CYS 17 -0.455 4.937 -3.489
113 HB3 CYS 17 3HB CYS 17 -0.307 6.341 -2.491
114 H THR 18 H THR 18 -1.425 3.711 0.953
115 HA THR 18 HA THR 18 -1.365 6.184 2.338
116 HB THR 18 HB THR 18 -2.312 4.048 3.200
117 HG1 THR 18 1HG THR 18 -0.493 5.569 4.741
118 HG21 THR 18 1HG2 THR 18 -0.900 2.418 4.210
119 HG22 THR 18 2HG2 THR 18 -0.221 2.721 2.587
120 HG23 THR 18 3HG2 THR 18 0.551 3.434 4.000
121 H ILE 19 H ILE 19 1.283 4.505 0.871
122 HA ILE 19 HA ILE 19 3.340 5.274 2.713
123 HB ILE 19 HB ILE 19 3.220 4.180 -0.104
124 HG12 ILE 19 2HG1 ILE 19 4.429 2.720 2.226
125 HG13 ILE 19 3HG1 ILE 19 2.672 2.886 2.234
126 HG21 ILE 19 1HG2 ILE 19 5.691 3.708 0.252
127 HG22 ILE 19 2HG2 ILE 19 5.260 5.409 -0.025
128 HG23 ILE 19 3HG2 ILE 19 5.621 4.841 1.621
129 HD11 ILE 19 1HD1 ILE 19 4.244 1.803 -0.121
130 HD12 ILE 19 2HD1 ILE 19 3.411 0.816 1.098
131 HD13 ILE 19 3HD1 ILE 19 2.477 1.899 0.037
132 H CYS 20 H CYS 20 2.255 6.433 -0.572
133 HA CYS 20 HA CYS 20 3.839 8.977 -0.213
134 HB2 CYS 20 2HB CYS 20 3.353 9.289 -2.567
135 HB3 CYS 20 3HB CYS 20 4.254 7.801 -2.260
136 H LEU 21 H LEU 21 0.946 7.854 0.804
137 HA LEU 21 HA LEU 21 -1.072 8.695 1.259
138 HB2 LEU 21 2HB LEU 21 0.633 11.144 1.770
139 HB3 LEU 21 3HB LEU 21 -1.035 10.959 2.330
140 HG LEU 21 HG LEU 21 1.170 8.975 3.050
141 HD11 LEU 21 1HD1 LEU 21 0.158 11.366 4.622
142 HD12 LEU 21 2HD1 LEU 21 1.286 10.116 5.210
143 HD13 LEU 21 3HD1 LEU 21 1.768 11.182 3.878
144 HD21 LEU 21 1HD2 LEU 21 -0.372 8.356 4.869
145 HD22 LEU 21 2HD2 LEU 21 -1.562 9.548 4.300
146 HD23 LEU 21 3HD2 LEU 21 -1.155 8.131 3.308
147 H SER 22 H SER 22 -0.977 8.381 -1.296
148 HA SER 22 HA SER 22 -2.500 10.704 -2.360
149 HB2 SER 22 2HB SER 22 0.078 9.571 -3.365
150 HB3 SER 22 3HB SER 22 -1.171 9.880 -4.590
151 HG SER 22 HG SER 22 -0.251 11.716 -2.620
152 H ILE 23 H ILE 23 -3.999 10.128 -4.038
153 HA ILE 23 HA ILE 23 -5.196 7.533 -3.748
154 HB ILE 23 HB ILE 23 -5.580 10.006 -5.444
155 HG12 ILE 23 2HG1 ILE 23 -6.284 9.905 -2.970
156 HG13 ILE 23 3HG1 ILE 23 -7.496 10.445 -4.134
157 HG21 ILE 23 1HG2 ILE 23 -6.279 8.473 -6.973
158 HG22 ILE 23 2HG2 ILE 23 -7.018 7.382 -5.777
159 HG23 ILE 23 3HG2 ILE 23 -7.780 8.943 -6.193
160 HD11 ILE 23 1HD1 ILE 23 -8.342 8.767 -2.426
161 HD12 ILE 23 2HD1 ILE 23 -8.618 8.330 -4.117
162 HD13 ILE 23 3HD1 ILE 23 -7.316 7.552 -3.224
163 H LEU 24 H LEU 24 -5.366 6.010 -5.331
164 HA LEU 24 HA LEU 24 -3.179 5.710 -7.294
165 HB2 LEU 24 2HB LEU 24 -5.295 3.852 -6.106
166 HB3 LEU 24 3HB LEU 24 -4.003 3.319 -7.176
167 HG LEU 24 HG LEU 24 -3.511 4.646 -4.458
168 HD11 LEU 24 1HD1 LEU 24 -4.643 2.559 -4.162
169 HD12 LEU 24 2HD1 LEU 24 -3.491 1.727 -5.238
170 HD13 LEU 24 3HD1 LEU 24 -2.945 2.420 -3.684
171 HD21 LEU 24 1HD2 LEU 24 -1.625 4.988 -5.815
172 HD22 LEU 24 2HD2 LEU 24 -1.235 3.511 -4.883
173 HD23 LEU 24 3HD2 LEU 24 -1.747 3.387 -6.570
174 H GLU 25 H GLU 25 -4.427 4.026 -9.077
175 HA GLU 25 HA GLU 25 -7.088 5.092 -9.707
176 HB2 GLU 25 2HB GLU 25 -6.634 5.649 -12.013
177 HB3 GLU 25 3HB GLU 25 -5.541 6.576 -10.983
178 HG2 GLU 25 2HG GLU 25 -3.747 4.886 -11.436
179 HG3 GLU 25 3HG GLU 25 -4.829 4.056 -12.557
180 H GLU 26 H GLU 26 -8.171 3.829 -11.455
181 HA GLU 26 HA GLU 26 -7.641 0.987 -11.005
182 HB2 GLU 26 2HB GLU 26 -9.941 1.885 -10.947
183 HB3 GLU 26 3HB GLU 26 -9.823 2.350 -12.650
184 HG2 GLU 26 2HG GLU 26 -9.536 -0.027 -13.295
185 HG3 GLU 26 3HG GLU 26 -9.457 -0.496 -11.598
186 H GLY 27 H GLY 27 -5.522 1.072 -12.013
187 HA2 GLY 27 2HA GLY 27 -5.243 -0.595 -14.031
188 HA3 GLY 27 3HA GLY 27 -5.647 0.828 -14.996
189 H GLU 28 H GLU 28 -3.496 0.587 -12.044
190 HA GLU 28 HA GLU 28 -1.223 1.279 -13.788
191 HB2 GLU 28 2HB GLU 28 -0.472 2.853 -12.143
192 HB3 GLU 28 3HB GLU 28 -2.065 3.333 -12.745
193 HG2 GLU 28 2HG GLU 28 -3.166 2.571 -10.783
194 HG3 GLU 28 3HG GLU 28 -1.770 1.664 -10.240
195 H ASP 29 H ASP 29 0.841 1.187 -12.093
196 HA ASP 29 HA ASP 29 0.984 -1.591 -11.381
197 HB2 ASP 29 2HB ASP 29 2.964 0.604 -10.699
198 HB3 ASP 29 3HB ASP 29 3.265 -1.120 -10.850
199 H VAL 30 H VAL 30 -0.218 -2.235 -9.597
200 HA VAL 30 HA VAL 30 0.350 -0.935 -7.030
201 HB VAL 30 HB VAL 30 -2.116 -1.378 -6.443
202 HG11 VAL 30 1HG1 VAL 30 -1.283 0.877 -8.285
203 HG12 VAL 30 2HG1 VAL 30 -2.839 0.828 -7.438
204 HG13 VAL 30 3HG1 VAL 30 -1.327 0.867 -6.519
205 HG21 VAL 30 1HG2 VAL 30 -3.749 -1.303 -8.214
206 HG22 VAL 30 2HG2 VAL 30 -2.497 -1.175 -9.448
207 HG23 VAL 30 3HG2 VAL 30 -2.668 -2.679 -8.513
208 H ARG 31 H ARG 31 -0.696 -2.484 -5.293
209 HA ARG 31 HA ARG 31 -0.171 -5.267 -5.934
210 HB2 ARG 31 2HB ARG 31 1.640 -3.367 -4.469
211 HB3 ARG 31 3HB ARG 31 1.424 -4.926 -3.670
212 HG2 ARG 31 2HG ARG 31 2.213 -4.721 -6.584
213 HG3 ARG 31 3HG ARG 31 3.406 -4.720 -5.269
214 HD2 ARG 31 2HD ARG 31 2.624 -6.892 -4.490
215 HD3 ARG 31 3HD ARG 31 1.323 -6.895 -5.702
216 HE ARG 31 HE ARG 31 3.837 -6.546 -6.987
217 HH11 ARG 31 1HH1 ARG 31 4.185 -9.925 -7.926
218 HH12 ARG 31 2HH1 ARG 31 4.688 -8.306 -8.239
219 HH21 ARG 31 1HH2 ARG 31 2.582 -10.349 -6.218
220 HH22 ARG 31 2HH2 ARG 31 1.984 -9.018 -5.293
221 H ARG 32 H ARG 32 -0.489 -6.554 -3.786
222 HA ARG 32 HA ARG 32 -2.597 -5.282 -2.140
223 HB2 ARG 32 2HB ARG 32 -3.731 -6.758 -3.699
224 HB3 ARG 32 3HB ARG 32 -2.492 -8.002 -3.516
225 HG2 ARG 32 2HG ARG 32 -4.468 -8.721 -2.360
226 HG3 ARG 32 3HG ARG 32 -3.210 -8.422 -1.186
227 HD2 ARG 32 2HD ARG 32 -4.997 -7.365 -0.143
228 HD3 ARG 32 3HD ARG 32 -4.302 -6.012 -1.006
229 HE ARG 32 HE ARG 32 -6.141 -5.838 -2.306
230 HH11 ARG 32 1HH1 ARG 32 -8.905 -7.984 -2.799
231 HH12 ARG 32 2HH1 ARG 32 -8.226 -6.442 -3.160
232 HH21 ARG 32 1HH2 ARG 32 -7.693 -9.516 -1.435
233 HH22 ARG 32 2HH2 ARG 32 -6.161 -9.028 -0.803
234 H LEU 33 H LEU 33 -2.582 -5.947 0.038
235 HA LEU 33 HA LEU 33 -0.449 -7.743 0.954
236 HB2 LEU 33 2HB LEU 33 -0.581 -5.981 2.975
237 HB3 LEU 33 3HB LEU 33 0.575 -5.808 1.668
238 HG LEU 33 HG LEU 33 -2.139 -4.442 1.531
239 HD11 LEU 33 1HD1 LEU 33 -1.109 -2.517 2.671
240 HD12 LEU 33 2HD1 LEU 33 -1.110 -3.921 3.738
241 HD13 LEU 33 3HD1 LEU 33 0.388 -3.434 2.918
242 HD21 LEU 33 1HD2 LEU 33 -0.835 -4.188 -0.531
243 HD22 LEU 33 2HD2 LEU 33 -0.741 -2.685 0.354
244 HD23 LEU 33 3HD2 LEU 33 0.630 -3.815 0.397
245 HA PRO 34 HA PRO 34 -3.546 -9.889 2.887
246 HB2 PRO 34 2HB PRO 34 -2.686 -10.435 5.470
247 HB3 PRO 34 3HB PRO 34 -2.069 -11.226 3.989
248 HG2 PRO 34 2HG PRO 34 -0.845 -8.960 5.555
249 HG3 PRO 34 3HG PRO 34 -0.042 -10.364 4.780
250 HD2 PRO 34 2HD PRO 34 -0.141 -7.843 3.705
251 HD3 PRO 34 3HD PRO 34 -0.018 -9.276 2.694
252 H CYS 35 H CYS 35 -2.525 -7.053 4.644
253 HA CYS 35 HA CYS 35 -4.917 -6.516 6.254
254 HB2 CYS 35 2HB CYS 35 -2.554 -5.748 6.627
255 HB3 CYS 35 3HB CYS 35 -2.714 -4.780 5.151
256 H MET 36 H MET 36 -5.322 -7.139 3.194
257 HA MET 36 HA MET 36 -6.637 -6.373 1.510
258 HB2 MET 36 2HB MET 36 -8.203 -5.477 3.960
259 HB3 MET 36 3HB MET 36 -8.861 -5.590 2.329
260 HG2 MET 36 2HG MET 36 -7.601 -8.069 2.695
261 HG3 MET 36 3HG MET 36 -8.300 -7.719 4.271
262 HE1 MET 36 1HE MET 36 -9.682 -6.727 0.617
263 HE2 MET 36 2HE MET 36 -8.882 -8.310 0.481
264 HE3 MET 36 3HE MET 36 -10.646 -8.180 0.292
265 H HIS 37 H HIS 37 -4.528 -4.653 1.765
266 HA HIS 37 HA HIS 37 -5.777 -1.995 1.263
267 HB2 HIS 37 1HB HIS 37 -3.436 -2.813 2.916
268 HB3 HIS 37 2HB HIS 37 -3.117 -1.481 1.813
269 HD2 HIS 37 2HD HIS 37 -5.586 0.321 1.947
270 HE1 HIS 37 1HE HIS 37 -5.029 0.428 6.169
271 HE2 HIS 37 2HE HIS 37 -6.133 1.585 4.164
272 H LEU 38 H LEU 38 -4.909 -0.820 -0.530
273 HA LEU 38 HA LEU 38 -3.538 -2.508 -2.556
274 HB2 LEU 38 2HB LEU 38 -5.990 -1.970 -3.006
275 HB3 LEU 38 3HB LEU 38 -5.575 -0.260 -2.913
276 HG LEU 38 HG LEU 38 -3.836 -0.774 -4.795
277 HD11 LEU 38 1HD1 LEU 38 -4.443 -2.680 -6.237
278 HD12 LEU 38 2HD1 LEU 38 -4.002 -3.264 -4.626
279 HD13 LEU 38 3HD1 LEU 38 -5.713 -3.166 -5.100
280 HD21 LEU 38 1HD2 LEU 38 -5.587 -0.516 -6.537
281 HD22 LEU 38 2HD2 LEU 38 -6.836 -0.913 -5.338
282 HD23 LEU 38 3HD2 LEU 38 -5.862 0.557 -5.167
283 H PHE 39 H PHE 39 -1.488 -1.698 -2.811
284 HA PHE 39 HA PHE 39 -1.008 1.234 -2.356
285 HB2 PHE 39 2HB PHE 39 0.684 -1.197 -1.668
286 HB3 PHE 39 3HB PHE 39 1.324 0.427 -1.664
287 HD1 PHE 39 1HD PHE 39 -1.832 1.065 -0.282
288 HD2 PHE 39 2HD PHE 39 1.838 -0.993 0.622
289 HE1 PHE 39 1HE PHE 39 -2.410 1.083 2.097
290 HE2 PHE 39 2HE PHE 39 1.306 -0.879 3.036
291 HZ PHE 39 HZ PHE 39 -0.851 0.109 3.777
292 H HIS 40 H HIS 40 0.979 1.999 -3.613
293 HA HIS 40 HA HIS 40 0.980 1.101 -6.382
294 HB2 HIS 40 1HB HIS 40 2.760 2.813 -4.663
295 HB3 HIS 40 2HB HIS 40 3.312 2.344 -6.263
296 HD2 HIS 40 2HD HIS 40 0.878 2.836 -8.113
297 HE1 HIS 40 1HE HIS 40 0.925 6.807 -6.581
298 HE2 HIS 40 2HE HIS 40 0.085 5.228 -8.489
299 H GLN 41 H GLN 41 2.710 -0.031 -7.468
300 HA GLN 41 HA GLN 41 3.963 -2.196 -6.097
301 HB2 GLN 41 2HB GLN 41 4.204 -0.914 -8.818
302 HB3 GLN 41 3HB GLN 41 5.484 -2.004 -8.283
303 HG2 GLN 41 2HG GLN 41 3.819 -3.742 -7.736
304 HG3 GLN 41 3HG GLN 41 2.527 -2.689 -8.347
305 HE21 GLN 41 1HE2 GLN 41 1.850 -4.016 -10.094
306 HE22 GLN 41 2HE2 GLN 41 2.941 -4.309 -11.453
307 H VAL 42 H VAL 42 5.630 0.690 -7.545
308 HA VAL 42 HA VAL 42 8.062 0.015 -6.332
309 HB VAL 42 HB VAL 42 7.120 2.789 -7.172
310 HG11 VAL 42 1HG1 VAL 42 9.179 2.913 -5.806
311 HG12 VAL 42 2HG1 VAL 42 9.924 1.633 -6.784
312 HG13 VAL 42 3HG1 VAL 42 9.560 3.216 -7.506
313 HG21 VAL 42 1HG2 VAL 42 6.934 1.181 -9.037
314 HG22 VAL 42 2HG2 VAL 42 8.334 2.222 -9.293
315 HG23 VAL 42 3HG2 VAL 42 8.566 0.568 -8.694
316 H CYS 43 H CYS 43 5.538 2.278 -5.071
317 HA CYS 43 HA CYS 43 6.909 3.066 -2.693
318 HB2 CYS 43 2HB CYS 43 3.939 2.551 -2.906
319 HB3 CYS 43 3HB CYS 43 4.787 3.628 -1.821
320 H VAL 44 H VAL 44 4.724 0.108 -3.209
321 HA VAL 44 HA VAL 44 5.173 -0.565 -0.491
322 HB VAL 44 HB VAL 44 3.124 -1.130 -1.842
323 HG11 VAL 44 1HG1 VAL 44 4.208 -2.307 -3.737
324 HG12 VAL 44 2HG1 VAL 44 4.866 -3.511 -2.612
325 HG13 VAL 44 3HG1 VAL 44 3.113 -3.371 -2.827
326 HG21 VAL 44 1HG2 VAL 44 4.425 -3.396 -0.306
327 HG22 VAL 44 2HG2 VAL 44 3.778 -1.943 0.464
328 HG23 VAL 44 3HG2 VAL 44 2.694 -3.029 -0.448
329 H ASP 45 H ASP 45 7.010 -1.137 -3.368
330 HA ASP 45 HA ASP 45 8.422 -3.484 -2.511
331 HB2 ASP 45 2HB ASP 45 8.426 -2.387 -4.824
332 HB3 ASP 45 3HB ASP 45 9.557 -1.196 -4.177
333 H GLN 46 H GLN 46 9.304 0.011 -2.330
334 HA GLN 46 HA GLN 46 11.370 -0.498 -0.396
335 HB2 GLN 46 2HB GLN 46 9.882 2.092 -1.040
336 HB3 GLN 46 3HB GLN 46 11.310 1.969 0.003
337 HG2 GLN 46 2HG GLN 46 12.539 0.902 -1.959
338 HG3 GLN 46 3HG GLN 46 11.153 1.329 -2.973
339 HE21 GLN 46 1HE2 GLN 46 13.528 2.811 -0.646
340 HE22 GLN 46 2HE2 GLN 46 13.578 4.339 -1.516
341 H ALA 47 H ALA 47 7.910 -0.083 0.027
342 HA ALA 47 HA ALA 47 8.015 0.465 2.837
343 HB1 ALA 47 1HB ALA 47 5.934 -1.165 1.344
344 HB2 ALA 47 2HB ALA 47 5.721 -0.294 2.874
345 HB3 ALA 47 3HB ALA 47 5.992 0.618 1.367
346 H LEU 48 H LEU 48 7.512 -2.633 1.125
347 HA LEU 48 HA LEU 48 7.568 -4.454 3.195
348 HB2 LEU 48 2HB LEU 48 6.952 -4.923 0.836
349 HB3 LEU 48 3HB LEU 48 8.612 -4.647 0.340
350 HG LEU 48 HG LEU 48 9.100 -6.640 2.094
351 HD11 LEU 48 1HD1 LEU 48 6.301 -7.258 1.040
352 HD12 LEU 48 2HD1 LEU 48 7.333 -8.324 2.017
353 HD13 LEU 48 3HD1 LEU 48 6.671 -6.839 2.722
354 HD21 LEU 48 1HD2 LEU 48 9.023 -8.181 0.183
355 HD22 LEU 48 2HD2 LEU 48 8.043 -7.012 -0.733
356 HD23 LEU 48 3HD2 LEU 48 9.715 -6.616 -0.280
357 H ILE 49 H ILE 49 10.397 -3.439 1.162
358 HA ILE 49 HA ILE 49 12.227 -5.004 2.665
359 HB ILE 49 HB ILE 49 13.986 -3.870 1.523
360 HG12 ILE 49 2HG1 ILE 49 13.081 -1.902 -0.102
361 HG13 ILE 49 3HG1 ILE 49 12.097 -1.634 1.345
362 HG21 ILE 49 1HG2 ILE 49 13.397 -4.265 -0.754
363 HG22 ILE 49 2HG2 ILE 49 12.519 -5.440 0.240
364 HG23 ILE 49 3HG2 ILE 49 11.679 -4.036 -0.440
365 HD11 ILE 49 1HD1 ILE 49 15.108 -1.569 1.079
366 HD12 ILE 49 2HD1 ILE 49 14.015 -0.301 1.674
367 HD13 ILE 49 3HD1 ILE 49 14.333 -1.734 2.666
368 H THR 50 H THR 50 10.999 -1.691 3.236
369 HA THR 50 HA THR 50 12.997 -1.077 5.208
370 HB THR 50 HB THR 50 10.274 0.099 4.543
371 HG1 THR 50 1HG THR 50 11.789 0.612 3.095
372 HG21 THR 50 1HG2 THR 50 10.928 2.027 5.970
373 HG22 THR 50 2HG2 THR 50 10.581 0.573 6.915
374 HG23 THR 50 3HG2 THR 50 12.271 1.064 6.628
375 H ASN 51 H ASN 51 9.679 -2.472 5.320
376 HA ASN 51 HA ASN 51 10.281 -4.006 7.611
377 HB2 ASN 51 2HB ASN 51 9.402 -1.373 8.262
378 HB3 ASN 51 3HB ASN 51 7.952 -2.360 8.396
379 HD21 ASN 51 1HD2 ASN 51 11.438 -2.402 9.243
380 HD22 ASN 51 2HD2 ASN 51 11.208 -3.147 10.826
381 H LYS 52 H LYS 52 8.929 -5.814 7.417
382 HA LYS 52 HA LYS 52 6.728 -5.651 5.441
383 HB2 LYS 52 2HB LYS 52 7.799 -7.981 7.105
384 HB3 LYS 52 3HB LYS 52 6.486 -8.063 5.931
385 HG2 LYS 52 2HG LYS 52 8.083 -8.645 4.485
386 HG3 LYS 52 3HG LYS 52 8.286 -6.910 4.328
387 HD2 LYS 52 2HD LYS 52 10.416 -8.060 4.477
388 HD3 LYS 52 3HD LYS 52 10.225 -6.979 5.866
389 HE2 LYS 52 2HE LYS 52 10.021 -8.742 7.379
390 HE3 LYS 52 3HE LYS 52 9.219 -9.780 6.189
391 HZ1 LYS 52 1HZ LYS 52 11.218 -10.239 5.147
392 HZ2 LYS 52 2HZ LYS 52 12.115 -9.230 6.132
393 HZ3 LYS 52 3HZ LYS 52 11.365 -10.618 6.685
394 H LYS 53 H LYS 53 5.907 -3.852 7.161
395 HA LYS 53 HA LYS 53 3.607 -5.302 8.209
396 HB2 LYS 53 2HB LYS 53 4.970 -3.165 9.906
397 HB3 LYS 53 3HB LYS 53 3.417 -3.952 10.233
398 HG2 LYS 53 2HG LYS 53 4.767 -6.185 10.189
399 HG3 LYS 53 3HG LYS 53 6.198 -5.146 10.333
400 HD2 LYS 53 2HD LYS 53 4.861 -4.104 12.369
401 HD3 LYS 53 3HD LYS 53 3.914 -5.609 12.259
402 HE2 LYS 53 2HE LYS 53 6.211 -6.822 12.231
403 HE3 LYS 53 3HE LYS 53 6.908 -5.268 12.713
404 HZ1 LYS 53 1HZ LYS 53 5.390 -5.340 14.642
405 HZ2 LYS 53 2HZ LYS 53 4.916 -6.856 14.202
406 HZ3 LYS 53 3HZ LYS 53 6.476 -6.579 14.635
407 H CYS 54 H CYS 54 1.767 -4.241 7.682
408 HA CYS 54 HA CYS 54 1.751 -1.972 5.830
409 HB2 CYS 54 2HB CYS 54 0.034 -3.732 5.859
410 HB3 CYS 54 3HB CYS 54 -0.365 -3.335 7.538
411 HA PRO 55 HA PRO 55 2.423 0.914 9.119
412 HB2 PRO 55 2HB PRO 55 1.632 3.303 7.959
413 HB3 PRO 55 3HB PRO 55 3.154 2.438 7.593
414 HG2 PRO 55 2HG PRO 55 0.546 2.341 6.073
415 HG3 PRO 55 3HG PRO 55 2.207 2.536 5.421
416 HD2 PRO 55 2HD PRO 55 0.957 0.131 5.418
417 HD3 PRO 55 3HD PRO 55 2.706 0.251 5.778
418 H ILE 56 H ILE 56 -0.739 1.865 7.568
419 HA ILE 56 HA ILE 56 -1.654 2.692 10.231
420 HB ILE 56 HB ILE 56 -1.856 4.217 8.384
421 HG12 ILE 56 2HG1 ILE 56 -4.698 3.466 9.107
422 HG13 ILE 56 3HG1 ILE 56 -3.556 4.007 10.343
423 HG21 ILE 56 1HG2 ILE 56 -3.855 2.318 7.091
424 HG22 ILE 56 2HG2 ILE 56 -3.423 3.938 6.533
425 HG23 ILE 56 3HG2 ILE 56 -2.221 2.656 6.485
426 HD11 ILE 56 1HD1 ILE 56 -4.890 5.880 9.498
427 HD12 ILE 56 2HD1 ILE 56 -3.174 6.107 9.112
428 HD13 ILE 56 3HD1 ILE 56 -4.313 5.585 7.848
429 H CYS 57 H CYS 57 -1.360 0.214 10.539
430 HA CYS 57 HA CYS 57 -3.850 -1.120 11.104
431 HB2 CYS 57 2HB CYS 57 -3.254 -2.998 9.366
432 HB3 CYS 57 3HB CYS 57 -4.376 -1.691 8.996
433 H ARG 58 H ARG 58 -0.415 -1.529 10.151
434 HA ARG 58 HA ARG 58 1.343 -2.284 11.309
435 HB2 ARG 58 2HB ARG 58 0.021 -0.912 13.102
436 HB3 ARG 58 3HB ARG 58 -0.274 -2.483 13.860
437 HG2 ARG 58 2HG ARG 58 2.186 -2.859 14.000
438 HG3 ARG 58 3HG ARG 58 2.454 -1.339 13.119
439 HD2 ARG 58 2HD ARG 58 1.037 -0.242 15.012
440 HD3 ARG 58 3HD ARG 58 1.353 -1.710 15.929
441 HE ARG 58 HE ARG 58 3.206 0.419 15.100
442 HH11 ARG 58 1HH1 ARG 58 5.891 -0.826 16.993
443 HH12 ARG 58 2HH1 ARG 58 5.305 0.487 16.044
444 HH21 ARG 58 1HH2 ARG 58 4.490 -2.715 17.363
445 HH22 ARG 58 2HH2 ARG 58 2.935 -2.762 16.601
446 H VAL 59 H VAL 59 -0.178 -4.166 9.894
447 HA VAL 59 HA VAL 59 0.047 -6.652 11.534
448 HB VAL 59 HB VAL 59 -1.512 -6.133 8.967
449 HG11 VAL 59 1HG1 VAL 59 -1.515 -8.519 10.870
450 HG12 VAL 59 2HG1 VAL 59 -2.630 -8.288 9.507
451 HG13 VAL 59 3HG1 VAL 59 -0.910 -8.503 9.195
452 HG21 VAL 59 1HG2 VAL 59 -2.487 -6.334 11.852
453 HG22 VAL 59 2HG2 VAL 59 -2.539 -4.889 10.826
454 HG23 VAL 59 3HG2 VAL 59 -3.535 -6.282 10.417
455 H ASP 60 H ASP 60 1.205 -8.401 10.612
456 HA ASP 60 HA ASP 60 3.503 -7.682 9.035
457 HB2 ASP 60 2HB ASP 60 3.334 -9.467 10.835
458 HB3 ASP 60 3HB ASP 60 2.447 -10.455 9.667
459 H ILE 61 H ILE 61 3.884 -8.083 6.878
460 HA ILE 61 HA ILE 61 1.603 -9.123 5.271
461 HB ILE 61 HB ILE 61 2.234 -7.639 3.512
462 HG12 ILE 61 2HG1 ILE 61 4.264 -6.374 5.396
463 HG13 ILE 61 3HG1 ILE 61 4.709 -7.519 4.116
464 HG21 ILE 61 1HG2 ILE 61 2.066 -5.958 6.025
465 HG22 ILE 61 2HG2 ILE 61 1.319 -5.645 4.434
466 HG23 ILE 61 3HG2 ILE 61 0.696 -6.940 5.472
467 HD11 ILE 61 1HD1 ILE 61 3.318 -4.860 3.746
468 HD12 ILE 61 2HD1 ILE 61 4.973 -5.309 3.261
469 HD13 ILE 61 3HD1 ILE 61 3.570 -6.091 2.470
470 H GLU 62 H GLU 62 4.851 -9.595 6.081
471 HA GLU 62 HA GLU 62 6.048 -10.763 3.822
472 HB2 GLU 62 2HB GLU 62 7.092 -10.400 6.118
473 HB3 GLU 62 3HB GLU 62 6.156 -11.774 6.699
474 HG2 GLU 62 2HG GLU 62 8.258 -12.673 6.286
475 HG3 GLU 62 3HG GLU 62 7.340 -13.176 4.872
476 H ALA 63 H ALA 63 3.808 -12.156 6.174
477 HA ALA 63 HA ALA 63 2.605 -14.120 6.241
478 HB1 ALA 63 1HB ALA 63 2.229 -13.350 3.332
479 HB2 ALA 63 2HB ALA 63 1.145 -14.377 4.299
480 HB3 ALA 63 3HB ALA 63 1.347 -12.656 4.715
481 H GLN 64 H GLN 64 5.093 -14.894 6.243
482 HA GLN 64 HA GLN 64 5.069 -17.381 4.667
483 HB2 GLN 64 2HB GLN 64 6.536 -15.431 3.638
484 HB3 GLN 64 3HB GLN 64 7.654 -15.814 4.940
485 HG2 GLN 64 2HG GLN 64 6.843 -18.292 3.655
486 HG3 GLN 64 3HG GLN 64 7.235 -17.129 2.394
487 HE21 GLN 64 1HE2 GLN 64 9.432 -17.044 1.820
488 HE22 GLN 64 2HE2 GLN 64 10.708 -17.575 2.907
489 H LEU 65 H LEU 65 7.425 -18.554 5.728
490 HA LEU 65 HA LEU 65 7.187 -18.237 8.639
491 HB2 LEU 65 2HB LEU 65 5.472 -19.910 7.717
492 HB3 LEU 65 3HB LEU 65 6.831 -20.984 7.397
493 HG LEU 65 HG LEU 65 6.212 -19.722 10.115
494 HD11 LEU 65 1HD1 LEU 65 5.487 -22.488 9.066
495 HD12 LEU 65 2HD1 LEU 65 5.224 -21.894 10.722
496 HD13 LEU 65 3HD1 LEU 65 4.353 -21.154 9.372
497 HD21 LEU 65 1HD2 LEU 65 8.541 -20.491 9.994
498 HD22 LEU 65 2HD2 LEU 65 7.609 -21.595 11.002
499 HD23 LEU 65 3HD2 LEU 65 8.020 -22.055 9.334
500 HA PRO 66 HA PRO 66 11.337 -18.578 6.815
501 HB2 PRO 66 2HB PRO 66 12.685 -17.008 8.656
502 HB3 PRO 66 3HB PRO 66 11.734 -16.359 7.283
503 HG2 PRO 66 2HG PRO 66 10.886 -16.718 10.168
504 HG3 PRO 66 3HG PRO 66 10.651 -15.284 9.113
505 HD2 PRO 66 2HD PRO 66 8.685 -17.107 9.528
506 HD3 PRO 66 3HD PRO 66 8.904 -16.349 7.917
507 H SER 67 H SER 67 13.350 -19.537 7.467
508 HA SER 67 HA SER 67 12.937 -21.761 9.294
509 HB2 SER 67 2HB SER 67 14.196 -21.850 7.100
510 HB3 SER 67 3HB SER 67 15.488 -20.903 7.865
511 HG SER 67 HG SER 67 15.979 -23.067 8.071
512 H GLU 68 H GLU 68 14.993 -18.787 9.261
513 HA GLU 68 HA GLU 68 15.178 -18.886 12.169
514 HB2 GLU 68 2HB GLU 68 17.046 -20.437 11.339
515 HB3 GLU 68 3HB GLU 68 17.779 -19.020 10.575
516 HG2 GLU 68 2HG GLU 68 17.684 -17.891 12.881
517 HG3 GLU 68 3HG GLU 68 17.202 -19.458 13.537
518 H SER 69 H SER 69 16.771 -17.561 9.232
519 HA SER 69 HA SER 69 15.580 -14.951 9.846
520 HB2 SER 69 2HB SER 69 17.481 -13.787 8.996
521 HB3 SER 69 3HB SER 69 18.128 -14.939 10.184
522 HG SER 69 HG SER 69 17.963 -15.281 7.381
Start of MODEL 9
1 H1 MET 1 H1 MET 1 -2.940 22.652 -9.158
2 H2 MET 1 H2 MET 1 -1.419 22.059 -9.366
3 H3 MET 1 H3 MET 1 -2.728 21.130 -9.748
4 HA MET 1 HA MET 1 -1.809 20.372 -7.697
5 HB2 MET 1 2HB MET 1 -1.628 21.863 -5.779
6 HB3 MET 1 3HB MET 1 -0.689 22.467 -7.143
7 HG2 MET 1 2HG MET 1 -3.109 23.758 -7.528
8 HG3 MET 1 3HG MET 1 -3.032 23.669 -5.776
9 HE1 MET 1 1HE MET 1 -1.343 24.808 -4.295
10 HE2 MET 1 2HE MET 1 0.066 24.034 -5.062
11 HE3 MET 1 3HE MET 1 0.027 25.799 -4.844
12 H LYS 2 H LYS 2 -3.903 19.298 -8.461
13 HA LYS 2 HA LYS 2 -6.212 19.001 -8.455
14 HB2 LYS 2 2HB LYS 2 -5.000 17.558 -6.854
15 HB3 LYS 2 3HB LYS 2 -5.263 18.742 -5.586
16 HG2 LYS 2 2HG LYS 2 -6.746 16.911 -5.288
17 HG3 LYS 2 3HG LYS 2 -7.723 18.306 -5.678
18 HD2 LYS 2 2HD LYS 2 -6.926 16.422 -7.906
19 HD3 LYS 2 3HD LYS 2 -8.147 15.912 -6.730
20 HE2 LYS 2 2HE LYS 2 -9.467 17.968 -7.176
21 HE3 LYS 2 3HE LYS 2 -8.318 18.408 -8.455
22 HZ1 LYS 2 1HZ LYS 2 -8.915 16.291 -9.541
23 HZ2 LYS 2 2HZ LYS 2 -10.020 15.999 -8.350
24 HZ3 LYS 2 3HZ LYS 2 -10.228 17.272 -9.348
25 H GLN 3 H GLN 3 -6.811 21.352 -8.984
26 HA GLN 3 HA GLN 3 -7.417 23.219 -6.975
27 HB2 GLN 3 2HB GLN 3 -8.774 22.830 -9.687
28 HB3 GLN 3 3HB GLN 3 -9.006 24.216 -8.615
29 HG2 GLN 3 2HG GLN 3 -6.415 24.472 -8.703
30 HG3 GLN 3 3HG GLN 3 -6.500 23.420 -10.126
31 HE21 GLN 3 1HE2 GLN 3 -6.932 24.506 -12.147
32 HE22 GLN 3 2HE2 GLN 3 -7.562 26.145 -12.161
33 H ASP 4 H ASP 4 -9.535 20.761 -8.443
34 HA ASP 4 HA ASP 4 -11.418 19.750 -7.720
35 HB2 ASP 4 2HB ASP 4 -9.888 19.436 -5.654
36 HB3 ASP 4 3HB ASP 4 -10.902 20.658 -4.878
37 H GLY 5 H GLY 5 -13.001 21.088 -5.284
38 HA2 GLY 5 2HA GLY 5 -13.993 23.450 -6.847
39 HA3 GLY 5 3HA GLY 5 -15.082 22.305 -6.041
40 H GLU 6 H GLU 6 -14.988 22.149 -3.703
41 HA GLU 6 HA GLU 6 -13.328 24.087 -2.252
42 HB2 GLU 6 2HB GLU 6 -16.366 24.084 -2.168
43 HB3 GLU 6 3HB GLU 6 -15.406 24.519 -0.744
44 HG2 GLU 6 2HG GLU 6 -14.227 26.264 -2.059
45 HG3 GLU 6 3HG GLU 6 -15.237 25.881 -3.463
46 H GLU 7 H GLU 7 -16.155 22.085 -1.212
47 HA GLU 7 HA GLU 7 -14.301 19.953 -0.407
48 HB2 GLU 7 2HB GLU 7 -14.449 21.680 1.475
49 HB3 GLU 7 3HB GLU 7 -16.149 21.234 1.651
50 HG2 GLU 7 2HG GLU 7 -15.416 18.836 1.980
51 HG3 GLU 7 3HG GLU 7 -13.736 19.369 1.855
52 H GLY 8 H GLY 8 -15.361 18.601 -1.910
53 HA2 GLY 8 2HA GLY 8 -17.234 16.862 -1.306
54 HA3 GLY 8 3HA GLY 8 -18.299 18.243 -1.604
55 H THR 9 H THR 9 -16.198 15.818 -3.111
56 HA THR 9 HA THR 9 -17.387 16.458 -5.711
57 HB THR 9 HB THR 9 -15.037 16.066 -6.679
58 HG1 THR 9 1HG THR 9 -13.459 17.038 -5.088
59 HG21 THR 9 1HG2 THR 9 -16.280 18.264 -6.648
60 HG22 THR 9 2HG2 THR 9 -15.426 18.660 -5.140
61 HG23 THR 9 3HG2 THR 9 -14.514 18.415 -6.640
62 H GLU 10 H GLU 10 -16.953 14.552 -7.235
63 HA GLU 10 HA GLU 10 -16.748 11.985 -5.746
64 HB2 GLU 10 2HB GLU 10 -18.980 12.949 -7.579
65 HB3 GLU 10 3HB GLU 10 -18.687 11.235 -7.233
66 HG2 GLU 10 2HG GLU 10 -19.001 11.617 -4.833
67 HG3 GLU 10 3HG GLU 10 -19.275 13.343 -5.116
68 H GLU 11 H GLU 11 -14.538 12.285 -6.709
69 HA GLU 11 HA GLU 11 -14.380 10.759 -9.157
70 HB2 GLU 11 2HB GLU 11 -14.031 13.684 -9.200
71 HB3 GLU 11 3HB GLU 11 -12.506 12.889 -9.582
72 HG2 GLU 11 2HG GLU 11 -15.130 12.210 -10.975
73 HG3 GLU 11 3HG GLU 11 -13.982 13.417 -11.558
74 H ASP 12 H ASP 12 -12.654 9.431 -8.828
75 HA ASP 12 HA ASP 12 -12.348 8.271 -6.722
76 HB2 ASP 12 2HB ASP 12 -10.785 7.739 -8.506
77 HB3 ASP 12 3HB ASP 12 -9.666 8.971 -7.906
78 H THR 13 H THR 13 -12.704 8.883 -4.760
79 HA THR 13 HA THR 13 -10.707 10.649 -3.424
80 HB THR 13 HB THR 13 -13.591 10.730 -2.588
81 HG1 THR 13 1HG THR 13 -12.559 11.823 -4.973
82 HG21 THR 13 1HG2 THR 13 -11.891 12.018 -1.341
83 HG22 THR 13 2HG2 THR 13 -11.379 12.824 -2.846
84 HG23 THR 13 3HG2 THR 13 -13.005 13.110 -2.188
85 H GLU 14 H GLU 14 -11.094 7.618 -3.584
86 HA GLU 14 HA GLU 14 -11.413 7.111 -0.647
87 HB2 GLU 14 2HB GLU 14 -12.804 5.879 -3.012
88 HB3 GLU 14 3HB GLU 14 -12.340 4.805 -1.699
89 HG2 GLU 14 2HG GLU 14 -13.921 7.351 -1.187
90 HG3 GLU 14 3HG GLU 14 -14.692 5.823 -1.618
91 H GLU 15 H GLU 15 -10.053 5.873 -3.827
92 HA GLU 15 HA GLU 15 -8.640 3.855 -2.280
93 HB2 GLU 15 2HB GLU 15 -8.580 4.531 -5.243
94 HB3 GLU 15 3HB GLU 15 -7.768 3.160 -4.463
95 HG2 GLU 15 2HG GLU 15 -10.076 2.576 -3.451
96 HG3 GLU 15 3HG GLU 15 -10.757 3.698 -4.631
97 H LYS 16 H LYS 16 -7.381 5.005 -0.847
98 HA LYS 16 HA LYS 16 -5.134 6.555 -2.031
99 HB2 LYS 16 2HB LYS 16 -6.488 6.621 0.684
100 HB3 LYS 16 3HB LYS 16 -4.803 7.098 0.534
101 HG2 LYS 16 2HG LYS 16 -5.717 8.577 -1.478
102 HG3 LYS 16 3HG LYS 16 -7.234 8.473 -0.572
103 HD2 LYS 16 2HD LYS 16 -6.179 9.513 1.371
104 HD3 LYS 16 3HD LYS 16 -4.568 9.289 0.672
105 HE2 LYS 16 2HE LYS 16 -5.028 11.561 0.319
106 HE3 LYS 16 3HE LYS 16 -5.231 10.766 -1.249
107 HZ1 LYS 16 1HZ LYS 16 -7.017 12.294 -0.829
108 HZ2 LYS 16 2HZ LYS 16 -7.619 10.763 -0.859
109 HZ3 LYS 16 3HZ LYS 16 -7.420 11.540 0.577
110 H CYS 17 H CYS 17 -3.175 6.075 -1.808
111 HA CYS 17 HA CYS 17 -1.967 3.535 -0.844
112 HB2 CYS 17 2HB CYS 17 -1.304 4.930 -2.853
113 HB3 CYS 17 3HB CYS 17 -0.968 6.251 -1.758
114 H THR 18 H THR 18 -1.701 3.293 1.398
115 HA THR 18 HA THR 18 -1.832 5.575 3.137
116 HB THR 18 HB THR 18 -2.107 2.880 3.464
117 HG1 THR 18 1HG THR 18 -2.919 4.670 4.734
118 HG21 THR 18 1HG2 THR 18 -0.529 2.093 5.131
119 HG22 THR 18 2HG2 THR 18 0.385 2.546 3.673
120 HG23 THR 18 3HG2 THR 18 0.363 3.615 5.093
121 H ILE 19 H ILE 19 0.834 4.330 1.241
122 HA ILE 19 HA ILE 19 2.877 5.210 3.092
123 HB ILE 19 HB ILE 19 2.772 4.027 0.318
124 HG12 ILE 19 2HG1 ILE 19 4.196 2.853 2.706
125 HG13 ILE 19 3HG1 ILE 19 2.432 2.791 2.681
126 HG21 ILE 19 1HG2 ILE 19 5.303 3.787 0.579
127 HG22 ILE 19 2HG2 ILE 19 4.705 5.410 0.195
128 HG23 ILE 19 3HG2 ILE 19 5.191 5.009 1.862
129 HD11 ILE 19 1HD1 ILE 19 4.178 1.766 0.424
130 HD12 ILE 19 2HD1 ILE 19 3.432 0.773 1.692
131 HD13 ILE 19 3HD1 ILE 19 2.410 1.669 0.542
132 H CYS 20 H CYS 20 1.759 6.290 -0.199
133 HA CYS 20 HA CYS 20 3.276 8.874 0.140
134 HB2 CYS 20 2HB CYS 20 2.617 9.259 -2.157
135 HB3 CYS 20 3HB CYS 20 3.564 7.775 -1.982
136 H LEU 21 H LEU 21 0.317 7.626 1.138
137 HA LEU 21 HA LEU 21 -1.612 8.515 1.809
138 HB2 LEU 21 2HB LEU 21 0.251 10.843 2.323
139 HB3 LEU 21 3HB LEU 21 -1.364 10.689 3.023
140 HG LEU 21 HG LEU 21 0.781 8.552 3.385
141 HD11 LEU 21 1HD1 LEU 21 1.599 10.657 4.307
142 HD12 LEU 21 2HD1 LEU 21 0.083 10.866 5.221
143 HD13 LEU 21 3HD1 LEU 21 1.184 9.514 5.594
144 HD21 LEU 21 1HD2 LEU 21 -0.629 7.902 5.312
145 HD22 LEU 21 2HD2 LEU 21 -1.796 9.181 4.907
146 HD23 LEU 21 3HD2 LEU 21 -1.544 7.801 3.813
147 H SER 22 H SER 22 -1.301 8.630 -1.005
148 HA SER 22 HA SER 22 -2.989 10.996 -1.624
149 HB2 SER 22 2HB SER 22 -0.539 11.260 -2.308
150 HB3 SER 22 3HB SER 22 -0.832 9.952 -3.477
151 HG SER 22 HG SER 22 -1.226 12.007 -4.385
152 H ILE 23 H ILE 23 -4.093 10.636 -3.839
153 HA ILE 23 HA ILE 23 -5.509 8.109 -3.700
154 HB ILE 23 HB ILE 23 -5.645 10.654 -5.351
155 HG12 ILE 23 2HG1 ILE 23 -6.452 10.673 -2.949
156 HG13 ILE 23 3HG1 ILE 23 -7.614 11.171 -4.161
157 HG21 ILE 23 1HG2 ILE 23 -7.285 8.140 -5.664
158 HG22 ILE 23 2HG2 ILE 23 -7.848 9.751 -6.194
159 HG23 ILE 23 3HG2 ILE 23 -6.384 9.065 -6.877
160 HD11 ILE 23 1HD1 ILE 23 -8.603 9.681 -2.408
161 HD12 ILE 23 2HD1 ILE 23 -8.780 9.022 -4.037
162 HD13 ILE 23 3HD1 ILE 23 -7.547 8.365 -2.956
163 H LEU 24 H LEU 24 -5.697 6.703 -5.448
164 HA LEU 24 HA LEU 24 -3.272 6.256 -7.063
165 HB2 LEU 24 2HB LEU 24 -5.765 4.617 -6.372
166 HB3 LEU 24 3HB LEU 24 -4.358 3.984 -7.231
167 HG LEU 24 HG LEU 24 -4.220 5.120 -4.386
168 HD11 LEU 24 1HD1 LEU 24 -4.335 2.244 -5.315
169 HD12 LEU 24 2HD1 LEU 24 -4.030 2.822 -3.648
170 HD13 LEU 24 3HD1 LEU 24 -5.585 3.149 -4.428
171 HD21 LEU 24 1HD2 LEU 24 -2.278 3.807 -6.274
172 HD22 LEU 24 2HD2 LEU 24 -2.137 5.322 -5.348
173 HD23 LEU 24 3HD2 LEU 24 -2.043 3.746 -4.517
174 H GLU 25 H GLU 25 -4.646 4.720 -9.063
175 HA GLU 25 HA GLU 25 -7.023 6.112 -9.884
176 HB2 GLU 25 2HB GLU 25 -6.383 6.642 -12.158
177 HB3 GLU 25 3HB GLU 25 -5.337 7.490 -11.016
178 HG2 GLU 25 2HG GLU 25 -3.547 5.845 -11.400
179 HG3 GLU 25 3HG GLU 25 -4.594 4.944 -12.510
180 H GLU 26 H GLU 26 -7.831 4.949 -12.070
181 HA GLU 26 HA GLU 26 -8.039 2.160 -11.339
182 HB2 GLU 26 2HB GLU 26 -9.954 3.368 -12.267
183 HB3 GLU 26 3HB GLU 26 -9.038 3.799 -13.710
184 HG2 GLU 26 2HG GLU 26 -10.607 2.022 -14.217
185 HG3 GLU 26 3HG GLU 26 -8.962 1.435 -14.413
186 H GLY 27 H GLY 27 -7.050 0.420 -12.258
187 HA2 GLY 27 2HA GLY 27 -5.598 -0.816 -13.549
188 HA3 GLY 27 3HA GLY 27 -5.707 0.462 -14.767
189 H GLU 28 H GLU 28 -4.546 1.594 -11.667
190 HA GLU 28 HA GLU 28 -1.958 2.155 -12.797
191 HB2 GLU 28 2HB GLU 28 -3.519 3.366 -10.970
192 HB3 GLU 28 3HB GLU 28 -2.561 2.393 -9.861
193 HG2 GLU 28 2HG GLU 28 -0.499 3.440 -10.974
194 HG3 GLU 28 3HG GLU 28 -1.602 4.470 -11.881
195 H ASP 29 H ASP 29 0.056 1.601 -11.390
196 HA ASP 29 HA ASP 29 0.175 -1.258 -10.893
197 HB2 ASP 29 2HB ASP 29 2.494 -0.844 -10.352
198 HB3 ASP 29 3HB ASP 29 2.060 -0.139 -11.888
199 H VAL 30 H VAL 30 -0.753 -2.055 -9.093
200 HA VAL 30 HA VAL 30 -0.372 -0.641 -6.543
201 HB VAL 30 HB VAL 30 -2.723 -1.048 -5.939
202 HG11 VAL 30 1HG1 VAL 30 -3.706 0.793 -7.196
203 HG12 VAL 30 2HG1 VAL 30 -2.010 1.165 -6.825
204 HG13 VAL 30 3HG1 VAL 30 -2.475 0.636 -8.454
205 HG21 VAL 30 1HG2 VAL 30 -4.409 -1.558 -7.630
206 HG22 VAL 30 2HG2 VAL 30 -3.164 -1.725 -8.878
207 HG23 VAL 30 3HG2 VAL 30 -3.243 -2.888 -7.533
208 H ARG 31 H ARG 31 -1.252 -2.211 -4.776
209 HA ARG 31 HA ARG 31 -0.660 -4.992 -5.368
210 HB2 ARG 31 2HB ARG 31 1.179 -3.048 -3.999
211 HB3 ARG 31 3HB ARG 31 0.996 -4.592 -3.173
212 HG2 ARG 31 2HG ARG 31 1.666 -4.511 -6.132
213 HG3 ARG 31 3HG ARG 31 2.915 -4.305 -4.923
214 HD2 ARG 31 2HD ARG 31 1.192 -6.592 -4.267
215 HD3 ARG 31 3HD ARG 31 1.879 -6.733 -5.894
216 HE ARG 31 HE ARG 31 3.911 -5.926 -4.068
217 HH11 ARG 31 1HH1 ARG 31 5.295 -9.137 -3.686
218 HH12 ARG 31 2HH1 ARG 31 5.585 -7.444 -3.554
219 HH21 ARG 31 1HH2 ARG 31 3.187 -9.915 -4.469
220 HH22 ARG 31 2HH2 ARG 31 1.966 -8.755 -4.860
221 H ARG 32 H ARG 32 -1.013 -6.277 -3.252
222 HA ARG 32 HA ARG 32 -2.772 -4.868 -1.371
223 HB2 ARG 32 2HB ARG 32 -3.932 -6.175 -3.409
224 HB3 ARG 32 3HB ARG 32 -3.597 -7.587 -2.412
225 HG2 ARG 32 2HG ARG 32 -5.211 -5.116 -1.619
226 HG3 ARG 32 3HG ARG 32 -5.857 -6.685 -2.102
227 HD2 ARG 32 2HD ARG 32 -4.255 -7.458 -0.016
228 HD3 ARG 32 3HD ARG 32 -4.686 -5.849 0.518
229 HE ARG 32 HE ARG 32 -6.360 -8.169 0.400
230 HH11 ARG 32 1HH1 ARG 32 -9.349 -6.436 1.118
231 HH12 ARG 32 2HH1 ARG 32 -8.603 -7.986 0.988
232 HH21 ARG 32 1HH2 ARG 32 -8.058 -4.468 0.717
233 HH22 ARG 32 2HH2 ARG 32 -6.415 -4.647 0.212
234 H LEU 33 H LEU 33 -2.623 -5.858 0.733
235 HA LEU 33 HA LEU 33 -0.647 -8.036 1.044
236 HB2 LEU 33 2HB LEU 33 -0.280 -6.443 3.228
237 HB3 LEU 33 3HB LEU 33 0.767 -6.442 1.818
238 HG LEU 33 HG LEU 33 -1.618 -4.570 2.133
239 HD11 LEU 33 1HD1 LEU 33 0.154 -4.455 4.021
240 HD12 LEU 33 2HD1 LEU 33 1.302 -3.945 2.782
241 HD13 LEU 33 3HD1 LEU 33 -0.150 -2.969 3.131
242 HD21 LEU 33 1HD2 LEU 33 0.088 -3.111 0.726
243 HD22 LEU 33 2HD2 LEU 33 0.780 -4.681 0.276
244 HD23 LEU 33 3HD2 LEU 33 -0.910 -4.269 -0.103
245 HA PRO 34 HA PRO 34 -3.514 -10.044 3.339
246 HB2 PRO 34 2HB PRO 34 -2.305 -11.075 5.583
247 HB3 PRO 34 3HB PRO 34 -1.940 -11.612 3.915
248 HG2 PRO 34 2HG PRO 34 -0.388 -9.672 5.637
249 HG3 PRO 34 3HG PRO 34 0.229 -10.975 4.570
250 HD2 PRO 34 2HD PRO 34 0.110 -8.322 3.898
251 HD3 PRO 34 3HD PRO 34 0.049 -9.604 2.685
252 H CYS 35 H CYS 35 -2.017 -7.377 5.068
253 HA CYS 35 HA CYS 35 -4.044 -7.217 7.216
254 HB2 CYS 35 2HB CYS 35 -2.716 -5.473 7.949
255 HB3 CYS 35 3HB CYS 35 -1.561 -6.590 7.213
256 H MET 36 H MET 36 -4.876 -7.260 4.291
257 HA MET 36 HA MET 36 -6.264 -6.322 2.894
258 HB2 MET 36 2HB MET 36 -8.430 -5.696 3.831
259 HB3 MET 36 3HB MET 36 -7.769 -7.164 4.549
260 HG2 MET 36 2HG MET 36 -7.082 -5.932 6.547
261 HG3 MET 36 3HG MET 36 -7.626 -4.409 5.829
262 HE1 MET 36 1HE MET 36 -10.129 -4.999 8.764
263 HE2 MET 36 2HE MET 36 -8.388 -5.359 8.703
264 HE3 MET 36 3HE MET 36 -9.011 -3.853 7.987
265 H HIS 37 H HIS 37 -4.122 -4.721 3.067
266 HA HIS 37 HA HIS 37 -5.253 -1.964 2.884
267 HB2 HIS 37 1HB HIS 37 -2.693 -3.095 3.880
268 HB3 HIS 37 2HB HIS 37 -2.474 -1.790 2.743
269 HD2 HIS 37 2HD HIS 37 -4.326 0.410 3.338
270 HE1 HIS 37 1HE HIS 37 -3.273 0.184 7.452
271 HE2 HIS 37 2HE HIS 37 -4.266 1.672 5.632
272 H LEU 38 H LEU 38 -4.872 -0.790 0.912
273 HA LEU 38 HA LEU 38 -3.764 -2.373 -1.339
274 HB2 LEU 38 2HB LEU 38 -5.539 -1.945 -2.534
275 HB3 LEU 38 3HB LEU 38 -6.359 -1.258 -1.154
276 HG LEU 38 HG LEU 38 -4.575 0.499 -2.888
277 HD11 LEU 38 1HD1 LEU 38 -6.026 -0.694 -4.447
278 HD12 LEU 38 2HD1 LEU 38 -7.455 -0.280 -3.473
279 HD13 LEU 38 3HD1 LEU 38 -6.537 0.985 -4.290
280 HD21 LEU 38 1HD2 LEU 38 -6.058 2.265 -2.164
281 HD22 LEU 38 2HD2 LEU 38 -7.227 1.116 -1.491
282 HD23 LEU 38 3HD2 LEU 38 -5.663 1.370 -0.697
283 H PHE 39 H PHE 39 -1.869 -1.556 -2.061
284 HA PHE 39 HA PHE 39 -1.127 1.254 -1.362
285 HB2 PHE 39 2HB PHE 39 0.542 -1.297 -1.156
286 HB3 PHE 39 3HB PHE 39 1.238 0.301 -1.150
287 HD1 PHE 39 1HD PHE 39 -1.571 0.935 0.843
288 HD2 PHE 39 2HD PHE 39 2.106 -1.255 0.889
289 HE1 PHE 39 1HE PHE 39 -1.677 0.799 3.286
290 HE2 PHE 39 2HE PHE 39 2.073 -1.281 3.365
291 HZ PHE 39 HZ PHE 39 0.139 -0.288 4.575
292 H HIS 40 H HIS 40 0.739 1.982 -2.893
293 HA HIS 40 HA HIS 40 0.220 1.185 -5.688
294 HB2 HIS 40 1HB HIS 40 2.321 2.849 -4.323
295 HB3 HIS 40 2HB HIS 40 2.540 2.366 -5.985
296 HD2 HIS 40 2HD HIS 40 0.318 3.115 -7.683
297 HE1 HIS 40 1HE HIS 40 0.204 6.892 -5.719
298 HE2 HIS 40 2HE HIS 40 -0.515 5.572 -7.807
299 H GLN 41 H GLN 41 2.010 0.240 -7.012
300 HA GLN 41 HA GLN 41 3.277 -2.038 -5.775
301 HB2 GLN 41 2HB GLN 41 2.482 -1.904 -8.117
302 HB3 GLN 41 3HB GLN 41 3.773 -0.747 -8.470
303 HG2 GLN 41 2HG GLN 41 5.494 -2.353 -8.053
304 HG3 GLN 41 3HG GLN 41 4.328 -3.533 -7.423
305 HE21 GLN 41 1HE2 GLN 41 2.301 -3.750 -9.197
306 HE22 GLN 41 2HE2 GLN 41 2.938 -4.085 -10.803
307 H VAL 42 H VAL 42 4.736 0.944 -7.330
308 HA VAL 42 HA VAL 42 7.308 0.364 -6.337
309 HB VAL 42 HB VAL 42 6.144 3.107 -6.959
310 HG11 VAL 42 1HG1 VAL 42 8.539 3.726 -7.364
311 HG12 VAL 42 2HG1 VAL 42 8.233 3.339 -5.668
312 HG13 VAL 42 3HG1 VAL 42 9.038 2.150 -6.714
313 HG21 VAL 42 1HG2 VAL 42 7.708 1.094 -8.647
314 HG22 VAL 42 2HG2 VAL 42 6.010 1.568 -8.889
315 HG23 VAL 42 3HG2 VAL 42 7.297 2.747 -9.150
316 H CYS 43 H CYS 43 4.789 2.436 -4.760
317 HA CYS 43 HA CYS 43 6.307 3.165 -2.457
318 HB2 CYS 43 2HB CYS 43 3.357 2.487 -2.488
319 HB3 CYS 43 3HB CYS 43 4.228 3.445 -1.329
320 H VAL 44 H VAL 44 4.232 0.115 -2.916
321 HA VAL 44 HA VAL 44 4.942 -0.639 -0.296
322 HB VAL 44 HB VAL 44 2.872 -1.324 -1.505
323 HG11 VAL 44 1HG1 VAL 44 3.856 -2.228 -3.564
324 HG12 VAL 44 2HG1 VAL 44 4.752 -3.440 -2.627
325 HG13 VAL 44 3HG1 VAL 44 2.981 -3.484 -2.660
326 HG21 VAL 44 1HG2 VAL 44 3.897 -2.323 0.655
327 HG22 VAL 44 2HG2 VAL 44 2.647 -3.256 -0.214
328 HG23 VAL 44 3HG2 VAL 44 4.377 -3.679 -0.356
329 H ASP 45 H ASP 45 6.636 -0.967 -3.322
330 HA ASP 45 HA ASP 45 8.152 -3.293 -2.691
331 HB2 ASP 45 2HB ASP 45 8.028 -2.076 -4.926
332 HB3 ASP 45 3HB ASP 45 9.158 -0.886 -4.264
333 H GLN 46 H GLN 46 8.978 0.198 -2.252
334 HA GLN 46 HA GLN 46 11.153 -0.507 -0.454
335 HB2 GLN 46 2HB GLN 46 9.785 2.178 -0.940
336 HB3 GLN 46 3HB GLN 46 11.168 1.924 0.134
337 HG2 GLN 46 2HG GLN 46 12.186 0.736 -2.065
338 HG3 GLN 46 3HG GLN 46 11.069 1.845 -2.868
339 HE21 GLN 46 1HE2 GLN 46 13.816 1.644 -0.539
340 HE22 GLN 46 2HE2 GLN 46 14.344 3.298 -0.824
341 H ALA 47 H ALA 47 7.709 -0.025 0.075
342 HA ALA 47 HA ALA 47 7.906 0.450 2.882
343 HB1 ALA 47 1HB ALA 47 5.837 0.570 1.485
344 HB2 ALA 47 2HB ALA 47 5.806 -1.216 1.462
345 HB3 ALA 47 3HB ALA 47 5.632 -0.347 3.000
346 H LEU 48 H LEU 48 7.384 -2.659 1.154
347 HA LEU 48 HA LEU 48 7.594 -4.355 3.280
348 HB2 LEU 48 2HB LEU 48 6.742 -4.818 1.014
349 HB3 LEU 48 3HB LEU 48 8.377 -4.835 0.369
350 HG LEU 48 HG LEU 48 7.450 -6.749 2.563
351 HD11 LEU 48 1HD1 LEU 48 5.949 -6.960 0.615
352 HD12 LEU 48 2HD1 LEU 48 7.359 -7.142 -0.455
353 HD13 LEU 48 3HD1 LEU 48 6.994 -8.379 0.771
354 HD21 LEU 48 1HD2 LEU 48 9.239 -8.214 1.473
355 HD22 LEU 48 2HD2 LEU 48 9.758 -6.780 0.564
356 HD23 LEU 48 3HD2 LEU 48 9.860 -6.819 2.341
357 H ILE 49 H ILE 49 10.332 -3.308 1.092
358 HA ILE 49 HA ILE 49 12.208 -4.889 2.561
359 HB ILE 49 HB ILE 49 13.940 -3.742 1.431
360 HG12 ILE 49 2HG1 ILE 49 12.984 -1.812 -0.232
361 HG13 ILE 49 3HG1 ILE 49 12.043 -1.527 1.240
362 HG21 ILE 49 1HG2 ILE 49 11.606 -4.024 -0.485
363 HG22 ILE 49 2HG2 ILE 49 13.328 -4.131 -0.866
364 HG23 ILE 49 3HG2 ILE 49 12.574 -5.360 0.163
365 HD11 ILE 49 1HD1 ILE 49 15.065 -1.601 1.011
366 HD12 ILE 49 2HD1 ILE 49 14.042 -0.185 1.342
367 HD13 ILE 49 3HD1 ILE 49 14.187 -1.476 2.549
368 H THR 50 H THR 50 10.997 -1.550 3.146
369 HA THR 50 HA THR 50 12.989 -0.953 5.087
370 HB THR 50 HB THR 50 10.263 0.165 4.381
371 HG1 THR 50 1HG THR 50 12.905 1.215 4.364
372 HG21 THR 50 1HG2 THR 50 12.039 1.139 6.654
373 HG22 THR 50 2HG2 THR 50 10.726 2.077 5.900
374 HG23 THR 50 3HG2 THR 50 10.348 0.585 6.764
375 H ASN 51 H ASN 51 9.696 -2.301 5.326
376 HA ASN 51 HA ASN 51 10.367 -3.978 7.501
377 HB2 ASN 51 2HB ASN 51 9.160 -1.410 8.238
378 HB3 ASN 51 3HB ASN 51 8.017 -2.709 8.541
379 HD21 ASN 51 1HD2 ASN 51 11.466 -1.855 9.113
380 HD22 ASN 51 2HD2 ASN 51 11.532 -2.627 10.690
381 H LYS 52 H LYS 52 9.547 -5.666 6.340
382 HA LYS 52 HA LYS 52 7.360 -5.784 4.660
383 HB2 LYS 52 2HB LYS 52 7.237 -8.183 5.222
384 HB3 LYS 52 3HB LYS 52 8.804 -7.546 4.726
385 HG2 LYS 52 2HG LYS 52 9.396 -7.444 7.266
386 HG3 LYS 52 3HG LYS 52 7.958 -8.438 7.489
387 HD2 LYS 52 2HD LYS 52 9.160 -9.685 5.347
388 HD3 LYS 52 3HD LYS 52 10.568 -9.024 6.135
389 HE2 LYS 52 2HE LYS 52 8.494 -10.959 7.267
390 HE3 LYS 52 3HE LYS 52 10.183 -11.322 6.871
391 HZ1 LYS 52 1HZ LYS 52 9.106 -9.704 9.042
392 HZ2 LYS 52 2HZ LYS 52 9.989 -11.061 9.165
393 HZ3 LYS 52 3HZ LYS 52 10.744 -9.676 8.647
394 H LYS 53 H LYS 53 7.124 -6.371 8.185
395 HA LYS 53 HA LYS 53 4.323 -6.579 8.013
396 HB2 LYS 53 2HB LYS 53 4.354 -6.312 10.473
397 HB3 LYS 53 3HB LYS 53 5.686 -7.337 9.950
398 HG2 LYS 53 2HG LYS 53 7.037 -5.014 9.972
399 HG3 LYS 53 3HG LYS 53 5.747 -4.565 11.107
400 HD2 LYS 53 2HD LYS 53 6.250 -6.777 12.317
401 HD3 LYS 53 3HD LYS 53 7.691 -6.906 11.280
402 HE2 LYS 53 2HE LYS 53 8.488 -4.714 12.126
403 HE3 LYS 53 3HE LYS 53 7.043 -4.578 13.136
404 HZ1 LYS 53 1HZ LYS 53 7.761 -6.607 14.268
405 HZ2 LYS 53 2HZ LYS 53 9.138 -6.641 13.365
406 HZ3 LYS 53 3HZ LYS 53 8.875 -5.401 14.412
407 H CYS 54 H CYS 54 2.644 -5.300 8.074
408 HA CYS 54 HA CYS 54 2.963 -2.868 6.594
409 HB2 CYS 54 2HB CYS 54 1.015 -3.963 6.189
410 HB3 CYS 54 3HB CYS 54 0.753 -4.446 7.862
411 HA PRO 55 HA PRO 55 3.981 -0.022 9.691
412 HB2 PRO 55 2HB PRO 55 2.792 2.369 8.902
413 HB3 PRO 55 3HB PRO 55 4.240 1.633 8.157
414 HG2 PRO 55 2HG PRO 55 1.366 1.425 7.224
415 HG3 PRO 55 3HG PRO 55 2.829 1.762 6.251
416 HD2 PRO 55 2HD PRO 55 1.775 -0.729 6.362
417 HD3 PRO 55 3HD PRO 55 3.546 -0.496 6.383
418 H ILE 56 H ILE 56 0.523 0.846 9.011
419 HA ILE 56 HA ILE 56 0.207 1.410 11.872
420 HB ILE 56 HB ILE 56 -0.476 2.978 10.073
421 HG12 ILE 56 2HG1 ILE 56 -2.750 3.560 10.957
422 HG13 ILE 56 3HG1 ILE 56 -2.695 2.130 11.975
423 HG21 ILE 56 1HG2 ILE 56 -1.370 1.311 8.449
424 HG22 ILE 56 2HG2 ILE 56 -2.780 1.087 9.513
425 HG23 ILE 56 3HG2 ILE 56 -2.467 2.661 8.764
426 HD11 ILE 56 1HD1 ILE 56 -0.632 3.017 13.079
427 HD12 ILE 56 2HD1 ILE 56 -0.714 4.448 12.021
428 HD13 ILE 56 3HD1 ILE 56 -1.999 4.137 13.205
429 H CYS 57 H CYS 57 0.623 -1.302 11.281
430 HA CYS 57 HA CYS 57 -1.784 -2.639 12.419
431 HB2 CYS 57 2HB CYS 57 -1.379 -4.259 10.269
432 HB3 CYS 57 3HB CYS 57 -2.680 -3.103 10.463
433 H ARG 58 H ARG 58 1.465 -2.926 11.054
434 HA ARG 58 HA ARG 58 3.279 -4.104 11.510
435 HB2 ARG 58 2HB ARG 58 2.300 -4.136 14.379
436 HB3 ARG 58 3HB ARG 58 3.929 -4.497 13.818
437 HG2 ARG 58 2HG ARG 58 4.363 -2.339 14.255
438 HG3 ARG 58 3HG ARG 58 3.667 -2.066 12.657
439 HD2 ARG 58 2HD ARG 58 2.700 -0.510 14.256
440 HD3 ARG 58 3HD ARG 58 1.447 -1.657 13.749
441 HE ARG 58 HE ARG 58 2.813 -2.600 16.086
442 HH11 ARG 58 1HH1 ARG 58 0.316 -1.587 18.355
443 HH12 ARG 58 2HH1 ARG 58 1.692 -2.600 18.121
444 HH21 ARG 58 1HH2 ARG 58 -0.452 -0.208 16.566
445 HH22 ARG 58 2HH2 ARG 58 0.417 -0.244 15.070
446 H VAL 59 H VAL 59 0.689 -5.701 10.938
447 HA VAL 59 HA VAL 59 1.542 -8.364 11.812
448 HB VAL 59 HB VAL 59 -0.276 -9.024 10.358
449 HG11 VAL 59 1HG1 VAL 59 -0.785 -8.222 12.706
450 HG12 VAL 59 2HG1 VAL 59 -1.208 -6.640 12.023
451 HG13 VAL 59 3HG1 VAL 59 -2.159 -8.072 11.595
452 HG21 VAL 59 1HG2 VAL 59 -1.796 -7.403 9.305
453 HG22 VAL 59 2HG2 VAL 59 -0.533 -6.162 9.492
454 HG23 VAL 59 3HG2 VAL 59 -0.212 -7.619 8.532
455 H ASP 60 H ASP 60 2.748 -9.756 10.526
456 HA ASP 60 HA ASP 60 4.416 -8.457 8.568
457 HB2 ASP 60 2HB ASP 60 5.013 -10.307 10.246
458 HB3 ASP 60 3HB ASP 60 4.370 -11.400 9.022
459 H ILE 61 H ILE 61 4.531 -8.872 6.337
460 HA ILE 61 HA ILE 61 1.992 -9.839 5.136
461 HB ILE 61 HB ILE 61 2.304 -8.317 3.363
462 HG12 ILE 61 2HG1 ILE 61 4.960 -7.622 4.647
463 HG13 ILE 61 3HG1 ILE 61 4.702 -8.340 3.073
464 HG21 ILE 61 1HG2 ILE 61 1.789 -6.315 4.493
465 HG22 ILE 61 2HG2 ILE 61 1.350 -7.582 5.640
466 HG23 ILE 61 3HG2 ILE 61 2.897 -6.693 5.844
467 HD11 ILE 61 1HD1 ILE 61 5.156 -5.964 2.808
468 HD12 ILE 61 2HD1 ILE 61 3.486 -6.365 2.306
469 HD13 ILE 61 3HD1 ILE 61 3.787 -5.550 3.858
470 H GLU 62 H GLU 62 5.397 -10.346 5.334
471 HA GLU 62 HA GLU 62 6.036 -11.378 2.830
472 HB2 GLU 62 2HB GLU 62 7.469 -11.000 4.932
473 HB3 GLU 62 3HB GLU 62 6.955 -12.609 5.450
474 HG2 GLU 62 2HG GLU 62 7.833 -13.491 3.222
475 HG3 GLU 62 3HG GLU 62 8.451 -11.868 2.894
476 H ALA 63 H ALA 63 5.461 -13.196 1.704
477 HA ALA 63 HA ALA 63 3.347 -14.884 2.790
478 HB1 ALA 63 1HB ALA 63 3.400 -14.217 0.394
479 HB2 ALA 63 2HB ALA 63 4.943 -15.084 0.192
480 HB3 ALA 63 3HB ALA 63 3.458 -15.981 0.576
481 H GLN 64 H GLN 64 3.673 -17.366 2.489
482 HA GLN 64 HA GLN 64 5.820 -18.216 4.164
483 HB2 GLN 64 2HB GLN 64 5.048 -20.462 3.708
484 HB3 GLN 64 3HB GLN 64 3.685 -19.390 3.946
485 HG2 GLN 64 2HG GLN 64 2.934 -20.609 2.155
486 HG3 GLN 64 3HG GLN 64 3.615 -19.214 1.323
487 HE21 GLN 64 1HE2 GLN 64 3.615 -20.776 -0.571
488 HE22 GLN 64 2HE2 GLN 64 4.980 -21.878 -0.680
489 H LEU 65 H LEU 65 7.934 -18.579 3.709
490 HA LEU 65 HA LEU 65 8.742 -19.471 1.040
491 HB2 LEU 65 2HB LEU 65 9.594 -16.873 2.363
492 HB3 LEU 65 3HB LEU 65 10.807 -17.833 1.541
493 HG LEU 65 HG LEU 65 8.792 -17.800 -0.363
494 HD11 LEU 65 1HD1 LEU 65 8.949 -15.042 0.934
495 HD12 LEU 65 2HD1 LEU 65 8.172 -15.421 -0.622
496 HD13 LEU 65 3HD1 LEU 65 7.518 -16.092 0.884
497 HD21 LEU 65 1HD2 LEU 65 11.161 -15.916 -0.024
498 HD22 LEU 65 2HD2 LEU 65 11.191 -17.533 -0.757
499 HD23 LEU 65 3HD2 LEU 65 10.292 -16.228 -1.544
500 HA PRO 66 HA PRO 66 11.170 -21.832 3.983
501 HB2 PRO 66 2HB PRO 66 12.567 -23.426 2.301
502 HB3 PRO 66 3HB PRO 66 10.784 -23.517 2.381
503 HG2 PRO 66 2HG PRO 66 12.452 -21.949 0.376
504 HG3 PRO 66 3HG PRO 66 11.137 -23.120 0.038
505 HD2 PRO 66 2HD PRO 66 10.708 -20.408 0.180
506 HD3 PRO 66 3HD PRO 66 9.478 -21.598 0.714
507 H SER 67 H SER 67 12.081 -19.465 4.300
508 HA SER 67 HA SER 67 13.831 -17.993 4.474
509 HB2 SER 67 2HB SER 67 15.265 -20.649 4.843
510 HB3 SER 67 3HB SER 67 15.863 -19.071 5.390
511 HG SER 67 HG SER 67 14.060 -18.906 6.736
512 H GLU 68 H GLU 68 13.599 -17.435 2.054
513 HA GLU 68 HA GLU 68 16.219 -17.910 0.773
514 HB2 GLU 68 2HB GLU 68 14.505 -19.514 -0.155
515 HB3 GLU 68 3HB GLU 68 13.519 -18.133 -0.627
516 HG2 GLU 68 2HG GLU 68 14.750 -18.864 -2.559
517 HG3 GLU 68 3HG GLU 68 15.430 -17.315 -2.058
518 H SER 69 H SER 69 17.038 -15.926 0.774
519 HA SER 69 HA SER 69 17.278 -13.682 0.800
520 HB2 SER 69 2HB SER 69 16.597 -13.949 -1.597
521 HB3 SER 69 3HB SER 69 14.920 -13.606 -1.112
522 HG SER 69 HG SER 69 15.716 -11.653 -0.215
Start of MODEL 10
1 H1 MET 1 H1 MET 1 -1.384 28.023 11.445
2 H2 MET 1 H2 MET 1 -0.152 27.126 12.090
3 H3 MET 1 H3 MET 1 -1.545 26.391 11.590
4 HA MET 1 HA MET 1 -1.539 26.522 13.959
5 HB2 MET 1 2HB MET 1 -0.037 28.503 14.098
6 HB3 MET 1 3HB MET 1 -1.344 29.539 13.501
7 HG2 MET 1 2HG MET 1 -1.197 29.598 15.969
8 HG3 MET 1 3HG MET 1 -2.737 28.923 15.440
9 HE1 MET 1 1HE MET 1 -2.889 26.260 18.006
10 HE2 MET 1 2HE MET 1 -3.152 28.014 17.860
11 HE3 MET 1 3HE MET 1 -3.722 26.915 16.579
12 H LYS 2 H LYS 2 -3.602 25.609 13.669
13 HA LYS 2 HA LYS 2 -5.941 26.838 14.131
14 HB2 LYS 2 2HB LYS 2 -5.132 27.358 11.315
15 HB3 LYS 2 3HB LYS 2 -6.694 26.604 11.438
16 HG2 LYS 2 2HG LYS 2 -7.631 28.330 12.748
17 HG3 LYS 2 3HG LYS 2 -6.070 28.858 13.350
18 HD2 LYS 2 2HD LYS 2 -5.554 29.583 10.910
19 HD3 LYS 2 3HD LYS 2 -7.320 29.450 10.670
20 HE2 LYS 2 2HE LYS 2 -7.620 30.905 12.714
21 HE3 LYS 2 3HE LYS 2 -5.859 31.049 12.830
22 HZ1 LYS 2 1HZ LYS 2 -5.881 32.102 10.649
23 HZ2 LYS 2 2HZ LYS 2 -7.527 32.014 10.598
24 HZ3 LYS 2 3HZ LYS 2 -6.786 32.946 11.734
25 H GLN 3 H GLN 3 -7.828 25.360 12.856
26 HA GLN 3 HA GLN 3 -6.842 22.550 13.040
27 HB2 GLN 3 2HB GLN 3 -8.635 21.980 14.561
28 HB3 GLN 3 3HB GLN 3 -7.693 23.305 15.247
29 HG2 GLN 3 2HG GLN 3 -9.594 24.787 13.989
30 HG3 GLN 3 3HG GLN 3 -10.514 23.296 14.186
31 HE21 GLN 3 1HE2 GLN 3 -8.745 25.890 15.905
32 HE22 GLN 3 2HE2 GLN 3 -9.510 25.570 17.458
33 H ASP 4 H ASP 4 -7.859 24.637 10.984
34 HA ASP 4 HA ASP 4 -10.369 23.515 10.043
35 HB2 ASP 4 2HB ASP 4 -8.697 25.856 9.023
36 HB3 ASP 4 3HB ASP 4 -10.409 25.551 8.719
37 H GLY 5 H GLY 5 -10.483 23.088 7.542
38 HA2 GLY 5 2HA GLY 5 -7.969 22.389 6.276
39 HA3 GLY 5 3HA GLY 5 -8.877 20.990 6.888
40 H GLU 6 H GLU 6 -8.921 20.450 4.506
41 HA GLU 6 HA GLU 6 -11.277 21.566 3.178
42 HB2 GLU 6 2HB GLU 6 -8.475 22.084 2.422
43 HB3 GLU 6 3HB GLU 6 -9.296 21.181 1.156
44 HG2 GLU 6 2HG GLU 6 -10.445 23.714 2.398
45 HG3 GLU 6 3HG GLU 6 -9.394 23.708 0.976
46 H GLU 7 H GLU 7 -12.073 19.969 1.569
47 HA GLU 7 HA GLU 7 -10.886 17.341 1.480
48 HB2 GLU 7 2HB GLU 7 -12.045 17.390 3.770
49 HB3 GLU 7 3HB GLU 7 -13.560 17.692 2.920
50 HG2 GLU 7 2HG GLU 7 -13.538 15.361 3.285
51 HG3 GLU 7 3HG GLU 7 -13.077 15.528 1.592
52 H GLY 8 H GLY 8 -11.442 16.713 -0.567
53 HA2 GLY 8 2HA GLY 8 -13.954 17.762 -1.802
54 HA3 GLY 8 3HA GLY 8 -12.399 17.890 -2.646
55 H THR 9 H THR 9 -14.556 16.468 -3.804
56 HA THR 9 HA THR 9 -13.457 13.783 -3.976
57 HB THR 9 HB THR 9 -14.956 13.620 -2.051
58 HG1 THR 9 1HG THR 9 -16.315 11.992 -2.936
59 HG21 THR 9 1HG2 THR 9 -17.175 14.410 -3.960
60 HG22 THR 9 2HG2 THR 9 -17.339 13.980 -2.242
61 HG23 THR 9 3HG2 THR 9 -16.499 15.473 -2.709
62 H GLU 10 H GLU 10 -13.820 13.025 -6.120
63 HA GLU 10 HA GLU 10 -16.031 13.971 -7.638
64 HB2 GLU 10 2HB GLU 10 -13.917 15.815 -7.704
65 HB3 GLU 10 3HB GLU 10 -13.684 14.888 -9.189
66 HG2 GLU 10 2HG GLU 10 -15.966 15.343 -9.905
67 HG3 GLU 10 3HG GLU 10 -16.384 16.027 -8.333
68 H GLU 11 H GLU 11 -12.619 12.760 -8.031
69 HA GLU 11 HA GLU 11 -13.752 10.331 -9.259
70 HB2 GLU 11 2HB GLU 11 -11.971 10.327 -10.923
71 HB3 GLU 11 3HB GLU 11 -12.999 11.752 -11.084
72 HG2 GLU 11 2HG GLU 11 -11.205 13.032 -9.742
73 HG3 GLU 11 3HG GLU 11 -10.165 11.621 -9.990
74 H ASP 12 H ASP 12 -13.008 8.614 -8.235
75 HA ASP 12 HA ASP 12 -12.428 7.472 -6.431
76 HB2 ASP 12 2HB ASP 12 -10.706 6.837 -8.009
77 HB3 ASP 12 3HB ASP 12 -9.648 8.127 -7.410
78 H THR 13 H THR 13 -12.775 7.904 -4.367
79 HA THR 13 HA THR 13 -10.939 9.824 -3.032
80 HB THR 13 HB THR 13 -13.925 9.548 -2.606
81 HG1 THR 13 1HG THR 13 -14.043 11.320 -3.773
82 HG21 THR 13 1HG2 THR 13 -12.897 10.265 -0.504
83 HG22 THR 13 2HG2 THR 13 -11.857 11.430 -1.370
84 HG23 THR 13 3HG2 THR 13 -13.613 11.677 -1.286
85 H GLU 14 H GLU 14 -11.573 6.626 -3.315
86 HA GLU 14 HA GLU 14 -11.533 6.111 -0.369
87 HB2 GLU 14 2HB GLU 14 -12.857 4.656 -2.676
88 HB3 GLU 14 3HB GLU 14 -12.412 3.821 -1.191
89 HG2 GLU 14 2HG GLU 14 -14.647 4.442 -0.849
90 HG3 GLU 14 3HG GLU 14 -13.699 5.561 0.123
91 H GLU 15 H GLU 15 -10.209 4.956 -3.584
92 HA GLU 15 HA GLU 15 -8.478 3.127 -2.072
93 HB2 GLU 15 2HB GLU 15 -8.643 3.681 -5.062
94 HB3 GLU 15 3HB GLU 15 -7.662 2.442 -4.259
95 HG2 GLU 15 2HG GLU 15 -9.985 1.779 -3.144
96 HG3 GLU 15 3HG GLU 15 -10.660 2.581 -4.564
97 H LYS 16 H LYS 16 -7.257 4.538 -0.776
98 HA LYS 16 HA LYS 16 -5.261 6.131 -2.324
99 HB2 LYS 16 2HB LYS 16 -5.184 7.638 -0.241
100 HB3 LYS 16 3HB LYS 16 -6.517 7.836 -1.376
101 HG2 LYS 16 2HG LYS 16 -8.082 6.803 -0.022
102 HG3 LYS 16 3HG LYS 16 -6.834 6.027 0.972
103 HD2 LYS 16 2HD LYS 16 -7.742 7.779 2.327
104 HD3 LYS 16 3HD LYS 16 -6.157 8.322 1.782
105 HE2 LYS 16 2HE LYS 16 -7.479 10.219 1.440
106 HE3 LYS 16 3HE LYS 16 -7.443 9.481 -0.168
107 HZ1 LYS 16 1HZ LYS 16 -9.643 9.267 1.806
108 HZ2 LYS 16 2HZ LYS 16 -9.680 10.109 0.399
109 HZ3 LYS 16 3HZ LYS 16 -9.622 8.492 0.357
110 H CYS 17 H CYS 17 -3.255 5.996 -1.884
111 HA CYS 17 HA CYS 17 -2.017 3.734 -0.572
112 HB2 CYS 17 2HB CYS 17 -1.291 5.007 -2.619
113 HB3 CYS 17 3HB CYS 17 -0.925 6.360 -1.587
114 H THR 18 H THR 18 -1.850 3.571 1.655
115 HA THR 18 HA THR 18 -2.097 5.847 3.357
116 HB THR 18 HB THR 18 -2.484 3.303 3.830
117 HG1 THR 18 1HG THR 18 -2.129 3.871 6.088
118 HG21 THR 18 1HG2 THR 18 0.297 3.690 5.017
119 HG22 THR 18 2HG2 THR 18 -0.741 2.267 5.168
120 HG23 THR 18 3HG2 THR 18 -0.048 2.689 3.586
121 H ILE 19 H ILE 19 0.749 4.355 1.780
122 HA ILE 19 HA ILE 19 2.666 5.436 3.569
123 HB ILE 19 HB ILE 19 2.753 4.355 0.759
124 HG12 ILE 19 2HG1 ILE 19 3.953 3.025 3.188
125 HG13 ILE 19 3HG1 ILE 19 2.205 2.906 2.954
126 HG21 ILE 19 1HG2 ILE 19 4.695 5.772 1.006
127 HG22 ILE 19 2HG2 ILE 19 4.970 5.198 2.665
128 HG23 ILE 19 3HG2 ILE 19 5.261 4.113 1.293
129 HD11 ILE 19 1HD1 ILE 19 3.860 1.143 1.820
130 HD12 ILE 19 2HD1 ILE 19 2.371 1.699 1.008
131 HD13 ILE 19 3HD1 ILE 19 3.952 2.374 0.579
132 H CYS 20 H CYS 20 1.642 6.372 0.227
133 HA CYS 20 HA CYS 20 3.218 8.899 0.268
134 HB2 CYS 20 2HB CYS 20 1.023 8.084 -1.651
135 HB3 CYS 20 3HB CYS 20 2.299 9.287 -1.870
136 H LEU 21 H LEU 21 0.200 7.906 1.614
137 HA LEU 21 HA LEU 21 -1.839 8.786 1.808
138 HB2 LEU 21 2HB LEU 21 -0.161 11.147 2.696
139 HB3 LEU 21 3HB LEU 21 -1.902 11.000 2.984
140 HG LEU 21 HG LEU 21 0.138 8.940 3.918
141 HD11 LEU 21 1HD1 LEU 21 -1.132 11.222 5.452
142 HD12 LEU 21 2HD1 LEU 21 -0.136 9.913 6.144
143 HD13 LEU 21 3HD1 LEU 21 0.584 11.051 4.992
144 HD21 LEU 21 1HD2 LEU 21 -2.778 9.422 4.720
145 HD22 LEU 21 2HD2 LEU 21 -2.198 8.065 3.733
146 HD23 LEU 21 3HD2 LEU 21 -1.692 8.192 5.409
147 H SER 22 H SER 22 -1.513 8.541 -0.655
148 HA SER 22 HA SER 22 -2.586 10.999 -1.915
149 HB2 SER 22 2HB SER 22 -0.313 9.296 -3.026
150 HB3 SER 22 3HB SER 22 -1.178 10.553 -3.921
151 HG SER 22 HG SER 22 0.163 11.061 -1.453
152 H ILE 23 H ILE 23 -4.178 10.500 -3.431
153 HA ILE 23 HA ILE 23 -5.569 8.026 -3.207
154 HB ILE 23 HB ILE 23 -5.635 10.455 -5.040
155 HG12 ILE 23 2HG1 ILE 23 -6.137 10.529 -2.398
156 HG13 ILE 23 3HG1 ILE 23 -6.999 11.509 -3.568
157 HG21 ILE 23 1HG2 ILE 23 -7.663 8.207 -4.855
158 HG22 ILE 23 2HG2 ILE 23 -7.956 9.799 -5.617
159 HG23 ILE 23 3HG2 ILE 23 -6.728 8.727 -6.256
160 HD11 ILE 23 1HD1 ILE 23 -8.429 10.383 -1.831
161 HD12 ILE 23 2HD1 ILE 23 -8.897 10.122 -3.503
162 HD13 ILE 23 3HD1 ILE 23 -8.070 8.825 -2.620
163 H LEU 24 H LEU 24 -5.946 6.532 -5.061
164 HA LEU 24 HA LEU 24 -3.592 6.172 -6.786
165 HB2 LEU 24 2HB LEU 24 -5.915 4.362 -5.948
166 HB3 LEU 24 3HB LEU 24 -4.499 3.837 -6.867
167 HG LEU 24 HG LEU 24 -4.252 5.013 -4.057
168 HD11 LEU 24 1HD1 LEU 24 -5.537 3.035 -3.874
169 HD12 LEU 24 2HD1 LEU 24 -4.459 2.153 -4.972
170 HD13 LEU 24 3HD1 LEU 24 -3.876 2.683 -3.355
171 HD21 LEU 24 1HD2 LEU 24 -2.049 3.755 -4.284
172 HD22 LEU 24 2HD2 LEU 24 -2.421 3.613 -6.016
173 HD23 LEU 24 3HD2 LEU 24 -2.277 5.222 -5.281
174 H GLU 25 H GLU 25 -5.373 4.446 -8.511
175 HA GLU 25 HA GLU 25 -7.632 5.952 -9.252
176 HB2 GLU 25 2HB GLU 25 -7.170 6.382 -11.569
177 HB3 GLU 25 3HB GLU 25 -5.941 7.186 -10.589
178 HG2 GLU 25 2HG GLU 25 -4.323 5.418 -11.093
179 HG3 GLU 25 3HG GLU 25 -5.531 4.538 -12.045
180 H GLU 26 H GLU 26 -8.736 4.740 -11.187
181 HA GLU 26 HA GLU 26 -8.954 1.963 -10.498
182 HB2 GLU 26 2HB GLU 26 -10.857 3.245 -11.304
183 HB3 GLU 26 3HB GLU 26 -10.019 3.662 -12.795
184 HG2 GLU 26 2HG GLU 26 -11.704 1.941 -13.185
185 HG3 GLU 26 3HG GLU 26 -10.099 1.320 -13.548
186 H GLY 27 H GLY 27 -7.156 0.771 -10.821
187 HA2 GLY 27 2HA GLY 27 -6.050 -0.764 -12.234
188 HA3 GLY 27 3HA GLY 27 -6.370 0.276 -13.625
189 H GLU 28 H GLU 28 -4.858 1.557 -10.620
190 HA GLU 28 HA GLU 28 -2.488 2.275 -12.151
191 HB2 GLU 28 2HB GLU 28 -3.778 3.448 -10.098
192 HB3 GLU 28 3HB GLU 28 -2.630 2.508 -9.158
193 HG2 GLU 28 2HG GLU 28 -0.789 3.568 -10.607
194 HG3 GLU 28 3HG GLU 28 -2.038 4.592 -11.312
195 H ASP 29 H ASP 29 -0.290 1.763 -11.204
196 HA ASP 29 HA ASP 29 0.078 -1.062 -10.736
197 HB2 ASP 29 2HB ASP 29 2.049 1.236 -10.408
198 HB3 ASP 29 3HB ASP 29 2.429 -0.464 -10.351
199 H VAL 30 H VAL 30 -0.649 -1.884 -8.845
200 HA VAL 30 HA VAL 30 0.277 -0.686 -6.317
201 HB VAL 30 HB VAL 30 -1.918 -0.951 -5.291
202 HG11 VAL 30 1HG1 VAL 30 -3.097 0.886 -6.336
203 HG12 VAL 30 2HG1 VAL 30 -1.361 1.224 -6.402
204 HG13 VAL 30 3HG1 VAL 30 -2.220 0.659 -7.849
205 HG21 VAL 30 1HG2 VAL 30 -2.876 -1.811 -8.056
206 HG22 VAL 30 2HG2 VAL 30 -2.885 -2.784 -6.564
207 HG23 VAL 30 3HG2 VAL 30 -3.938 -1.369 -6.712
208 H ARG 31 H ARG 31 -0.368 -2.374 -4.503
209 HA ARG 31 HA ARG 31 0.051 -5.115 -5.509
210 HB2 ARG 31 2HB ARG 31 1.885 -3.421 -3.895
211 HB3 ARG 31 3HB ARG 31 1.615 -4.998 -3.166
212 HG2 ARG 31 2HG ARG 31 2.305 -4.691 -6.077
213 HG3 ARG 31 3HG ARG 31 3.573 -4.720 -4.831
214 HD2 ARG 31 2HD ARG 31 2.997 -6.969 -4.227
215 HD3 ARG 31 3HD ARG 31 1.500 -6.908 -5.195
216 HE ARG 31 HE ARG 31 3.660 -6.267 -6.883
217 HH11 ARG 31 1HH1 ARG 31 4.065 -9.395 -8.342
218 HH12 ARG 31 2HH1 ARG 31 4.331 -7.684 -8.459
219 HH21 ARG 31 1HH2 ARG 31 2.824 -10.218 -6.433
220 HH22 ARG 31 2HH2 ARG 31 2.349 -9.080 -5.219
221 H ARG 32 H ARG 32 -0.312 -6.671 -3.617
222 HA ARG 32 HA ARG 32 -2.450 -5.611 -1.866
223 HB2 ARG 32 2HB ARG 32 -3.488 -7.073 -3.521
224 HB3 ARG 32 3HB ARG 32 -2.214 -8.283 -3.323
225 HG2 ARG 32 2HG ARG 32 -4.211 -9.047 -2.188
226 HG3 ARG 32 3HG ARG 32 -2.962 -8.732 -1.005
227 HD2 ARG 32 2HD ARG 32 -4.735 -7.659 0.048
228 HD3 ARG 32 3HD ARG 32 -4.097 -6.324 -0.857
229 HE ARG 32 HE ARG 32 -5.960 -6.273 -2.188
230 HH11 ARG 32 1HH1 ARG 32 -8.663 -8.517 -2.522
231 HH12 ARG 32 2HH1 ARG 32 -8.034 -6.981 -2.983
232 HH21 ARG 32 1HH2 ARG 32 -7.417 -9.915 -1.057
233 HH22 ARG 32 2HH2 ARG 32 -5.889 -9.359 -0.477
234 H LEU 33 H LEU 33 -2.301 -6.227 0.263
235 HA LEU 33 HA LEU 33 -0.230 -8.094 1.130
236 HB2 LEU 33 2HB LEU 33 -0.264 -6.332 3.176
237 HB3 LEU 33 3HB LEU 33 0.908 -6.236 1.873
238 HG LEU 33 HG LEU 33 -1.717 -4.751 1.610
239 HD11 LEU 33 1HD1 LEU 33 0.687 -3.884 3.288
240 HD12 LEU 33 2HD1 LEU 33 -0.657 -2.830 2.810
241 HD13 LEU 33 3HD1 LEU 33 -0.961 -4.209 3.872
242 HD21 LEU 33 1HD2 LEU 33 -0.110 -3.067 0.528
243 HD22 LEU 33 2HD2 LEU 33 1.204 -4.221 0.790
244 HD23 LEU 33 3HD2 LEU 33 -0.130 -4.611 -0.309
245 HA PRO 34 HA PRO 34 -3.508 -9.984 3.057
246 HB2 PRO 34 2HB PRO 34 -2.636 -10.718 5.589
247 HB3 PRO 34 3HB PRO 34 -2.139 -11.489 4.054
248 HG2 PRO 34 2HG PRO 34 -0.652 -9.427 5.676
249 HG3 PRO 34 3HG PRO 34 -0.016 -10.856 4.796
250 HD2 PRO 34 2HD PRO 34 0.065 -8.270 3.866
251 HD3 PRO 34 3HD PRO 34 0.052 -9.659 2.784
252 H CYS 35 H CYS 35 -2.275 -7.257 4.882
253 HA CYS 35 HA CYS 35 -4.615 -6.716 6.577
254 HB2 CYS 35 2HB CYS 35 -2.277 -6.099 7.011
255 HB3 CYS 35 3HB CYS 35 -2.278 -5.058 5.622
256 H MET 36 H MET 36 -4.959 -7.124 3.445
257 HA MET 36 HA MET 36 -6.052 -6.186 1.715
258 HB2 MET 36 2HB MET 36 -7.953 -5.640 4.027
259 HB3 MET 36 3HB MET 36 -8.380 -5.599 2.310
260 HG2 MET 36 2HG MET 36 -7.256 -8.005 2.283
261 HG3 MET 36 3HG MET 36 -7.591 -7.953 4.012
262 HE1 MET 36 1HE MET 36 -8.944 -8.144 0.389
263 HE2 MET 36 2HE MET 36 -10.707 -8.003 0.572
264 HE3 MET 36 3HE MET 36 -9.676 -6.585 0.835
265 H HIS 37 H HIS 37 -4.098 -4.494 2.224
266 HA HIS 37 HA HIS 37 -5.331 -1.789 2.118
267 HB2 HIS 37 1HB HIS 37 -3.447 -3.045 3.963
268 HB3 HIS 37 2HB HIS 37 -2.669 -1.721 3.166
269 HD2 HIS 37 2HD HIS 37 -5.530 0.094 3.113
270 HE1 HIS 37 1HE HIS 37 -4.654 0.371 7.263
271 HE2 HIS 37 2HE HIS 37 -5.994 1.376 5.331
272 H LEU 38 H LEU 38 -5.324 -1.771 -0.159
273 HA LEU 38 HA LEU 38 -2.970 -2.725 -1.574
274 HB2 LEU 38 2HB LEU 38 -4.109 -2.217 -3.620
275 HB3 LEU 38 3HB LEU 38 -5.153 -3.114 -2.548
276 HG LEU 38 HG LEU 38 -5.673 -0.279 -2.139
277 HD11 LEU 38 1HD1 LEU 38 -6.440 0.308 -4.395
278 HD12 LEU 38 2HD1 LEU 38 -4.702 -0.053 -4.432
279 HD13 LEU 38 3HD1 LEU 38 -5.880 -1.245 -5.027
280 HD21 LEU 38 1HD2 LEU 38 -7.371 -2.431 -3.426
281 HD22 LEU 38 2HD2 LEU 38 -7.231 -2.133 -1.669
282 HD23 LEU 38 3HD2 LEU 38 -7.917 -0.898 -2.737
283 H PHE 39 H PHE 39 -1.206 -1.600 -2.177
284 HA PHE 39 HA PHE 39 -1.328 1.393 -2.092
285 HB2 PHE 39 2HB PHE 39 0.699 -0.449 -0.787
286 HB3 PHE 39 3HB PHE 39 0.821 1.308 -0.835
287 HD1 PHE 39 1HD PHE 39 0.881 -0.621 1.615
288 HD2 PHE 39 2HD PHE 39 -2.271 1.727 -0.142
289 HE1 PHE 39 1HE PHE 39 -0.272 -0.468 3.810
290 HE2 PHE 39 2HE PHE 39 -3.412 1.851 2.020
291 HZ PHE 39 HZ PHE 39 -2.382 0.790 4.028
292 H HIS 40 H HIS 40 0.452 2.442 -3.260
293 HA HIS 40 HA HIS 40 0.806 1.480 -5.849
294 HB2 HIS 40 1HB HIS 40 2.674 3.275 -4.271
295 HB3 HIS 40 2HB HIS 40 2.816 3.004 -5.997
296 HD2 HIS 40 2HD HIS 40 0.479 3.742 -7.493
297 HE1 HIS 40 1HE HIS 40 -0.103 7.120 -4.968
298 HE2 HIS 40 2HE HIS 40 -0.672 6.013 -7.262
299 H GLN 41 H GLN 41 2.402 0.398 -6.977
300 HA GLN 41 HA GLN 41 4.141 -1.418 -5.570
301 HB2 GLN 41 2HB GLN 41 3.174 -0.917 -8.304
302 HB3 GLN 41 3HB GLN 41 4.854 -1.419 -8.318
303 HG2 GLN 41 2HG GLN 41 4.229 -3.265 -6.688
304 HG3 GLN 41 3HG GLN 41 2.542 -2.764 -6.900
305 HE21 GLN 41 1HE2 GLN 41 2.651 -2.407 -9.854
306 HE22 GLN 41 2HE2 GLN 41 2.837 -4.018 -10.484
307 H VAL 42 H VAL 42 4.698 1.586 -5.368
308 HA VAL 42 HA VAL 42 7.645 1.341 -5.762
309 HB VAL 42 HB VAL 42 5.971 3.871 -6.093
310 HG11 VAL 42 1HG1 VAL 42 8.978 3.415 -6.356
311 HG12 VAL 42 2HG1 VAL 42 8.119 4.921 -6.746
312 HG13 VAL 42 3HG1 VAL 42 8.177 4.349 -5.074
313 HG21 VAL 42 1HG2 VAL 42 5.764 2.427 -8.061
314 HG22 VAL 42 2HG2 VAL 42 6.825 3.789 -8.443
315 HG23 VAL 42 3HG2 VAL 42 7.523 2.188 -8.106
316 H CYS 43 H CYS 43 5.194 3.402 -4.081
317 HA CYS 43 HA CYS 43 6.461 3.939 -1.658
318 HB2 CYS 43 2HB CYS 43 3.571 3.053 -1.958
319 HB3 CYS 43 3HB CYS 43 4.284 4.162 -0.786
320 H VAL 44 H VAL 44 4.463 1.019 -2.416
321 HA VAL 44 HA VAL 44 5.077 -0.026 0.188
322 HB VAL 44 HB VAL 44 2.874 -0.088 -1.147
323 HG11 VAL 44 1HG1 VAL 44 2.434 -1.949 -2.466
324 HG12 VAL 44 2HG1 VAL 44 4.040 -1.452 -3.056
325 HG13 VAL 44 3HG1 VAL 44 3.909 -2.818 -1.950
326 HG21 VAL 44 1HG2 VAL 44 3.239 -1.017 1.092
327 HG22 VAL 44 2HG2 VAL 44 2.237 -2.122 0.118
328 HG23 VAL 44 3HG2 VAL 44 3.962 -2.471 0.381
329 H ASP 45 H ASP 45 6.538 -0.315 -2.853
330 HA ASP 45 HA ASP 45 7.761 -2.934 -2.578
331 HB2 ASP 45 2HB ASP 45 7.910 -1.863 -4.730
332 HB3 ASP 45 3HB ASP 45 8.622 -0.404 -4.042
333 H GLN 46 H GLN 46 9.023 0.376 -1.982
334 HA GLN 46 HA GLN 46 11.154 -0.516 -0.332
335 HB2 GLN 46 2HB GLN 46 9.731 2.150 -0.665
336 HB3 GLN 46 3HB GLN 46 11.054 1.967 0.495
337 HG2 GLN 46 2HG GLN 46 11.404 1.146 -2.416
338 HG3 GLN 46 3HG GLN 46 11.633 2.815 -1.884
339 HE21 GLN 46 1HE2 GLN 46 13.052 -0.416 -1.886
340 HE22 GLN 46 2HE2 GLN 46 14.494 0.056 -0.986
341 H ALA 47 H ALA 47 7.775 0.112 0.548
342 HA ALA 47 HA ALA 47 8.272 0.080 3.363
343 HB1 ALA 47 1HB ALA 47 5.837 -0.981 1.901
344 HB2 ALA 47 2HB ALA 47 5.916 -0.401 3.579
345 HB3 ALA 47 3HB ALA 47 6.160 0.744 2.231
346 H LEU 48 H LEU 48 7.137 -2.656 1.296
347 HA LEU 48 HA LEU 48 7.248 -4.687 3.157
348 HB2 LEU 48 2HB LEU 48 6.128 -4.751 1.020
349 HB3 LEU 48 3HB LEU 48 7.641 -4.693 0.126
350 HG LEU 48 HG LEU 48 7.228 -6.950 2.086
351 HD11 LEU 48 1HD1 LEU 48 5.261 -6.478 0.106
352 HD12 LEU 48 2HD1 LEU 48 6.319 -7.700 -0.598
353 HD13 LEU 48 3HD1 LEU 48 5.568 -7.985 0.979
354 HD21 LEU 48 1HD2 LEU 48 9.391 -6.828 0.900
355 HD22 LEU 48 2HD2 LEU 48 8.476 -8.228 0.350
356 HD23 LEU 48 3HD2 LEU 48 8.552 -6.767 -0.661
357 H ILE 49 H ILE 49 9.887 -3.666 0.880
358 HA ILE 49 HA ILE 49 11.697 -5.636 1.926
359 HB ILE 49 HB ILE 49 13.427 -4.495 0.712
360 HG12 ILE 49 2HG1 ILE 49 12.476 -2.363 -0.642
361 HG13 ILE 49 3HG1 ILE 49 11.659 -2.175 0.915
362 HG21 ILE 49 1HG2 ILE 49 11.781 -5.887 -0.525
363 HG22 ILE 49 2HG2 ILE 49 10.869 -4.417 -0.930
364 HG23 ILE 49 3HG2 ILE 49 12.524 -4.628 -1.519
365 HD11 ILE 49 1HD1 ILE 49 14.641 -2.293 0.377
366 HD12 ILE 49 2HD1 ILE 49 13.708 -0.968 1.109
367 HD13 ILE 49 3HD1 ILE 49 13.979 -2.464 2.011
368 H THR 50 H THR 50 10.932 -2.257 2.927
369 HA THR 50 HA THR 50 13.145 -1.967 4.626
370 HB THR 50 HB THR 50 10.444 -0.678 4.399
371 HG1 THR 50 1HG THR 50 13.149 0.160 4.499
372 HG21 THR 50 1HG2 THR 50 10.449 -0.838 6.790
373 HG22 THR 50 2HG2 THR 50 12.149 -0.296 6.875
374 HG23 THR 50 3HG2 THR 50 10.869 0.805 6.315
375 H ASN 51 H ASN 51 9.874 -3.333 5.315
376 HA ASN 51 HA ASN 51 10.994 -5.138 7.298
377 HB2 ASN 51 2HB ASN 51 9.439 -2.685 8.098
378 HB3 ASN 51 3HB ASN 51 8.835 -4.212 8.723
379 HD21 ASN 51 1HD2 ASN 51 12.239 -2.916 8.522
380 HD22 ASN 51 2HD2 ASN 51 12.518 -3.224 10.215
381 H LYS 52 H LYS 52 9.646 -6.981 7.234
382 HA LYS 52 HA LYS 52 7.241 -7.003 5.577
383 HB2 LYS 52 2HB LYS 52 6.973 -9.237 6.423
384 HB3 LYS 52 3HB LYS 52 8.491 -8.958 5.589
385 HG2 LYS 52 2HG LYS 52 9.794 -9.054 7.607
386 HG3 LYS 52 3HG LYS 52 8.355 -8.918 8.641
387 HD2 LYS 52 2HD LYS 52 7.492 -10.982 7.533
388 HD3 LYS 52 3HD LYS 52 9.081 -11.224 6.806
389 HE2 LYS 52 2HE LYS 52 10.031 -11.673 8.972
390 HE3 LYS 52 3HE LYS 52 8.641 -10.919 9.799
391 HZ1 LYS 52 1HZ LYS 52 8.425 -13.404 8.213
392 HZ2 LYS 52 2HZ LYS 52 8.501 -13.337 9.865
393 HZ3 LYS 52 3HZ LYS 52 7.247 -12.658 9.059
394 H LYS 53 H LYS 53 6.123 -5.174 6.568
395 HA LYS 53 HA LYS 53 4.054 -6.227 8.293
396 HB2 LYS 53 2HB LYS 53 4.206 -4.488 10.017
397 HB3 LYS 53 3HB LYS 53 5.604 -5.560 10.043
398 HG2 LYS 53 2HG LYS 53 6.748 -3.691 8.577
399 HG3 LYS 53 3HG LYS 53 5.428 -2.666 9.147
400 HD2 LYS 53 2HD LYS 53 6.023 -3.234 11.503
401 HD3 LYS 53 3HD LYS 53 7.355 -4.255 10.910
402 HE2 LYS 53 2HE LYS 53 8.348 -2.261 9.791
403 HE3 LYS 53 3HE LYS 53 7.065 -1.249 10.469
404 HZ1 LYS 53 1HZ LYS 53 9.060 -1.179 11.804
405 HZ2 LYS 53 2HZ LYS 53 7.868 -1.918 12.670
406 HZ3 LYS 53 3HZ LYS 53 9.076 -2.814 11.964
407 H CYS 54 H CYS 54 2.155 -4.949 8.017
408 HA CYS 54 HA CYS 54 2.039 -3.356 5.575
409 HB2 CYS 54 2HB CYS 54 0.121 -4.606 6.270
410 HB3 CYS 54 3HB CYS 54 0.116 -3.842 7.851
411 HA PRO 55 HA PRO 55 3.859 0.202 7.445
412 HB2 PRO 55 2HB PRO 55 3.231 2.137 5.597
413 HB3 PRO 55 3HB PRO 55 4.401 0.817 5.263
414 HG2 PRO 55 2HG PRO 55 1.438 0.877 4.600
415 HG3 PRO 55 3HG PRO 55 2.790 0.508 3.491
416 HD2 PRO 55 2HD PRO 55 1.463 -1.495 4.614
417 HD3 PRO 55 3HD PRO 55 3.251 -1.556 4.542
418 H ILE 56 H ILE 56 3.256 1.670 8.944
419 HA ILE 56 HA ILE 56 2.001 2.767 10.426
420 HB ILE 56 HB ILE 56 -0.122 3.284 8.340
421 HG12 ILE 56 2HG1 ILE 56 1.955 3.788 7.169
422 HG13 ILE 56 3HG1 ILE 56 1.125 5.263 7.598
423 HG21 ILE 56 1HG2 ILE 56 -0.684 4.179 10.513
424 HG22 ILE 56 2HG2 ILE 56 0.938 4.852 10.732
425 HG23 ILE 56 3HG2 ILE 56 -0.162 5.527 9.511
426 HD11 ILE 56 1HD1 ILE 56 3.518 4.114 9.109
427 HD12 ILE 56 2HD1 ILE 56 3.549 5.457 7.955
428 HD13 ILE 56 3HD1 ILE 56 2.684 5.639 9.486
429 H CYS 57 H CYS 57 1.464 -0.222 9.629
430 HA CYS 57 HA CYS 57 -0.801 -0.618 11.586
431 HB2 CYS 57 2HB CYS 57 -0.001 -2.430 9.332
432 HB3 CYS 57 3HB CYS 57 -1.431 -2.556 10.377
433 H ARG 58 H ARG 58 -0.017 -3.398 11.526
434 HA ARG 58 HA ARG 58 2.822 -3.449 12.325
435 HB2 ARG 58 2HB ARG 58 0.813 -3.348 14.342
436 HB3 ARG 58 3HB ARG 58 1.286 -5.039 14.247
437 HG2 ARG 58 2HG ARG 58 2.828 -4.271 15.772
438 HG3 ARG 58 3HG ARG 58 3.762 -4.072 14.280
439 HD2 ARG 58 2HD ARG 58 3.042 -1.679 14.189
440 HD3 ARG 58 3HD ARG 58 2.087 -1.931 15.665
441 HE ARG 58 HE ARG 58 4.832 -2.665 16.064
442 HH11 ARG 58 1HH1 ARG 58 5.643 0.338 17.748
443 HH12 ARG 58 2HH1 ARG 58 6.148 -1.277 17.418
444 HH21 ARG 58 1HH2 ARG 58 3.593 1.146 16.857
445 HH22 ARG 58 2HH2 ARG 58 2.670 0.106 15.831
446 H VAL 59 H VAL 59 -0.166 -5.328 11.756
447 HA VAL 59 HA VAL 59 0.447 -7.862 11.663
448 HB VAL 59 HB VAL 59 -1.136 -7.868 9.603
449 HG11 VAL 59 1HG1 VAL 59 -3.042 -7.205 10.999
450 HG12 VAL 59 2HG1 VAL 59 -1.873 -8.088 11.989
451 HG13 VAL 59 3HG1 VAL 59 -1.981 -6.317 12.105
452 HG21 VAL 59 1HG2 VAL 59 -0.668 -5.734 8.647
453 HG22 VAL 59 2HG2 VAL 59 -2.349 -5.801 9.216
454 HG23 VAL 59 3HG2 VAL 59 -1.168 -4.872 10.123
455 H ASP 60 H ASP 60 1.833 -9.219 10.765
456 HA ASP 60 HA ASP 60 3.884 -8.380 8.967
457 HB2 ASP 60 2HB ASP 60 3.942 -10.219 10.733
458 HB3 ASP 60 3HB ASP 60 3.005 -11.219 9.618
459 H ILE 61 H ILE 61 4.150 -8.989 6.791
460 HA ILE 61 HA ILE 61 1.680 -9.717 5.317
461 HB ILE 61 HB ILE 61 2.409 -8.301 3.524
462 HG12 ILE 61 2HG1 ILE 61 4.731 -7.451 5.324
463 HG13 ILE 61 3HG1 ILE 61 4.878 -8.469 3.878
464 HG21 ILE 61 1HG2 ILE 61 1.074 -7.445 5.578
465 HG22 ILE 61 2HG2 ILE 61 2.589 -6.647 6.046
466 HG23 ILE 61 3HG2 ILE 61 1.786 -6.230 4.506
467 HD11 ILE 61 1HD1 ILE 61 3.796 -6.687 2.546
468 HD12 ILE 61 2HD1 ILE 61 3.885 -5.614 3.968
469 HD13 ILE 61 3HD1 ILE 61 5.382 -6.219 3.240
470 H GLU 62 H GLU 62 4.984 -10.516 5.888
471 HA GLU 62 HA GLU 62 5.677 -11.745 3.426
472 HB2 GLU 62 2HB GLU 62 7.234 -11.196 5.215
473 HB3 GLU 62 3HB GLU 62 6.468 -12.386 6.286
474 HG2 GLU 62 2HG GLU 62 7.502 -13.401 3.662
475 HG3 GLU 62 3HG GLU 62 8.714 -12.820 4.806
476 H ALA 63 H ALA 63 5.412 -13.832 2.657
477 HA ALA 63 HA ALA 63 3.944 -15.790 4.257
478 HB1 ALA 63 1HB ALA 63 2.885 -14.695 1.607
479 HB2 ALA 63 2HB ALA 63 2.260 -16.131 2.450
480 HB3 ALA 63 3HB ALA 63 2.118 -14.525 3.202
481 H GLN 64 H GLN 64 5.938 -16.882 4.147
482 HA GLN 64 HA GLN 64 7.158 -18.624 3.407
483 HB2 GLN 64 2HB GLN 64 4.790 -19.231 2.515
484 HB3 GLN 64 3HB GLN 64 5.420 -18.856 0.919
485 HG2 GLN 64 2HG GLN 64 6.835 -20.819 2.770
486 HG3 GLN 64 3HG GLN 64 5.407 -21.297 1.860
487 HE21 GLN 64 1HE2 GLN 64 8.821 -21.104 1.669
488 HE22 GLN 64 2HE2 GLN 64 8.897 -21.324 -0.075
489 H LEU 65 H LEU 65 8.008 -15.955 2.907
490 HA LEU 65 HA LEU 65 9.711 -16.426 0.520
491 HB2 LEU 65 2HB LEU 65 7.670 -14.297 0.766
492 HB3 LEU 65 3HB LEU 65 9.287 -13.645 0.587
493 HG LEU 65 HG LEU 65 9.502 -15.369 -1.413
494 HD11 LEU 65 1HD1 LEU 65 6.486 -14.943 -1.241
495 HD12 LEU 65 2HD1 LEU 65 7.362 -15.630 -2.629
496 HD13 LEU 65 3HD1 LEU 65 7.332 -16.493 -1.086
497 HD21 LEU 65 1HD2 LEU 65 8.694 -13.610 -2.930
498 HD22 LEU 65 2HD2 LEU 65 7.866 -12.809 -1.574
499 HD23 LEU 65 3HD2 LEU 65 9.640 -12.925 -1.601
500 HA PRO 66 HA PRO 66 12.740 -14.936 3.415
501 HB2 PRO 66 2HB PRO 66 14.777 -14.142 1.784
502 HB3 PRO 66 3HB PRO 66 14.302 -15.864 1.928
503 HG2 PRO 66 2HG PRO 66 13.477 -13.879 -0.213
504 HG3 PRO 66 3HG PRO 66 14.111 -15.542 -0.434
505 HD2 PRO 66 2HD PRO 66 11.435 -14.947 -0.449
506 HD3 PRO 66 3HD PRO 66 12.053 -16.503 0.189
507 H SER 67 H SER 67 13.447 -12.941 4.337
508 HA SER 67 HA SER 67 12.183 -10.499 3.451
509 HB2 SER 67 2HB SER 67 14.473 -10.955 5.415
510 HB3 SER 67 3HB SER 67 13.453 -9.505 5.295
511 HG SER 67 HG SER 67 12.737 -10.898 6.943
512 H GLU 68 H GLU 68 13.683 -8.469 3.188
513 HA GLU 68 HA GLU 68 16.195 -9.002 1.818
514 HB2 GLU 68 2HB GLU 68 14.243 -9.070 0.154
515 HB3 GLU 68 3HB GLU 68 14.007 -7.349 0.475
516 HG2 GLU 68 2HG GLU 68 16.054 -6.779 -0.572
517 HG3 GLU 68 3HG GLU 68 16.751 -8.382 -0.295
518 H SER 69 H SER 69 16.811 -6.299 1.141
519 HA SER 69 HA SER 69 15.942 -4.478 3.193
520 HB2 SER 69 2HB SER 69 18.806 -5.551 3.098
521 HB3 SER 69 3HB SER 69 18.331 -4.052 3.914
522 HG SER 69 HG SER 69 16.731 -6.109 4.638
Start of MODEL 11
1 H1 MET 1 H1 MET 1 -24.483 41.669 -9.312
2 H2 MET 1 H2 MET 1 -25.460 42.550 -10.311
3 H3 MET 1 H3 MET 1 -24.015 41.966 -10.856
4 HA MET 1 HA MET 1 -23.821 44.287 -10.464
5 HB2 MET 1 2HB MET 1 -25.138 43.555 -7.898
6 HB3 MET 1 3HB MET 1 -23.778 44.680 -7.758
7 HG2 MET 1 2HG MET 1 -24.747 46.118 -9.499
8 HG3 MET 1 3HG MET 1 -26.175 45.070 -9.573
9 HE1 MET 1 1HE MET 1 -25.898 48.315 -8.979
10 HE2 MET 1 2HE MET 1 -27.464 47.501 -9.217
11 HE3 MET 1 3HE MET 1 -27.196 48.519 -7.782
12 H LYS 2 H LYS 2 -22.793 42.475 -7.488
13 HA LYS 2 HA LYS 2 -20.036 43.160 -8.213
14 HB2 LYS 2 2HB LYS 2 -21.361 43.329 -5.909
15 HB3 LYS 2 3HB LYS 2 -20.903 41.635 -5.733
16 HG2 LYS 2 2HG LYS 2 -18.571 42.200 -5.668
17 HG3 LYS 2 3HG LYS 2 -18.862 43.811 -6.373
18 HD2 LYS 2 2HD LYS 2 -20.107 44.516 -4.386
19 HD3 LYS 2 3HD LYS 2 -19.906 42.907 -3.658
20 HE2 LYS 2 2HE LYS 2 -17.452 43.229 -3.635
21 HE3 LYS 2 3HE LYS 2 -17.645 44.819 -4.395
22 HZ1 LYS 2 1HZ LYS 2 -18.894 45.522 -2.454
23 HZ2 LYS 2 2HZ LYS 2 -18.705 44.046 -1.750
24 HZ3 LYS 2 3HZ LYS 2 -17.396 45.005 -2.014
25 H GLN 3 H GLN 3 -18.363 41.308 -7.997
26 HA GLN 3 HA GLN 3 -19.457 38.971 -9.459
27 HB2 GLN 3 2HB GLN 3 -17.648 40.253 -10.530
28 HB3 GLN 3 3HB GLN 3 -16.596 39.991 -9.126
29 HG2 GLN 3 2HG GLN 3 -16.431 37.650 -9.548
30 HG3 GLN 3 3HG GLN 3 -17.833 37.655 -10.627
31 HE21 GLN 3 1HE2 GLN 3 -17.503 37.981 -12.850
32 HE22 GLN 3 2HE2 GLN 3 -15.926 38.415 -13.496
33 H ASP 4 H ASP 4 -19.572 37.009 -8.456
34 HA ASP 4 HA ASP 4 -17.740 36.201 -6.387
35 HB2 ASP 4 2HB ASP 4 -20.489 37.175 -5.725
36 HB3 ASP 4 3HB ASP 4 -20.148 35.544 -5.152
37 H GLY 5 H GLY 5 -18.207 33.793 -5.931
38 HA2 GLY 5 2HA GLY 5 -20.202 32.351 -7.267
39 HA3 GLY 5 3HA GLY 5 -18.783 32.384 -8.336
40 H GLU 6 H GLU 6 -19.936 30.023 -6.885
41 HA GLU 6 HA GLU 6 -17.511 29.124 -5.525
42 HB2 GLU 6 2HB GLU 6 -20.279 29.103 -4.228
43 HB3 GLU 6 3HB GLU 6 -18.875 28.196 -3.648
44 HG2 GLU 6 2HG GLU 6 -17.639 30.354 -3.348
45 HG3 GLU 6 3HG GLU 6 -19.119 31.229 -3.790
46 H GLU 7 H GLU 7 -17.913 26.664 -5.024
47 HA GLU 7 HA GLU 7 -19.915 25.369 -6.694
48 HB2 GLU 7 2HB GLU 7 -18.189 25.709 -8.344
49 HB3 GLU 7 3HB GLU 7 -16.960 25.007 -7.295
50 HG2 GLU 7 2HG GLU 7 -17.575 22.869 -7.814
51 HG3 GLU 7 3HG GLU 7 -19.296 23.222 -7.661
52 H GLY 8 H GLY 8 -17.076 23.622 -5.830
53 HA2 GLY 8 2HA GLY 8 -17.594 22.967 -3.126
54 HA3 GLY 8 3HA GLY 8 -18.469 21.820 -4.168
55 H THR 9 H THR 9 -17.024 20.088 -3.436
56 HA THR 9 HA THR 9 -14.522 19.984 -4.967
57 HB THR 9 HB THR 9 -13.376 18.981 -2.965
58 HG1 THR 9 1HG THR 9 -15.152 18.465 -1.703
59 HG21 THR 9 1HG2 THR 9 -14.326 21.818 -2.411
60 HG22 THR 9 2HG2 THR 9 -12.832 21.049 -1.852
61 HG23 THR 9 3HG2 THR 9 -13.055 21.394 -3.581
62 H GLU 10 H GLU 10 -13.743 17.386 -4.261
63 HA GLU 10 HA GLU 10 -16.173 15.735 -4.500
64 HB2 GLU 10 2HB GLU 10 -15.152 14.522 -6.354
65 HB3 GLU 10 3HB GLU 10 -15.326 16.230 -6.758
66 HG2 GLU 10 2HG GLU 10 -12.768 16.238 -5.743
67 HG3 GLU 10 3HG GLU 10 -12.847 14.597 -6.377
68 H GLU 11 H GLU 11 -15.869 13.637 -3.668
69 HA GLU 11 HA GLU 11 -13.916 13.453 -1.551
70 HB2 GLU 11 2HB GLU 11 -15.903 11.400 -2.663
71 HB3 GLU 11 3HB GLU 11 -14.934 11.220 -1.199
72 HG2 GLU 11 2HG GLU 11 -16.818 11.975 -0.210
73 HG3 GLU 11 3HG GLU 11 -16.072 13.536 -0.525
74 H ASP 12 H ASP 12 -12.116 12.007 -1.422
75 HA ASP 12 HA ASP 12 -11.582 10.323 -3.750
76 HB2 ASP 12 2HB ASP 12 -10.771 12.868 -4.045
77 HB3 ASP 12 3HB ASP 12 -9.397 12.300 -3.106
78 H THR 13 H THR 13 -11.899 8.833 -2.027
79 HA THR 13 HA THR 13 -9.424 8.370 -0.451
80 HB THR 13 HB THR 13 -11.653 9.657 0.602
81 HG1 THR 13 1HG THR 13 -10.497 9.189 2.599
82 HG21 THR 13 1HG2 THR 13 -11.571 6.917 1.908
83 HG22 THR 13 2HG2 THR 13 -12.568 8.312 2.354
84 HG23 THR 13 3HG2 THR 13 -12.864 7.482 0.819
85 H GLU 14 H GLU 14 -11.695 6.967 -2.397
86 HA GLU 14 HA GLU 14 -12.209 4.512 -1.133
87 HB2 GLU 14 2HB GLU 14 -12.318 5.463 -4.039
88 HB3 GLU 14 3HB GLU 14 -12.816 3.854 -3.521
89 HG2 GLU 14 2HG GLU 14 -14.823 4.925 -3.521
90 HG3 GLU 14 3HG GLU 14 -14.376 5.057 -1.828
91 H GLU 15 H GLU 15 -9.724 5.524 -3.492
92 HA GLU 15 HA GLU 15 -8.159 3.114 -2.767
93 HB2 GLU 15 2HB GLU 15 -7.510 2.965 -5.213
94 HB3 GLU 15 3HB GLU 15 -9.096 2.364 -4.739
95 HG2 GLU 15 2HG GLU 15 -10.221 4.306 -5.660
96 HG3 GLU 15 3HG GLU 15 -8.693 5.126 -5.967
97 H LYS 16 H LYS 16 -6.733 4.303 -1.481
98 HA LYS 16 HA LYS 16 -4.907 5.967 -3.062
99 HB2 LYS 16 2HB LYS 16 -4.755 7.646 -1.180
100 HB3 LYS 16 3HB LYS 16 -6.235 7.711 -2.161
101 HG2 LYS 16 2HG LYS 16 -7.553 6.716 -0.564
102 HG3 LYS 16 3HG LYS 16 -6.173 6.105 0.365
103 HD2 LYS 16 2HD LYS 16 -7.341 8.005 1.468
104 HD3 LYS 16 3HD LYS 16 -5.624 8.337 1.157
105 HE2 LYS 16 2HE LYS 16 -6.072 9.849 -0.562
106 HE3 LYS 16 3HE LYS 16 -7.633 9.114 -0.948
107 HZ1 LYS 16 1HZ LYS 16 -7.065 10.877 1.339
108 HZ2 LYS 16 2HZ LYS 16 -8.069 11.123 0.032
109 HZ3 LYS 16 3HZ LYS 16 -8.470 10.013 1.133
110 H CYS 17 H CYS 17 -2.925 6.041 -2.373
111 HA CYS 17 HA CYS 17 -1.736 3.729 -1.034
112 HB2 CYS 17 2HB CYS 17 -1.097 4.918 -3.196
113 HB3 CYS 17 3HB CYS 17 -0.582 6.262 -2.204
114 H THR 18 H THR 18 -1.716 3.771 1.258
115 HA THR 18 HA THR 18 -1.886 6.245 2.664
116 HB THR 18 HB THR 18 -2.547 3.914 3.494
117 HG1 THR 18 1HG THR 18 -1.136 5.805 5.059
118 HG21 THR 18 1HG2 THR 18 -0.939 2.733 4.834
119 HG22 THR 18 2HG2 THR 18 -0.201 2.956 3.223
120 HG23 THR 18 3HG2 THR 18 0.296 3.974 4.587
121 H ILE 19 H ILE 19 0.829 4.807 1.107
122 HA ILE 19 HA ILE 19 2.810 5.783 2.992
123 HB ILE 19 HB ILE 19 2.812 4.230 0.408
124 HG12 ILE 19 2HG1 ILE 19 3.804 3.312 3.124
125 HG13 ILE 19 3HG1 ILE 19 2.076 3.279 2.764
126 HG21 ILE 19 1HG2 ILE 19 5.273 3.879 0.881
127 HG22 ILE 19 2HG2 ILE 19 4.864 5.544 0.436
128 HG23 ILE 19 3HG2 ILE 19 5.152 5.128 2.140
129 HD11 ILE 19 1HD1 ILE 19 2.455 1.915 0.773
130 HD12 ILE 19 2HD1 ILE 19 4.201 1.904 1.100
131 HD13 ILE 19 3HD1 ILE 19 3.078 1.121 2.233
132 H CYS 20 H CYS 20 1.951 6.324 -0.500
133 HA CYS 20 HA CYS 20 3.589 8.797 -0.719
134 HB2 CYS 20 2HB CYS 20 1.290 7.902 -2.471
135 HB3 CYS 20 3HB CYS 20 2.564 9.069 -2.830
136 H LEU 21 H LEU 21 0.511 7.969 0.686
137 HA LEU 21 HA LEU 21 -1.446 8.957 0.935
138 HB2 LEU 21 2HB LEU 21 0.345 11.320 1.541
139 HB3 LEU 21 3HB LEU 21 -1.376 11.242 1.945
140 HG LEU 21 HG LEU 21 0.624 9.140 2.901
141 HD11 LEU 21 1HD1 LEU 21 0.626 10.336 5.046
142 HD12 LEU 21 2HD1 LEU 21 1.338 11.293 3.735
143 HD13 LEU 21 3HD1 LEU 21 -0.310 11.661 4.306
144 HD21 LEU 21 1HD2 LEU 21 -1.769 8.468 2.972
145 HD22 LEU 21 2HD2 LEU 21 -1.104 8.675 4.590
146 HD23 LEU 21 3HD2 LEU 21 -2.152 9.935 3.900
147 H SER 22 H SER 22 -1.069 8.529 -1.579
148 HA SER 22 HA SER 22 -2.245 10.881 -2.971
149 HB2 SER 22 2HB SER 22 0.100 10.752 -3.711
150 HB3 SER 22 3HB SER 22 -0.082 9.019 -4.055
151 HG SER 22 HG SER 22 -1.568 9.528 -5.698
152 H ILE 23 H ILE 23 -3.980 10.279 -4.311
153 HA ILE 23 HA ILE 23 -5.260 7.804 -4.017
154 HB ILE 23 HB ILE 23 -5.368 10.198 -5.902
155 HG12 ILE 23 2HG1 ILE 23 -7.212 10.896 -4.690
156 HG13 ILE 23 3HG1 ILE 23 -7.404 9.347 -3.842
157 HG21 ILE 23 1HG2 ILE 23 -6.350 8.486 -7.223
158 HG22 ILE 23 2HG2 ILE 23 -7.242 7.797 -5.855
159 HG23 ILE 23 3HG2 ILE 23 -7.677 9.385 -6.519
160 HD11 ILE 23 1HD1 ILE 23 -6.709 11.160 -2.375
161 HD12 ILE 23 2HD1 ILE 23 -5.471 9.899 -2.458
162 HD13 ILE 23 3HD1 ILE 23 -5.261 11.438 -3.353
163 H LEU 24 H LEU 24 -5.614 6.321 -5.713
164 HA LEU 24 HA LEU 24 -3.349 5.716 -7.527
165 HB2 LEU 24 2HB LEU 24 -5.671 4.043 -6.428
166 HB3 LEU 24 3HB LEU 24 -4.300 3.405 -7.349
167 HG LEU 24 HG LEU 24 -4.041 4.777 -4.634
168 HD11 LEU 24 1HD1 LEU 24 -5.188 2.664 -4.447
169 HD12 LEU 24 2HD1 LEU 24 -3.903 1.853 -5.373
170 HD13 LEU 24 3HD1 LEU 24 -3.547 2.571 -3.772
171 HD21 LEU 24 1HD2 LEU 24 -1.720 3.683 -4.890
172 HD22 LEU 24 2HD2 LEU 24 -2.117 3.547 -6.612
173 HD23 LEU 24 3HD2 LEU 24 -2.084 5.151 -5.837
174 H GLU 25 H GLU 25 -5.091 3.881 -9.094
175 HA GLU 25 HA GLU 25 -7.386 5.252 -9.907
176 HB2 GLU 25 2HB GLU 25 -6.858 5.629 -12.262
177 HB3 GLU 25 3HB GLU 25 -5.783 6.575 -11.231
178 HG2 GLU 25 2HG GLU 25 -3.964 4.971 -11.580
179 HG3 GLU 25 3HG GLU 25 -5.030 3.938 -12.553
180 H GLU 26 H GLU 26 -8.329 3.921 -11.920
181 HA GLU 26 HA GLU 26 -8.413 1.203 -11.126
182 HB2 GLU 26 2HB GLU 26 -10.248 2.501 -12.285
183 HB3 GLU 26 3HB GLU 26 -9.307 2.415 -13.781
184 HG2 GLU 26 2HG GLU 26 -9.328 -0.144 -13.483
185 HG3 GLU 26 3HG GLU 26 -10.493 0.105 -12.183
186 H GLY 27 H GLY 27 -6.817 -0.283 -11.442
187 HA2 GLY 27 2HA GLY 27 -5.605 -1.765 -12.781
188 HA3 GLY 27 3HA GLY 27 -5.879 -0.721 -14.179
189 H GLU 28 H GLU 28 -4.590 0.843 -11.340
190 HA GLU 28 HA GLU 28 -2.126 1.589 -12.562
191 HB2 GLU 28 2HB GLU 28 -3.279 2.930 -10.931
192 HB3 GLU 28 3HB GLU 28 -3.289 1.615 -9.766
193 HG2 GLU 28 2HG GLU 28 -1.811 3.255 -8.981
194 HG3 GLU 28 3HG GLU 28 -0.836 1.878 -9.459
195 H ASP 29 H ASP 29 -0.022 1.147 -11.681
196 HA ASP 29 HA ASP 29 0.506 -1.708 -11.219
197 HB2 ASP 29 2HB ASP 29 2.365 0.685 -11.156
198 HB3 ASP 29 3HB ASP 29 2.850 -0.973 -10.922
199 H VAL 30 H VAL 30 -0.301 -2.334 -9.282
200 HA VAL 30 HA VAL 30 0.749 -1.051 -6.834
201 HB VAL 30 HB VAL 30 -1.405 -1.044 -5.770
202 HG11 VAL 30 1HG1 VAL 30 -2.541 0.696 -6.947
203 HG12 VAL 30 2HG1 VAL 30 -0.819 0.909 -7.297
204 HG13 VAL 30 3HG1 VAL 30 -1.892 0.157 -8.497
205 HG21 VAL 30 1HG2 VAL 30 -2.518 -2.974 -6.677
206 HG22 VAL 30 2HG2 VAL 30 -3.491 -1.565 -7.127
207 HG23 VAL 30 3HG2 VAL 30 -2.446 -2.318 -8.333
208 H ARG 31 H ARG 31 -0.013 -2.571 -4.906
209 HA ARG 31 HA ARG 31 0.192 -5.377 -5.692
210 HB2 ARG 31 2HB ARG 31 2.300 -3.723 -4.421
211 HB3 ARG 31 3HB ARG 31 1.919 -5.131 -3.444
212 HG2 ARG 31 2HG ARG 31 2.453 -5.417 -6.418
213 HG3 ARG 31 3HG ARG 31 3.783 -5.237 -5.274
214 HD2 ARG 31 2HD ARG 31 1.998 -7.235 -4.218
215 HD3 ARG 31 3HD ARG 31 2.261 -7.585 -5.937
216 HE ARG 31 HE ARG 31 4.721 -6.948 -4.575
217 HH11 ARG 31 1HH1 ARG 31 5.793 -10.283 -4.298
218 HH12 ARG 31 2HH1 ARG 31 6.266 -8.627 -4.217
219 HH21 ARG 31 1HH2 ARG 31 3.535 -10.838 -4.810
220 HH22 ARG 31 2HH2 ARG 31 2.404 -9.557 -5.068
221 H ARG 32 H ARG 32 -0.139 -6.694 -3.491
222 HA ARG 32 HA ARG 32 -2.066 -5.226 -1.811
223 HB2 ARG 32 2HB ARG 32 -3.067 -6.565 -3.830
224 HB3 ARG 32 3HB ARG 32 -2.681 -8.009 -2.894
225 HG2 ARG 32 2HG ARG 32 -4.313 -5.676 -1.794
226 HG3 ARG 32 3HG ARG 32 -5.050 -6.973 -2.719
227 HD2 ARG 32 2HD ARG 32 -3.391 -8.050 -0.542
228 HD3 ARG 32 3HD ARG 32 -4.586 -6.909 0.051
229 HE ARG 32 HE ARG 32 -5.674 -8.819 -1.847
230 HH11 ARG 32 1HH1 ARG 32 -7.343 -10.651 0.648
231 HH12 ARG 32 2HH1 ARG 32 -7.226 -10.352 -1.049
232 HH21 ARG 32 1HH2 ARG 32 -5.914 -9.504 2.168
233 HH22 ARG 32 2HH2 ARG 32 -4.703 -8.460 1.509
234 H LEU 33 H LEU 33 -2.196 -6.083 0.298
235 HA LEU 33 HA LEU 33 -0.154 -8.032 1.122
236 HB2 LEU 33 2HB LEU 33 -0.270 -6.198 3.178
237 HB3 LEU 33 3HB LEU 33 1.002 -6.242 1.968
238 HG LEU 33 HG LEU 33 -1.512 -4.635 1.469
239 HD11 LEU 33 1HD1 LEU 33 -0.820 -4.033 3.717
240 HD12 LEU 33 2HD1 LEU 33 0.840 -3.721 3.171
241 HD13 LEU 33 3HD1 LEU 33 -0.514 -2.717 2.591
242 HD21 LEU 33 1HD2 LEU 33 0.325 -4.834 -0.317
243 HD22 LEU 33 2HD2 LEU 33 0.078 -3.180 0.252
244 HD23 LEU 33 3HD2 LEU 33 1.450 -4.151 0.855
245 HA PRO 34 HA PRO 34 -3.335 -9.888 3.269
246 HB2 PRO 34 2HB PRO 34 -2.446 -10.365 5.862
247 HB3 PRO 34 3HB PRO 34 -1.979 -11.285 4.400
248 HG2 PRO 34 2HG PRO 34 -0.479 -9.097 5.803
249 HG3 PRO 34 3HG PRO 34 0.152 -10.591 5.031
250 HD2 PRO 34 2HD PRO 34 0.211 -8.069 3.907
251 HD3 PRO 34 3HD PRO 34 0.212 -9.524 2.922
252 H CYS 35 H CYS 35 -2.159 -7.001 4.893
253 HA CYS 35 HA CYS 35 -4.361 -6.278 6.603
254 HB2 CYS 35 2HB CYS 35 -1.970 -5.413 6.450
255 HB3 CYS 35 3HB CYS 35 -2.512 -4.518 5.019
256 H MET 36 H MET 36 -4.804 -6.971 3.384
257 HA MET 36 HA MET 36 -6.240 -6.312 1.754
258 HB2 MET 36 2HB MET 36 -7.793 -5.385 4.210
259 HB3 MET 36 3HB MET 36 -8.489 -5.535 2.600
260 HG2 MET 36 2HG MET 36 -7.188 -7.901 3.988
261 HG3 MET 36 3HG MET 36 -8.861 -7.431 4.261
262 HE1 MET 36 1HE MET 36 -10.010 -10.272 2.122
263 HE2 MET 36 2HE MET 36 -8.842 -10.284 3.467
264 HE3 MET 36 3HE MET 36 -10.275 -9.232 3.535
265 H HIS 37 H HIS 37 -4.123 -4.469 2.270
266 HA HIS 37 HA HIS 37 -5.412 -1.845 1.713
267 HB2 HIS 37 1HB HIS 37 -3.378 -2.765 3.701
268 HB3 HIS 37 2HB HIS 37 -2.956 -1.305 2.862
269 HD2 HIS 37 2HD HIS 37 -6.245 -0.375 2.835
270 HE1 HIS 37 1HE HIS 37 -5.447 0.380 6.926
271 HE2 HIS 37 2HE HIS 37 -7.040 0.827 4.978
272 H LEU 38 H LEU 38 -5.297 -1.972 -0.530
273 HA LEU 38 HA LEU 38 -2.891 -2.867 -1.854
274 HB2 LEU 38 2HB LEU 38 -3.802 -2.244 -3.905
275 HB3 LEU 38 3HB LEU 38 -5.107 -2.975 -3.000
276 HG LEU 38 HG LEU 38 -4.854 0.074 -3.177
277 HD11 LEU 38 1HD1 LEU 38 -4.676 -0.663 -5.438
278 HD12 LEU 38 2HD1 LEU 38 -6.065 -1.762 -5.249
279 HD13 LEU 38 3HD1 LEU 38 -6.282 0.003 -5.162
280 HD21 LEU 38 1HD2 LEU 38 -6.545 -0.770 -1.607
281 HD22 LEU 38 2HD2 LEU 38 -7.317 -0.057 -3.022
282 HD23 LEU 38 3HD2 LEU 38 -7.220 -1.821 -2.882
283 H PHE 39 H PHE 39 -1.119 -1.724 -2.579
284 HA PHE 39 HA PHE 39 -1.084 1.232 -2.333
285 HB2 PHE 39 2HB PHE 39 0.767 -0.725 -0.932
286 HB3 PHE 39 3HB PHE 39 1.102 0.995 -1.077
287 HD1 PHE 39 1HD PHE 39 -1.910 1.813 -0.402
288 HD2 PHE 39 2HD PHE 39 0.926 -0.806 1.481
289 HE1 PHE 39 1HE PHE 39 -3.093 2.098 1.729
290 HE2 PHE 39 2HE PHE 39 -0.223 -0.459 3.647
291 HZ PHE 39 HZ PHE 39 -2.233 0.978 3.783
292 H HIS 40 H HIS 40 0.731 2.157 -3.601
293 HA HIS 40 HA HIS 40 1.008 0.979 -6.127
294 HB2 HIS 40 1HB HIS 40 2.854 2.924 -4.723
295 HB3 HIS 40 2HB HIS 40 3.087 2.447 -6.390
296 HD2 HIS 40 2HD HIS 40 0.957 3.002 -8.143
297 HE1 HIS 40 1HE HIS 40 0.280 6.693 -6.133
298 HE2 HIS 40 2HE HIS 40 -0.069 5.339 -8.342
299 H GLN 41 H GLN 41 2.683 -0.018 -7.267
300 HA GLN 41 HA GLN 41 4.367 -1.888 -5.861
301 HB2 GLN 41 2HB GLN 41 3.359 -1.400 -8.545
302 HB3 GLN 41 3HB GLN 41 5.080 -1.663 -8.644
303 HG2 GLN 41 2HG GLN 41 4.790 -3.730 -7.209
304 HG3 GLN 41 3HG GLN 41 3.044 -3.427 -7.226
305 HE21 GLN 41 1HE2 GLN 41 1.820 -4.133 -9.061
306 HE22 GLN 41 2HE2 GLN 41 2.614 -4.839 -10.463
307 H VAL 42 H VAL 42 4.912 1.115 -5.561
308 HA VAL 42 HA VAL 42 7.861 0.890 -5.848
309 HB VAL 42 HB VAL 42 6.186 3.362 -6.481
310 HG11 VAL 42 1HG1 VAL 42 9.213 2.996 -6.364
311 HG12 VAL 42 2HG1 VAL 42 8.376 4.425 -7.013
312 HG13 VAL 42 3HG1 VAL 42 8.235 4.029 -5.296
313 HG21 VAL 42 1HG2 VAL 42 7.999 1.616 -8.205
314 HG22 VAL 42 2HG2 VAL 42 6.236 1.774 -8.352
315 HG23 VAL 42 3HG2 VAL 42 7.275 3.156 -8.722
316 H CYS 43 H CYS 43 5.326 3.057 -4.445
317 HA CYS 43 HA CYS 43 6.452 3.756 -1.995
318 HB2 CYS 43 2HB CYS 43 3.579 2.860 -2.420
319 HB3 CYS 43 3HB CYS 43 4.211 4.009 -1.249
320 H VAL 44 H VAL 44 4.434 0.826 -2.624
321 HA VAL 44 HA VAL 44 4.917 -0.093 0.049
322 HB VAL 44 HB VAL 44 2.871 -0.435 -1.545
323 HG11 VAL 44 1HG1 VAL 44 4.279 -3.103 -1.902
324 HG12 VAL 44 2HG1 VAL 44 2.702 -2.579 -2.542
325 HG13 VAL 44 3HG1 VAL 44 4.210 -1.887 -3.186
326 HG21 VAL 44 1HG2 VAL 44 3.094 -1.055 0.840
327 HG22 VAL 44 2HG2 VAL 44 2.249 -2.317 -0.086
328 HG23 VAL 44 3HG2 VAL 44 3.953 -2.535 0.370
329 H ASP 45 H ASP 45 6.541 -0.508 -2.941
330 HA ASP 45 HA ASP 45 7.778 -3.056 -2.441
331 HB2 ASP 45 2HB ASP 45 7.703 -1.845 -4.656
332 HB3 ASP 45 3HB ASP 45 8.934 -0.731 -4.042
333 H GLN 46 H GLN 46 8.993 0.318 -2.038
334 HA GLN 46 HA GLN 46 11.170 -0.566 -0.369
335 HB2 GLN 46 2HB GLN 46 9.957 2.198 -0.783
336 HB3 GLN 46 3HB GLN 46 11.373 1.874 0.238
337 HG2 GLN 46 2HG GLN 46 12.529 0.831 -1.716
338 HG3 GLN 46 3HG GLN 46 11.152 1.270 -2.742
339 HE21 GLN 46 1HE2 GLN 46 12.810 2.495 -4.029
340 HE22 GLN 46 2HE2 GLN 46 13.275 4.085 -3.430
341 H ALA 47 H ALA 47 7.805 0.163 0.398
342 HA ALA 47 HA ALA 47 8.228 0.454 3.207
343 HB1 ALA 47 1HB ALA 47 5.865 -0.837 1.814
344 HB2 ALA 47 2HB ALA 47 5.885 -0.099 3.429
345 HB3 ALA 47 3HB ALA 47 6.116 0.921 1.985
346 H LEU 48 H LEU 48 7.430 -2.503 1.302
347 HA LEU 48 HA LEU 48 7.464 -4.346 3.406
348 HB2 LEU 48 2HB LEU 48 6.546 -4.670 1.134
349 HB3 LEU 48 3HB LEU 48 8.166 -4.732 0.453
350 HG LEU 48 HG LEU 48 7.169 -6.706 2.564
351 HD11 LEU 48 1HD1 LEU 48 6.680 -8.231 0.698
352 HD12 LEU 48 2HD1 LEU 48 5.711 -6.758 0.559
353 HD13 LEU 48 3HD1 LEU 48 7.144 -6.970 -0.470
354 HD21 LEU 48 1HD2 LEU 48 8.911 -8.192 1.448
355 HD22 LEU 48 2HD2 LEU 48 9.519 -6.743 0.623
356 HD23 LEU 48 3HD2 LEU 48 9.568 -6.875 2.400
357 H ILE 49 H ILE 49 10.144 -3.499 1.103
358 HA ILE 49 HA ILE 49 12.006 -5.182 2.464
359 HB ILE 49 HB ILE 49 13.717 -4.169 1.159
360 HG12 ILE 49 2HG1 ILE 49 12.757 -2.151 -0.395
361 HG13 ILE 49 3HG1 ILE 49 11.959 -1.827 1.154
362 HG21 ILE 49 1HG2 ILE 49 12.875 -4.490 -1.073
363 HG22 ILE 49 2HG2 ILE 49 12.085 -5.654 0.006
364 HG23 ILE 49 3HG2 ILE 49 11.209 -4.218 -0.559
365 HD11 ILE 49 1HD1 ILE 49 14.244 -1.971 2.260
366 HD12 ILE 49 2HD1 ILE 49 14.937 -2.043 0.629
367 HD13 ILE 49 3HD1 ILE 49 14.022 -0.611 1.146
368 H THR 50 H THR 50 10.947 -1.849 3.159
369 HA THR 50 HA THR 50 13.105 -1.243 4.938
370 HB THR 50 HB THR 50 10.313 -0.163 4.515
371 HG1 THR 50 1HG THR 50 11.849 0.572 3.175
372 HG21 THR 50 1HG2 THR 50 10.488 0.046 6.911
373 HG22 THR 50 2HG2 THR 50 12.161 0.654 6.777
374 HG23 THR 50 3HG2 THR 50 10.794 1.619 6.169
375 H ASN 51 H ASN 51 9.897 -2.810 5.361
376 HA ASN 51 HA ASN 51 10.919 -4.546 7.297
377 HB2 ASN 51 2HB ASN 51 9.999 -2.047 8.452
378 HB3 ASN 51 3HB ASN 51 8.813 -3.292 8.835
379 HD21 ASN 51 1HD2 ASN 51 11.889 -2.041 9.680
380 HD22 ASN 51 2HD2 ASN 51 12.283 -3.307 10.833
381 H LYS 52 H LYS 52 9.655 -6.314 7.052
382 HA LYS 52 HA LYS 52 7.200 -6.359 5.571
383 HB2 LYS 52 2HB LYS 52 7.080 -8.676 6.474
384 HB3 LYS 52 3HB LYS 52 8.528 -8.285 5.558
385 HG2 LYS 52 2HG LYS 52 9.904 -8.780 7.287
386 HG3 LYS 52 3HG LYS 52 8.984 -7.765 8.424
387 HD2 LYS 52 2HD LYS 52 7.277 -9.495 8.553
388 HD3 LYS 52 3HD LYS 52 8.261 -10.574 7.562
389 HE2 LYS 52 2HE LYS 52 8.877 -11.354 9.587
390 HE3 LYS 52 3HE LYS 52 10.063 -10.036 9.476
391 HZ1 LYS 52 1HZ LYS 52 8.407 -8.670 10.684
392 HZ2 LYS 52 2HZ LYS 52 7.415 -9.976 10.773
393 HZ3 LYS 52 3HZ LYS 52 8.852 -10.002 11.578
394 H LYS 53 H LYS 53 5.993 -4.605 6.616
395 HA LYS 53 HA LYS 53 4.019 -5.799 8.351
396 HB2 LYS 53 2HB LYS 53 4.097 -4.076 10.093
397 HB3 LYS 53 3HB LYS 53 5.631 -4.946 10.027
398 HG2 LYS 53 2HG LYS 53 6.486 -3.010 8.531
399 HG3 LYS 53 3HG LYS 53 5.023 -2.139 9.014
400 HD2 LYS 53 2HD LYS 53 5.684 -2.398 11.402
401 HD3 LYS 53 3HD LYS 53 7.166 -3.239 10.880
402 HE2 LYS 53 2HE LYS 53 7.775 -1.226 9.510
403 HE3 LYS 53 3HE LYS 53 6.346 -0.394 10.135
404 HZ1 LYS 53 1HZ LYS 53 7.279 -0.602 12.353
405 HZ2 LYS 53 2HZ LYS 53 8.612 -1.368 11.761
406 HZ3 LYS 53 3HZ LYS 53 8.317 0.199 11.362
407 H CYS 54 H CYS 54 1.974 -4.726 7.966
408 HA CYS 54 HA CYS 54 1.863 -2.841 5.694
409 HB2 CYS 54 2HB CYS 54 0.132 -4.477 5.933
410 HB3 CYS 54 3HB CYS 54 -0.258 -3.942 7.557
411 HA PRO 55 HA PRO 55 2.248 0.651 8.579
412 HB2 PRO 55 2HB PRO 55 1.918 2.682 6.778
413 HB3 PRO 55 3HB PRO 55 3.439 1.741 6.890
414 HG2 PRO 55 2HG PRO 55 1.143 1.344 4.954
415 HG3 PRO 55 3HG PRO 55 2.898 1.421 4.595
416 HD2 PRO 55 2HD PRO 55 1.542 -0.929 4.887
417 HD3 PRO 55 3HD PRO 55 3.248 -0.763 5.407
418 H ILE 56 H ILE 56 0.626 1.525 9.726
419 HA ILE 56 HA ILE 56 -1.389 1.532 10.639
420 HB ILE 56 HB ILE 56 -2.379 2.596 7.981
421 HG12 ILE 56 2HG1 ILE 56 -2.216 4.731 9.637
422 HG13 ILE 56 3HG1 ILE 56 -0.942 3.782 10.381
423 HG21 ILE 56 1HG2 ILE 56 -4.198 1.809 9.500
424 HG22 ILE 56 2HG2 ILE 56 -3.496 2.767 10.825
425 HG23 ILE 56 3HG2 ILE 56 -4.164 3.572 9.392
426 HD11 ILE 56 1HD1 ILE 56 0.259 3.742 8.179
427 HD12 ILE 56 2HD1 ILE 56 -1.080 4.665 7.463
428 HD13 ILE 56 3HD1 ILE 56 -0.073 5.387 8.731
429 H CYS 57 H CYS 57 -1.590 -0.357 11.236
430 HA CYS 57 HA CYS 57 -3.411 -2.379 10.894
431 HB2 CYS 57 2HB CYS 57 -1.093 -2.671 8.991
432 HB3 CYS 57 3HB CYS 57 -1.833 -4.084 9.773
433 H ARG 58 H ARG 58 0.152 -2.375 10.720
434 HA ARG 58 HA ARG 58 1.761 -3.264 12.057
435 HB2 ARG 58 2HB ARG 58 0.595 -1.936 13.959
436 HB3 ARG 58 3HB ARG 58 -0.138 -3.480 14.412
437 HG2 ARG 58 2HG ARG 58 2.294 -4.426 14.413
438 HG3 ARG 58 3HG ARG 58 2.798 -2.727 14.346
439 HD2 ARG 58 2HD ARG 58 1.287 -2.354 16.387
440 HD3 ARG 58 3HD ARG 58 1.146 -4.123 16.487
441 HE ARG 58 HE ARG 58 3.880 -3.518 16.336
442 HH11 ARG 58 1HH1 ARG 58 4.531 -2.967 19.762
443 HH12 ARG 58 2HH1 ARG 58 5.240 -3.227 18.212
444 HH21 ARG 58 1HH2 ARG 58 2.167 -2.859 19.980
445 HH22 ARG 58 2HH2 ARG 58 1.195 -3.066 18.566
446 H VAL 59 H VAL 59 0.708 -4.872 10.262
447 HA VAL 59 HA VAL 59 0.510 -7.468 11.669
448 HB VAL 59 HB VAL 59 -1.171 -6.632 9.262
449 HG11 VAL 59 1HG1 VAL 59 -0.639 -8.970 9.047
450 HG12 VAL 59 2HG1 VAL 59 -0.890 -9.260 10.785
451 HG13 VAL 59 3HG1 VAL 59 -2.266 -8.897 9.727
452 HG21 VAL 59 1HG2 VAL 59 -3.105 -6.953 10.777
453 HG22 VAL 59 2HG2 VAL 59 -2.000 -7.296 12.130
454 HG23 VAL 59 3HG2 VAL 59 -2.055 -5.683 11.403
455 H ASP 60 H ASP 60 1.555 -9.134 10.520
456 HA ASP 60 HA ASP 60 3.861 -8.239 9.015
457 HB2 ASP 60 2HB ASP 60 3.625 -10.178 10.722
458 HB3 ASP 60 3HB ASP 60 2.935 -11.109 9.390
459 H ILE 61 H ILE 61 4.306 -8.748 6.829
460 HA ILE 61 HA ILE 61 1.980 -9.566 5.167
461 HB ILE 61 HB ILE 61 2.595 -7.917 3.564
462 HG12 ILE 61 2HG1 ILE 61 4.677 -6.793 5.485
463 HG13 ILE 61 3HG1 ILE 61 5.123 -7.928 4.203
464 HG21 ILE 61 1HG2 ILE 61 1.721 -6.019 4.676
465 HG22 ILE 61 2HG2 ILE 61 1.160 -7.364 5.685
466 HG23 ILE 61 3HG2 ILE 61 2.564 -6.434 6.197
467 HD11 ILE 61 1HD1 ILE 61 4.094 -6.552 2.529
468 HD12 ILE 61 2HD1 ILE 61 3.647 -5.335 3.751
469 HD13 ILE 61 3HD1 ILE 61 5.367 -5.651 3.417
470 H GLU 62 H GLU 62 5.173 -10.231 5.926
471 HA GLU 62 HA GLU 62 6.221 -11.156 3.427
472 HB2 GLU 62 2HB GLU 62 7.401 -10.727 5.608
473 HB3 GLU 62 3HB GLU 62 6.736 -12.249 6.220
474 HG2 GLU 62 2HG GLU 62 7.989 -13.395 4.307
475 HG3 GLU 62 3HG GLU 62 8.706 -11.823 3.933
476 H ALA 63 H ALA 63 6.554 -13.568 2.940
477 HA ALA 63 HA ALA 63 4.196 -15.203 3.675
478 HB1 ALA 63 1HB ALA 63 3.778 -14.228 1.435
479 HB2 ALA 63 2HB ALA 63 5.358 -14.824 0.875
480 HB3 ALA 63 3HB ALA 63 4.078 -15.976 1.318
481 H GLN 64 H GLN 64 4.731 -17.582 3.188
482 HA GLN 64 HA GLN 64 7.154 -18.249 4.511
483 HB2 GLN 64 2HB GLN 64 5.139 -19.852 2.901
484 HB3 GLN 64 3HB GLN 64 6.613 -20.597 3.534
485 HG2 GLN 64 2HG GLN 64 6.012 -19.829 5.826
486 HG3 GLN 64 3HG GLN 64 4.463 -19.238 5.198
487 HE21 GLN 64 1HE2 GLN 64 5.682 -21.790 6.908
488 HE22 GLN 64 2HE2 GLN 64 4.644 -23.053 6.262
489 H LEU 65 H LEU 65 8.932 -17.265 3.474
490 HA LEU 65 HA LEU 65 10.020 -18.922 1.308
491 HB2 LEU 65 2HB LEU 65 8.770 -17.060 0.246
492 HB3 LEU 65 3HB LEU 65 9.735 -15.882 1.130
493 HG LEU 65 HG LEU 65 11.195 -17.955 -0.508
494 HD11 LEU 65 1HD1 LEU 65 9.731 -15.576 -1.722
495 HD12 LEU 65 2HD1 LEU 65 10.892 -16.629 -2.568
496 HD13 LEU 65 3HD1 LEU 65 9.356 -17.295 -1.993
497 HD21 LEU 65 1HD2 LEU 65 12.497 -16.258 0.721
498 HD22 LEU 65 2HD2 LEU 65 12.657 -15.997 -1.016
499 HD23 LEU 65 3HD2 LEU 65 11.580 -14.956 -0.060
500 HA PRO 66 HA PRO 66 13.122 -18.134 4.479
501 HB2 PRO 66 2HB PRO 66 15.181 -19.675 3.502
502 HB3 PRO 66 3HB PRO 66 13.734 -20.355 4.307
503 HG2 PRO 66 2HG PRO 66 14.256 -20.084 1.334
504 HG3 PRO 66 3HG PRO 66 13.635 -21.509 2.227
505 HD2 PRO 66 2HD PRO 66 11.987 -19.773 0.916
506 HD3 PRO 66 3HD PRO 66 11.493 -20.541 2.459
507 H SER 67 H SER 67 14.135 -16.188 4.528
508 HA SER 67 HA SER 67 16.095 -15.500 2.478
509 HB2 SER 67 2HB SER 67 14.062 -14.728 1.382
510 HB3 SER 67 3HB SER 67 13.574 -13.821 2.826
511 HG SER 67 HG SER 67 16.107 -13.263 1.814
512 H GLU 68 H GLU 68 14.148 -14.147 5.219
513 HA GLU 68 HA GLU 68 14.760 -12.959 7.050
514 HB2 GLU 68 2HB GLU 68 17.078 -14.913 6.868
515 HB3 GLU 68 3HB GLU 68 16.713 -13.922 8.291
516 HG2 GLU 68 2HG GLU 68 14.582 -14.975 8.614
517 HG3 GLU 68 3HG GLU 68 14.656 -15.794 7.051
518 H SER 69 H SER 69 15.042 -11.160 5.234
519 HA SER 69 HA SER 69 17.336 -9.650 6.055
520 HB2 SER 69 2HB SER 69 18.246 -11.002 4.122
521 HB3 SER 69 3HB SER 69 16.973 -10.299 3.098
522 HG SER 69 HG SER 69 17.836 -8.221 3.864
Start of MODEL 12
1 H1 MET 1 H1 MET 1 -25.525 46.297 -5.035
2 H2 MET 1 H2 MET 1 -26.078 46.653 -6.556
3 H3 MET 1 H3 MET 1 -27.069 45.948 -5.428
4 HA MET 1 HA MET 1 -26.382 44.324 -7.024
5 HB2 MET 1 2HB MET 1 -23.674 45.409 -6.273
6 HB3 MET 1 3HB MET 1 -23.800 43.683 -6.570
7 HG2 MET 1 2HG MET 1 -25.227 44.522 -8.692
8 HG3 MET 1 3HG MET 1 -24.205 45.943 -8.472
9 HE1 MET 1 1HE MET 1 -22.858 41.653 -9.608
10 HE2 MET 1 2HE MET 1 -23.582 41.980 -8.024
11 HE3 MET 1 3HE MET 1 -24.534 42.229 -9.509
12 H LYS 2 H LYS 2 -25.029 42.150 -6.093
13 HA LYS 2 HA LYS 2 -25.580 41.847 -3.246
14 HB2 LYS 2 2HB LYS 2 -26.787 39.745 -3.611
15 HB3 LYS 2 3HB LYS 2 -27.648 41.083 -4.384
16 HG2 LYS 2 2HG LYS 2 -26.366 40.391 -6.548
17 HG3 LYS 2 3HG LYS 2 -26.008 38.883 -5.710
18 HD2 LYS 2 2HD LYS 2 -28.844 39.955 -6.123
19 HD3 LYS 2 3HD LYS 2 -27.998 38.959 -7.296
20 HE2 LYS 2 2HE LYS 2 -29.328 37.443 -6.146
21 HE3 LYS 2 3HE LYS 2 -27.697 37.181 -5.519
22 HZ1 LYS 2 1HZ LYS 2 -28.312 38.423 -3.565
23 HZ2 LYS 2 2HZ LYS 2 -29.807 38.766 -4.181
24 HZ3 LYS 2 3HZ LYS 2 -29.397 37.220 -3.805
25 H GLN 3 H GLN 3 -24.660 39.416 -2.792
26 HA GLN 3 HA GLN 3 -22.240 38.981 -4.430
27 HB2 GLN 3 2HB GLN 3 -20.951 38.515 -2.409
28 HB3 GLN 3 3HB GLN 3 -21.551 40.176 -2.377
29 HG2 GLN 3 2HG GLN 3 -23.390 39.487 -0.846
30 HG3 GLN 3 3HG GLN 3 -22.810 37.813 -0.901
31 HE21 GLN 3 1HE2 GLN 3 -22.581 37.917 1.478
32 HE22 GLN 3 2HE2 GLN 3 -21.173 38.751 2.121
33 H ASP 4 H ASP 4 -21.386 36.622 -3.579
34 HA ASP 4 HA ASP 4 -23.582 34.858 -2.905
35 HB2 ASP 4 2HB ASP 4 -23.304 35.345 -5.587
36 HB3 ASP 4 3HB ASP 4 -22.122 34.046 -5.396
37 H GLY 5 H GLY 5 -22.430 32.442 -3.031
38 HA2 GLY 5 2HA GLY 5 -19.553 32.596 -2.491
39 HA3 GLY 5 3HA GLY 5 -20.571 32.190 -1.093
40 H GLU 6 H GLU 6 -18.585 30.485 -2.593
41 HA GLU 6 HA GLU 6 -20.412 28.248 -3.258
42 HB2 GLU 6 2HB GLU 6 -18.073 29.351 -4.808
43 HB3 GLU 6 3HB GLU 6 -18.224 27.593 -4.682
44 HG2 GLU 6 2HG GLU 6 -20.564 27.725 -5.503
45 HG3 GLU 6 3HG GLU 6 -20.363 29.466 -5.763
46 H GLU 7 H GLU 7 -19.549 26.177 -2.622
47 HA GLU 7 HA GLU 7 -17.102 26.003 -1.151
48 HB2 GLU 7 2HB GLU 7 -18.705 26.767 0.617
49 HB3 GLU 7 3HB GLU 7 -19.800 25.451 0.183
50 HG2 GLU 7 2HG GLU 7 -18.681 24.035 1.531
51 HG3 GLU 7 3HG GLU 7 -17.202 24.282 0.609
52 H GLY 8 H GLY 8 -16.411 23.949 -1.650
53 HA2 GLY 8 2HA GLY 8 -18.317 21.910 -2.633
54 HA3 GLY 8 3HA GLY 8 -16.982 22.411 -3.700
55 H THR 9 H THR 9 -17.197 19.729 -2.731
56 HA THR 9 HA THR 9 -14.677 19.531 -1.339
57 HB THR 9 HB THR 9 -16.311 19.819 0.510
58 HG1 THR 9 1HG THR 9 -14.635 18.706 1.163
59 HG21 THR 9 1HG2 THR 9 -17.393 17.155 -0.465
60 HG22 THR 9 2HG2 THR 9 -17.880 18.026 1.006
61 HG23 THR 9 3HG2 THR 9 -18.235 18.718 -0.595
62 H GLU 10 H GLU 10 -14.231 17.003 -1.110
63 HA GLU 10 HA GLU 10 -15.446 15.453 -3.246
64 HB2 GLU 10 2HB GLU 10 -13.675 16.957 -4.323
65 HB3 GLU 10 3HB GLU 10 -12.464 16.104 -3.354
66 HG2 GLU 10 2HG GLU 10 -13.111 13.965 -4.418
67 HG3 GLU 10 3HG GLU 10 -14.403 14.781 -5.308
68 H GLU 11 H GLU 11 -14.845 13.131 -2.893
69 HA GLU 11 HA GLU 11 -13.499 12.665 -0.298
70 HB2 GLU 11 2HB GLU 11 -15.900 13.039 0.111
71 HB3 GLU 11 3HB GLU 11 -16.320 11.764 -1.041
72 HG2 GLU 11 2HG GLU 11 -15.386 10.056 0.349
73 HG3 GLU 11 3HG GLU 11 -14.475 11.226 1.313
74 H ASP 12 H ASP 12 -11.946 11.194 -0.755
75 HA ASP 12 HA ASP 12 -12.641 8.714 -2.100
76 HB2 ASP 12 2HB ASP 12 -11.950 10.239 -3.992
77 HB3 ASP 12 3HB ASP 12 -10.393 10.473 -3.191
78 H THR 13 H THR 13 -11.804 7.305 -0.611
79 HA THR 13 HA THR 13 -9.004 7.717 0.225
80 HB THR 13 HB THR 13 -11.010 7.104 2.414
81 HG1 THR 13 1HG THR 13 -10.351 9.586 1.298
82 HG21 THR 13 1HG2 THR 13 -8.579 6.788 2.919
83 HG22 THR 13 2HG2 THR 13 -8.271 8.465 2.417
84 HG23 THR 13 3HG2 THR 13 -9.274 8.126 3.843
85 H GLU 14 H GLU 14 -11.007 5.690 -1.300
86 HA GLU 14 HA GLU 14 -10.780 3.308 0.285
87 HB2 GLU 14 2HB GLU 14 -11.620 3.916 -2.590
88 HB3 GLU 14 3HB GLU 14 -11.505 2.278 -1.962
89 HG2 GLU 14 2HG GLU 14 -13.714 2.685 -1.573
90 HG3 GLU 14 3HG GLU 14 -13.038 3.124 -0.012
91 H GLU 15 H GLU 15 -9.202 4.473 -2.717
92 HA GLU 15 HA GLU 15 -7.108 2.380 -2.302
93 HB2 GLU 15 2HB GLU 15 -6.825 2.475 -4.768
94 HB3 GLU 15 3HB GLU 15 -8.333 1.767 -4.203
95 HG2 GLU 15 2HG GLU 15 -9.636 3.609 -4.893
96 HG3 GLU 15 3HG GLU 15 -8.251 4.681 -5.033
97 H LYS 16 H LYS 16 -6.241 4.056 -0.797
98 HA LYS 16 HA LYS 16 -4.701 6.042 -2.349
99 HB2 LYS 16 2HB LYS 16 -6.313 6.808 -0.512
100 HB3 LYS 16 3HB LYS 16 -5.180 6.097 0.665
101 HG2 LYS 16 2HG LYS 16 -3.382 7.484 -0.218
102 HG3 LYS 16 3HG LYS 16 -4.450 8.078 -1.496
103 HD2 LYS 16 2HD LYS 16 -5.610 8.602 1.141
104 HD3 LYS 16 3HD LYS 16 -3.981 9.283 0.986
105 HE2 LYS 16 2HE LYS 16 -4.805 10.115 -1.362
106 HE3 LYS 16 3HE LYS 16 -6.434 9.840 -0.718
107 HZ1 LYS 16 1HZ LYS 16 -5.785 11.345 1.117
108 HZ2 LYS 16 2HZ LYS 16 -4.326 11.600 0.360
109 HZ3 LYS 16 3HZ LYS 16 -5.728 12.085 -0.353
110 H CYS 17 H CYS 17 -2.709 5.831 -2.508
111 HA CYS 17 HA CYS 17 -0.837 3.838 -1.335
112 HB2 CYS 17 2HB CYS 17 -0.563 5.095 -3.509
113 HB3 CYS 17 3HB CYS 17 -0.462 6.555 -2.586
114 H THR 18 H THR 18 -1.378 3.993 0.998
115 HA THR 18 HA THR 18 -1.481 6.522 2.251
116 HB THR 18 HB THR 18 -2.220 4.300 3.214
117 HG1 THR 18 1HG THR 18 -0.699 6.183 4.688
118 HG21 THR 18 1HG2 THR 18 -0.673 3.022 4.462
119 HG22 THR 18 2HG2 THR 18 0.114 3.264 2.880
120 HG23 THR 18 3HG2 THR 18 0.626 4.218 4.282
121 H ILE 19 H ILE 19 1.255 4.900 0.913
122 HA ILE 19 HA ILE 19 3.265 5.870 2.699
123 HB ILE 19 HB ILE 19 3.203 4.648 -0.067
124 HG12 ILE 19 2HG1 ILE 19 4.436 3.272 2.291
125 HG13 ILE 19 3HG1 ILE 19 2.684 3.454 2.357
126 HG21 ILE 19 1HG2 ILE 19 5.559 5.418 1.673
127 HG22 ILE 19 2HG2 ILE 19 5.675 4.274 0.314
128 HG23 ILE 19 3HG2 ILE 19 5.195 5.964 0.022
129 HD11 ILE 19 1HD1 ILE 19 3.285 1.344 1.276
130 HD12 ILE 19 2HD1 ILE 19 2.438 2.431 0.153
131 HD13 ILE 19 3HD1 ILE 19 4.202 2.231 0.035
132 H CYS 20 H CYS 20 2.072 6.840 -0.603
133 HA CYS 20 HA CYS 20 3.520 9.482 -0.358
134 HB2 CYS 20 2HB CYS 20 3.072 9.661 -2.723
135 HB3 CYS 20 3HB CYS 20 4.036 8.228 -2.347
136 H LEU 21 H LEU 21 0.717 8.203 0.679
137 HA LEU 21 HA LEU 21 -1.361 8.856 1.136
138 HB2 LEU 21 2HB LEU 21 0.083 11.503 1.442
139 HB3 LEU 21 3HB LEU 21 -1.542 11.188 2.061
140 HG LEU 21 HG LEU 21 0.860 9.481 2.840
141 HD11 LEU 21 1HD1 LEU 21 -0.334 11.859 4.296
142 HD12 LEU 21 2HD1 LEU 21 0.928 10.760 4.914
143 HD13 LEU 21 3HD1 LEU 21 1.265 11.785 3.508
144 HD21 LEU 21 1HD2 LEU 21 -0.581 8.839 4.732
145 HD22 LEU 21 2HD2 LEU 21 -1.885 9.887 4.128
146 HD23 LEU 21 3HD2 LEU 21 -1.377 8.454 3.209
147 H SER 22 H SER 22 -0.864 8.709 -1.646
148 HA SER 22 HA SER 22 -2.661 10.843 -2.709
149 HB2 SER 22 2HB SER 22 -0.078 10.810 -3.274
150 HB3 SER 22 3HB SER 22 -0.537 9.487 -4.365
151 HG SER 22 HG SER 22 -1.137 12.199 -4.446
152 H ILE 23 H ILE 23 -4.176 10.134 -4.420
153 HA ILE 23 HA ILE 23 -5.089 7.443 -4.000
154 HB ILE 23 HB ILE 23 -5.871 9.811 -5.723
155 HG12 ILE 23 2HG1 ILE 23 -6.285 10.016 -3.286
156 HG13 ILE 23 3HG1 ILE 23 -7.754 10.013 -4.239
157 HG21 ILE 23 1HG2 ILE 23 -6.583 8.029 -7.047
158 HG22 ILE 23 2HG2 ILE 23 -7.158 7.069 -5.676
159 HG23 ILE 23 3HG2 ILE 23 -8.013 8.552 -6.164
160 HD11 ILE 23 1HD1 ILE 23 -8.087 8.653 -2.249
161 HD12 ILE 23 2HD1 ILE 23 -8.087 7.578 -3.656
162 HD13 ILE 23 3HD1 ILE 23 -6.663 7.672 -2.613
163 H LEU 24 H LEU 24 -5.348 5.900 -5.598
164 HA LEU 24 HA LEU 24 -3.097 5.633 -7.484
165 HB2 LEU 24 2HB LEU 24 -5.251 3.722 -6.443
166 HB3 LEU 24 3HB LEU 24 -3.826 3.242 -7.375
167 HG LEU 24 HG LEU 24 -3.703 4.563 -4.616
168 HD11 LEU 24 1HD1 LEU 24 -3.182 2.506 -3.690
169 HD12 LEU 24 2HD1 LEU 24 -4.598 2.202 -4.706
170 HD13 LEU 24 3HD1 LEU 24 -2.989 1.715 -5.285
171 HD21 LEU 24 1HD2 LEU 24 -1.292 3.631 -4.909
172 HD22 LEU 24 2HD2 LEU 24 -1.688 3.625 -6.640
173 HD23 LEU 24 3HD2 LEU 24 -1.759 5.152 -5.727
174 H GLU 25 H GLU 25 -4.567 3.750 -9.141
175 HA GLU 25 HA GLU 25 -7.095 4.857 -9.802
176 HB2 GLU 25 2HB GLU 25 -6.770 5.259 -12.167
177 HB3 GLU 25 3HB GLU 25 -5.672 6.294 -11.239
178 HG2 GLU 25 2HG GLU 25 -3.806 4.783 -11.688
179 HG3 GLU 25 3HG GLU 25 -4.869 3.682 -12.587
180 H GLU 26 H GLU 26 -8.133 3.445 -11.593
181 HA GLU 26 HA GLU 26 -7.696 0.685 -10.812
182 HB2 GLU 26 2HB GLU 26 -9.951 1.672 -11.227
183 HB3 GLU 26 3HB GLU 26 -9.554 1.833 -12.947
184 HG2 GLU 26 2HG GLU 26 -9.207 -0.625 -13.097
185 HG3 GLU 26 3HG GLU 26 -9.533 -0.785 -11.369
186 H GLY 27 H GLY 27 -6.074 -0.494 -11.696
187 HA2 GLY 27 2HA GLY 27 -5.277 -1.729 -13.590
188 HA3 GLY 27 3HA GLY 27 -5.671 -0.371 -14.647
189 H GLU 28 H GLU 28 -4.078 0.576 -11.683
190 HA GLU 28 HA GLU 28 -1.675 1.265 -13.196
191 HB2 GLU 28 2HB GLU 28 -2.972 2.741 -11.593
192 HB3 GLU 28 3HB GLU 28 -2.399 1.721 -10.279
193 HG2 GLU 28 2HG GLU 28 -0.049 2.355 -10.871
194 HG3 GLU 28 3HG GLU 28 -0.671 3.351 -12.193
195 H ASP 29 H ASP 29 0.466 0.834 -12.202
196 HA ASP 29 HA ASP 29 0.864 -1.904 -11.399
197 HB2 ASP 29 2HB ASP 29 2.764 0.454 -11.243
198 HB3 ASP 29 3HB ASP 29 3.194 -1.253 -11.139
199 H VAL 30 H VAL 30 -0.097 -2.404 -9.490
200 HA VAL 30 HA VAL 30 0.868 -1.058 -7.038
201 HB VAL 30 HB VAL 30 -1.331 -1.019 -6.064
202 HG11 VAL 30 1HG1 VAL 30 -0.680 0.923 -7.541
203 HG12 VAL 30 2HG1 VAL 30 -1.605 0.164 -8.844
204 HG13 VAL 30 3HG1 VAL 30 -2.425 0.691 -7.374
205 HG21 VAL 30 1HG2 VAL 30 -2.384 -2.981 -7.021
206 HG22 VAL 30 2HG2 VAL 30 -3.368 -1.562 -7.407
207 HG23 VAL 30 3HG2 VAL 30 -2.328 -2.269 -8.654
208 H ARG 31 H ARG 31 0.138 -2.542 -5.092
209 HA ARG 31 HA ARG 31 -0.041 -5.354 -5.861
210 HB2 ARG 31 2HB ARG 31 2.253 -4.113 -4.349
211 HB3 ARG 31 3HB ARG 31 1.585 -5.569 -3.646
212 HG2 ARG 31 2HG ARG 31 1.874 -6.067 -6.464
213 HG3 ARG 31 3HG ARG 31 3.361 -5.308 -5.912
214 HD2 ARG 31 2HD ARG 31 2.260 -7.541 -4.238
215 HD3 ARG 31 3HD ARG 31 2.960 -7.937 -5.815
216 HE ARG 31 HE ARG 31 4.802 -6.244 -4.618
217 HH11 ARG 31 1HH1 ARG 31 6.816 -8.770 -3.220
218 HH12 ARG 31 2HH1 ARG 31 6.787 -7.160 -3.830
219 HH21 ARG 31 1HH2 ARG 31 4.824 -10.081 -3.245
220 HH22 ARG 31 2HH2 ARG 31 3.378 -9.377 -3.874
221 H ARG 32 H ARG 32 -0.785 -6.627 -3.937
222 HA ARG 32 HA ARG 32 -2.536 -4.939 -2.241
223 HB2 ARG 32 2HB ARG 32 -3.330 -6.763 -4.233
224 HB3 ARG 32 3HB ARG 32 -3.404 -7.733 -2.763
225 HG2 ARG 32 2HG ARG 32 -4.806 -5.089 -3.313
226 HG3 ARG 32 3HG ARG 32 -5.544 -6.686 -3.221
227 HD2 ARG 32 2HD ARG 32 -4.763 -6.787 -0.771
228 HD3 ARG 32 3HD ARG 32 -4.265 -5.123 -0.933
229 HE ARG 32 HE ARG 32 -6.447 -4.413 -0.886
230 HH11 ARG 32 1HH1 ARG 32 -9.461 -6.186 -0.678
231 HH12 ARG 32 2HH1 ARG 32 -8.687 -4.645 -0.547
232 HH21 ARG 32 1HH2 ARG 32 -8.125 -8.118 -1.138
233 HH22 ARG 32 2HH2 ARG 32 -6.425 -7.911 -1.367
234 H LEU 33 H LEU 33 -2.584 -5.629 0.001
235 HA LEU 33 HA LEU 33 -0.666 -7.733 0.698
236 HB2 LEU 33 2HB LEU 33 -0.837 -5.914 2.843
237 HB3 LEU 33 3HB LEU 33 0.549 -6.151 1.775
238 HG LEU 33 HG LEU 33 -1.754 -4.256 1.287
239 HD11 LEU 33 1HD1 LEU 33 0.992 -3.675 2.498
240 HD12 LEU 33 2HD1 LEU 33 -0.280 -2.482 2.139
241 HD13 LEU 33 3HD1 LEU 33 -0.549 -3.701 3.386
242 HD21 LEU 33 1HD2 LEU 33 -0.750 -3.903 -0.743
243 HD22 LEU 33 2HD2 LEU 33 0.665 -3.305 0.099
244 HD23 LEU 33 3HD2 LEU 33 0.578 -5.020 -0.326
245 HA PRO 34 HA PRO 34 -3.705 -9.745 2.747
246 HB2 PRO 34 2HB PRO 34 -2.879 -10.243 5.364
247 HB3 PRO 34 3HB PRO 34 -2.306 -11.097 3.902
248 HG2 PRO 34 2HG PRO 34 -0.952 -8.911 5.445
249 HG3 PRO 34 3HG PRO 34 -0.231 -10.305 4.579
250 HD2 PRO 34 2HD PRO 34 -0.348 -7.699 3.671
251 HD3 PRO 34 3HD PRO 34 -0.140 -9.074 2.593
252 H CYS 35 H CYS 35 -2.701 -6.858 4.631
253 HA CYS 35 HA CYS 35 -5.335 -6.650 5.988
254 HB2 CYS 35 2HB CYS 35 -4.368 -4.883 7.079
255 HB3 CYS 35 3HB CYS 35 -3.100 -6.085 6.974
256 H MET 36 H MET 36 -5.375 -6.725 3.064
257 HA MET 36 HA MET 36 -6.416 -5.882 1.386
258 HB2 MET 36 2HB MET 36 -8.565 -4.715 1.825
259 HB3 MET 36 3HB MET 36 -8.305 -6.219 2.701
260 HG2 MET 36 2HG MET 36 -7.791 -4.994 4.743
261 HG3 MET 36 3HG MET 36 -7.940 -3.446 3.892
262 HE1 MET 36 1HE MET 36 -10.953 -3.893 6.500
263 HE2 MET 36 2HE MET 36 -9.312 -4.565 6.625
264 HE3 MET 36 3HE MET 36 -9.545 -2.887 6.080
265 H HIS 37 H HIS 37 -4.303 -3.912 2.725
266 HA HIS 37 HA HIS 37 -5.187 -1.384 1.625
267 HB2 HIS 37 1HB HIS 37 -3.014 -2.440 3.407
268 HB3 HIS 37 2HB HIS 37 -2.672 -0.965 2.557
269 HD2 HIS 37 2HD HIS 37 -5.074 0.801 2.670
270 HE1 HIS 37 1HE HIS 37 -5.086 0.281 6.896
271 HE2 HIS 37 2HE HIS 37 -5.910 1.746 4.964
272 H LEU 38 H LEU 38 -5.184 -1.829 -0.711
273 HA LEU 38 HA LEU 38 -2.741 -2.655 -1.999
274 HB2 LEU 38 2HB LEU 38 -3.640 -2.074 -4.076
275 HB3 LEU 38 3HB LEU 38 -4.934 -2.818 -3.158
276 HG LEU 38 HG LEU 38 -4.715 0.220 -3.381
277 HD11 LEU 38 1HD1 LEU 38 -4.626 -0.598 -5.638
278 HD12 LEU 38 2HD1 LEU 38 -5.991 -1.702 -5.345
279 HD13 LEU 38 3HD1 LEU 38 -6.230 0.058 -5.321
280 HD21 LEU 38 1HD2 LEU 38 -6.333 -0.570 -1.722
281 HD22 LEU 38 2HD2 LEU 38 -7.186 0.042 -3.130
282 HD23 LEU 38 3HD2 LEU 38 -7.033 -1.707 -2.912
283 H PHE 39 H PHE 39 -1.017 -1.518 -2.858
284 HA PHE 39 HA PHE 39 -0.924 1.429 -2.603
285 HB2 PHE 39 2HB PHE 39 0.973 -0.564 -1.317
286 HB3 PHE 39 3HB PHE 39 1.330 1.147 -1.468
287 HD1 PHE 39 1HD PHE 39 -1.654 2.022 -0.591
288 HD2 PHE 39 2HD PHE 39 1.300 -0.644 1.063
289 HE1 PHE 39 1HE PHE 39 -2.661 2.283 1.624
290 HE2 PHE 39 2HE PHE 39 0.337 -0.307 3.306
291 HZ PHE 39 HZ PHE 39 -1.670 1.130 3.597
292 H HIS 40 H HIS 40 0.916 2.307 -3.905
293 HA HIS 40 HA HIS 40 1.191 1.179 -6.467
294 HB2 HIS 40 1HB HIS 40 3.004 3.040 -4.894
295 HB3 HIS 40 2HB HIS 40 3.326 2.622 -6.568
296 HD2 HIS 40 2HD HIS 40 0.836 3.026 -8.163
297 HE1 HIS 40 1HE HIS 40 0.556 6.913 -6.460
298 HE2 HIS 40 2HE HIS 40 -0.194 5.369 -8.399
299 H GLN 41 H GLN 41 2.778 -0.073 -7.530
300 HA GLN 41 HA GLN 41 4.185 -2.001 -5.953
301 HB2 GLN 41 2HB GLN 41 3.346 -1.697 -8.669
302 HB3 GLN 41 3HB GLN 41 5.093 -1.912 -8.728
303 HG2 GLN 41 2HG GLN 41 4.847 -3.887 -7.200
304 HG3 GLN 41 3HG GLN 41 3.088 -3.644 -7.257
305 HE21 GLN 41 1HE2 GLN 41 1.970 -4.831 -8.831
306 HE22 GLN 41 2HE2 GLN 41 2.790 -5.544 -10.215
307 H VAL 42 H VAL 42 5.089 1.058 -5.999
308 HA VAL 42 HA VAL 42 8.011 0.495 -6.201
309 HB VAL 42 HB VAL 42 6.459 2.958 -7.104
310 HG11 VAL 42 1HG1 VAL 42 8.481 3.748 -5.984
311 HG12 VAL 42 2HG1 VAL 42 9.470 2.546 -6.846
312 HG13 VAL 42 3HG1 VAL 42 8.700 3.881 -7.732
313 HG21 VAL 42 1HG2 VAL 42 6.531 1.104 -8.747
314 HG22 VAL 42 2HG2 VAL 42 7.530 2.460 -9.286
315 HG23 VAL 42 3HG2 VAL 42 8.296 1.018 -8.581
316 H CYS 43 H CYS 43 5.653 2.948 -4.930
317 HA CYS 43 HA CYS 43 6.918 3.716 -2.539
318 HB2 CYS 43 2HB CYS 43 3.970 3.050 -2.835
319 HB3 CYS 43 3HB CYS 43 4.728 4.210 -1.759
320 H VAL 44 H VAL 44 4.753 0.869 -3.069
321 HA VAL 44 HA VAL 44 5.162 0.013 -0.383
322 HB VAL 44 HB VAL 44 3.117 -0.313 -1.931
323 HG11 VAL 44 1HG1 VAL 44 4.503 -1.763 -3.584
324 HG12 VAL 44 2HG1 VAL 44 4.431 -3.014 -2.338
325 HG13 VAL 44 3HG1 VAL 44 2.921 -2.377 -3.045
326 HG21 VAL 44 1HG2 VAL 44 4.174 -2.488 -0.087
327 HG22 VAL 44 2HG2 VAL 44 3.380 -0.997 0.434
328 HG23 VAL 44 3HG2 VAL 44 2.474 -2.217 -0.505
329 H ASP 45 H ASP 45 6.913 -0.548 -3.298
330 HA ASP 45 HA ASP 45 8.043 -3.122 -2.595
331 HB2 ASP 45 2HB ASP 45 8.253 -2.178 -4.875
332 HB3 ASP 45 3HB ASP 45 9.293 -0.886 -4.253
333 H GLN 46 H GLN 46 9.335 0.236 -2.316
334 HA GLN 46 HA GLN 46 11.368 -0.630 -0.501
335 HB2 GLN 46 2HB GLN 46 10.285 2.191 -0.928
336 HB3 GLN 46 3HB GLN 46 11.785 1.759 -0.080
337 HG2 GLN 46 2HG GLN 46 12.451 0.516 -2.254
338 HG3 GLN 46 3HG GLN 46 11.145 1.420 -3.033
339 HE21 GLN 46 1HE2 GLN 46 14.376 1.477 -2.872
340 HE22 GLN 46 2HE2 GLN 46 14.642 3.214 -2.793
341 H ALA 47 H ALA 47 8.025 0.274 0.103
342 HA ALA 47 HA ALA 47 8.288 0.608 2.926
343 HB1 ALA 47 1HB ALA 47 5.971 -0.647 1.413
344 HB2 ALA 47 2HB ALA 47 5.913 0.145 2.999
345 HB3 ALA 47 3HB ALA 47 6.259 1.107 1.540
346 H LEU 48 H LEU 48 7.253 -2.341 1.137
347 HA LEU 48 HA LEU 48 7.187 -4.085 3.283
348 HB2 LEU 48 2HB LEU 48 6.169 -4.322 1.024
349 HB3 LEU 48 3HB LEU 48 7.743 -4.707 0.339
350 HG LEU 48 HG LEU 48 6.637 -6.331 2.654
351 HD11 LEU 48 1HD1 LEU 48 4.838 -6.178 0.921
352 HD12 LEU 48 2HD1 LEU 48 5.977 -6.804 -0.283
353 HD13 LEU 48 3HD1 LEU 48 5.484 -7.814 1.099
354 HD21 LEU 48 1HD2 LEU 48 8.352 -7.098 0.241
355 HD22 LEU 48 2HD2 LEU 48 8.967 -6.831 1.878
356 HD23 LEU 48 3HD2 LEU 48 7.869 -8.177 1.570
357 H ILE 49 H ILE 49 9.950 -3.524 0.965
358 HA ILE 49 HA ILE 49 11.605 -5.453 2.227
359 HB ILE 49 HB ILE 49 13.464 -4.480 1.128
360 HG12 ILE 49 2HG1 ILE 49 12.815 -2.349 -0.389
361 HG13 ILE 49 3HG1 ILE 49 11.882 -2.008 1.073
362 HG21 ILE 49 1HG2 ILE 49 11.173 -4.177 -0.818
363 HG22 ILE 49 2HG2 ILE 49 12.806 -4.771 -1.106
364 HG23 ILE 49 3HG2 ILE 49 11.669 -5.747 -0.158
365 HD11 ILE 49 1HD1 ILE 49 14.022 -0.956 1.334
366 HD12 ILE 49 2HD1 ILE 49 14.047 -2.376 2.396
367 HD13 ILE 49 3HD1 ILE 49 14.878 -2.430 0.833
368 H THR 50 H THR 50 11.123 -1.961 2.937
369 HA THR 50 HA THR 50 13.136 -1.698 4.871
370 HB THR 50 HB THR 50 10.545 -0.247 4.294
371 HG1 THR 50 1HG THR 50 12.090 0.366 2.990
372 HG21 THR 50 1HG2 THR 50 12.416 0.401 6.590
373 HG22 THR 50 2HG2 THR 50 11.218 1.516 5.889
374 HG23 THR 50 3HG2 THR 50 10.671 0.037 6.682
375 H ASN 51 H ASN 51 9.694 -2.734 5.193
376 HA ASN 51 HA ASN 51 10.383 -4.433 7.355
377 HB2 ASN 51 2HB ASN 51 9.864 -1.761 8.182
378 HB3 ASN 51 3HB ASN 51 8.357 -2.624 8.467
379 HD21 ASN 51 1HD2 ASN 51 11.492 -2.016 9.695
380 HD22 ASN 51 2HD2 ASN 51 11.450 -3.247 10.948
381 H LYS 52 H LYS 52 8.835 -6.066 7.339
382 HA LYS 52 HA LYS 52 6.664 -5.765 5.340
383 HB2 LYS 52 2HB LYS 52 7.637 -8.205 6.919
384 HB3 LYS 52 3HB LYS 52 6.406 -8.167 5.655
385 HG2 LYS 52 2HG LYS 52 8.231 -8.882 4.438
386 HG3 LYS 52 3HG LYS 52 8.244 -7.155 4.141
387 HD2 LYS 52 2HD LYS 52 10.035 -6.950 5.955
388 HD3 LYS 52 3HD LYS 52 10.052 -8.722 6.033
389 HE2 LYS 52 2HE LYS 52 10.831 -8.886 3.772
390 HE3 LYS 52 3HE LYS 52 10.415 -7.195 3.433
391 HZ1 LYS 52 1HZ LYS 52 12.564 -8.002 5.287
392 HZ2 LYS 52 2HZ LYS 52 12.800 -7.611 3.749
393 HZ3 LYS 52 3HZ LYS 52 12.220 -6.458 4.756
394 H LYS 53 H LYS 53 5.766 -4.051 6.906
395 HA LYS 53 HA LYS 53 3.683 -5.430 8.418
396 HB2 LYS 53 2HB LYS 53 4.008 -3.982 10.423
397 HB3 LYS 53 3HB LYS 53 5.280 -5.173 10.175
398 HG2 LYS 53 2HG LYS 53 6.843 -3.575 10.202
399 HG3 LYS 53 3HG LYS 53 6.110 -2.787 8.807
400 HD2 LYS 53 2HD LYS 53 4.542 -1.574 10.355
401 HD3 LYS 53 3HD LYS 53 5.381 -2.332 11.723
402 HE2 LYS 53 2HE LYS 53 6.333 -0.145 11.441
403 HE3 LYS 53 3HE LYS 53 7.535 -1.328 10.905
404 HZ1 LYS 53 1HZ LYS 53 6.849 -0.872 8.622
405 HZ2 LYS 53 2HZ LYS 53 5.735 0.209 9.134
406 HZ3 LYS 53 3HZ LYS 53 7.337 0.516 9.365
407 H CYS 54 H CYS 54 1.754 -4.395 8.151
408 HA CYS 54 HA CYS 54 1.489 -2.196 6.272
409 HB2 CYS 54 2HB CYS 54 -0.204 -4.103 7.349
410 HB3 CYS 54 3HB CYS 54 -0.595 -2.657 8.302
411 HA PRO 55 HA PRO 55 2.333 1.055 9.246
412 HB2 PRO 55 2HB PRO 55 1.089 3.199 8.016
413 HB3 PRO 55 3HB PRO 55 2.650 2.503 7.495
414 HG2 PRO 55 2HG PRO 55 -0.089 1.982 6.336
415 HG3 PRO 55 3HG PRO 55 1.458 2.262 5.478
416 HD2 PRO 55 2HD PRO 55 0.397 -0.217 5.902
417 HD3 PRO 55 3HD PRO 55 2.160 0.064 5.841
418 H ILE 56 H ILE 56 -0.976 1.893 8.025
419 HA ILE 56 HA ILE 56 -1.941 1.854 10.803
420 HB ILE 56 HB ILE 56 -3.395 2.579 8.226
421 HG12 ILE 56 2HG1 ILE 56 -2.273 4.554 10.252
422 HG13 ILE 56 3HG1 ILE 56 -1.329 4.044 8.855
423 HG21 ILE 56 1HG2 ILE 56 -4.026 3.143 11.172
424 HG22 ILE 56 2HG2 ILE 56 -4.963 3.751 9.795
425 HG23 ILE 56 3HG2 ILE 56 -4.917 2.026 10.122
426 HD11 ILE 56 1HD1 ILE 56 -2.445 6.112 8.321
427 HD12 ILE 56 2HD1 ILE 56 -3.104 4.807 7.318
428 HD13 ILE 56 3HD1 ILE 56 -4.030 5.427 8.706
429 H CYS 57 H CYS 57 -1.376 -0.414 10.763
430 HA CYS 57 HA CYS 57 -3.790 -1.743 11.300
431 HB2 CYS 57 2HB CYS 57 -2.114 -3.452 9.426
432 HB3 CYS 57 3HB CYS 57 -3.512 -3.900 10.348
433 H ARG 58 H ARG 58 -0.218 -2.013 10.823
434 HA ARG 58 HA ARG 58 1.400 -3.021 11.980
435 HB2 ARG 58 2HB ARG 58 0.445 -1.654 13.928
436 HB3 ARG 58 3HB ARG 58 -0.397 -3.133 14.414
437 HG2 ARG 58 2HG ARG 58 2.053 -4.189 14.186
438 HG3 ARG 58 3HG ARG 58 2.562 -2.526 14.433
439 HD2 ARG 58 2HD ARG 58 0.533 -3.796 16.319
440 HD3 ARG 58 3HD ARG 58 2.227 -4.233 16.433
441 HE ARG 58 HE ARG 58 2.779 -2.256 17.327
442 HH11 ARG 58 1HH1 ARG 58 0.853 0.533 18.236
443 HH12 ARG 58 2HH1 ARG 58 2.368 -0.268 18.417
444 HH21 ARG 58 1HH2 ARG 58 -0.836 -0.431 16.870
445 HH22 ARG 58 2HH2 ARG 58 -0.515 -1.936 16.088
446 H VAL 59 H VAL 59 0.336 -4.668 10.283
447 HA VAL 59 HA VAL 59 0.382 -7.207 11.775
448 HB VAL 59 HB VAL 59 -1.973 -6.672 10.983
449 HG11 VAL 59 1HG1 VAL 59 -1.531 -5.699 8.801
450 HG12 VAL 59 2HG1 VAL 59 -0.847 -7.240 8.226
451 HG13 VAL 59 3HG1 VAL 59 -2.550 -7.158 8.697
452 HG21 VAL 59 1HG2 VAL 59 -2.453 -8.940 10.315
453 HG22 VAL 59 2HG2 VAL 59 -0.790 -9.205 9.781
454 HG23 VAL 59 3HG2 VAL 59 -1.153 -8.992 11.516
455 H ASP 60 H ASP 60 1.238 -8.912 10.453
456 HA ASP 60 HA ASP 60 3.540 -8.051 8.900
457 HB2 ASP 60 2HB ASP 60 3.560 -10.023 10.385
458 HB3 ASP 60 3HB ASP 60 2.322 -10.794 9.384
459 H ILE 61 H ILE 61 3.808 -8.230 6.709
460 HA ILE 61 HA ILE 61 1.484 -9.111 5.060
461 HB ILE 61 HB ILE 61 2.058 -7.464 3.431
462 HG12 ILE 61 2HG1 ILE 61 4.191 -6.448 5.353
463 HG13 ILE 61 3HG1 ILE 61 4.538 -7.387 3.887
464 HG21 ILE 61 1HG2 ILE 61 1.162 -5.567 4.518
465 HG22 ILE 61 2HG2 ILE 61 0.602 -6.921 5.509
466 HG23 ILE 61 3HG2 ILE 61 2.002 -5.962 6.049
467 HD11 ILE 61 1HD1 ILE 61 3.276 -5.714 2.578
468 HD12 ILE 61 2HD1 ILE 61 3.211 -4.687 4.035
469 HD13 ILE 61 3HD1 ILE 61 4.790 -5.101 3.324
470 H GLU 62 H GLU 62 4.735 -9.647 5.781
471 HA GLU 62 HA GLU 62 5.917 -10.466 3.409
472 HB2 GLU 62 2HB GLU 62 6.895 -10.377 5.755
473 HB3 GLU 62 3HB GLU 62 6.167 -11.942 6.070
474 HG2 GLU 62 2HG GLU 62 7.854 -11.646 3.586
475 HG3 GLU 62 3HG GLU 62 8.688 -11.566 5.132
476 H ALA 63 H ALA 63 5.762 -12.200 2.068
477 HA ALA 63 HA ALA 63 4.598 -14.662 2.830
478 HB1 ALA 63 1HB ALA 63 2.982 -12.932 0.908
479 HB2 ALA 63 2HB ALA 63 2.749 -14.684 1.136
480 HB3 ALA 63 3HB ALA 63 2.443 -13.564 2.482
481 H GLN 64 H GLN 64 6.923 -14.755 2.129
482 HA GLN 64 HA GLN 64 6.936 -15.996 -0.437
483 HB2 GLN 64 2HB GLN 64 7.366 -13.382 -0.855
484 HB3 GLN 64 3HB GLN 64 8.977 -13.742 -0.254
485 HG2 GLN 64 2HG GLN 64 8.808 -13.846 -2.739
486 HG3 GLN 64 3HG GLN 64 9.314 -15.386 -2.044
487 HE21 GLN 64 1HE2 GLN 64 6.049 -13.819 -2.545
488 HE22 GLN 64 2HE2 GLN 64 5.412 -15.201 -3.406
489 H LEU 65 H LEU 65 9.008 -17.207 -0.784
490 HA LEU 65 HA LEU 65 9.895 -18.329 1.655
491 HB2 LEU 65 2HB LEU 65 9.875 -19.391 -0.629
492 HB3 LEU 65 3HB LEU 65 11.290 -18.429 -1.050
493 HG LEU 65 HG LEU 65 11.763 -19.742 1.507
494 HD11 LEU 65 1HD1 LEU 65 10.917 -21.603 -0.753
495 HD12 LEU 65 2HD1 LEU 65 11.651 -22.093 0.790
496 HD13 LEU 65 3HD1 LEU 65 10.042 -21.351 0.776
497 HD21 LEU 65 1HD2 LEU 65 13.518 -18.995 -0.063
498 HD22 LEU 65 2HD2 LEU 65 13.673 -20.721 0.309
499 HD23 LEU 65 3HD2 LEU 65 12.983 -20.210 -1.248
500 HA PRO 66 HA PRO 66 12.583 -14.869 2.529
501 HB2 PRO 66 2HB PRO 66 13.468 -15.544 5.035
502 HB3 PRO 66 3HB PRO 66 11.792 -15.005 4.703
503 HG2 PRO 66 2HG PRO 66 12.806 -17.853 4.959
504 HG3 PRO 66 3HG PRO 66 11.377 -17.109 5.748
505 HD2 PRO 66 2HD PRO 66 11.158 -18.578 3.466
506 HD3 PRO 66 3HD PRO 66 10.143 -17.127 3.740
507 H SER 67 H SER 67 14.569 -14.604 1.594
508 HA SER 67 HA SER 67 16.818 -16.276 2.391
509 HB2 SER 67 2HB SER 67 15.826 -17.744 0.715
510 HB3 SER 67 3HB SER 67 15.702 -16.404 -0.442
511 HG SER 67 HG SER 67 17.948 -16.269 -0.439
512 H GLU 68 H GLU 68 17.149 -14.016 3.107
513 HA GLU 68 HA GLU 68 18.819 -12.514 3.063
514 HB2 GLU 68 2HB GLU 68 19.674 -13.774 0.903
515 HB3 GLU 68 3HB GLU 68 19.003 -12.376 0.054
516 HG2 GLU 68 2HG GLU 68 21.223 -11.775 0.421
517 HG3 GLU 68 3HG GLU 68 20.391 -10.955 1.747
518 H SER 69 H SER 69 17.734 -10.829 3.869
519 HA SER 69 HA SER 69 17.120 -8.641 3.865
520 HB2 SER 69 2HB SER 69 17.887 -8.438 1.449
521 HB3 SER 69 3HB SER 69 16.212 -8.815 0.977
522 HG SER 69 HG SER 69 15.588 -7.095 2.383
Start of MODEL 13
1 H1 MET 1 H1 MET 1 2.499 16.143 -2.669
2 H2 MET 1 H2 MET 1 2.401 14.872 -3.720
3 H3 MET 1 H3 MET 1 3.804 15.169 -2.906
4 HA MET 1 HA MET 1 4.019 15.836 -5.153
5 HB2 MET 1 2HB MET 1 1.498 16.360 -5.290
6 HB3 MET 1 3HB MET 1 1.908 17.970 -4.696
7 HG2 MET 1 2HG MET 1 3.139 16.579 -7.114
8 HG3 MET 1 3HG MET 1 1.816 17.733 -7.208
9 HE1 MET 1 1HE MET 1 2.349 20.219 -5.604
10 HE2 MET 1 2HE MET 1 3.355 21.158 -6.733
11 HE3 MET 1 3HE MET 1 2.002 20.187 -7.351
12 H LYS 2 H LYS 2 3.037 18.668 -3.048
13 HA LYS 2 HA LYS 2 5.772 18.754 -2.043
14 HB2 LYS 2 2HB LYS 2 4.406 21.047 -3.526
15 HB3 LYS 2 3HB LYS 2 5.598 21.332 -2.255
16 HG2 LYS 2 2HG LYS 2 7.091 19.658 -3.622
17 HG3 LYS 2 3HG LYS 2 6.050 20.144 -4.967
18 HD2 LYS 2 2HD LYS 2 7.697 21.994 -3.159
19 HD3 LYS 2 3HD LYS 2 8.114 21.491 -4.790
20 HE2 LYS 2 2HE LYS 2 7.270 23.614 -5.125
21 HE3 LYS 2 3HE LYS 2 5.905 22.577 -5.556
22 HZ1 LYS 2 1HZ LYS 2 5.271 24.465 -4.153
23 HZ2 LYS 2 2HZ LYS 2 4.975 23.066 -3.344
24 HZ3 LYS 2 3HZ LYS 2 6.265 23.953 -2.948
25 H GLN 3 H GLN 3 5.580 20.744 -0.295
26 HA GLN 3 HA GLN 3 3.541 20.133 1.598
27 HB2 GLN 3 2HB GLN 3 4.173 22.159 2.725
28 HB3 GLN 3 3HB GLN 3 5.624 21.316 2.215
29 HG2 GLN 3 2HG GLN 3 4.394 23.739 0.789
30 HG3 GLN 3 3HG GLN 3 5.705 23.813 1.955
31 HE21 GLN 3 1HE2 GLN 3 7.505 21.913 1.297
32 HE22 GLN 3 2HE2 GLN 3 8.069 22.167 -0.340
33 H ASP 4 H ASP 4 1.624 21.343 2.157
34 HA ASP 4 HA ASP 4 0.502 23.253 0.311
35 HB2 ASP 4 2HB ASP 4 0.188 20.697 -0.529
36 HB3 ASP 4 3HB ASP 4 -1.116 20.724 0.656
37 H GLY 5 H GLY 5 -2.100 23.206 1.269
38 HA2 GLY 5 2HA GLY 5 -1.813 23.535 4.207
39 HA3 GLY 5 3HA GLY 5 -3.166 24.074 3.196
40 H GLU 6 H GLU 6 -4.820 23.016 4.396
41 HA GLU 6 HA GLU 6 -4.972 20.118 4.164
42 HB2 GLU 6 2HB GLU 6 -5.252 19.804 6.593
43 HB3 GLU 6 3HB GLU 6 -3.663 20.440 6.190
44 HG2 GLU 6 2HG GLU 6 -4.805 22.805 6.687
45 HG3 GLU 6 3HG GLU 6 -5.956 21.816 7.586
46 H GLU 7 H GLU 7 -7.199 19.770 5.813
47 HA GLU 7 HA GLU 7 -9.441 19.720 5.497
48 HB2 GLU 7 2HB GLU 7 -8.918 22.661 5.922
49 HB3 GLU 7 3HB GLU 7 -10.560 22.019 5.723
50 HG2 GLU 7 2HG GLU 7 -10.211 20.422 7.551
51 HG3 GLU 7 3HG GLU 7 -8.566 21.020 7.794
52 H GLY 8 H GLY 8 -8.776 18.876 3.279
53 HA2 GLY 8 2HA GLY 8 -10.760 20.048 1.474
54 HA3 GLY 8 3HA GLY 8 -9.098 20.031 0.856
55 H THR 9 H THR 9 -11.842 18.020 1.899
56 HA THR 9 HA THR 9 -10.734 15.712 0.405
57 HB THR 9 HB THR 9 -11.556 14.294 2.370
58 HG1 THR 9 1HG THR 9 -12.633 16.046 3.402
59 HG21 THR 9 1HG2 THR 9 -9.139 14.638 1.907
60 HG22 THR 9 2HG2 THR 9 -9.155 16.069 2.964
61 HG23 THR 9 3HG2 THR 9 -9.493 14.467 3.641
62 H GLU 10 H GLU 10 -12.389 15.381 -1.135
63 HA GLU 10 HA GLU 10 -15.051 14.924 -0.088
64 HB2 GLU 10 2HB GLU 10 -14.811 17.447 -0.729
65 HB3 GLU 10 3HB GLU 10 -14.732 16.872 -2.404
66 HG2 GLU 10 2HG GLU 10 -16.929 15.731 -2.089
67 HG3 GLU 10 3HG GLU 10 -16.949 16.249 -0.398
68 H GLU 11 H GLU 11 -15.777 13.122 -1.201
69 HA GLU 11 HA GLU 11 -15.544 11.229 -2.438
70 HB2 GLU 11 2HB GLU 11 -15.185 13.290 -4.635
71 HB3 GLU 11 3HB GLU 11 -15.422 11.559 -4.918
72 HG2 GLU 11 2HG GLU 11 -17.536 11.601 -3.659
73 HG3 GLU 11 3HG GLU 11 -17.360 13.341 -3.399
74 H ASP 12 H ASP 12 -13.960 10.465 -4.549
75 HA ASP 12 HA ASP 12 -11.991 9.334 -4.804
76 HB2 ASP 12 2HB ASP 12 -12.199 11.468 -6.063
77 HB3 ASP 12 3HB ASP 12 -11.189 12.257 -4.845
78 H THR 13 H THR 13 -12.202 8.776 -2.407
79 HA THR 13 HA THR 13 -9.606 9.342 -1.068
80 HB THR 13 HB THR 13 -12.403 9.944 -0.214
81 HG1 THR 13 1HG THR 13 -11.036 11.524 -0.936
82 HG21 THR 13 1HG2 THR 13 -10.225 9.325 1.813
83 HG22 THR 13 2HG2 THR 13 -11.737 10.204 2.141
84 HG23 THR 13 3HG2 THR 13 -11.803 8.510 1.637
85 H GLU 14 H GLU 14 -11.773 6.936 -1.977
86 HA GLU 14 HA GLU 14 -11.314 5.138 0.233
87 HB2 GLU 14 2HB GLU 14 -13.120 5.259 -1.927
88 HB3 GLU 14 3HB GLU 14 -12.077 3.919 -2.364
89 HG2 GLU 14 2HG GLU 14 -13.529 2.725 -1.101
90 HG3 GLU 14 3HG GLU 14 -12.506 3.254 0.235
91 H GLU 15 H GLU 15 -10.158 5.315 -3.175
92 HA GLU 15 HA GLU 15 -8.311 3.101 -2.685
93 HB2 GLU 15 2HB GLU 15 -8.876 4.684 -5.230
94 HB3 GLU 15 3HB GLU 15 -7.975 3.159 -5.085
95 HG2 GLU 15 2HG GLU 15 -10.171 2.289 -3.911
96 HG3 GLU 15 3HG GLU 15 -10.937 3.682 -4.689
97 H LYS 16 H LYS 16 -7.269 4.714 -1.018
98 HA LYS 16 HA LYS 16 -5.253 6.328 -2.455
99 HB2 LYS 16 2HB LYS 16 -6.980 7.328 -0.781
100 HB3 LYS 16 3HB LYS 16 -5.950 6.622 0.493
101 HG2 LYS 16 2HG LYS 16 -4.013 7.835 -0.491
102 HG3 LYS 16 3HG LYS 16 -5.104 8.490 -1.729
103 HD2 LYS 16 2HD LYS 16 -6.298 9.121 0.784
104 HD3 LYS 16 3HD LYS 16 -4.568 9.495 0.934
105 HE2 LYS 16 2HE LYS 16 -4.757 10.691 -1.317
106 HE3 LYS 16 3HE LYS 16 -6.519 10.496 -1.190
107 HZ1 LYS 16 1HZ LYS 16 -6.355 11.734 0.917
108 HZ2 LYS 16 2HZ LYS 16 -4.731 11.962 0.633
109 HZ3 LYS 16 3HZ LYS 16 -5.856 12.620 -0.375
110 H CYS 17 H CYS 17 -3.271 5.971 -2.291
111 HA CYS 17 HA CYS 17 -1.955 3.580 -1.117
112 HB2 CYS 17 2HB CYS 17 -1.304 4.832 -3.211
113 HB3 CYS 17 3HB CYS 17 -1.009 6.238 -2.221
114 H THR 18 H THR 18 -2.104 3.555 1.177
115 HA THR 18 HA THR 18 -2.140 5.926 2.714
116 HB THR 18 HB THR 18 -2.802 3.593 3.446
117 HG1 THR 18 1HG THR 18 -1.209 5.315 5.029
118 HG21 THR 18 1HG2 THR 18 -1.145 2.178 4.411
119 HG22 THR 18 2HG2 THR 18 -0.519 2.625 2.807
120 HG23 THR 18 3HG2 THR 18 0.122 3.401 4.271
121 H ILE 19 H ILE 19 0.573 4.522 1.053
122 HA ILE 19 HA ILE 19 2.571 5.372 2.971
123 HB ILE 19 HB ILE 19 2.538 4.035 0.265
124 HG12 ILE 19 2HG1 ILE 19 3.716 3.064 2.893
125 HG13 ILE 19 3HG1 ILE 19 1.990 2.890 2.558
126 HG21 ILE 19 1HG2 ILE 19 4.504 5.396 0.162
127 HG22 ILE 19 2HG2 ILE 19 4.920 5.048 1.859
128 HG23 ILE 19 3HG2 ILE 19 5.060 3.785 0.623
129 HD11 ILE 19 1HD1 ILE 19 4.184 1.781 0.776
130 HD12 ILE 19 2HD1 ILE 19 3.230 0.862 1.949
131 HD13 ILE 19 3HD1 ILE 19 2.434 1.608 0.540
132 H CYS 20 H CYS 20 1.624 6.327 -0.419
133 HA CYS 20 HA CYS 20 3.192 8.882 -0.123
134 HB2 CYS 20 2HB CYS 20 2.702 9.169 -2.463
135 HB3 CYS 20 3HB CYS 20 3.553 7.650 -2.159
136 H LEU 21 H LEU 21 0.152 7.780 0.770
137 HA LEU 21 HA LEU 21 -1.809 8.704 1.263
138 HB2 LEU 21 2HB LEU 21 0.000 11.091 1.717
139 HB3 LEU 21 3HB LEU 21 -1.653 10.966 2.330
140 HG LEU 21 HG LEU 21 0.482 8.876 2.969
141 HD11 LEU 21 1HD1 LEU 21 1.262 11.037 3.769
142 HD12 LEU 21 2HD1 LEU 21 -0.301 11.328 4.577
143 HD13 LEU 21 3HD1 LEU 21 0.764 10.006 5.119
144 HD21 LEU 21 1HD2 LEU 21 -1.020 8.364 4.859
145 HD22 LEU 21 2HD2 LEU 21 -2.166 9.605 4.307
146 HD23 LEU 21 3HD2 LEU 21 -1.859 8.154 3.324
147 H SER 22 H SER 22 -1.121 8.699 -1.531
148 HA SER 22 HA SER 22 -2.792 10.936 -2.552
149 HB2 SER 22 2HB SER 22 -0.068 10.085 -3.235
150 HB3 SER 22 3HB SER 22 -1.139 10.003 -4.641
151 HG SER 22 HG SER 22 -1.571 12.135 -4.457
152 H ILE 23 H ILE 23 -4.135 10.369 -4.401
153 HA ILE 23 HA ILE 23 -5.297 7.777 -4.121
154 HB ILE 23 HB ILE 23 -5.701 10.264 -5.778
155 HG12 ILE 23 2HG1 ILE 23 -6.439 10.090 -3.375
156 HG13 ILE 23 3HG1 ILE 23 -7.697 10.515 -4.521
157 HG21 ILE 23 1HG2 ILE 23 -6.279 8.702 -7.407
158 HG22 ILE 23 2HG2 ILE 23 -7.196 7.676 -6.275
159 HG23 ILE 23 3HG2 ILE 23 -7.775 9.294 -6.731
160 HD11 ILE 23 1HD1 ILE 23 -8.634 8.266 -4.447
161 HD12 ILE 23 2HD1 ILE 23 -7.265 7.674 -3.486
162 HD13 ILE 23 3HD1 ILE 23 -8.383 8.819 -2.782
163 H LEU 24 H LEU 24 -5.583 6.295 -5.711
164 HA LEU 24 HA LEU 24 -3.225 5.749 -7.393
165 HB2 LEU 24 2HB LEU 24 -5.684 4.126 -6.558
166 HB3 LEU 24 3HB LEU 24 -4.263 3.459 -7.371
167 HG LEU 24 HG LEU 24 -4.150 4.779 -4.610
168 HD11 LEU 24 1HD1 LEU 24 -4.194 1.874 -5.430
169 HD12 LEU 24 2HD1 LEU 24 -3.953 2.517 -3.768
170 HD13 LEU 24 3HD1 LEU 24 -5.500 2.760 -4.596
171 HD21 LEU 24 1HD2 LEU 24 -2.040 4.965 -5.569
172 HD22 LEU 24 2HD2 LEU 24 -1.954 3.414 -4.684
173 HD23 LEU 24 3HD2 LEU 24 -2.169 3.412 -6.440
174 H GLU 25 H GLU 25 -4.792 4.004 -9.193
175 HA GLU 25 HA GLU 25 -6.989 5.431 -10.266
176 HB2 GLU 25 2HB GLU 25 -6.055 5.640 -12.567
177 HB3 GLU 25 3HB GLU 25 -5.241 6.704 -11.414
178 HG2 GLU 25 2HG GLU 25 -3.278 5.450 -11.392
179 HG3 GLU 25 3HG GLU 25 -4.095 3.973 -11.915
180 H GLU 26 H GLU 26 -7.233 3.955 -12.673
181 HA GLU 26 HA GLU 26 -6.885 1.137 -11.774
182 HB2 GLU 26 2HB GLU 26 -9.235 1.884 -11.820
183 HB3 GLU 26 3HB GLU 26 -9.074 2.338 -13.522
184 HG2 GLU 26 2HG GLU 26 -8.665 0.003 -14.146
185 HG3 GLU 26 3HG GLU 26 -8.552 -0.468 -12.447
186 H GLY 27 H GLY 27 -4.761 1.169 -12.609
187 HA2 GLY 27 2HA GLY 27 -4.317 0.282 -15.223
188 HA3 GLY 27 3HA GLY 27 -4.129 2.050 -15.252
189 H GLU 28 H GLU 28 -3.040 2.668 -12.941
190 HA GLU 28 HA GLU 28 -0.369 2.253 -12.953
191 HB2 GLU 28 2HB GLU 28 -2.348 3.120 -10.919
192 HB3 GLU 28 3HB GLU 28 -0.871 2.539 -10.210
193 HG2 GLU 28 2HG GLU 28 -0.698 4.503 -12.509
194 HG3 GLU 28 3HG GLU 28 -1.057 5.062 -10.864
195 H ASP 29 H ASP 29 1.119 1.250 -11.599
196 HA ASP 29 HA ASP 29 0.634 -1.625 -11.229
197 HB2 ASP 29 2HB ASP 29 3.044 0.179 -10.842
198 HB3 ASP 29 3HB ASP 29 3.009 -1.489 -10.271
199 H VAL 30 H VAL 30 -0.155 -2.440 -9.383
200 HA VAL 30 HA VAL 30 0.104 -0.953 -6.862
201 HB VAL 30 HB VAL 30 -2.231 -1.346 -6.328
202 HG11 VAL 30 1HG1 VAL 30 -1.385 0.761 -7.591
203 HG12 VAL 30 2HG1 VAL 30 -2.268 0.094 -8.976
204 HG13 VAL 30 3HG1 VAL 30 -3.130 0.471 -7.476
205 HG21 VAL 30 1HG2 VAL 30 -3.871 -2.015 -8.025
206 HG22 VAL 30 2HG2 VAL 30 -2.573 -2.306 -9.197
207 HG23 VAL 30 3HG2 VAL 30 -2.706 -3.318 -7.738
208 H ARG 31 H ARG 31 -1.043 -2.641 -5.145
209 HA ARG 31 HA ARG 31 -0.096 -5.328 -5.605
210 HB2 ARG 31 2HB ARG 31 1.507 -3.203 -4.245
211 HB3 ARG 31 3HB ARG 31 1.319 -4.656 -3.270
212 HG2 ARG 31 2HG ARG 31 2.224 -4.890 -6.148
213 HG3 ARG 31 3HG ARG 31 3.373 -4.476 -4.878
214 HD2 ARG 31 2HD ARG 31 3.142 -6.486 -3.765
215 HD3 ARG 31 3HD ARG 31 1.540 -6.827 -4.451
216 HE ARG 31 HE ARG 31 3.099 -6.842 -6.659
217 HH11 ARG 31 1HH1 ARG 31 4.399 -10.111 -6.562
218 HH12 ARG 31 2HH1 ARG 31 3.952 -8.787 -7.573
219 HH21 ARG 31 1HH2 ARG 31 4.109 -9.938 -4.207
220 HH22 ARG 31 2HH2 ARG 31 3.442 -8.486 -3.553
221 H ARG 32 H ARG 32 -0.229 -6.495 -3.300
222 HA ARG 32 HA ARG 32 -2.475 -5.422 -1.749
223 HB2 ARG 32 2HB ARG 32 -3.524 -6.943 -3.339
224 HB3 ARG 32 3HB ARG 32 -2.244 -8.138 -3.122
225 HG2 ARG 32 2HG ARG 32 -4.237 -8.911 -2.000
226 HG3 ARG 32 3HG ARG 32 -2.998 -8.582 -0.810
227 HD2 ARG 32 2HD ARG 32 -4.844 -7.579 0.195
228 HD3 ARG 32 3HD ARG 32 -4.151 -6.201 -0.631
229 HE ARG 32 HE ARG 32 -5.894 -6.115 -2.106
230 HH11 ARG 32 1HH1 ARG 32 -8.761 -8.148 -2.404
231 HH12 ARG 32 2HH1 ARG 32 -7.996 -6.694 -2.922
232 HH21 ARG 32 1HH2 ARG 32 -7.660 -9.577 -0.862
233 HH22 ARG 32 2HH2 ARG 32 -6.095 -9.134 -0.283
234 H LEU 33 H LEU 33 -2.459 -6.215 0.450
235 HA LEU 33 HA LEU 33 -0.311 -7.988 1.317
236 HB2 LEU 33 2HB LEU 33 -0.318 -6.285 3.386
237 HB3 LEU 33 3HB LEU 33 0.784 -6.063 2.033
238 HG LEU 33 HG LEU 33 -1.923 -4.756 1.901
239 HD11 LEU 33 1HD1 LEU 33 -1.036 -2.818 3.180
240 HD12 LEU 33 2HD1 LEU 33 -1.309 -4.258 4.168
241 HD13 LEU 33 3HD1 LEU 33 0.344 -3.809 3.692
242 HD21 LEU 33 1HD2 LEU 33 -0.008 -4.582 0.111
243 HD22 LEU 33 2HD2 LEU 33 -0.708 -3.064 0.690
244 HD23 LEU 33 3HD2 LEU 33 0.853 -3.634 1.326
245 HA PRO 34 HA PRO 34 -3.439 -9.991 3.359
246 HB2 PRO 34 2HB PRO 34 -2.391 -10.802 5.777
247 HB3 PRO 34 3HB PRO 34 -1.911 -11.474 4.188
248 HG2 PRO 34 2HG PRO 34 -0.503 -9.362 5.826
249 HG3 PRO 34 3HG PRO 34 0.198 -10.751 4.929
250 HD2 PRO 34 2HD PRO 34 0.124 -8.177 4.003
251 HD3 PRO 34 3HD PRO 34 0.123 -9.555 2.912
252 H CYS 35 H CYS 35 -2.133 -7.226 5.105
253 HA CYS 35 HA CYS 35 -4.500 -6.814 6.865
254 HB2 CYS 35 2HB CYS 35 -2.175 -6.086 7.389
255 HB3 CYS 35 3HB CYS 35 -2.263 -4.990 6.006
256 H MET 36 H MET 36 -5.021 -7.330 3.945
257 HA MET 36 HA MET 36 -6.417 -6.584 2.348
258 HB2 MET 36 2HB MET 36 -8.618 -6.011 3.268
259 HB3 MET 36 3HB MET 36 -7.881 -7.395 4.067
260 HG2 MET 36 2HG MET 36 -7.311 -6.118 6.007
261 HG3 MET 36 3HG MET 36 -7.716 -4.588 5.226
262 HE1 MET 36 1HE MET 36 -10.005 -3.481 5.242
263 HE2 MET 36 2HE MET 36 -10.341 -4.633 3.931
264 HE3 MET 36 3HE MET 36 -11.526 -4.404 5.238
265 H HIS 37 H HIS 37 -4.424 -4.824 2.340
266 HA HIS 37 HA HIS 37 -5.777 -2.194 2.077
267 HB2 HIS 37 1HB HIS 37 -3.430 -3.056 3.682
268 HB3 HIS 37 2HB HIS 37 -3.104 -1.688 2.640
269 HD2 HIS 37 2HD HIS 37 -5.638 0.038 2.773
270 HE1 HIS 37 1HE HIS 37 -5.184 0.087 6.998
271 HE2 HIS 37 2HE HIS 37 -6.291 1.231 5.000
272 H LEU 38 H LEU 38 -5.658 -1.389 0.047
273 HA LEU 38 HA LEU 38 -4.038 -2.806 -1.964
274 HB2 LEU 38 2HB LEU 38 -6.517 -2.138 -2.172
275 HB3 LEU 38 3HB LEU 38 -5.978 -0.467 -2.282
276 HG LEU 38 HG LEU 38 -5.262 -2.750 -4.183
277 HD11 LEU 38 1HD1 LEU 38 -7.605 -1.946 -4.351
278 HD12 LEU 38 2HD1 LEU 38 -7.023 -0.282 -4.556
279 HD13 LEU 38 3HD1 LEU 38 -6.669 -1.508 -5.786
280 HD21 LEU 38 1HD2 LEU 38 -4.445 -0.736 -5.605
281 HD22 LEU 38 2HD2 LEU 38 -4.393 0.141 -4.062
282 HD23 LEU 38 3HD2 LEU 38 -3.395 -1.314 -4.307
283 H PHE 39 H PHE 39 -1.960 -2.028 -2.335
284 HA PHE 39 HA PHE 39 -1.400 0.854 -1.719
285 HB2 PHE 39 2HB PHE 39 0.358 -1.609 -1.298
286 HB3 PHE 39 3HB PHE 39 0.980 0.022 -1.349
287 HD1 PHE 39 1HD PHE 39 1.906 -1.110 0.777
288 HD2 PHE 39 2HD PHE 39 -2.104 0.381 0.429
289 HE1 PHE 39 1HE PHE 39 1.754 -0.996 3.232
290 HE2 PHE 39 2HE PHE 39 -2.260 0.527 2.874
291 HZ PHE 39 HZ PHE 39 -0.347 -0.179 4.301
292 H HIS 40 H HIS 40 0.493 1.664 -3.037
293 HA HIS 40 HA HIS 40 0.376 0.876 -5.870
294 HB2 HIS 40 1HB HIS 40 2.015 2.699 -4.150
295 HB3 HIS 40 2HB HIS 40 2.726 2.187 -5.667
296 HD2 HIS 40 2HD HIS 40 0.744 2.610 -7.867
297 HE1 HIS 40 1HE HIS 40 0.684 6.611 -6.441
298 HE2 HIS 40 2HE HIS 40 0.356 5.086 -8.474
299 H GLN 41 H GLN 41 2.212 -0.060 -6.988
300 HA GLN 41 HA GLN 41 3.525 -2.212 -5.631
301 HB2 GLN 41 2HB GLN 41 2.861 -2.150 -8.001
302 HB3 GLN 41 3HB GLN 41 4.122 -0.956 -8.340
303 HG2 GLN 41 2HG GLN 41 5.870 -2.491 -7.920
304 HG3 GLN 41 3HG GLN 41 4.843 -3.571 -6.975
305 HE21 GLN 41 1HE2 GLN 41 2.608 -4.077 -8.651
306 HE22 GLN 41 2HE2 GLN 41 3.239 -4.735 -10.155
307 H VAL 42 H VAL 42 4.950 0.800 -7.122
308 HA VAL 42 HA VAL 42 7.503 0.316 -6.067
309 HB VAL 42 HB VAL 42 6.255 3.021 -6.709
310 HG11 VAL 42 1HG1 VAL 42 8.375 3.271 -5.464
311 HG12 VAL 42 2HG1 VAL 42 9.170 2.121 -6.562
312 HG13 VAL 42 3HG1 VAL 42 8.614 3.699 -7.162
313 HG21 VAL 42 1HG2 VAL 42 7.383 2.684 -8.926
314 HG22 VAL 42 2HG2 VAL 42 7.780 1.022 -8.442
315 HG23 VAL 42 3HG2 VAL 42 6.087 1.521 -8.653
316 H CYS 43 H CYS 43 4.823 2.219 -4.601
317 HA CYS 43 HA CYS 43 6.218 3.114 -2.256
318 HB2 CYS 43 2HB CYS 43 3.302 2.333 -2.475
319 HB3 CYS 43 3HB CYS 43 4.048 3.392 -1.308
320 H VAL 44 H VAL 44 4.263 0.009 -2.759
321 HA VAL 44 HA VAL 44 4.892 -0.721 -0.092
322 HB VAL 44 HB VAL 44 2.866 -1.416 -1.439
323 HG11 VAL 44 1HG1 VAL 44 4.820 -3.580 -2.335
324 HG12 VAL 44 2HG1 VAL 44 3.065 -3.614 -2.506
325 HG13 VAL 44 3HG1 VAL 44 4.016 -2.398 -3.387
326 HG21 VAL 44 1HG2 VAL 44 2.569 -3.336 -0.128
327 HG22 VAL 44 2HG2 VAL 44 4.321 -3.678 -0.057
328 HG23 VAL 44 3HG2 VAL 44 3.665 -2.302 0.831
329 H ASP 45 H ASP 45 6.637 -1.081 -3.083
330 HA ASP 45 HA ASP 45 8.229 -3.348 -2.366
331 HB2 ASP 45 2HB ASP 45 8.524 -1.039 -4.282
332 HB3 ASP 45 3HB ASP 45 9.987 -1.898 -3.826
333 H GLN 46 H GLN 46 8.966 0.191 -2.046
334 HA GLN 46 HA GLN 46 11.176 -0.442 -0.285
335 HB2 GLN 46 2HB GLN 46 9.712 2.187 -0.782
336 HB3 GLN 46 3HB GLN 46 11.065 2.006 0.349
337 HG2 GLN 46 2HG GLN 46 12.405 0.989 -1.578
338 HG3 GLN 46 3HG GLN 46 11.111 1.534 -2.656
339 HE21 GLN 46 1HE2 GLN 46 12.177 3.237 -3.790
340 HE22 GLN 46 2HE2 GLN 46 12.933 4.575 -2.933
341 H ALA 47 H ALA 47 7.734 0.050 0.362
342 HA ALA 47 HA ALA 47 7.954 0.358 3.169
343 HB1 ALA 47 1HB ALA 47 5.888 -1.285 1.657
344 HB2 ALA 47 2HB ALA 47 5.696 -0.536 3.254
345 HB3 ALA 47 3HB ALA 47 5.862 0.488 1.805
346 H LEU 48 H LEU 48 7.533 -2.675 1.331
347 HA LEU 48 HA LEU 48 7.740 -4.466 3.451
348 HB2 LEU 48 2HB LEU 48 6.747 -4.832 1.215
349 HB3 LEU 48 3HB LEU 48 8.345 -4.878 0.483
350 HG LEU 48 HG LEU 48 7.606 -6.780 2.740
351 HD11 LEU 48 1HD1 LEU 48 6.819 -8.398 1.047
352 HD12 LEU 48 2HD1 LEU 48 5.801 -6.951 1.069
353 HD13 LEU 48 3HD1 LEU 48 7.002 -7.162 -0.222
354 HD21 LEU 48 1HD2 LEU 48 9.164 -8.306 1.501
355 HD22 LEU 48 2HD2 LEU 48 9.477 -7.010 0.328
356 HD23 LEU 48 3HD2 LEU 48 9.980 -6.836 2.022
357 H ILE 49 H ILE 49 10.345 -3.376 1.139
358 HA ILE 49 HA ILE 49 12.292 -5.055 2.387
359 HB ILE 49 HB ILE 49 13.955 -3.898 1.201
360 HG12 ILE 49 2HG1 ILE 49 12.965 -1.851 -0.294
361 HG13 ILE 49 3HG1 ILE 49 12.156 -1.598 1.265
362 HG21 ILE 49 1HG2 ILE 49 13.236 -4.176 -1.056
363 HG22 ILE 49 2HG2 ILE 49 12.438 -5.402 -0.055
364 HG23 ILE 49 3HG2 ILE 49 11.537 -3.985 -0.613
365 HD11 ILE 49 1HD1 ILE 49 14.344 -1.647 2.417
366 HD12 ILE 49 2HD1 ILE 49 15.152 -1.893 0.854
367 HD13 ILE 49 3HD1 ILE 49 14.279 -0.380 1.177
368 H THR 50 H THR 50 11.141 -1.748 3.204
369 HA THR 50 HA THR 50 13.204 -1.306 5.115
370 HB THR 50 HB THR 50 10.450 -0.128 4.635
371 HG1 THR 50 1HG THR 50 13.119 0.827 4.455
372 HG21 THR 50 1HG2 THR 50 11.033 1.657 6.261
373 HG22 THR 50 2HG2 THR 50 10.705 0.102 7.034
374 HG23 THR 50 3HG2 THR 50 12.387 0.659 6.845
375 H ASN 51 H ASN 51 9.951 -2.823 5.304
376 HA ASN 51 HA ASN 51 10.802 -4.675 7.242
377 HB2 ASN 51 2HB ASN 51 9.479 -2.207 8.299
378 HB3 ASN 51 3HB ASN 51 8.677 -3.710 8.751
379 HD21 ASN 51 1HD2 ASN 51 11.017 -1.617 9.869
380 HD22 ASN 51 2HD2 ASN 51 11.883 -2.790 10.848
381 H LYS 52 H LYS 52 9.315 -6.438 7.101
382 HA LYS 52 HA LYS 52 7.132 -6.082 5.150
383 HB2 LYS 52 2HB LYS 52 7.795 -8.552 6.804
384 HB3 LYS 52 3HB LYS 52 6.788 -8.450 5.367
385 HG2 LYS 52 2HG LYS 52 8.599 -9.062 4.196
386 HG3 LYS 52 3HG LYS 52 9.227 -7.426 4.451
387 HD2 LYS 52 2HD LYS 52 10.370 -8.199 6.527
388 HD3 LYS 52 3HD LYS 52 9.626 -9.797 6.329
389 HE2 LYS 52 2HE LYS 52 10.791 -9.898 4.051
390 HE3 LYS 52 3HE LYS 52 11.768 -8.514 4.603
391 HZ1 LYS 52 1HZ LYS 52 12.835 -10.633 5.152
392 HZ2 LYS 52 2HZ LYS 52 12.248 -10.007 6.607
393 HZ3 LYS 52 3HZ LYS 52 11.459 -11.163 5.853
394 H LYS 53 H LYS 53 6.164 -4.325 6.775
395 HA LYS 53 HA LYS 53 4.012 -5.818 8.081
396 HB2 LYS 53 2HB LYS 53 4.210 -4.837 10.221
397 HB3 LYS 53 3HB LYS 53 5.763 -5.562 9.828
398 HG2 LYS 53 2HG LYS 53 6.481 -3.147 9.119
399 HG3 LYS 53 3HG LYS 53 5.009 -2.629 9.963
400 HD2 LYS 53 2HD LYS 53 6.036 -4.334 11.828
401 HD3 LYS 53 3HD LYS 53 7.543 -3.805 11.061
402 HE2 LYS 53 2HE LYS 53 6.950 -1.448 11.505
403 HE3 LYS 53 3HE LYS 53 5.371 -1.951 12.132
404 HZ1 LYS 53 1HZ LYS 53 6.890 -1.556 13.928
405 HZ2 LYS 53 2HZ LYS 53 6.539 -3.167 13.874
406 HZ3 LYS 53 3HZ LYS 53 7.987 -2.623 13.321
407 H CYS 54 H CYS 54 2.099 -4.736 7.920
408 HA CYS 54 HA CYS 54 1.807 -2.610 5.975
409 HB2 CYS 54 2HB CYS 54 0.085 -4.281 6.493
410 HB3 CYS 54 3HB CYS 54 -0.043 -3.647 8.133
411 HA PRO 55 HA PRO 55 3.475 0.275 8.967
412 HB2 PRO 55 2HB PRO 55 3.412 2.603 7.480
413 HB3 PRO 55 3HB PRO 55 4.609 1.293 7.242
414 HG2 PRO 55 2HG PRO 55 2.047 1.775 5.697
415 HG3 PRO 55 3HG PRO 55 3.681 1.410 5.055
416 HD2 PRO 55 2HD PRO 55 1.786 -0.516 5.359
417 HD3 PRO 55 3HD PRO 55 3.516 -0.865 5.679
418 H ILE 56 H ILE 56 0.485 1.042 7.199
419 HA ILE 56 HA ILE 56 -0.473 2.927 9.157
420 HB ILE 56 HB ILE 56 -1.076 2.976 6.775
421 HG12 ILE 56 2HG1 ILE 56 -3.489 3.339 6.907
422 HG13 ILE 56 3HG1 ILE 56 -3.561 2.572 8.491
423 HG21 ILE 56 1HG2 ILE 56 -2.646 0.451 7.348
424 HG22 ILE 56 2HG2 ILE 56 -2.742 1.393 5.855
425 HG23 ILE 56 3HG2 ILE 56 -1.228 0.592 6.287
426 HD11 ILE 56 1HD1 ILE 56 -1.899 5.049 7.827
427 HD12 ILE 56 2HD1 ILE 56 -3.517 5.083 8.554
428 HD13 ILE 56 3HD1 ILE 56 -2.169 4.359 9.448
429 H CYS 57 H CYS 57 -0.195 -0.487 9.269
430 HA CYS 57 HA CYS 57 -2.280 -0.711 11.450
431 HB2 CYS 57 2HB CYS 57 -1.548 -2.879 9.459
432 HB3 CYS 57 3HB CYS 57 -2.757 -2.921 10.744
433 H ARG 58 H ARG 58 -0.060 -3.170 10.473
434 HA ARG 58 HA ARG 58 2.209 -2.953 11.561
435 HB2 ARG 58 2HB ARG 58 0.555 -2.767 13.936
436 HB3 ARG 58 3HB ARG 58 1.388 -4.298 13.989
437 HG2 ARG 58 2HG ARG 58 3.549 -3.225 13.508
438 HG3 ARG 58 3HG ARG 58 2.764 -1.633 13.435
439 HD2 ARG 58 2HD ARG 58 2.712 -3.483 15.855
440 HD3 ARG 58 3HD ARG 58 3.875 -2.156 15.634
441 HE ARG 58 HE ARG 58 1.336 -1.055 15.259
442 HH11 ARG 58 1HH1 ARG 58 0.737 -0.122 18.618
443 HH12 ARG 58 2HH1 ARG 58 0.331 0.170 16.965
444 HH21 ARG 58 1HH2 ARG 58 2.368 -1.777 19.147
445 HH22 ARG 58 2HH2 ARG 58 3.099 -2.664 17.858
446 H VAL 59 H VAL 59 -0.483 -5.041 11.024
447 HA VAL 59 HA VAL 59 0.538 -7.534 11.695
448 HB VAL 59 HB VAL 59 -0.974 -6.975 9.127
449 HG11 VAL 59 1HG1 VAL 59 -1.794 -9.143 9.247
450 HG12 VAL 59 2HG1 VAL 59 -0.167 -9.387 9.870
451 HG13 VAL 59 3HG1 VAL 59 -1.531 -9.281 10.997
452 HG21 VAL 59 1HG2 VAL 59 -3.077 -7.279 10.517
453 HG22 VAL 59 2HG2 VAL 59 -2.078 -7.053 11.965
454 HG23 VAL 59 3HG2 VAL 59 -2.263 -5.743 10.767
455 H ASP 60 H ASP 60 1.951 -8.974 10.761
456 HA ASP 60 HA ASP 60 4.032 -8.153 8.984
457 HB2 ASP 60 2HB ASP 60 4.333 -9.976 10.551
458 HB3 ASP 60 3HB ASP 60 2.956 -10.851 9.862
459 H ILE 61 H ILE 61 4.277 -8.614 6.797
460 HA ILE 61 HA ILE 61 1.848 -9.522 5.341
461 HB ILE 61 HB ILE 61 2.354 -8.015 3.580
462 HG12 ILE 61 2HG1 ILE 61 4.714 -7.058 5.228
463 HG13 ILE 61 3HG1 ILE 61 4.837 -8.043 3.760
464 HG21 ILE 61 1HG2 ILE 61 2.552 -6.381 6.121
465 HG22 ILE 61 2HG2 ILE 61 1.676 -5.981 4.619
466 HG23 ILE 61 3HG2 ILE 61 1.075 -7.264 5.684
467 HD11 ILE 61 1HD1 ILE 61 5.207 -5.796 3.148
468 HD12 ILE 61 2HD1 ILE 61 3.603 -6.316 2.531
469 HD13 ILE 61 3HD1 ILE 61 3.722 -5.259 3.970
470 H GLU 62 H GLU 62 5.158 -10.118 5.913
471 HA GLU 62 HA GLU 62 6.001 -11.039 3.396
472 HB2 GLU 62 2HB GLU 62 7.401 -10.844 5.537
473 HB3 GLU 62 3HB GLU 62 6.763 -12.438 5.986
474 HG2 GLU 62 2HG GLU 62 7.610 -13.358 3.818
475 HG3 GLU 62 3HG GLU 62 8.172 -11.750 3.361
476 H ALA 63 H ALA 63 5.641 -12.892 2.193
477 HA ALA 63 HA ALA 63 3.227 -14.359 2.739
478 HB1 ALA 63 1HB ALA 63 5.540 -14.951 0.829
479 HB2 ALA 63 2HB ALA 63 3.946 -15.735 0.798
480 HB3 ALA 63 3HB ALA 63 4.084 -13.999 0.442
481 H GLN 64 H GLN 64 2.983 -16.140 3.983
482 HA GLN 64 HA GLN 64 4.541 -16.774 6.021
483 HB2 GLN 64 2HB GLN 64 2.361 -18.163 4.622
484 HB3 GLN 64 3HB GLN 64 3.436 -19.296 5.443
485 HG2 GLN 64 2HG GLN 64 3.230 -17.989 7.542
486 HG3 GLN 64 3HG GLN 64 2.081 -16.903 6.742
487 HE21 GLN 64 1HE2 GLN 64 2.111 -19.404 8.900
488 HE22 GLN 64 2HE2 GLN 64 0.601 -20.170 8.425
489 H LEU 65 H LEU 65 6.649 -17.135 6.115
490 HA LEU 65 HA LEU 65 7.894 -19.129 4.301
491 HB2 LEU 65 2HB LEU 65 8.503 -16.840 3.740
492 HB3 LEU 65 3HB LEU 65 8.823 -16.460 5.432
493 HG LEU 65 HG LEU 65 10.724 -18.091 5.426
494 HD11 LEU 65 1HD1 LEU 65 11.589 -18.871 3.238
495 HD12 LEU 65 2HD1 LEU 65 10.007 -19.574 3.587
496 HD13 LEU 65 3HD1 LEU 65 10.140 -18.226 2.435
497 HD21 LEU 65 1HD2 LEU 65 12.239 -16.658 4.141
498 HD22 LEU 65 2HD2 LEU 65 10.853 -15.936 3.280
499 HD23 LEU 65 3HD2 LEU 65 11.056 -15.675 5.021
500 HA PRO 66 HA PRO 66 8.718 -20.654 8.510
501 HB2 PRO 66 2HB PRO 66 9.233 -23.270 7.955
502 HB3 PRO 66 3HB PRO 66 7.590 -22.577 7.851
503 HG2 PRO 66 2HG PRO 66 9.563 -22.977 5.576
504 HG3 PRO 66 3HG PRO 66 7.846 -23.495 5.654
505 HD2 PRO 66 2HD PRO 66 8.612 -21.166 4.454
506 HD3 PRO 66 3HD PRO 66 7.071 -21.285 5.355
507 H SER 67 H SER 67 10.560 -19.014 7.982
508 HA SER 67 HA SER 67 13.095 -20.423 8.467
509 HB2 SER 67 2HB SER 67 12.850 -18.226 6.362
510 HB3 SER 67 3HB SER 67 14.346 -18.981 6.941
511 HG SER 67 HG SER 67 13.717 -19.906 5.032
512 H GLU 68 H GLU 68 11.669 -17.111 7.900
513 HA GLU 68 HA GLU 68 12.364 -16.238 10.572
514 HB2 GLU 68 2HB GLU 68 13.867 -14.457 9.769
515 HB3 GLU 68 3HB GLU 68 14.520 -16.038 9.387
516 HG2 GLU 68 2HG GLU 68 12.896 -15.220 7.134
517 HG3 GLU 68 3HG GLU 68 13.890 -13.847 7.601
518 H SER 69 H SER 69 12.085 -13.435 10.005
519 HA SER 69 HA SER 69 9.949 -12.994 8.126
520 HB2 SER 69 2HB SER 69 8.468 -11.969 9.908
521 HB3 SER 69 3HB SER 69 8.555 -13.741 9.966
522 HG SER 69 HG SER 69 10.292 -12.097 11.456
Start of MODEL 14
1 H1 MET 1 H1 MET 1 -18.574 38.815 -20.030
2 H2 MET 1 H2 MET 1 -19.522 38.914 -21.377
3 H3 MET 1 H3 MET 1 -18.017 38.240 -21.466
4 HA MET 1 HA MET 1 -17.992 40.402 -22.427
5 HB2 MET 1 2HB MET 1 -19.104 41.179 -19.727
6 HB3 MET 1 3HB MET 1 -18.163 42.336 -20.698
7 HG2 MET 1 2HG MET 1 -19.638 42.164 -22.557
8 HG3 MET 1 3HG MET 1 -20.515 40.807 -21.848
9 HE1 MET 1 1HE MET 1 -20.631 44.719 -22.312
10 HE2 MET 1 2HE MET 1 -21.523 43.454 -23.191
11 HE3 MET 1 3HE MET 1 -22.387 44.559 -22.099
12 H LYS 2 H LYS 2 -16.805 41.232 -19.147
13 HA LYS 2 HA LYS 2 -14.139 40.205 -20.006
14 HB2 LYS 2 2HB LYS 2 -14.372 42.670 -20.435
15 HB3 LYS 2 3HB LYS 2 -14.749 42.894 -18.722
16 HG2 LYS 2 2HG LYS 2 -12.463 41.607 -18.325
17 HG3 LYS 2 3HG LYS 2 -12.142 41.998 -20.008
18 HD2 LYS 2 2HD LYS 2 -12.138 44.342 -19.556
19 HD3 LYS 2 3HD LYS 2 -12.950 44.127 -17.982
20 HE2 LYS 2 2HE LYS 2 -11.061 43.031 -17.015
21 HE3 LYS 2 3HE LYS 2 -10.246 42.879 -18.578
22 HZ1 LYS 2 1HZ LYS 2 -9.973 45.249 -18.630
23 HZ2 LYS 2 2HZ LYS 2 -10.794 45.439 -17.213
24 HZ3 LYS 2 3HZ LYS 2 -9.344 44.663 -17.229
25 H GLN 3 H GLN 3 -14.853 38.360 -18.608
26 HA GLN 3 HA GLN 3 -13.818 38.774 -15.947
27 HB2 GLN 3 2HB GLN 3 -16.730 38.142 -16.433
28 HB3 GLN 3 3HB GLN 3 -15.895 37.225 -15.176
29 HG2 GLN 3 2HG GLN 3 -15.185 39.279 -14.049
30 HG3 GLN 3 3HG GLN 3 -15.980 40.262 -15.285
31 HE21 GLN 3 1HE2 GLN 3 -16.434 38.968 -12.199
32 HE22 GLN 3 2HE2 GLN 3 -18.189 39.073 -12.205
33 H ASP 4 H ASP 4 -13.487 36.667 -14.946
34 HA ASP 4 HA ASP 4 -12.585 34.594 -16.789
35 HB2 ASP 4 2HB ASP 4 -11.683 33.588 -14.717
36 HB3 ASP 4 3HB ASP 4 -11.157 35.247 -14.929
37 H GLY 5 H GLY 5 -13.148 32.319 -15.198
38 HA2 GLY 5 2HA GLY 5 -16.096 32.098 -15.223
39 HA3 GLY 5 3HA GLY 5 -15.125 31.017 -16.250
40 H GLU 6 H GLU 6 -15.826 29.116 -14.920
41 HA GLU 6 HA GLU 6 -14.308 28.945 -12.395
42 HB2 GLU 6 2HB GLU 6 -17.275 28.339 -12.750
43 HB3 GLU 6 3HB GLU 6 -16.288 27.659 -11.449
44 HG2 GLU 6 2HG GLU 6 -15.650 30.019 -10.790
45 HG3 GLU 6 3HG GLU 6 -16.886 30.600 -11.921
46 H GLU 7 H GLU 7 -14.205 26.581 -11.687
47 HA GLU 7 HA GLU 7 -14.527 24.621 -13.781
48 HB2 GLU 7 2HB GLU 7 -12.303 25.524 -14.262
49 HB3 GLU 7 3HB GLU 7 -11.808 25.335 -12.573
50 HG2 GLU 7 2HG GLU 7 -11.597 23.035 -12.742
51 HG3 GLU 7 3HG GLU 7 -12.897 22.893 -13.930
52 H GLY 8 H GLY 8 -15.367 22.949 -12.702
53 HA2 GLY 8 2HA GLY 8 -15.456 22.990 -9.739
54 HA3 GLY 8 3HA GLY 8 -16.467 22.009 -10.820
55 H THR 9 H THR 9 -15.640 20.432 -8.956
56 HA THR 9 HA THR 9 -13.367 18.911 -10.062
57 HB THR 9 HB THR 9 -12.510 18.605 -7.743
58 HG1 THR 9 1HG THR 9 -14.310 19.101 -6.546
59 HG21 THR 9 1HG2 THR 9 -12.645 21.571 -8.432
60 HG22 THR 9 2HG2 THR 9 -11.417 20.742 -7.462
61 HG23 THR 9 3HG2 THR 9 -11.543 20.407 -9.204
62 H GLU 10 H GLU 10 -13.333 16.757 -8.713
63 HA GLU 10 HA GLU 10 -16.098 15.782 -8.226
64 HB2 GLU 10 2HB GLU 10 -15.256 13.641 -9.206
65 HB3 GLU 10 3HB GLU 10 -15.381 14.949 -10.373
66 HG2 GLU 10 2HG GLU 10 -12.729 14.308 -9.017
67 HG3 GLU 10 3HG GLU 10 -13.292 13.404 -10.418
68 H GLU 11 H GLU 11 -16.102 13.815 -6.720
69 HA GLU 11 HA GLU 11 -14.295 14.119 -4.521
70 HB2 GLU 11 2HB GLU 11 -16.119 11.813 -5.381
71 HB3 GLU 11 3HB GLU 11 -15.106 11.781 -3.940
72 HG2 GLU 11 2HG GLU 11 -16.963 12.539 -2.940
73 HG3 GLU 11 3HG GLU 11 -16.286 14.098 -3.394
74 H ASP 12 H ASP 12 -12.538 12.797 -3.890
75 HA ASP 12 HA ASP 12 -11.605 10.757 -5.757
76 HB2 ASP 12 2HB ASP 12 -10.782 13.207 -6.399
77 HB3 ASP 12 3HB ASP 12 -9.654 12.975 -5.070
78 H THR 13 H THR 13 -12.139 9.514 -3.884
79 HA THR 13 HA THR 13 -9.924 9.431 -1.934
80 HB THR 13 HB THR 13 -12.483 10.708 -1.368
81 HG1 THR 13 1HG THR 13 -10.546 11.673 -1.212
82 HG21 THR 13 1HG2 THR 13 -11.446 8.886 0.830
83 HG22 THR 13 2HG2 THR 13 -12.699 10.134 0.959
84 HG23 THR 13 3HG2 THR 13 -12.996 8.702 -0.037
85 H GLU 14 H GLU 14 -11.981 7.597 -3.736
86 HA GLU 14 HA GLU 14 -12.566 5.471 -1.966
87 HB2 GLU 14 2HB GLU 14 -12.341 5.670 -5.011
88 HB3 GLU 14 3HB GLU 14 -12.845 4.216 -4.161
89 HG2 GLU 14 2HG GLU 14 -14.908 5.100 -4.522
90 HG3 GLU 14 3HG GLU 14 -14.581 5.856 -2.972
91 H GLU 15 H GLU 15 -9.875 5.968 -4.309
92 HA GLU 15 HA GLU 15 -8.441 3.770 -2.913
93 HB2 GLU 15 2HB GLU 15 -7.637 3.007 -5.114
94 HB3 GLU 15 3HB GLU 15 -9.334 2.724 -4.792
95 HG2 GLU 15 2HG GLU 15 -10.047 4.485 -6.257
96 HG3 GLU 15 3HG GLU 15 -8.405 5.070 -6.488
97 H LYS 16 H LYS 16 -6.903 4.807 -1.825
98 HA LYS 16 HA LYS 16 -4.974 6.420 -3.357
99 HB2 LYS 16 2HB LYS 16 -4.824 7.867 -1.165
100 HB3 LYS 16 3HB LYS 16 -6.014 8.266 -2.393
101 HG2 LYS 16 2HG LYS 16 -7.796 7.198 -1.189
102 HG3 LYS 16 3HG LYS 16 -6.641 6.511 -0.038
103 HD2 LYS 16 2HD LYS 16 -7.855 8.415 0.926
104 HD3 LYS 16 3HD LYS 16 -6.120 8.783 0.806
105 HE2 LYS 16 2HE LYS 16 -6.446 10.156 -1.137
106 HE3 LYS 16 3HE LYS 16 -8.079 9.532 -1.386
107 HZ1 LYS 16 1HZ LYS 16 -8.029 11.757 -0.446
108 HZ2 LYS 16 2HZ LYS 16 -8.862 10.706 0.471
109 HZ3 LYS 16 3HZ LYS 16 -7.338 11.177 0.937
110 H CYS 17 H CYS 17 -2.973 6.019 -2.836
111 HA CYS 17 HA CYS 17 -1.993 3.777 -1.228
112 HB2 CYS 17 2HB CYS 17 -0.936 4.814 -3.263
113 HB3 CYS 17 3HB CYS 17 -0.727 6.298 -2.362
114 H THR 18 H THR 18 -1.785 3.804 0.972
115 HA THR 18 HA THR 18 -2.122 6.293 2.407
116 HB THR 18 HB THR 18 -3.002 4.074 3.145
117 HG1 THR 18 1HG THR 18 -1.418 5.700 4.834
118 HG21 THR 18 1HG2 THR 18 -0.168 3.673 4.186
119 HG22 THR 18 2HG2 THR 18 -1.563 2.602 4.387
120 HG23 THR 18 3HG2 THR 18 -0.833 2.831 2.773
121 H ILE 19 H ILE 19 0.713 4.844 0.996
122 HA ILE 19 HA ILE 19 2.496 5.749 3.120
123 HB ILE 19 HB ILE 19 2.806 4.274 0.504
124 HG12 ILE 19 2HG1 ILE 19 3.645 3.371 3.274
125 HG13 ILE 19 3HG1 ILE 19 1.947 3.249 2.799
126 HG21 ILE 19 1HG2 ILE 19 4.781 5.641 0.670
127 HG22 ILE 19 2HG2 ILE 19 4.926 5.325 2.415
128 HG23 ILE 19 3HG2 ILE 19 5.242 4.032 1.243
129 HD11 ILE 19 1HD1 ILE 19 3.241 1.174 2.355
130 HD12 ILE 19 2HD1 ILE 19 2.465 1.868 0.908
131 HD13 ILE 19 3HD1 ILE 19 4.214 2.056 1.164
132 H CYS 20 H CYS 20 1.973 6.432 -0.392
133 HA CYS 20 HA CYS 20 3.553 8.966 -0.260
134 HB2 CYS 20 2HB CYS 20 1.701 8.306 -2.520
135 HB3 CYS 20 3HB CYS 20 3.222 9.186 -2.501
136 H LEU 21 H LEU 21 0.446 8.007 0.791
137 HA LEU 21 HA LEU 21 -1.558 8.941 0.951
138 HB2 LEU 21 2HB LEU 21 0.239 11.233 1.789
139 HB3 LEU 21 3HB LEU 21 -1.509 11.222 2.056
140 HG LEU 21 HG LEU 21 0.335 9.016 3.068
141 HD11 LEU 21 1HD1 LEU 21 0.145 10.084 5.272
142 HD12 LEU 21 2HD1 LEU 21 0.969 11.129 4.102
143 HD13 LEU 21 3HD1 LEU 21 -0.727 11.454 4.538
144 HD21 LEU 21 1HD2 LEU 21 -2.514 9.816 3.840
145 HD22 LEU 21 2HD2 LEU 21 -2.076 8.401 2.866
146 HD23 LEU 21 3HD2 LEU 21 -1.566 8.489 4.549
147 H SER 22 H SER 22 -1.552 8.615 -1.449
148 HA SER 22 HA SER 22 -2.437 11.102 -2.754
149 HB2 SER 22 2HB SER 22 -0.130 9.371 -3.746
150 HB3 SER 22 3HB SER 22 -0.993 10.548 -4.753
151 HG SER 22 HG SER 22 0.294 11.222 -2.293
152 H ILE 23 H ILE 23 -3.806 10.625 -4.549
153 HA ILE 23 HA ILE 23 -5.329 8.204 -4.371
154 HB ILE 23 HB ILE 23 -5.202 10.709 -6.072
155 HG12 ILE 23 2HG1 ILE 23 -6.200 10.663 -3.743
156 HG13 ILE 23 3HG1 ILE 23 -7.232 11.302 -5.012
157 HG21 ILE 23 1HG2 ILE 23 -7.270 10.034 -7.250
158 HG22 ILE 23 2HG2 ILE 23 -5.822 9.208 -7.739
159 HG23 ILE 23 3HG2 ILE 23 -7.014 8.364 -6.710
160 HD11 ILE 23 1HD1 ILE 23 -7.420 8.406 -4.087
161 HD12 ILE 23 2HD1 ILE 23 -8.336 9.724 -3.369
162 HD13 ILE 23 3HD1 ILE 23 -8.576 9.304 -5.069
163 H LEU 24 H LEU 24 -5.665 6.782 -6.181
164 HA LEU 24 HA LEU 24 -3.235 6.132 -7.752
165 HB2 LEU 24 2HB LEU 24 -5.690 4.526 -6.895
166 HB3 LEU 24 3HB LEU 24 -4.257 3.852 -7.678
167 HG LEU 24 HG LEU 24 -4.048 5.270 -4.976
168 HD11 LEU 24 1HD1 LEU 24 -4.093 2.980 -4.029
169 HD12 LEU 24 2HD1 LEU 24 -5.631 3.577 -4.672
170 HD13 LEU 24 3HD1 LEU 24 -4.701 2.415 -5.630
171 HD21 LEU 24 1HD2 LEU 24 -1.985 5.003 -6.083
172 HD22 LEU 24 2HD2 LEU 24 -2.077 3.706 -4.845
173 HD23 LEU 24 3HD2 LEU 24 -2.359 3.330 -6.558
174 H GLU 25 H GLU 25 -4.902 4.355 -9.477
175 HA GLU 25 HA GLU 25 -7.043 5.937 -10.499
176 HB2 GLU 25 2HB GLU 25 -6.373 6.387 -12.696
177 HB3 GLU 25 3HB GLU 25 -5.055 6.969 -11.677
178 HG2 GLU 25 2HG GLU 25 -3.776 4.888 -12.195
179 HG3 GLU 25 3HG GLU 25 -5.081 4.365 -13.267
180 H GLU 26 H GLU 26 -8.004 4.701 -12.550
181 HA GLU 26 HA GLU 26 -8.697 2.158 -11.546
182 HB2 GLU 26 2HB GLU 26 -10.223 3.430 -12.895
183 HB3 GLU 26 3HB GLU 26 -9.130 3.412 -14.290
184 HG2 GLU 26 2HG GLU 26 -9.456 1.068 -14.652
185 HG3 GLU 26 3HG GLU 26 -10.126 0.830 -13.037
186 H GLY 27 H GLY 27 -7.109 0.683 -11.283
187 HA2 GLY 27 2HA GLY 27 -6.100 -1.288 -12.116
188 HA3 GLY 27 3HA GLY 27 -6.127 -0.615 -13.751
189 H GLU 28 H GLU 28 -4.860 1.413 -11.136
190 HA GLU 28 HA GLU 28 -2.345 1.654 -12.410
191 HB2 GLU 28 2HB GLU 28 -3.702 3.191 -10.760
192 HB3 GLU 28 3HB GLU 28 -2.846 2.323 -9.496
193 HG2 GLU 28 2HG GLU 28 -0.682 3.044 -10.564
194 HG3 GLU 28 3HG GLU 28 -1.603 3.885 -11.817
195 H ASP 29 H ASP 29 -0.255 1.249 -11.330
196 HA ASP 29 HA ASP 29 0.102 -1.477 -10.608
197 HB2 ASP 29 2HB ASP 29 2.075 0.783 -10.147
198 HB3 ASP 29 3HB ASP 29 2.420 -0.932 -10.345
199 H VAL 30 H VAL 30 -0.884 -2.143 -8.735
200 HA VAL 30 HA VAL 30 -0.024 -0.939 -6.170
201 HB VAL 30 HB VAL 30 -2.312 -1.012 -5.340
202 HG11 VAL 30 1HG1 VAL 30 -1.505 1.059 -6.454
203 HG12 VAL 30 2HG1 VAL 30 -2.225 0.504 -7.975
204 HG13 VAL 30 3HG1 VAL 30 -3.254 0.848 -6.598
205 HG21 VAL 30 1HG2 VAL 30 -3.093 -1.930 -8.139
206 HG22 VAL 30 2HG2 VAL 30 -3.291 -2.837 -6.623
207 HG23 VAL 30 3HG2 VAL 30 -4.222 -1.357 -6.910
208 H ARG 31 H ARG 31 -0.006 -2.516 -4.418
209 HA ARG 31 HA ARG 31 -0.339 -5.328 -5.338
210 HB2 ARG 31 2HB ARG 31 1.311 -4.376 -2.954
211 HB3 ARG 31 3HB ARG 31 1.072 -6.032 -3.467
212 HG2 ARG 31 2HG ARG 31 2.275 -5.374 -5.660
213 HG3 ARG 31 3HG ARG 31 2.821 -3.955 -4.718
214 HD2 ARG 31 2HD ARG 31 3.451 -5.660 -2.878
215 HD3 ARG 31 3HD ARG 31 3.214 -6.896 -4.132
216 HE ARG 31 HE ARG 31 5.108 -4.763 -4.830
217 HH11 ARG 31 1HH1 ARG 31 7.926 -6.813 -4.347
218 HH12 ARG 31 2HH1 ARG 31 7.367 -5.307 -4.918
219 HH21 ARG 31 1HH2 ARG 31 6.399 -8.324 -3.352
220 HH22 ARG 31 2HH2 ARG 31 4.727 -7.900 -3.227
221 H ARG 32 H ARG 32 -0.986 -6.708 -3.392
222 HA ARG 32 HA ARG 32 -2.833 -5.248 -1.582
223 HB2 ARG 32 2HB ARG 32 -3.826 -6.544 -3.676
224 HB3 ARG 32 3HB ARG 32 -3.408 -7.997 -2.774
225 HG2 ARG 32 2HG ARG 32 -5.339 -5.777 -2.014
226 HG3 ARG 32 3HG ARG 32 -5.689 -7.472 -2.365
227 HD2 ARG 32 2HD ARG 32 -4.079 -7.859 -0.216
228 HD3 ARG 32 3HD ARG 32 -4.535 -6.223 0.128
229 HE ARG 32 HE ARG 32 -6.786 -6.844 0.372
230 HH11 ARG 32 1HH1 ARG 32 -8.125 -10.095 0.607
231 HH12 ARG 32 2HH1 ARG 32 -8.390 -8.440 0.970
232 HH21 ARG 32 1HH2 ARG 32 -6.081 -10.790 -0.374
233 HH22 ARG 32 2HH2 ARG 32 -4.872 -9.605 -0.720
234 H LEU 33 H LEU 33 -1.899 -5.450 0.309
235 HA LEU 33 HA LEU 33 -0.134 -7.707 0.919
236 HB2 LEU 33 2HB LEU 33 0.064 -6.262 3.119
237 HB3 LEU 33 3HB LEU 33 0.898 -5.752 1.659
238 HG LEU 33 HG LEU 33 -1.890 -4.738 2.139
239 HD11 LEU 33 1HD1 LEU 33 -0.884 -2.858 3.507
240 HD12 LEU 33 2HD1 LEU 33 -0.760 -4.430 4.325
241 HD13 LEU 33 3HD1 LEU 33 0.654 -3.727 3.528
242 HD21 LEU 33 1HD2 LEU 33 0.622 -3.274 1.185
243 HD22 LEU 33 2HD2 LEU 33 -0.453 -4.098 0.057
244 HD23 LEU 33 3HD2 LEU 33 -1.062 -2.749 1.021
245 HA PRO 34 HA PRO 34 -2.965 -10.190 2.702
246 HB2 PRO 34 2HB PRO 34 -1.815 -11.307 4.947
247 HB3 PRO 34 3HB PRO 34 -1.305 -11.655 3.267
248 HG2 PRO 34 2HG PRO 34 -0.061 -9.748 5.245
249 HG3 PRO 34 3HG PRO 34 0.751 -10.896 4.132
250 HD2 PRO 34 2HD PRO 34 0.458 -8.218 3.627
251 HD3 PRO 34 3HD PRO 34 0.540 -9.398 2.320
252 H CYS 35 H CYS 35 -1.873 -7.659 4.791
253 HA CYS 35 HA CYS 35 -3.965 -7.600 6.836
254 HB2 CYS 35 2HB CYS 35 -1.628 -6.599 6.836
255 HB3 CYS 35 3HB CYS 35 -2.237 -5.460 5.617
256 H MET 36 H MET 36 -4.751 -7.768 3.722
257 HA MET 36 HA MET 36 -6.296 -6.890 2.379
258 HB2 MET 36 2HB MET 36 -7.729 -6.407 5.005
259 HB3 MET 36 3HB MET 36 -8.468 -6.328 3.398
260 HG2 MET 36 2HG MET 36 -7.107 -8.769 3.363
261 HG3 MET 36 3HG MET 36 -7.752 -8.684 4.996
262 HE1 MET 36 1HE MET 36 -10.450 -7.030 4.609
263 HE2 MET 36 2HE MET 36 -11.621 -8.338 4.331
264 HE3 MET 36 3HE MET 36 -10.353 -8.529 5.564
265 H HIS 37 H HIS 37 -4.286 -5.205 2.432
266 HA HIS 37 HA HIS 37 -5.641 -2.562 2.362
267 HB2 HIS 37 1HB HIS 37 -3.129 -3.382 3.791
268 HB3 HIS 37 2HB HIS 37 -3.093 -1.843 2.931
269 HD2 HIS 37 2HD HIS 37 -5.898 -0.642 3.505
270 HE1 HIS 37 1HE HIS 37 -5.034 -1.065 7.643
271 HE2 HIS 37 2HE HIS 37 -6.522 0.100 5.927
272 H LEU 38 H LEU 38 -5.023 -1.221 0.628
273 HA LEU 38 HA LEU 38 -3.637 -2.635 -1.596
274 HB2 LEU 38 2HB LEU 38 -6.054 -2.263 -1.939
275 HB3 LEU 38 3HB LEU 38 -5.874 -0.542 -1.630
276 HG LEU 38 HG LEU 38 -4.163 -1.789 -3.780
277 HD11 LEU 38 1HD1 LEU 38 -6.034 -1.533 -5.415
278 HD12 LEU 38 2HD1 LEU 38 -6.352 -2.800 -4.221
279 HD13 LEU 38 3HD1 LEU 38 -7.144 -1.211 -4.073
280 HD21 LEU 38 1HD2 LEU 38 -5.742 0.825 -3.630
281 HD22 LEU 38 2HD2 LEU 38 -4.000 0.666 -3.319
282 HD23 LEU 38 3HD2 LEU 38 -4.644 0.325 -4.924
283 H PHE 39 H PHE 39 -1.663 -1.730 -1.935
284 HA PHE 39 HA PHE 39 -1.246 1.161 -1.283
285 HB2 PHE 39 2HB PHE 39 0.558 -1.232 -0.743
286 HB3 PHE 39 3HB PHE 39 1.120 0.425 -0.716
287 HD1 PHE 39 1HD PHE 39 -2.083 0.535 0.917
288 HD2 PHE 39 2HD PHE 39 1.989 -0.726 1.457
289 HE1 PHE 39 1HE PHE 39 -2.414 0.531 3.338
290 HE2 PHE 39 2HE PHE 39 1.679 -0.659 3.903
291 HZ PHE 39 HZ PHE 39 -0.532 -0.041 4.859
292 H HIS 40 H HIS 40 0.499 2.083 -2.734
293 HA HIS 40 HA HIS 40 0.459 1.191 -5.474
294 HB2 HIS 40 1HB HIS 40 2.331 2.848 -3.799
295 HB3 HIS 40 2HB HIS 40 2.884 2.321 -5.372
296 HD2 HIS 40 2HD HIS 40 0.671 2.943 -7.388
297 HE1 HIS 40 1HE HIS 40 0.630 6.865 -5.718
298 HE2 HIS 40 2HE HIS 40 -0.078 5.388 -7.716
299 H GLN 41 H GLN 41 1.960 -0.051 -6.647
300 HA GLN 41 HA GLN 41 3.497 -2.087 -5.330
301 HB2 GLN 41 2HB GLN 41 3.046 -1.123 -8.120
302 HB3 GLN 41 3HB GLN 41 4.622 -1.875 -7.831
303 HG2 GLN 41 2HG GLN 41 3.632 -3.853 -6.919
304 HG3 GLN 41 3HG GLN 41 2.019 -3.121 -6.903
305 HE21 GLN 41 1HE2 GLN 41 0.731 -4.181 -8.433
306 HE22 GLN 41 2HE2 GLN 41 1.366 -4.636 -10.004
307 H VAL 42 H VAL 42 4.407 1.061 -6.842
308 HA VAL 42 HA VAL 42 7.151 0.827 -6.279
309 HB VAL 42 HB VAL 42 5.398 3.311 -6.515
310 HG11 VAL 42 1HG1 VAL 42 7.527 4.478 -7.133
311 HG12 VAL 42 2HG1 VAL 42 7.504 3.963 -5.443
312 HG13 VAL 42 3HG1 VAL 42 8.436 3.032 -6.638
313 HG21 VAL 42 1HG2 VAL 42 6.279 3.343 -8.840
314 HG22 VAL 42 2HG2 VAL 42 7.151 1.829 -8.528
315 HG23 VAL 42 3HG2 VAL 42 5.375 1.859 -8.528
316 H CYS 43 H CYS 43 4.745 2.708 -4.323
317 HA CYS 43 HA CYS 43 6.478 3.342 -2.178
318 HB2 CYS 43 2HB CYS 43 3.512 2.760 -1.965
319 HB3 CYS 43 3HB CYS 43 4.515 3.774 -0.932
320 H VAL 44 H VAL 44 4.302 0.407 -2.510
321 HA VAL 44 HA VAL 44 5.063 -0.450 0.073
322 HB VAL 44 HB VAL 44 2.935 -1.006 -1.185
323 HG11 VAL 44 1HG1 VAL 44 4.570 -3.383 -2.142
324 HG12 VAL 44 2HG1 VAL 44 2.890 -2.926 -2.556
325 HG13 VAL 44 3HG1 VAL 44 4.260 -1.984 -3.170
326 HG21 VAL 44 1HG2 VAL 44 4.429 -3.297 0.128
327 HG22 VAL 44 2HG2 VAL 44 3.691 -1.962 1.010
328 HG23 VAL 44 3HG2 VAL 44 2.669 -3.063 0.044
329 H ASP 45 H ASP 45 6.625 -0.774 -3.034
330 HA ASP 45 HA ASP 45 8.184 -3.087 -2.488
331 HB2 ASP 45 2HB ASP 45 8.101 -1.114 -4.534
332 HB3 ASP 45 3HB ASP 45 9.723 -1.004 -3.874
333 H GLN 46 H GLN 46 8.966 0.375 -2.002
334 HA GLN 46 HA GLN 46 11.258 -0.180 -0.344
335 HB2 GLN 46 2HB GLN 46 9.494 2.307 -0.621
336 HB3 GLN 46 3HB GLN 46 11.010 2.289 0.280
337 HG2 GLN 46 2HG GLN 46 10.815 1.610 -2.693
338 HG3 GLN 46 3HG GLN 46 11.139 3.227 -2.064
339 HE21 GLN 46 1HE2 GLN 46 13.164 2.791 -3.522
340 HE22 GLN 46 2HE2 GLN 46 14.507 2.059 -2.651
341 H ALA 47 H ALA 47 7.824 0.170 0.433
342 HA ALA 47 HA ALA 47 8.164 0.425 3.246
343 HB1 ALA 47 1HB ALA 47 6.027 0.638 1.945
344 HB2 ALA 47 2HB ALA 47 6.004 -1.139 1.791
345 HB3 ALA 47 3HB ALA 47 5.890 -0.388 3.397
346 H LEU 48 H LEU 48 7.665 -2.529 1.284
347 HA LEU 48 HA LEU 48 7.877 -4.404 3.334
348 HB2 LEU 48 2HB LEU 48 6.856 -4.669 1.097
349 HB3 LEU 48 3HB LEU 48 8.445 -4.684 0.340
350 HG LEU 48 HG LEU 48 7.754 -6.679 2.514
351 HD11 LEU 48 1HD1 LEU 48 5.883 -6.784 0.948
352 HD12 LEU 48 2HD1 LEU 48 7.009 -6.933 -0.419
353 HD13 LEU 48 3HD1 LEU 48 6.896 -8.225 0.803
354 HD21 LEU 48 1HD2 LEU 48 9.501 -6.862 0.007
355 HD22 LEU 48 2HD2 LEU 48 10.111 -6.666 1.657
356 HD23 LEU 48 3HD2 LEU 48 9.278 -8.153 1.205
357 H ILE 49 H ILE 49 10.467 -3.216 1.062
358 HA ILE 49 HA ILE 49 12.449 -4.942 2.187
359 HB ILE 49 HB ILE 49 14.080 -3.682 1.055
360 HG12 ILE 49 2HG1 ILE 49 13.069 -1.605 -0.348
361 HG13 ILE 49 3HG1 ILE 49 12.239 -1.425 1.204
362 HG21 ILE 49 1HG2 ILE 49 11.635 -3.772 -0.722
363 HG22 ILE 49 2HG2 ILE 49 13.335 -3.860 -1.204
364 HG23 ILE 49 3HG2 ILE 49 12.626 -5.168 -0.249
365 HD11 ILE 49 1HD1 ILE 49 14.442 -1.517 2.374
366 HD12 ILE 49 2HD1 ILE 49 15.241 -1.634 0.792
367 HD13 ILE 49 3HD1 ILE 49 14.333 -0.171 1.224
368 H THR 50 H THR 50 11.395 -1.599 3.107
369 HA THR 50 HA THR 50 13.438 -1.260 5.022
370 HB THR 50 HB THR 50 10.652 -0.070 4.719
371 HG1 THR 50 1HG THR 50 13.308 0.722 4.141
372 HG21 THR 50 1HG2 THR 50 11.157 0.168 7.085
373 HG22 THR 50 2HG2 THR 50 12.812 0.719 6.719
374 HG23 THR 50 3HG2 THR 50 11.406 1.719 6.277
375 H ASN 51 H ASN 51 10.104 -2.619 5.349
376 HA ASN 51 HA ASN 51 10.990 -4.338 7.471
377 HB2 ASN 51 2HB ASN 51 9.553 -3.507 9.234
378 HB3 ASN 51 3HB ASN 51 10.615 -2.198 8.733
379 HD21 ASN 51 1HD2 ASN 51 7.308 -3.188 9.139
380 HD22 ASN 51 2HD2 ASN 51 6.569 -1.845 8.324
381 H LYS 52 H LYS 52 9.764 -6.226 7.239
382 HA LYS 52 HA LYS 52 7.427 -6.100 5.459
383 HB2 LYS 52 2HB LYS 52 8.690 -8.467 6.920
384 HB3 LYS 52 3HB LYS 52 7.354 -8.527 5.768
385 HG2 LYS 52 2HG LYS 52 9.042 -9.020 4.344
386 HG3 LYS 52 3HG LYS 52 9.011 -7.273 4.151
387 HD2 LYS 52 2HD LYS 52 10.974 -7.021 5.581
388 HD3 LYS 52 3HD LYS 52 10.893 -8.749 6.022
389 HE2 LYS 52 2HE LYS 52 11.045 -9.248 3.522
390 HE3 LYS 52 3HE LYS 52 11.468 -7.533 3.282
391 HZ1 LYS 52 1HZ LYS 52 12.859 -9.567 4.871
392 HZ2 LYS 52 2HZ LYS 52 13.402 -8.906 3.461
393 HZ3 LYS 52 3HZ LYS 52 13.340 -7.960 4.806
394 H LYS 53 H LYS 53 6.564 -4.498 7.381
395 HA LYS 53 HA LYS 53 4.485 -6.192 8.563
396 HB2 LYS 53 2HB LYS 53 6.097 -4.267 10.307
397 HB3 LYS 53 3HB LYS 53 4.465 -4.802 10.667
398 HG2 LYS 53 2HG LYS 53 5.598 -6.281 11.929
399 HG3 LYS 53 3HG LYS 53 5.444 -7.230 10.456
400 HD2 LYS 53 2HD LYS 53 7.786 -6.564 9.834
401 HD3 LYS 53 3HD LYS 53 7.910 -5.637 11.330
402 HE2 LYS 53 2HE LYS 53 7.334 -8.631 11.152
403 HE3 LYS 53 3HE LYS 53 8.941 -7.941 11.410
404 HZ1 LYS 53 1HZ LYS 53 8.145 -6.964 13.454
405 HZ2 LYS 53 2HZ LYS 53 6.637 -7.598 13.219
406 HZ3 LYS 53 3HZ LYS 53 7.919 -8.594 13.474
407 H CYS 54 H CYS 54 2.559 -5.252 8.102
408 HA CYS 54 HA CYS 54 2.317 -2.927 6.399
409 HB2 CYS 54 2HB CYS 54 0.647 -4.705 6.489
410 HB3 CYS 54 3HB CYS 54 0.332 -4.348 8.188
411 HA PRO 55 HA PRO 55 3.302 -0.336 9.915
412 HB2 PRO 55 2HB PRO 55 3.634 2.083 8.673
413 HB3 PRO 55 3HB PRO 55 4.774 0.719 8.486
414 HG2 PRO 55 2HG PRO 55 2.487 1.481 6.641
415 HG3 PRO 55 3HG PRO 55 4.202 1.170 6.205
416 HD2 PRO 55 2HD PRO 55 2.302 -0.760 5.993
417 HD3 PRO 55 3HD PRO 55 3.959 -1.155 6.547
418 H ILE 56 H ILE 56 0.298 -0.607 8.688
419 HA ILE 56 HA ILE 56 -0.748 1.489 10.502
420 HB ILE 56 HB ILE 56 -0.906 2.202 8.143
421 HG12 ILE 56 2HG1 ILE 56 -3.231 2.801 7.984
422 HG13 ILE 56 3HG1 ILE 56 -3.700 1.624 9.201
423 HG21 ILE 56 1HG2 ILE 56 -2.637 -0.260 7.771
424 HG22 ILE 56 2HG2 ILE 56 -2.431 1.042 6.581
425 HG23 ILE 56 3HG2 ILE 56 -1.042 0.054 7.043
426 HD11 ILE 56 1HD1 ILE 56 -2.430 2.858 10.919
427 HD12 ILE 56 2HD1 ILE 56 -1.802 3.969 9.675
428 HD13 ILE 56 3HD1 ILE 56 -3.532 3.960 10.075
429 H CYS 57 H CYS 57 -0.134 -1.556 10.513
430 HA CYS 57 HA CYS 57 -2.709 -2.460 11.813
431 HB2 CYS 57 2HB CYS 57 -1.167 -4.042 9.728
432 HB3 CYS 57 3HB CYS 57 -2.544 -4.588 10.694
433 H ARG 58 H ARG 58 0.592 -3.398 10.896
434 HA ARG 58 HA ARG 58 2.427 -3.731 12.217
435 HB2 ARG 58 2HB ARG 58 1.140 -2.948 14.261
436 HB3 ARG 58 3HB ARG 58 0.703 -4.638 14.553
437 HG2 ARG 58 2HG ARG 58 2.817 -5.207 15.231
438 HG3 ARG 58 3HG ARG 58 3.617 -4.091 14.111
439 HD2 ARG 58 2HD ARG 58 2.069 -3.187 16.571
440 HD3 ARG 58 3HD ARG 58 3.808 -3.454 16.571
441 HE ARG 58 HE ARG 58 2.306 -1.265 15.335
442 HH11 ARG 58 1HH1 ARG 58 5.189 0.355 14.115
443 HH12 ARG 58 2HH1 ARG 58 3.484 0.468 14.327
444 HH21 ARG 58 1HH2 ARG 58 6.337 -1.595 14.823
445 HH22 ARG 58 2HH2 ARG 58 5.431 -2.883 15.541
446 H VAL 59 H VAL 59 -0.046 -5.661 11.150
447 HA VAL 59 HA VAL 59 0.837 -8.295 11.764
448 HB VAL 59 HB VAL 59 -0.754 -7.123 9.439
449 HG11 VAL 59 1HG1 VAL 59 -0.510 -10.023 10.352
450 HG12 VAL 59 2HG1 VAL 59 -1.743 -9.414 9.227
451 HG13 VAL 59 3HG1 VAL 59 -0.048 -9.344 8.773
452 HG21 VAL 59 1HG2 VAL 59 -2.732 -7.857 10.715
453 HG22 VAL 59 2HG2 VAL 59 -1.689 -8.468 12.015
454 HG23 VAL 59 3HG2 VAL 59 -1.791 -6.727 11.687
455 H ASP 60 H ASP 60 1.980 -9.748 10.390
456 HA ASP 60 HA ASP 60 4.303 -8.625 9.021
457 HB2 ASP 60 2HB ASP 60 4.394 -10.601 10.541
458 HB3 ASP 60 3HB ASP 60 3.336 -11.484 9.431
459 H ILE 61 H ILE 61 4.722 -8.851 6.819
460 HA ILE 61 HA ILE 61 2.486 -9.849 5.108
461 HB ILE 61 HB ILE 61 3.031 -8.211 3.481
462 HG12 ILE 61 2HG1 ILE 61 5.142 -7.169 5.413
463 HG13 ILE 61 3HG1 ILE 61 5.475 -8.041 3.905
464 HG21 ILE 61 1HG2 ILE 61 2.066 -6.308 4.526
465 HG22 ILE 61 2HG2 ILE 61 1.496 -7.686 5.483
466 HG23 ILE 61 3HG2 ILE 61 2.834 -6.700 6.096
467 HD11 ILE 61 1HD1 ILE 61 5.714 -5.756 3.415
468 HD12 ILE 61 2HD1 ILE 61 4.170 -6.308 2.689
469 HD13 ILE 61 3HD1 ILE 61 4.168 -5.346 4.196
470 H GLU 62 H GLU 62 5.781 -10.220 5.926
471 HA GLU 62 HA GLU 62 6.911 -11.022 3.477
472 HB2 GLU 62 2HB GLU 62 8.124 -10.679 5.673
473 HB3 GLU 62 3HB GLU 62 7.604 -12.290 6.160
474 HG2 GLU 62 2HG GLU 62 8.831 -13.315 4.352
475 HG3 GLU 62 3HG GLU 62 9.031 -11.778 3.515
476 H ALA 63 H ALA 63 5.734 -12.265 2.127
477 HA ALA 63 HA ALA 63 4.187 -14.521 2.954
478 HB1 ALA 63 1HB ALA 63 5.286 -13.800 0.198
479 HB2 ALA 63 2HB ALA 63 3.964 -14.940 0.525
480 HB3 ALA 63 3HB ALA 63 3.749 -13.217 0.885
481 H GLN 64 H GLN 64 4.602 -16.751 1.849
482 HA GLN 64 HA GLN 64 6.968 -17.834 2.994
483 HB2 GLN 64 2HB GLN 64 4.729 -19.016 2.368
484 HB3 GLN 64 3HB GLN 64 5.398 -19.120 0.732
485 HG2 GLN 64 2HG GLN 64 7.447 -20.265 1.803
486 HG3 GLN 64 3HG GLN 64 6.516 -20.323 3.304
487 HE21 GLN 64 1HE2 GLN 64 5.026 -22.080 3.541
488 HE22 GLN 64 2HE2 GLN 64 4.700 -23.173 2.203
489 H LEU 65 H LEU 65 8.872 -18.491 2.066
490 HA LEU 65 HA LEU 65 10.525 -18.862 0.592
491 HB2 LEU 65 2HB LEU 65 8.522 -18.968 -1.202
492 HB3 LEU 65 3HB LEU 65 9.275 -17.492 -1.765
493 HG LEU 65 HG LEU 65 11.440 -19.280 -1.303
494 HD11 LEU 65 1HD1 LEU 65 10.784 -21.320 -2.502
495 HD12 LEU 65 2HD1 LEU 65 9.731 -21.093 -1.091
496 HD13 LEU 65 3HD1 LEU 65 9.135 -20.695 -2.714
497 HD21 LEU 65 1HD2 LEU 65 9.994 -18.627 -3.900
498 HD22 LEU 65 2HD2 LEU 65 11.318 -17.697 -3.159
499 HD23 LEU 65 3HD2 LEU 65 11.619 -19.338 -3.762
500 HA PRO 66 HA PRO 66 11.215 -14.504 1.837
501 HB2 PRO 66 2HB PRO 66 13.597 -14.852 3.184
502 HB3 PRO 66 3HB PRO 66 11.987 -15.166 3.904
503 HG2 PRO 66 2HG PRO 66 13.888 -17.165 2.647
504 HG3 PRO 66 3HG PRO 66 13.015 -17.297 4.208
505 HD2 PRO 66 2HD PRO 66 12.094 -18.480 1.947
506 HD3 PRO 66 3HD PRO 66 10.956 -17.735 3.117
507 H SER 67 H SER 67 12.044 -13.091 0.361
508 HA SER 67 HA SER 67 14.524 -13.734 -1.073
509 HB2 SER 67 2HB SER 67 12.536 -14.701 -2.334
510 HB3 SER 67 3HB SER 67 11.899 -13.052 -2.471
511 HG SER 67 HG SER 67 14.304 -14.122 -3.532
512 H GLU 68 H GLU 68 15.577 -11.803 -1.753
513 HA GLU 68 HA GLU 68 14.505 -9.173 -1.191
514 HB2 GLU 68 2HB GLU 68 15.514 -10.782 0.948
515 HB3 GLU 68 3HB GLU 68 16.831 -9.703 0.561
516 HG2 GLU 68 2HG GLU 68 13.961 -8.735 0.997
517 HG3 GLU 68 3HG GLU 68 15.053 -9.034 2.344
518 H SER 69 H SER 69 16.260 -7.538 -1.946
519 HA SER 69 HA SER 69 18.710 -8.516 -2.973
520 HB2 SER 69 2HB SER 69 17.122 -9.480 -4.710
521 HB3 SER 69 3HB SER 69 16.580 -7.818 -5.042
522 HG SER 69 HG SER 69 18.940 -7.415 -5.318
Start of MODEL 15
1 H1 MET 1 H1 MET 1 -13.814 24.312 -26.700
2 H2 MET 1 H2 MET 1 -14.974 25.064 -27.605
3 H3 MET 1 H3 MET 1 -15.074 23.445 -27.308
4 HA MET 1 HA MET 1 -14.387 23.803 -29.528
5 HB2 MET 1 2HB MET 1 -12.118 25.371 -28.257
6 HB3 MET 1 3HB MET 1 -12.042 24.667 -29.883
7 HG2 MET 1 2HG MET 1 -14.364 25.862 -30.227
8 HG3 MET 1 3HG MET 1 -13.847 26.852 -28.858
9 HE1 MET 1 1HE MET 1 -12.006 26.704 -33.100
10 HE2 MET 1 2HE MET 1 -11.995 25.267 -32.060
11 HE3 MET 1 3HE MET 1 -13.541 25.971 -32.588
12 H LYS 2 H LYS 2 -11.236 23.355 -27.782
13 HA LYS 2 HA LYS 2 -11.674 20.438 -28.139
14 HB2 LYS 2 2HB LYS 2 -10.541 21.611 -30.122
15 HB3 LYS 2 3HB LYS 2 -9.153 21.870 -29.058
16 HG2 LYS 2 2HG LYS 2 -8.986 19.405 -28.704
17 HG3 LYS 2 3HG LYS 2 -10.460 19.175 -29.661
18 HD2 LYS 2 2HD LYS 2 -8.668 18.668 -31.124
19 HD3 LYS 2 3HD LYS 2 -9.266 20.259 -31.622
20 HE2 LYS 2 2HE LYS 2 -7.423 21.326 -30.295
21 HE3 LYS 2 3HE LYS 2 -6.843 19.716 -29.841
22 HZ1 LYS 2 1HZ LYS 2 -6.451 19.269 -32.179
23 HZ2 LYS 2 2HZ LYS 2 -6.984 20.768 -32.598
24 HZ3 LYS 2 3HZ LYS 2 -5.616 20.601 -31.702
25 H GLN 3 H GLN 3 -12.040 20.604 -25.829
26 HA GLN 3 HA GLN 3 -9.705 20.056 -24.273
27 HB2 GLN 3 2HB GLN 3 -10.835 22.783 -24.219
28 HB3 GLN 3 3HB GLN 3 -10.990 22.001 -22.644
29 HG2 GLN 3 2HG GLN 3 -8.626 21.555 -22.520
30 HG3 GLN 3 3HG GLN 3 -8.374 22.056 -24.198
31 HE21 GLN 3 1HE2 GLN 3 -7.647 24.156 -24.483
32 HE22 GLN 3 2HE2 GLN 3 -7.895 25.421 -23.282
33 H ASP 4 H ASP 4 -10.533 19.388 -21.981
34 HA ASP 4 HA ASP 4 -13.369 18.865 -21.769
35 HB2 ASP 4 2HB ASP 4 -12.275 17.001 -23.255
36 HB3 ASP 4 3HB ASP 4 -11.488 16.473 -21.766
37 H GLY 5 H GLY 5 -13.612 17.587 -19.516
38 HA2 GLY 5 2HA GLY 5 -11.450 17.505 -17.704
39 HA3 GLY 5 3HA GLY 5 -12.229 19.081 -17.512
40 H GLU 6 H GLU 6 -14.793 18.759 -17.641
41 HA GLU 6 HA GLU 6 -16.548 18.470 -16.306
42 HB2 GLU 6 2HB GLU 6 -15.649 15.600 -16.455
43 HB3 GLU 6 3HB GLU 6 -16.892 16.082 -15.292
44 HG2 GLU 6 2HG GLU 6 -18.126 17.221 -17.193
45 HG3 GLU 6 3HG GLU 6 -17.012 16.417 -18.308
46 H GLU 7 H GLU 7 -14.191 16.426 -14.577
47 HA GLU 7 HA GLU 7 -13.597 16.307 -12.424
48 HB2 GLU 7 2HB GLU 7 -12.694 18.633 -13.000
49 HB3 GLU 7 3HB GLU 7 -14.045 19.267 -12.039
50 HG2 GLU 7 2HG GLU 7 -13.274 17.648 -10.181
51 HG3 GLU 7 3HG GLU 7 -11.840 17.346 -11.163
52 H GLY 8 H GLY 8 -15.535 15.034 -12.300
53 HA2 GLY 8 2HA GLY 8 -17.548 16.158 -10.399
54 HA3 GLY 8 3HA GLY 8 -17.756 14.687 -11.374
55 H THR 9 H THR 9 -18.021 13.316 -9.622
56 HA THR 9 HA THR 9 -17.662 12.042 -7.885
57 HB THR 9 HB THR 9 -15.594 10.961 -7.489
58 HG1 THR 9 1HG THR 9 -13.665 11.640 -8.345
59 HG21 THR 9 1HG2 THR 9 -15.008 10.137 -9.702
60 HG22 THR 9 2HG2 THR 9 -16.763 10.381 -9.607
61 HG23 THR 9 3HG2 THR 9 -15.740 11.555 -10.472
62 H GLU 10 H GLU 10 -16.017 11.940 -5.699
63 HA GLU 10 HA GLU 10 -15.652 14.446 -4.446
64 HB2 GLU 10 2HB GLU 10 -17.680 14.319 -2.921
65 HB3 GLU 10 3HB GLU 10 -17.958 14.936 -4.529
66 HG2 GLU 10 2HG GLU 10 -18.420 12.028 -4.473
67 HG3 GLU 10 3HG GLU 10 -19.335 12.837 -3.215
68 H GLU 11 H GLU 11 -16.906 11.093 -3.936
69 HA GLU 11 HA GLU 11 -15.576 10.818 -1.399
70 HB2 GLU 11 2HB GLU 11 -17.634 9.603 -2.118
71 HB3 GLU 11 3HB GLU 11 -16.679 8.687 -3.292
72 HG2 GLU 11 2HG GLU 11 -15.438 7.584 -1.564
73 HG3 GLU 11 3HG GLU 11 -15.932 8.766 -0.344
74 H ASP 12 H ASP 12 -13.594 9.661 -0.976
75 HA ASP 12 HA ASP 12 -11.793 9.072 -3.166
76 HB2 ASP 12 2HB ASP 12 -11.750 11.587 -2.799
77 HB3 ASP 12 3HB ASP 12 -11.262 11.290 -1.126
78 H THR 13 H THR 13 -9.551 8.872 -1.499
79 HA THR 13 HA THR 13 -8.511 7.744 0.037
80 HB THR 13 HB THR 13 -10.461 8.923 1.473
81 HG1 THR 13 1HG THR 13 -8.523 7.115 2.436
82 HG21 THR 13 1HG2 THR 13 -11.333 7.457 3.169
83 HG22 THR 13 2HG2 THR 13 -11.877 6.792 1.625
84 HG23 THR 13 3HG2 THR 13 -10.526 6.039 2.480
85 H GLU 14 H GLU 14 -10.958 6.262 -1.627
86 HA GLU 14 HA GLU 14 -10.934 3.595 -0.650
87 HB2 GLU 14 2HB GLU 14 -11.464 4.918 -3.329
88 HB3 GLU 14 3HB GLU 14 -11.423 3.158 -3.232
89 HG2 GLU 14 2HG GLU 14 -13.179 4.810 -1.382
90 HG3 GLU 14 3HG GLU 14 -13.708 4.300 -2.989
91 H GLU 15 H GLU 15 -8.987 5.121 -3.249
92 HA GLU 15 HA GLU 15 -6.984 2.934 -2.924
93 HB2 GLU 15 2HB GLU 15 -6.715 3.027 -5.400
94 HB3 GLU 15 3HB GLU 15 -8.235 2.357 -4.833
95 HG2 GLU 15 2HG GLU 15 -9.486 4.260 -5.488
96 HG3 GLU 15 3HG GLU 15 -8.061 5.281 -5.635
97 H LYS 16 H LYS 16 -6.157 4.667 -1.399
98 HA LYS 16 HA LYS 16 -4.490 6.580 -2.945
99 HB2 LYS 16 2HB LYS 16 -5.970 7.658 -1.301
100 HB3 LYS 16 3HB LYS 16 -5.319 6.622 -0.012
101 HG2 LYS 16 2HG LYS 16 -3.172 7.588 -0.164
102 HG3 LYS 16 3HG LYS 16 -3.540 8.389 -1.693
103 HD2 LYS 16 2HD LYS 16 -5.097 9.111 0.806
104 HD3 LYS 16 3HD LYS 16 -3.493 9.787 0.499
105 HE2 LYS 16 2HE LYS 16 -4.468 10.312 -1.900
106 HE3 LYS 16 3HE LYS 16 -6.040 10.189 -1.086
107 HZ1 LYS 16 1HZ LYS 16 -5.246 12.427 -1.070
108 HZ2 LYS 16 2HZ LYS 16 -5.195 11.876 0.478
109 HZ3 LYS 16 3HZ LYS 16 -3.798 11.993 -0.411
110 H CYS 17 H CYS 17 -2.457 6.222 -3.037
111 HA CYS 17 HA CYS 17 -0.813 4.066 -1.862
112 HB2 CYS 17 2HB CYS 17 -0.383 5.402 -3.980
113 HB3 CYS 17 3HB CYS 17 -0.218 6.828 -3.011
114 H THR 18 H THR 18 -1.603 4.256 0.469
115 HA THR 18 HA THR 18 -1.552 6.762 1.716
116 HB THR 18 HB THR 18 -2.617 4.615 2.567
117 HG1 THR 18 1HG THR 18 -1.204 6.423 4.233
118 HG21 THR 18 1HG2 THR 18 -0.354 3.400 2.644
119 HG22 THR 18 2HG2 THR 18 0.014 4.366 4.079
120 HG23 THR 18 3HG2 THR 18 -1.383 3.279 4.107
121 H ILE 19 H ILE 19 1.143 4.769 0.891
122 HA ILE 19 HA ILE 19 3.105 5.679 2.747
123 HB ILE 19 HB ILE 19 3.047 4.491 -0.045
124 HG12 ILE 19 2HG1 ILE 19 4.292 3.093 2.293
125 HG13 ILE 19 3HG1 ILE 19 2.540 3.305 2.380
126 HG21 ILE 19 1HG2 ILE 19 5.502 4.050 0.263
127 HG22 ILE 19 2HG2 ILE 19 5.067 5.750 -0.016
128 HG23 ILE 19 3HG2 ILE 19 5.472 5.197 1.628
129 HD11 ILE 19 1HD1 ILE 19 2.203 2.245 0.251
130 HD12 ILE 19 2HD1 ILE 19 3.957 2.129 -0.034
131 HD13 ILE 19 3HD1 ILE 19 3.205 1.180 1.266
132 H CYS 20 H CYS 20 2.002 6.702 -0.470
133 HA CYS 20 HA CYS 20 3.789 9.124 -0.570
134 HB2 CYS 20 2HB CYS 20 2.564 8.832 -2.990
135 HB3 CYS 20 3HB CYS 20 4.148 8.193 -2.563
136 H LEU 21 H LEU 21 0.762 8.292 0.438
137 HA LEU 21 HA LEU 21 -1.258 9.179 0.657
138 HB2 LEU 21 2HB LEU 21 0.442 11.638 1.148
139 HB3 LEU 21 3HB LEU 21 -1.271 11.530 1.573
140 HG LEU 21 HG LEU 21 0.812 9.557 2.607
141 HD11 LEU 21 1HD1 LEU 21 -0.272 12.063 3.927
142 HD12 LEU 21 2HD1 LEU 21 0.750 10.823 4.700
143 HD13 LEU 21 3HD1 LEU 21 1.396 11.785 3.359
144 HD21 LEU 21 1HD2 LEU 21 -2.011 10.253 3.559
145 HD22 LEU 21 2HD2 LEU 21 -1.547 8.762 2.710
146 HD23 LEU 21 3HD2 LEU 21 -0.906 9.085 4.317
147 H SER 22 H SER 22 -0.500 8.955 -2.051
148 HA SER 22 HA SER 22 -1.980 11.235 -3.310
149 HB2 SER 22 2HB SER 22 0.347 9.581 -4.368
150 HB3 SER 22 3HB SER 22 -0.586 10.754 -5.322
151 HG SER 22 HG SER 22 0.885 11.315 -2.945
152 H ILE 23 H ILE 23 -3.642 10.634 -4.829
153 HA ILE 23 HA ILE 23 -4.673 7.998 -4.481
154 HB ILE 23 HB ILE 23 -5.361 10.473 -6.048
155 HG12 ILE 23 2HG1 ILE 23 -5.811 10.239 -3.570
156 HG13 ILE 23 3HG1 ILE 23 -7.198 10.632 -4.565
157 HG21 ILE 23 1HG2 ILE 23 -6.753 7.808 -6.402
158 HG22 ILE 23 2HG2 ILE 23 -7.520 9.385 -6.718
159 HG23 ILE 23 3HG2 ILE 23 -6.077 8.914 -7.615
160 HD11 ILE 23 1HD1 ILE 23 -7.653 8.880 -2.802
161 HD12 ILE 23 2HD1 ILE 23 -8.027 8.330 -4.443
162 HD13 ILE 23 3HD1 ILE 23 -6.547 7.796 -3.626
163 H LEU 24 H LEU 24 -5.069 6.505 -6.038
164 HA LEU 24 HA LEU 24 -2.882 6.031 -7.943
165 HB2 LEU 24 2HB LEU 24 -5.172 4.332 -6.823
166 HB3 LEU 24 3HB LEU 24 -3.835 3.706 -7.791
167 HG LEU 24 HG LEU 24 -3.444 5.079 -5.073
168 HD11 LEU 24 1HD1 LEU 24 -3.470 2.140 -5.784
169 HD12 LEU 24 2HD1 LEU 24 -2.947 2.833 -4.227
170 HD13 LEU 24 3HD1 LEU 24 -4.623 3.000 -4.752
171 HD21 LEU 24 1HD2 LEU 24 -1.664 3.709 -7.078
172 HD22 LEU 24 2HD2 LEU 24 -1.503 5.330 -6.352
173 HD23 LEU 24 3HD2 LEU 24 -1.211 3.872 -5.367
174 H GLU 25 H GLU 25 -4.554 4.234 -9.572
175 HA GLU 25 HA GLU 25 -6.853 5.625 -10.400
176 HB2 GLU 25 2HB GLU 25 -6.285 6.144 -12.693
177 HB3 GLU 25 3HB GLU 25 -5.166 6.984 -11.617
178 HG2 GLU 25 2HG GLU 25 -3.430 5.296 -12.063
179 HG3 GLU 25 3HG GLU 25 -4.555 4.401 -13.107
180 H GLU 26 H GLU 26 -7.707 4.435 -12.535
181 HA GLU 26 HA GLU 26 -8.057 1.763 -11.703
182 HB2 GLU 26 2HB GLU 26 -9.743 3.091 -12.961
183 HB3 GLU 26 3HB GLU 26 -8.703 3.056 -14.393
184 HG2 GLU 26 2HG GLU 26 -8.856 0.548 -14.403
185 HG3 GLU 26 3HG GLU 26 -9.918 0.627 -12.996
186 H GLY 27 H GLY 27 -6.793 0.013 -12.003
187 HA2 GLY 27 2HA GLY 27 -5.491 -1.532 -13.139
188 HA3 GLY 27 3HA GLY 27 -5.583 -0.510 -14.583
189 H GLU 28 H GLU 28 -4.471 1.222 -11.787
190 HA GLU 28 HA GLU 28 -1.896 1.677 -12.851
191 HB2 GLU 28 2HB GLU 28 -3.066 3.191 -11.357
192 HB3 GLU 28 3HB GLU 28 -3.123 1.971 -10.090
193 HG2 GLU 28 2HG GLU 28 -1.565 3.680 -9.509
194 HG3 GLU 28 3HG GLU 28 -0.703 2.171 -9.746
195 H ASP 29 H ASP 29 0.104 1.151 -11.877
196 HA ASP 29 HA ASP 29 0.527 -1.665 -11.227
197 HB2 ASP 29 2HB ASP 29 2.298 0.780 -11.122
198 HB3 ASP 29 3HB ASP 29 2.858 -0.822 -10.660
199 H VAL 30 H VAL 30 -0.540 -2.178 -9.355
200 HA VAL 30 HA VAL 30 0.300 -0.851 -6.842
201 HB VAL 30 HB VAL 30 -1.965 -0.902 -5.991
202 HG11 VAL 30 1HG1 VAL 30 -3.024 0.803 -7.437
203 HG12 VAL 30 2HG1 VAL 30 -1.300 1.144 -7.157
204 HG13 VAL 30 3HG1 VAL 30 -1.858 0.465 -8.699
205 HG21 VAL 30 1HG2 VAL 30 -3.908 -1.415 -7.405
206 HG22 VAL 30 2HG2 VAL 30 -2.842 -1.912 -8.728
207 HG23 VAL 30 3HG2 VAL 30 -2.884 -2.843 -7.213
208 H ARG 31 H ARG 31 -0.809 -2.384 -5.003
209 HA ARG 31 HA ARG 31 -0.606 -5.189 -5.695
210 HB2 ARG 31 2HB ARG 31 1.503 -3.607 -4.309
211 HB3 ARG 31 3HB ARG 31 1.056 -5.055 -3.417
212 HG2 ARG 31 2HG ARG 31 1.686 -5.269 -6.368
213 HG3 ARG 31 3HG ARG 31 2.996 -5.108 -5.206
214 HD2 ARG 31 2HD ARG 31 0.884 -7.159 -4.608
215 HD3 ARG 31 3HD ARG 31 1.971 -7.502 -5.948
216 HE ARG 31 HE ARG 31 2.607 -7.477 -3.115
217 HH11 ARG 31 1HH1 ARG 31 6.046 -8.083 -3.668
218 HH12 ARG 31 2HH1 ARG 31 4.791 -8.036 -2.485
219 HH21 ARG 31 1HH2 ARG 31 5.566 -7.594 -5.929
220 HH22 ARG 31 2HH2 ARG 31 3.955 -7.174 -6.375
221 H ARG 32 H ARG 32 -1.069 -6.446 -3.545
222 HA ARG 32 HA ARG 32 -2.875 -4.877 -1.816
223 HB2 ARG 32 2HB ARG 32 -4.324 -6.160 -3.285
224 HB3 ARG 32 3HB ARG 32 -3.294 -7.589 -3.158
225 HG2 ARG 32 2HG ARG 32 -5.319 -7.939 -1.856
226 HG3 ARG 32 3HG ARG 32 -3.928 -7.876 -0.787
227 HD2 ARG 32 2HD ARG 32 -5.287 -6.451 0.380
228 HD3 ARG 32 3HD ARG 32 -4.537 -5.292 -0.676
229 HE ARG 32 HE ARG 32 -7.023 -6.559 -1.653
230 HH11 ARG 32 1HH1 ARG 32 -8.940 -3.625 -1.230
231 HH12 ARG 32 2HH1 ARG 32 -8.971 -5.255 -1.797
232 HH21 ARG 32 1HH2 ARG 32 -7.022 -2.799 -0.101
233 HH22 ARG 32 2HH2 ARG 32 -5.559 -3.720 -0.254
234 H LEU 33 H LEU 33 -2.757 -5.524 0.415
235 HA LEU 33 HA LEU 33 -0.808 -7.619 1.048
236 HB2 LEU 33 2HB LEU 33 -0.893 -5.840 3.220
237 HB3 LEU 33 3HB LEU 33 0.457 -6.084 2.118
238 HG LEU 33 HG LEU 33 -1.773 -4.052 1.709
239 HD11 LEU 33 1HD1 LEU 33 -0.420 -3.714 3.820
240 HD12 LEU 33 2HD1 LEU 33 1.046 -3.647 2.826
241 HD13 LEU 33 3HD1 LEU 33 -0.232 -2.424 2.639
242 HD21 LEU 33 1HD2 LEU 33 0.797 -4.703 0.250
243 HD22 LEU 33 2HD2 LEU 33 -0.733 -4.058 -0.399
244 HD23 LEU 33 3HD2 LEU 33 0.374 -2.992 0.443
245 HA PRO 34 HA PRO 34 -3.854 -9.636 3.137
246 HB2 PRO 34 2HB PRO 34 -2.911 -10.256 5.680
247 HB3 PRO 34 3HB PRO 34 -2.413 -11.061 4.162
248 HG2 PRO 34 2HG PRO 34 -0.982 -8.894 5.691
249 HG3 PRO 34 3HG PRO 34 -0.315 -10.327 4.842
250 HD2 PRO 34 2HD PRO 34 -0.347 -7.756 3.854
251 HD3 PRO 34 3HD PRO 34 -0.320 -9.162 2.786
252 H CYS 35 H CYS 35 -2.640 -6.853 5.035
253 HA CYS 35 HA CYS 35 -5.153 -6.539 6.583
254 HB2 CYS 35 2HB CYS 35 -4.064 -4.609 7.390
255 HB3 CYS 35 3HB CYS 35 -2.905 -5.943 7.451
256 H MET 36 H MET 36 -5.433 -6.677 3.607
257 HA MET 36 HA MET 36 -6.528 -5.641 1.952
258 HB2 MET 36 2HB MET 36 -8.742 -4.698 2.740
259 HB3 MET 36 3HB MET 36 -8.328 -6.350 3.182
260 HG2 MET 36 2HG MET 36 -7.662 -5.636 5.427
261 HG3 MET 36 3HG MET 36 -8.077 -3.959 5.039
262 HE1 MET 36 1HE MET 36 -9.269 -4.737 7.586
263 HE2 MET 36 2HE MET 36 -10.606 -5.912 7.638
264 HE3 MET 36 3HE MET 36 -8.961 -6.455 7.240
265 H HIS 37 H HIS 37 -4.293 -4.165 2.511
266 HA HIS 37 HA HIS 37 -5.232 -1.378 2.070
267 HB2 HIS 37 1HB HIS 37 -2.857 -2.611 3.378
268 HB3 HIS 37 2HB HIS 37 -2.481 -1.267 2.317
269 HD2 HIS 37 2HD HIS 37 -4.712 0.779 2.763
270 HE1 HIS 37 1HE HIS 37 -4.063 0.474 6.949
271 HE2 HIS 37 2HE HIS 37 -5.088 1.896 5.091
272 H LEU 38 H LEU 38 -4.592 -0.240 0.133
273 HA LEU 38 HA LEU 38 -3.709 -2.066 -2.054
274 HB2 LEU 38 2HB LEU 38 -6.168 -0.937 -1.956
275 HB3 LEU 38 3HB LEU 38 -5.306 0.451 -2.563
276 HG LEU 38 HG LEU 38 -4.261 -1.374 -4.253
277 HD11 LEU 38 1HD1 LEU 38 -7.014 -2.486 -3.532
278 HD12 LEU 38 2HD1 LEU 38 -5.965 -3.063 -4.839
279 HD13 LEU 38 3HD1 LEU 38 -5.458 -3.266 -3.152
280 HD21 LEU 38 1HD2 LEU 38 -5.474 0.593 -5.005
281 HD22 LEU 38 2HD2 LEU 38 -6.100 -0.826 -5.853
282 HD23 LEU 38 3HD2 LEU 38 -7.027 -0.115 -4.512
283 H PHE 39 H PHE 39 -1.508 -1.573 -2.190
284 HA PHE 39 HA PHE 39 -0.780 1.330 -1.939
285 HB2 PHE 39 2HB PHE 39 0.667 -1.166 -1.007
286 HB3 PHE 39 3HB PHE 39 1.421 0.411 -1.103
287 HD1 PHE 39 1HD PHE 39 -1.772 1.332 0.010
288 HD2 PHE 39 2HD PHE 39 1.742 -0.749 1.392
289 HE1 PHE 39 1HE PHE 39 -2.439 1.729 2.317
290 HE2 PHE 39 2HE PHE 39 1.097 -0.273 3.723
291 HZ PHE 39 HZ PHE 39 -1.027 0.918 4.205
292 H HIS 40 H HIS 40 0.711 2.126 -3.404
293 HA HIS 40 HA HIS 40 0.752 1.163 -6.069
294 HB2 HIS 40 1HB HIS 40 2.232 3.112 -4.392
295 HB3 HIS 40 2HB HIS 40 3.199 2.472 -5.704
296 HD2 HIS 40 2HD HIS 40 0.811 2.507 -7.991
297 HE1 HIS 40 1HE HIS 40 1.420 6.680 -7.492
298 HE2 HIS 40 2HE HIS 40 0.517 4.876 -9.038
299 H GLN 41 H GLN 41 2.386 -0.020 -7.267
300 HA GLN 41 HA GLN 41 3.476 -2.169 -5.757
301 HB2 GLN 41 2HB GLN 41 2.640 -2.178 -8.130
302 HB3 GLN 41 3HB GLN 41 4.159 -1.415 -8.628
303 HG2 GLN 41 2HG GLN 41 5.443 -3.316 -7.905
304 HG3 GLN 41 3HG GLN 41 4.092 -3.980 -6.982
305 HE21 GLN 41 1HE2 GLN 41 1.916 -4.203 -8.619
306 HE22 GLN 41 2HE2 GLN 41 2.386 -5.075 -10.065
307 H VAL 42 H VAL 42 5.000 0.751 -7.204
308 HA VAL 42 HA VAL 42 7.664 0.001 -6.344
309 HB VAL 42 HB VAL 42 6.422 2.629 -7.249
310 HG11 VAL 42 1HG1 VAL 42 8.333 3.243 -5.860
311 HG12 VAL 42 2HG1 VAL 42 9.342 1.994 -6.624
312 HG13 VAL 42 3HG1 VAL 42 8.796 3.406 -7.557
313 HG21 VAL 42 1HG2 VAL 42 7.678 2.154 -9.315
314 HG22 VAL 42 2HG2 VAL 42 8.354 0.680 -8.591
315 HG23 VAL 42 3HG2 VAL 42 6.618 0.787 -8.942
316 H CYS 43 H CYS 43 5.232 2.328 -5.017
317 HA CYS 43 HA CYS 43 6.770 3.206 -2.793
318 HB2 CYS 43 2HB CYS 43 3.763 2.889 -2.888
319 HB3 CYS 43 3HB CYS 43 4.709 4.042 -1.952
320 H VAL 44 H VAL 44 4.533 0.357 -3.051
321 HA VAL 44 HA VAL 44 4.929 -0.353 -0.341
322 HB VAL 44 HB VAL 44 2.967 -0.983 -1.840
323 HG11 VAL 44 1HG1 VAL 44 4.369 -2.083 -3.605
324 HG12 VAL 44 2HG1 VAL 44 4.771 -3.356 -2.441
325 HG13 VAL 44 3HG1 VAL 44 3.085 -3.110 -2.937
326 HG21 VAL 44 1HG2 VAL 44 4.268 -3.148 -0.162
327 HG22 VAL 44 2HG2 VAL 44 3.382 -1.765 0.485
328 HG23 VAL 44 3HG2 VAL 44 2.542 -2.970 -0.528
329 H ASP 45 H ASP 45 6.842 -0.929 -3.243
330 HA ASP 45 HA ASP 45 8.193 -3.273 -2.346
331 HB2 ASP 45 2HB ASP 45 8.313 -2.204 -4.659
332 HB3 ASP 45 3HB ASP 45 9.416 -1.004 -3.979
333 H GLN 46 H GLN 46 9.175 0.164 -2.155
334 HA GLN 46 HA GLN 46 11.237 -0.295 -0.197
335 HB2 GLN 46 2HB GLN 46 9.678 2.178 -1.061
336 HB3 GLN 46 3HB GLN 46 10.966 2.264 0.141
337 HG2 GLN 46 2HG GLN 46 11.605 0.909 -2.480
338 HG3 GLN 46 3HG GLN 46 11.414 2.664 -2.474
339 HE21 GLN 46 1HE2 GLN 46 13.535 3.446 -2.617
340 HE22 GLN 46 2HE2 GLN 46 14.775 2.973 -1.463
341 H ALA 47 H ALA 47 7.751 0.209 0.174
342 HA ALA 47 HA ALA 47 7.837 0.710 2.985
343 HB1 ALA 47 1HB ALA 47 5.758 -0.903 1.475
344 HB2 ALA 47 2HB ALA 47 5.538 -0.012 2.994
345 HB3 ALA 47 3HB ALA 47 5.834 0.880 1.477
346 H LEU 48 H LEU 48 7.352 -2.419 1.259
347 HA LEU 48 HA LEU 48 7.327 -4.044 3.472
348 HB2 LEU 48 2HB LEU 48 6.542 -4.545 1.188
349 HB3 LEU 48 3HB LEU 48 8.200 -4.711 0.625
350 HG LEU 48 HG LEU 48 7.071 -6.414 2.890
351 HD11 LEU 48 1HD1 LEU 48 6.978 -7.013 -0.090
352 HD12 LEU 48 2HD1 LEU 48 6.504 -8.122 1.220
353 HD13 LEU 48 3HD1 LEU 48 5.579 -6.641 0.945
354 HD21 LEU 48 1HD2 LEU 48 8.760 -8.080 1.912
355 HD22 LEU 48 2HD2 LEU 48 9.394 -6.741 0.935
356 HD23 LEU 48 3HD2 LEU 48 9.474 -6.686 2.708
357 H ILE 49 H ILE 49 10.173 -3.193 1.388
358 HA ILE 49 HA ILE 49 11.966 -4.800 2.923
359 HB ILE 49 HB ILE 49 13.752 -3.702 1.838
360 HG12 ILE 49 2HG1 ILE 49 12.984 -1.737 0.164
361 HG13 ILE 49 3HG1 ILE 49 11.950 -1.411 1.562
362 HG21 ILE 49 1HG2 ILE 49 12.343 -5.259 0.517
363 HG22 ILE 49 2HG2 ILE 49 11.501 -3.864 -0.181
364 HG23 ILE 49 3HG2 ILE 49 13.230 -4.078 -0.463
365 HD11 ILE 49 1HD1 ILE 49 14.047 -0.169 1.755
366 HD12 ILE 49 2HD1 ILE 49 13.983 -1.395 3.028
367 HD13 ILE 49 3HD1 ILE 49 14.981 -1.669 1.587
368 H THR 50 H THR 50 10.763 -1.464 3.446
369 HA THR 50 HA THR 50 12.730 -0.859 5.443
370 HB THR 50 HB THR 50 10.025 0.337 4.735
371 HG1 THR 50 1HG THR 50 11.598 0.790 3.295
372 HG21 THR 50 1HG2 THR 50 10.292 0.874 7.086
373 HG22 THR 50 2HG2 THR 50 12.011 1.271 6.848
374 HG23 THR 50 3HG2 THR 50 10.741 2.291 6.131
375 H ASN 51 H ASN 51 9.342 -2.034 5.610
376 HA ASN 51 HA ASN 51 9.825 -3.637 7.927
377 HB2 ASN 51 2HB ASN 51 8.209 -2.476 9.403
378 HB3 ASN 51 3HB ASN 51 9.709 -1.582 9.160
379 HD21 ASN 51 1HD2 ASN 51 7.385 -0.346 10.194
380 HD22 ASN 51 2HD2 ASN 51 6.898 0.827 8.975
381 H LYS 52 H LYS 52 9.019 -5.078 6.273
382 HA LYS 52 HA LYS 52 6.744 -5.225 4.973
383 HB2 LYS 52 2HB LYS 52 6.646 -7.662 5.358
384 HB3 LYS 52 3HB LYS 52 8.195 -6.990 4.884
385 HG2 LYS 52 2HG LYS 52 8.698 -7.060 7.515
386 HG3 LYS 52 3HG LYS 52 7.425 -8.298 7.465
387 HD2 LYS 52 2HD LYS 52 8.713 -9.268 5.443
388 HD3 LYS 52 3HD LYS 52 10.036 -8.209 5.887
389 HE2 LYS 52 2HE LYS 52 8.773 -10.282 7.750
390 HE3 LYS 52 3HE LYS 52 10.173 -10.600 6.728
391 HZ1 LYS 52 1HZ LYS 52 11.408 -8.944 7.817
392 HZ2 LYS 52 2HZ LYS 52 10.148 -8.550 8.809
393 HZ3 LYS 52 3HZ LYS 52 10.858 -10.044 8.903
394 H LYS 53 H LYS 53 6.554 -6.059 8.457
395 HA LYS 53 HA LYS 53 3.775 -6.395 8.354
396 HB2 LYS 53 2HB LYS 53 5.215 -5.198 10.784
397 HB3 LYS 53 3HB LYS 53 3.689 -6.056 10.765
398 HG2 LYS 53 2HG LYS 53 5.035 -7.633 11.657
399 HG3 LYS 53 3HG LYS 53 5.117 -8.124 9.971
400 HD2 LYS 53 2HD LYS 53 7.325 -7.263 9.721
401 HD3 LYS 53 3HD LYS 53 7.214 -6.274 11.182
402 HE2 LYS 53 2HE LYS 53 7.155 -9.324 11.150
403 HE3 LYS 53 3HE LYS 53 8.628 -8.364 11.359
404 HZ1 LYS 53 1HZ LYS 53 7.643 -7.382 13.327
405 HZ2 LYS 53 2HZ LYS 53 6.304 -8.330 13.165
406 HZ3 LYS 53 3HZ LYS 53 7.765 -9.016 13.470
407 H CYS 54 H CYS 54 2.186 -5.066 7.931
408 HA CYS 54 HA CYS 54 2.345 -2.586 6.824
409 HB2 CYS 54 2HB CYS 54 0.384 -4.030 6.791
410 HB3 CYS 54 3HB CYS 54 0.094 -3.717 8.505
411 HA PRO 55 HA PRO 55 3.589 -0.126 10.320
412 HB2 PRO 55 2HB PRO 55 3.685 2.375 9.181
413 HB3 PRO 55 3HB PRO 55 4.863 1.076 8.831
414 HG2 PRO 55 2HG PRO 55 2.411 1.828 7.224
415 HG3 PRO 55 3HG PRO 55 4.086 1.576 6.634
416 HD2 PRO 55 2HD PRO 55 2.213 -0.389 6.495
417 HD3 PRO 55 3HD PRO 55 3.921 -0.771 6.888
418 H ILE 56 H ILE 56 0.481 -0.308 9.254
419 HA ILE 56 HA ILE 56 -0.473 1.612 11.330
420 HB ILE 56 HB ILE 56 -1.947 0.702 8.811
421 HG12 ILE 56 2HG1 ILE 56 -1.800 3.455 8.694
422 HG13 ILE 56 3HG1 ILE 56 -0.221 3.060 9.367
423 HG21 ILE 56 1HG2 ILE 56 -3.463 1.053 10.712
424 HG22 ILE 56 2HG2 ILE 56 -2.751 2.655 11.002
425 HG23 ILE 56 3HG2 ILE 56 -3.662 2.330 9.509
426 HD11 ILE 56 1HD1 ILE 56 -1.459 1.967 6.794
427 HD12 ILE 56 2HD1 ILE 56 -0.107 3.110 6.919
428 HD13 ILE 56 3HD1 ILE 56 0.099 1.426 7.448
429 H CYS 57 H CYS 57 -1.505 -1.263 9.479
430 HA CYS 57 HA CYS 57 -3.263 -2.304 11.498
431 HB2 CYS 57 2HB CYS 57 -2.009 -3.891 9.255
432 HB3 CYS 57 3HB CYS 57 -3.628 -4.007 9.949
433 H ARG 58 H ARG 58 0.168 -2.644 10.985
434 HA ARG 58 HA ARG 58 1.798 -3.885 11.861
435 HB2 ARG 58 2HB ARG 58 0.735 -2.573 13.828
436 HB3 ARG 58 3HB ARG 58 0.098 -4.141 14.349
437 HG2 ARG 58 2HG ARG 58 2.514 -5.005 14.247
438 HG3 ARG 58 3HG ARG 58 3.020 -3.329 13.967
439 HD2 ARG 58 2HD ARG 58 2.155 -2.630 16.108
440 HD3 ARG 58 3HD ARG 58 1.283 -4.167 16.311
441 HE ARG 58 HE ARG 58 4.131 -4.523 15.999
442 HH11 ARG 58 1HH1 ARG 58 4.502 -5.551 19.355
443 HH12 ARG 58 2HH1 ARG 58 5.206 -5.573 17.781
444 HH21 ARG 58 1HH2 ARG 58 2.402 -4.488 19.695
445 HH22 ARG 58 2HH2 ARG 58 1.635 -3.725 18.348
446 H VAL 59 H VAL 59 0.188 -5.401 10.205
447 HA VAL 59 HA VAL 59 0.416 -8.099 11.454
448 HB VAL 59 HB VAL 59 -1.413 -7.314 9.139
449 HG11 VAL 59 1HG1 VAL 59 -1.194 -9.855 10.820
450 HG12 VAL 59 2HG1 VAL 59 -2.416 -9.551 9.568
451 HG13 VAL 59 3HG1 VAL 59 -0.718 -9.677 9.112
452 HG21 VAL 59 1HG2 VAL 59 -2.346 -6.263 11.111
453 HG22 VAL 59 2HG2 VAL 59 -3.292 -7.709 10.769
454 HG23 VAL 59 3HG2 VAL 59 -2.091 -7.729 12.081
455 H ASP 60 H ASP 60 1.559 -9.603 10.170
456 HA ASP 60 HA ASP 60 3.561 -8.373 8.502
457 HB2 ASP 60 2HB ASP 60 3.904 -10.371 9.988
458 HB3 ASP 60 3HB ASP 60 2.988 -11.325 8.813
459 H ILE 61 H ILE 61 3.846 -8.537 6.339
460 HA ILE 61 HA ILE 61 1.521 -9.415 4.718
461 HB ILE 61 HB ILE 61 1.873 -7.607 3.281
462 HG12 ILE 61 2HG1 ILE 61 4.407 -6.986 4.839
463 HG13 ILE 61 3HG1 ILE 61 4.360 -7.655 3.238
464 HG21 ILE 61 1HG2 ILE 61 1.284 -5.756 4.647
465 HG22 ILE 61 2HG2 ILE 61 0.825 -7.145 5.636
466 HG23 ILE 61 3HG2 ILE 61 2.347 -6.296 5.981
467 HD11 ILE 61 1HD1 ILE 61 3.072 -5.755 2.408
468 HD12 ILE 61 2HD1 ILE 61 3.290 -4.945 3.978
469 HD13 ILE 61 3HD1 ILE 61 4.719 -5.320 2.982
470 H GLU 62 H GLU 62 4.886 -9.847 5.315
471 HA GLU 62 HA GLU 62 5.909 -10.460 2.820
472 HB2 GLU 62 2HB GLU 62 6.997 -10.589 5.194
473 HB3 GLU 62 3HB GLU 62 6.435 -12.265 5.197
474 HG2 GLU 62 2HG GLU 62 7.580 -12.487 2.884
475 HG3 GLU 62 3HG GLU 62 8.309 -10.913 3.204
476 H ALA 63 H ALA 63 5.796 -12.228 1.387
477 HA ALA 63 HA ALA 63 3.957 -14.420 2.056
478 HB1 ALA 63 1HB ALA 63 2.685 -14.032 -0.038
479 HB2 ALA 63 2HB ALA 63 2.527 -12.646 1.066
480 HB3 ALA 63 3HB ALA 63 3.617 -12.547 -0.336
481 H GLN 64 H GLN 64 4.213 -16.172 0.544
482 HA GLN 64 HA GLN 64 6.925 -16.632 -0.175
483 HB2 GLN 64 2HB GLN 64 4.693 -18.202 0.200
484 HB3 GLN 64 3HB GLN 64 4.781 -18.210 -1.563
485 HG2 GLN 64 2HG GLN 64 6.956 -19.023 0.419
486 HG3 GLN 64 3HG GLN 64 6.010 -20.112 -0.602
487 HE21 GLN 64 1HE2 GLN 64 6.497 -20.166 -2.961
488 HE22 GLN 64 2HE2 GLN 64 7.985 -19.400 -3.520
489 H LEU 65 H LEU 65 8.013 -16.278 -2.131
490 HA LEU 65 HA LEU 65 6.510 -14.966 -4.332
491 HB2 LEU 65 2HB LEU 65 8.886 -13.971 -2.742
492 HB3 LEU 65 3HB LEU 65 8.727 -13.513 -4.433
493 HG LEU 65 HG LEU 65 6.362 -13.111 -2.583
494 HD11 LEU 65 1HD1 LEU 65 8.226 -12.084 -1.383
495 HD12 LEU 65 2HD1 LEU 65 8.739 -11.224 -2.855
496 HD13 LEU 65 3HD1 LEU 65 7.185 -10.833 -2.076
497 HD21 LEU 65 1HD2 LEU 65 5.917 -11.241 -4.127
498 HD22 LEU 65 2HD2 LEU 65 7.425 -11.583 -5.003
499 HD23 LEU 65 3HD2 LEU 65 6.087 -12.755 -5.026
500 HA PRO 66 HA PRO 66 8.871 -17.989 -6.490
501 HB2 PRO 66 2HB PRO 66 8.801 -17.068 -9.070
502 HB3 PRO 66 3HB PRO 66 7.346 -17.676 -8.218
503 HG2 PRO 66 2HG PRO 66 8.242 -14.796 -8.544
504 HG3 PRO 66 3HG PRO 66 6.615 -15.490 -8.847
505 HD2 PRO 66 2HD PRO 66 7.263 -14.240 -6.499
506 HD3 PRO 66 3HD PRO 66 6.155 -15.649 -6.539
507 H SER 67 H SER 67 10.858 -18.199 -7.954
508 HA SER 67 HA SER 67 13.031 -16.619 -6.921
509 HB2 SER 67 2HB SER 67 14.249 -18.013 -8.710
510 HB3 SER 67 3HB SER 67 13.373 -18.944 -7.474
511 HG SER 67 HG SER 67 12.267 -18.205 -9.986
512 H GLU 68 H GLU 68 14.362 -15.216 -8.101
513 HA GLU 68 HA GLU 68 15.036 -13.699 -9.595
514 HB2 GLU 68 2HB GLU 68 13.843 -15.434 -11.396
515 HB3 GLU 68 3HB GLU 68 12.921 -13.941 -11.642
516 HG2 GLU 68 2HG GLU 68 15.371 -12.852 -11.612
517 HG3 GLU 68 3HG GLU 68 15.873 -14.502 -11.991
518 H SER 69 H SER 69 13.805 -11.561 -10.836
519 HA SER 69 HA SER 69 11.473 -10.730 -9.344
520 HB2 SER 69 2HB SER 69 12.778 -8.889 -8.169
521 HB3 SER 69 3HB SER 69 13.049 -10.519 -7.513
522 HG SER 69 HG SER 69 14.665 -9.422 -9.542
Start of MODEL 16
1 H1 MET 1 H1 MET 1 0.366 43.399 -6.686
2 H2 MET 1 H2 MET 1 1.529 43.089 -7.823
3 H3 MET 1 H3 MET 1 -0.027 43.430 -8.276
4 HA MET 1 HA MET 1 0.282 41.088 -8.493
5 HB2 MET 1 2HB MET 1 1.279 41.429 -5.647
6 HB3 MET 1 3HB MET 1 0.684 39.866 -6.227
7 HG2 MET 1 2HG MET 1 2.478 39.487 -7.552
8 HG3 MET 1 3HG MET 1 2.605 41.166 -8.068
9 HE1 MET 1 1HE MET 1 5.553 39.112 -5.569
10 HE2 MET 1 2HE MET 1 3.925 38.405 -5.688
11 HE3 MET 1 3HE MET 1 4.830 38.816 -7.166
12 H LYS 2 H LYS 2 -1.702 39.913 -8.330
13 HA LYS 2 HA LYS 2 -3.311 40.207 -5.978
14 HB2 LYS 2 2HB LYS 2 -3.798 42.190 -7.835
15 HB3 LYS 2 3HB LYS 2 -4.885 40.938 -8.431
16 HG2 LYS 2 2HG LYS 2 -5.995 40.816 -6.245
17 HG3 LYS 2 3HG LYS 2 -4.785 41.910 -5.539
18 HD2 LYS 2 2HD LYS 2 -5.468 43.703 -7.096
19 HD3 LYS 2 3HD LYS 2 -6.730 42.662 -7.770
20 HE2 LYS 2 2HE LYS 2 -6.517 43.433 -4.822
21 HE3 LYS 2 3HE LYS 2 -7.467 44.348 -6.001
22 HZ1 LYS 2 1HZ LYS 2 -8.800 42.402 -6.391
23 HZ2 LYS 2 2HZ LYS 2 -7.911 41.508 -5.330
24 HZ3 LYS 2 3HZ LYS 2 -8.815 42.770 -4.790
25 H GLN 3 H GLN 3 -3.973 38.034 -5.721
26 HA GLN 3 HA GLN 3 -5.194 36.674 -7.929
27 HB2 GLN 3 2HB GLN 3 -2.544 36.255 -8.059
28 HB3 GLN 3 3HB GLN 3 -2.863 35.189 -6.685
29 HG2 GLN 3 2HG GLN 3 -4.717 34.133 -8.162
30 HG3 GLN 3 3HG GLN 3 -4.021 35.055 -9.501
31 HE21 GLN 3 1HE2 GLN 3 -2.210 34.112 -10.588
32 HE22 GLN 3 2HE2 GLN 3 -1.412 32.683 -9.939
33 H ASP 4 H ASP 4 -6.552 34.956 -7.012
34 HA ASP 4 HA ASP 4 -6.069 33.958 -4.386
35 HB2 ASP 4 2HB ASP 4 -7.254 36.208 -3.946
36 HB3 ASP 4 3HB ASP 4 -8.656 35.531 -4.782
37 H GLY 5 H GLY 5 -7.671 32.107 -4.041
38 HA2 GLY 5 2HA GLY 5 -9.750 31.366 -5.642
39 HA3 GLY 5 3HA GLY 5 -8.337 30.866 -6.596
40 H GLU 6 H GLU 6 -10.301 29.030 -5.479
41 HA GLU 6 HA GLU 6 -8.419 27.283 -4.168
42 HB2 GLU 6 2HB GLU 6 -9.792 26.737 -2.271
43 HB3 GLU 6 3HB GLU 6 -9.512 28.467 -2.258
44 HG2 GLU 6 2HG GLU 6 -11.714 28.699 -1.958
45 HG3 GLU 6 3HG GLU 6 -11.910 28.332 -3.661
46 H GLU 7 H GLU 7 -9.279 25.013 -4.297
47 HA GLU 7 HA GLU 7 -11.847 24.550 -5.255
48 HB2 GLU 7 2HB GLU 7 -9.820 24.704 -7.351
49 HB3 GLU 7 3HB GLU 7 -10.316 23.019 -7.160
50 HG2 GLU 7 2HG GLU 7 -12.686 23.659 -7.369
51 HG3 GLU 7 3HG GLU 7 -12.236 25.357 -7.548
52 H GLY 8 H GLY 8 -12.361 22.594 -4.273
53 HA2 GLY 8 2HA GLY 8 -10.275 20.577 -3.795
54 HA3 GLY 8 3HA GLY 8 -11.042 21.300 -2.361
55 H THR 9 H THR 9 -11.279 18.483 -3.147
56 HA THR 9 HA THR 9 -14.184 18.317 -3.702
57 HB THR 9 HB THR 9 -13.644 16.411 -5.238
58 HG1 THR 9 1HG THR 9 -11.572 15.886 -4.522
59 HG21 THR 9 1HG2 THR 9 -12.255 18.967 -6.134
60 HG22 THR 9 2HG2 THR 9 -12.998 17.720 -7.150
61 HG23 THR 9 3HG2 THR 9 -14.019 18.740 -6.114
62 H GLU 10 H GLU 10 -14.527 15.617 -3.550
63 HA GLU 10 HA GLU 10 -13.757 14.795 -0.892
64 HB2 GLU 10 2HB GLU 10 -15.078 13.533 -3.291
65 HB3 GLU 10 3HB GLU 10 -14.307 12.462 -2.113
66 HG2 GLU 10 2HG GLU 10 -15.584 13.484 -0.276
67 HG3 GLU 10 3HG GLU 10 -16.374 14.581 -1.420
68 H GLU 11 H GLU 11 -12.515 12.778 -0.594
69 HA GLU 11 HA GLU 11 -10.151 12.357 -2.232
70 HB2 GLU 11 2HB GLU 11 -10.252 14.220 0.014
71 HB3 GLU 11 3HB GLU 11 -9.335 12.809 0.514
72 HG2 GLU 11 2HG GLU 11 -8.709 13.995 -2.199
73 HG3 GLU 11 3HG GLU 11 -8.204 14.882 -0.754
74 H ASP 12 H ASP 12 -9.095 10.439 -1.398
75 HA ASP 12 HA ASP 12 -9.425 8.150 -1.168
76 HB2 ASP 12 2HB ASP 12 -8.600 9.120 0.987
77 HB3 ASP 12 3HB ASP 12 -10.242 9.016 1.609
78 H THR 13 H THR 13 -11.309 8.200 -2.645
79 HA THR 13 HA THR 13 -13.722 7.098 -1.263
80 HB THR 13 HB THR 13 -13.649 9.646 -1.837
81 HG1 THR 13 1HG THR 13 -15.871 9.588 -1.824
82 HG21 THR 13 1HG2 THR 13 -14.871 8.618 -4.420
83 HG22 THR 13 2HG2 THR 13 -14.699 10.298 -3.897
84 HG23 THR 13 3HG2 THR 13 -13.250 9.348 -4.295
85 H GLU 14 H GLU 14 -11.391 6.328 -3.170
86 HA GLU 14 HA GLU 14 -12.921 4.554 -4.888
87 HB2 GLU 14 2HB GLU 14 -12.139 6.864 -6.044
88 HB3 GLU 14 3HB GLU 14 -10.588 6.036 -6.148
89 HG2 GLU 14 2HG GLU 14 -11.606 4.219 -7.441
90 HG3 GLU 14 3HG GLU 14 -13.226 4.864 -7.146
91 H GLU 15 H GLU 15 -9.506 5.754 -4.505
92 HA GLU 15 HA GLU 15 -8.738 3.791 -2.589
93 HB2 GLU 15 2HB GLU 15 -7.231 2.592 -4.287
94 HB3 GLU 15 3HB GLU 15 -8.919 2.147 -4.292
95 HG2 GLU 15 2HG GLU 15 -9.403 3.535 -6.226
96 HG3 GLU 15 3HG GLU 15 -7.813 4.256 -6.188
97 H LYS 16 H LYS 16 -6.793 4.430 -1.737
98 HA LYS 16 HA LYS 16 -4.950 5.997 -3.395
99 HB2 LYS 16 2HB LYS 16 -4.475 7.539 -1.442
100 HB3 LYS 16 3HB LYS 16 -5.971 7.834 -2.335
101 HG2 LYS 16 2HG LYS 16 -7.322 7.093 -0.669
102 HG3 LYS 16 3HG LYS 16 -6.051 6.116 0.097
103 HD2 LYS 16 2HD LYS 16 -6.552 8.185 1.410
104 HD3 LYS 16 3HD LYS 16 -4.876 8.127 0.837
105 HE2 LYS 16 2HE LYS 16 -5.463 9.559 -1.105
106 HE3 LYS 16 3HE LYS 16 -7.140 9.621 -0.584
107 HZ1 LYS 16 1HZ LYS 16 -6.530 10.867 1.290
108 HZ2 LYS 16 2HZ LYS 16 -4.894 10.642 1.046
109 HZ3 LYS 16 3HZ LYS 16 -5.803 11.521 0.006
110 H CYS 17 H CYS 17 -2.870 5.996 -2.735
111 HA CYS 17 HA CYS 17 -1.575 3.716 -1.396
112 HB2 CYS 17 2HB CYS 17 -0.838 5.126 -3.399
113 HB3 CYS 17 3HB CYS 17 -0.664 6.460 -2.277
114 H THR 18 H THR 18 -1.183 3.656 0.877
115 HA THR 18 HA THR 18 -1.817 6.078 2.405
116 HB THR 18 HB THR 18 -2.321 3.626 3.082
117 HG1 THR 18 1HG THR 18 -2.717 5.468 4.366
118 HG21 THR 18 1HG2 THR 18 0.431 3.982 4.348
119 HG22 THR 18 2HG2 THR 18 -0.676 2.626 4.554
120 HG23 THR 18 3HG2 THR 18 0.102 2.901 2.973
121 H ILE 19 H ILE 19 1.040 4.684 0.929
122 HA ILE 19 HA ILE 19 2.869 5.653 2.932
123 HB ILE 19 HB ILE 19 3.073 4.343 0.218
124 HG12 ILE 19 2HG1 ILE 19 4.068 3.296 2.887
125 HG13 ILE 19 3HG1 ILE 19 2.352 3.188 2.499
126 HG21 ILE 19 1HG2 ILE 19 5.028 5.759 0.378
127 HG22 ILE 19 2HG2 ILE 19 5.304 5.271 2.065
128 HG23 ILE 19 3HG2 ILE 19 5.535 4.102 0.745
129 HD11 ILE 19 1HD1 ILE 19 4.565 2.062 0.767
130 HD12 ILE 19 2HD1 ILE 19 3.519 1.138 1.867
131 HD13 ILE 19 3HD1 ILE 19 2.819 1.953 0.450
132 H CYS 20 H CYS 20 2.156 6.532 -0.508
133 HA CYS 20 HA CYS 20 3.598 9.157 -0.219
134 HB2 CYS 20 2HB CYS 20 3.137 9.323 -2.590
135 HB3 CYS 20 3HB CYS 20 4.003 7.821 -2.220
136 H LEU 21 H LEU 21 0.538 7.938 0.555
137 HA LEU 21 HA LEU 21 -1.548 8.794 0.697
138 HB2 LEU 21 2HB LEU 21 0.113 11.174 1.526
139 HB3 LEU 21 3HB LEU 21 -1.624 11.022 1.824
140 HG LEU 21 HG LEU 21 0.400 8.969 2.780
141 HD11 LEU 21 1HD1 LEU 21 0.908 11.101 3.834
142 HD12 LEU 21 2HD1 LEU 21 -0.796 11.298 4.313
143 HD13 LEU 21 3HD1 LEU 21 0.187 9.981 5.001
144 HD21 LEU 21 1HD2 LEU 21 -2.004 8.212 2.624
145 HD22 LEU 21 2HD2 LEU 21 -1.403 8.253 4.280
146 HD23 LEU 21 3HD2 LEU 21 -2.463 9.552 3.689
147 H SER 22 H SER 22 -0.958 8.637 -1.958
148 HA SER 22 HA SER 22 -2.420 11.025 -2.969
149 HB2 SER 22 2HB SER 22 -1.312 10.897 -5.022
150 HB3 SER 22 3HB SER 22 -0.016 10.660 -3.840
151 HG SER 22 HG SER 22 -1.344 8.714 -5.444
152 H ILE 23 H ILE 23 -4.109 10.535 -4.539
153 HA ILE 23 HA ILE 23 -5.477 8.019 -4.290
154 HB ILE 23 HB ILE 23 -5.583 10.464 -6.104
155 HG12 ILE 23 2HG1 ILE 23 -6.368 10.575 -3.658
156 HG13 ILE 23 3HG1 ILE 23 -7.475 11.149 -4.898
157 HG21 ILE 23 1HG2 ILE 23 -6.363 8.804 -7.539
158 HG22 ILE 23 2HG2 ILE 23 -7.291 7.971 -6.283
159 HG23 ILE 23 3HG2 ILE 23 -7.812 9.567 -6.896
160 HD11 ILE 23 1HD1 ILE 23 -8.492 9.701 -3.082
161 HD12 ILE 23 2HD1 ILE 23 -8.859 9.204 -4.737
162 HD13 ILE 23 3HD1 ILE 23 -7.645 8.322 -3.787
163 H LEU 24 H LEU 24 -5.689 6.523 -6.040
164 HA LEU 24 HA LEU 24 -3.253 6.119 -7.679
165 HB2 LEU 24 2HB LEU 24 -5.549 4.355 -6.724
166 HB3 LEU 24 3HB LEU 24 -4.168 3.746 -7.630
167 HG LEU 24 HG LEU 24 -3.833 5.151 -4.949
168 HD11 LEU 24 1HD1 LEU 24 -5.246 3.306 -4.589
169 HD12 LEU 24 2HD1 LEU 24 -4.227 2.224 -5.550
170 HD13 LEU 24 3HD1 LEU 24 -3.629 2.877 -3.992
171 HD21 LEU 24 1HD2 LEU 24 -1.696 3.832 -5.011
172 HD22 LEU 24 2HD2 LEU 24 -2.068 3.461 -6.712
173 HD23 LEU 24 3HD2 LEU 24 -1.873 5.152 -6.202
174 H GLU 25 H GLU 25 -4.675 4.297 -9.456
175 HA GLU 25 HA GLU 25 -7.044 5.642 -10.394
176 HB2 GLU 25 2HB GLU 25 -6.409 5.954 -12.697
177 HB3 GLU 25 3HB GLU 25 -5.291 6.851 -11.665
178 HG2 GLU 25 2HG GLU 25 -3.597 5.074 -11.932
179 HG3 GLU 25 3HG GLU 25 -4.729 4.121 -12.910
180 H GLU 26 H GLU 26 -8.035 4.295 -12.273
181 HA GLU 26 HA GLU 26 -8.265 1.629 -11.358
182 HB2 GLU 26 2HB GLU 26 -10.082 2.777 -12.525
183 HB3 GLU 26 3HB GLU 26 -9.088 2.978 -13.967
184 HG2 GLU 26 2HG GLU 26 -10.727 1.203 -14.287
185 HG3 GLU 26 3HG GLU 26 -9.095 0.553 -14.370
186 H GLY 27 H GLY 27 -7.186 -0.165 -11.819
187 HA2 GLY 27 2HA GLY 27 -5.687 -1.639 -12.740
188 HA3 GLY 27 3HA GLY 27 -5.859 -0.722 -14.242
189 H GLU 28 H GLU 28 -4.557 1.010 -11.409
190 HA GLU 28 HA GLU 28 -2.087 1.457 -12.774
191 HB2 GLU 28 2HB GLU 28 -3.333 2.945 -11.106
192 HB3 GLU 28 3HB GLU 28 -2.692 1.915 -9.824
193 HG2 GLU 28 2HG GLU 28 -0.384 2.519 -10.520
194 HG3 GLU 28 3HG GLU 28 -1.026 3.431 -11.893
195 H ASP 29 H ASP 29 0.059 0.972 -11.779
196 HA ASP 29 HA ASP 29 0.409 -1.773 -10.998
197 HB2 ASP 29 2HB ASP 29 2.380 0.507 -10.667
198 HB3 ASP 29 3HB ASP 29 2.730 -1.213 -10.745
199 H VAL 30 H VAL 30 -0.725 -2.217 -9.099
200 HA VAL 30 HA VAL 30 0.334 -0.996 -6.619
201 HB VAL 30 HB VAL 30 -1.998 -1.097 -5.685
202 HG11 VAL 30 1HG1 VAL 30 -2.800 1.004 -6.843
203 HG12 VAL 30 2HG1 VAL 30 -1.166 1.078 -6.187
204 HG13 VAL 30 3HG1 VAL 30 -1.424 0.867 -7.935
205 HG21 VAL 30 1HG2 VAL 30 -3.013 -2.567 -7.455
206 HG22 VAL 30 2HG2 VAL 30 -3.913 -1.060 -7.177
207 HG23 VAL 30 3HG2 VAL 30 -2.886 -1.206 -8.590
208 H ARG 31 H ARG 31 0.056 -2.448 -4.774
209 HA ARG 31 HA ARG 31 -0.256 -5.274 -5.524
210 HB2 ARG 31 2HB ARG 31 2.048 -3.883 -4.251
211 HB3 ARG 31 3HB ARG 31 1.467 -5.223 -3.269
212 HG2 ARG 31 2HG ARG 31 2.010 -5.555 -6.230
213 HG3 ARG 31 3HG ARG 31 3.300 -5.704 -5.029
214 HD2 ARG 31 2HD ARG 31 2.635 -7.733 -4.358
215 HD3 ARG 31 3HD ARG 31 0.924 -7.278 -4.303
216 HE ARG 31 HE ARG 31 1.509 -7.425 -6.995
217 HH11 ARG 31 1HH1 ARG 31 1.017 -10.862 -7.552
218 HH12 ARG 31 2HH1 ARG 31 1.052 -9.294 -8.271
219 HH21 ARG 31 1HH2 ARG 31 1.431 -11.094 -5.219
220 HH22 ARG 31 2HH2 ARG 31 1.746 -9.677 -4.284
221 H ARG 32 H ARG 32 -0.795 -6.523 -3.395
222 HA ARG 32 HA ARG 32 -2.570 -4.845 -1.723
223 HB2 ARG 32 2HB ARG 32 -3.598 -6.264 -3.711
224 HB3 ARG 32 3HB ARG 32 -3.315 -7.638 -2.646
225 HG2 ARG 32 2HG ARG 32 -4.994 -5.157 -2.038
226 HG3 ARG 32 3HG ARG 32 -5.600 -6.741 -2.511
227 HD2 ARG 32 2HD ARG 32 -4.036 -7.311 -0.235
228 HD3 ARG 32 3HD ARG 32 -4.740 -5.764 0.137
229 HE ARG 32 HE ARG 32 -6.857 -6.657 0.190
230 HH11 ARG 32 1HH1 ARG 32 -7.930 -9.986 -0.238
231 HH12 ARG 32 2HH1 ARG 32 -8.383 -8.410 0.291
232 HH21 ARG 32 1HH2 ARG 32 -5.732 -10.378 -1.044
233 HH22 ARG 32 2HH2 ARG 32 -4.611 -9.065 -1.075
234 H LEU 33 H LEU 33 -2.411 -5.389 0.455
235 HA LEU 33 HA LEU 33 -0.533 -7.553 1.150
236 HB2 LEU 33 2HB LEU 33 -0.467 -5.823 3.251
237 HB3 LEU 33 3HB LEU 33 0.717 -5.836 1.952
238 HG LEU 33 HG LEU 33 -1.777 -4.108 1.913
239 HD11 LEU 33 1HD1 LEU 33 -0.559 -2.362 2.971
240 HD12 LEU 33 2HD1 LEU 33 -0.104 -3.760 3.933
241 HD13 LEU 33 3HD1 LEU 33 1.013 -3.156 2.718
242 HD21 LEU 33 1HD2 LEU 33 -0.756 -4.035 -0.297
243 HD22 LEU 33 2HD2 LEU 33 -0.217 -2.594 0.528
244 HD23 LEU 33 3HD2 LEU 33 0.873 -3.993 0.401
245 HA PRO 34 HA PRO 34 -3.463 -9.732 3.104
246 HB2 PRO 34 2HB PRO 34 -2.429 -10.492 5.565
247 HB3 PRO 34 3HB PRO 34 -1.909 -11.158 3.989
248 HG2 PRO 34 2HG PRO 34 -0.571 -9.051 5.671
249 HG3 PRO 34 3HG PRO 34 0.168 -10.364 4.699
250 HD2 PRO 34 2HD PRO 34 -0.039 -7.724 3.923
251 HD3 PRO 34 3HD PRO 34 0.098 -9.039 2.757
252 H CYS 35 H CYS 35 -2.284 -6.977 4.906
253 HA CYS 35 HA CYS 35 -4.488 -6.771 6.837
254 HB2 CYS 35 2HB CYS 35 -3.113 -5.076 7.632
255 HB3 CYS 35 3HB CYS 35 -1.942 -6.233 6.982
256 H MET 36 H MET 36 -5.140 -6.840 3.983
257 HA MET 36 HA MET 36 -6.331 -5.932 2.392
258 HB2 MET 36 2HB MET 36 -8.071 -5.095 4.732
259 HB3 MET 36 3HB MET 36 -8.552 -5.137 3.025
260 HG2 MET 36 2HG MET 36 -7.758 -7.603 3.044
261 HG3 MET 36 3HG MET 36 -7.812 -7.467 4.802
262 HE1 MET 36 1HE MET 36 -11.224 -8.817 5.333
263 HE2 MET 36 2HE MET 36 -9.560 -9.403 5.094
264 HE3 MET 36 3HE MET 36 -9.871 -7.992 6.137
265 H HIS 37 H HIS 37 -4.385 -4.565 2.185
266 HA HIS 37 HA HIS 37 -5.427 -1.808 1.769
267 HB2 HIS 37 1HB HIS 37 -2.985 -2.704 3.275
268 HB3 HIS 37 2HB HIS 37 -2.835 -1.293 2.240
269 HD2 HIS 37 2HD HIS 37 -4.930 0.620 2.645
270 HE1 HIS 37 1HE HIS 37 -5.167 -0.188 6.814
271 HE2 HIS 37 2HE HIS 37 -5.771 1.477 4.969
272 H LEU 38 H LEU 38 -4.423 -0.665 -0.014
273 HA LEU 38 HA LEU 38 -3.293 -2.423 -2.129
274 HB2 LEU 38 2HB LEU 38 -5.778 -2.187 -2.352
275 HB3 LEU 38 3HB LEU 38 -5.612 -0.444 -2.246
276 HG LEU 38 HG LEU 38 -3.896 -0.974 -4.341
277 HD11 LEU 38 1HD1 LEU 38 -5.028 -2.582 -5.823
278 HD12 LEU 38 2HD1 LEU 38 -4.486 -3.380 -4.333
279 HD13 LEU 38 3HD1 LEU 38 -6.204 -2.951 -4.556
280 HD21 LEU 38 1HD2 LEU 38 -5.704 -0.154 -5.785
281 HD22 LEU 38 2HD2 LEU 38 -6.902 -0.507 -4.525
282 HD23 LEU 38 3HD2 LEU 38 -5.663 0.738 -4.267
283 H PHE 39 H PHE 39 -1.279 -1.438 -2.463
284 HA PHE 39 HA PHE 39 -1.136 1.553 -2.401
285 HB2 PHE 39 2HB PHE 39 0.742 -0.467 -1.125
286 HB3 PHE 39 3HB PHE 39 1.048 1.262 -1.199
287 HD1 PHE 39 1HD PHE 39 1.155 -0.410 1.295
288 HD2 PHE 39 2HD PHE 39 -2.099 1.842 -0.417
289 HE1 PHE 39 1HE PHE 39 0.099 -0.207 3.523
290 HE2 PHE 39 2HE PHE 39 -3.177 1.965 1.762
291 HZ PHE 39 HZ PHE 39 -2.093 0.932 3.764
292 H HIS 40 H HIS 40 0.721 2.393 -3.695
293 HA HIS 40 HA HIS 40 0.986 1.164 -6.219
294 HB2 HIS 40 1HB HIS 40 2.926 2.976 -4.759
295 HB3 HIS 40 2HB HIS 40 3.114 2.512 -6.442
296 HD2 HIS 40 2HD HIS 40 0.813 3.158 -8.063
297 HE1 HIS 40 1HE HIS 40 0.483 6.905 -6.059
298 HE2 HIS 40 2HE HIS 40 -0.162 5.544 -8.175
299 H GLN 41 H GLN 41 2.446 -0.201 -7.173
300 HA GLN 41 HA GLN 41 4.002 -2.058 -5.625
301 HB2 GLN 41 2HB GLN 41 3.141 -1.631 -8.421
302 HB3 GLN 41 3HB GLN 41 4.768 -2.281 -8.331
303 HG2 GLN 41 2HG GLN 41 4.001 -4.036 -6.774
304 HG3 GLN 41 3HG GLN 41 2.349 -3.403 -6.890
305 HE21 GLN 41 1HE2 GLN 41 1.018 -4.226 -8.615
306 HE22 GLN 41 2HE2 GLN 41 1.719 -5.148 -9.932
307 H VAL 42 H VAL 42 4.804 0.963 -5.681
308 HA VAL 42 HA VAL 42 7.700 0.442 -6.059
309 HB VAL 42 HB VAL 42 6.237 3.030 -6.752
310 HG11 VAL 42 1HG1 VAL 42 8.420 3.719 -7.685
311 HG12 VAL 42 2HG1 VAL 42 8.559 3.387 -5.952
312 HG13 VAL 42 3HG1 VAL 42 9.148 2.195 -7.132
313 HG21 VAL 42 1HG2 VAL 42 5.724 1.351 -8.450
314 HG22 VAL 42 2HG2 VAL 42 6.916 2.476 -9.104
315 HG23 VAL 42 3HG2 VAL 42 7.431 0.870 -8.542
316 H CYS 43 H CYS 43 5.361 2.843 -4.652
317 HA CYS 43 HA CYS 43 6.769 3.638 -2.342
318 HB2 CYS 43 2HB CYS 43 3.809 2.964 -2.478
319 HB3 CYS 43 3HB CYS 43 4.632 4.113 -1.428
320 H VAL 44 H VAL 44 4.526 0.809 -2.689
321 HA VAL 44 HA VAL 44 5.123 -0.019 -0.028
322 HB VAL 44 HB VAL 44 2.964 -0.298 -1.399
323 HG11 VAL 44 1HG1 VAL 44 2.649 -2.339 -2.548
324 HG12 VAL 44 2HG1 VAL 44 4.197 -1.726 -3.180
325 HG13 VAL 44 3HG1 VAL 44 4.201 -3.007 -1.966
326 HG21 VAL 44 1HG2 VAL 44 2.364 -2.207 0.029
327 HG22 VAL 44 2HG2 VAL 44 4.087 -2.543 0.310
328 HG23 VAL 44 3HG2 VAL 44 3.374 -1.046 0.926
329 H ASP 45 H ASP 45 6.678 -0.585 -3.022
330 HA ASP 45 HA ASP 45 7.851 -3.168 -2.419
331 HB2 ASP 45 2HB ASP 45 7.842 -2.237 -4.708
332 HB3 ASP 45 3HB ASP 45 8.918 -0.929 -4.195
333 H GLN 46 H GLN 46 9.237 0.160 -2.311
334 HA GLN 46 HA GLN 46 11.423 -0.623 -0.644
335 HB2 GLN 46 2HB GLN 46 10.064 2.076 -1.099
336 HB3 GLN 46 3HB GLN 46 11.549 1.905 -0.160
337 HG2 GLN 46 2HG GLN 46 11.379 0.904 -3.031
338 HG3 GLN 46 3HG GLN 46 11.744 2.587 -2.641
339 HE21 GLN 46 1HE2 GLN 46 13.954 2.783 -3.133
340 HE22 GLN 46 2HE2 GLN 46 15.152 1.723 -2.402
341 H ALA 47 H ALA 47 8.109 0.260 0.213
342 HA ALA 47 HA ALA 47 8.568 0.578 3.006
343 HB1 ALA 47 1HB ALA 47 6.459 1.073 1.767
344 HB2 ALA 47 2HB ALA 47 6.164 -0.680 1.642
345 HB3 ALA 47 3HB ALA 47 6.203 0.099 3.237
346 H LEU 48 H LEU 48 7.501 -2.376 1.239
347 HA LEU 48 HA LEU 48 7.554 -4.151 3.382
348 HB2 LEU 48 2HB LEU 48 6.423 -4.422 1.211
349 HB3 LEU 48 3HB LEU 48 7.962 -4.637 0.388
350 HG LEU 48 HG LEU 48 7.129 -6.477 2.659
351 HD11 LEU 48 1HD1 LEU 48 6.347 -6.731 -0.270
352 HD12 LEU 48 2HD1 LEU 48 6.103 -7.974 0.980
353 HD13 LEU 48 3HD1 LEU 48 5.244 -6.433 1.090
354 HD21 LEU 48 1HD2 LEU 48 8.849 -6.879 0.160
355 HD22 LEU 48 2HD2 LEU 48 9.454 -6.773 1.824
356 HD23 LEU 48 3HD2 LEU 48 8.456 -8.145 1.340
357 H ILE 49 H ILE 49 10.166 -3.483 0.941
358 HA ILE 49 HA ILE 49 11.934 -5.370 2.144
359 HB ILE 49 HB ILE 49 13.661 -4.490 0.812
360 HG12 ILE 49 2HG1 ILE 49 12.936 -2.355 -0.666
361 HG13 ILE 49 3HG1 ILE 49 12.207 -1.950 0.897
362 HG21 ILE 49 1HG2 ILE 49 12.765 -4.729 -1.369
363 HG22 ILE 49 2HG2 ILE 49 11.791 -5.747 -0.292
364 HG23 ILE 49 3HG2 ILE 49 11.164 -4.193 -0.869
365 HD11 ILE 49 1HD1 ILE 49 14.423 -2.300 2.000
366 HD12 ILE 49 2HD1 ILE 49 15.125 -2.665 0.410
367 HD13 ILE 49 3HD1 ILE 49 14.481 -1.048 0.752
368 H THR 50 H THR 50 11.249 -1.949 2.917
369 HA THR 50 HA THR 50 13.479 -1.617 4.667
370 HB THR 50 HB THR 50 10.800 -0.231 4.363
371 HG1 THR 50 1HG THR 50 12.292 0.311 2.890
372 HG21 THR 50 1HG2 THR 50 12.916 0.404 6.447
373 HG22 THR 50 2HG2 THR 50 11.611 1.500 5.937
374 HG23 THR 50 3HG2 THR 50 11.208 -0.020 6.741
375 H ASN 51 H ASN 51 10.072 -2.680 5.239
376 HA ASN 51 HA ASN 51 10.909 -4.531 7.250
377 HB2 ASN 51 2HB ASN 51 9.761 -1.880 8.106
378 HB3 ASN 51 3HB ASN 51 9.043 -3.325 8.814
379 HD21 ASN 51 1HD2 ASN 51 11.459 -1.093 9.421
380 HD22 ASN 51 2HD2 ASN 51 12.446 -2.141 10.425
381 H LYS 52 H LYS 52 9.437 -6.210 7.070
382 HA LYS 52 HA LYS 52 7.046 -5.773 5.424
383 HB2 LYS 52 2HB LYS 52 8.046 -8.258 6.899
384 HB3 LYS 52 3HB LYS 52 6.657 -8.171 5.815
385 HG2 LYS 52 2HG LYS 52 8.082 -8.710 4.154
386 HG3 LYS 52 3HG LYS 52 8.609 -7.036 4.240
387 HD2 LYS 52 2HD LYS 52 10.405 -7.730 5.871
388 HD3 LYS 52 3HD LYS 52 9.873 -9.412 5.652
389 HE2 LYS 52 2HE LYS 52 10.186 -8.983 3.116
390 HE3 LYS 52 3HE LYS 52 11.039 -7.502 3.587
391 HZ1 LYS 52 1HZ LYS 52 11.773 -10.265 4.346
392 HZ2 LYS 52 2HZ LYS 52 12.566 -9.318 3.259
393 HZ3 LYS 52 3HZ LYS 52 12.568 -8.912 4.854
394 H LYS 53 H LYS 53 5.929 -4.178 6.756
395 HA LYS 53 HA LYS 53 4.145 -5.590 8.567
396 HB2 LYS 53 2HB LYS 53 4.454 -4.030 10.463
397 HB3 LYS 53 3HB LYS 53 5.871 -5.031 10.135
398 HG2 LYS 53 2HG LYS 53 6.672 -2.927 8.726
399 HG3 LYS 53 3HG LYS 53 5.520 -2.060 9.737
400 HD2 LYS 53 2HD LYS 53 7.859 -3.772 10.733
401 HD3 LYS 53 3HD LYS 53 7.847 -2.017 10.586
402 HE2 LYS 53 2HE LYS 53 7.444 -2.307 12.829
403 HE3 LYS 53 3HE LYS 53 5.816 -2.049 12.184
404 HZ1 LYS 53 1HZ LYS 53 5.516 -4.460 12.246
405 HZ2 LYS 53 2HZ LYS 53 7.046 -4.672 12.807
406 HZ3 LYS 53 3HZ LYS 53 5.933 -3.903 13.737
407 H CYS 54 H CYS 54 2.062 -4.743 8.361
408 HA CYS 54 HA CYS 54 1.497 -2.625 6.403
409 HB2 CYS 54 2HB CYS 54 0.090 -4.643 6.995
410 HB3 CYS 54 3HB CYS 54 -0.263 -3.869 8.540
411 HA PRO 55 HA PRO 55 2.447 0.520 9.370
412 HB2 PRO 55 2HB PRO 55 1.138 2.727 8.291
413 HB3 PRO 55 3HB PRO 55 2.686 2.052 7.707
414 HG2 PRO 55 2HG PRO 55 -0.088 1.552 6.613
415 HG3 PRO 55 3HG PRO 55 1.426 1.884 5.715
416 HD2 PRO 55 2HD PRO 55 0.459 -0.639 6.027
417 HD3 PRO 55 3HD PRO 55 2.219 -0.310 6.065
418 H ILE 56 H ILE 56 -0.968 1.251 8.397
419 HA ILE 56 HA ILE 56 -1.652 1.570 11.245
420 HB ILE 56 HB ILE 56 -3.846 2.335 10.323
421 HG12 ILE 56 2HG1 ILE 56 -2.512 2.369 7.583
422 HG13 ILE 56 3HG1 ILE 56 -3.519 1.010 8.092
423 HG21 ILE 56 1HG2 ILE 56 -1.931 3.842 10.880
424 HG22 ILE 56 2HG2 ILE 56 -1.422 3.789 9.179
425 HG23 ILE 56 3HG2 ILE 56 -2.990 4.493 9.627
426 HD11 ILE 56 1HD1 ILE 56 -5.433 2.510 8.448
427 HD12 ILE 56 2HD1 ILE 56 -4.444 3.912 7.978
428 HD13 ILE 56 3HD1 ILE 56 -4.813 2.653 6.791
429 H CYS 57 H CYS 57 -0.945 -0.960 10.814
430 HA CYS 57 HA CYS 57 -3.278 -2.471 11.670
431 HB2 CYS 57 2HB CYS 57 -2.550 -4.212 9.672
432 HB3 CYS 57 3HB CYS 57 -4.020 -3.261 9.776
433 H ARG 58 H ARG 58 0.187 -2.255 11.017
434 HA ARG 58 HA ARG 58 1.954 -3.269 11.829
435 HB2 ARG 58 2HB ARG 58 0.863 -2.073 13.837
436 HB3 ARG 58 3HB ARG 58 0.378 -3.682 14.375
437 HG2 ARG 58 2HG ARG 58 3.117 -3.991 13.790
438 HG3 ARG 58 3HG ARG 58 3.050 -2.356 14.386
439 HD2 ARG 58 2HD ARG 58 1.515 -4.255 16.082
440 HD3 ARG 58 3HD ARG 58 3.205 -4.716 15.878
441 HE ARG 58 HE ARG 58 3.015 -1.931 16.502
442 HH11 ARG 58 1HH1 ARG 58 3.794 -2.358 19.915
443 HH12 ARG 58 2HH1 ARG 58 3.760 -1.244 18.601
444 HH21 ARG 58 1HH2 ARG 58 3.138 -4.613 19.573
445 HH22 ARG 58 2HH2 ARG 58 2.609 -5.097 18.002
446 H VAL 59 H VAL 59 0.110 -5.176 10.496
447 HA VAL 59 HA VAL 59 0.905 -7.697 11.883
448 HB VAL 59 HB VAL 59 -1.446 -7.382 11.168
449 HG11 VAL 59 1HG1 VAL 59 -0.371 -7.476 8.337
450 HG12 VAL 59 2HG1 VAL 59 -2.077 -7.560 8.826
451 HG13 VAL 59 3HG1 VAL 59 -1.143 -6.083 9.134
452 HG21 VAL 59 1HG2 VAL 59 -0.117 -9.631 9.614
453 HG22 VAL 59 2HG2 VAL 59 -0.442 -9.668 11.367
454 HG23 VAL 59 3HG2 VAL 59 -1.779 -9.569 10.209
455 H ASP 60 H ASP 60 1.912 -9.329 10.547
456 HA ASP 60 HA ASP 60 4.101 -8.231 8.960
457 HB2 ASP 60 2HB ASP 60 4.326 -10.226 10.414
458 HB3 ASP 60 3HB ASP 60 3.162 -11.088 9.402
459 H ILE 61 H ILE 61 4.329 -8.444 6.762
460 HA ILE 61 HA ILE 61 1.973 -9.332 5.179
461 HB ILE 61 HB ILE 61 2.469 -7.655 3.563
462 HG12 ILE 61 2HG1 ILE 61 4.729 -6.756 5.404
463 HG13 ILE 61 3HG1 ILE 61 4.926 -7.542 3.822
464 HG21 ILE 61 1HG2 ILE 61 1.594 -5.782 4.717
465 HG22 ILE 61 2HG2 ILE 61 1.080 -7.159 5.701
466 HG23 ILE 61 3HG2 ILE 61 2.473 -6.202 6.217
467 HD11 ILE 61 1HD1 ILE 61 3.541 -5.704 2.837
468 HD12 ILE 61 2HD1 ILE 61 3.718 -4.841 4.392
469 HD13 ILE 61 3HD1 ILE 61 5.167 -5.227 3.434
470 H GLU 62 H GLU 62 5.322 -9.762 5.757
471 HA GLU 62 HA GLU 62 6.466 -10.504 3.374
472 HB2 GLU 62 2HB GLU 62 7.517 -10.449 5.677
473 HB3 GLU 62 3HB GLU 62 6.765 -11.992 6.027
474 HG2 GLU 62 2HG GLU 62 8.182 -12.115 3.464
475 HG3 GLU 62 3HG GLU 62 9.240 -11.452 4.697
476 H ALA 63 H ALA 63 4.745 -12.773 5.583
477 HA ALA 63 HA ALA 63 3.302 -13.928 3.373
478 HB1 ALA 63 1HB ALA 63 5.512 -15.134 3.210
479 HB2 ALA 63 2HB ALA 63 5.308 -15.670 4.883
480 HB3 ALA 63 3HB ALA 63 4.174 -16.218 3.612
481 H GLN 64 H GLN 64 2.180 -16.098 4.544
482 HA GLN 64 HA GLN 64 1.961 -15.784 7.421
483 HB2 GLN 64 2HB GLN 64 0.277 -14.136 6.519
484 HB3 GLN 64 3HB GLN 64 -0.580 -15.467 5.752
485 HG2 GLN 64 2HG GLN 64 0.003 -15.968 8.621
486 HG3 GLN 64 3HG GLN 64 -0.892 -14.473 8.381
487 HE21 GLN 64 1HE2 GLN 64 -2.796 -14.828 6.568
488 HE22 GLN 64 2HE2 GLN 64 -3.780 -16.230 6.981
489 H LEU 65 H LEU 65 3.155 -17.791 6.697
490 HA LEU 65 HA LEU 65 1.645 -20.070 7.125
491 HB2 LEU 65 2HB LEU 65 1.252 -19.398 4.441
492 HB3 LEU 65 3HB LEU 65 2.607 -20.513 4.356
493 HG LEU 65 HG LEU 65 1.295 -22.162 5.731
494 HD11 LEU 65 1HD1 LEU 65 -0.999 -20.209 5.209
495 HD12 LEU 65 2HD1 LEU 65 -1.177 -21.864 5.833
496 HD13 LEU 65 3HD1 LEU 65 -0.361 -20.633 6.801
497 HD21 LEU 65 1HD2 LEU 65 -0.175 -22.814 3.846
498 HD22 LEU 65 2HD2 LEU 65 0.024 -21.201 3.130
499 HD23 LEU 65 3HD2 LEU 65 1.417 -22.296 3.267
500 HA PRO 66 HA PRO 66 6.131 -21.324 6.343
501 HB2 PRO 66 2HB PRO 66 7.992 -19.668 5.233
502 HB3 PRO 66 3HB PRO 66 6.825 -20.580 4.230
503 HG2 PRO 66 2HG PRO 66 6.623 -17.703 5.167
504 HG3 PRO 66 3HG PRO 66 6.416 -18.339 3.502
505 HD2 PRO 66 2HD PRO 66 4.319 -17.860 5.174
506 HD3 PRO 66 3HD PRO 66 4.294 -19.198 3.990
507 H SER 67 H SER 67 8.472 -20.468 7.303
508 HA SER 67 HA SER 67 8.063 -18.324 9.272
509 HB2 SER 67 2HB SER 67 8.909 -21.169 9.978
510 HB3 SER 67 3HB SER 67 8.963 -19.772 11.072
511 HG SER 67 HG SER 67 6.552 -19.734 10.126
512 H GLU 68 H GLU 68 9.656 -17.017 8.707
513 HA GLU 68 HA GLU 68 11.617 -16.155 8.136
514 HB2 GLU 68 2HB GLU 68 12.821 -18.727 9.227
515 HB3 GLU 68 3HB GLU 68 13.716 -17.258 8.821
516 HG2 GLU 68 2HG GLU 68 12.413 -15.961 10.455
517 HG3 GLU 68 3HG GLU 68 11.459 -17.385 10.874
518 H SER 69 H SER 69 13.760 -16.639 6.733
519 HA SER 69 HA SER 69 13.523 -18.495 4.576
520 HB2 SER 69 2HB SER 69 12.869 -15.544 4.157
521 HB3 SER 69 3HB SER 69 13.516 -16.577 2.867
522 HG SER 69 HG SER 69 11.225 -17.314 4.347
Start of MODEL 17
1 H1 MET 1 H1 MET 1 -21.456 43.069 -23.359
2 H2 MET 1 H2 MET 1 -21.463 42.714 -24.968
3 H3 MET 1 H3 MET 1 -22.098 41.645 -23.873
4 HA MET 1 HA MET 1 -19.983 40.837 -24.547
5 HB2 MET 1 2HB MET 1 -17.970 42.260 -23.858
6 HB3 MET 1 3HB MET 1 -18.820 42.717 -25.330
7 HG2 MET 1 2HG MET 1 -19.401 44.055 -22.661
8 HG3 MET 1 3HG MET 1 -18.127 44.598 -23.744
9 HE1 MET 1 1HE MET 1 -20.678 47.413 -24.122
10 HE2 MET 1 2HE MET 1 -21.210 46.344 -22.806
11 HE3 MET 1 3HE MET 1 -19.478 46.697 -23.022
12 H LYS 2 H LYS 2 -19.602 39.248 -23.008
13 HA LYS 2 HA LYS 2 -18.791 39.898 -20.363
14 HB2 LYS 2 2HB LYS 2 -21.562 39.997 -20.681
15 HB3 LYS 2 3HB LYS 2 -21.345 38.321 -20.246
16 HG2 LYS 2 2HG LYS 2 -20.060 40.543 -18.599
17 HG3 LYS 2 3HG LYS 2 -21.774 40.200 -18.469
18 HD2 LYS 2 2HD LYS 2 -20.993 37.696 -18.054
19 HD3 LYS 2 3HD LYS 2 -19.446 38.459 -17.661
20 HE2 LYS 2 2HE LYS 2 -20.648 38.266 -15.601
21 HE3 LYS 2 3HE LYS 2 -20.703 39.976 -16.054
22 HZ1 LYS 2 1HZ LYS 2 -22.848 39.195 -15.331
23 HZ2 LYS 2 2HZ LYS 2 -22.939 39.576 -16.926
24 HZ3 LYS 2 3HZ LYS 2 -22.864 38.000 -16.457
25 H GLN 3 H GLN 3 -17.954 37.865 -19.389
26 HA GLN 3 HA GLN 3 -18.709 35.320 -20.482
27 HB2 GLN 3 2HB GLN 3 -16.131 36.626 -21.295
28 HB3 GLN 3 3HB GLN 3 -15.951 35.028 -20.598
29 HG2 GLN 3 2HG GLN 3 -18.131 34.875 -22.485
30 HG3 GLN 3 3HG GLN 3 -16.805 35.734 -23.261
31 HE21 GLN 3 1HE2 GLN 3 -15.494 34.281 -24.428
32 HE22 GLN 3 2HE2 GLN 3 -15.147 32.659 -23.847
33 H ASP 4 H ASP 4 -18.269 33.718 -18.903
34 HA ASP 4 HA ASP 4 -16.438 34.022 -16.775
35 HB2 ASP 4 2HB ASP 4 -18.213 35.669 -15.992
36 HB3 ASP 4 3HB ASP 4 -19.390 34.352 -16.045
37 H GLY 5 H GLY 5 -16.599 31.990 -15.420
38 HA2 GLY 5 2HA GLY 5 -18.451 30.093 -15.298
39 HA3 GLY 5 3HA GLY 5 -17.844 29.763 -16.929
40 H GLU 6 H GLU 6 -17.487 28.832 -13.722
41 HA GLU 6 HA GLU 6 -15.059 27.374 -14.434
42 HB2 GLU 6 2HB GLU 6 -15.139 29.533 -12.400
43 HB3 GLU 6 3HB GLU 6 -14.670 27.968 -11.725
44 HG2 GLU 6 2HG GLU 6 -12.978 27.715 -13.557
45 HG3 GLU 6 3HG GLU 6 -13.334 29.373 -14.068
46 H GLU 7 H GLU 7 -15.339 25.231 -13.772
47 HA GLU 7 HA GLU 7 -16.586 24.648 -11.316
48 HB2 GLU 7 2HB GLU 7 -18.619 24.750 -12.829
49 HB3 GLU 7 3HB GLU 7 -17.898 23.476 -13.817
50 HG2 GLU 7 2HG GLU 7 -17.849 22.743 -10.972
51 HG3 GLU 7 3HG GLU 7 -19.473 23.227 -11.437
52 H GLY 8 H GLY 8 -15.412 22.891 -10.606
53 HA2 GLY 8 2HA GLY 8 -14.440 20.766 -12.204
54 HA3 GLY 8 3HA GLY 8 -13.142 21.969 -12.008
55 H THR 9 H THR 9 -14.624 19.251 -10.566
56 HA THR 9 HA THR 9 -13.177 19.702 -8.046
57 HB THR 9 HB THR 9 -15.206 18.745 -6.866
58 HG1 THR 9 1HG THR 9 -17.156 18.823 -7.983
59 HG21 THR 9 1HG2 THR 9 -14.695 21.215 -6.862
60 HG22 THR 9 2HG2 THR 9 -15.786 21.399 -8.253
61 HG23 THR 9 3HG2 THR 9 -16.422 20.839 -6.698
62 H GLU 10 H GLU 10 -13.112 17.426 -6.842
63 HA GLU 10 HA GLU 10 -13.445 15.163 -8.614
64 HB2 GLU 10 2HB GLU 10 -11.168 16.357 -9.137
65 HB3 GLU 10 3HB GLU 10 -10.652 15.755 -7.556
66 HG2 GLU 10 2HG GLU 10 -11.110 13.433 -8.297
67 HG3 GLU 10 3HG GLU 10 -11.764 14.040 -9.826
68 H GLU 11 H GLU 11 -13.299 13.140 -7.274
69 HA GLU 11 HA GLU 11 -12.868 13.505 -4.411
70 HB2 GLU 11 2HB GLU 11 -15.119 12.731 -3.822
71 HB3 GLU 11 3HB GLU 11 -15.168 14.262 -4.692
72 HG2 GLU 11 2HG GLU 11 -15.668 12.866 -6.819
73 HG3 GLU 11 3HG GLU 11 -15.959 11.513 -5.716
74 H ASP 12 H ASP 12 -11.718 11.666 -3.779
75 HA ASP 12 HA ASP 12 -12.768 9.099 -4.456
76 HB2 ASP 12 2HB ASP 12 -11.285 9.635 -6.478
77 HB3 ASP 12 3HB ASP 12 -9.917 9.638 -5.363
78 H THR 13 H THR 13 -12.135 7.712 -2.876
79 HA THR 13 HA THR 13 -9.841 8.151 -1.152
80 HB THR 13 HB THR 13 -12.605 8.173 0.146
81 HG1 THR 13 1HG THR 13 -10.967 10.189 -0.745
82 HG21 THR 13 1HG2 THR 13 -9.801 8.388 1.309
83 HG22 THR 13 2HG2 THR 13 -11.237 9.011 2.153
84 HG23 THR 13 3HG2 THR 13 -11.118 7.293 1.796
85 H GLU 14 H GLU 14 -11.315 5.992 -3.056
86 HA GLU 14 HA GLU 14 -11.895 3.829 -1.191
87 HB2 GLU 14 2HB GLU 14 -11.765 4.223 -4.197
88 HB3 GLU 14 3HB GLU 14 -11.725 2.586 -3.544
89 HG2 GLU 14 2HG GLU 14 -13.896 4.583 -2.801
90 HG3 GLU 14 3HG GLU 14 -14.022 3.478 -4.174
91 H GLU 15 H GLU 15 -9.303 4.698 -3.545
92 HA GLU 15 HA GLU 15 -7.541 2.814 -2.064
93 HB2 GLU 15 2HB GLU 15 -6.611 2.116 -4.234
94 HB3 GLU 15 3HB GLU 15 -8.242 1.576 -3.878
95 HG2 GLU 15 2HG GLU 15 -9.210 3.253 -5.383
96 HG3 GLU 15 3HG GLU 15 -7.609 3.901 -5.741
97 H LYS 16 H LYS 16 -6.148 4.043 -1.019
98 HA LYS 16 HA LYS 16 -4.733 6.138 -2.530
99 HB2 LYS 16 2HB LYS 16 -6.393 6.841 -0.663
100 HB3 LYS 16 3HB LYS 16 -5.229 6.133 0.487
101 HG2 LYS 16 2HG LYS 16 -3.473 7.596 -0.523
102 HG3 LYS 16 3HG LYS 16 -4.733 8.299 -1.558
103 HD2 LYS 16 2HD LYS 16 -5.830 8.581 0.986
104 HD3 LYS 16 3HD LYS 16 -4.095 8.837 1.273
105 HE2 LYS 16 2HE LYS 16 -4.210 10.392 -0.823
106 HE3 LYS 16 3HE LYS 16 -5.968 10.321 -0.615
107 HZ1 LYS 16 1HZ LYS 16 -3.949 11.347 1.255
108 HZ2 LYS 16 2HZ LYS 16 -5.107 12.213 0.494
109 HZ3 LYS 16 3HZ LYS 16 -5.550 11.154 1.682
110 H CYS 17 H CYS 17 -2.672 5.951 -2.486
111 HA CYS 17 HA CYS 17 -1.008 3.796 -1.262
112 HB2 CYS 17 2HB CYS 17 -0.462 5.103 -3.357
113 HB3 CYS 17 3HB CYS 17 -0.422 6.551 -2.398
114 H THR 18 H THR 18 -1.767 3.916 1.008
115 HA THR 18 HA THR 18 -1.773 6.370 2.393
116 HB THR 18 HB THR 18 -2.688 4.148 3.193
117 HG1 THR 18 1HG THR 18 -1.164 5.871 4.849
118 HG21 THR 18 1HG2 THR 18 -1.280 2.722 4.483
119 HG22 THR 18 2HG2 THR 18 -0.406 2.994 2.944
120 HG23 THR 18 3HG2 THR 18 0.085 3.849 4.414
121 H ILE 19 H ILE 19 0.962 4.644 1.148
122 HA ILE 19 HA ILE 19 2.888 5.403 3.109
123 HB ILE 19 HB ILE 19 2.954 4.309 0.290
124 HG12 ILE 19 2HG1 ILE 19 3.932 2.846 2.735
125 HG13 ILE 19 3HG1 ILE 19 2.185 3.029 2.560
126 HG21 ILE 19 1HG2 ILE 19 5.382 3.796 0.825
127 HG22 ILE 19 2HG2 ILE 19 5.003 5.510 0.537
128 HG23 ILE 19 3HG2 ILE 19 5.229 4.917 2.197
129 HD11 ILE 19 1HD1 ILE 19 2.983 0.942 1.530
130 HD12 ILE 19 2HD1 ILE 19 2.216 2.036 0.355
131 HD13 ILE 19 3HD1 ILE 19 3.990 1.882 0.407
132 H CYS 20 H CYS 20 2.006 6.637 -0.196
133 HA CYS 20 HA CYS 20 3.596 9.160 0.298
134 HB2 CYS 20 2HB CYS 20 3.281 9.528 -2.065
135 HB3 CYS 20 3HB CYS 20 4.131 8.010 -1.755
136 H LEU 21 H LEU 21 0.635 7.981 1.069
137 HA LEU 21 HA LEU 21 -1.425 8.752 1.423
138 HB2 LEU 21 2HB LEU 21 0.143 11.308 1.895
139 HB3 LEU 21 3HB LEU 21 -1.535 11.075 2.393
140 HG LEU 21 HG LEU 21 0.714 9.224 3.306
141 HD11 LEU 21 1HD1 LEU 21 -0.454 11.666 4.674
142 HD12 LEU 21 2HD1 LEU 21 0.685 10.493 5.394
143 HD13 LEU 21 3HD1 LEU 21 1.195 11.485 4.017
144 HD21 LEU 21 1HD2 LEU 21 -1.556 8.280 3.498
145 HD22 LEU 21 2HD2 LEU 21 -0.918 8.672 5.093
146 HD23 LEU 21 3HD2 LEU 21 -2.119 9.744 4.340
147 H SER 22 H SER 22 -0.672 8.667 -1.313
148 HA SER 22 HA SER 22 -2.111 11.006 -2.477
149 HB2 SER 22 2HB SER 22 0.493 10.362 -2.874
150 HB3 SER 22 3HB SER 22 -0.244 9.329 -4.112
151 HG SER 22 HG SER 22 -0.142 12.104 -3.877
152 H ILE 23 H ILE 23 -3.724 10.517 -4.154
153 HA ILE 23 HA ILE 23 -4.930 7.908 -3.844
154 HB ILE 23 HB ILE 23 -5.478 10.439 -5.403
155 HG12 ILE 23 2HG1 ILE 23 -5.900 10.349 -2.908
156 HG13 ILE 23 3HG1 ILE 23 -7.279 10.781 -3.901
157 HG21 ILE 23 1HG2 ILE 23 -6.299 8.830 -6.874
158 HG22 ILE 23 2HG2 ILE 23 -7.023 7.841 -5.592
159 HG23 ILE 23 3HG2 ILE 23 -7.697 9.441 -6.007
160 HD11 ILE 23 1HD1 ILE 23 -7.837 9.186 -2.055
161 HD12 ILE 23 2HD1 ILE 23 -8.248 8.551 -3.655
162 HD13 ILE 23 3HD1 ILE 23 -6.803 7.964 -2.811
163 H LEU 24 H LEU 24 -5.288 6.473 -5.527
164 HA LEU 24 HA LEU 24 -3.056 6.192 -7.449
165 HB2 LEU 24 2HB LEU 24 -5.262 4.334 -6.425
166 HB3 LEU 24 3HB LEU 24 -3.909 3.829 -7.445
167 HG LEU 24 HG LEU 24 -3.491 5.066 -4.678
168 HD11 LEU 24 1HD1 LEU 24 -4.695 3.141 -4.260
169 HD12 LEU 24 2HD1 LEU 24 -3.897 2.207 -5.522
170 HD13 LEU 24 3HD1 LEU 24 -3.007 2.661 -4.037
171 HD21 LEU 24 1HD2 LEU 24 -1.278 3.866 -5.015
172 HD22 LEU 24 2HD2 LEU 24 -1.750 3.661 -6.719
173 HD23 LEU 24 3HD2 LEU 24 -1.569 5.289 -6.045
174 H GLU 25 H GLU 25 -4.792 4.401 -9.116
175 HA GLU 25 HA GLU 25 -7.016 6.003 -9.958
176 HB2 GLU 25 2HB GLU 25 -6.425 6.636 -12.096
177 HB3 GLU 25 3HB GLU 25 -4.960 7.000 -11.189
178 HG2 GLU 25 2HG GLU 25 -4.039 4.764 -11.988
179 HG3 GLU 25 3HG GLU 25 -5.460 4.610 -13.019
180 H GLU 26 H GLU 26 -8.127 4.855 -11.875
181 HA GLU 26 HA GLU 26 -8.848 2.262 -11.111
182 HB2 GLU 26 2HB GLU 26 -10.219 3.820 -12.468
183 HB3 GLU 26 3HB GLU 26 -9.071 3.690 -13.791
184 HG2 GLU 26 2HG GLU 26 -10.647 2.219 -14.540
185 HG3 GLU 26 3HG GLU 26 -9.644 1.081 -13.654
186 H GLY 27 H GLY 27 -7.221 0.733 -10.940
187 HA2 GLY 27 2HA GLY 27 -6.179 -1.153 -11.869
188 HA3 GLY 27 3HA GLY 27 -6.448 -0.486 -13.487
189 H GLU 28 H GLU 28 -4.814 1.437 -10.976
190 HA GLU 28 HA GLU 28 -2.503 1.798 -12.581
191 HB2 GLU 28 2HB GLU 28 -3.652 3.136 -10.557
192 HB3 GLU 28 3HB GLU 28 -2.501 2.243 -9.594
193 HG2 GLU 28 2HG GLU 28 -0.652 3.193 -10.976
194 HG3 GLU 28 3HG GLU 28 -1.834 4.032 -11.985
195 H ASP 29 H ASP 29 -0.248 1.376 -11.677
196 HA ASP 29 HA ASP 29 0.207 -1.390 -11.039
197 HB2 ASP 29 2HB ASP 29 2.062 0.995 -10.811
198 HB3 ASP 29 3HB ASP 29 2.545 -0.700 -10.772
199 H VAL 30 H VAL 30 -0.764 -1.969 -9.124
200 HA VAL 30 HA VAL 30 0.208 -0.806 -6.600
201 HB VAL 30 HB VAL 30 -2.075 -0.973 -5.671
202 HG11 VAL 30 1HG1 VAL 30 -3.074 0.959 -7.074
203 HG12 VAL 30 2HG1 VAL 30 -1.530 1.221 -6.239
204 HG13 VAL 30 3HG1 VAL 30 -1.578 0.916 -7.984
205 HG21 VAL 30 1HG2 VAL 30 -2.990 -1.477 -8.523
206 HG22 VAL 30 2HG2 VAL 30 -3.062 -2.636 -7.181
207 HG23 VAL 30 3HG2 VAL 30 -4.030 -1.154 -7.139
208 H ARG 31 H ARG 31 -0.787 -2.468 -4.819
209 HA ARG 31 HA ARG 31 -0.391 -5.214 -5.694
210 HB2 ARG 31 2HB ARG 31 1.633 -3.459 -4.388
211 HB3 ARG 31 3HB ARG 31 1.420 -4.990 -3.548
212 HG2 ARG 31 2HG ARG 31 1.730 -5.153 -6.526
213 HG3 ARG 31 3HG ARG 31 3.147 -4.619 -5.624
214 HD2 ARG 31 2HD ARG 31 1.610 -7.121 -4.852
215 HD3 ARG 31 3HD ARG 31 2.915 -7.130 -6.058
216 HE ARG 31 HE ARG 31 3.975 -5.815 -3.868
217 HH11 ARG 31 1HH1 ARG 31 5.351 -8.603 -2.210
218 HH12 ARG 31 2HH1 ARG 31 5.448 -6.895 -2.434
219 HH21 ARG 31 1HH2 ARG 31 3.746 -9.860 -3.421
220 HH22 ARG 31 2HH2 ARG 31 2.687 -9.033 -4.508
221 H ARG 32 H ARG 32 -0.508 -6.613 -3.555
222 HA ARG 32 HA ARG 32 -2.503 -5.390 -1.740
223 HB2 ARG 32 2HB ARG 32 -3.727 -6.737 -3.355
224 HB3 ARG 32 3HB ARG 32 -2.551 -8.050 -3.239
225 HG2 ARG 32 2HG ARG 32 -4.573 -8.680 -2.049
226 HG3 ARG 32 3HG ARG 32 -3.248 -8.511 -0.912
227 HD2 ARG 32 2HD ARG 32 -4.882 -7.353 0.217
228 HD3 ARG 32 3HD ARG 32 -4.144 -6.031 -0.659
229 HE ARG 32 HE ARG 32 -6.373 -7.399 -2.019
230 HH11 ARG 32 1HH1 ARG 32 -8.600 -4.711 -1.501
231 HH12 ARG 32 2HH1 ARG 32 -8.416 -6.264 -2.232
232 HH21 ARG 32 1HH2 ARG 32 -6.919 -3.899 -0.024
233 HH22 ARG 32 2HH2 ARG 32 -5.346 -4.601 -0.163
234 H LEU 33 H LEU 33 -2.437 -6.195 0.410
235 HA LEU 33 HA LEU 33 -0.325 -8.076 1.136
236 HB2 LEU 33 2HB LEU 33 -0.320 -6.321 3.239
237 HB3 LEU 33 3HB LEU 33 0.872 -6.290 1.950
238 HG LEU 33 HG LEU 33 -1.683 -4.682 1.683
239 HD11 LEU 33 1HD1 LEU 33 -0.726 -2.865 2.923
240 HD12 LEU 33 2HD1 LEU 33 -0.786 -4.267 3.983
241 HD13 LEU 33 3HD1 LEU 33 0.759 -3.783 3.268
242 HD21 LEU 33 1HD2 LEU 33 0.054 -4.739 -0.192
243 HD22 LEU 33 2HD2 LEU 33 -0.136 -3.131 0.510
244 HD23 LEU 33 3HD2 LEU 33 1.245 -4.159 0.972
245 HA PRO 34 HA PRO 34 -3.427 -9.948 3.389
246 HB2 PRO 34 2HB PRO 34 -2.381 -10.651 5.847
247 HB3 PRO 34 3HB PRO 34 -1.927 -11.404 4.289
248 HG2 PRO 34 2HG PRO 34 -0.460 -9.261 5.827
249 HG3 PRO 34 3HG PRO 34 0.203 -10.685 4.960
250 HD2 PRO 34 2HD PRO 34 0.131 -8.124 3.993
251 HD3 PRO 34 3HD PRO 34 0.159 -9.515 2.920
252 H CYS 35 H CYS 35 -2.199 -7.062 4.920
253 HA CYS 35 HA CYS 35 -4.318 -6.530 6.860
254 HB2 CYS 35 2HB CYS 35 -2.091 -5.440 6.774
255 HB3 CYS 35 3HB CYS 35 -2.533 -4.732 5.220
256 H MET 36 H MET 36 -4.693 -7.099 3.516
257 HA MET 36 HA MET 36 -6.205 -6.491 1.974
258 HB2 MET 36 2HB MET 36 -7.882 -5.873 4.434
259 HB3 MET 36 3HB MET 36 -8.511 -5.927 2.787
260 HG2 MET 36 2HG MET 36 -6.929 -8.266 3.880
261 HG3 MET 36 3HG MET 36 -8.616 -8.066 4.311
262 HE1 MET 36 1HE MET 36 -10.488 -7.569 2.387
263 HE2 MET 36 2HE MET 36 -10.644 -8.975 1.304
264 HE3 MET 36 3HE MET 36 -10.440 -9.218 3.053
265 H HIS 37 H HIS 37 -4.229 -4.522 2.992
266 HA HIS 37 HA HIS 37 -5.551 -1.975 2.322
267 HB2 HIS 37 1HB HIS 37 -3.219 -2.768 3.920
268 HB3 HIS 37 2HB HIS 37 -2.740 -1.634 2.669
269 HD2 HIS 37 2HD HIS 37 -5.210 0.275 2.551
270 HE1 HIS 37 1HE HIS 37 -4.776 0.936 6.718
271 HE2 HIS 37 2HE HIS 37 -5.836 1.799 4.565
272 H LEU 38 H LEU 38 -4.814 -0.753 0.402
273 HA LEU 38 HA LEU 38 -3.700 -2.484 -1.764
274 HB2 LEU 38 2HB LEU 38 -6.185 -0.910 -1.543
275 HB3 LEU 38 3HB LEU 38 -5.175 -0.249 -2.809
276 HG LEU 38 HG LEU 38 -5.910 -3.189 -2.677
277 HD11 LEU 38 1HD1 LEU 38 -7.149 -0.935 -4.324
278 HD12 LEU 38 2HD1 LEU 38 -7.561 -2.654 -4.436
279 HD13 LEU 38 3HD1 LEU 38 -7.929 -1.748 -2.954
280 HD21 LEU 38 1HD2 LEU 38 -5.201 -3.180 -5.037
281 HD22 LEU 38 2HD2 LEU 38 -4.819 -1.451 -4.932
282 HD23 LEU 38 3HD2 LEU 38 -3.863 -2.632 -4.013
283 H PHE 39 H PHE 39 -1.638 -1.736 -2.208
284 HA PHE 39 HA PHE 39 -1.095 1.167 -1.714
285 HB2 PHE 39 2HB PHE 39 0.570 -1.269 -0.980
286 HB3 PHE 39 3HB PHE 39 1.190 0.365 -0.972
287 HD1 PHE 39 1HD PHE 39 1.543 -1.266 1.356
288 HD2 PHE 39 2HD PHE 39 -1.833 1.216 0.350
289 HE1 PHE 39 1HE PHE 39 0.992 -1.042 3.741
290 HE2 PHE 39 2HE PHE 39 -2.452 1.325 2.713
291 HZ PHE 39 HZ PHE 39 -1.031 0.226 4.441
292 H HIS 40 H HIS 40 0.431 2.085 -3.104
293 HA HIS 40 HA HIS 40 0.683 1.359 -5.817
294 HB2 HIS 40 1HB HIS 40 2.076 3.058 -3.808
295 HB3 HIS 40 2HB HIS 40 3.166 2.487 -5.050
296 HD2 HIS 40 2HD HIS 40 1.058 2.866 -7.581
297 HE1 HIS 40 1HE HIS 40 1.516 6.962 -6.512
298 HE2 HIS 40 2HE HIS 40 0.690 5.302 -8.299
299 H GLN 41 H GLN 41 2.177 0.120 -7.006
300 HA GLN 41 HA GLN 41 3.450 -2.071 -5.712
301 HB2 GLN 41 2HB GLN 41 2.670 -2.052 -8.047
302 HB3 GLN 41 3HB GLN 41 3.926 -0.886 -8.482
303 HG2 GLN 41 2HG GLN 41 5.516 -2.510 -8.620
304 HG3 GLN 41 3HG GLN 41 5.050 -3.214 -7.071
305 HE21 GLN 41 1HE2 GLN 41 3.655 -2.987 -10.462
306 HE22 GLN 41 2HE2 GLN 41 3.124 -4.655 -10.423
307 H VAL 42 H VAL 42 4.808 0.983 -7.088
308 HA VAL 42 HA VAL 42 7.492 0.434 -6.331
309 HB VAL 42 HB VAL 42 6.060 3.084 -6.804
310 HG11 VAL 42 1HG1 VAL 42 8.351 3.973 -7.279
311 HG12 VAL 42 2HG1 VAL 42 8.148 3.524 -5.582
312 HG13 VAL 42 3HG1 VAL 42 9.046 2.451 -6.678
313 HG21 VAL 42 1HG2 VAL 42 7.774 1.320 -8.614
314 HG22 VAL 42 2HG2 VAL 42 6.020 1.559 -8.760
315 HG23 VAL 42 3HG2 VAL 42 7.118 2.912 -9.048
316 H CYS 43 H CYS 43 5.136 2.630 -4.673
317 HA CYS 43 HA CYS 43 6.721 3.216 -2.412
318 HB2 CYS 43 2HB CYS 43 3.719 2.855 -2.460
319 HB3 CYS 43 3HB CYS 43 4.671 3.826 -1.345
320 H VAL 44 H VAL 44 4.480 0.358 -2.882
321 HA VAL 44 HA VAL 44 5.030 -0.475 -0.217
322 HB VAL 44 HB VAL 44 2.936 -0.982 -1.594
323 HG11 VAL 44 1HG1 VAL 44 2.895 -3.172 -2.627
324 HG12 VAL 44 2HG1 VAL 44 4.098 -2.177 -3.481
325 HG13 VAL 44 3HG1 VAL 44 4.628 -3.414 -2.328
326 HG21 VAL 44 1HG2 VAL 44 4.289 -3.188 -0.020
327 HG22 VAL 44 2HG2 VAL 44 3.542 -1.753 0.698
328 HG23 VAL 44 3HG2 VAL 44 2.546 -2.908 -0.230
329 H ASP 45 H ASP 45 6.691 -0.955 -3.265
330 HA ASP 45 HA ASP 45 8.210 -3.250 -2.471
331 HB2 ASP 45 2HB ASP 45 8.208 -2.224 -4.785
332 HB3 ASP 45 3HB ASP 45 9.231 -0.922 -4.151
333 H GLN 46 H GLN 46 8.903 0.283 -2.182
334 HA GLN 46 HA GLN 46 11.122 -0.191 -0.412
335 HB2 GLN 46 2HB GLN 46 9.445 2.320 -0.867
336 HB3 GLN 46 3HB GLN 46 10.902 2.261 0.144
337 HG2 GLN 46 2HG GLN 46 12.197 1.411 -1.838
338 HG3 GLN 46 3HG GLN 46 10.760 1.655 -2.841
339 HE21 GLN 46 1HE2 GLN 46 13.278 3.326 -0.893
340 HE22 GLN 46 2HE2 GLN 46 12.963 4.894 -1.621
341 H ALA 47 H ALA 47 7.679 0.022 0.258
342 HA ALA 47 HA ALA 47 7.955 0.405 3.085
343 HB1 ALA 47 1HB ALA 47 5.841 0.601 1.758
344 HB2 ALA 47 2HB ALA 47 5.824 -1.176 1.607
345 HB3 ALA 47 3HB ALA 47 5.682 -0.423 3.209
346 H LEU 48 H LEU 48 7.500 -2.569 1.171
347 HA LEU 48 HA LEU 48 7.734 -4.539 3.103
348 HB2 LEU 48 2HB LEU 48 6.985 -4.840 0.754
349 HB3 LEU 48 3HB LEU 48 8.603 -4.480 0.183
350 HG LEU 48 HG LEU 48 9.153 -6.591 1.861
351 HD11 LEU 48 1HD1 LEU 48 6.739 -6.952 2.330
352 HD12 LEU 48 2HD1 LEU 48 6.437 -7.158 0.591
353 HD13 LEU 48 3HD1 LEU 48 7.454 -8.323 1.464
354 HD21 LEU 48 1HD2 LEU 48 8.344 -6.707 -1.063
355 HD22 LEU 48 2HD2 LEU 48 9.954 -6.330 -0.420
356 HD23 LEU 48 3HD2 LEU 48 9.272 -7.949 -0.184
357 H ILE 49 H ILE 49 10.391 -3.211 1.002
358 HA ILE 49 HA ILE 49 12.375 -4.778 2.316
359 HB ILE 49 HB ILE 49 14.012 -3.520 1.176
360 HG12 ILE 49 2HG1 ILE 49 12.959 -1.548 -0.356
361 HG13 ILE 49 3HG1 ILE 49 12.052 -1.348 1.154
362 HG21 ILE 49 1HG2 ILE 49 12.586 -5.116 -0.108
363 HG22 ILE 49 2HG2 ILE 49 11.649 -3.737 -0.707
364 HG23 ILE 49 3HG2 ILE 49 13.364 -3.863 -1.093
365 HD11 ILE 49 1HD1 ILE 49 14.191 -1.247 2.418
366 HD12 ILE 49 2HD1 ILE 49 15.080 -1.424 0.890
367 HD13 ILE 49 3HD1 ILE 49 14.085 0.019 1.180
368 H THR 50 H THR 50 11.025 -1.556 3.081
369 HA THR 50 HA THR 50 13.003 -0.879 5.007
370 HB THR 50 HB THR 50 10.146 0.005 4.513
371 HG1 THR 50 1HG THR 50 11.584 0.868 3.164
372 HG21 THR 50 1HG2 THR 50 10.331 0.258 6.914
373 HG22 THR 50 2HG2 THR 50 11.956 0.977 6.751
374 HG23 THR 50 3HG2 THR 50 10.522 1.834 6.143
375 H ASN 51 H ASN 51 9.869 -2.643 5.270
376 HA ASN 51 HA ASN 51 10.747 -4.314 7.376
377 HB2 ASN 51 2HB ASN 51 9.795 -1.716 8.240
378 HB3 ASN 51 3HB ASN 51 8.526 -2.861 8.585
379 HD21 ASN 51 1HD2 ASN 51 12.040 -2.297 9.027
380 HD22 ASN 51 2HD2 ASN 51 12.150 -3.145 10.558
381 H LYS 52 H LYS 52 9.368 -6.169 7.088
382 HA LYS 52 HA LYS 52 7.151 -5.812 5.177
383 HB2 LYS 52 2HB LYS 52 8.123 -8.339 6.593
384 HB3 LYS 52 3HB LYS 52 6.931 -8.220 5.292
385 HG2 LYS 52 2HG LYS 52 8.665 -8.714 3.979
386 HG3 LYS 52 3HG LYS 52 8.913 -6.981 4.026
387 HD2 LYS 52 2HD LYS 52 10.694 -7.178 5.616
388 HD3 LYS 52 3HD LYS 52 10.285 -8.872 5.988
389 HE2 LYS 52 2HE LYS 52 11.282 -9.704 4.126
390 HE3 LYS 52 3HE LYS 52 10.758 -8.351 3.115
391 HZ1 LYS 52 1HZ LYS 52 13.133 -8.371 3.376
392 HZ2 LYS 52 2HZ LYS 52 12.498 -7.010 4.055
393 HZ3 LYS 52 3HZ LYS 52 13.010 -8.255 5.012
394 H LYS 53 H LYS 53 6.139 -4.297 7.004
395 HA LYS 53 HA LYS 53 3.986 -5.966 8.010
396 HB2 LYS 53 2HB LYS 53 4.073 -5.031 10.309
397 HB3 LYS 53 3HB LYS 53 5.465 -6.047 9.922
398 HG2 LYS 53 2HG LYS 53 6.715 -3.870 9.338
399 HG3 LYS 53 3HG LYS 53 5.374 -3.010 10.115
400 HD2 LYS 53 2HD LYS 53 5.832 -4.370 12.202
401 HD3 LYS 53 3HD LYS 53 7.211 -5.107 11.347
402 HE2 LYS 53 2HE LYS 53 7.959 -2.660 10.891
403 HE3 LYS 53 3HE LYS 53 6.831 -2.204 12.178
404 HZ1 LYS 53 1HZ LYS 53 9.132 -4.032 12.347
405 HZ2 LYS 53 2HZ LYS 53 9.049 -2.550 13.026
406 HZ3 LYS 53 3HZ LYS 53 8.098 -3.776 13.614
407 H CYS 54 H CYS 54 2.078 -4.853 7.873
408 HA CYS 54 HA CYS 54 1.885 -2.569 6.206
409 HB2 CYS 54 2HB CYS 54 0.113 -4.362 6.964
410 HB3 CYS 54 3HB CYS 54 -0.154 -3.238 8.304
411 HA PRO 55 HA PRO 55 3.523 0.261 9.245
412 HB2 PRO 55 2HB PRO 55 3.012 2.670 8.003
413 HB3 PRO 55 3HB PRO 55 4.315 1.548 7.501
414 HG2 PRO 55 2HG PRO 55 1.541 1.828 6.318
415 HG3 PRO 55 3HG PRO 55 3.110 1.726 5.456
416 HD2 PRO 55 2HD PRO 55 1.491 -0.436 5.794
417 HD3 PRO 55 3HD PRO 55 3.278 -0.603 5.857
418 H ILE 56 H ILE 56 0.273 0.538 7.874
419 HA ILE 56 HA ILE 56 -0.720 1.264 10.551
420 HB ILE 56 HB ILE 56 -0.808 3.180 9.088
421 HG12 ILE 56 2HG1 ILE 56 -3.705 2.508 9.339
422 HG13 ILE 56 3HG1 ILE 56 -2.725 2.330 10.802
423 HG21 ILE 56 1HG2 ILE 56 -2.272 3.352 7.158
424 HG22 ILE 56 2HG2 ILE 56 -1.069 2.084 6.883
425 HG23 ILE 56 3HG2 ILE 56 -2.735 1.652 7.312
426 HD11 ILE 56 1HD1 ILE 56 -1.893 4.625 10.601
427 HD12 ILE 56 2HD1 ILE 56 -2.805 4.851 9.090
428 HD13 ILE 56 3HD1 ILE 56 -3.665 4.612 10.628
429 H CYS 57 H CYS 57 -1.573 -0.356 11.315
430 HA CYS 57 HA CYS 57 -3.495 -1.938 11.454
431 HB2 CYS 57 2HB CYS 57 -2.041 -3.378 9.249
432 HB3 CYS 57 3HB CYS 57 -3.385 -3.960 10.222
433 H ARG 58 H ARG 58 0.034 -2.252 10.858
434 HA ARG 58 HA ARG 58 1.647 -3.497 11.844
435 HB2 ARG 58 2HB ARG 58 -0.185 -3.114 14.228
436 HB3 ARG 58 3HB ARG 58 1.235 -4.133 14.360
437 HG2 ARG 58 2HG ARG 58 1.481 -1.299 13.324
438 HG3 ARG 58 3HG ARG 58 1.445 -1.677 15.056
439 HD2 ARG 58 2HD ARG 58 3.313 -3.295 14.744
440 HD3 ARG 58 3HD ARG 58 3.456 -2.804 13.054
441 HE ARG 58 HE ARG 58 4.326 -1.404 15.447
442 HH11 ARG 58 1HH1 ARG 58 5.466 1.441 13.717
443 HH12 ARG 58 2HH1 ARG 58 5.478 0.593 15.217
444 HH21 ARG 58 1HH2 ARG 58 4.152 0.611 11.902
445 HH22 ARG 58 2HH2 ARG 58 3.348 -0.895 12.079
446 H VAL 59 H VAL 59 0.920 -5.077 10.164
447 HA VAL 59 HA VAL 59 0.652 -7.676 11.516
448 HB VAL 59 HB VAL 59 -0.755 -7.515 8.885
449 HG11 VAL 59 1HG1 VAL 59 -1.492 -8.743 11.582
450 HG12 VAL 59 2HG1 VAL 59 -2.280 -9.078 10.024
451 HG13 VAL 59 3HG1 VAL 59 -0.596 -9.568 10.280
452 HG21 VAL 59 1HG2 VAL 59 -2.901 -6.746 9.792
453 HG22 VAL 59 2HG2 VAL 59 -2.102 -6.262 11.305
454 HG23 VAL 59 3HG2 VAL 59 -1.678 -5.481 9.757
455 H ASP 60 H ASP 60 2.010 -9.212 10.503
456 HA ASP 60 HA ASP 60 4.056 -8.121 8.804
457 HB2 ASP 60 2HB ASP 60 4.336 -9.988 10.443
458 HB3 ASP 60 3HB ASP 60 3.389 -11.027 9.370
459 H ILE 61 H ILE 61 4.339 -8.457 6.576
460 HA ILE 61 HA ILE 61 1.983 -9.519 5.105
461 HB ILE 61 HB ILE 61 2.307 -7.857 3.460
462 HG12 ILE 61 2HG1 ILE 61 4.743 -6.922 5.027
463 HG13 ILE 61 3HG1 ILE 61 4.772 -7.754 3.461
464 HG21 ILE 61 1HG2 ILE 61 2.596 -6.319 6.052
465 HG22 ILE 61 2HG2 ILE 61 1.579 -5.933 4.641
466 HG23 ILE 61 3HG2 ILE 61 1.139 -7.275 5.709
467 HD11 ILE 61 1HD1 ILE 61 3.342 -5.964 2.537
468 HD12 ILE 61 2HD1 ILE 61 3.599 -5.049 4.053
469 HD13 ILE 61 3HD1 ILE 61 4.993 -5.450 3.021
470 H GLU 62 H GLU 62 5.306 -9.876 5.613
471 HA GLU 62 HA GLU 62 6.317 -10.743 3.117
472 HB2 GLU 62 2HB GLU 62 7.331 -10.409 5.614
473 HB3 GLU 62 3HB GLU 62 7.170 -12.139 5.668
474 HG2 GLU 62 2HG GLU 62 8.508 -10.822 3.277
475 HG3 GLU 62 3HG GLU 62 9.359 -10.901 4.818
476 H ALA 63 H ALA 63 5.001 -12.729 5.835
477 HA ALA 63 HA ALA 63 3.350 -14.214 3.991
478 HB1 ALA 63 1HB ALA 63 5.794 -15.581 5.198
479 HB2 ALA 63 2HB ALA 63 4.416 -16.454 4.471
480 HB3 ALA 63 3HB ALA 63 5.428 -15.382 3.479
481 H GLN 64 H GLN 64 1.786 -15.454 5.100
482 HA GLN 64 HA GLN 64 1.316 -14.666 7.851
483 HB2 GLN 64 2HB GLN 64 -0.460 -14.991 6.080
484 HB3 GLN 64 3HB GLN 64 -0.114 -16.716 6.095
485 HG2 GLN 64 2HG GLN 64 -1.991 -16.491 7.488
486 HG3 GLN 64 3HG GLN 64 -0.666 -16.635 8.640
487 HE21 GLN 64 1HE2 GLN 64 -0.384 -14.885 10.155
488 HE22 GLN 64 2HE2 GLN 64 -1.323 -13.408 9.998
489 H LEU 65 H LEU 65 3.267 -15.568 8.903
490 HA LEU 65 HA LEU 65 3.251 -18.540 9.108
491 HB2 LEU 65 2HB LEU 65 5.356 -16.452 9.427
492 HB3 LEU 65 3HB LEU 65 5.389 -17.779 10.590
493 HG LEU 65 HG LEU 65 5.289 -19.429 8.711
494 HD11 LEU 65 1HD1 LEU 65 5.912 -18.637 6.439
495 HD12 LEU 65 2HD1 LEU 65 4.340 -17.997 6.939
496 HD13 LEU 65 3HD1 LEU 65 5.782 -16.956 7.007
497 HD21 LEU 65 1HD2 LEU 65 7.659 -19.150 8.076
498 HD22 LEU 65 2HD2 LEU 65 7.631 -17.481 8.694
499 HD23 LEU 65 3HD2 LEU 65 7.411 -18.850 9.804
500 HA PRO 66 HA PRO 66 1.266 -17.779 13.076
501 HB2 PRO 66 2HB PRO 66 0.649 -20.344 13.736
502 HB3 PRO 66 3HB PRO 66 -0.200 -19.472 12.426
503 HG2 PRO 66 2HG PRO 66 2.096 -21.438 12.156
504 HG3 PRO 66 3HG PRO 66 0.559 -21.395 11.238
505 HD2 PRO 66 2HD PRO 66 2.904 -20.294 10.311
506 HD3 PRO 66 3HD PRO 66 1.298 -19.608 9.906
507 H SER 67 H SER 67 3.312 -16.990 13.859
508 HA SER 67 HA SER 67 4.964 -16.914 15.414
509 HB2 SER 67 2HB SER 67 4.147 -19.731 16.246
510 HB3 SER 67 3HB SER 67 5.185 -18.623 17.145
511 HG SER 67 HG SER 67 2.954 -18.630 17.795
512 H GLU 68 H GLU 68 6.935 -18.603 16.196
513 HA GLU 68 HA GLU 68 8.962 -19.252 15.549
514 HB2 GLU 68 2HB GLU 68 7.262 -21.237 15.431
515 HB3 GLU 68 3HB GLU 68 7.655 -21.264 13.714
516 HG2 GLU 68 2HG GLU 68 9.976 -21.736 14.184
517 HG3 GLU 68 3HG GLU 68 9.815 -21.223 15.868
518 H SER 69 H SER 69 8.870 -16.985 14.478
519 HA SER 69 HA SER 69 10.176 -17.168 11.915
520 HB2 SER 69 2HB SER 69 7.705 -16.946 11.358
521 HB3 SER 69 3HB SER 69 7.695 -15.431 12.289
522 HG SER 69 HG SER 69 9.513 -14.823 10.882
Start of MODEL 18
1 H1 MET 1 H1 MET 1 -26.528 40.570 -16.925
2 H2 MET 1 H2 MET 1 -27.139 39.820 -18.270
3 H3 MET 1 H3 MET 1 -28.033 39.946 -16.877
4 HA MET 1 HA MET 1 -27.206 37.722 -17.081
5 HB2 MET 1 2HB MET 1 -24.630 39.238 -17.457
6 HB3 MET 1 3HB MET 1 -24.566 37.672 -16.631
7 HG2 MET 1 2HG MET 1 -25.664 36.552 -18.455
8 HG3 MET 1 3HG MET 1 -25.936 38.075 -19.311
9 HE1 MET 1 1HE MET 1 -25.011 36.437 -21.285
10 HE2 MET 1 2HE MET 1 -23.311 35.928 -21.409
11 HE3 MET 1 3HE MET 1 -24.381 35.163 -20.213
12 H LYS 2 H LYS 2 -25.794 36.689 -15.066
13 HA LYS 2 HA LYS 2 -25.853 38.411 -12.738
14 HB2 LYS 2 2HB LYS 2 -27.259 36.944 -11.410
15 HB3 LYS 2 3HB LYS 2 -28.170 37.539 -12.787
16 HG2 LYS 2 2HG LYS 2 -26.925 35.013 -13.533
17 HG3 LYS 2 3HG LYS 2 -27.706 34.835 -11.959
18 HD2 LYS 2 2HD LYS 2 -29.810 35.838 -12.996
19 HD3 LYS 2 3HD LYS 2 -28.970 35.804 -14.554
20 HE2 LYS 2 2HE LYS 2 -30.345 33.832 -14.420
21 HE3 LYS 2 3HE LYS 2 -28.653 33.327 -14.294
22 HZ1 LYS 2 1HZ LYS 2 -30.077 32.234 -12.678
23 HZ2 LYS 2 2HZ LYS 2 -28.934 33.140 -11.925
24 HZ3 LYS 2 3HZ LYS 2 -30.492 33.677 -12.007
25 H GLN 3 H GLN 3 -25.080 36.658 -10.795
26 HA GLN 3 HA GLN 3 -22.620 35.523 -11.837
27 HB2 GLN 3 2HB GLN 3 -22.259 34.719 -9.582
28 HB3 GLN 3 3HB GLN 3 -22.791 36.388 -9.527
29 HG2 GLN 3 2HG GLN 3 -25.056 34.466 -9.349
30 HG3 GLN 3 3HG GLN 3 -23.856 34.237 -8.081
31 HE21 GLN 3 1HE2 GLN 3 -24.172 35.493 -6.265
32 HE22 GLN 3 2HE2 GLN 3 -25.030 37.024 -6.277
33 H ASP 4 H ASP 4 -22.212 33.091 -10.937
34 HA ASP 4 HA ASP 4 -24.458 31.327 -11.546
35 HB2 ASP 4 2HB ASP 4 -22.867 31.824 -13.616
36 HB3 ASP 4 3HB ASP 4 -21.746 30.751 -12.771
37 H GLY 5 H GLY 5 -23.475 28.931 -10.887
38 HA2 GLY 5 2HA GLY 5 -21.548 29.210 -8.648
39 HA3 GLY 5 3HA GLY 5 -23.205 28.704 -8.265
40 H GLU 6 H GLU 6 -20.130 27.541 -8.954
41 HA GLU 6 HA GLU 6 -21.037 24.841 -9.467
42 HB2 GLU 6 2HB GLU 6 -20.651 26.485 -11.700
43 HB3 GLU 6 3HB GLU 6 -19.048 25.789 -11.491
44 HG2 GLU 6 2HG GLU 6 -21.671 24.234 -11.723
45 HG3 GLU 6 3HG GLU 6 -20.501 24.478 -13.029
46 H GLU 7 H GLU 7 -19.138 23.384 -9.023
47 HA GLU 7 HA GLU 7 -16.747 24.783 -7.909
48 HB2 GLU 7 2HB GLU 7 -18.601 24.050 -6.216
49 HB3 GLU 7 3HB GLU 7 -18.064 22.410 -6.561
50 HG2 GLU 7 2HG GLU 7 -16.958 23.138 -4.572
51 HG3 GLU 7 3HG GLU 7 -15.724 23.118 -5.820
52 H GLY 8 H GLY 8 -17.629 22.906 -10.418
53 HA2 GLY 8 2HA GLY 8 -16.212 21.750 -11.788
54 HA3 GLY 8 3HA GLY 8 -15.016 21.595 -10.482
55 H THR 9 H THR 9 -14.702 19.348 -10.319
56 HA THR 9 HA THR 9 -16.921 17.793 -9.367
57 HB THR 9 HB THR 9 -17.274 17.706 -11.830
58 HG1 THR 9 1HG THR 9 -17.378 15.388 -11.810
59 HG21 THR 9 1HG2 THR 9 -14.723 16.059 -11.837
60 HG22 THR 9 2HG2 THR 9 -15.747 16.480 -13.230
61 HG23 THR 9 3HG2 THR 9 -14.812 17.742 -12.397
62 H GLU 10 H GLU 10 -16.013 15.390 -9.055
63 HA GLU 10 HA GLU 10 -13.155 15.411 -8.421
64 HB2 GLU 10 2HB GLU 10 -14.495 16.534 -6.509
65 HB3 GLU 10 3HB GLU 10 -15.202 14.938 -6.214
66 HG2 GLU 10 2HG GLU 10 -12.941 14.013 -5.809
67 HG3 GLU 10 3HG GLU 10 -12.215 15.562 -6.260
68 H GLU 11 H GLU 11 -12.376 13.225 -8.435
69 HA GLU 11 HA GLU 11 -14.308 11.022 -8.534
70 HB2 GLU 11 2HB GLU 11 -12.496 11.905 -10.805
71 HB3 GLU 11 3HB GLU 11 -12.847 10.187 -10.544
72 HG2 GLU 11 2HG GLU 11 -15.257 10.596 -10.706
73 HG3 GLU 11 3HG GLU 11 -14.979 12.333 -10.903
74 H ASP 12 H ASP 12 -13.419 9.208 -7.775
75 HA ASP 12 HA ASP 12 -12.464 8.137 -6.122
76 HB2 ASP 12 2HB ASP 12 -11.141 7.408 -8.035
77 HB3 ASP 12 3HB ASP 12 -9.900 8.607 -7.631
78 H THR 13 H THR 13 -12.367 8.713 -4.102
79 HA THR 13 HA THR 13 -10.122 10.427 -3.195
80 HB THR 13 HB THR 13 -13.072 10.930 -2.646
81 HG1 THR 13 1HG THR 13 -11.423 11.802 -4.492
82 HG21 THR 13 1HG2 THR 13 -12.260 12.984 -1.433
83 HG22 THR 13 2HG2 THR 13 -12.010 11.473 -0.551
84 HG23 THR 13 3HG2 THR 13 -10.638 12.258 -1.391
85 H GLU 14 H GLU 14 -11.072 7.479 -3.233
86 HA GLU 14 HA GLU 14 -11.221 6.987 -0.304
87 HB2 GLU 14 2HB GLU 14 -13.138 6.407 -2.383
88 HB3 GLU 14 3HB GLU 14 -12.471 4.876 -1.804
89 HG2 GLU 14 2HG GLU 14 -12.955 5.517 0.529
90 HG3 GLU 14 3HG GLU 14 -13.576 7.082 -0.013
91 H GLU 15 H GLU 15 -10.231 5.598 -3.554
92 HA GLU 15 HA GLU 15 -8.575 3.660 -2.084
93 HB2 GLU 15 2HB GLU 15 -8.958 4.102 -5.072
94 HB3 GLU 15 3HB GLU 15 -7.977 2.843 -4.303
95 HG2 GLU 15 2HG GLU 15 -10.256 2.404 -2.949
96 HG3 GLU 15 3HG GLU 15 -10.971 3.133 -4.386
97 H LYS 16 H LYS 16 -7.095 4.899 -0.986
98 HA LYS 16 HA LYS 16 -5.132 6.333 -2.716
99 HB2 LYS 16 2HB LYS 16 -4.830 7.964 -0.823
100 HB3 LYS 16 3HB LYS 16 -6.366 8.069 -1.703
101 HG2 LYS 16 2HG LYS 16 -7.587 7.015 -0.007
102 HG3 LYS 16 3HG LYS 16 -6.115 6.527 0.854
103 HD2 LYS 16 2HD LYS 16 -7.147 8.384 2.023
104 HD3 LYS 16 3HD LYS 16 -5.618 8.923 1.314
105 HE2 LYS 16 2HE LYS 16 -6.646 10.498 0.098
106 HE3 LYS 16 3HE LYS 16 -7.715 9.294 -0.641
107 HZ1 LYS 16 1HZ LYS 16 -8.944 10.999 0.503
108 HZ2 LYS 16 2HZ LYS 16 -9.241 9.538 1.134
109 HZ3 LYS 16 3HZ LYS 16 -8.247 10.599 1.945
110 H CYS 17 H CYS 17 -3.100 5.966 -2.435
111 HA CYS 17 HA CYS 17 -1.952 3.734 -0.953
112 HB2 CYS 17 2HB CYS 17 -1.101 4.781 -3.078
113 HB3 CYS 17 3HB CYS 17 -0.769 6.245 -2.189
114 H THR 18 H THR 18 -1.815 3.759 1.227
115 HA THR 18 HA THR 18 -1.858 6.160 2.774
116 HB THR 18 HB THR 18 -2.659 3.858 3.407
117 HG1 THR 18 1HG THR 18 -1.935 4.193 5.620
118 HG21 THR 18 1HG2 THR 18 0.210 3.439 4.296
119 HG22 THR 18 2HG2 THR 18 -1.159 2.303 4.321
120 HG23 THR 18 3HG2 THR 18 -0.431 2.776 2.776
121 H ILE 19 H ILE 19 0.853 4.442 1.222
122 HA ILE 19 HA ILE 19 2.830 5.431 3.066
123 HB ILE 19 HB ILE 19 2.855 4.064 0.381
124 HG12 ILE 19 2HG1 ILE 19 4.018 3.046 2.987
125 HG13 ILE 19 3HG1 ILE 19 2.275 2.934 2.713
126 HG21 ILE 19 1HG2 ILE 19 5.171 5.082 2.061
127 HG22 ILE 19 2HG2 ILE 19 5.366 3.812 0.838
128 HG23 ILE 19 3HG2 ILE 19 4.824 5.425 0.349
129 HD11 ILE 19 1HD1 ILE 19 2.582 1.671 0.681
130 HD12 ILE 19 2HD1 ILE 19 4.342 1.841 0.775
131 HD13 ILE 19 3HD1 ILE 19 3.485 0.889 2.004
132 H CYS 20 H CYS 20 1.824 6.286 -0.294
133 HA CYS 20 HA CYS 20 3.534 8.736 -0.384
134 HB2 CYS 20 2HB CYS 20 1.225 7.980 -2.197
135 HB3 CYS 20 3HB CYS 20 2.518 9.148 -2.474
136 H LEU 21 H LEU 21 0.467 7.843 0.983
137 HA LEU 21 HA LEU 21 -1.468 8.876 1.390
138 HB2 LEU 21 2HB LEU 21 0.418 11.162 2.034
139 HB3 LEU 21 3HB LEU 21 -1.282 11.095 2.520
140 HG LEU 21 HG LEU 21 0.734 8.927 3.248
141 HD11 LEU 21 1HD1 LEU 21 1.501 11.017 4.167
142 HD12 LEU 21 2HD1 LEU 21 -0.102 11.322 4.891
143 HD13 LEU 21 3HD1 LEU 21 0.895 9.946 5.441
144 HD21 LEU 21 1HD2 LEU 21 -1.683 8.284 3.398
145 HD22 LEU 21 2HD2 LEU 21 -0.917 8.348 4.979
146 HD23 LEU 21 3HD2 LEU 21 -1.975 9.681 4.456
147 H SER 22 H SER 22 -1.557 8.533 -1.084
148 HA SER 22 HA SER 22 -2.630 11.041 -2.203
149 HB2 SER 22 2HB SER 22 -0.432 9.406 -3.546
150 HB3 SER 22 3HB SER 22 -1.402 10.650 -4.354
151 HG SER 22 HG SER 22 -0.053 11.314 -1.962
152 H ILE 23 H ILE 23 -4.356 10.596 -3.706
153 HA ILE 23 HA ILE 23 -5.654 8.134 -3.635
154 HB ILE 23 HB ILE 23 -5.715 10.676 -5.329
155 HG12 ILE 23 2HG1 ILE 23 -7.780 11.123 -4.176
156 HG13 ILE 23 3HG1 ILE 23 -7.722 9.552 -3.352
157 HG21 ILE 23 1HG2 ILE 23 -6.593 9.014 -6.811
158 HG22 ILE 23 2HG2 ILE 23 -7.576 8.275 -5.535
159 HG23 ILE 23 3HG2 ILE 23 -7.950 9.901 -6.160
160 HD11 ILE 23 1HD1 ILE 23 -5.888 10.279 -1.987
161 HD12 ILE 23 2HD1 ILE 23 -5.741 11.804 -2.915
162 HD13 ILE 23 3HD1 ILE 23 -7.171 11.496 -1.912
163 H LEU 24 H LEU 24 -5.972 6.754 -5.397
164 HA LEU 24 HA LEU 24 -3.590 6.270 -7.090
165 HB2 LEU 24 2HB LEU 24 -6.001 4.564 -6.311
166 HB3 LEU 24 3HB LEU 24 -4.583 3.961 -7.180
167 HG LEU 24 HG LEU 24 -4.348 5.198 -4.401
168 HD11 LEU 24 1HD1 LEU 24 -4.278 2.938 -3.551
169 HD12 LEU 24 2HD1 LEU 24 -5.834 3.320 -4.312
170 HD13 LEU 24 3HD1 LEU 24 -4.665 2.309 -5.187
171 HD21 LEU 24 1HD2 LEU 24 -2.553 3.647 -6.262
172 HD22 LEU 24 2HD2 LEU 24 -2.271 5.200 -5.445
173 HD23 LEU 24 3HD2 LEU 24 -2.284 3.664 -4.510
174 H GLU 25 H GLU 25 -5.213 4.580 -8.932
175 HA GLU 25 HA GLU 25 -7.508 6.032 -9.726
176 HB2 GLU 25 2HB GLU 25 -6.980 6.452 -12.039
177 HB3 GLU 25 3HB GLU 25 -5.839 7.320 -11.003
178 HG2 GLU 25 2HG GLU 25 -4.099 5.689 -11.438
179 HG3 GLU 25 3HG GLU 25 -5.219 4.663 -12.356
180 H GLU 26 H GLU 26 -8.475 4.789 -11.798
181 HA GLU 26 HA GLU 26 -8.694 2.057 -10.976
182 HB2 GLU 26 2HB GLU 26 -10.575 3.167 -11.970
183 HB3 GLU 26 3HB GLU 26 -9.684 3.521 -13.458
184 HG2 GLU 26 2HG GLU 26 -9.800 1.327 -14.226
185 HG3 GLU 26 3HG GLU 26 -9.833 0.643 -12.601
186 H GLY 27 H GLY 27 -7.025 0.698 -11.168
187 HA2 GLY 27 2HA GLY 27 -5.848 -0.892 -12.427
188 HA3 GLY 27 3HA GLY 27 -6.103 0.069 -13.891
189 H GLU 28 H GLU 28 -4.865 1.845 -11.104
190 HA GLU 28 HA GLU 28 -2.362 2.344 -12.404
191 HB2 GLU 28 2HB GLU 28 -3.769 3.629 -10.515
192 HB3 GLU 28 3HB GLU 28 -2.759 2.678 -9.438
193 HG2 GLU 28 2HG GLU 28 -0.745 3.639 -10.740
194 HG3 GLU 28 3HG GLU 28 -1.890 4.691 -11.570
195 H ASP 29 H ASP 29 -0.263 1.828 -11.327
196 HA ASP 29 HA ASP 29 0.142 -0.928 -10.780
197 HB2 ASP 29 2HB ASP 29 1.909 1.423 -10.024
198 HB3 ASP 29 3HB ASP 29 2.409 -0.260 -10.181
199 H VAL 30 H VAL 30 -0.864 -1.861 -8.973
200 HA VAL 30 HA VAL 30 -0.382 -0.619 -6.359
201 HB VAL 30 HB VAL 30 -2.703 -1.057 -5.679
202 HG11 VAL 30 1HG1 VAL 30 -3.731 0.859 -6.807
203 HG12 VAL 30 2HG1 VAL 30 -2.033 1.195 -6.408
204 HG13 VAL 30 3HG1 VAL 30 -2.503 0.801 -8.073
205 HG21 VAL 30 1HG2 VAL 30 -3.271 -1.598 -8.618
206 HG22 VAL 30 2HG2 VAL 30 -3.335 -2.795 -7.308
207 HG23 VAL 30 3HG2 VAL 30 -4.471 -1.436 -7.328
208 H ARG 31 H ARG 31 -1.130 -2.239 -4.625
209 HA ARG 31 HA ARG 31 -0.423 -4.967 -5.394
210 HB2 ARG 31 2HB ARG 31 1.285 -2.956 -3.962
211 HB3 ARG 31 3HB ARG 31 1.218 -4.532 -3.186
212 HG2 ARG 31 2HG ARG 31 1.868 -4.327 -6.144
213 HG3 ARG 31 3HG ARG 31 3.097 -4.047 -4.909
214 HD2 ARG 31 2HD ARG 31 2.474 -6.263 -3.866
215 HD3 ARG 31 3HD ARG 31 1.496 -6.595 -5.319
216 HE ARG 31 HE ARG 31 3.898 -5.849 -6.345
217 HH11 ARG 31 1HH1 ARG 31 6.069 -8.540 -5.826
218 HH12 ARG 31 2HH1 ARG 31 5.790 -7.053 -6.663
219 HH21 ARG 31 1HH2 ARG 31 4.447 -9.273 -4.217
220 HH22 ARG 31 2HH2 ARG 31 3.032 -8.308 -3.971
221 H ARG 32 H ARG 32 -0.636 -6.385 -3.390
222 HA ARG 32 HA ARG 32 -2.624 -5.294 -1.480
223 HB2 ARG 32 2HB ARG 32 -3.833 -6.700 -3.079
224 HB3 ARG 32 3HB ARG 32 -2.570 -7.934 -3.028
225 HG2 ARG 32 2HG ARG 32 -4.497 -8.711 -1.771
226 HG3 ARG 32 3HG ARG 32 -3.142 -8.474 -0.684
227 HD2 ARG 32 2HD ARG 32 -4.877 -7.483 0.504
228 HD3 ARG 32 3HD ARG 32 -4.159 -6.089 -0.287
229 HE ARG 32 HE ARG 32 -6.294 -7.383 -1.804
230 HH11 ARG 32 1HH1 ARG 32 -8.580 -4.768 -1.231
231 HH12 ARG 32 2HH1 ARG 32 -8.293 -6.231 -2.096
232 HH21 ARG 32 1HH2 ARG 32 -7.020 -4.051 0.435
233 HH22 ARG 32 2HH2 ARG 32 -5.457 -4.789 0.430
234 H LEU 33 H LEU 33 -2.398 -6.049 0.644
235 HA LEU 33 HA LEU 33 -0.252 -7.914 1.253
236 HB2 LEU 33 2HB LEU 33 0.121 -6.299 3.269
237 HB3 LEU 33 3HB LEU 33 0.871 -5.891 1.735
238 HG LEU 33 HG LEU 33 -1.874 -4.768 2.236
239 HD11 LEU 33 1HD1 LEU 33 -0.878 -2.925 3.592
240 HD12 LEU 33 2HD1 LEU 33 -0.797 -4.482 4.434
241 HD13 LEU 33 3HD1 LEU 33 0.653 -3.810 3.658
242 HD21 LEU 33 1HD2 LEU 33 -0.913 -2.796 1.155
243 HD22 LEU 33 2HD2 LEU 33 0.703 -3.534 1.169
244 HD23 LEU 33 3HD2 LEU 33 -0.581 -4.210 0.156
245 HA PRO 34 HA PRO 34 -3.175 -10.084 3.187
246 HB2 PRO 34 2HB PRO 34 -2.038 -11.116 5.485
247 HB3 PRO 34 3HB PRO 34 -1.591 -11.603 3.822
248 HG2 PRO 34 2HG PRO 34 -0.180 -9.644 5.638
249 HG3 PRO 34 3HG PRO 34 0.524 -10.901 4.569
250 HD2 PRO 34 2HD PRO 34 0.348 -8.242 3.939
251 HD3 PRO 34 3HD PRO 34 0.349 -9.492 2.698
252 H CYS 35 H CYS 35 -1.871 -7.534 5.213
253 HA CYS 35 HA CYS 35 -4.216 -7.345 7.045
254 HB2 CYS 35 2HB CYS 35 -1.858 -6.723 7.608
255 HB3 CYS 35 3HB CYS 35 -1.982 -5.434 6.400
256 H MET 36 H MET 36 -4.848 -7.489 4.169
257 HA MET 36 HA MET 36 -6.435 -6.702 2.845
258 HB2 MET 36 2HB MET 36 -8.472 -6.095 3.940
259 HB3 MET 36 3HB MET 36 -7.646 -7.343 4.873
260 HG2 MET 36 2HG MET 36 -6.858 -5.635 6.482
261 HG3 MET 36 3HG MET 36 -7.591 -4.363 5.500
262 HE1 MET 36 1HE MET 36 -8.016 -6.842 8.381
263 HE2 MET 36 2HE MET 36 -9.732 -7.298 8.330
264 HE3 MET 36 3HE MET 36 -8.624 -7.876 7.065
265 H HIS 37 H HIS 37 -4.196 -4.800 3.198
266 HA HIS 37 HA HIS 37 -5.607 -2.238 2.674
267 HB2 HIS 37 1HB HIS 37 -3.087 -3.011 4.141
268 HB3 HIS 37 2HB HIS 37 -3.146 -1.446 3.338
269 HD2 HIS 37 2HD HIS 37 -5.798 -0.211 3.895
270 HE1 HIS 37 1HE HIS 37 -5.274 -1.000 8.042
271 HE2 HIS 37 2HE HIS 37 -6.562 0.384 6.319
272 H LEU 38 H LEU 38 -4.547 -0.809 0.980
273 HA LEU 38 HA LEU 38 -3.535 -2.504 -1.249
274 HB2 LEU 38 2HB LEU 38 -5.997 -2.147 -1.329
275 HB3 LEU 38 3HB LEU 38 -5.761 -0.408 -1.339
276 HG LEU 38 HG LEU 38 -4.378 -2.107 -3.433
277 HD11 LEU 38 1HD1 LEU 38 -7.303 -1.255 -3.522
278 HD12 LEU 38 2HD1 LEU 38 -6.392 -1.954 -4.868
279 HD13 LEU 38 3HD1 LEU 38 -6.703 -2.929 -3.422
280 HD21 LEU 38 1HD2 LEU 38 -5.660 0.664 -3.478
281 HD22 LEU 38 2HD2 LEU 38 -3.911 0.329 -3.455
282 HD23 LEU 38 3HD2 LEU 38 -4.882 -0.121 -4.859
283 H PHE 39 H PHE 39 -1.642 -1.677 -1.905
284 HA PHE 39 HA PHE 39 -1.039 1.211 -1.347
285 HB2 PHE 39 2HB PHE 39 0.691 -1.291 -1.138
286 HB3 PHE 39 3HB PHE 39 1.341 0.328 -1.075
287 HD1 PHE 39 1HD PHE 39 -1.670 0.675 0.784
288 HD2 PHE 39 2HD PHE 39 2.223 -1.113 0.990
289 HE1 PHE 39 1HE PHE 39 -1.899 0.480 3.201
290 HE2 PHE 39 2HE PHE 39 2.040 -1.230 3.455
291 HZ PHE 39 HZ PHE 39 -0.050 -0.448 4.574
292 H HIS 40 H HIS 40 0.939 1.911 -2.808
293 HA HIS 40 HA HIS 40 0.391 1.190 -5.626
294 HB2 HIS 40 1HB HIS 40 2.499 2.842 -4.249
295 HB3 HIS 40 2HB HIS 40 2.696 2.397 -5.924
296 HD2 HIS 40 2HD HIS 40 0.402 3.191 -7.570
297 HE1 HIS 40 1HE HIS 40 0.300 6.894 -5.469
298 HE2 HIS 40 2HE HIS 40 -0.453 5.650 -7.585
299 H GLN 41 H GLN 41 2.090 0.259 -6.948
300 HA GLN 41 HA GLN 41 3.566 -1.975 -5.988
301 HB2 GLN 41 2HB GLN 41 2.809 -1.379 -8.346
302 HB3 GLN 41 3HB GLN 41 4.152 -0.245 -8.429
303 HG2 GLN 41 2HG GLN 41 5.146 -2.082 -9.391
304 HG3 GLN 41 3HG GLN 41 5.571 -2.416 -7.710
305 HE21 GLN 41 1HE2 GLN 41 2.931 -2.994 -10.136
306 HE22 GLN 41 2HE2 GLN 41 2.525 -4.587 -9.525
307 H VAL 42 H VAL 42 4.951 1.178 -7.162
308 HA VAL 42 HA VAL 42 7.519 0.625 -6.210
309 HB VAL 42 HB VAL 42 6.163 3.294 -6.773
310 HG11 VAL 42 1HG1 VAL 42 9.125 2.653 -6.413
311 HG12 VAL 42 2HG1 VAL 42 8.492 4.164 -7.102
312 HG13 VAL 42 3HG1 VAL 42 8.152 3.756 -5.417
313 HG21 VAL 42 1HG2 VAL 42 7.356 3.105 -8.935
314 HG22 VAL 42 2HG2 VAL 42 8.022 1.535 -8.440
315 HG23 VAL 42 3HG2 VAL 42 6.278 1.725 -8.710
316 H CYS 43 H CYS 43 4.936 2.547 -4.563
317 HA CYS 43 HA CYS 43 6.446 3.248 -2.243
318 HB2 CYS 43 2HB CYS 43 3.507 2.529 -2.312
319 HB3 CYS 43 3HB CYS 43 4.367 3.519 -1.155
320 H VAL 44 H VAL 44 4.439 0.176 -2.837
321 HA VAL 44 HA VAL 44 5.157 -0.626 -0.215
322 HB VAL 44 HB VAL 44 3.051 -1.247 -1.438
323 HG11 VAL 44 1HG1 VAL 44 3.109 -3.396 -2.586
324 HG12 VAL 44 2HG1 VAL 44 4.071 -2.199 -3.483
325 HG13 VAL 44 3HG1 VAL 44 4.878 -3.439 -2.502
326 HG21 VAL 44 1HG2 VAL 44 2.812 -3.204 -0.141
327 HG22 VAL 44 2HG2 VAL 44 4.557 -3.574 -0.224
328 HG23 VAL 44 3HG2 VAL 44 4.005 -2.211 0.743
329 H ASP 45 H ASP 45 6.760 -0.936 -3.296
330 HA ASP 45 HA ASP 45 8.448 -3.166 -2.666
331 HB2 ASP 45 2HB ASP 45 8.565 -0.838 -4.549
332 HB3 ASP 45 3HB ASP 45 10.119 -1.516 -4.080
333 H GLN 46 H GLN 46 8.956 0.376 -2.194
334 HA GLN 46 HA GLN 46 11.253 -0.118 -0.502
335 HB2 GLN 46 2HB GLN 46 9.540 2.388 -0.839
336 HB3 GLN 46 3HB GLN 46 11.069 2.310 0.058
337 HG2 GLN 46 2HG GLN 46 12.203 1.488 -2.032
338 HG3 GLN 46 3HG GLN 46 10.696 1.763 -2.919
339 HE21 GLN 46 1HE2 GLN 46 13.661 3.216 -2.018
340 HE22 GLN 46 2HE2 GLN 46 13.159 4.871 -2.334
341 H ALA 47 H ALA 47 7.818 0.031 0.209
342 HA ALA 47 HA ALA 47 8.108 0.422 3.032
343 HB1 ALA 47 1HB ALA 47 5.837 -0.437 3.157
344 HB2 ALA 47 2HB ALA 47 5.994 0.587 1.706
345 HB3 ALA 47 3HB ALA 47 5.989 -1.188 1.554
346 H LEU 48 H LEU 48 7.532 -2.566 1.186
347 HA LEU 48 HA LEU 48 7.742 -4.403 3.253
348 HB2 LEU 48 2HB LEU 48 6.719 -4.652 0.992
349 HB3 LEU 48 3HB LEU 48 8.317 -4.796 0.272
350 HG LEU 48 HG LEU 48 7.477 -6.661 2.515
351 HD11 LEU 48 1HD1 LEU 48 5.602 -6.672 0.903
352 HD12 LEU 48 2HD1 LEU 48 6.739 -6.981 -0.425
353 HD13 LEU 48 3HD1 LEU 48 6.494 -8.197 0.852
354 HD21 LEU 48 1HD2 LEU 48 8.891 -8.275 1.253
355 HD22 LEU 48 2HD2 LEU 48 9.213 -7.036 0.025
356 HD23 LEU 48 3HD2 LEU 48 9.818 -6.827 1.680
357 H ILE 49 H ILE 49 10.328 -3.329 0.913
358 HA ILE 49 HA ILE 49 12.327 -4.967 2.150
359 HB ILE 49 HB ILE 49 13.953 -3.657 0.989
360 HG12 ILE 49 2HG1 ILE 49 12.734 -1.760 -0.548
361 HG13 ILE 49 3HG1 ILE 49 11.928 -1.577 1.025
362 HG21 ILE 49 1HG2 ILE 49 12.699 -5.344 -0.260
363 HG22 ILE 49 2HG2 ILE 49 11.520 -4.124 -0.765
364 HG23 ILE 49 3HG2 ILE 49 13.203 -4.001 -1.298
365 HD11 ILE 49 1HD1 ILE 49 13.877 -0.135 0.954
366 HD12 ILE 49 2HD1 ILE 49 14.157 -1.438 2.128
367 HD13 ILE 49 3HD1 ILE 49 14.919 -1.511 0.526
368 H THR 50 H THR 50 11.121 -1.657 2.973
369 HA THR 50 HA THR 50 13.197 -1.185 4.828
370 HB THR 50 HB THR 50 10.491 -0.008 4.268
371 HG1 THR 50 1HG THR 50 13.082 1.090 4.634
372 HG21 THR 50 1HG2 THR 50 10.783 1.663 6.068
373 HG22 THR 50 2HG2 THR 50 10.359 0.060 6.664
374 HG23 THR 50 3HG2 THR 50 12.042 0.636 6.798
375 H ASN 51 H ASN 51 10.007 -2.812 5.135
376 HA ASN 51 HA ASN 51 10.863 -4.376 7.342
377 HB2 ASN 51 2HB ASN 51 9.860 -1.785 8.080
378 HB3 ASN 51 3HB ASN 51 8.539 -2.904 8.363
379 HD21 ASN 51 1HD2 ASN 51 12.100 -2.631 8.903
380 HD22 ASN 51 2HD2 ASN 51 12.046 -3.344 10.513
381 H LYS 52 H LYS 52 9.586 -6.242 7.185
382 HA LYS 52 HA LYS 52 7.428 -6.202 5.186
383 HB2 LYS 52 2HB LYS 52 8.718 -8.431 6.798
384 HB3 LYS 52 3HB LYS 52 7.512 -8.659 5.516
385 HG2 LYS 52 2HG LYS 52 8.951 -7.952 3.814
386 HG3 LYS 52 3HG LYS 52 9.994 -7.029 4.904
387 HD2 LYS 52 2HD LYS 52 10.823 -9.129 5.906
388 HD3 LYS 52 3HD LYS 52 9.847 -10.015 4.717
389 HE2 LYS 52 2HE LYS 52 11.170 -8.212 3.102
390 HE3 LYS 52 3HE LYS 52 12.382 -8.462 4.367
391 HZ1 LYS 52 1HZ LYS 52 12.155 -10.873 3.932
392 HZ2 LYS 52 2HZ LYS 52 11.090 -10.629 2.821
393 HZ3 LYS 52 3HZ LYS 52 12.630 -10.071 2.543
394 H LYS 53 H LYS 53 6.294 -4.606 6.868
395 HA LYS 53 HA LYS 53 4.233 -6.281 8.089
396 HB2 LYS 53 2HB LYS 53 4.292 -4.908 10.215
397 HB3 LYS 53 3HB LYS 53 5.590 -6.088 10.041
398 HG2 LYS 53 2HG LYS 53 7.220 -4.521 9.953
399 HG3 LYS 53 3HG LYS 53 6.288 -3.420 8.936
400 HD2 LYS 53 2HD LYS 53 4.964 -2.693 10.884
401 HD3 LYS 53 3HD LYS 53 5.965 -3.732 11.936
402 HE2 LYS 53 2HE LYS 53 7.996 -2.526 11.194
403 HE3 LYS 53 3HE LYS 53 7.023 -1.541 10.090
404 HZ1 LYS 53 1HZ LYS 53 7.461 -0.332 12.074
405 HZ2 LYS 53 2HZ LYS 53 5.853 -0.681 12.041
406 HZ3 LYS 53 3HZ LYS 53 6.865 -1.527 13.032
407 H CYS 54 H CYS 54 2.269 -5.142 8.273
408 HA CYS 54 HA CYS 54 1.793 -2.963 6.374
409 HB2 CYS 54 2HB CYS 54 0.157 -4.726 7.153
410 HB3 CYS 54 3HB CYS 54 0.139 -3.914 8.718
411 HA PRO 55 HA PRO 55 3.198 0.026 9.527
412 HB2 PRO 55 2HB PRO 55 3.552 2.216 7.968
413 HB3 PRO 55 3HB PRO 55 4.586 0.770 7.782
414 HG2 PRO 55 2HG PRO 55 2.108 1.467 6.161
415 HG3 PRO 55 3HG PRO 55 3.746 1.061 5.548
416 HD2 PRO 55 2HD PRO 55 1.770 -0.816 5.795
417 HD3 PRO 55 3HD PRO 55 3.489 -1.212 6.093
418 H ILE 56 H ILE 56 0.729 -0.601 9.945
419 HA ILE 56 HA ILE 56 -0.708 1.810 10.613
420 HB ILE 56 HB ILE 56 -2.115 -0.240 8.791
421 HG12 ILE 56 2HG1 ILE 56 -2.725 2.052 7.590
422 HG13 ILE 56 3HG1 ILE 56 -1.202 2.578 8.292
423 HG21 ILE 56 1HG2 ILE 56 -3.566 0.464 10.645
424 HG22 ILE 56 2HG2 ILE 56 -3.222 2.169 10.284
425 HG23 ILE 56 3HG2 ILE 56 -4.123 1.161 9.129
426 HD11 ILE 56 1HD1 ILE 56 -0.351 0.239 7.210
427 HD12 ILE 56 2HD1 ILE 56 -1.783 0.471 6.205
428 HD13 ILE 56 3HD1 ILE 56 -0.492 1.705 6.250
429 H CYS 57 H CYS 57 -1.068 -1.628 9.945
430 HA CYS 57 HA CYS 57 -2.135 -2.448 12.582
431 HB2 CYS 57 2HB CYS 57 -1.244 -4.222 10.317
432 HB3 CYS 57 3HB CYS 57 -2.612 -4.389 11.417
433 H ARG 58 H ARG 58 -0.649 -4.895 12.625
434 HA ARG 58 HA ARG 58 2.192 -4.166 12.435
435 HB2 ARG 58 2HB ARG 58 0.865 -4.391 15.031
436 HB3 ARG 58 3HB ARG 58 2.083 -5.649 14.882
437 HG2 ARG 58 2HG ARG 58 3.726 -3.857 14.107
438 HG3 ARG 58 3HG ARG 58 2.482 -2.663 14.511
439 HD2 ARG 58 2HD ARG 58 3.842 -2.731 16.417
440 HD3 ARG 58 3HD ARG 58 2.451 -3.738 16.863
441 HE ARG 58 HE ARG 58 4.369 -5.451 15.745
442 HH11 ARG 58 1HH1 ARG 58 6.384 -6.029 18.592
443 HH12 ARG 58 2HH1 ARG 58 6.025 -6.544 16.988
444 HH21 ARG 58 1HH2 ARG 58 5.239 -4.171 19.523
445 HH22 ARG 58 2HH2 ARG 58 4.034 -3.375 18.573
446 H VAL 59 H VAL 59 0.302 -5.796 10.917
447 HA VAL 59 HA VAL 59 0.897 -8.578 11.623
448 HB VAL 59 HB VAL 59 -0.581 -7.461 9.217
449 HG11 VAL 59 1HG1 VAL 59 -0.725 -10.169 10.617
450 HG12 VAL 59 2HG1 VAL 59 -1.734 -9.661 9.245
451 HG13 VAL 59 3HG1 VAL 59 0.006 -9.849 9.029
452 HG21 VAL 59 1HG2 VAL 59 -1.727 -6.591 11.207
453 HG22 VAL 59 2HG2 VAL 59 -2.682 -7.895 10.516
454 HG23 VAL 59 3HG2 VAL 59 -1.692 -8.201 11.961
455 H ASP 60 H ASP 60 2.253 -9.869 10.411
456 HA ASP 60 HA ASP 60 4.395 -8.708 8.852
457 HB2 ASP 60 2HB ASP 60 4.670 -10.702 10.274
458 HB3 ASP 60 3HB ASP 60 3.456 -11.567 9.321
459 H ILE 61 H ILE 61 4.616 -8.809 6.607
460 HA ILE 61 HA ILE 61 2.232 -9.734 5.069
461 HB ILE 61 HB ILE 61 2.616 -8.047 3.471
462 HG12 ILE 61 2HG1 ILE 61 5.049 -7.231 5.102
463 HG13 ILE 61 3HG1 ILE 61 5.073 -7.980 3.496
464 HG21 ILE 61 1HG2 ILE 61 1.904 -6.131 4.681
465 HG22 ILE 61 2HG2 ILE 61 1.384 -7.505 5.667
466 HG23 ILE 61 3HG2 ILE 61 2.849 -6.604 6.119
467 HD11 ILE 61 1HD1 ILE 61 3.974 -5.278 4.210
468 HD12 ILE 61 2HD1 ILE 61 5.370 -5.676 3.181
469 HD13 ILE 61 3HD1 ILE 61 3.710 -6.111 2.647
470 H GLU 62 H GLU 62 5.561 -10.201 5.605
471 HA GLU 62 HA GLU 62 6.497 -11.028 3.107
472 HB2 GLU 62 2HB GLU 62 7.873 -10.943 5.160
473 HB3 GLU 62 3HB GLU 62 7.040 -12.368 5.799
474 HG2 GLU 62 2HG GLU 62 7.924 -13.787 4.084
475 HG3 GLU 62 3HG GLU 62 8.376 -12.408 3.074
476 H ALA 63 H ALA 63 6.512 -13.031 2.018
477 HA ALA 63 HA ALA 63 4.427 -14.969 2.771
478 HB1 ALA 63 1HB ALA 63 3.390 -13.426 1.130
479 HB2 ALA 63 2HB ALA 63 4.741 -13.703 0.008
480 HB3 ALA 63 3HB ALA 63 3.638 -15.035 0.423
481 H GLN 64 H GLN 64 4.786 -16.916 1.196
482 HA GLN 64 HA GLN 64 7.165 -18.015 2.036
483 HB2 GLN 64 2HB GLN 64 4.968 -19.065 1.172
484 HB3 GLN 64 3HB GLN 64 5.683 -18.971 -0.441
485 HG2 GLN 64 2HG GLN 64 7.567 -20.395 0.327
486 HG3 GLN 64 3HG GLN 64 6.917 -20.371 1.979
487 HE21 GLN 64 1HE2 GLN 64 6.059 -21.363 -1.401
488 HE22 GLN 64 2HE2 GLN 64 4.985 -22.649 -0.858
489 H LEU 65 H LEU 65 9.199 -17.406 1.538
490 HA LEU 65 HA LEU 65 9.877 -15.759 -0.592
491 HB2 LEU 65 2HB LEU 65 11.317 -17.203 1.538
492 HB3 LEU 65 3HB LEU 65 12.250 -17.163 0.046
493 HG LEU 65 HG LEU 65 11.898 -14.689 -0.089
494 HD11 LEU 65 1HD1 LEU 65 9.851 -14.611 1.411
495 HD12 LEU 65 2HD1 LEU 65 10.916 -14.946 2.789
496 HD13 LEU 65 3HD1 LEU 65 11.121 -13.460 1.848
497 HD21 LEU 65 1HD2 LEU 65 13.959 -15.741 0.881
498 HD22 LEU 65 2HD2 LEU 65 13.579 -14.154 1.599
499 HD23 LEU 65 3HD2 LEU 65 13.217 -15.648 2.484
500 HA PRO 66 HA PRO 66 10.071 -18.635 -3.956
501 HB2 PRO 66 2HB PRO 66 11.325 -17.136 -5.868
502 HB3 PRO 66 3HB PRO 66 9.658 -16.787 -5.309
503 HG2 PRO 66 2HG PRO 66 12.232 -15.472 -4.434
504 HG3 PRO 66 3HG PRO 66 10.695 -14.682 -4.888
505 HD2 PRO 66 2HD PRO 66 11.389 -15.157 -2.276
506 HD3 PRO 66 3HD PRO 66 9.688 -15.221 -2.832
507 H SER 67 H SER 67 13.064 -16.828 -3.106
508 HA SER 67 HA SER 67 14.478 -19.319 -2.692
509 HB2 SER 67 2HB SER 67 15.269 -17.475 -4.977
510 HB3 SER 67 3HB SER 67 16.450 -18.505 -4.145
511 HG SER 67 HG SER 67 14.083 -19.699 -5.029
512 H GLU 68 H GLU 68 15.427 -15.833 -3.356
513 HA GLU 68 HA GLU 68 16.260 -15.682 -0.527
514 HB2 GLU 68 2HB GLU 68 18.104 -16.605 -2.061
515 HB3 GLU 68 3HB GLU 68 18.201 -14.984 -2.755
516 HG2 GLU 68 2HG GLU 68 18.615 -14.057 -0.472
517 HG3 GLU 68 3HG GLU 68 18.439 -15.675 0.215
518 H SER 69 H SER 69 14.312 -14.450 -0.631
519 HA SER 69 HA SER 69 13.117 -12.543 -0.565
520 HB2 SER 69 2HB SER 69 15.273 -11.340 0.048
521 HB3 SER 69 3HB SER 69 15.471 -10.994 -1.687
522 HG SER 69 HG SER 69 13.386 -10.102 -1.647
Start of MODEL 19
1 H1 MET 1 H1 MET 1 -25.323 31.346 -8.728
2 H2 MET 1 H2 MET 1 -25.253 32.989 -8.638
3 H3 MET 1 H3 MET 1 -23.946 32.080 -8.206
4 HA MET 1 HA MET 1 -25.037 32.913 -6.258
5 HB2 MET 1 2HB MET 1 -27.409 31.459 -7.470
6 HB3 MET 1 3HB MET 1 -27.318 31.873 -5.744
7 HG2 MET 1 2HG MET 1 -27.174 34.211 -6.200
8 HG3 MET 1 3HG MET 1 -26.899 33.942 -7.924
9 HE1 MET 1 1HE MET 1 -28.576 35.730 -8.548
10 HE2 MET 1 2HE MET 1 -30.281 35.763 -8.047
11 HE3 MET 1 3HE MET 1 -28.998 36.061 -6.851
12 H LYS 2 H LYS 2 -26.399 29.608 -6.903
13 HA LYS 2 HA LYS 2 -23.935 28.445 -5.782
14 HB2 LYS 2 2HB LYS 2 -26.606 28.326 -4.612
15 HB3 LYS 2 3HB LYS 2 -26.206 26.748 -5.268
16 HG2 LYS 2 2HG LYS 2 -25.577 26.900 -2.930
17 HG3 LYS 2 3HG LYS 2 -24.143 26.657 -3.929
18 HD2 LYS 2 2HD LYS 2 -24.807 29.511 -3.426
19 HD3 LYS 2 3HD LYS 2 -24.450 28.594 -1.958
20 HE2 LYS 2 2HE LYS 2 -22.281 28.015 -2.636
21 HE3 LYS 2 3HE LYS 2 -22.608 28.337 -4.341
22 HZ1 LYS 2 1HZ LYS 2 -21.269 30.061 -3.351
23 HZ2 LYS 2 2HZ LYS 2 -22.708 30.657 -3.879
24 HZ3 LYS 2 3HZ LYS 2 -22.455 30.420 -2.263
25 H GLN 3 H GLN 3 -23.123 27.044 -7.289
26 HA GLN 3 HA GLN 3 -24.911 25.616 -9.030
27 HB2 GLN 3 2HB GLN 3 -23.726 26.068 -11.073
28 HB3 GLN 3 3HB GLN 3 -24.402 27.572 -10.464
29 HG2 GLN 3 2HG GLN 3 -22.249 28.373 -9.746
30 HG3 GLN 3 3HG GLN 3 -21.490 26.797 -9.987
31 HE21 GLN 3 1HE2 GLN 3 -20.833 29.511 -11.268
32 HE22 GLN 3 2HE2 GLN 3 -20.923 29.116 -12.979
33 H ASP 4 H ASP 4 -23.044 24.148 -10.418
34 HA ASP 4 HA ASP 4 -21.837 22.624 -8.289
35 HB2 ASP 4 2HB ASP 4 -22.779 21.704 -10.438
36 HB3 ASP 4 3HB ASP 4 -21.417 22.438 -11.300
37 H GLY 5 H GLY 5 -19.549 22.216 -8.058
38 HA2 GLY 5 2HA GLY 5 -17.394 23.339 -9.287
39 HA3 GLY 5 3HA GLY 5 -17.942 24.662 -8.236
40 H GLU 6 H GLU 6 -17.681 21.049 -7.882
41 HA GLU 6 HA GLU 6 -15.687 21.320 -5.791
42 HB2 GLU 6 2HB GLU 6 -18.543 20.892 -5.188
43 HB3 GLU 6 3HB GLU 6 -17.588 19.505 -4.682
44 HG2 GLU 6 2HG GLU 6 -16.892 22.373 -3.919
45 HG3 GLU 6 3HG GLU 6 -17.919 21.316 -2.948
46 H GLU 7 H GLU 7 -14.912 18.981 -5.258
47 HA GLU 7 HA GLU 7 -15.656 16.981 -7.264
48 HB2 GLU 7 2HB GLU 7 -13.739 18.546 -8.185
49 HB3 GLU 7 3HB GLU 7 -12.727 17.737 -6.993
50 HG2 GLU 7 2HG GLU 7 -12.379 16.308 -8.754
51 HG3 GLU 7 3HG GLU 7 -13.820 15.533 -8.093
52 H GLY 8 H GLY 8 -15.933 15.238 -5.915
53 HA2 GLY 8 2HA GLY 8 -14.045 14.685 -3.722
54 HA3 GLY 8 3HA GLY 8 -15.638 15.250 -3.200
55 H THR 9 H THR 9 -17.500 13.965 -4.707
56 HA THR 9 HA THR 9 -17.141 11.127 -4.153
57 HB THR 9 HB THR 9 -19.278 11.056 -5.567
58 HG1 THR 9 1HG THR 9 -18.713 13.090 -6.622
59 HG21 THR 9 1HG2 THR 9 -19.330 11.194 -3.081
60 HG22 THR 9 2HG2 THR 9 -19.285 12.970 -3.187
61 HG23 THR 9 3HG2 THR 9 -20.680 12.077 -3.827
62 H GLU 10 H GLU 10 -16.665 9.564 -5.663
63 HA GLU 10 HA GLU 10 -16.342 8.507 -7.617
64 HB2 GLU 10 2HB GLU 10 -17.133 10.927 -8.812
65 HB3 GLU 10 3HB GLU 10 -15.506 10.652 -9.436
66 HG2 GLU 10 2HG GLU 10 -17.916 8.778 -9.497
67 HG3 GLU 10 3HG GLU 10 -17.314 9.741 -10.842
68 H GLU 11 H GLU 11 -14.409 7.536 -8.032
69 HA GLU 11 HA GLU 11 -12.537 6.871 -6.775
70 HB2 GLU 11 2HB GLU 11 -11.691 8.648 -9.079
71 HB3 GLU 11 3HB GLU 11 -10.540 7.679 -8.142
72 HG2 GLU 11 2HG GLU 11 -11.841 5.625 -8.651
73 HG3 GLU 11 3HG GLU 11 -12.901 6.576 -9.699
74 H ASP 12 H ASP 12 -12.982 7.914 -4.623
75 HA ASP 12 HA ASP 12 -10.525 9.207 -3.910
76 HB2 ASP 12 2HB ASP 12 -11.869 11.194 -4.469
77 HB3 ASP 12 3HB ASP 12 -13.192 10.577 -3.453
78 H THR 13 H THR 13 -10.257 9.061 -1.700
79 HA THR 13 HA THR 13 -10.213 8.080 0.321
80 HB THR 13 HB THR 13 -13.176 8.637 0.047
81 HG1 THR 13 1HG THR 13 -11.928 10.469 -0.017
82 HG21 THR 13 1HG2 THR 13 -11.582 7.997 2.565
83 HG22 THR 13 2HG2 THR 13 -13.170 8.793 2.547
84 HG23 THR 13 3HG2 THR 13 -13.017 7.130 1.958
85 H GLU 14 H GLU 14 -11.520 6.190 -2.093
86 HA GLU 14 HA GLU 14 -11.798 3.783 -0.458
87 HB2 GLU 14 2HB GLU 14 -11.605 4.212 -3.474
88 HB3 GLU 14 3HB GLU 14 -11.840 2.649 -2.683
89 HG2 GLU 14 2HG GLU 14 -13.824 4.021 -1.447
90 HG3 GLU 14 3HG GLU 14 -13.741 4.975 -2.929
91 H GLU 15 H GLU 15 -9.311 5.107 -2.752
92 HA GLU 15 HA GLU 15 -7.434 3.127 -1.595
93 HB2 GLU 15 2HB GLU 15 -6.623 2.679 -3.863
94 HB3 GLU 15 3HB GLU 15 -8.238 2.098 -3.514
95 HG2 GLU 15 2HG GLU 15 -9.277 3.711 -4.908
96 HG3 GLU 15 3HG GLU 15 -7.829 4.707 -5.005
97 H LYS 16 H LYS 16 -5.917 4.157 -0.622
98 HA LYS 16 HA LYS 16 -4.506 6.340 -2.077
99 HB2 LYS 16 2HB LYS 16 -5.104 6.208 0.914
100 HB3 LYS 16 3HB LYS 16 -3.886 7.253 0.180
101 HG2 LYS 16 2HG LYS 16 -5.780 8.218 -1.277
102 HG3 LYS 16 3HG LYS 16 -6.895 7.370 -0.189
103 HD2 LYS 16 2HD LYS 16 -6.652 9.605 0.667
104 HD3 LYS 16 3HD LYS 16 -5.731 8.548 1.753
105 HE2 LYS 16 2HE LYS 16 -3.984 9.375 -0.385
106 HE3 LYS 16 3HE LYS 16 -4.848 10.811 0.167
107 HZ1 LYS 16 1HZ LYS 16 -4.127 10.272 2.425
108 HZ2 LYS 16 2HZ LYS 16 -3.232 9.010 1.843
109 HZ3 LYS 16 3HZ LYS 16 -2.877 10.560 1.399
110 H CYS 17 H CYS 17 -2.463 6.021 -2.297
111 HA CYS 17 HA CYS 17 -0.763 3.869 -1.157
112 HB2 CYS 17 2HB CYS 17 -0.494 5.203 -3.347
113 HB3 CYS 17 3HB CYS 17 -0.183 6.592 -2.363
114 H THR 18 H THR 18 -1.225 4.046 1.178
115 HA THR 18 HA THR 18 -1.070 6.618 2.423
116 HB THR 18 HB THR 18 -2.076 4.511 3.402
117 HG1 THR 18 1HG THR 18 -0.333 6.196 4.873
118 HG21 THR 18 1HG2 THR 18 0.706 4.104 4.544
119 HG22 THR 18 2HG2 THR 18 -0.722 3.046 4.639
120 HG23 THR 18 3HG2 THR 18 0.171 3.238 3.101
121 H ILE 19 H ILE 19 1.422 4.709 1.010
122 HA ILE 19 HA ILE 19 3.591 5.448 2.716
123 HB ILE 19 HB ILE 19 3.272 4.271 -0.052
124 HG12 ILE 19 2HG1 ILE 19 4.500 2.776 2.235
125 HG13 ILE 19 3HG1 ILE 19 2.773 3.104 2.383
126 HG21 ILE 19 1HG2 ILE 19 5.701 3.623 0.182
127 HG22 ILE 19 2HG2 ILE 19 5.411 5.354 -0.090
128 HG23 ILE 19 3HG2 ILE 19 5.805 4.764 1.542
129 HD11 ILE 19 1HD1 ILE 19 3.237 0.950 1.252
130 HD12 ILE 19 2HD1 ILE 19 2.302 2.087 0.249
131 HD13 ILE 19 3HD1 ILE 19 4.033 1.833 -0.069
132 H CYS 20 H CYS 20 2.527 6.514 -0.613
133 HA CYS 20 HA CYS 20 4.165 9.030 -0.352
134 HB2 CYS 20 2HB CYS 20 3.640 9.299 -2.690
135 HB3 CYS 20 3HB CYS 20 4.444 7.756 -2.388
136 H LEU 21 H LEU 21 1.298 8.058 0.842
137 HA LEU 21 HA LEU 21 -0.653 8.946 1.402
138 HB2 LEU 21 2HB LEU 21 1.134 11.384 1.607
139 HB3 LEU 21 3HB LEU 21 -0.490 11.308 2.294
140 HG LEU 21 HG LEU 21 1.692 9.302 3.010
141 HD11 LEU 21 1HD1 LEU 21 0.842 11.825 4.475
142 HD12 LEU 21 2HD1 LEU 21 1.986 10.590 5.063
143 HD13 LEU 21 3HD1 LEU 21 2.391 11.553 3.633
144 HD21 LEU 21 1HD2 LEU 21 -0.963 10.048 4.338
145 HD22 LEU 21 2HD2 LEU 21 -0.608 8.528 3.477
146 HD23 LEU 21 3HD2 LEU 21 0.233 8.900 4.976
147 H SER 22 H SER 22 -0.200 8.855 -1.478
148 HA SER 22 HA SER 22 -1.904 11.144 -2.369
149 HB2 SER 22 2HB SER 22 0.325 9.575 -3.693
150 HB3 SER 22 3HB SER 22 -0.853 10.509 -4.638
151 HG SER 22 HG SER 22 0.846 11.458 -2.552
152 H ILE 23 H ILE 23 -3.682 10.666 -3.871
153 HA ILE 23 HA ILE 23 -4.959 8.200 -3.448
154 HB ILE 23 HB ILE 23 -5.320 10.552 -5.357
155 HG12 ILE 23 2HG1 ILE 23 -7.079 11.289 -3.926
156 HG13 ILE 23 3HG1 ILE 23 -7.008 9.809 -2.953
157 HG21 ILE 23 1HG2 ILE 23 -7.122 8.172 -4.772
158 HG22 ILE 23 2HG2 ILE 23 -7.690 9.673 -5.547
159 HG23 ILE 23 3HG2 ILE 23 -6.475 8.687 -6.339
160 HD11 ILE 23 1HD1 ILE 23 -4.980 10.495 -1.932
161 HD12 ILE 23 2HD1 ILE 23 -4.872 11.949 -2.977
162 HD13 ILE 23 3HD1 ILE 23 -6.170 11.789 -1.774
163 H LEU 24 H LEU 24 -5.255 6.619 -4.886
164 HA LEU 24 HA LEU 24 -3.202 6.180 -6.971
165 HB2 LEU 24 2HB LEU 24 -5.366 4.464 -5.678
166 HB3 LEU 24 3HB LEU 24 -4.219 3.842 -6.878
167 HG LEU 24 HG LEU 24 -3.422 5.108 -4.210
168 HD11 LEU 24 1HD1 LEU 24 -2.788 2.786 -3.605
169 HD12 LEU 24 2HD1 LEU 24 -4.519 3.083 -3.767
170 HD13 LEU 24 3HD1 LEU 24 -3.656 2.219 -5.062
171 HD21 LEU 24 1HD2 LEU 24 -1.647 5.459 -5.650
172 HD22 LEU 24 2HD2 LEU 24 -1.235 3.883 -4.926
173 HD23 LEU 24 3HD2 LEU 24 -1.924 3.950 -6.558
174 H GLU 25 H GLU 25 -5.149 4.409 -8.531
175 HA GLU 25 HA GLU 25 -7.288 5.916 -9.363
176 HB2 GLU 25 2HB GLU 25 -6.700 6.543 -11.616
177 HB3 GLU 25 3HB GLU 25 -5.514 7.271 -10.524
178 HG2 GLU 25 2HG GLU 25 -3.965 5.380 -11.034
179 HG3 GLU 25 3HG GLU 25 -5.110 4.769 -12.225
180 H GLU 26 H GLU 26 -8.486 4.671 -10.946
181 HA GLU 26 HA GLU 26 -8.009 1.814 -10.874
182 HB2 GLU 26 2HB GLU 26 -10.241 2.998 -10.946
183 HB3 GLU 26 3HB GLU 26 -9.982 3.325 -12.654
184 HG2 GLU 26 2HG GLU 26 -9.918 0.536 -11.401
185 HG3 GLU 26 3HG GLU 26 -11.392 1.278 -12.008
186 H GLY 27 H GLY 27 -5.953 1.489 -11.773
187 HA2 GLY 27 2HA GLY 27 -5.688 0.562 -14.278
188 HA3 GLY 27 3HA GLY 27 -5.472 2.292 -14.580
189 H GLU 28 H GLU 28 -4.126 2.671 -11.871
190 HA GLU 28 HA GLU 28 -1.468 2.439 -12.837
191 HB2 GLU 28 2HB GLU 28 -2.889 3.458 -10.464
192 HB3 GLU 28 3HB GLU 28 -1.336 2.793 -10.033
193 HG2 GLU 28 2HG GLU 28 -1.535 4.690 -12.391
194 HG3 GLU 28 3HG GLU 28 -1.497 5.305 -10.729
195 H ASP 29 H ASP 29 0.311 1.414 -11.744
196 HA ASP 29 HA ASP 29 -0.181 -1.441 -11.263
197 HB2 ASP 29 2HB ASP 29 2.346 0.244 -11.105
198 HB3 ASP 29 3HB ASP 29 2.253 -1.423 -10.604
199 H VAL 30 H VAL 30 -0.990 -2.080 -9.384
200 HA VAL 30 HA VAL 30 -0.056 -0.853 -6.873
201 HB VAL 30 HB VAL 30 -2.350 -0.871 -5.994
202 HG11 VAL 30 1HG1 VAL 30 -3.197 1.107 -7.140
203 HG12 VAL 30 2HG1 VAL 30 -1.438 1.224 -6.968
204 HG13 VAL 30 3HG1 VAL 30 -2.159 0.796 -8.534
205 HG21 VAL 30 1HG2 VAL 30 -3.392 -2.566 -7.464
206 HG22 VAL 30 2HG2 VAL 30 -4.292 -1.041 -7.492
207 HG23 VAL 30 3HG2 VAL 30 -3.243 -1.457 -8.851
208 H ARG 31 H ARG 31 -1.022 -2.353 -5.049
209 HA ARG 31 HA ARG 31 -1.193 -5.136 -5.788
210 HB2 ARG 31 2HB ARG 31 1.206 -3.917 -4.391
211 HB3 ARG 31 3HB ARG 31 0.610 -5.438 -3.755
212 HG2 ARG 31 2HG ARG 31 0.728 -5.898 -6.539
213 HG3 ARG 31 3HG ARG 31 2.176 -4.948 -6.152
214 HD2 ARG 31 2HD ARG 31 2.714 -6.515 -4.317
215 HD3 ARG 31 3HD ARG 31 1.272 -7.474 -4.737
216 HE ARG 31 HE ARG 31 2.936 -7.165 -7.025
217 HH11 ARG 31 1HH1 ARG 31 4.623 -10.246 -6.639
218 HH12 ARG 31 2HH1 ARG 31 4.260 -8.955 -7.724
219 HH21 ARG 31 1HH2 ARG 31 3.787 -10.193 -4.419
220 HH22 ARG 31 2HH2 ARG 31 2.820 -8.851 -3.925
221 H ARG 32 H ARG 32 -1.457 -6.373 -3.530
222 HA ARG 32 HA ARG 32 -3.052 -4.679 -1.717
223 HB2 ARG 32 2HB ARG 32 -4.281 -6.021 -3.684
224 HB3 ARG 32 3HB ARG 32 -4.033 -7.401 -2.616
225 HG2 ARG 32 2HG ARG 32 -5.549 -4.821 -2.012
226 HG3 ARG 32 3HG ARG 32 -6.226 -6.427 -2.299
227 HD2 ARG 32 2HD ARG 32 -4.579 -6.988 -0.197
228 HD3 ARG 32 3HD ARG 32 -4.906 -5.319 0.152
229 HE ARG 32 HE ARG 32 -7.223 -5.742 0.328
230 HH11 ARG 32 1HH1 ARG 32 -8.752 -8.877 0.804
231 HH12 ARG 32 2HH1 ARG 32 -8.978 -7.169 0.842
232 HH21 ARG 32 1HH2 ARG 32 -6.651 -9.781 0.186
233 HH22 ARG 32 2HH2 ARG 32 -5.334 -8.703 -0.094
234 H LEU 33 H LEU 33 -2.756 -5.366 0.469
235 HA LEU 33 HA LEU 33 -0.853 -7.600 0.835
236 HB2 LEU 33 2HB LEU 33 -1.147 -5.788 3.097
237 HB3 LEU 33 3HB LEU 33 0.322 -6.294 2.254
238 HG LEU 33 HG LEU 33 -1.548 -4.088 1.354
239 HD11 LEU 33 1HD1 LEU 33 1.200 -3.684 2.576
240 HD12 LEU 33 2HD1 LEU 33 -0.138 -2.536 2.326
241 HD13 LEU 33 3HD1 LEU 33 -0.257 -3.766 3.572
242 HD21 LEU 33 1HD2 LEU 33 0.248 -3.411 -0.146
243 HD22 LEU 33 2HD2 LEU 33 1.339 -4.669 0.512
244 HD23 LEU 33 3HD2 LEU 33 -0.038 -5.120 -0.475
245 HA PRO 34 HA PRO 34 -3.700 -9.811 3.207
246 HB2 PRO 34 2HB PRO 34 -2.481 -10.548 5.555
247 HB3 PRO 34 3HB PRO 34 -2.039 -11.222 3.956
248 HG2 PRO 34 2HG PRO 34 -0.625 -9.098 5.548
249 HG3 PRO 34 3HG PRO 34 0.061 -10.404 4.528
250 HD2 PRO 34 2HD PRO 34 -0.303 -7.723 3.826
251 HD3 PRO 34 3HD PRO 34 -0.040 -9.016 2.648
252 H CYS 35 H CYS 35 -2.136 -7.111 4.931
253 HA CYS 35 HA CYS 35 -4.279 -6.769 6.919
254 HB2 CYS 35 2HB CYS 35 -2.815 -5.200 7.771
255 HB3 CYS 35 3HB CYS 35 -1.708 -6.404 7.106
256 H MET 36 H MET 36 -5.070 -6.711 4.086
257 HA MET 36 HA MET 36 -6.202 -5.601 2.580
258 HB2 MET 36 2HB MET 36 -8.353 -4.804 3.370
259 HB3 MET 36 3HB MET 36 -7.883 -6.314 4.150
260 HG2 MET 36 2HG MET 36 -7.242 -5.097 6.190
261 HG3 MET 36 3HG MET 36 -7.619 -3.557 5.414
262 HE1 MET 36 1HE MET 36 -9.300 -2.528 6.932
263 HE2 MET 36 2HE MET 36 -10.515 -3.457 7.840
264 HE3 MET 36 3HE MET 36 -8.781 -3.790 8.075
265 H HIS 37 H HIS 37 -4.115 -4.307 2.419
266 HA HIS 37 HA HIS 37 -5.086 -1.501 2.211
267 HB2 HIS 37 1HB HIS 37 -2.507 -2.538 3.321
268 HB3 HIS 37 2HB HIS 37 -2.420 -1.119 2.280
269 HD2 HIS 37 2HD HIS 37 -4.028 1.012 2.936
270 HE1 HIS 37 1HE HIS 37 -4.426 -0.007 7.046
271 HE2 HIS 37 2HE HIS 37 -4.748 1.847 5.312
272 H LEU 38 H LEU 38 -4.415 -0.321 0.367
273 HA LEU 38 HA LEU 38 -3.808 -2.013 -1.996
274 HB2 LEU 38 2HB LEU 38 -6.222 -0.733 -1.300
275 HB3 LEU 38 3HB LEU 38 -5.481 0.420 -2.386
276 HG LEU 38 HG LEU 38 -5.801 -2.528 -3.060
277 HD11 LEU 38 1HD1 LEU 38 -8.016 -1.486 -2.631
278 HD12 LEU 38 2HD1 LEU 38 -7.627 -0.198 -3.793
279 HD13 LEU 38 3HD1 LEU 38 -7.793 -1.871 -4.348
280 HD21 LEU 38 1HD2 LEU 38 -5.363 -0.072 -4.825
281 HD22 LEU 38 2HD2 LEU 38 -4.114 -1.274 -4.406
282 HD23 LEU 38 3HD2 LEU 38 -5.521 -1.746 -5.380
283 H PHE 39 H PHE 39 -1.721 -1.385 -2.525
284 HA PHE 39 HA PHE 39 -0.962 1.489 -2.153
285 HB2 PHE 39 2HB PHE 39 0.523 -1.046 -1.362
286 HB3 PHE 39 3HB PHE 39 1.303 0.514 -1.472
287 HD1 PHE 39 1HD PHE 39 -1.572 1.722 -0.079
288 HD2 PHE 39 2HD PHE 39 1.612 -1.004 0.922
289 HE1 PHE 39 1HE PHE 39 -2.064 2.013 2.298
290 HE2 PHE 39 2HE PHE 39 1.172 -0.630 3.324
291 HZ PHE 39 HZ PHE 39 -0.719 0.810 4.026
292 H HIS 40 H HIS 40 0.735 2.188 -3.610
293 HA HIS 40 HA HIS 40 0.679 1.146 -6.289
294 HB2 HIS 40 1HB HIS 40 2.583 2.854 -4.700
295 HB3 HIS 40 2HB HIS 40 3.034 2.328 -6.311
296 HD2 HIS 40 2HD HIS 40 0.809 2.911 -8.190
297 HE1 HIS 40 1HE HIS 40 1.144 6.905 -6.782
298 HE2 HIS 40 2HE HIS 40 0.445 5.401 -8.741
299 H GLN 41 H GLN 41 2.223 -0.153 -7.392
300 HA GLN 41 HA GLN 41 3.491 -2.266 -5.967
301 HB2 GLN 41 2HB GLN 41 3.352 -1.272 -8.755
302 HB3 GLN 41 3HB GLN 41 4.852 -2.114 -8.390
303 HG2 GLN 41 2HG GLN 41 3.659 -4.026 -7.490
304 HG3 GLN 41 3HG GLN 41 2.101 -3.190 -7.678
305 HE21 GLN 41 1HE2 GLN 41 0.931 -4.037 -9.366
306 HE22 GLN 41 2HE2 GLN 41 1.676 -4.480 -10.903
307 H VAL 42 H VAL 42 5.027 0.645 -7.493
308 HA VAL 42 HA VAL 42 7.595 -0.050 -6.509
309 HB VAL 42 HB VAL 42 6.498 2.685 -7.287
310 HG11 VAL 42 1HG1 VAL 42 9.367 1.675 -6.992
311 HG12 VAL 42 2HG1 VAL 42 8.905 3.221 -7.742
312 HG13 VAL 42 3HG1 VAL 42 8.593 2.948 -6.022
313 HG21 VAL 42 1HG2 VAL 42 6.309 1.030 -9.117
314 HG22 VAL 42 2HG2 VAL 42 7.619 2.160 -9.463
315 HG23 VAL 42 3HG2 VAL 42 7.995 0.535 -8.860
316 H CYS 43 H CYS 43 5.130 2.182 -5.081
317 HA CYS 43 HA CYS 43 6.713 2.997 -2.832
318 HB2 CYS 43 2HB CYS 43 3.712 2.614 -2.886
319 HB3 CYS 43 3HB CYS 43 4.658 3.659 -1.843
320 H VAL 44 H VAL 44 4.477 0.105 -3.196
321 HA VAL 44 HA VAL 44 4.951 -0.553 -0.476
322 HB VAL 44 HB VAL 44 2.887 -1.102 -1.833
323 HG11 VAL 44 1HG1 VAL 44 4.033 -2.285 -3.696
324 HG12 VAL 44 2HG1 VAL 44 4.586 -3.524 -2.548
325 HG13 VAL 44 3HG1 VAL 44 2.845 -3.310 -2.866
326 HG21 VAL 44 1HG2 VAL 44 3.575 -1.919 0.493
327 HG22 VAL 44 2HG2 VAL 44 2.401 -2.905 -0.407
328 HG23 VAL 44 3HG2 VAL 44 4.098 -3.414 -0.297
329 H ASP 45 H ASP 45 6.672 -1.268 -3.446
330 HA ASP 45 HA ASP 45 8.106 -3.572 -2.531
331 HB2 ASP 45 2HB ASP 45 8.181 -2.773 -4.868
332 HB3 ASP 45 3HB ASP 45 9.023 -1.306 -4.355
333 H GLN 46 H GLN 46 8.994 -0.081 -2.464
334 HA GLN 46 HA GLN 46 11.150 -0.534 -0.626
335 HB2 GLN 46 2HB GLN 46 9.615 2.023 -1.277
336 HB3 GLN 46 3HB GLN 46 11.093 1.950 -0.296
337 HG2 GLN 46 2HG GLN 46 12.292 0.890 -2.214
338 HG3 GLN 46 3HG GLN 46 10.838 1.077 -3.209
339 HE21 GLN 46 1HE2 GLN 46 12.675 2.278 -4.501
340 HE22 GLN 46 2HE2 GLN 46 12.792 3.998 -4.134
341 H ALA 47 H ALA 47 7.714 -0.064 -0.059
342 HA ALA 47 HA ALA 47 7.917 0.523 2.728
343 HB1 ALA 47 1HB ALA 47 5.840 0.633 1.327
344 HB2 ALA 47 2HB ALA 47 5.799 -1.151 1.342
345 HB3 ALA 47 3HB ALA 47 5.629 -0.252 2.860
346 H LEU 48 H LEU 48 7.542 -2.635 1.015
347 HA LEU 48 HA LEU 48 7.592 -4.222 3.337
348 HB2 LEU 48 2HB LEU 48 6.775 -4.782 1.017
349 HB3 LEU 48 3HB LEU 48 8.443 -5.041 0.518
350 HG LEU 48 HG LEU 48 7.195 -6.513 2.883
351 HD11 LEU 48 1HD1 LEU 48 6.642 -8.345 1.327
352 HD12 LEU 48 2HD1 LEU 48 5.762 -6.867 0.908
353 HD13 LEU 48 3HD1 LEU 48 7.184 -7.352 -0.043
354 HD21 LEU 48 1HD2 LEU 48 8.847 -8.289 2.241
355 HD22 LEU 48 2HD2 LEU 48 9.513 -7.201 1.013
356 HD23 LEU 48 3HD2 LEU 48 9.639 -6.797 2.739
357 H ILE 49 H ILE 49 10.286 -3.432 1.027
358 HA ILE 49 HA ILE 49 12.216 -4.897 2.506
359 HB ILE 49 HB ILE 49 13.898 -3.816 1.252
360 HG12 ILE 49 2HG1 ILE 49 12.928 -1.920 -0.427
361 HG13 ILE 49 3HG1 ILE 49 12.032 -1.566 1.060
362 HG21 ILE 49 1HG2 ILE 49 13.218 -4.273 -0.996
363 HG22 ILE 49 2HG2 ILE 49 12.425 -5.438 0.082
364 HG23 ILE 49 3HG2 ILE 49 11.511 -4.079 -0.597
365 HD11 ILE 49 1HD1 ILE 49 14.100 -0.276 1.003
366 HD12 ILE 49 2HD1 ILE 49 14.196 -1.470 2.310
367 HD13 ILE 49 3HD1 ILE 49 15.053 -1.761 0.784
368 H THR 50 H THR 50 10.960 -1.587 3.000
369 HA THR 50 HA THR 50 13.014 -0.861 4.869
370 HB THR 50 HB THR 50 10.197 0.162 4.356
371 HG1 THR 50 1HG THR 50 11.645 0.752 2.841
372 HG21 THR 50 1HG2 THR 50 10.587 0.637 6.716
373 HG22 THR 50 2HG2 THR 50 12.233 1.221 6.358
374 HG23 THR 50 3HG2 THR 50 10.811 2.116 5.773
375 H ASN 51 H ASN 51 9.709 -2.278 5.226
376 HA ASN 51 HA ASN 51 10.560 -3.799 7.484
377 HB2 ASN 51 2HB ASN 51 10.034 -1.361 8.361
378 HB3 ASN 51 3HB ASN 51 8.352 -1.785 8.096
379 HD21 ASN 51 1HD2 ASN 51 9.437 -4.807 9.005
380 HD22 ASN 51 2HD2 ASN 51 9.437 -4.532 10.729
381 H LYS 52 H LYS 52 9.560 -5.679 6.659
382 HA LYS 52 HA LYS 52 7.031 -5.702 5.312
383 HB2 LYS 52 2HB LYS 52 7.153 -8.138 5.671
384 HB3 LYS 52 3HB LYS 52 8.598 -7.458 4.947
385 HG2 LYS 52 2HG LYS 52 9.922 -8.299 6.556
386 HG3 LYS 52 3HG LYS 52 8.964 -7.543 7.847
387 HD2 LYS 52 2HD LYS 52 7.338 -9.335 7.711
388 HD3 LYS 52 3HD LYS 52 8.226 -10.111 6.401
389 HE2 LYS 52 2HE LYS 52 8.915 -11.408 8.087
390 HE3 LYS 52 3HE LYS 52 10.189 -10.176 8.165
391 HZ1 LYS 52 1HZ LYS 52 7.723 -10.320 9.778
392 HZ2 LYS 52 2HZ LYS 52 9.224 -10.659 10.338
393 HZ3 LYS 52 3HZ LYS 52 8.813 -9.104 9.910
394 H LYS 53 H LYS 53 5.779 -4.268 6.656
395 HA LYS 53 HA LYS 53 3.859 -5.831 8.059
396 HB2 LYS 53 2HB LYS 53 3.880 -4.418 10.148
397 HB3 LYS 53 3HB LYS 53 5.207 -5.562 10.025
398 HG2 LYS 53 2HG LYS 53 6.750 -3.946 10.143
399 HG3 LYS 53 3HG LYS 53 6.012 -3.004 8.845
400 HD2 LYS 53 2HD LYS 53 4.396 -2.045 10.450
401 HD3 LYS 53 3HD LYS 53 5.181 -2.950 11.770
402 HE2 LYS 53 2HE LYS 53 7.290 -1.798 11.351
403 HE3 LYS 53 3HE LYS 53 6.622 -1.000 9.919
404 HZ1 LYS 53 1HZ LYS 53 5.751 -0.579 12.703
405 HZ2 LYS 53 2HZ LYS 53 6.648 0.459 11.797
406 HZ3 LYS 53 3HZ LYS 53 5.083 0.149 11.381
407 H CYS 54 H CYS 54 1.892 -4.644 8.201
408 HA CYS 54 HA CYS 54 1.476 -2.335 6.426
409 HB2 CYS 54 2HB CYS 54 -0.092 -4.156 8.087
410 HB3 CYS 54 3HB CYS 54 -0.498 -2.465 8.445
411 HA PRO 55 HA PRO 55 2.512 0.802 9.475
412 HB2 PRO 55 2HB PRO 55 0.879 2.880 8.679
413 HB3 PRO 55 3HB PRO 55 2.364 2.378 7.825
414 HG2 PRO 55 2HG PRO 55 -0.493 1.688 7.123
415 HG3 PRO 55 3HG PRO 55 0.862 2.148 6.049
416 HD2 PRO 55 2HD PRO 55 0.069 -0.455 6.479
417 HD3 PRO 55 3HD PRO 55 1.750 0.005 6.071
418 H ILE 56 H ILE 56 -1.000 1.552 9.046
419 HA ILE 56 HA ILE 56 -1.287 1.148 11.941
420 HB ILE 56 HB ILE 56 -1.974 3.243 11.011
421 HG12 ILE 56 2HG1 ILE 56 -4.583 1.968 11.806
422 HG13 ILE 56 3HG1 ILE 56 -3.221 1.915 12.934
423 HG21 ILE 56 1HG2 ILE 56 -2.671 2.693 8.745
424 HG22 ILE 56 2HG2 ILE 56 -4.017 1.704 9.354
425 HG23 ILE 56 3HG2 ILE 56 -4.017 3.455 9.594
426 HD11 ILE 56 1HD1 ILE 56 -3.013 4.360 12.863
427 HD12 ILE 56 2HD1 ILE 56 -4.360 4.456 11.702
428 HD13 ILE 56 3HD1 ILE 56 -4.646 3.869 13.351
429 H CYS 57 H CYS 57 -0.828 -1.146 11.006
430 HA CYS 57 HA CYS 57 -3.300 -2.636 11.695
431 HB2 CYS 57 2HB CYS 57 -1.691 -3.949 9.565
432 HB3 CYS 57 3HB CYS 57 -3.353 -4.185 10.040
433 H ARG 58 H ARG 58 0.284 -2.563 11.124
434 HA ARG 58 HA ARG 58 1.968 -3.503 12.231
435 HB2 ARG 58 2HB ARG 58 0.463 -2.432 14.185
436 HB3 ARG 58 3HB ARG 58 0.337 -4.124 14.684
437 HG2 ARG 58 2HG ARG 58 2.886 -4.234 14.611
438 HG3 ARG 58 3HG ARG 58 2.879 -2.514 14.201
439 HD2 ARG 58 2HD ARG 58 3.174 -2.354 16.463
440 HD3 ARG 58 3HD ARG 58 1.402 -2.281 16.390
441 HE ARG 58 HE ARG 58 2.146 -4.990 16.618
442 HH11 ARG 58 1HH1 ARG 58 2.484 -5.180 20.139
443 HH12 ARG 58 2HH1 ARG 58 2.405 -6.086 18.673
444 HH21 ARG 58 1HH2 ARG 58 2.400 -2.810 20.065
445 HH22 ARG 58 2HH2 ARG 58 2.229 -2.030 18.533
446 H VAL 59 H VAL 59 0.301 -5.146 10.557
447 HA VAL 59 HA VAL 59 0.728 -7.838 11.746
448 HB VAL 59 HB VAL 59 -1.101 -7.023 9.439
449 HG11 VAL 59 1HG1 VAL 59 -0.798 -9.661 10.950
450 HG12 VAL 59 2HG1 VAL 59 -2.032 -9.314 9.720
451 HG13 VAL 59 3HG1 VAL 59 -0.335 -9.361 9.258
452 HG21 VAL 59 1HG2 VAL 59 -2.061 -6.152 11.494
453 HG22 VAL 59 2HG2 VAL 59 -2.964 -7.589 11.023
454 HG23 VAL 59 3HG2 VAL 59 -1.769 -7.688 12.337
455 H ASP 60 H ASP 60 1.881 -9.303 10.393
456 HA ASP 60 HA ASP 60 3.943 -8.167 8.737
457 HB2 ASP 60 2HB ASP 60 3.923 -10.297 10.208
458 HB3 ASP 60 3HB ASP 60 3.079 -11.081 8.871
459 H ILE 61 H ILE 61 4.178 -8.516 6.446
460 HA ILE 61 HA ILE 61 1.682 -9.170 4.985
461 HB ILE 61 HB ILE 61 2.197 -7.490 3.378
462 HG12 ILE 61 2HG1 ILE 61 4.571 -6.732 5.151
463 HG13 ILE 61 3HG1 ILE 61 4.671 -7.495 3.549
464 HG21 ILE 61 1HG2 ILE 61 0.931 -6.999 5.587
465 HG22 ILE 61 2HG2 ILE 61 2.406 -6.108 6.043
466 HG23 ILE 61 3HG2 ILE 61 1.446 -5.625 4.605
467 HD11 ILE 61 1HD1 ILE 61 3.534 -4.775 4.198
468 HD12 ILE 61 2HD1 ILE 61 4.970 -5.182 3.213
469 HD13 ILE 61 3HD1 ILE 61 3.330 -5.619 2.633
470 H GLU 62 H GLU 62 5.000 -9.862 5.313
471 HA GLU 62 HA GLU 62 5.757 -10.559 2.687
472 HB2 GLU 62 2HB GLU 62 7.312 -10.624 4.558
473 HB3 GLU 62 3HB GLU 62 6.451 -12.010 5.275
474 HG2 GLU 62 2HG GLU 62 6.968 -13.265 3.082
475 HG3 GLU 62 3HG GLU 62 7.992 -11.904 2.648
476 H ALA 63 H ALA 63 5.422 -12.294 1.344
477 HA ALA 63 HA ALA 63 3.837 -14.577 2.352
478 HB1 ALA 63 1HB ALA 63 2.505 -14.567 0.268
479 HB2 ALA 63 2HB ALA 63 2.228 -13.101 1.236
480 HB3 ALA 63 3HB ALA 63 3.260 -13.029 -0.210
481 H GLN 64 H GLN 64 5.861 -15.577 2.482
482 HA GLN 64 HA GLN 64 7.311 -17.134 1.835
483 HB2 GLN 64 2HB GLN 64 5.353 -17.931 0.548
484 HB3 GLN 64 3HB GLN 64 5.946 -17.091 -0.881
485 HG2 GLN 64 2HG GLN 64 7.463 -18.697 -1.341
486 HG3 GLN 64 3HG GLN 64 8.055 -18.749 0.321
487 HE21 GLN 64 1HE2 GLN 64 6.578 -20.687 -2.001
488 HE22 GLN 64 2HE2 GLN 64 5.796 -21.792 -0.875
489 H LEU 65 H LEU 65 8.925 -15.539 2.173
490 HA LEU 65 HA LEU 65 11.081 -15.166 1.769
491 HB2 LEU 65 2HB LEU 65 10.528 -15.559 -1.178
492 HB3 LEU 65 3HB LEU 65 11.797 -14.476 -0.687
493 HG LEU 65 HG LEU 65 12.838 -16.244 0.696
494 HD11 LEU 65 1HD1 LEU 65 10.788 -18.066 -0.640
495 HD12 LEU 65 2HD1 LEU 65 12.189 -18.598 0.318
496 HD13 LEU 65 3HD1 LEU 65 10.878 -17.697 1.098
497 HD21 LEU 65 1HD2 LEU 65 13.589 -15.774 -1.612
498 HD22 LEU 65 2HD2 LEU 65 13.759 -17.487 -1.226
499 HD23 LEU 65 3HD2 LEU 65 12.407 -16.940 -2.243
500 HA PRO 66 HA PRO 66 9.797 -10.919 1.956
501 HB2 PRO 66 2HB PRO 66 12.026 -9.833 3.141
502 HB3 PRO 66 3HB PRO 66 10.823 -10.823 4.015
503 HG2 PRO 66 2HG PRO 66 13.505 -11.687 2.920
504 HG3 PRO 66 3HG PRO 66 12.752 -12.095 4.492
505 HD2 PRO 66 2HD PRO 66 12.697 -13.765 2.299
506 HD3 PRO 66 3HD PRO 66 11.406 -13.735 3.535
507 H SER 67 H SER 67 13.163 -11.624 0.845
508 HA SER 67 HA SER 67 12.703 -10.577 -1.728
509 HB2 SER 67 2HB SER 67 12.896 -8.387 -0.458
510 HB3 SER 67 3HB SER 67 14.539 -8.865 0.013
511 HG SER 67 HG SER 67 14.302 -7.528 -1.939
512 H GLU 68 H GLU 68 15.124 -10.352 -2.749
513 HA GLU 68 HA GLU 68 17.086 -12.004 -1.375
514 HB2 GLU 68 2HB GLU 68 15.474 -13.499 -2.884
515 HB3 GLU 68 3HB GLU 68 16.467 -12.875 -4.207
516 HG2 GLU 68 2HG GLU 68 18.512 -13.662 -2.970
517 HG3 GLU 68 3HG GLU 68 17.466 -14.299 -1.697
518 H SER 69 H SER 69 18.708 -10.436 -1.414
519 HA SER 69 HA SER 69 19.797 -9.467 -3.838
520 HB2 SER 69 2HB SER 69 17.751 -7.986 -3.695
521 HB3 SER 69 3HB SER 69 18.314 -7.441 -2.100
522 HG SER 69 HG SER 69 20.323 -6.909 -3.273
Start of MODEL 20
1 H1 MET 1 H1 MET 1 -28.944 37.823 3.635
2 H2 MET 1 H2 MET 1 -30.275 38.599 4.244
3 H3 MET 1 H3 MET 1 -30.149 38.281 2.627
4 HA MET 1 HA MET 1 -29.749 40.572 2.996
5 HB2 MET 1 2HB MET 1 -28.055 39.546 5.186
6 HB3 MET 1 3HB MET 1 -27.234 40.738 4.165
7 HG2 MET 1 2HG MET 1 -29.205 42.235 4.341
8 HG3 MET 1 3HG MET 1 -29.896 41.138 5.548
9 HE1 MET 1 1HE MET 1 -29.045 44.363 5.612
10 HE2 MET 1 2HE MET 1 -29.983 43.604 6.921
11 HE3 MET 1 3HE MET 1 -28.501 44.515 7.296
12 H LYS 2 H LYS 2 -26.505 38.993 3.043
13 HA LYS 2 HA LYS 2 -26.159 39.606 0.220
14 HB2 LYS 2 2HB LYS 2 -24.173 38.141 0.389
15 HB3 LYS 2 3HB LYS 2 -24.137 39.475 1.524
16 HG2 LYS 2 2HG LYS 2 -25.046 36.683 2.343
17 HG3 LYS 2 3HG LYS 2 -23.353 37.155 2.285
18 HD2 LYS 2 2HD LYS 2 -24.580 39.207 3.801
19 HD3 LYS 2 3HD LYS 2 -25.333 37.695 4.342
20 HE2 LYS 2 2HE LYS 2 -23.400 38.082 5.711
21 HE3 LYS 2 3HE LYS 2 -23.051 36.710 4.643
22 HZ1 LYS 2 1HZ LYS 2 -21.806 38.191 3.230
23 HZ2 LYS 2 2HZ LYS 2 -22.158 39.491 4.183
24 HZ3 LYS 2 3HZ LYS 2 -21.218 38.272 4.761
25 H GLN 3 H GLN 3 -25.845 37.789 -1.365
26 HA GLN 3 HA GLN 3 -27.731 35.548 -0.872
27 HB2 GLN 3 2HB GLN 3 -28.277 37.194 -2.826
28 HB3 GLN 3 3HB GLN 3 -26.787 36.600 -3.572
29 HG2 GLN 3 2HG GLN 3 -27.927 34.208 -3.007
30 HG3 GLN 3 3HG GLN 3 -29.395 35.183 -3.067
31 HE21 GLN 3 1HE2 GLN 3 -27.174 33.375 -4.934
32 HE22 GLN 3 2HE2 GLN 3 -27.644 34.024 -6.498
33 H ASP 4 H ASP 4 -26.673 33.522 -0.992
34 HA ASP 4 HA ASP 4 -23.935 33.381 -2.055
35 HB2 ASP 4 2HB ASP 4 -24.797 32.732 0.797
36 HB3 ASP 4 3HB ASP 4 -23.382 31.997 0.037
37 H GLY 5 H GLY 5 -23.419 31.046 -2.433
38 HA2 GLY 5 2HA GLY 5 -25.174 28.898 -2.066
39 HA3 GLY 5 3HA GLY 5 -25.674 29.700 -3.570
40 H GLU 6 H GLU 6 -23.123 27.831 -1.973
41 HA GLU 6 HA GLU 6 -21.859 27.364 -4.592
42 HB2 GLU 6 2HB GLU 6 -20.419 28.105 -2.002
43 HB3 GLU 6 3HB GLU 6 -19.640 27.399 -3.428
44 HG2 GLU 6 2HG GLU 6 -20.443 29.356 -4.784
45 HG3 GLU 6 3HG GLU 6 -21.047 30.103 -3.294
46 H GLU 7 H GLU 7 -21.249 25.152 -4.790
47 HA GLU 7 HA GLU 7 -21.021 23.486 -2.510
48 HB2 GLU 7 2HB GLU 7 -22.747 21.874 -3.232
49 HB3 GLU 7 3HB GLU 7 -23.443 23.397 -2.681
50 HG2 GLU 7 2HG GLU 7 -23.707 24.102 -5.090
51 HG3 GLU 7 3HG GLU 7 -23.121 22.505 -5.579
52 H GLY 8 H GLY 8 -19.592 21.946 -3.112
53 HA2 GLY 8 2HA GLY 8 -19.130 21.252 -5.936
54 HA3 GLY 8 3HA GLY 8 -17.769 21.977 -5.038
55 H THR 9 H THR 9 -17.997 19.145 -6.067
56 HA THR 9 HA THR 9 -17.497 17.770 -3.537
57 HB THR 9 HB THR 9 -18.933 15.833 -4.368
58 HG1 THR 9 1HG THR 9 -20.049 17.917 -5.939
59 HG21 THR 9 1HG2 THR 9 -20.999 16.662 -3.410
60 HG22 THR 9 2HG2 THR 9 -19.637 17.317 -2.478
61 HG23 THR 9 3HG2 THR 9 -20.503 18.346 -3.642
62 H GLU 10 H GLU 10 -15.865 16.226 -3.837
63 HA GLU 10 HA GLU 10 -15.066 15.466 -6.551
64 HB2 GLU 10 2HB GLU 10 -13.756 17.546 -4.931
65 HB3 GLU 10 3HB GLU 10 -12.651 16.217 -5.290
66 HG2 GLU 10 2HG GLU 10 -12.827 16.499 -7.615
67 HG3 GLU 10 3HG GLU 10 -14.352 17.374 -7.510
68 H GLU 11 H GLU 11 -15.263 13.291 -6.230
69 HA GLU 11 HA GLU 11 -14.832 12.180 -3.550
70 HB2 GLU 11 2HB GLU 11 -16.257 11.406 -6.046
71 HB3 GLU 11 3HB GLU 11 -15.524 10.061 -5.149
72 HG2 GLU 11 2HG GLU 11 -16.674 10.575 -3.146
73 HG3 GLU 11 3HG GLU 11 -17.140 12.183 -3.707
74 H ASP 12 H ASP 12 -12.737 12.073 -3.117
75 HA ASP 12 HA ASP 12 -10.921 10.682 -5.038
76 HB2 ASP 12 2HB ASP 12 -11.087 13.323 -4.863
77 HB3 ASP 12 3HB ASP 12 -10.198 13.122 -3.357
78 H THR 13 H THR 13 -12.114 9.304 -3.003
79 HA THR 13 HA THR 13 -9.873 8.697 -1.179
80 HB THR 13 HB THR 13 -12.622 9.562 -0.187
81 HG1 THR 13 1HG THR 13 -11.196 11.224 -0.735
82 HG21 THR 13 1HG2 THR 13 -11.474 9.476 2.102
83 HG22 THR 13 2HG2 THR 13 -11.951 7.921 1.426
84 HG23 THR 13 3HG2 THR 13 -10.250 8.425 1.352
85 H GLU 14 H GLU 14 -11.928 7.361 -3.351
86 HA GLU 14 HA GLU 14 -12.703 5.006 -1.827
87 HB2 GLU 14 2HB GLU 14 -12.527 5.700 -4.778
88 HB3 GLU 14 3HB GLU 14 -12.838 4.040 -4.215
89 HG2 GLU 14 2HG GLU 14 -14.726 5.032 -2.768
90 HG3 GLU 14 3HG GLU 14 -14.548 6.507 -3.724
91 H GLU 15 H GLU 15 -9.998 5.804 -4.096
92 HA GLU 15 HA GLU 15 -8.517 3.520 -2.903
93 HB2 GLU 15 2HB GLU 15 -7.666 3.075 -5.228
94 HB3 GLU 15 3HB GLU 15 -9.330 2.626 -4.884
95 HG2 GLU 15 2HG GLU 15 -10.218 4.453 -6.129
96 HG3 GLU 15 3HG GLU 15 -8.651 5.257 -6.231
97 H LYS 16 H LYS 16 -6.973 4.485 -1.728
98 HA LYS 16 HA LYS 16 -5.080 6.181 -3.201
99 HB2 LYS 16 2HB LYS 16 -4.902 7.698 -1.139
100 HB3 LYS 16 3HB LYS 16 -6.277 7.929 -2.228
101 HG2 LYS 16 2HG LYS 16 -7.780 6.798 -0.810
102 HG3 LYS 16 3HG LYS 16 -6.469 6.277 0.267
103 HD2 LYS 16 2HD LYS 16 -7.816 8.153 1.195
104 HD3 LYS 16 3HD LYS 16 -6.109 8.601 0.991
105 HE2 LYS 16 2HE LYS 16 -6.525 9.961 -0.845
106 HE3 LYS 16 3HE LYS 16 -8.002 9.118 -1.297
107 HZ1 LYS 16 1HZ LYS 16 -8.611 11.170 -0.512
108 HZ2 LYS 16 2HZ LYS 16 -9.055 10.170 0.664
109 HZ3 LYS 16 3HZ LYS 16 -7.691 11.093 0.864
110 H CYS 17 H CYS 17 -3.069 5.884 -2.718
111 HA CYS 17 HA CYS 17 -1.903 3.612 -1.310
112 HB2 CYS 17 2HB CYS 17 -1.010 4.932 -3.297
113 HB3 CYS 17 3HB CYS 17 -0.856 6.307 -2.231
114 H THR 18 H THR 18 -1.504 3.507 0.878
115 HA THR 18 HA THR 18 -1.988 5.912 2.488
116 HB THR 18 HB THR 18 -2.724 3.477 2.987
117 HG1 THR 18 1HG THR 18 -2.758 4.064 5.152
118 HG21 THR 18 1HG2 THR 18 -1.249 2.247 4.453
119 HG22 THR 18 2HG2 THR 18 -0.357 2.572 2.937
120 HG23 THR 18 3HG2 THR 18 -0.025 3.522 4.399
121 H ILE 19 H ILE 19 0.802 4.339 1.038
122 HA ILE 19 HA ILE 19 2.663 5.120 3.094
123 HB ILE 19 HB ILE 19 2.835 3.983 0.298
124 HG12 ILE 19 2HG1 ILE 19 3.879 2.701 2.827
125 HG13 ILE 19 3HG1 ILE 19 2.132 2.716 2.565
126 HG21 ILE 19 1HG2 ILE 19 5.065 4.809 2.184
127 HG22 ILE 19 2HG2 ILE 19 5.303 3.642 0.865
128 HG23 ILE 19 3HG2 ILE 19 4.814 5.309 0.496
129 HD11 ILE 19 1HD1 ILE 19 3.199 0.667 1.682
130 HD12 ILE 19 2HD1 ILE 19 2.345 1.610 0.438
131 HD13 ILE 19 3HD1 ILE 19 4.123 1.656 0.532
132 H CYS 20 H CYS 20 1.873 6.284 -0.238
133 HA CYS 20 HA CYS 20 3.487 8.795 0.196
134 HB2 CYS 20 2HB CYS 20 3.030 9.153 -2.154
135 HB3 CYS 20 3HB CYS 20 3.852 7.609 -1.888
136 H LEU 21 H LEU 21 0.417 7.710 1.006
137 HA LEU 21 HA LEU 21 -1.660 8.623 1.113
138 HB2 LEU 21 2HB LEU 21 0.052 10.923 2.068
139 HB3 LEU 21 3HB LEU 21 -1.698 10.819 2.307
140 HG LEU 21 HG LEU 21 0.233 8.674 3.268
141 HD11 LEU 21 1HD1 LEU 21 0.758 10.765 4.396
142 HD12 LEU 21 2HD1 LEU 21 -0.958 10.995 4.821
143 HD13 LEU 21 3HD1 LEU 21 -0.035 9.634 5.509
144 HD21 LEU 21 1HD2 LEU 21 -2.190 7.997 3.004
145 HD22 LEU 21 2HD2 LEU 21 -1.630 7.946 4.670
146 HD23 LEU 21 3HD2 LEU 21 -2.638 9.303 4.113
147 H SER 22 H SER 22 -1.141 8.445 -1.417
148 HA SER 22 HA SER 22 -2.307 10.923 -2.579
149 HB2 SER 22 2HB SER 22 0.063 10.834 -3.245
150 HB3 SER 22 3HB SER 22 -0.144 9.165 -3.815
151 HG SER 22 HG SER 22 -1.521 9.891 -5.429
152 H ILE 23 H ILE 23 -3.931 10.479 -4.168
153 HA ILE 23 HA ILE 23 -5.291 8.035 -4.036
154 HB ILE 23 HB ILE 23 -5.335 10.563 -5.740
155 HG12 ILE 23 2HG1 ILE 23 -7.377 10.952 -4.525
156 HG13 ILE 23 3HG1 ILE 23 -7.259 9.418 -3.682
157 HG21 ILE 23 1HG2 ILE 23 -7.598 9.790 -6.523
158 HG22 ILE 23 2HG2 ILE 23 -6.245 8.928 -7.224
159 HG23 ILE 23 3HG2 ILE 23 -7.199 8.157 -5.941
160 HD11 ILE 23 1HD1 ILE 23 -6.703 11.460 -2.342
161 HD12 ILE 23 2HD1 ILE 23 -5.409 10.250 -2.385
162 HD13 ILE 23 3HD1 ILE 23 -5.304 11.725 -3.393
163 H LEU 24 H LEU 24 -5.615 6.681 -5.767
164 HA LEU 24 HA LEU 24 -3.224 6.068 -7.431
165 HB2 LEU 24 2HB LEU 24 -5.699 4.473 -6.618
166 HB3 LEU 24 3HB LEU 24 -4.303 3.795 -7.462
167 HG LEU 24 HG LEU 24 -4.015 5.111 -4.721
168 HD11 LEU 24 1HD1 LEU 24 -4.539 2.240 -5.443
169 HD12 LEU 24 2HD1 LEU 24 -4.078 2.842 -3.818
170 HD13 LEU 24 3HD1 LEU 24 -5.612 3.344 -4.549
171 HD21 LEU 24 1HD2 LEU 24 -2.028 3.552 -4.710
172 HD22 LEU 24 2HD2 LEU 24 -2.329 3.272 -6.430
173 HD23 LEU 24 3HD2 LEU 24 -1.941 4.925 -5.862
174 H GLU 25 H GLU 25 -4.924 4.395 -9.232
175 HA GLU 25 HA GLU 25 -7.087 5.901 -10.134
176 HB2 GLU 25 2HB GLU 25 -6.430 6.435 -12.394
177 HB3 GLU 25 3HB GLU 25 -5.323 7.222 -11.269
178 HG2 GLU 25 2HG GLU 25 -3.582 5.592 -11.736
179 HG3 GLU 25 3HG GLU 25 -4.688 4.634 -12.739
180 H GLU 26 H GLU 26 -7.959 4.780 -12.263
181 HA GLU 26 HA GLU 26 -8.272 2.024 -11.674
182 HB2 GLU 26 2HB GLU 26 -9.997 3.386 -12.764
183 HB3 GLU 26 3HB GLU 26 -8.960 3.626 -14.179
184 HG2 GLU 26 2HG GLU 26 -9.023 1.201 -14.663
185 HG3 GLU 26 3HG GLU 26 -9.919 0.910 -13.169
186 H GLY 27 H GLY 27 -6.441 0.790 -11.738
187 HA2 GLY 27 2HA GLY 27 -5.227 -0.793 -13.070
188 HA3 GLY 27 3HA GLY 27 -5.262 0.326 -14.439
189 H GLU 28 H GLU 28 -4.504 1.842 -11.403
190 HA GLU 28 HA GLU 28 -1.830 2.504 -12.024
191 HB2 GLU 28 2HB GLU 28 -3.306 3.718 -10.499
192 HB3 GLU 28 3HB GLU 28 -3.417 2.314 -9.436
193 HG2 GLU 28 2HG GLU 28 -2.010 4.104 -8.537
194 HG3 GLU 28 3HG GLU 28 -1.152 2.578 -8.711
195 H ASP 29 H ASP 29 0.049 1.809 -10.726
196 HA ASP 29 HA ASP 29 0.249 -1.132 -10.732
197 HB2 ASP 29 2HB ASP 29 2.209 1.073 -10.032
198 HB3 ASP 29 3HB ASP 29 2.568 -0.643 -9.918
199 H VAL 30 H VAL 30 -0.689 -2.120 -8.961
200 HA VAL 30 HA VAL 30 -0.154 -0.980 -6.300
201 HB VAL 30 HB VAL 30 -2.536 -1.265 -5.655
202 HG11 VAL 30 1HG1 VAL 30 -1.698 0.934 -6.382
203 HG12 VAL 30 2HG1 VAL 30 -2.202 0.567 -8.047
204 HG13 VAL 30 3HG1 VAL 30 -3.413 0.701 -6.776
205 HG21 VAL 30 1HG2 VAL 30 -3.242 -2.952 -7.326
206 HG22 VAL 30 2HG2 VAL 30 -4.278 -1.515 -7.364
207 HG23 VAL 30 3HG2 VAL 30 -3.054 -1.747 -8.620
208 H ARG 31 H ARG 31 -0.489 -2.565 -4.561
209 HA ARG 31 HA ARG 31 -0.417 -5.352 -5.526
210 HB2 ARG 31 2HB ARG 31 1.350 -4.222 -3.348
211 HB3 ARG 31 3HB ARG 31 1.221 -5.924 -3.801
212 HG2 ARG 31 2HG ARG 31 1.881 -5.170 -6.195
213 HG3 ARG 31 3HG ARG 31 2.363 -3.650 -5.419
214 HD2 ARG 31 2HD ARG 31 4.346 -4.876 -5.333
215 HD3 ARG 31 3HD ARG 31 3.623 -5.202 -3.739
216 HE ARG 31 HE ARG 31 2.724 -7.184 -5.526
217 HH11 ARG 31 1HH1 ARG 31 5.285 -9.542 -5.021
218 HH12 ARG 31 2HH1 ARG 31 3.701 -9.284 -5.648
219 HH21 ARG 31 1HH2 ARG 31 6.493 -7.736 -4.073
220 HH22 ARG 31 2HH2 ARG 31 5.754 -6.179 -4.001
221 H ARG 32 H ARG 32 -0.812 -6.815 -3.568
222 HA ARG 32 HA ARG 32 -2.788 -5.616 -1.716
223 HB2 ARG 32 2HB ARG 32 -3.947 -7.119 -3.253
224 HB3 ARG 32 3HB ARG 32 -2.657 -8.321 -3.142
225 HG2 ARG 32 2HG ARG 32 -4.574 -9.100 -1.876
226 HG3 ARG 32 3HG ARG 32 -3.242 -8.774 -0.779
227 HD2 ARG 32 2HD ARG 32 -4.953 -7.727 0.353
228 HD3 ARG 32 3HD ARG 32 -4.334 -6.384 -0.578
229 HE ARG 32 HE ARG 32 -6.452 -7.937 -1.893
230 HH11 ARG 32 1HH1 ARG 32 -8.876 -5.413 -1.434
231 HH12 ARG 32 2HH1 ARG 32 -8.574 -6.960 -2.138
232 HH21 ARG 32 1HH2 ARG 32 -7.247 -4.433 0.022
233 HH22 ARG 32 2HH2 ARG 32 -5.634 -5.032 -0.116
234 H LEU 33 H LEU 33 -2.526 -6.274 0.489
235 HA LEU 33 HA LEU 33 -0.309 -8.071 1.114
236 HB2 LEU 33 2HB LEU 33 -0.259 -6.394 3.231
237 HB3 LEU 33 3HB LEU 33 0.773 -6.151 1.832
238 HG LEU 33 HG LEU 33 -1.964 -4.865 1.912
239 HD11 LEU 33 1HD1 LEU 33 -0.950 -2.938 3.097
240 HD12 LEU 33 2HD1 LEU 33 -0.983 -4.384 4.117
241 HD13 LEU 33 3HD1 LEU 33 0.534 -3.869 3.355
242 HD21 LEU 33 1HD2 LEU 33 -0.295 -4.692 -0.103
243 HD22 LEU 33 2HD2 LEU 33 -0.921 -3.174 0.552
244 HD23 LEU 33 3HD2 LEU 33 0.713 -3.733 0.975
245 HA PRO 34 HA PRO 34 -3.128 -10.386 3.135
246 HB2 PRO 34 2HB PRO 34 -2.088 -11.064 5.623
247 HB3 PRO 34 3HB PRO 34 -1.539 -11.722 4.053
248 HG2 PRO 34 2HG PRO 34 -0.295 -9.528 5.702
249 HG3 PRO 34 3HG PRO 34 0.507 -10.821 4.755
250 HD2 PRO 34 2HD PRO 34 0.206 -8.230 3.938
251 HD3 PRO 34 3HD PRO 34 0.355 -9.555 2.791
252 H CYS 35 H CYS 35 -2.182 -7.615 5.011
253 HA CYS 35 HA CYS 35 -4.468 -7.295 6.805
254 HB2 CYS 35 2HB CYS 35 -2.131 -6.374 6.979
255 HB3 CYS 35 3HB CYS 35 -2.509 -5.365 5.573
256 H MET 36 H MET 36 -5.020 -7.788 3.685
257 HA MET 36 HA MET 36 -6.442 -7.034 2.106
258 HB2 MET 36 2HB MET 36 -7.905 -6.264 4.644
259 HB3 MET 36 3HB MET 36 -8.657 -6.216 3.054
260 HG2 MET 36 2HG MET 36 -7.310 -8.793 3.612
261 HG3 MET 36 3HG MET 36 -8.589 -8.384 4.748
262 HE1 MET 36 1HE MET 36 -7.828 -9.985 1.338
263 HE2 MET 36 2HE MET 36 -9.160 -9.436 0.299
264 HE3 MET 36 3HE MET 36 -7.915 -8.279 0.823
265 H HIS 37 H HIS 37 -4.332 -5.082 2.836
266 HA HIS 37 HA HIS 37 -5.722 -2.520 2.260
267 HB2 HIS 37 1HB HIS 37 -3.217 -3.312 3.642
268 HB3 HIS 37 2HB HIS 37 -3.037 -1.937 2.558
269 HD2 HIS 37 2HD HIS 37 -5.523 -0.209 2.961
270 HE1 HIS 37 1HE HIS 37 -4.818 -0.384 7.159
271 HE2 HIS 37 2HE HIS 37 -6.048 0.863 5.289
272 H LEU 38 H LEU 38 -4.829 -1.119 0.517
273 HA LEU 38 HA LEU 38 -3.774 -2.696 -1.775
274 HB2 LEU 38 2HB LEU 38 -6.224 -2.285 -1.906
275 HB3 LEU 38 3HB LEU 38 -5.969 -0.556 -1.757
276 HG LEU 38 HG LEU 38 -4.488 -2.005 -3.945
277 HD11 LEU 38 1HD1 LEU 38 -6.454 -1.922 -5.432
278 HD12 LEU 38 2HD1 LEU 38 -6.747 -3.009 -4.065
279 HD13 LEU 38 3HD1 LEU 38 -7.471 -1.379 -4.085
280 HD21 LEU 38 1HD2 LEU 38 -6.024 0.644 -3.846
281 HD22 LEU 38 2HD2 LEU 38 -4.258 0.454 -3.719
282 HD23 LEU 38 3HD2 LEU 38 -5.097 0.032 -5.221
283 H PHE 39 H PHE 39 -1.778 -1.860 -2.179
284 HA PHE 39 HA PHE 39 -1.255 1.023 -1.532
285 HB2 PHE 39 2HB PHE 39 0.458 -1.457 -1.073
286 HB3 PHE 39 3HB PHE 39 1.093 0.168 -1.008
287 HD1 PHE 39 1HD PHE 39 1.762 -1.286 1.178
288 HD2 PHE 39 2HD PHE 39 -2.028 0.646 0.542
289 HE1 PHE 39 1HE PHE 39 1.392 -1.204 3.614
290 HE2 PHE 39 2HE PHE 39 -2.444 0.637 2.952
291 HZ PHE 39 HZ PHE 39 -0.739 -0.254 4.516
292 H HIS 40 H HIS 40 0.781 1.761 -2.781
293 HA HIS 40 HA HIS 40 0.558 1.090 -5.626
294 HB2 HIS 40 1HB HIS 40 2.204 2.838 -3.877
295 HB3 HIS 40 2HB HIS 40 3.019 2.302 -5.331
296 HD2 HIS 40 2HD HIS 40 1.089 2.766 -7.669
297 HE1 HIS 40 1HE HIS 40 1.023 6.757 -6.214
298 HE2 HIS 40 2HE HIS 40 0.650 5.208 -8.267
299 H GLN 41 H GLN 41 2.374 0.201 -6.873
300 HA GLN 41 HA GLN 41 3.715 -2.037 -5.648
301 HB2 GLN 41 2HB GLN 41 2.961 -1.986 -7.995
302 HB3 GLN 41 3HB GLN 41 4.147 -0.718 -8.359
303 HG2 GLN 41 2HG GLN 41 5.921 -2.170 -8.345
304 HG3 GLN 41 3HG GLN 41 5.257 -3.157 -7.040
305 HE21 GLN 41 1HE2 GLN 41 3.267 -4.553 -7.649
306 HE22 GLN 41 2HE2 GLN 41 3.334 -5.249 -9.262
307 H VAL 42 H VAL 42 5.077 1.030 -7.100
308 HA VAL 42 HA VAL 42 7.681 0.437 -6.157
309 HB VAL 42 HB VAL 42 6.438 3.132 -6.843
310 HG11 VAL 42 1HG1 VAL 42 8.811 3.836 -7.246
311 HG12 VAL 42 2HG1 VAL 42 8.493 3.499 -5.540
312 HG13 VAL 42 3HG1 VAL 42 9.363 2.307 -6.528
313 HG21 VAL 42 1HG2 VAL 42 6.399 1.506 -8.720
314 HG22 VAL 42 2HG2 VAL 42 7.607 2.760 -9.015
315 HG23 VAL 42 3HG2 VAL 42 8.121 1.157 -8.458
316 H CYS 43 H CYS 43 5.125 2.482 -4.616
317 HA CYS 43 HA CYS 43 6.589 3.240 -2.289
318 HB2 CYS 43 2HB CYS 43 3.661 2.489 -2.383
319 HB3 CYS 43 3HB CYS 43 4.482 3.535 -1.243
320 H VAL 44 H VAL 44 4.555 0.192 -2.802
321 HA VAL 44 HA VAL 44 5.234 -0.566 -0.150
322 HB VAL 44 HB VAL 44 3.111 -1.115 -1.417
323 HG11 VAL 44 1HG1 VAL 44 4.365 -2.206 -3.364
324 HG12 VAL 44 2HG1 VAL 44 4.755 -3.537 -2.264
325 HG13 VAL 44 3HG1 VAL 44 3.055 -3.156 -2.643
326 HG21 VAL 44 1HG2 VAL 44 4.533 -3.366 0.030
327 HG22 VAL 44 2HG2 VAL 44 3.813 -1.961 0.824
328 HG23 VAL 44 3HG2 VAL 44 2.781 -3.094 -0.095
329 H ASP 45 H ASP 45 6.861 -1.000 -3.175
330 HA ASP 45 HA ASP 45 8.409 -3.339 -2.533
331 HB2 ASP 45 2HB ASP 45 8.423 -2.476 -4.792
332 HB3 ASP 45 3HB ASP 45 9.025 -0.904 -4.256
333 H GLN 46 H GLN 46 9.300 0.134 -2.311
334 HA GLN 46 HA GLN 46 11.472 -0.278 -0.519
335 HB2 GLN 46 2HB GLN 46 9.680 2.060 -1.263
336 HB3 GLN 46 3HB GLN 46 10.803 2.260 0.080
337 HG2 GLN 46 2HG GLN 46 11.891 1.133 -2.503
338 HG3 GLN 46 3HG GLN 46 11.497 2.857 -2.426
339 HE21 GLN 46 1HE2 GLN 46 13.557 3.842 -2.286
340 HE22 GLN 46 2HE2 GLN 46 14.664 3.445 -0.977
341 H ALA 47 H ALA 47 8.013 0.012 0.202
342 HA ALA 47 HA ALA 47 8.351 0.356 3.009
343 HB1 ALA 47 1HB ALA 47 6.159 -1.190 1.589
344 HB2 ALA 47 2HB ALA 47 6.061 -0.408 3.181
345 HB3 ALA 47 3HB ALA 47 6.226 0.587 1.710
346 H LEU 48 H LEU 48 7.682 -2.680 1.223
347 HA LEU 48 HA LEU 48 7.923 -4.486 3.326
348 HB2 LEU 48 2HB LEU 48 6.829 -4.973 1.227
349 HB3 LEU 48 3HB LEU 48 8.316 -4.757 0.315
350 HG LEU 48 HG LEU 48 8.509 -6.810 2.463
351 HD11 LEU 48 1HD1 LEU 48 7.252 -8.515 1.182
352 HD12 LEU 48 2HD1 LEU 48 6.195 -7.237 1.786
353 HD13 LEU 48 3HD1 LEU 48 6.669 -7.250 0.075
354 HD21 LEU 48 1HD2 LEU 48 9.593 -8.083 0.645
355 HD22 LEU 48 2HD2 LEU 48 9.074 -6.870 -0.542
356 HD23 LEU 48 3HD2 LEU 48 10.262 -6.444 0.702
357 H ILE 49 H ILE 49 10.465 -3.475 0.934
358 HA ILE 49 HA ILE 49 12.443 -5.160 2.124
359 HB ILE 49 HB ILE 49 14.061 -3.993 0.839
360 HG12 ILE 49 2HG1 ILE 49 13.007 -1.998 -0.647
361 HG13 ILE 49 3HG1 ILE 49 12.240 -1.722 0.926
362 HG21 ILE 49 1HG2 ILE 49 13.205 -4.283 -1.393
363 HG22 ILE 49 2HG2 ILE 49 12.580 -5.557 -0.336
364 HG23 ILE 49 3HG2 ILE 49 11.537 -4.206 -0.823
365 HD11 ILE 49 1HD1 ILE 49 14.502 -1.791 2.010
366 HD12 ILE 49 2HD1 ILE 49 15.228 -2.002 0.403
367 HD13 ILE 49 3HD1 ILE 49 14.368 -0.507 0.803
368 H THR 50 H THR 50 11.333 -1.838 2.904
369 HA THR 50 HA THR 50 13.505 -1.327 4.693
370 HB THR 50 HB THR 50 10.750 -0.105 4.349
371 HG1 THR 50 1HG THR 50 12.240 0.471 2.832
372 HG21 THR 50 1HG2 THR 50 12.888 0.702 6.355
373 HG22 THR 50 2HG2 THR 50 11.518 1.717 5.854
374 HG23 THR 50 3HG2 THR 50 11.214 0.204 6.719
375 H ASN 51 H ASN 51 10.278 -2.841 5.107
376 HA ASN 51 HA ASN 51 11.129 -4.560 7.155
377 HB2 ASN 51 2HB ASN 51 10.069 -1.948 8.116
378 HB3 ASN 51 3HB ASN 51 9.114 -3.326 8.644
379 HD21 ASN 51 1HD2 ASN 51 12.413 -2.003 8.825
380 HD22 ASN 51 2HD2 ASN 51 12.778 -2.868 10.310
381 H LYS 52 H LYS 52 9.624 -6.270 7.075
382 HA LYS 52 HA LYS 52 7.289 -5.996 5.312
383 HB2 LYS 52 2HB LYS 52 8.149 -8.363 7.026
384 HB3 LYS 52 3HB LYS 52 7.056 -8.372 5.653
385 HG2 LYS 52 2HG LYS 52 8.776 -8.902 4.331
386 HG3 LYS 52 3HG LYS 52 9.482 -7.311 4.613
387 HD2 LYS 52 2HD LYS 52 10.744 -8.192 6.558
388 HD3 LYS 52 3HD LYS 52 9.882 -9.727 6.424
389 HE2 LYS 52 2HE LYS 52 11.823 -10.324 5.426
390 HE3 LYS 52 3HE LYS 52 10.880 -9.870 4.026
391 HZ1 LYS 52 1HZ LYS 52 12.096 -7.730 4.021
392 HZ2 LYS 52 2HZ LYS 52 12.931 -8.171 5.375
393 HZ3 LYS 52 3HZ LYS 52 13.186 -8.985 4.073
394 H LYS 53 H LYS 53 6.483 -4.192 6.980
395 HA LYS 53 HA LYS 53 4.338 -5.632 8.367
396 HB2 LYS 53 2HB LYS 53 4.428 -4.670 10.412
397 HB3 LYS 53 3HB LYS 53 6.138 -4.912 10.111
398 HG2 LYS 53 2HG LYS 53 4.643 -2.260 9.748
399 HG3 LYS 53 3HG LYS 53 5.532 -2.719 11.185
400 HD2 LYS 53 2HD LYS 53 7.604 -2.536 10.213
401 HD3 LYS 53 3HD LYS 53 7.006 -2.827 8.574
402 HE2 LYS 53 2HE LYS 53 6.331 -0.291 10.087
403 HE3 LYS 53 3HE LYS 53 7.792 -0.468 9.099
404 HZ1 LYS 53 1HZ LYS 53 6.285 -1.147 7.258
405 HZ2 LYS 53 2HZ LYS 53 5.017 -0.721 8.142
406 HZ3 LYS 53 3HZ LYS 53 6.129 0.438 7.709
407 H CYS 54 H CYS 54 2.383 -4.688 8.025
408 HA CYS 54 HA CYS 54 2.090 -2.479 6.088
409 HB2 CYS 54 2HB CYS 54 0.455 -4.260 6.195
410 HB3 CYS 54 3HB CYS 54 0.195 -3.991 7.912
411 HA PRO 55 HA PRO 55 3.110 0.520 9.127
412 HB2 PRO 55 2HB PRO 55 1.995 2.820 8.045
413 HB3 PRO 55 3HB PRO 55 3.484 2.026 7.448
414 HG2 PRO 55 2HG PRO 55 0.662 1.720 6.389
415 HG3 PRO 55 3HG PRO 55 2.173 2.000 5.463
416 HD2 PRO 55 2HD PRO 55 1.137 -0.480 5.735
417 HD3 PRO 55 3HD PRO 55 2.906 -0.230 5.819
418 H ILE 56 H ILE 56 -0.352 0.766 8.103
419 HA ILE 56 HA ILE 56 -0.947 1.801 10.831
420 HB ILE 56 HB ILE 56 -1.355 3.300 8.980
421 HG12 ILE 56 2HG1 ILE 56 -3.967 2.427 10.280
422 HG13 ILE 56 3HG1 ILE 56 -2.693 3.363 11.067
423 HG21 ILE 56 1HG2 ILE 56 -3.513 1.416 7.975
424 HG22 ILE 56 2HG2 ILE 56 -3.031 2.976 7.289
425 HG23 ILE 56 3HG2 ILE 56 -1.925 1.611 7.204
426 HD11 ILE 56 1HD1 ILE 56 -4.414 4.868 10.286
427 HD12 ILE 56 2HD1 ILE 56 -2.960 5.128 9.300
428 HD13 ILE 56 3HD1 ILE 56 -4.340 4.207 8.648
429 H CYS 57 H CYS 57 -0.463 -0.633 10.988
430 HA CYS 57 HA CYS 57 -2.890 -2.309 11.529
431 HB2 CYS 57 2HB CYS 57 -0.923 -2.828 9.286
432 HB3 CYS 57 3HB CYS 57 -1.940 -4.090 10.008
433 H ARG 58 H ARG 58 0.609 -2.260 10.808
434 HA ARG 58 HA ARG 58 2.420 -3.040 11.769
435 HB2 ARG 58 2HB ARG 58 0.963 -2.106 13.986
436 HB3 ARG 58 3HB ARG 58 1.441 -3.738 14.450
437 HG2 ARG 58 2HG ARG 58 3.819 -3.032 13.542
438 HG3 ARG 58 3HG ARG 58 3.167 -1.384 13.612
439 HD2 ARG 58 2HD ARG 58 4.272 -1.718 15.677
440 HD3 ARG 58 3HD ARG 58 2.545 -1.901 16.057
441 HE ARG 58 HE ARG 58 3.440 -4.449 15.406
442 HH11 ARG 58 1HH1 ARG 58 4.943 -5.453 18.440
443 HH12 ARG 58 2HH1 ARG 58 4.339 -5.976 16.910
444 HH21 ARG 58 1HH2 ARG 58 4.892 -3.135 18.990
445 HH22 ARG 58 2HH2 ARG 58 4.217 -2.028 17.848
446 H VAL 59 H VAL 59 0.068 -4.879 10.813
447 HA VAL 59 HA VAL 59 0.847 -7.467 11.933
448 HB VAL 59 HB VAL 59 -0.848 -6.739 9.494
449 HG11 VAL 59 1HG1 VAL 59 -0.677 -9.329 11.111
450 HG12 VAL 59 2HG1 VAL 59 -1.841 -8.997 9.810
451 HG13 VAL 59 3HG1 VAL 59 -0.125 -9.101 9.438
452 HG21 VAL 59 1HG2 VAL 59 -2.803 -7.136 10.947
453 HG22 VAL 59 2HG2 VAL 59 -1.733 -7.413 12.337
454 HG23 VAL 59 3HG2 VAL 59 -1.842 -5.809 11.596
455 H ASP 60 H ASP 60 2.043 -9.021 10.751
456 HA ASP 60 HA ASP 60 4.200 -8.072 9.081
457 HB2 ASP 60 2HB ASP 60 4.494 -9.942 10.604
458 HB3 ASP 60 3HB ASP 60 3.147 -10.812 9.859
459 H ILE 61 H ILE 61 4.490 -8.556 6.871
460 HA ILE 61 HA ILE 61 2.075 -9.494 5.395
461 HB ILE 61 HB ILE 61 2.641 -8.013 3.598
462 HG12 ILE 61 2HG1 ILE 61 4.829 -6.884 5.396
463 HG13 ILE 61 3HG1 ILE 61 5.120 -7.919 3.986
464 HG21 ILE 61 1HG2 ILE 61 1.222 -7.309 5.640
465 HG22 ILE 61 2HG2 ILE 61 2.638 -6.322 6.092
466 HG23 ILE 61 3HG2 ILE 61 1.774 -6.033 4.545
467 HD11 ILE 61 1HD1 ILE 61 3.873 -6.318 2.590
468 HD12 ILE 61 2HD1 ILE 61 3.809 -5.202 3.983
469 HD13 ILE 61 3HD1 ILE 61 5.387 -5.657 3.298
470 H GLU 62 H GLU 62 5.383 -10.031 5.979
471 HA GLU 62 HA GLU 62 6.328 -11.016 3.539
472 HB2 GLU 62 2HB GLU 62 7.686 -10.800 5.610
473 HB3 GLU 62 3HB GLU 62 6.875 -12.229 6.282
474 HG2 GLU 62 2HG GLU 62 7.694 -13.606 4.396
475 HG3 GLU 62 3HG GLU 62 8.378 -12.172 3.626
476 H ALA 63 H ALA 63 5.678 -12.628 2.188
477 HA ALA 63 HA ALA 63 4.500 -15.058 3.261
478 HB1 ALA 63 1HB ALA 63 2.948 -13.190 1.402
479 HB2 ALA 63 2HB ALA 63 2.465 -14.848 1.835
480 HB3 ALA 63 3HB ALA 63 2.523 -13.585 3.082
481 H GLN 64 H GLN 64 4.389 -16.669 1.552
482 HA GLN 64 HA GLN 64 5.591 -17.929 0.114
483 HB2 GLN 64 2HB GLN 64 5.391 -15.489 -1.690
484 HB3 GLN 64 3HB GLN 64 5.872 -17.118 -2.181
485 HG2 GLN 64 2HG GLN 64 3.634 -17.942 -1.255
486 HG3 GLN 64 3HG GLN 64 3.162 -16.240 -1.118
487 HE21 GLN 64 1HE2 GLN 64 4.367 -18.710 -3.487
488 HE22 GLN 64 2HE2 GLN 64 3.565 -17.949 -4.852
489 H LEU 65 H LEU 65 7.124 -17.225 2.022
490 HA LEU 65 HA LEU 65 9.234 -17.466 2.680
491 HB2 LEU 65 2HB LEU 65 9.870 -17.593 -0.294
492 HB3 LEU 65 3HB LEU 65 11.117 -17.542 0.910
493 HG LEU 65 HG LEU 65 10.053 -19.557 2.036
494 HD11 LEU 65 1HD1 LEU 65 7.816 -19.553 1.034
495 HD12 LEU 65 2HD1 LEU 65 8.515 -19.657 -0.601
496 HD13 LEU 65 3HD1 LEU 65 8.670 -21.014 0.537
497 HD21 LEU 65 1HD2 LEU 65 11.069 -21.118 0.411
498 HD22 LEU 65 2HD2 LEU 65 11.077 -19.835 -0.821
499 HD23 LEU 65 3HD2 LEU 65 12.076 -19.680 0.640
500 HA PRO 66 HA PRO 66 10.745 -13.361 3.121
501 HB2 PRO 66 2HB PRO 66 13.370 -13.724 3.871
502 HB3 PRO 66 3HB PRO 66 11.995 -14.092 4.952
503 HG2 PRO 66 2HG PRO 66 13.522 -16.023 3.188
504 HG3 PRO 66 3HG PRO 66 13.093 -16.203 4.921
505 HD2 PRO 66 2HD PRO 66 11.596 -17.357 2.995
506 HD3 PRO 66 3HD PRO 66 10.810 -16.591 4.406
507 H SER 67 H SER 67 11.253 -11.943 1.552
508 HA SER 67 HA SER 67 12.592 -12.838 -0.877
509 HB2 SER 67 2HB SER 67 10.730 -11.114 -0.780
510 HB3 SER 67 3HB SER 67 11.898 -9.987 -0.059
511 HG SER 67 HG SER 67 13.219 -10.462 -1.991
512 H GLU 68 H GLU 68 13.444 -10.876 1.977
513 HA GLU 68 HA GLU 68 16.271 -11.064 1.427
514 HB2 GLU 68 2HB GLU 68 15.062 -8.845 0.297
515 HB3 GLU 68 3HB GLU 68 15.355 -8.249 1.926
516 HG2 GLU 68 2HG GLU 68 17.266 -7.647 0.639
517 HG3 GLU 68 3HG GLU 68 17.783 -8.991 1.656
518 H SER 69 H SER 69 17.308 -9.733 3.451
519 HA SER 69 HA SER 69 16.090 -10.830 5.830
520 HB2 SER 69 2HB SER 69 18.583 -10.528 5.407
521 HB3 SER 69 3HB SER 69 18.333 -8.782 5.641
522 HG SER 69 HG SER 69 17.341 -9.412 7.682
Start of MODEL 21
1 H1 MET 1 H1 MET 1 1.960 35.254 16.040
2 H2 MET 1 H2 MET 1 1.095 35.294 17.453
3 H3 MET 1 H3 MET 1 1.808 33.893 16.933
4 HA MET 1 HA MET 1 -0.498 33.732 16.505
5 HB2 MET 1 2HB MET 1 -0.069 36.355 15.006
6 HB3 MET 1 3HB MET 1 -1.491 35.318 14.810
7 HG2 MET 1 2HG MET 1 -2.311 36.676 16.438
8 HG3 MET 1 3HG MET 1 -1.588 35.426 17.445
9 HE1 MET 1 1HE MET 1 -2.133 39.000 16.899
10 HE2 MET 1 2HE MET 1 -0.597 39.856 17.149
11 HE3 MET 1 3HE MET 1 -0.852 38.898 15.670
12 H LYS 2 H LYS 2 -1.408 33.087 14.285
13 HA LYS 2 HA LYS 2 0.500 32.846 12.110
14 HB2 LYS 2 2HB LYS 2 1.132 30.841 13.250
15 HB3 LYS 2 3HB LYS 2 -0.538 30.392 13.597
16 HG2 LYS 2 2HG LYS 2 -0.968 29.880 11.269
17 HG3 LYS 2 3HG LYS 2 0.585 30.577 10.767
18 HD2 LYS 2 2HD LYS 2 1.815 28.832 11.882
19 HD3 LYS 2 3HD LYS 2 0.361 28.189 12.658
20 HE2 LYS 2 2HE LYS 2 0.616 28.347 9.630
21 HE3 LYS 2 3HE LYS 2 1.303 26.988 10.532
22 HZ1 LYS 2 1HZ LYS 2 -0.945 26.610 9.678
23 HZ2 LYS 2 2HZ LYS 2 -0.860 26.415 11.311
24 HZ3 LYS 2 3HZ LYS 2 -1.526 27.770 10.645
25 H GLN 3 H GLN 3 -2.454 31.076 12.977
26 HA GLN 3 HA GLN 3 -4.547 31.059 12.216
27 HB2 GLN 3 2HB GLN 3 -4.262 33.736 12.208
28 HB3 GLN 3 3HB GLN 3 -4.324 33.473 10.457
29 HG2 GLN 3 2HG GLN 3 -6.412 31.891 11.227
30 HG3 GLN 3 3HG GLN 3 -6.426 33.034 12.566
31 HE21 GLN 3 1HE2 GLN 3 -6.377 35.505 11.788
32 HE22 GLN 3 2HE2 GLN 3 -7.363 35.784 10.356
33 H ASP 4 H ASP 4 -5.606 30.123 10.289
34 HA ASP 4 HA ASP 4 -4.198 29.859 7.809
35 HB2 ASP 4 2HB ASP 4 -2.820 28.581 9.642
36 HB3 ASP 4 3HB ASP 4 -4.138 27.421 9.641
37 H GLY 5 H GLY 5 -5.386 28.071 6.502
38 HA2 GLY 5 2HA GLY 5 -7.398 26.476 7.441
39 HA3 GLY 5 3HA GLY 5 -8.230 28.011 7.126
40 H GLU 6 H GLU 6 -8.244 25.217 5.744
41 HA GLU 6 HA GLU 6 -8.443 26.338 3.061
42 HB2 GLU 6 2HB GLU 6 -6.689 23.951 3.792
43 HB3 GLU 6 3HB GLU 6 -7.473 24.092 2.217
44 HG2 GLU 6 2HG GLU 6 -6.375 26.367 1.959
45 HG3 GLU 6 3HG GLU 6 -5.402 25.977 3.389
46 H GLU 7 H GLU 7 -10.077 25.157 1.850
47 HA GLU 7 HA GLU 7 -11.102 22.691 2.729
48 HB2 GLU 7 2HB GLU 7 -12.359 24.182 4.297
49 HB3 GLU 7 3HB GLU 7 -12.953 25.123 2.916
50 HG2 GLU 7 2HG GLU 7 -14.125 23.158 2.037
51 HG3 GLU 7 3HG GLU 7 -13.376 22.119 3.255
52 H GLY 8 H GLY 8 -11.846 21.769 0.791
53 HA2 GLY 8 2HA GLY 8 -12.983 22.906 -1.441
54 HA3 GLY 8 3HA GLY 8 -11.245 23.229 -1.634
55 H THR 9 H THR 9 -10.531 21.765 -3.084
56 HA THR 9 HA THR 9 -10.244 19.926 -4.288
57 HB THR 9 HB THR 9 -8.860 19.424 -2.359
58 HG1 THR 9 1HG THR 9 -8.319 17.896 -3.608
59 HG21 THR 9 1HG2 THR 9 -10.327 18.947 -0.569
60 HG22 THR 9 2HG2 THR 9 -11.218 17.733 -1.513
61 HG23 THR 9 3HG2 THR 9 -9.549 17.414 -0.988
62 H GLU 10 H GLU 10 -11.257 17.174 -3.821
63 HA GLU 10 HA GLU 10 -14.165 17.525 -3.893
64 HB2 GLU 10 2HB GLU 10 -12.525 16.425 -6.207
65 HB3 GLU 10 3HB GLU 10 -14.141 15.798 -5.862
66 HG2 GLU 10 2HG GLU 10 -14.957 18.230 -5.866
67 HG3 GLU 10 3HG GLU 10 -13.406 18.641 -6.614
68 H GLU 11 H GLU 11 -15.149 15.184 -3.911
69 HA GLU 11 HA GLU 11 -13.957 13.860 -1.624
70 HB2 GLU 11 2HB GLU 11 -16.428 14.094 -2.045
71 HB3 GLU 11 3HB GLU 11 -16.270 12.980 -3.415
72 HG2 GLU 11 2HG GLU 11 -15.292 11.267 -1.829
73 HG3 GLU 11 3HG GLU 11 -15.586 12.389 -0.497
74 H ASP 12 H ASP 12 -12.088 12.648 -1.987
75 HA ASP 12 HA ASP 12 -12.356 10.557 -4.054
76 HB2 ASP 12 2HB ASP 12 -11.157 12.718 -4.920
77 HB3 ASP 12 3HB ASP 12 -9.792 12.179 -3.937
78 H THR 13 H THR 13 -12.342 8.892 -2.640
79 HA THR 13 HA THR 13 -9.911 8.401 -1.027
80 HB THR 13 HB THR 13 -12.552 9.317 -0.016
81 HG1 THR 13 1HG THR 13 -10.559 10.435 0.057
82 HG21 THR 13 1HG2 THR 13 -12.320 8.356 2.204
83 HG22 THR 13 2HG2 THR 13 -12.659 7.102 1.004
84 HG23 THR 13 3HG2 THR 13 -11.005 7.303 1.648
85 H GLU 14 H GLU 14 -12.032 7.024 -3.151
86 HA GLU 14 HA GLU 14 -12.558 4.508 -1.847
87 HB2 GLU 14 2HB GLU 14 -12.570 5.517 -4.709
88 HB3 GLU 14 3HB GLU 14 -12.762 3.793 -4.379
89 HG2 GLU 14 2HG GLU 14 -14.524 5.926 -3.105
90 HG3 GLU 14 3HG GLU 14 -14.918 5.106 -4.621
91 H GLU 15 H GLU 15 -9.970 5.640 -4.081
92 HA GLU 15 HA GLU 15 -8.427 3.205 -3.312
93 HB2 GLU 15 2HB GLU 15 -7.572 3.206 -5.661
94 HB3 GLU 15 3HB GLU 15 -9.243 2.717 -5.431
95 HG2 GLU 15 2HG GLU 15 -10.090 4.780 -6.316
96 HG3 GLU 15 3HG GLU 15 -8.494 5.536 -6.306
97 H LYS 16 H LYS 16 -7.517 4.563 -1.647
98 HA LYS 16 HA LYS 16 -5.395 6.344 -2.755
99 HB2 LYS 16 2HB LYS 16 -7.032 6.519 -0.228
100 HB3 LYS 16 3HB LYS 16 -5.333 6.981 -0.138
101 HG2 LYS 16 2HG LYS 16 -5.721 8.440 -2.179
102 HG3 LYS 16 3HG LYS 16 -7.460 8.202 -1.912
103 HD2 LYS 16 2HD LYS 16 -7.402 9.411 0.143
104 HD3 LYS 16 3HD LYS 16 -5.646 9.218 0.284
105 HE2 LYS 16 2HE LYS 16 -5.674 11.381 -0.454
106 HE3 LYS 16 3HE LYS 16 -5.560 10.525 -2.000
107 HZ1 LYS 16 1HZ LYS 16 -7.237 12.241 -2.082
108 HZ2 LYS 16 2HZ LYS 16 -7.980 10.785 -2.216
109 HZ3 LYS 16 3HZ LYS 16 -8.065 11.584 -0.823
110 H CYS 17 H CYS 17 -3.414 5.967 -2.295
111 HA CYS 17 HA CYS 17 -2.226 3.467 -1.189
112 HB2 CYS 17 2HB CYS 17 -1.380 4.767 -3.172
113 HB3 CYS 17 3HB CYS 17 -1.212 6.169 -2.140
114 H THR 18 H THR 18 -1.876 3.292 1.042
115 HA THR 18 HA THR 18 -2.288 5.648 2.685
116 HB THR 18 HB THR 18 -2.847 3.216 3.280
117 HG1 THR 18 1HG THR 18 -1.535 5.013 5.027
118 HG21 THR 18 1HG2 THR 18 -0.463 2.430 2.876
119 HG22 THR 18 2HG2 THR 18 0.011 3.294 4.341
120 HG23 THR 18 3HG2 THR 18 -1.167 1.986 4.470
121 H ILE 19 H ILE 19 0.524 4.485 1.007
122 HA ILE 19 HA ILE 19 2.403 5.291 3.090
123 HB ILE 19 HB ILE 19 2.555 4.021 0.358
124 HG12 ILE 19 2HG1 ILE 19 3.691 3.057 3.005
125 HG13 ILE 19 3HG1 ILE 19 1.987 2.803 2.606
126 HG21 ILE 19 1HG2 ILE 19 4.462 5.469 0.346
127 HG22 ILE 19 2HG2 ILE 19 4.829 5.117 2.054
128 HG23 ILE 19 3HG2 ILE 19 5.077 3.883 0.808
129 HD11 ILE 19 1HD1 ILE 19 4.288 1.864 0.855
130 HD12 ILE 19 2HD1 ILE 19 3.390 0.864 1.999
131 HD13 ILE 19 3HD1 ILE 19 2.557 1.580 0.593
132 H CYS 20 H CYS 20 1.593 6.278 -0.294
133 HA CYS 20 HA CYS 20 3.049 8.890 0.056
134 HB2 CYS 20 2HB CYS 20 2.525 9.178 -2.287
135 HB3 CYS 20 3HB CYS 20 3.433 7.683 -2.016
136 H LEU 21 H LEU 21 -0.017 7.595 0.824
137 HA LEU 21 HA LEU 21 -2.028 8.496 1.231
138 HB2 LEU 21 2HB LEU 21 -0.223 10.799 1.995
139 HB3 LEU 21 3HB LEU 21 -1.921 10.664 2.470
140 HG LEU 21 HG LEU 21 0.110 8.470 3.080
141 HD11 LEU 21 1HD1 LEU 21 0.903 10.517 4.123
142 HD12 LEU 21 2HD1 LEU 21 -0.702 10.803 4.844
143 HD13 LEU 21 3HD1 LEU 21 0.273 9.395 5.339
144 HD21 LEU 21 1HD2 LEU 21 -2.590 9.178 4.319
145 HD22 LEU 21 2HD2 LEU 21 -2.289 7.826 3.207
146 HD23 LEU 21 3HD2 LEU 21 -1.532 7.833 4.799
147 H SER 22 H SER 22 -1.619 8.394 -1.405
148 HA SER 22 HA SER 22 -2.969 10.827 -2.412
149 HB2 SER 22 2HB SER 22 -0.246 10.308 -2.858
150 HB3 SER 22 3HB SER 22 -1.039 9.669 -4.311
151 HG SER 22 HG SER 22 -1.065 12.268 -3.227
152 H ILE 23 H ILE 23 -4.058 10.396 -4.530
153 HA ILE 23 HA ILE 23 -5.450 7.882 -4.435
154 HB ILE 23 HB ILE 23 -5.452 10.400 -6.107
155 HG12 ILE 23 2HG1 ILE 23 -6.513 10.238 -3.799
156 HG13 ILE 23 3HG1 ILE 23 -7.535 10.833 -5.090
157 HG21 ILE 23 1HG2 ILE 23 -6.964 7.873 -6.749
158 HG22 ILE 23 2HG2 ILE 23 -7.548 9.499 -7.207
159 HG23 ILE 23 3HG2 ILE 23 -5.982 8.936 -7.790
160 HD11 ILE 23 1HD1 ILE 23 -8.721 9.183 -3.643
161 HD12 ILE 23 2HD1 ILE 23 -8.603 8.599 -5.306
162 HD13 ILE 23 3HD1 ILE 23 -7.526 7.952 -4.084
163 H LEU 24 H LEU 24 -5.599 6.422 -6.080
164 HA LEU 24 HA LEU 24 -3.142 5.813 -7.593
165 HB2 LEU 24 2HB LEU 24 -5.679 4.234 -6.916
166 HB3 LEU 24 3HB LEU 24 -4.227 3.556 -7.660
167 HG LEU 24 HG LEU 24 -4.310 4.804 -4.856
168 HD11 LEU 24 1HD1 LEU 24 -4.032 2.540 -4.039
169 HD12 LEU 24 2HD1 LEU 24 -5.545 2.735 -4.932
170 HD13 LEU 24 3HD1 LEU 24 -4.172 1.903 -5.705
171 HD21 LEU 24 1HD2 LEU 24 -2.176 3.575 -6.587
172 HD22 LEU 24 2HD2 LEU 24 -2.176 5.109 -5.677
173 HD23 LEU 24 3HD2 LEU 24 -2.046 3.545 -4.819
174 H GLU 25 H GLU 25 -4.291 4.258 -9.596
175 HA GLU 25 HA GLU 25 -6.708 5.513 -10.554
176 HB2 GLU 25 2HB GLU 25 -5.958 6.041 -12.806
177 HB3 GLU 25 3HB GLU 25 -5.027 6.955 -11.614
178 HG2 GLU 25 2HG GLU 25 -3.147 5.382 -11.844
179 HG3 GLU 25 3HG GLU 25 -4.079 4.414 -13.000
180 H GLU 26 H GLU 26 -7.411 4.329 -12.709
181 HA GLU 26 HA GLU 26 -7.518 1.552 -12.005
182 HB2 GLU 26 2HB GLU 26 -9.361 2.870 -13.052
183 HB3 GLU 26 3HB GLU 26 -8.458 2.946 -14.563
184 HG2 GLU 26 2HG GLU 26 -9.071 0.273 -13.246
185 HG3 GLU 26 3HG GLU 26 -10.327 1.116 -14.146
186 H GLY 27 H GLY 27 -6.245 -0.104 -12.683
187 HA2 GLY 27 2HA GLY 27 -4.772 -1.303 -13.974
188 HA3 GLY 27 3HA GLY 27 -4.853 -0.030 -15.198
189 H GLU 28 H GLU 28 -3.969 1.261 -12.084
190 HA GLU 28 HA GLU 28 -1.326 1.844 -13.030
191 HB2 GLU 28 2HB GLU 28 -3.006 3.041 -11.306
192 HB3 GLU 28 3HB GLU 28 -2.096 2.095 -10.133
193 HG2 GLU 28 2HG GLU 28 0.014 3.157 -11.173
194 HG3 GLU 28 3HG GLU 28 -1.069 4.183 -12.109
195 H ASP 29 H ASP 29 0.616 1.357 -11.689
196 HA ASP 29 HA ASP 29 0.924 -1.425 -11.036
197 HB2 ASP 29 2HB ASP 29 2.723 0.886 -10.220
198 HB3 ASP 29 3HB ASP 29 3.143 -0.824 -10.362
199 H VAL 30 H VAL 30 -0.171 -2.259 -9.247
200 HA VAL 30 HA VAL 30 -0.023 -0.763 -6.710
201 HB VAL 30 HB VAL 30 -2.338 -1.298 -6.211
202 HG11 VAL 30 1HG1 VAL 30 -2.242 0.111 -8.892
203 HG12 VAL 30 2HG1 VAL 30 -3.405 0.346 -7.582
204 HG13 VAL 30 3HG1 VAL 30 -1.720 0.861 -7.371
205 HG21 VAL 30 1HG2 VAL 30 -2.665 -3.325 -7.567
206 HG22 VAL 30 2HG2 VAL 30 -3.888 -2.104 -7.949
207 HG23 VAL 30 3HG2 VAL 30 -2.532 -2.361 -9.060
208 H ARG 31 H ARG 31 -1.066 -2.503 -4.990
209 HA ARG 31 HA ARG 31 -0.069 -5.160 -5.499
210 HB2 ARG 31 2HB ARG 31 1.540 -3.052 -4.163
211 HB3 ARG 31 3HB ARG 31 1.332 -4.456 -3.139
212 HG2 ARG 31 2HG ARG 31 2.195 -5.007 -5.975
213 HG3 ARG 31 3HG ARG 31 3.345 -4.199 -4.917
214 HD2 ARG 31 2HD ARG 31 3.775 -6.522 -4.720
215 HD3 ARG 31 3HD ARG 31 3.029 -5.982 -3.209
216 HE ARG 31 HE ARG 31 1.237 -7.101 -5.261
217 HH11 ARG 31 1HH1 ARG 31 0.667 -10.039 -3.396
218 HH12 ARG 31 2HH1 ARG 31 0.135 -9.093 -4.737
219 HH21 ARG 31 1HH2 ARG 31 2.459 -9.305 -2.053
220 HH22 ARG 31 2HH2 ARG 31 3.280 -7.848 -2.470
221 H ARG 32 H ARG 32 -0.105 -6.324 -3.152
222 HA ARG 32 HA ARG 32 -2.398 -5.336 -1.632
223 HB2 ARG 32 2HB ARG 32 -3.427 -6.760 -3.332
224 HB3 ARG 32 3HB ARG 32 -2.195 -8.008 -3.107
225 HG2 ARG 32 2HG ARG 32 -4.279 -8.720 -2.061
226 HG3 ARG 32 3HG ARG 32 -3.048 -8.485 -0.835
227 HD2 ARG 32 2HD ARG 32 -4.802 -7.366 0.158
228 HD3 ARG 32 3HD ARG 32 -4.051 -6.038 -0.684
229 HE ARG 32 HE ARG 32 -6.045 -7.429 -2.298
230 HH11 ARG 32 1HH1 ARG 32 -8.563 -5.012 -1.756
231 HH12 ARG 32 2HH1 ARG 32 -8.157 -6.447 -2.627
232 HH21 ARG 32 1HH2 ARG 32 -7.091 -4.196 -0.049
233 HH22 ARG 32 2HH2 ARG 32 -5.468 -4.790 -0.092
234 H LEU 33 H LEU 33 -2.425 -6.177 0.534
235 HA LEU 33 HA LEU 33 -0.295 -7.996 1.346
236 HB2 LEU 33 2HB LEU 33 -0.662 -6.260 3.514
237 HB3 LEU 33 3HB LEU 33 0.742 -6.294 2.455
238 HG LEU 33 HG LEU 33 -1.666 -4.617 1.692
239 HD11 LEU 33 1HD1 LEU 33 -0.655 -2.754 2.973
240 HD12 LEU 33 2HD1 LEU 33 -1.308 -4.020 4.007
241 HD13 LEU 33 3HD1 LEU 33 0.444 -3.899 3.771
242 HD21 LEU 33 1HD2 LEU 33 0.035 -3.265 0.620
243 HD22 LEU 33 2HD2 LEU 33 1.336 -4.054 1.539
244 HD23 LEU 33 3HD2 LEU 33 0.507 -4.932 0.250
245 HA PRO 34 HA PRO 34 -3.429 -10.110 3.403
246 HB2 PRO 34 2HB PRO 34 -2.453 -10.721 5.924
247 HB3 PRO 34 3HB PRO 34 -1.927 -11.494 4.399
248 HG2 PRO 34 2HG PRO 34 -0.576 -9.285 5.942
249 HG3 PRO 34 3HG PRO 34 0.152 -10.696 5.110
250 HD2 PRO 34 2HD PRO 34 0.052 -8.149 4.084
251 HD3 PRO 34 3HD PRO 34 0.112 -9.570 3.043
252 H CYS 35 H CYS 35 -2.326 -7.261 5.098
253 HA CYS 35 HA CYS 35 -4.547 -6.714 6.896
254 HB2 CYS 35 2HB CYS 35 -2.294 -5.720 6.950
255 HB3 CYS 35 3HB CYS 35 -2.601 -5.001 5.367
256 H MET 36 H MET 36 -4.888 -7.314 3.590
257 HA MET 36 HA MET 36 -6.266 -6.651 1.966
258 HB2 MET 36 2HB MET 36 -8.047 -6.109 4.373
259 HB3 MET 36 3HB MET 36 -8.602 -6.036 2.700
260 HG2 MET 36 2HG MET 36 -7.199 -8.465 2.840
261 HG3 MET 36 3HG MET 36 -8.089 -8.383 4.360
262 HE1 MET 36 1HE MET 36 -9.256 -10.687 3.461
263 HE2 MET 36 2HE MET 36 -10.143 -10.786 1.921
264 HE3 MET 36 3HE MET 36 -8.380 -10.547 1.916
265 H HIS 37 H HIS 37 -4.365 -4.685 2.901
266 HA HIS 37 HA HIS 37 -5.716 -2.119 2.323
267 HB2 HIS 37 1HB HIS 37 -3.376 -2.988 3.780
268 HB3 HIS 37 2HB HIS 37 -2.836 -1.962 2.466
269 HD2 HIS 37 2HD HIS 37 -5.066 0.305 2.472
270 HE1 HIS 37 1HE HIS 37 -4.006 0.879 6.556
271 HE2 HIS 37 2HE HIS 37 -5.142 1.929 4.522
272 H LEU 38 H LEU 38 -5.318 -0.990 0.337
273 HA LEU 38 HA LEU 38 -4.086 -2.551 -1.881
274 HB2 LEU 38 2HB LEU 38 -6.416 -1.822 -2.261
275 HB3 LEU 38 3HB LEU 38 -6.026 -0.195 -1.702
276 HG LEU 38 HG LEU 38 -4.463 0.055 -3.685
277 HD11 LEU 38 1HD1 LEU 38 -4.127 -2.336 -4.230
278 HD12 LEU 38 2HD1 LEU 38 -5.866 -2.496 -4.594
279 HD13 LEU 38 3HD1 LEU 38 -4.835 -1.458 -5.595
280 HD21 LEU 38 1HD2 LEU 38 -6.328 0.448 -5.264
281 HD22 LEU 38 2HD2 LEU 38 -7.413 -0.498 -4.226
282 HD23 LEU 38 3HD2 LEU 38 -6.716 1.026 -3.636
283 H PHE 39 H PHE 39 -1.971 -1.877 -2.315
284 HA PHE 39 HA PHE 39 -1.217 0.914 -1.520
285 HB2 PHE 39 2HB PHE 39 0.390 -1.672 -1.270
286 HB3 PHE 39 3HB PHE 39 1.117 -0.086 -1.295
287 HD1 PHE 39 1HD PHE 39 2.155 -1.050 0.768
288 HD2 PHE 39 2HD PHE 39 -1.961 0.144 0.635
289 HE1 PHE 39 1HE PHE 39 2.124 -0.909 3.240
290 HE2 PHE 39 2HE PHE 39 -1.984 0.329 3.062
291 HZ PHE 39 HZ PHE 39 0.043 -0.195 4.400
292 H HIS 40 H HIS 40 0.676 1.695 -2.871
293 HA HIS 40 HA HIS 40 0.391 1.031 -5.734
294 HB2 HIS 40 1HB HIS 40 2.166 2.771 -4.067
295 HB3 HIS 40 2HB HIS 40 2.735 2.327 -5.662
296 HD2 HIS 40 2HD HIS 40 0.497 2.864 -7.644
297 HE1 HIS 40 1HE HIS 40 0.247 6.726 -5.863
298 HE2 HIS 40 2HE HIS 40 -0.331 5.306 -7.931
299 H GLN 41 H GLN 41 2.226 0.181 -6.945
300 HA GLN 41 HA GLN 41 3.552 -2.050 -5.751
301 HB2 GLN 41 2HB GLN 41 2.854 -1.740 -8.140
302 HB3 GLN 41 3HB GLN 41 4.213 -0.636 -8.365
303 HG2 GLN 41 2HG GLN 41 5.780 -2.325 -8.282
304 HG3 GLN 41 3HG GLN 41 4.867 -3.283 -7.115
305 HE21 GLN 41 1HE2 GLN 41 2.389 -3.820 -8.353
306 HE22 GLN 41 2HE2 GLN 41 2.755 -4.666 -9.845
307 H VAL 42 H VAL 42 4.981 1.052 -7.054
308 HA VAL 42 HA VAL 42 7.536 0.475 -6.004
309 HB VAL 42 HB VAL 42 6.371 3.236 -6.554
310 HG11 VAL 42 1HG1 VAL 42 8.526 3.309 -5.316
311 HG12 VAL 42 2HG1 VAL 42 9.252 2.210 -6.507
312 HG13 VAL 42 3HG1 VAL 42 8.744 3.845 -6.985
313 HG21 VAL 42 1HG2 VAL 42 7.477 2.942 -8.793
314 HG22 VAL 42 2HG2 VAL 42 7.787 1.244 -8.385
315 HG23 VAL 42 3HG2 VAL 42 6.121 1.840 -8.560
316 H CYS 43 H CYS 43 4.881 2.435 -4.518
317 HA CYS 43 HA CYS 43 6.265 3.213 -2.149
318 HB2 CYS 43 2HB CYS 43 3.348 2.423 -2.318
319 HB3 CYS 43 3HB CYS 43 4.127 3.455 -1.151
320 H VAL 44 H VAL 44 4.310 0.116 -2.727
321 HA VAL 44 HA VAL 44 4.966 -0.683 -0.091
322 HB VAL 44 HB VAL 44 2.956 -1.399 -1.456
323 HG11 VAL 44 1HG1 VAL 44 3.223 -3.582 -2.550
324 HG12 VAL 44 2HG1 VAL 44 4.104 -2.311 -3.429
325 HG13 VAL 44 3HG1 VAL 44 4.974 -3.478 -2.408
326 HG21 VAL 44 1HG2 VAL 44 4.450 -3.676 -0.152
327 HG22 VAL 44 2HG2 VAL 44 3.831 -2.328 0.795
328 HG23 VAL 44 3HG2 VAL 44 2.699 -3.322 -0.166
329 H ASP 45 H ASP 45 6.704 -0.915 -3.103
330 HA ASP 45 HA ASP 45 8.344 -3.168 -2.480
331 HB2 ASP 45 2HB ASP 45 8.212 -1.985 -4.708
332 HB3 ASP 45 3HB ASP 45 9.164 -0.664 -4.020
333 H GLN 46 H GLN 46 9.031 0.361 -2.065
334 HA GLN 46 HA GLN 46 11.228 -0.221 -0.313
335 HB2 GLN 46 2HB GLN 46 9.654 2.383 -0.572
336 HB3 GLN 46 3HB GLN 46 11.203 2.173 0.267
337 HG2 GLN 46 2HG GLN 46 12.066 1.193 -1.986
338 HG3 GLN 46 3HG GLN 46 10.640 1.956 -2.706
339 HE21 GLN 46 1HE2 GLN 46 13.817 2.484 -2.552
340 HE22 GLN 46 2HE2 GLN 46 13.827 4.223 -2.287
341 H ALA 47 H ALA 47 7.793 0.052 0.368
342 HA ALA 47 HA ALA 47 8.030 0.330 3.200
343 HB1 ALA 47 1HB ALA 47 5.948 -1.241 1.636
344 HB2 ALA 47 2HB ALA 47 5.771 -0.559 3.265
345 HB3 ALA 47 3HB ALA 47 5.934 0.523 1.858
346 H LEU 48 H LEU 48 7.436 -2.676 1.343
347 HA LEU 48 HA LEU 48 7.727 -4.485 3.413
348 HB2 LEU 48 2HB LEU 48 6.646 -4.776 1.194
349 HB3 LEU 48 3HB LEU 48 8.223 -4.890 0.424
350 HG LEU 48 HG LEU 48 7.464 -6.769 2.689
351 HD11 LEU 48 1HD1 LEU 48 5.586 -6.849 1.102
352 HD12 LEU 48 2HD1 LEU 48 6.716 -7.089 -0.247
353 HD13 LEU 48 3HD1 LEU 48 6.538 -8.336 1.012
354 HD21 LEU 48 1HD2 LEU 48 9.199 -7.113 0.191
355 HD22 LEU 48 2HD2 LEU 48 9.811 -6.894 1.841
356 HD23 LEU 48 3HD2 LEU 48 8.911 -8.355 1.427
357 H ILE 49 H ILE 49 10.266 -3.387 1.041
358 HA ILE 49 HA ILE 49 12.270 -5.061 2.207
359 HB ILE 49 HB ILE 49 13.879 -3.854 1.004
360 HG12 ILE 49 2HG1 ILE 49 12.914 -1.794 -0.413
361 HG13 ILE 49 3HG1 ILE 49 12.002 -1.596 1.101
362 HG21 ILE 49 1HG2 ILE 49 12.272 -5.333 -0.239
363 HG22 ILE 49 2HG2 ILE 49 11.456 -3.867 -0.803
364 HG23 ILE 49 3HG2 ILE 49 13.143 -4.141 -1.221
365 HD11 ILE 49 1HD1 ILE 49 14.198 -0.339 0.967
366 HD12 ILE 49 2HD1 ILE 49 14.022 -1.377 2.388
367 HD13 ILE 49 3HD1 ILE 49 15.023 -1.908 1.024
368 H THR 50 H THR 50 11.062 -1.808 3.122
369 HA THR 50 HA THR 50 13.223 -1.308 4.926
370 HB THR 50 HB THR 50 10.417 -0.196 4.640
371 HG1 THR 50 1HG THR 50 11.834 0.615 3.242
372 HG21 THR 50 1HG2 THR 50 12.419 0.538 6.800
373 HG22 THR 50 2HG2 THR 50 11.012 1.518 6.323
374 HG23 THR 50 3HG2 THR 50 10.761 -0.079 7.035
375 H ASN 51 H ASN 51 10.002 -2.891 5.246
376 HA ASN 51 HA ASN 51 10.953 -4.674 7.224
377 HB2 ASN 51 2HB ASN 51 10.342 -2.238 8.382
378 HB3 ASN 51 3HB ASN 51 8.758 -2.983 8.394
379 HD21 ASN 51 1HD2 ASN 51 12.026 -3.047 9.647
380 HD22 ASN 51 2HD2 ASN 51 11.753 -4.293 10.861
381 H LYS 52 H LYS 52 9.423 -6.477 7.230
382 HA LYS 52 HA LYS 52 7.258 -6.168 5.228
383 HB2 LYS 52 2HB LYS 52 8.089 -8.630 6.826
384 HB3 LYS 52 3HB LYS 52 6.935 -8.553 5.498
385 HG2 LYS 52 2HG LYS 52 8.668 -9.217 4.250
386 HG3 LYS 52 3HG LYS 52 9.063 -7.495 4.206
387 HD2 LYS 52 2HD LYS 52 10.719 -7.783 5.981
388 HD3 LYS 52 3HD LYS 52 10.148 -9.447 6.278
389 HE2 LYS 52 2HE LYS 52 10.715 -9.937 3.842
390 HE3 LYS 52 3HE LYS 52 11.599 -8.391 3.818
391 HZ1 LYS 52 1HZ LYS 52 12.906 -9.318 5.700
392 HZ2 LYS 52 2HZ LYS 52 12.026 -10.719 5.567
393 HZ3 LYS 52 3HZ LYS 52 13.011 -10.279 4.347
394 H LYS 53 H LYS 53 6.330 -4.457 6.919
395 HA LYS 53 HA LYS 53 4.085 -5.912 8.062
396 HB2 LYS 53 2HB LYS 53 4.270 -4.757 10.281
397 HB3 LYS 53 3HB LYS 53 5.478 -6.011 9.994
398 HG2 LYS 53 2HG LYS 53 7.120 -4.211 9.340
399 HG3 LYS 53 3HG LYS 53 5.919 -3.001 9.824
400 HD2 LYS 53 2HD LYS 53 5.889 -4.088 12.113
401 HD3 LYS 53 3HD LYS 53 7.217 -5.142 11.563
402 HE2 LYS 53 2HE LYS 53 8.574 -3.123 11.039
403 HE3 LYS 53 3HE LYS 53 7.269 -2.090 11.629
404 HZ1 LYS 53 1HZ LYS 53 8.800 -4.060 13.206
405 HZ2 LYS 53 2HZ LYS 53 8.940 -2.424 13.308
406 HZ3 LYS 53 3HZ LYS 53 7.549 -3.166 13.796
407 H CYS 54 H CYS 54 2.253 -4.611 8.055
408 HA CYS 54 HA CYS 54 2.184 -2.395 6.185
409 HB2 CYS 54 2HB CYS 54 0.264 -3.848 6.732
410 HB3 CYS 54 3HB CYS 54 0.275 -3.225 8.389
411 HA PRO 55 HA PRO 55 4.073 0.358 9.150
412 HB2 PRO 55 2HB PRO 55 3.761 2.791 7.841
413 HB3 PRO 55 3HB PRO 55 5.016 1.570 7.477
414 HG2 PRO 55 2HG PRO 55 2.383 2.019 6.064
415 HG3 PRO 55 3HG PRO 55 3.992 1.699 5.351
416 HD2 PRO 55 2HD PRO 55 2.110 -0.251 5.654
417 HD3 PRO 55 3HD PRO 55 3.858 -0.601 5.850
418 H ILE 56 H ILE 56 0.739 0.437 8.284
419 HA ILE 56 HA ILE 56 0.104 2.297 10.529
420 HB ILE 56 HB ILE 56 -1.559 1.257 8.190
421 HG12 ILE 56 2HG1 ILE 56 -1.895 3.690 7.749
422 HG13 ILE 56 3HG1 ILE 56 -0.745 4.081 9.030
423 HG21 ILE 56 1HG2 ILE 56 -3.011 1.292 10.172
424 HG22 ILE 56 2HG2 ILE 56 -2.440 2.924 10.586
425 HG23 ILE 56 3HG2 ILE 56 -3.407 2.650 9.121
426 HD11 ILE 56 1HD1 ILE 56 1.089 3.245 7.743
427 HD12 ILE 56 2HD1 ILE 56 0.002 2.365 6.631
428 HD13 ILE 56 3HD1 ILE 56 0.091 4.143 6.608
429 H CYS 57 H CYS 57 -1.190 -0.739 9.108
430 HA CYS 57 HA CYS 57 -2.567 -1.530 11.480
431 HB2 CYS 57 2HB CYS 57 -1.725 -3.403 9.267
432 HB3 CYS 57 3HB CYS 57 -3.183 -3.414 10.252
433 H ARG 58 H ARG 58 0.789 -1.892 10.690
434 HA ARG 58 HA ARG 58 2.517 -2.937 11.607
435 HB2 ARG 58 2HB ARG 58 0.640 -2.603 13.902
436 HB3 ARG 58 3HB ARG 58 1.968 -3.733 14.148
437 HG2 ARG 58 2HG ARG 58 3.617 -2.073 13.613
438 HG3 ARG 58 3HG ARG 58 2.377 -0.895 13.113
439 HD2 ARG 58 2HD ARG 58 1.604 -0.571 15.309
440 HD3 ARG 58 3HD ARG 58 2.256 -2.127 15.864
441 HE ARG 58 HE ARG 58 4.341 -0.326 15.032
442 HH11 ARG 58 1HH1 ARG 58 5.341 0.257 18.381
443 HH12 ARG 58 2HH1 ARG 58 5.839 0.309 16.731
444 HH21 ARG 58 1HH2 ARG 58 3.158 -0.491 18.940
445 HH22 ARG 58 2HH2 ARG 58 2.092 -0.957 17.663
446 H VAL 59 H VAL 59 -0.202 -4.857 10.949
447 HA VAL 59 HA VAL 59 0.794 -7.364 11.879
448 HB VAL 59 HB VAL 59 -1.008 -6.742 9.497
449 HG11 VAL 59 1HG1 VAL 59 -0.649 -9.296 11.132
450 HG12 VAL 59 2HG1 VAL 59 -1.938 -9.023 9.940
451 HG13 VAL 59 3HG1 VAL 59 -0.262 -9.072 9.412
452 HG21 VAL 59 1HG2 VAL 59 -1.721 -7.364 12.402
453 HG22 VAL 59 2HG2 VAL 59 -1.938 -5.793 11.606
454 HG23 VAL 59 3HG2 VAL 59 -2.879 -7.178 11.067
455 H ASP 60 H ASP 60 1.939 -8.965 10.774
456 HA ASP 60 HA ASP 60 4.083 -8.169 9.034
457 HB2 ASP 60 2HB ASP 60 4.384 -9.970 10.609
458 HB3 ASP 60 3HB ASP 60 2.977 -10.834 9.971
459 H ILE 61 H ILE 61 4.369 -8.705 6.871
460 HA ILE 61 HA ILE 61 1.998 -9.710 5.378
461 HB ILE 61 HB ILE 61 2.423 -8.174 3.644
462 HG12 ILE 61 2HG1 ILE 61 4.866 -7.310 5.230
463 HG13 ILE 61 3HG1 ILE 61 4.862 -8.124 3.655
464 HG21 ILE 61 1HG2 ILE 61 1.722 -6.147 4.665
465 HG22 ILE 61 2HG2 ILE 61 1.203 -7.396 5.806
466 HG23 ILE 61 3HG2 ILE 61 2.680 -6.471 6.135
467 HD11 ILE 61 1HD1 ILE 61 5.226 -5.824 3.266
468 HD12 ILE 61 2HD1 ILE 61 3.547 -6.233 2.753
469 HD13 ILE 61 3HD1 ILE 61 3.847 -5.360 4.289
470 H GLU 62 H GLU 62 5.299 -10.186 6.044
471 HA GLU 62 HA GLU 62 6.354 -11.099 3.634
472 HB2 GLU 62 2HB GLU 62 7.558 -10.822 5.848
473 HB3 GLU 62 3HB GLU 62 6.885 -12.381 6.345
474 HG2 GLU 62 2HG GLU 62 7.985 -13.476 4.412
475 HG3 GLU 62 3HG GLU 62 8.544 -11.907 3.825
476 H ALA 63 H ALA 63 6.094 -12.895 2.348
477 HA ALA 63 HA ALA 63 3.871 -14.683 3.077
478 HB1 ALA 63 1HB ALA 63 4.072 -15.448 0.760
479 HB2 ALA 63 2HB ALA 63 3.931 -13.676 0.845
480 HB3 ALA 63 3HB ALA 63 5.515 -14.434 0.530
481 H GLN 64 H GLN 64 5.115 -15.664 4.875
482 HA GLN 64 HA GLN 64 6.285 -18.154 3.865
483 HB2 GLN 64 2HB GLN 64 8.105 -16.180 4.525
484 HB3 GLN 64 3HB GLN 64 7.854 -16.924 6.094
485 HG2 GLN 64 2HG GLN 64 9.545 -18.284 5.377
486 HG3 GLN 64 3HG GLN 64 8.208 -19.186 4.661
487 HE21 GLN 64 1HE2 GLN 64 10.393 -16.401 3.857
488 HE22 GLN 64 2HE2 GLN 64 10.606 -16.915 2.184
489 H LEU 65 H LEU 65 6.035 -19.870 5.482
490 HA LEU 65 HA LEU 65 4.335 -19.187 7.794
491 HB2 LEU 65 2HB LEU 65 5.103 -21.729 6.464
492 HB3 LEU 65 3HB LEU 65 5.230 -21.783 8.219
493 HG LEU 65 HG LEU 65 2.825 -20.647 8.154
494 HD11 LEU 65 1HD1 LEU 65 2.781 -20.491 5.658
495 HD12 LEU 65 2HD1 LEU 65 2.904 -22.263 5.565
496 HD13 LEU 65 3HD1 LEU 65 1.475 -21.507 6.300
497 HD21 LEU 65 1HD2 LEU 65 3.354 -22.756 9.246
498 HD22 LEU 65 2HD2 LEU 65 1.861 -22.915 8.311
499 HD23 LEU 65 3HD2 LEU 65 3.378 -23.601 7.680
500 HA PRO 66 HA PRO 66 8.127 -20.326 10.269
501 HB2 PRO 66 2HB PRO 66 10.528 -21.078 9.227
502 HB3 PRO 66 3HB PRO 66 9.138 -22.198 9.325
503 HG2 PRO 66 2HG PRO 66 9.967 -20.513 6.931
504 HG3 PRO 66 3HG PRO 66 9.667 -22.282 6.980
505 HD2 PRO 66 2HD PRO 66 7.733 -20.567 6.212
506 HD3 PRO 66 3HD PRO 66 7.340 -21.973 7.239
507 H SER 67 H SER 67 7.712 -17.975 10.399
508 HA SER 67 HA SER 67 10.300 -16.552 10.126
509 HB2 SER 67 2HB SER 67 7.522 -15.398 9.613
510 HB3 SER 67 3HB SER 67 9.028 -14.460 9.729
511 HG SER 67 HG SER 67 8.988 -14.858 7.619
512 H GLU 68 H GLU 68 10.962 -15.950 12.157
513 HA GLU 68 HA GLU 68 8.984 -16.155 14.350
514 HB2 GLU 68 2HB GLU 68 11.354 -17.384 14.201
515 HB3 GLU 68 3HB GLU 68 11.955 -15.850 14.817
516 HG2 GLU 68 2HG GLU 68 9.585 -16.710 16.326
517 HG3 GLU 68 3HG GLU 68 10.728 -18.040 16.219
518 H SER 69 H SER 69 10.376 -14.342 16.170
519 HA SER 69 HA SER 69 9.403 -11.835 14.987
520 HB2 SER 69 2HB SER 69 8.764 -12.650 17.304
521 HB3 SER 69 3HB SER 69 10.463 -12.442 17.780
522 HG SER 69 HG SER 69 10.180 -10.243 16.937
Start of MODEL 22
1 H1 MET 1 H1 MET 1 -25.676 39.723 -12.358
2 H2 MET 1 H2 MET 1 -24.414 40.014 -13.376
3 H3 MET 1 H3 MET 1 -24.135 39.763 -11.776
4 HA MET 1 HA MET 1 -23.940 42.098 -12.262
5 HB2 MET 1 2HB MET 1 -26.788 41.732 -13.274
6 HB3 MET 1 3HB MET 1 -26.019 43.301 -12.995
7 HG2 MET 1 2HG MET 1 -24.320 42.834 -14.670
8 HG3 MET 1 3HG MET 1 -25.022 41.235 -14.981
9 HE1 MET 1 1HE MET 1 -24.461 43.855 -17.028
10 HE2 MET 1 2HE MET 1 -24.888 42.223 -17.603
11 HE3 MET 1 3HE MET 1 -25.842 43.633 -18.125
12 H LYS 2 H LYS 2 -23.988 40.893 -9.794
13 HA LYS 2 HA LYS 2 -25.585 42.735 -8.320
14 HB2 LYS 2 2HB LYS 2 -27.264 40.862 -8.969
15 HB3 LYS 2 3HB LYS 2 -26.419 39.831 -7.839
16 HG2 LYS 2 2HG LYS 2 -27.539 42.574 -7.067
17 HG3 LYS 2 3HG LYS 2 -28.531 41.128 -7.122
18 HD2 LYS 2 2HD LYS 2 -28.049 40.940 -4.968
19 HD3 LYS 2 3HD LYS 2 -26.558 40.177 -5.525
20 HE2 LYS 2 2HE LYS 2 -25.361 42.322 -5.281
21 HE3 LYS 2 3HE LYS 2 -26.873 43.157 -4.910
22 HZ1 LYS 2 1HZ LYS 2 -25.511 42.559 -2.955
23 HZ2 LYS 2 2HZ LYS 2 -27.028 41.909 -2.885
24 HZ3 LYS 2 3HZ LYS 2 -25.721 40.986 -3.274
25 H GLN 3 H GLN 3 -24.220 39.420 -7.975
26 HA GLN 3 HA GLN 3 -21.889 40.438 -6.649
27 HB2 GLN 3 2HB GLN 3 -24.081 39.462 -5.036
28 HB3 GLN 3 3HB GLN 3 -22.802 38.253 -4.959
29 HG2 GLN 3 2HG GLN 3 -21.184 39.882 -4.205
30 HG3 GLN 3 3HG GLN 3 -22.272 41.230 -4.572
31 HE21 GLN 3 1HE2 GLN 3 -21.006 39.756 -1.938
32 HE22 GLN 3 2HE2 GLN 3 -22.382 39.927 -0.864
33 H ASP 4 H ASP 4 -20.799 37.874 -5.953
34 HA ASP 4 HA ASP 4 -21.136 36.205 -8.327
35 HB2 ASP 4 2HB ASP 4 -19.482 38.153 -8.797
36 HB3 ASP 4 3HB ASP 4 -18.423 37.389 -7.607
37 H GLY 5 H GLY 5 -19.853 34.131 -7.963
38 HA2 GLY 5 2HA GLY 5 -18.429 33.464 -5.692
39 HA3 GLY 5 3HA GLY 5 -20.129 33.270 -5.216
40 H GLU 6 H GLU 6 -17.966 31.197 -5.621
41 HA GLU 6 HA GLU 6 -19.597 29.346 -7.194
42 HB2 GLU 6 2HB GLU 6 -16.599 29.795 -7.599
43 HB3 GLU 6 3HB GLU 6 -17.475 28.351 -8.122
44 HG2 GLU 6 2HG GLU 6 -18.955 29.810 -9.535
45 HG3 GLU 6 3HG GLU 6 -17.912 31.187 -9.130
46 H GLU 7 H GLU 7 -19.187 27.090 -6.371
47 HA GLU 7 HA GLU 7 -17.180 26.694 -4.401
48 HB2 GLU 7 2HB GLU 7 -18.997 27.667 -2.976
49 HB3 GLU 7 3HB GLU 7 -20.106 26.408 -3.551
50 HG2 GLU 7 2HG GLU 7 -18.660 24.660 -2.593
51 HG3 GLU 7 3HG GLU 7 -17.436 25.863 -2.170
52 H GLY 8 H GLY 8 -16.539 24.612 -4.793
53 HA2 GLY 8 2HA GLY 8 -18.353 22.484 -5.481
54 HA3 GLY 8 3HA GLY 8 -17.379 23.023 -6.872
55 H THR 9 H THR 9 -17.198 20.417 -5.459
56 HA THR 9 HA THR 9 -14.346 20.425 -4.799
57 HB THR 9 HB THR 9 -14.864 19.030 -2.746
58 HG1 THR 9 1HG THR 9 -17.029 18.549 -3.192
59 HG21 THR 9 1HG2 THR 9 -14.265 21.472 -2.586
60 HG22 THR 9 2HG2 THR 9 -16.005 21.844 -2.536
61 HG23 THR 9 3HG2 THR 9 -15.274 20.870 -1.253
62 H GLU 10 H GLU 10 -13.913 17.777 -4.291
63 HA GLU 10 HA GLU 10 -15.590 16.178 -6.086
64 HB2 GLU 10 2HB GLU 10 -13.556 17.374 -7.273
65 HB3 GLU 10 3HB GLU 10 -12.573 16.180 -6.408
66 HG2 GLU 10 2HG GLU 10 -13.894 14.355 -7.472
67 HG3 GLU 10 3HG GLU 10 -14.916 15.563 -8.266
68 H GLU 11 H GLU 11 -15.141 13.864 -5.677
69 HA GLU 11 HA GLU 11 -14.301 13.414 -2.883
70 HB2 GLU 11 2HB GLU 11 -15.142 11.077 -3.347
71 HB3 GLU 11 3HB GLU 11 -16.344 12.353 -3.288
72 HG2 GLU 11 2HG GLU 11 -15.238 11.515 -5.983
73 HG3 GLU 11 3HG GLU 11 -16.408 10.491 -5.160
74 H ASP 12 H ASP 12 -12.408 12.454 -2.333
75 HA ASP 12 HA ASP 12 -10.710 11.168 -4.410
76 HB2 ASP 12 2HB ASP 12 -10.357 13.663 -4.448
77 HB3 ASP 12 3HB ASP 12 -9.991 13.627 -2.726
78 H THR 13 H THR 13 -11.821 9.648 -2.590
79 HA THR 13 HA THR 13 -9.517 9.113 -0.795
80 HB THR 13 HB THR 13 -11.174 10.794 0.179
81 HG1 THR 13 1HG THR 13 -10.278 8.558 1.646
82 HG21 THR 13 1HG2 THR 13 -13.233 9.447 -0.068
83 HG22 THR 13 2HG2 THR 13 -12.586 8.264 1.093
84 HG23 THR 13 3HG2 THR 13 -12.909 9.930 1.606
85 H GLU 14 H GLU 14 -11.764 7.716 -2.677
86 HA GLU 14 HA GLU 14 -12.495 5.390 -1.230
87 HB2 GLU 14 2HB GLU 14 -12.332 6.170 -4.157
88 HB3 GLU 14 3HB GLU 14 -12.842 4.529 -3.661
89 HG2 GLU 14 2HG GLU 14 -14.582 5.538 -2.184
90 HG3 GLU 14 3HG GLU 14 -14.123 7.148 -2.755
91 H GLU 15 H GLU 15 -9.829 5.830 -3.646
92 HA GLU 15 HA GLU 15 -8.609 3.331 -2.553
93 HB2 GLU 15 2HB GLU 15 -7.987 2.858 -4.942
94 HB3 GLU 15 3HB GLU 15 -9.685 2.657 -4.527
95 HG2 GLU 15 2HG GLU 15 -10.379 4.537 -5.733
96 HG3 GLU 15 3HG GLU 15 -8.805 5.310 -5.693
97 H LYS 16 H LYS 16 -7.168 4.688 -1.268
98 HA LYS 16 HA LYS 16 -5.117 6.009 -2.972
99 HB2 LYS 16 2HB LYS 16 -4.762 7.538 -0.919
100 HB3 LYS 16 3HB LYS 16 -6.072 7.879 -2.042
101 HG2 LYS 16 2HG LYS 16 -7.726 6.936 -0.569
102 HG3 LYS 16 3HG LYS 16 -6.457 6.334 0.507
103 HD2 LYS 16 2HD LYS 16 -7.603 8.412 1.322
104 HD3 LYS 16 3HD LYS 16 -5.848 8.608 1.156
105 HE2 LYS 16 2HE LYS 16 -6.036 9.933 -0.791
106 HE3 LYS 16 3HE LYS 16 -7.646 9.329 -1.164
107 HZ1 LYS 16 1HZ LYS 16 -8.501 10.565 0.716
108 HZ2 LYS 16 2HZ LYS 16 -6.999 11.224 0.997
109 HZ3 LYS 16 3HZ LYS 16 -7.818 11.512 -0.415
110 H CYS 17 H CYS 17 -3.164 5.676 -2.684
111 HA CYS 17 HA CYS 17 -1.859 3.486 -1.263
112 HB2 CYS 17 2HB CYS 17 -1.178 4.708 -3.382
113 HB3 CYS 17 3HB CYS 17 -0.963 6.141 -2.415
114 H THR 18 H THR 18 -2.027 3.520 0.988
115 HA THR 18 HA THR 18 -2.255 5.948 2.449
116 HB THR 18 HB THR 18 -2.792 3.435 3.047
117 HG1 THR 18 1HG THR 18 -3.331 5.270 4.298
118 HG21 THR 18 1HG2 THR 18 -0.328 2.814 3.096
119 HG22 THR 18 2HG2 THR 18 -0.179 3.827 4.548
120 HG23 THR 18 3HG2 THR 18 -1.254 2.419 4.570
121 H ILE 19 H ILE 19 0.576 4.451 1.028
122 HA ILE 19 HA ILE 19 2.446 5.504 2.948
123 HB ILE 19 HB ILE 19 2.590 4.087 0.287
124 HG12 ILE 19 2HG1 ILE 19 3.668 3.193 2.982
125 HG13 ILE 19 3HG1 ILE 19 1.952 3.010 2.614
126 HG21 ILE 19 1HG2 ILE 19 4.535 5.515 0.296
127 HG22 ILE 19 2HG2 ILE 19 4.862 5.152 2.007
128 HG23 ILE 19 3HG2 ILE 19 5.079 3.900 0.766
129 HD11 ILE 19 1HD1 ILE 19 4.185 1.867 0.912
130 HD12 ILE 19 2HD1 ILE 19 3.182 0.972 2.069
131 HD13 ILE 19 3HD1 ILE 19 2.442 1.703 0.623
132 H CYS 20 H CYS 20 1.567 6.336 -0.498
133 HA CYS 20 HA CYS 20 3.062 8.944 -0.216
134 HB2 CYS 20 2HB CYS 20 2.646 9.176 -2.570
135 HB3 CYS 20 3HB CYS 20 3.530 7.688 -2.218
136 H LEU 21 H LEU 21 0.113 7.799 0.761
137 HA LEU 21 HA LEU 21 -1.873 8.697 1.210
138 HB2 LEU 21 2HB LEU 21 -0.057 11.082 1.648
139 HB3 LEU 21 3HB LEU 21 -1.722 10.995 2.232
140 HG LEU 21 HG LEU 21 0.393 8.927 2.969
141 HD11 LEU 21 1HD1 LEU 21 -0.497 11.390 4.504
142 HD12 LEU 21 2HD1 LEU 21 0.572 10.098 5.112
143 HD13 LEU 21 3HD1 LEU 21 1.100 11.115 3.760
144 HD21 LEU 21 1HD2 LEU 21 -1.181 8.435 4.823
145 HD22 LEU 21 2HD2 LEU 21 -2.322 9.646 4.191
146 HD23 LEU 21 3HD2 LEU 21 -1.953 8.171 3.266
147 H SER 22 H SER 22 -1.690 8.439 -1.464
148 HA SER 22 HA SER 22 -3.217 10.787 -2.467
149 HB2 SER 22 2HB SER 22 -0.832 9.471 -3.840
150 HB3 SER 22 3HB SER 22 -1.928 10.647 -4.596
151 HG SER 22 HG SER 22 -0.318 11.095 -2.289
152 H ILE 23 H ILE 23 -4.704 10.209 -4.213
153 HA ILE 23 HA ILE 23 -5.744 7.561 -4.109
154 HB ILE 23 HB ILE 23 -6.231 10.117 -5.654
155 HG12 ILE 23 2HG1 ILE 23 -7.027 9.811 -3.277
156 HG13 ILE 23 3HG1 ILE 23 -8.269 10.198 -4.456
157 HG21 ILE 23 1HG2 ILE 23 -8.264 9.078 -6.658
158 HG22 ILE 23 2HG2 ILE 23 -6.734 8.557 -7.349
159 HG23 ILE 23 3HG2 ILE 23 -7.605 7.472 -6.250
160 HD11 ILE 23 1HD1 ILE 23 -8.911 8.424 -2.795
161 HD12 ILE 23 2HD1 ILE 23 -9.153 7.993 -4.492
162 HD13 ILE 23 3HD1 ILE 23 -7.771 7.360 -3.578
163 H LEU 24 H LEU 24 -5.938 6.195 -5.947
164 HA LEU 24 HA LEU 24 -3.446 5.951 -7.507
165 HB2 LEU 24 2HB LEU 24 -5.761 4.081 -6.816
166 HB3 LEU 24 3HB LEU 24 -4.280 3.570 -7.632
167 HG LEU 24 HG LEU 24 -4.221 4.830 -4.845
168 HD11 LEU 24 1HD1 LEU 24 -5.601 2.837 -4.841
169 HD12 LEU 24 2HD1 LEU 24 -4.305 1.929 -5.659
170 HD13 LEU 24 3HD1 LEU 24 -4.058 2.580 -4.001
171 HD21 LEU 24 1HD2 LEU 24 -2.106 4.974 -5.838
172 HD22 LEU 24 2HD2 LEU 24 -2.051 3.444 -4.904
173 HD23 LEU 24 3HD2 LEU 24 -2.266 3.395 -6.658
174 H GLU 25 H GLU 25 -4.920 4.125 -9.400
175 HA GLU 25 HA GLU 25 -7.131 5.511 -10.429
176 HB2 GLU 25 2HB GLU 25 -6.285 5.954 -12.693
177 HB3 GLU 25 3HB GLU 25 -5.352 6.875 -11.502
178 HG2 GLU 25 2HG GLU 25 -3.561 5.183 -11.587
179 HG3 GLU 25 3HG GLU 25 -4.471 4.240 -12.766
180 H GLU 26 H GLU 26 -7.952 4.228 -12.378
181 HA GLU 26 HA GLU 26 -7.538 1.350 -11.924
182 HB2 GLU 26 2HB GLU 26 -9.814 2.263 -12.271
183 HB3 GLU 26 3HB GLU 26 -9.354 2.828 -13.883
184 HG2 GLU 26 2HG GLU 26 -8.881 0.465 -14.557
185 HG3 GLU 26 3HG GLU 26 -9.281 -0.073 -12.925
186 H GLY 27 H GLY 27 -5.329 1.153 -12.577
187 HA2 GLY 27 2HA GLY 27 -4.769 0.249 -15.102
188 HA3 GLY 27 3HA GLY 27 -4.548 1.999 -15.275
189 H GLU 28 H GLU 28 -3.591 2.397 -12.523
190 HA GLU 28 HA GLU 28 -0.818 2.098 -12.958
191 HB2 GLU 28 2HB GLU 28 -2.650 3.131 -10.891
192 HB3 GLU 28 3HB GLU 28 -1.213 2.442 -10.176
193 HG2 GLU 28 2HG GLU 28 -0.939 4.344 -12.524
194 HG3 GLU 28 3HG GLU 28 -1.219 4.960 -10.886
195 H ASP 29 H ASP 29 0.695 1.043 -11.597
196 HA ASP 29 HA ASP 29 0.027 -1.807 -11.183
197 HB2 ASP 29 2HB ASP 29 2.579 -0.217 -11.227
198 HB3 ASP 29 3HB ASP 29 2.520 -1.693 -10.268
199 H VAL 30 H VAL 30 -0.580 -2.595 -9.316
200 HA VAL 30 HA VAL 30 -0.205 -1.066 -6.817
201 HB VAL 30 HB VAL 30 -2.551 -1.445 -6.232
202 HG11 VAL 30 1HG1 VAL 30 -2.312 0.080 -8.849
203 HG12 VAL 30 2HG1 VAL 30 -3.526 0.315 -7.587
204 HG13 VAL 30 3HG1 VAL 30 -1.826 0.703 -7.261
205 HG21 VAL 30 1HG2 VAL 30 -3.053 -3.392 -7.687
206 HG22 VAL 30 2HG2 VAL 30 -4.218 -2.077 -7.911
207 HG23 VAL 30 3HG2 VAL 30 -2.948 -2.337 -9.118
208 H ARG 31 H ARG 31 -1.282 -2.668 -4.998
209 HA ARG 31 HA ARG 31 -0.270 -5.369 -5.500
210 HB2 ARG 31 2HB ARG 31 1.335 -3.179 -4.513
211 HB3 ARG 31 3HB ARG 31 1.084 -4.247 -3.155
212 HG2 ARG 31 2HG ARG 31 1.995 -5.361 -5.843
213 HG3 ARG 31 3HG ARG 31 3.122 -4.546 -4.763
214 HD2 ARG 31 2HD ARG 31 3.502 -6.536 -3.927
215 HD3 ARG 31 3HD ARG 31 2.052 -6.231 -2.959
216 HE ARG 31 HE ARG 31 1.580 -7.507 -5.547
217 HH11 ARG 31 1HH1 ARG 31 1.847 -10.819 -4.372
218 HH12 ARG 31 2HH1 ARG 31 1.543 -9.825 -5.747
219 HH21 ARG 31 1HH2 ARG 31 2.395 -9.824 -2.288
220 HH22 ARG 31 2HH2 ARG 31 2.241 -8.117 -2.120
221 H ARG 32 H ARG 32 -0.185 -6.510 -3.173
222 HA ARG 32 HA ARG 32 -2.349 -5.500 -1.493
223 HB2 ARG 32 2HB ARG 32 -3.452 -7.042 -3.142
224 HB3 ARG 32 3HB ARG 32 -2.259 -8.282 -2.778
225 HG2 ARG 32 2HG ARG 32 -4.387 -8.771 -1.666
226 HG3 ARG 32 3HG ARG 32 -3.096 -8.530 -0.506
227 HD2 ARG 32 2HD ARG 32 -4.785 -7.344 0.475
228 HD3 ARG 32 3HD ARG 32 -3.986 -6.052 -0.371
229 HE ARG 32 HE ARG 32 -6.595 -7.217 -0.972
230 HH11 ARG 32 1HH1 ARG 32 -7.298 -4.981 -3.585
231 HH12 ARG 32 2HH1 ARG 32 -7.924 -6.238 -2.589
232 HH21 ARG 32 1HH2 ARG 32 -5.023 -4.352 -3.413
233 HH22 ARG 32 2HH2 ARG 32 -4.095 -4.919 -2.099
234 H LEU 33 H LEU 33 -2.295 -6.191 0.608
235 HA LEU 33 HA LEU 33 -0.186 -7.979 1.463
236 HB2 LEU 33 2HB LEU 33 -0.088 -6.248 3.476
237 HB3 LEU 33 3HB LEU 33 0.945 -6.034 2.074
238 HG LEU 33 HG LEU 33 -1.764 -4.658 2.178
239 HD11 LEU 33 1HD1 LEU 33 -0.638 -4.206 4.341
240 HD12 LEU 33 2HD1 LEU 33 0.847 -3.741 3.482
241 HD13 LEU 33 3HD1 LEU 33 -0.618 -2.760 3.326
242 HD21 LEU 33 1HD2 LEU 33 -0.452 -2.870 0.982
243 HD22 LEU 33 2HD2 LEU 33 0.928 -3.989 0.929
244 HD23 LEU 33 3HD2 LEU 33 -0.580 -4.353 0.064
245 HA PRO 34 HA PRO 34 -3.162 -10.093 3.413
246 HB2 PRO 34 2HB PRO 34 -2.057 -10.957 5.794
247 HB3 PRO 34 3HB PRO 34 -1.575 -11.554 4.176
248 HG2 PRO 34 2HG PRO 34 -0.230 -9.439 5.867
249 HG3 PRO 34 3HG PRO 34 0.515 -10.782 4.937
250 HD2 PRO 34 2HD PRO 34 0.376 -8.211 4.024
251 HD3 PRO 34 3HD PRO 34 0.322 -9.579 2.915
252 H CYS 35 H CYS 35 -1.894 -7.420 5.337
253 HA CYS 35 HA CYS 35 -4.518 -7.107 6.820
254 HB2 CYS 35 2HB CYS 35 -2.675 -6.705 8.218
255 HB3 CYS 35 3HB CYS 35 -1.867 -5.698 6.999
256 H MET 36 H MET 36 -4.858 -7.366 4.266
257 HA MET 36 HA MET 36 -5.966 -6.422 2.537
258 HB2 MET 36 2HB MET 36 -7.551 -5.821 5.062
259 HB3 MET 36 3HB MET 36 -8.191 -5.718 3.416
260 HG2 MET 36 2HG MET 36 -7.183 -8.167 3.194
261 HG3 MET 36 3HG MET 36 -7.315 -8.149 4.950
262 HE1 MET 36 1HE MET 36 -10.783 -8.050 1.870
263 HE2 MET 36 2HE MET 36 -9.754 -6.618 2.063
264 HE3 MET 36 3HE MET 36 -9.048 -8.156 1.505
265 H HIS 37 H HIS 37 -4.130 -4.894 2.273
266 HA HIS 37 HA HIS 37 -5.470 -2.268 2.073
267 HB2 HIS 37 1HB HIS 37 -2.863 -2.924 3.370
268 HB3 HIS 37 2HB HIS 37 -2.923 -1.474 2.382
269 HD2 HIS 37 2HD HIS 37 -5.033 0.311 3.046
270 HE1 HIS 37 1HE HIS 37 -4.806 -0.682 7.186
271 HE2 HIS 37 2HE HIS 37 -5.674 1.026 5.486
272 H LEU 38 H LEU 38 -4.920 -1.031 0.270
273 HA LEU 38 HA LEU 38 -3.812 -2.606 -1.990
274 HB2 LEU 38 2HB LEU 38 -6.320 -2.079 -1.879
275 HB3 LEU 38 3HB LEU 38 -5.909 -0.377 -1.978
276 HG LEU 38 HG LEU 38 -5.398 -2.528 -4.081
277 HD11 LEU 38 1HD1 LEU 38 -7.197 -0.061 -4.067
278 HD12 LEU 38 2HD1 LEU 38 -7.034 -1.226 -5.390
279 HD13 LEU 38 3HD1 LEU 38 -7.751 -1.734 -3.850
280 HD21 LEU 38 1HD2 LEU 38 -3.563 -0.996 -4.293
281 HD22 LEU 38 2HD2 LEU 38 -4.752 -0.523 -5.517
282 HD23 LEU 38 3HD2 LEU 38 -4.633 0.392 -4.000
283 H PHE 39 H PHE 39 -1.742 -1.849 -2.171
284 HA PHE 39 HA PHE 39 -1.275 1.105 -1.934
285 HB2 PHE 39 2HB PHE 39 0.525 -1.272 -1.326
286 HB3 PHE 39 3HB PHE 39 1.101 0.378 -1.394
287 HD1 PHE 39 1HD PHE 39 -1.975 0.916 0.194
288 HD2 PHE 39 2HD PHE 39 1.830 -0.972 0.865
289 HE1 PHE 39 1HE PHE 39 -2.354 1.001 2.620
290 HE2 PHE 39 2HE PHE 39 1.464 -0.863 3.302
291 HZ PHE 39 HZ PHE 39 -0.660 0.092 4.194
292 H HIS 40 H HIS 40 0.605 1.815 -3.316
293 HA HIS 40 HA HIS 40 0.466 0.852 -6.071
294 HB2 HIS 40 1HB HIS 40 2.348 2.614 -4.482
295 HB3 HIS 40 2HB HIS 40 2.758 2.099 -6.106
296 HD2 HIS 40 2HD HIS 40 0.775 2.667 -8.058
297 HE1 HIS 40 1HE HIS 40 0.633 6.606 -6.476
298 HE2 HIS 40 2HE HIS 40 0.290 5.132 -8.561
299 H GLN 41 H GLN 41 2.087 -0.378 -7.157
300 HA GLN 41 HA GLN 41 3.362 -2.444 -5.622
301 HB2 GLN 41 2HB GLN 41 2.352 -2.474 -7.981
302 HB3 GLN 41 3HB GLN 41 3.871 -1.744 -8.526
303 HG2 GLN 41 2HG GLN 41 5.131 -3.696 -7.814
304 HG3 GLN 41 3HG GLN 41 3.732 -4.365 -6.977
305 HE21 GLN 41 1HE2 GLN 41 1.628 -4.364 -8.712
306 HE22 GLN 41 2HE2 GLN 41 2.109 -5.058 -10.247
307 H VAL 42 H VAL 42 4.349 0.702 -5.797
308 HA VAL 42 HA VAL 42 7.237 -0.035 -5.809
309 HB VAL 42 HB VAL 42 6.609 1.144 -7.799
310 HG11 VAL 42 1HG1 VAL 42 4.714 2.519 -7.058
311 HG12 VAL 42 2HG1 VAL 42 5.821 3.542 -6.094
312 HG13 VAL 42 3HG1 VAL 42 5.946 3.485 -7.853
313 HG21 VAL 42 1HG2 VAL 42 8.289 2.895 -5.954
314 HG22 VAL 42 2HG2 VAL 42 8.863 1.457 -6.827
315 HG23 VAL 42 3HG2 VAL 42 8.332 2.887 -7.729
316 H CYS 43 H CYS 43 4.867 2.386 -4.529
317 HA CYS 43 HA CYS 43 6.305 3.274 -2.244
318 HB2 CYS 43 2HB CYS 43 3.358 2.558 -2.399
319 HB3 CYS 43 3HB CYS 43 4.149 3.703 -1.326
320 H VAL 44 H VAL 44 4.392 0.211 -2.767
321 HA VAL 44 HA VAL 44 4.832 -0.556 -0.038
322 HB VAL 44 HB VAL 44 2.889 -1.186 -1.527
323 HG11 VAL 44 1HG1 VAL 44 3.118 -3.090 -2.935
324 HG12 VAL 44 2HG1 VAL 44 4.428 -1.983 -3.409
325 HG13 VAL 44 3HG1 VAL 44 4.792 -3.390 -2.396
326 HG21 VAL 44 1HG2 VAL 44 2.530 -3.236 -0.400
327 HG22 VAL 44 2HG2 VAL 44 4.270 -3.545 -0.211
328 HG23 VAL 44 3HG2 VAL 44 3.523 -2.247 0.712
329 H ASP 45 H ASP 45 6.775 -0.823 -2.929
330 HA ASP 45 HA ASP 45 8.145 -3.268 -2.206
331 HB2 ASP 45 2HB ASP 45 8.137 -2.329 -4.510
332 HB3 ASP 45 3HB ASP 45 9.093 -0.949 -3.947
333 H GLN 46 H GLN 46 9.048 0.199 -2.033
334 HA GLN 46 HA GLN 46 11.217 -0.195 -0.205
335 HB2 GLN 46 2HB GLN 46 9.447 2.161 -0.977
336 HB3 GLN 46 3HB GLN 46 10.603 2.346 0.341
337 HG2 GLN 46 2HG GLN 46 11.490 1.304 -2.374
338 HG3 GLN 46 3HG GLN 46 11.352 3.036 -2.030
339 HE21 GLN 46 1HE2 GLN 46 13.678 3.424 -2.195
340 HE22 GLN 46 2HE2 GLN 46 14.720 2.814 -0.914
341 H ALA 47 H ALA 47 7.731 0.119 0.411
342 HA ALA 47 HA ALA 47 7.952 0.404 3.231
343 HB1 ALA 47 1HB ALA 47 5.898 -1.218 1.684
344 HB2 ALA 47 2HB ALA 47 5.706 -0.512 3.302
345 HB3 ALA 47 3HB ALA 47 5.864 0.549 1.877
346 H LEU 48 H LEU 48 7.635 -2.615 1.292
347 HA LEU 48 HA LEU 48 7.781 -4.398 3.440
348 HB2 LEU 48 2HB LEU 48 6.895 -4.772 1.144
349 HB3 LEU 48 3HB LEU 48 8.535 -4.844 0.508
350 HG LEU 48 HG LEU 48 7.666 -6.686 2.762
351 HD11 LEU 48 1HD1 LEU 48 6.919 -8.338 1.098
352 HD12 LEU 48 2HD1 LEU 48 5.925 -6.876 1.034
353 HD13 LEU 48 3HD1 LEU 48 7.170 -7.149 -0.203
354 HD21 LEU 48 1HD2 LEU 48 10.079 -6.749 2.100
355 HD22 LEU 48 2HD2 LEU 48 9.267 -8.254 1.662
356 HD23 LEU 48 3HD2 LEU 48 9.607 -7.034 0.419
357 H ILE 49 H ILE 49 10.428 -3.280 1.228
358 HA ILE 49 HA ILE 49 12.404 -4.898 2.496
359 HB ILE 49 HB ILE 49 14.047 -3.629 1.337
360 HG12 ILE 49 2HG1 ILE 49 13.068 -1.589 -0.102
361 HG13 ILE 49 3HG1 ILE 49 12.100 -1.438 1.363
362 HG21 ILE 49 1HG2 ILE 49 13.328 -3.860 -0.939
363 HG22 ILE 49 2HG2 ILE 49 12.648 -5.177 0.030
364 HG23 ILE 49 3HG2 ILE 49 11.626 -3.818 -0.473
365 HD11 ILE 49 1HD1 ILE 49 15.107 -1.292 1.049
366 HD12 ILE 49 2HD1 ILE 49 14.017 -0.122 1.821
367 HD13 ILE 49 3HD1 ILE 49 14.402 -1.635 2.635
368 H THR 50 H THR 50 11.148 -1.625 3.263
369 HA THR 50 HA THR 50 13.170 -0.995 5.173
370 HB THR 50 HB THR 50 10.300 -0.066 4.794
371 HG1 THR 50 1HG THR 50 11.723 0.709 3.316
372 HG21 THR 50 1HG2 THR 50 10.822 1.772 6.372
373 HG22 THR 50 2HG2 THR 50 10.716 0.206 7.187
374 HG23 THR 50 3HG2 THR 50 12.312 0.928 6.851
375 H ASN 51 H ASN 51 9.934 -2.597 5.502
376 HA ASN 51 HA ASN 51 11.006 -4.508 7.278
377 HB2 ASN 51 2HB ASN 51 9.958 -2.064 8.540
378 HB3 ASN 51 3HB ASN 51 8.895 -3.406 8.894
379 HD21 ASN 51 1HD2 ASN 51 12.477 -3.750 8.499
380 HD22 ASN 51 2HD2 ASN 51 12.704 -4.256 10.162
381 H LYS 52 H LYS 52 9.604 -6.312 7.262
382 HA LYS 52 HA LYS 52 7.389 -6.102 5.366
383 HB2 LYS 52 2HB LYS 52 8.402 -8.478 7.008
384 HB3 LYS 52 3HB LYS 52 7.176 -8.518 5.746
385 HG2 LYS 52 2HG LYS 52 8.893 -9.105 4.415
386 HG3 LYS 52 3HG LYS 52 9.138 -7.367 4.306
387 HD2 LYS 52 2HD LYS 52 10.902 -7.450 5.980
388 HD3 LYS 52 3HD LYS 52 10.595 -9.169 6.291
389 HE2 LYS 52 2HE LYS 52 11.352 -8.110 3.535
390 HE3 LYS 52 3HE LYS 52 12.573 -8.550 4.738
391 HZ1 LYS 52 1HZ LYS 52 10.516 -10.460 3.841
392 HZ2 LYS 52 2HZ LYS 52 12.062 -10.398 3.231
393 HZ3 LYS 52 3HZ LYS 52 11.761 -10.760 4.785
394 H LYS 53 H LYS 53 6.293 -4.406 6.914
395 HA LYS 53 HA LYS 53 4.158 -5.956 8.161
396 HB2 LYS 53 2HB LYS 53 4.118 -4.212 10.076
397 HB3 LYS 53 3HB LYS 53 5.151 -5.636 10.218
398 HG2 LYS 53 2HG LYS 53 7.114 -4.429 9.939
399 HG3 LYS 53 3HG LYS 53 6.314 -3.067 9.118
400 HD2 LYS 53 2HD LYS 53 5.288 -2.305 11.132
401 HD3 LYS 53 3HD LYS 53 5.743 -3.763 12.029
402 HE2 LYS 53 2HE LYS 53 7.823 -1.926 10.788
403 HE3 LYS 53 3HE LYS 53 7.137 -1.589 12.385
404 HZ1 LYS 53 1HZ LYS 53 7.959 -3.707 13.155
405 HZ2 LYS 53 2HZ LYS 53 8.529 -4.085 11.646
406 HZ3 LYS 53 3HZ LYS 53 9.209 -2.883 12.440
407 H CYS 54 H CYS 54 2.215 -4.873 8.130
408 HA CYS 54 HA CYS 54 1.799 -2.812 6.090
409 HB2 CYS 54 2HB CYS 54 0.205 -4.596 6.587
410 HB3 CYS 54 3HB CYS 54 0.059 -4.040 8.258
411 HA PRO 55 HA PRO 55 3.188 0.304 8.918
412 HB2 PRO 55 2HB PRO 55 2.349 2.611 7.623
413 HB3 PRO 55 3HB PRO 55 3.762 1.624 7.143
414 HG2 PRO 55 2HG PRO 55 0.960 1.547 6.001
415 HG3 PRO 55 3HG PRO 55 2.518 1.554 5.120
416 HD2 PRO 55 2HD PRO 55 1.128 -0.741 5.582
417 HD3 PRO 55 3HD PRO 55 2.922 -0.719 5.651
418 H ILE 56 H ILE 56 -0.217 0.617 7.783
419 HA ILE 56 HA ILE 56 -0.882 2.158 10.212
420 HB ILE 56 HB ILE 56 -2.700 1.321 7.923
421 HG12 ILE 56 2HG1 ILE 56 -0.839 2.578 6.945
422 HG13 ILE 56 3HG1 ILE 56 -2.327 3.491 6.893
423 HG21 ILE 56 1HG2 ILE 56 -3.887 3.506 8.577
424 HG22 ILE 56 2HG2 ILE 56 -4.074 2.166 9.696
425 HG23 ILE 56 3HG2 ILE 56 -2.929 3.464 10.074
426 HD11 ILE 56 1HD1 ILE 56 -0.414 4.912 7.490
427 HD12 ILE 56 2HD1 ILE 56 -1.594 4.874 8.807
428 HD13 ILE 56 3HD1 ILE 56 -0.093 3.922 8.926
429 H CYS 57 H CYS 57 -0.178 -0.937 10.070
430 HA CYS 57 HA CYS 57 -2.587 -1.855 11.647
431 HB2 CYS 57 2HB CYS 57 -1.558 -3.942 9.931
432 HB3 CYS 57 3HB CYS 57 -3.183 -3.363 10.246
433 H ARG 58 H ARG 58 0.602 -2.933 10.561
434 HA ARG 58 HA ARG 58 2.477 -3.264 11.957
435 HB2 ARG 58 2HB ARG 58 1.286 -2.901 14.142
436 HB3 ARG 58 3HB ARG 58 0.644 -4.563 14.010
437 HG2 ARG 58 2HG ARG 58 2.972 -5.451 14.028
438 HG3 ARG 58 3HG ARG 58 3.590 -3.796 14.064
439 HD2 ARG 58 2HD ARG 58 3.754 -4.478 16.264
440 HD3 ARG 58 3HD ARG 58 2.243 -3.576 16.291
441 HE ARG 58 HE ARG 58 2.702 -6.473 16.550
442 HH11 ARG 58 1HH1 ARG 58 -0.591 -7.118 17.575
443 HH12 ARG 58 2HH1 ARG 58 1.009 -7.745 17.463
444 HH21 ARG 58 1HH2 ARG 58 -1.057 -4.919 16.805
445 HH22 ARG 58 2HH2 ARG 58 0.217 -3.992 16.108
446 H VAL 59 H VAL 59 -0.235 -5.370 11.307
447 HA VAL 59 HA VAL 59 0.847 -7.866 11.743
448 HB VAL 59 HB VAL 59 -0.905 -7.135 9.391
449 HG11 VAL 59 1HG1 VAL 59 -1.852 -9.415 9.695
450 HG12 VAL 59 2HG1 VAL 59 -0.141 -9.454 9.274
451 HG13 VAL 59 3HG1 VAL 59 -0.644 -9.733 10.959
452 HG21 VAL 59 1HG2 VAL 59 -1.684 -7.739 12.282
453 HG22 VAL 59 2HG2 VAL 59 -1.975 -6.213 11.413
454 HG23 VAL 59 3HG2 VAL 59 -2.832 -7.669 10.932
455 H ASP 60 H ASP 60 2.138 -9.285 10.661
456 HA ASP 60 HA ASP 60 4.180 -8.110 9.015
457 HB2 ASP 60 2HB ASP 60 4.386 -10.001 10.758
458 HB3 ASP 60 3HB ASP 60 3.775 -11.078 9.497
459 H ILE 61 H ILE 61 4.647 -8.662 6.823
460 HA ILE 61 HA ILE 61 2.301 -9.695 5.294
461 HB ILE 61 HB ILE 61 2.727 -8.082 3.612
462 HG12 ILE 61 2HG1 ILE 61 4.959 -6.953 5.345
463 HG13 ILE 61 3HG1 ILE 61 5.244 -7.974 3.926
464 HG21 ILE 61 1HG2 ILE 61 2.806 -6.517 6.205
465 HG22 ILE 61 2HG2 ILE 61 1.903 -6.139 4.716
466 HG23 ILE 61 3HG2 ILE 61 1.394 -7.480 5.757
467 HD11 ILE 61 1HD1 ILE 61 3.920 -6.416 2.567
468 HD12 ILE 61 2HD1 ILE 61 3.872 -5.294 3.961
469 HD13 ILE 61 3HD1 ILE 61 5.439 -5.735 3.232
470 H GLU 62 H GLU 62 5.587 -10.126 5.913
471 HA GLU 62 HA GLU 62 6.629 -11.155 3.523
472 HB2 GLU 62 2HB GLU 62 7.885 -10.783 5.651
473 HB3 GLU 62 3HB GLU 62 7.112 -12.208 6.346
474 HG2 GLU 62 2HG GLU 62 8.095 -13.613 4.521
475 HG3 GLU 62 3HG GLU 62 8.824 -12.161 3.821
476 H ALA 63 H ALA 63 4.961 -12.217 2.382
477 HA ALA 63 HA ALA 63 3.874 -14.718 3.437
478 HB1 ALA 63 1HB ALA 63 2.893 -14.939 1.183
479 HB2 ALA 63 2HB ALA 63 2.601 -13.314 1.837
480 HB3 ALA 63 3HB ALA 63 3.867 -13.564 0.610
481 H GLN 64 H GLN 64 4.260 -16.765 2.343
482 HA GLN 64 HA GLN 64 6.924 -17.586 2.211
483 HB2 GLN 64 2HB GLN 64 5.967 -19.681 1.315
484 HB3 GLN 64 3HB GLN 64 5.058 -19.036 2.678
485 HG2 GLN 64 2HG GLN 64 3.616 -17.903 0.652
486 HG3 GLN 64 3HG GLN 64 4.259 -19.295 -0.210
487 HE21 GLN 64 1HE2 GLN 64 2.525 -20.727 -0.353
488 HE22 GLN 64 2HE2 GLN 64 1.548 -21.165 1.044
489 H LEU 65 H LEU 65 8.176 -16.214 0.838
490 HA LEU 65 HA LEU 65 7.964 -16.984 -2.020
491 HB2 LEU 65 2HB LEU 65 6.718 -14.835 -1.572
492 HB3 LEU 65 3HB LEU 65 8.233 -14.116 -1.033
493 HG LEU 65 HG LEU 65 9.207 -14.562 -3.323
494 HD11 LEU 65 1HD1 LEU 65 7.530 -15.075 -5.152
495 HD12 LEU 65 2HD1 LEU 65 7.868 -16.445 -4.094
496 HD13 LEU 65 3HD1 LEU 65 6.364 -15.520 -3.887
497 HD21 LEU 65 1HD2 LEU 65 6.588 -12.999 -3.264
498 HD22 LEU 65 2HD2 LEU 65 8.181 -12.390 -2.761
499 HD23 LEU 65 3HD2 LEU 65 7.892 -12.804 -4.459
500 HA PRO 66 HA PRO 66 12.239 -17.095 -0.291
501 HB2 PRO 66 2HB PRO 66 13.010 -19.566 -1.153
502 HB3 PRO 66 3HB PRO 66 11.923 -19.342 0.248
503 HG2 PRO 66 2HG PRO 66 11.128 -19.945 -2.620
504 HG3 PRO 66 3HG PRO 66 10.600 -20.787 -1.129
505 HD2 PRO 66 2HD PRO 66 9.113 -18.814 -2.292
506 HD3 PRO 66 3HD PRO 66 9.187 -18.997 -0.512
507 H SER 67 H SER 67 12.465 -15.290 -1.900
508 HA SER 67 HA SER 67 14.260 -16.129 -4.083
509 HB2 SER 67 2HB SER 67 12.012 -16.312 -5.085
510 HB3 SER 67 3HB SER 67 11.648 -14.645 -4.599
511 HG SER 67 HG SER 67 13.363 -13.968 -5.914
512 H GLU 68 H GLU 68 15.179 -14.947 -1.967
513 HA GLU 68 HA GLU 68 16.651 -13.322 -1.446
514 HB2 GLU 68 2HB GLU 68 16.702 -12.819 -3.961
515 HB3 GLU 68 3HB GLU 68 15.607 -11.468 -3.610
516 HG2 GLU 68 2HG GLU 68 17.258 -10.421 -2.179
517 HG3 GLU 68 3HG GLU 68 18.283 -11.861 -2.222
518 H SER 69 H SER 69 16.638 -11.120 -0.438
519 HA SER 69 HA SER 69 15.876 -9.716 1.118
520 HB2 SER 69 2HB SER 69 14.226 -9.008 -0.682
521 HB3 SER 69 3HB SER 69 13.056 -10.114 0.074
522 HG SER 69 HG SER 69 13.635 -8.976 2.062
Start of MODEL 23
1 H1 MET 1 H1 MET 1 -24.521 47.406 -4.203
2 H2 MET 1 H2 MET 1 -23.289 48.516 -4.164
3 H3 MET 1 H3 MET 1 -23.525 47.553 -5.490
4 HA MET 1 HA MET 1 -21.674 46.706 -4.269
5 HB2 MET 1 2HB MET 1 -23.718 46.650 -2.011
6 HB3 MET 1 3HB MET 1 -22.223 45.699 -1.989
7 HG2 MET 1 2HG MET 1 -20.874 47.729 -2.211
8 HG3 MET 1 3HG MET 1 -22.336 48.726 -2.256
9 HE1 MET 1 1HE MET 1 -20.599 49.501 1.220
10 HE2 MET 1 2HE MET 1 -19.745 48.999 -0.256
11 HE3 MET 1 3HE MET 1 -21.082 50.171 -0.355
12 H LYS 2 H LYS 2 -21.398 44.294 -3.958
13 HA LYS 2 HA LYS 2 -23.688 42.615 -4.120
14 HB2 LYS 2 2HB LYS 2 -22.668 43.415 -6.659
15 HB3 LYS 2 3HB LYS 2 -21.940 41.838 -6.366
16 HG2 LYS 2 2HG LYS 2 -24.344 41.056 -5.732
17 HG3 LYS 2 3HG LYS 2 -24.884 42.582 -6.459
18 HD2 LYS 2 2HD LYS 2 -23.543 41.859 -8.559
19 HD3 LYS 2 3HD LYS 2 -23.363 40.289 -7.762
20 HE2 LYS 2 2HE LYS 2 -25.251 39.914 -9.057
21 HE3 LYS 2 3HE LYS 2 -25.964 40.364 -7.502
22 HZ1 LYS 2 1HZ LYS 2 -26.203 42.627 -8.391
23 HZ2 LYS 2 2HZ LYS 2 -25.601 42.130 -9.843
24 HZ3 LYS 2 3HZ LYS 2 -27.027 41.525 -9.297
25 H GLN 3 H GLN 3 -22.567 40.197 -4.519
26 HA GLN 3 HA GLN 3 -19.781 40.152 -3.871
27 HB2 GLN 3 2HB GLN 3 -21.425 39.948 -1.633
28 HB3 GLN 3 3HB GLN 3 -21.229 38.252 -2.098
29 HG2 GLN 3 2HG GLN 3 -18.727 38.629 -2.147
30 HG3 GLN 3 3HG GLN 3 -19.006 40.289 -1.602
31 HE21 GLN 3 1HE2 GLN 3 -18.955 40.604 0.651
32 HE22 GLN 3 2HE2 GLN 3 -19.175 39.272 1.781
33 H ASP 4 H ASP 4 -19.262 37.495 -3.815
34 HA ASP 4 HA ASP 4 -21.037 36.009 -5.535
35 HB2 ASP 4 2HB ASP 4 -19.540 37.599 -7.010
36 HB3 ASP 4 3HB ASP 4 -18.218 36.518 -6.559
37 H GLY 5 H GLY 5 -19.879 33.697 -5.837
38 HA2 GLY 5 2HA GLY 5 -17.750 33.117 -3.959
39 HA3 GLY 5 3HA GLY 5 -19.345 32.626 -3.350
40 H GLU 6 H GLU 6 -17.228 30.750 -3.956
41 HA GLU 6 HA GLU 6 -18.477 29.173 -6.081
42 HB2 GLU 6 2HB GLU 6 -15.694 30.366 -6.136
43 HB3 GLU 6 3HB GLU 6 -15.863 28.701 -6.682
44 HG2 GLU 6 2HG GLU 6 -17.513 31.006 -7.794
45 HG3 GLU 6 3HG GLU 6 -16.029 30.384 -8.519
46 H GLU 7 H GLU 7 -17.308 27.021 -6.133
47 HA GLU 7 HA GLU 7 -16.042 26.232 -3.583
48 HB2 GLU 7 2HB GLU 7 -18.497 25.924 -3.229
49 HB3 GLU 7 3HB GLU 7 -18.555 24.851 -4.612
50 HG2 GLU 7 2HG GLU 7 -18.491 23.454 -2.703
51 HG3 GLU 7 3HG GLU 7 -16.862 23.353 -3.357
52 H GLY 8 H GLY 8 -17.240 23.657 -5.441
53 HA2 GLY 8 2HA GLY 8 -15.791 23.257 -7.693
54 HA3 GLY 8 3HA GLY 8 -14.583 22.991 -6.412
55 H THR 9 H THR 9 -14.925 20.731 -7.761
56 HA THR 9 HA THR 9 -16.354 19.013 -5.885
57 HB THR 9 HB THR 9 -17.187 17.678 -7.905
58 HG1 THR 9 1HG THR 9 -17.461 18.834 -9.798
59 HG21 THR 9 1HG2 THR 9 -18.705 19.029 -6.431
60 HG22 THR 9 2HG2 THR 9 -18.513 20.397 -7.551
61 HG23 THR 9 3HG2 THR 9 -19.270 18.894 -8.108
62 H GLU 10 H GLU 10 -15.518 16.706 -6.164
63 HA GLU 10 HA GLU 10 -13.097 16.392 -7.745
64 HB2 GLU 10 2HB GLU 10 -13.139 16.264 -4.694
65 HB3 GLU 10 3HB GLU 10 -11.948 15.400 -5.673
66 HG2 GLU 10 2HG GLU 10 -11.324 17.593 -6.755
67 HG3 GLU 10 3HG GLU 10 -12.341 18.410 -5.555
68 H GLU 11 H GLU 11 -12.365 13.923 -7.306
69 HA GLU 11 HA GLU 11 -14.608 12.165 -6.733
70 HB2 GLU 11 2HB GLU 11 -14.499 11.090 -8.936
71 HB3 GLU 11 3HB GLU 11 -15.022 12.771 -9.065
72 HG2 GLU 11 2HG GLU 11 -12.610 13.380 -9.656
73 HG3 GLU 11 3HG GLU 11 -12.275 11.645 -9.748
74 H ASP 12 H ASP 12 -13.944 10.047 -6.468
75 HA ASP 12 HA ASP 12 -12.802 8.559 -5.341
76 HB2 ASP 12 2HB ASP 12 -11.650 8.268 -7.461
77 HB3 ASP 12 3HB ASP 12 -10.399 9.404 -6.941
78 H THR 13 H THR 13 -12.615 8.765 -3.260
79 HA THR 13 HA THR 13 -10.337 10.262 -2.150
80 HB THR 13 HB THR 13 -13.203 10.573 -1.167
81 HG1 THR 13 1HG THR 13 -11.737 11.877 -3.067
82 HG21 THR 13 1HG2 THR 13 -12.209 12.522 0.099
83 HG22 THR 13 2HG2 THR 13 -11.677 10.950 0.699
84 HG23 THR 13 3HG2 THR 13 -10.593 11.921 -0.330
85 H GLU 14 H GLU 14 -11.105 7.426 -2.797
86 HA GLU 14 HA GLU 14 -11.178 6.271 -0.055
87 HB2 GLU 14 2HB GLU 14 -12.540 5.422 -2.653
88 HB3 GLU 14 3HB GLU 14 -12.310 4.360 -1.272
89 HG2 GLU 14 2HG GLU 14 -14.318 5.077 -0.604
90 HG3 GLU 14 3HG GLU 14 -13.441 6.462 0.030
91 H GLU 15 H GLU 15 -10.077 5.682 -3.511
92 HA GLU 15 HA GLU 15 -8.428 3.490 -2.456
93 HB2 GLU 15 2HB GLU 15 -8.671 4.595 -5.280
94 HB3 GLU 15 3HB GLU 15 -7.765 3.157 -4.777
95 HG2 GLU 15 2HG GLU 15 -10.195 2.642 -3.610
96 HG3 GLU 15 3HG GLU 15 -10.712 3.548 -5.027
97 H LYS 16 H LYS 16 -7.131 4.639 -0.973
98 HA LYS 16 HA LYS 16 -5.134 6.436 -2.213
99 HB2 LYS 16 2HB LYS 16 -6.967 7.134 -0.431
100 HB3 LYS 16 3HB LYS 16 -5.758 6.548 0.736
101 HG2 LYS 16 2HG LYS 16 -4.100 8.070 -0.244
102 HG3 LYS 16 3HG LYS 16 -5.262 8.503 -1.519
103 HD2 LYS 16 2HD LYS 16 -6.789 9.457 0.214
104 HD3 LYS 16 3HD LYS 16 -5.492 9.209 1.418
105 HE2 LYS 16 2HE LYS 16 -3.957 10.546 -0.013
106 HE3 LYS 16 3HE LYS 16 -5.244 10.787 -1.192
107 HZ1 LYS 16 1HZ LYS 16 -6.458 12.024 0.462
108 HZ2 LYS 16 2HZ LYS 16 -5.277 11.760 1.590
109 HZ3 LYS 16 3HZ LYS 16 -4.952 12.668 0.264
110 H CYS 17 H CYS 17 -3.119 6.120 -1.954
111 HA CYS 17 HA CYS 17 -1.921 3.570 -0.944
112 HB2 CYS 17 2HB CYS 17 -1.142 4.860 -2.969
113 HB3 CYS 17 3HB CYS 17 -0.715 6.189 -1.910
114 H THR 18 H THR 18 -1.754 3.355 1.303
115 HA THR 18 HA THR 18 -1.833 5.614 3.012
116 HB THR 18 HB THR 18 -2.317 3.148 3.568
117 HG1 THR 18 1HG THR 18 -0.916 4.927 5.272
118 HG21 THR 18 1HG2 THR 18 0.082 2.428 3.012
119 HG22 THR 18 2HG2 THR 18 0.580 3.255 4.497
120 HG23 THR 18 3HG2 THR 18 -0.558 1.902 4.594
121 H ILE 19 H ILE 19 0.864 4.408 1.153
122 HA ILE 19 HA ILE 19 2.889 5.359 3.010
123 HB ILE 19 HB ILE 19 2.864 4.031 0.292
124 HG12 ILE 19 2HG1 ILE 19 4.186 2.995 2.807
125 HG13 ILE 19 3HG1 ILE 19 2.431 2.871 2.670
126 HG21 ILE 19 1HG2 ILE 19 4.757 5.465 0.201
127 HG22 ILE 19 2HG2 ILE 19 5.192 5.125 1.894
128 HG23 ILE 19 3HG2 ILE 19 5.384 3.867 0.653
129 HD11 ILE 19 1HD1 ILE 19 2.600 1.669 0.568
130 HD12 ILE 19 2HD1 ILE 19 4.372 1.796 0.596
131 HD13 ILE 19 3HD1 ILE 19 3.526 0.837 1.836
132 H CYS 20 H CYS 20 1.677 6.190 -0.294
133 HA CYS 20 HA CYS 20 3.242 8.717 -0.450
134 HB2 CYS 20 2HB CYS 20 0.889 7.799 -2.134
135 HB3 CYS 20 3HB CYS 20 2.063 9.069 -2.475
136 H LEU 21 H LEU 21 0.314 7.671 1.076
137 HA LEU 21 HA LEU 21 -1.654 8.587 1.596
138 HB2 LEU 21 2HB LEU 21 0.219 10.845 2.371
139 HB3 LEU 21 3HB LEU 21 -1.466 10.733 2.899
140 HG LEU 21 HG LEU 21 0.572 8.519 3.405
141 HD11 LEU 21 1HD1 LEU 21 -0.271 10.788 5.237
142 HD12 LEU 21 2HD1 LEU 21 0.746 9.391 5.682
143 HD13 LEU 21 3HD1 LEU 21 1.331 10.560 4.486
144 HD21 LEU 21 1HD2 LEU 21 -1.805 7.811 3.553
145 HD22 LEU 21 2HD2 LEU 21 -1.054 7.837 5.147
146 HD23 LEU 21 3HD2 LEU 21 -2.143 9.158 4.665
147 H SER 22 H SER 22 -1.376 8.588 -1.043
148 HA SER 22 HA SER 22 -2.751 11.057 -1.909
149 HB2 SER 22 2HB SER 22 -0.098 10.791 -2.423
150 HB3 SER 22 3HB SER 22 -0.760 9.895 -3.809
151 HG SER 22 HG SER 22 -0.525 12.220 -4.087
152 H ILE 23 H ILE 23 -4.067 10.642 -3.919
153 HA ILE 23 HA ILE 23 -5.355 8.080 -3.697
154 HB ILE 23 HB ILE 23 -5.700 10.611 -5.328
155 HG12 ILE 23 2HG1 ILE 23 -6.315 10.611 -2.890
156 HG13 ILE 23 3HG1 ILE 23 -7.616 11.017 -3.988
157 HG21 ILE 23 1HG2 ILE 23 -6.487 9.002 -6.830
158 HG22 ILE 23 2HG2 ILE 23 -7.303 8.053 -5.581
159 HG23 ILE 23 3HG2 ILE 23 -7.923 9.657 -6.046
160 HD11 ILE 23 1HD1 ILE 23 -7.264 8.225 -2.794
161 HD12 ILE 23 2HD1 ILE 23 -8.281 9.488 -2.102
162 HD13 ILE 23 3HD1 ILE 23 -8.652 8.837 -3.710
163 H LEU 24 H LEU 24 -5.715 6.667 -5.392
164 HA LEU 24 HA LEU 24 -3.394 6.181 -7.099
165 HB2 LEU 24 2HB LEU 24 -5.851 4.552 -6.252
166 HB3 LEU 24 3HB LEU 24 -4.494 3.889 -7.162
167 HG LEU 24 HG LEU 24 -4.211 5.100 -4.363
168 HD11 LEU 24 1HD1 LEU 24 -4.366 2.194 -5.186
169 HD12 LEU 24 2HD1 LEU 24 -3.988 2.826 -3.559
170 HD13 LEU 24 3HD1 LEU 24 -5.583 3.109 -4.273
171 HD21 LEU 24 1HD2 LEU 24 -2.042 3.731 -4.543
172 HD22 LEU 24 2HD2 LEU 24 -2.350 3.697 -6.283
173 HD23 LEU 24 3HD2 LEU 24 -2.171 5.262 -5.460
174 H GLU 25 H GLU 25 -4.773 4.605 -9.011
175 HA GLU 25 HA GLU 25 -7.196 5.966 -9.801
176 HB2 GLU 25 2HB GLU 25 -6.699 6.444 -12.066
177 HB3 GLU 25 3HB GLU 25 -5.474 7.244 -11.078
178 HG2 GLU 25 2HG GLU 25 -3.844 5.496 -11.606
179 HG3 GLU 25 3HG GLU 25 -5.056 4.595 -12.537
180 H GLU 26 H GLU 26 -8.138 4.752 -11.875
181 HA GLU 26 HA GLU 26 -8.552 2.083 -11.010
182 HB2 GLU 26 2HB GLU 26 -10.255 3.401 -12.183
183 HB3 GLU 26 3HB GLU 26 -9.252 3.455 -13.641
184 HG2 GLU 26 2HG GLU 26 -9.413 0.988 -13.859
185 HG3 GLU 26 3HG GLU 26 -10.310 0.903 -12.340
186 H GLY 27 H GLY 27 -6.990 0.559 -11.099
187 HA2 GLY 27 2HA GLY 27 -5.823 -1.123 -12.220
188 HA3 GLY 27 3HA GLY 27 -6.085 -0.275 -13.751
189 H GLU 28 H GLU 28 -4.704 1.583 -11.080
190 HA GLU 28 HA GLU 28 -2.246 2.043 -12.444
191 HB2 GLU 28 2HB GLU 28 -3.556 3.453 -10.741
192 HB3 GLU 28 3HB GLU 28 -2.893 2.401 -9.494
193 HG2 GLU 28 2HG GLU 28 -0.599 3.119 -10.140
194 HG3 GLU 28 3HG GLU 28 -1.271 4.094 -11.464
195 H ASP 29 H ASP 29 -0.082 1.575 -11.245
196 HA ASP 29 HA ASP 29 0.196 -1.234 -10.707
197 HB2 ASP 29 2HB ASP 29 2.459 -0.818 -10.344
198 HB3 ASP 29 3HB ASP 29 1.975 0.241 -11.639
199 H VAL 30 H VAL 30 -0.706 -2.096 -8.982
200 HA VAL 30 HA VAL 30 -0.138 -0.916 -6.351
201 HB VAL 30 HB VAL 30 -2.412 -1.154 -5.528
202 HG11 VAL 30 1HG1 VAL 30 -2.436 0.528 -8.056
203 HG12 VAL 30 2HG1 VAL 30 -3.492 0.700 -6.654
204 HG13 VAL 30 3HG1 VAL 30 -1.756 1.031 -6.492
205 HG21 VAL 30 1HG2 VAL 30 -4.318 -1.560 -7.031
206 HG22 VAL 30 2HG2 VAL 30 -3.209 -1.873 -8.379
207 HG23 VAL 30 3HG2 VAL 30 -3.247 -2.967 -6.974
208 H ARG 31 H ARG 31 -1.141 -2.633 -4.640
209 HA ARG 31 HA ARG 31 -0.772 -5.379 -5.654
210 HB2 ARG 31 2HB ARG 31 0.918 -5.921 -4.088
211 HB3 ARG 31 3HB ARG 31 1.490 -4.505 -4.957
212 HG2 ARG 31 2HG ARG 31 1.554 -3.229 -3.050
213 HG3 ARG 31 3HG ARG 31 -0.021 -3.723 -2.530
214 HD2 ARG 31 2HD ARG 31 1.522 -4.565 -0.906
215 HD3 ARG 31 3HD ARG 31 0.800 -5.886 -1.807
216 HE ARG 31 HE ARG 31 3.541 -4.811 -2.298
217 HH11 ARG 31 1HH1 ARG 31 4.819 -8.016 -2.862
218 HH12 ARG 31 2HH1 ARG 31 5.161 -6.329 -2.856
219 HH21 ARG 31 1HH2 ARG 31 2.645 -8.784 -2.360
220 HH22 ARG 31 2HH2 ARG 31 1.405 -7.669 -1.949
221 H ARG 32 H ARG 32 -1.123 -6.924 -3.700
222 HA ARG 32 HA ARG 32 -3.015 -5.738 -1.751
223 HB2 ARG 32 2HB ARG 32 -4.344 -7.202 -3.191
224 HB3 ARG 32 3HB ARG 32 -3.092 -8.450 -3.166
225 HG2 ARG 32 2HG ARG 32 -4.935 -9.137 -1.742
226 HG3 ARG 32 3HG ARG 32 -3.502 -8.865 -0.769
227 HD2 ARG 32 2HD ARG 32 -5.118 -7.817 0.502
228 HD3 ARG 32 3HD ARG 32 -4.480 -6.453 -0.407
229 HE ARG 32 HE ARG 32 -6.758 -7.846 -1.623
230 HH11 ARG 32 1HH1 ARG 32 -9.033 -5.271 -0.883
231 HH12 ARG 32 2HH1 ARG 32 -8.824 -6.795 -1.662
232 HH21 ARG 32 1HH2 ARG 32 -7.267 -4.360 0.432
233 HH22 ARG 32 2HH2 ARG 32 -5.685 -5.030 0.221
234 H LEU 33 H LEU 33 -2.622 -6.353 0.397
235 HA LEU 33 HA LEU 33 -0.439 -8.194 0.940
236 HB2 LEU 33 2HB LEU 33 0.207 -6.498 2.747
237 HB3 LEU 33 3HB LEU 33 0.649 -6.072 1.112
238 HG LEU 33 HG LEU 33 -2.034 -5.038 1.901
239 HD11 LEU 33 1HD1 LEU 33 0.525 -4.206 3.352
240 HD12 LEU 33 2HD1 LEU 33 -0.953 -3.253 3.349
241 HD13 LEU 33 3HD1 LEU 33 -0.957 -4.863 4.086
242 HD21 LEU 33 1HD2 LEU 33 0.457 -3.696 0.814
243 HD22 LEU 33 2HD2 LEU 33 -0.887 -4.345 -0.162
244 HD23 LEU 33 3HD2 LEU 33 -1.161 -2.982 0.930
245 HA PRO 34 HA PRO 34 -3.162 -10.270 3.092
246 HB2 PRO 34 2HB PRO 34 -2.012 -11.130 5.460
247 HB3 PRO 34 3HB PRO 34 -1.551 -11.700 3.827
248 HG2 PRO 34 2HG PRO 34 -0.195 -9.619 5.535
249 HG3 PRO 34 3HG PRO 34 0.545 -10.891 4.509
250 HD2 PRO 34 2HD PRO 34 0.273 -8.263 3.785
251 HD3 PRO 34 3HD PRO 34 0.320 -9.559 2.587
252 H CYS 35 H CYS 35 -1.895 -7.742 5.265
253 HA CYS 35 HA CYS 35 -4.598 -7.394 6.569
254 HB2 CYS 35 2HB CYS 35 -2.828 -7.132 8.052
255 HB3 CYS 35 3HB CYS 35 -1.913 -6.086 6.939
256 H MET 36 H MET 36 -4.878 -7.477 3.988
257 HA MET 36 HA MET 36 -6.203 -6.561 2.478
258 HB2 MET 36 2HB MET 36 -7.336 -6.161 5.245
259 HB3 MET 36 3HB MET 36 -8.308 -5.795 3.814
260 HG2 MET 36 2HG MET 36 -6.980 -8.475 4.315
261 HG3 MET 36 3HG MET 36 -8.673 -8.085 4.629
262 HE1 MET 36 1HE MET 36 -7.982 -10.602 2.916
263 HE2 MET 36 2HE MET 36 -9.631 -10.018 3.250
264 HE3 MET 36 3HE MET 36 -9.150 -10.416 1.586
265 H HIS 37 H HIS 37 -4.126 -4.716 2.766
266 HA HIS 37 HA HIS 37 -5.688 -2.273 2.120
267 HB2 HIS 37 1HB HIS 37 -2.977 -2.633 3.397
268 HB3 HIS 37 2HB HIS 37 -3.413 -1.134 2.580
269 HD2 HIS 37 2HD HIS 37 -5.620 0.197 3.536
270 HE1 HIS 37 1HE HIS 37 -5.182 -1.283 7.510
271 HE2 HIS 37 2HE HIS 37 -6.298 0.503 6.047
272 H LEU 38 H LEU 38 -4.322 -0.887 0.435
273 HA LEU 38 HA LEU 38 -3.148 -2.665 -1.582
274 HB2 LEU 38 2HB LEU 38 -4.420 -1.837 -3.341
275 HB3 LEU 38 3HB LEU 38 -5.584 -2.308 -2.118
276 HG LEU 38 HG LEU 38 -4.728 0.550 -2.802
277 HD11 LEU 38 1HD1 LEU 38 -6.971 0.740 -3.744
278 HD12 LEU 38 2HD1 LEU 38 -6.077 -0.559 -4.534
279 HD13 LEU 38 3HD1 LEU 38 -7.325 -0.941 -3.326
280 HD21 LEU 38 1HD2 LEU 38 -6.817 -0.480 -0.820
281 HD22 LEU 38 2HD2 LEU 38 -5.409 0.562 -0.457
282 HD23 LEU 38 3HD2 LEU 38 -6.738 1.190 -1.416
283 H PHE 39 H PHE 39 -1.236 -1.869 -2.129
284 HA PHE 39 HA PHE 39 -0.638 1.035 -1.673
285 HB2 PHE 39 2HB PHE 39 1.060 -1.448 -1.197
286 HB3 PHE 39 3HB PHE 39 1.693 0.174 -1.109
287 HD1 PHE 39 1HD PHE 39 2.086 -1.697 1.095
288 HD2 PHE 39 2HD PHE 39 -1.238 0.954 0.411
289 HE1 PHE 39 1HE PHE 39 1.475 -1.827 3.488
290 HE2 PHE 39 2HE PHE 39 -1.915 0.712 2.754
291 HZ PHE 39 HZ PHE 39 -0.576 -0.678 4.310
292 H HIS 40 H HIS 40 0.932 1.920 -3.215
293 HA HIS 40 HA HIS 40 0.658 0.966 -5.881
294 HB2 HIS 40 1HB HIS 40 2.828 2.671 -4.653
295 HB3 HIS 40 2HB HIS 40 2.790 2.275 -6.355
296 HD2 HIS 40 2HD HIS 40 0.593 3.174 -7.811
297 HE1 HIS 40 1HE HIS 40 0.258 6.665 -5.393
298 HE2 HIS 40 2HE HIS 40 -0.408 5.577 -7.619
299 H GLN 41 H GLN 41 2.330 -0.060 -7.267
300 HA GLN 41 HA GLN 41 3.679 -2.276 -5.978
301 HB2 GLN 41 2HB GLN 41 2.802 -2.046 -8.454
302 HB3 GLN 41 3HB GLN 41 4.313 -1.189 -8.737
303 HG2 GLN 41 2HG GLN 41 5.265 -3.159 -9.110
304 HG3 GLN 41 3HG GLN 41 5.213 -3.430 -7.374
305 HE21 GLN 41 1HE2 GLN 41 2.047 -3.747 -7.506
306 HE22 GLN 41 2HE2 GLN 41 1.917 -5.314 -8.220
307 H VAL 42 H VAL 42 4.673 0.913 -7.353
308 HA VAL 42 HA VAL 42 7.438 0.509 -6.709
309 HB VAL 42 HB VAL 42 5.982 3.162 -7.052
310 HG11 VAL 42 1HG1 VAL 42 8.264 3.966 -7.704
311 HG12 VAL 42 2HG1 VAL 42 8.212 3.441 -6.017
312 HG13 VAL 42 3HG1 VAL 42 8.934 2.385 -7.248
313 HG21 VAL 42 1HG2 VAL 42 5.679 1.749 -9.041
314 HG22 VAL 42 2HG2 VAL 42 6.886 2.986 -9.393
315 HG23 VAL 42 3HG2 VAL 42 7.405 1.323 -9.037
316 H CYS 43 H CYS 43 5.012 2.530 -4.887
317 HA CYS 43 HA CYS 43 6.668 3.265 -2.727
318 HB2 CYS 43 2HB CYS 43 3.744 2.464 -2.532
319 HB3 CYS 43 3HB CYS 43 4.657 3.465 -1.418
320 H VAL 44 H VAL 44 4.741 0.200 -3.066
321 HA VAL 44 HA VAL 44 5.380 -0.517 -0.417
322 HB VAL 44 HB VAL 44 3.383 -1.224 -1.773
323 HG11 VAL 44 1HG1 VAL 44 3.582 -3.059 -3.277
324 HG12 VAL 44 2HG1 VAL 44 4.892 -1.984 -3.678
325 HG13 VAL 44 3HG1 VAL 44 5.246 -3.431 -2.729
326 HG21 VAL 44 1HG2 VAL 44 4.160 -2.165 0.456
327 HG22 VAL 44 2HG2 VAL 44 3.114 -3.222 -0.510
328 HG23 VAL 44 3HG2 VAL 44 4.869 -3.511 -0.443
329 H ASP 45 H ASP 45 7.248 -0.851 -3.351
330 HA ASP 45 HA ASP 45 8.863 -3.103 -2.575
331 HB2 ASP 45 2HB ASP 45 9.081 -2.190 -4.811
332 HB3 ASP 45 3HB ASP 45 9.531 -0.601 -4.175
333 H GLN 46 H GLN 46 9.460 0.421 -2.177
334 HA GLN 46 HA GLN 46 11.564 -0.021 -0.294
335 HB2 GLN 46 2HB GLN 46 9.860 2.442 -0.868
336 HB3 GLN 46 3HB GLN 46 11.273 2.455 0.200
337 HG2 GLN 46 2HG GLN 46 11.349 1.635 -2.746
338 HG3 GLN 46 3HG GLN 46 11.790 3.225 -2.120
339 HE21 GLN 46 1HE2 GLN 46 12.941 -0.045 -2.665
340 HE22 GLN 46 2HE2 GLN 46 14.489 0.200 -1.876
341 H ALA 47 H ALA 47 8.092 0.183 0.181
342 HA ALA 47 HA ALA 47 8.171 0.480 3.025
343 HB1 ALA 47 1HB ALA 47 6.188 -1.126 1.372
344 HB2 ALA 47 2HB ALA 47 5.919 -0.408 2.972
345 HB3 ALA 47 3HB ALA 47 6.156 0.643 1.551
346 H LEU 48 H LEU 48 7.647 -2.556 1.188
347 HA LEU 48 HA LEU 48 7.866 -4.345 3.258
348 HB2 LEU 48 2HB LEU 48 6.926 -4.656 0.991
349 HB3 LEU 48 3HB LEU 48 8.542 -4.729 0.302
350 HG LEU 48 HG LEU 48 7.710 -6.652 2.503
351 HD11 LEU 48 1HD1 LEU 48 6.890 -8.207 0.766
352 HD12 LEU 48 2HD1 LEU 48 5.916 -6.732 0.813
353 HD13 LEU 48 3HD1 LEU 48 7.124 -6.951 -0.473
354 HD21 LEU 48 1HD2 LEU 48 9.247 -8.191 1.264
355 HD22 LEU 48 2HD2 LEU 48 9.585 -6.899 0.093
356 HD23 LEU 48 3HD2 LEU 48 10.094 -6.731 1.783
357 H ILE 49 H ILE 49 10.536 -3.244 1.057
358 HA ILE 49 HA ILE 49 12.497 -4.902 2.329
359 HB ILE 49 HB ILE 49 14.152 -3.627 1.198
360 HG12 ILE 49 2HG1 ILE 49 13.019 -1.686 -0.347
361 HG13 ILE 49 3HG1 ILE 49 12.169 -1.485 1.202
362 HG21 ILE 49 1HG2 ILE 49 11.781 -3.913 -0.677
363 HG22 ILE 49 2HG2 ILE 49 13.501 -3.983 -1.078
364 HG23 ILE 49 3HG2 ILE 49 12.774 -5.258 -0.080
365 HD11 ILE 49 1HD1 ILE 49 14.166 -0.093 1.177
366 HD12 ILE 49 2HD1 ILE 49 14.370 -1.395 2.371
367 HD13 ILE 49 3HD1 ILE 49 15.180 -1.504 0.793
368 H THR 50 H THR 50 11.257 -1.613 3.128
369 HA THR 50 HA THR 50 13.321 -1.103 5.033
370 HB THR 50 HB THR 50 10.528 0.004 4.609
371 HG1 THR 50 1HG THR 50 12.022 0.779 3.249
372 HG21 THR 50 1HG2 THR 50 11.057 1.748 6.284
373 HG22 THR 50 2HG2 THR 50 10.793 0.161 7.018
374 HG23 THR 50 3HG2 THR 50 12.452 0.785 6.827
375 H ASN 51 H ASN 51 10.072 -2.616 5.238
376 HA ASN 51 HA ASN 51 10.887 -4.443 7.251
377 HB2 ASN 51 2HB ASN 51 9.241 -2.002 8.013
378 HB3 ASN 51 3HB ASN 51 8.786 -3.562 8.664
379 HD21 ASN 51 1HD2 ASN 51 11.834 -4.363 8.916
380 HD22 ASN 51 2HD2 ASN 51 12.167 -3.578 10.432
381 H LYS 52 H LYS 52 9.460 -6.206 7.119
382 HA LYS 52 HA LYS 52 7.312 -6.018 5.105
383 HB2 LYS 52 2HB LYS 52 8.159 -8.417 6.794
384 HB3 LYS 52 3HB LYS 52 7.182 -8.396 5.333
385 HG2 LYS 52 2HG LYS 52 9.269 -9.204 4.653
386 HG3 LYS 52 3HG LYS 52 9.237 -7.546 4.070
387 HD2 LYS 52 2HD LYS 52 10.962 -6.891 5.484
388 HD3 LYS 52 3HD LYS 52 10.444 -7.995 6.775
389 HE2 LYS 52 2HE LYS 52 12.594 -8.707 5.952
390 HE3 LYS 52 3HE LYS 52 11.360 -9.907 5.615
391 HZ1 LYS 52 1HZ LYS 52 12.810 -9.605 3.768
392 HZ2 LYS 52 2HZ LYS 52 11.311 -9.071 3.318
393 HZ3 LYS 52 3HZ LYS 52 12.602 -8.054 3.688
394 H LYS 53 H LYS 53 6.349 -4.286 6.800
395 HA LYS 53 HA LYS 53 4.171 -5.813 8.070
396 HB2 LYS 53 2HB LYS 53 4.187 -4.079 9.990
397 HB3 LYS 53 3HB LYS 53 5.295 -5.451 10.088
398 HG2 LYS 53 2HG LYS 53 7.148 -4.216 9.761
399 HG3 LYS 53 3HG LYS 53 6.357 -3.017 8.718
400 HD2 LYS 53 2HD LYS 53 5.282 -2.060 10.821
401 HD3 LYS 53 3HD LYS 53 6.422 -3.101 11.738
402 HE2 LYS 53 2HE LYS 53 8.242 -2.193 10.189
403 HE3 LYS 53 3HE LYS 53 7.081 -1.009 9.596
404 HZ1 LYS 53 1HZ LYS 53 8.077 -1.265 12.360
405 HZ2 LYS 53 2HZ LYS 53 8.546 -0.152 11.269
406 HZ3 LYS 53 3HZ LYS 53 6.994 -0.114 11.841
407 H CYS 54 H CYS 54 2.269 -4.884 7.776
408 HA CYS 54 HA CYS 54 1.798 -2.635 5.949
409 HB2 CYS 54 2HB CYS 54 0.333 -4.623 6.215
410 HB3 CYS 54 3HB CYS 54 0.112 -4.236 7.924
411 HA PRO 55 HA PRO 55 2.534 0.116 9.507
412 HB2 PRO 55 2HB PRO 55 1.861 2.543 8.457
413 HB3 PRO 55 3HB PRO 55 3.350 1.674 7.960
414 HG2 PRO 55 2HG PRO 55 0.648 1.675 6.585
415 HG3 PRO 55 3HG PRO 55 2.254 1.994 5.846
416 HD2 PRO 55 2HD PRO 55 1.077 -0.468 5.741
417 HD3 PRO 55 3HD PRO 55 2.849 -0.303 5.956
418 H ILE 56 H ILE 56 1.225 1.259 11.042
419 HA ILE 56 HA ILE 56 -0.571 1.637 12.311
420 HB ILE 56 HB ILE 56 -2.320 1.458 9.832
421 HG12 ILE 56 2HG1 ILE 56 -1.562 4.028 11.232
422 HG13 ILE 56 3HG1 ILE 56 -0.425 3.346 10.069
423 HG21 ILE 56 1HG2 ILE 56 -2.832 2.523 12.643
424 HG22 ILE 56 2HG2 ILE 56 -3.932 2.716 11.263
425 HG23 ILE 56 3HG2 ILE 56 -3.595 1.106 11.897
426 HD11 ILE 56 1HD1 ILE 56 -3.335 3.976 9.435
427 HD12 ILE 56 2HD1 ILE 56 -1.927 4.959 8.985
428 HD13 ILE 56 3HD1 ILE 56 -2.118 3.330 8.309
429 H CYS 57 H CYS 57 -1.837 -0.830 9.909
430 HA CYS 57 HA CYS 57 -3.013 -2.402 12.047
431 HB2 CYS 57 2HB CYS 57 -3.178 -4.132 10.325
432 HB3 CYS 57 3HB CYS 57 -4.017 -2.627 9.983
433 H ARG 58 H ARG 58 0.224 -2.310 10.689
434 HA ARG 58 HA ARG 58 2.166 -3.199 11.332
435 HB2 ARG 58 2HB ARG 58 1.176 -2.238 13.591
436 HB3 ARG 58 3HB ARG 58 1.099 -3.945 14.038
437 HG2 ARG 58 2HG ARG 58 3.664 -3.815 13.034
438 HG3 ARG 58 3HG ARG 58 3.458 -2.153 13.590
439 HD2 ARG 58 2HD ARG 58 2.757 -3.077 15.839
440 HD3 ARG 58 3HD ARG 58 3.133 -4.704 15.222
441 HE ARG 58 HE ARG 58 5.354 -2.954 14.832
442 HH11 ARG 58 1HH1 ARG 58 7.109 -3.895 17.744
443 HH12 ARG 58 2HH1 ARG 58 7.220 -3.077 16.232
444 HH21 ARG 58 1HH2 ARG 58 5.059 -4.875 18.416
445 HH22 ARG 58 2HH2 ARG 58 3.695 -4.758 17.359
446 H VAL 59 H VAL 59 -0.211 -5.160 10.533
447 HA VAL 59 HA VAL 59 0.722 -7.702 11.583
448 HB VAL 59 HB VAL 59 -0.898 -7.070 9.092
449 HG11 VAL 59 1HG1 VAL 59 -1.845 -9.353 9.418
450 HG12 VAL 59 2HG1 VAL 59 -0.113 -9.398 9.106
451 HG13 VAL 59 3HG1 VAL 59 -0.715 -9.616 10.764
452 HG21 VAL 59 1HG2 VAL 59 -2.909 -7.555 10.525
453 HG22 VAL 59 2HG2 VAL 59 -1.842 -7.627 11.944
454 HG23 VAL 59 3HG2 VAL 59 -2.051 -6.110 11.049
455 H ASP 60 H ASP 60 2.066 -9.190 10.495
456 HA ASP 60 HA ASP 60 4.122 -7.996 8.851
457 HB2 ASP 60 2HB ASP 60 4.326 -9.883 10.600
458 HB3 ASP 60 3HB ASP 60 3.697 -10.954 9.346
459 H ILE 61 H ILE 61 4.522 -8.537 6.627
460 HA ILE 61 HA ILE 61 2.152 -9.601 5.159
461 HB ILE 61 HB ILE 61 2.628 -8.091 3.380
462 HG12 ILE 61 2HG1 ILE 61 4.887 -6.995 5.100
463 HG13 ILE 61 3HG1 ILE 61 5.100 -7.959 3.629
464 HG21 ILE 61 1HG2 ILE 61 1.267 -7.388 5.474
465 HG22 ILE 61 2HG2 ILE 61 2.686 -6.393 5.876
466 HG23 ILE 61 3HG2 ILE 61 1.778 -6.114 4.360
467 HD11 ILE 61 1HD1 ILE 61 5.348 -5.687 3.032
468 HD12 ILE 61 2HD1 ILE 61 3.784 -6.284 2.392
469 HD13 ILE 61 3HD1 ILE 61 3.824 -5.230 3.844
470 H GLU 62 H GLU 62 5.476 -10.003 5.753
471 HA GLU 62 HA GLU 62 6.444 -11.129 3.390
472 HB2 GLU 62 2HB GLU 62 7.716 -10.671 5.516
473 HB3 GLU 62 3HB GLU 62 6.945 -12.080 6.252
474 HG2 GLU 62 2HG GLU 62 7.990 -13.569 4.616
475 HG3 GLU 62 3HG GLU 62 8.601 -12.182 3.700
476 H ALA 63 H ALA 63 6.304 -13.220 2.485
477 HA ALA 63 HA ALA 63 4.656 -15.263 3.832
478 HB1 ALA 63 1HB ALA 63 3.027 -13.854 2.617
479 HB2 ALA 63 2HB ALA 63 3.958 -14.084 1.114
480 HB3 ALA 63 3HB ALA 63 3.161 -15.474 1.893
481 H GLN 64 H GLN 64 7.339 -15.347 3.514
482 HA GLN 64 HA GLN 64 7.615 -17.623 1.719
483 HB2 GLN 64 2HB GLN 64 8.232 -15.239 0.558
484 HB3 GLN 64 3HB GLN 64 9.767 -15.540 1.377
485 HG2 GLN 64 2HG GLN 64 9.847 -17.798 0.280
486 HG3 GLN 64 3HG GLN 64 8.314 -17.442 -0.527
487 HE21 GLN 64 1HE2 GLN 64 8.283 -15.539 -2.073
488 HE22 GLN 64 2HE2 GLN 64 9.800 -15.193 -2.900
489 H LEU 65 H LEU 65 9.143 -19.059 2.593
490 HA LEU 65 HA LEU 65 10.201 -18.412 5.235
491 HB2 LEU 65 2HB LEU 65 9.699 -20.844 3.702
492 HB3 LEU 65 3HB LEU 65 11.355 -20.849 4.290
493 HG LEU 65 HG LEU 65 9.825 -21.958 5.827
494 HD11 LEU 65 1HD1 LEU 65 11.871 -20.899 6.702
495 HD12 LEU 65 2HD1 LEU 65 10.976 -19.401 7.024
496 HD13 LEU 65 3HD1 LEU 65 10.559 -20.888 7.894
497 HD21 LEU 65 1HD2 LEU 65 8.147 -20.782 7.109
498 HD22 LEU 65 2HD2 LEU 65 8.521 -19.247 6.312
499 HD23 LEU 65 3HD2 LEU 65 7.800 -20.578 5.383
500 HA PRO 66 HA PRO 66 14.362 -18.190 3.023
501 HB2 PRO 66 2HB PRO 66 14.631 -18.464 0.331
502 HB3 PRO 66 3HB PRO 66 14.546 -19.899 1.406
503 HG2 PRO 66 2HG PRO 66 12.272 -18.606 -0.143
504 HG3 PRO 66 3HG PRO 66 12.749 -20.334 -0.139
505 HD2 PRO 66 2HD PRO 66 10.771 -19.401 1.465
506 HD3 PRO 66 3HD PRO 66 11.899 -20.656 2.043
507 H SER 67 H SER 67 15.328 -16.326 2.043
508 HA SER 67 HA SER 67 15.486 -14.266 1.074
509 HB2 SER 67 2HB SER 67 12.479 -14.113 0.679
510 HB3 SER 67 3HB SER 67 13.747 -13.119 -0.040
511 HG SER 67 HG SER 67 12.881 -15.654 -0.686
512 H GLU 68 H GLU 68 16.206 -13.271 2.942
513 HA GLU 68 HA GLU 68 14.202 -12.251 4.849
514 HB2 GLU 68 2HB GLU 68 15.403 -14.532 5.427
515 HB3 GLU 68 3HB GLU 68 16.814 -13.534 5.747
516 HG2 GLU 68 2HG GLU 68 14.072 -13.133 7.042
517 HG3 GLU 68 3HG GLU 68 15.323 -14.172 7.722
518 H SER 69 H SER 69 15.221 -10.369 6.048
519 HA SER 69 HA SER 69 16.022 -8.293 5.879
520 HB2 SER 69 2HB SER 69 18.263 -9.389 6.004
521 HB3 SER 69 3HB SER 69 18.309 -9.420 4.227
522 HG SER 69 HG SER 69 17.967 -7.159 4.297
Start of MODEL 24
1 H1 MET 1 H1 MET 1 -16.314 34.556 -25.246
2 H2 MET 1 H2 MET 1 -17.548 35.379 -25.968
3 H3 MET 1 H3 MET 1 -17.381 33.757 -26.211
4 HA MET 1 HA MET 1 -16.672 34.936 -28.135
5 HB2 MET 1 2HB MET 1 -14.846 36.322 -26.155
6 HB3 MET 1 3HB MET 1 -14.434 36.183 -27.877
7 HG2 MET 1 2HG MET 1 -16.615 37.193 -28.480
8 HG3 MET 1 3HG MET 1 -16.955 37.463 -26.764
9 HE1 MET 1 1HE MET 1 -16.176 41.012 -28.434
10 HE2 MET 1 2HE MET 1 -16.926 39.602 -29.214
11 HE3 MET 1 3HE MET 1 -17.404 40.066 -27.562
12 H LYS 2 H LYS 2 -13.620 34.378 -26.246
13 HA LYS 2 HA LYS 2 -13.520 31.642 -27.378
14 HB2 LYS 2 2HB LYS 2 -11.840 33.978 -28.126
15 HB3 LYS 2 3HB LYS 2 -10.905 32.596 -27.551
16 HG2 LYS 2 2HG LYS 2 -12.075 31.116 -29.162
17 HG3 LYS 2 3HG LYS 2 -12.949 32.524 -29.806
18 HD2 LYS 2 2HD LYS 2 -10.743 33.580 -30.385
19 HD3 LYS 2 3HD LYS 2 -9.917 32.169 -29.712
20 HE2 LYS 2 2HE LYS 2 -9.921 31.727 -32.008
21 HE3 LYS 2 3HE LYS 2 -11.251 30.745 -31.379
22 HZ1 LYS 2 1HZ LYS 2 -11.913 31.898 -33.357
23 HZ2 LYS 2 2HZ LYS 2 -12.760 32.526 -32.093
24 HZ3 LYS 2 3HZ LYS 2 -11.491 33.359 -32.736
25 H GLN 3 H GLN 3 -13.646 30.567 -25.438
26 HA GLN 3 HA GLN 3 -11.535 30.942 -23.481
27 HB2 GLN 3 2HB GLN 3 -14.501 31.346 -22.859
28 HB3 GLN 3 3HB GLN 3 -13.333 30.847 -21.630
29 HG2 GLN 3 2HG GLN 3 -12.012 32.895 -21.990
30 HG3 GLN 3 3HG GLN 3 -13.140 33.419 -23.249
31 HE21 GLN 3 1HE2 GLN 3 -13.097 32.504 -19.736
32 HE22 GLN 3 2HE2 GLN 3 -14.390 33.624 -19.343
33 H ASP 4 H ASP 4 -11.683 29.049 -21.922
34 HA ASP 4 HA ASP 4 -12.365 26.596 -23.334
35 HB2 ASP 4 2HB ASP 4 -10.921 27.397 -20.829
36 HB3 ASP 4 3HB ASP 4 -11.714 25.823 -20.787
37 H GLY 5 H GLY 5 -13.484 24.885 -21.876
38 HA2 GLY 5 2HA GLY 5 -16.109 26.012 -20.986
39 HA3 GLY 5 3HA GLY 5 -15.857 24.391 -21.653
40 H GLU 6 H GLU 6 -15.335 22.702 -20.241
41 HA GLU 6 HA GLU 6 -14.335 23.228 -17.564
42 HB2 GLU 6 2HB GLU 6 -17.187 22.637 -18.175
43 HB3 GLU 6 3HB GLU 6 -16.475 21.444 -17.102
44 HG2 GLU 6 2HG GLU 6 -16.324 24.444 -16.595
45 HG3 GLU 6 3HG GLU 6 -17.587 23.387 -15.959
46 H GLU 7 H GLU 7 -13.785 20.998 -16.548
47 HA GLU 7 HA GLU 7 -13.891 18.738 -18.262
48 HB2 GLU 7 2HB GLU 7 -11.898 19.845 -19.259
49 HB3 GLU 7 3HB GLU 7 -11.157 19.968 -17.661
50 HG2 GLU 7 2HG GLU 7 -10.231 18.090 -18.954
51 HG3 GLU 7 3HG GLU 7 -11.024 17.522 -17.491
52 H GLY 8 H GLY 8 -13.842 17.024 -16.969
53 HA2 GLY 8 2HA GLY 8 -13.803 17.486 -14.019
54 HA3 GLY 8 3HA GLY 8 -14.572 16.126 -14.858
55 H THR 9 H THR 9 -13.503 14.596 -13.441
56 HA THR 9 HA THR 9 -10.926 13.823 -14.464
57 HB THR 9 HB THR 9 -10.200 15.320 -12.709
58 HG1 THR 9 1HG THR 9 -9.724 12.906 -11.482
59 HG21 THR 9 1HG2 THR 9 -11.803 13.533 -10.847
60 HG22 THR 9 2HG2 THR 9 -10.690 14.835 -10.351
61 HG23 THR 9 3HG2 THR 9 -12.169 15.222 -11.255
62 H GLU 10 H GLU 10 -10.375 11.618 -13.264
63 HA GLU 10 HA GLU 10 -12.634 9.891 -13.682
64 HB2 GLU 10 2HB GLU 10 -9.776 9.622 -13.293
65 HB3 GLU 10 3HB GLU 10 -10.600 8.559 -12.142
66 HG2 GLU 10 2HG GLU 10 -11.947 7.595 -13.985
67 HG3 GLU 10 3HG GLU 10 -11.164 8.692 -15.131
68 H GLU 11 H GLU 11 -13.595 8.424 -12.083
69 HA GLU 11 HA GLU 11 -14.186 9.888 -9.601
70 HB2 GLU 11 2HB GLU 11 -15.420 7.502 -11.030
71 HB3 GLU 11 3HB GLU 11 -15.845 7.918 -9.357
72 HG2 GLU 11 2HG GLU 11 -16.529 10.171 -10.042
73 HG3 GLU 11 3HG GLU 11 -16.082 9.823 -11.718
74 H ASP 12 H ASP 12 -12.177 9.708 -8.556
75 HA ASP 12 HA ASP 12 -12.522 7.465 -6.740
76 HB2 ASP 12 2HB ASP 12 -10.733 6.578 -8.125
77 HB3 ASP 12 3HB ASP 12 -9.821 8.091 -7.967
78 H THR 13 H THR 13 -12.363 8.228 -4.741
79 HA THR 13 HA THR 13 -10.732 10.548 -4.062
80 HB THR 13 HB THR 13 -13.690 10.697 -3.384
81 HG1 THR 13 1HG THR 13 -12.301 11.546 -5.644
82 HG21 THR 13 1HG2 THR 13 -11.388 12.700 -3.265
83 HG22 THR 13 2HG2 THR 13 -13.099 13.168 -3.152
84 HG23 THR 13 3HG2 THR 13 -12.395 12.128 -1.914
85 H GLU 14 H GLU 14 -10.964 7.597 -3.481
86 HA GLU 14 HA GLU 14 -11.214 7.657 -0.508
87 HB2 GLU 14 2HB GLU 14 -12.968 6.279 -2.480
88 HB3 GLU 14 3HB GLU 14 -12.388 5.250 -1.177
89 HG2 GLU 14 2HG GLU 14 -13.507 7.960 -0.454
90 HG3 GLU 14 3HG GLU 14 -14.619 6.683 -0.937
91 H GLU 15 H GLU 15 -10.129 5.796 -3.486
92 HA GLU 15 HA GLU 15 -8.639 4.028 -1.726
93 HB2 GLU 15 2HB GLU 15 -8.703 4.181 -4.767
94 HB3 GLU 15 3HB GLU 15 -8.015 2.895 -3.747
95 HG2 GLU 15 2HG GLU 15 -10.389 2.807 -2.644
96 HG3 GLU 15 3HG GLU 15 -10.934 3.715 -4.055
97 H LYS 16 H LYS 16 -7.171 5.263 -0.647
98 HA LYS 16 HA LYS 16 -5.072 6.611 -2.307
99 HB2 LYS 16 2HB LYS 16 -4.612 7.883 -0.067
100 HB3 LYS 16 3HB LYS 16 -5.918 8.412 -1.118
101 HG2 LYS 16 2HG LYS 16 -7.588 7.371 0.207
102 HG3 LYS 16 3HG LYS 16 -6.375 6.457 1.112
103 HD2 LYS 16 2HD LYS 16 -7.236 8.203 2.506
104 HD3 LYS 16 3HD LYS 16 -5.567 8.646 2.081
105 HE2 LYS 16 2HE LYS 16 -6.326 10.241 0.436
106 HE3 LYS 16 3HE LYS 16 -7.974 9.591 0.471
107 HZ1 LYS 16 1HZ LYS 16 -7.793 11.650 1.697
108 HZ2 LYS 16 2HZ LYS 16 -8.235 10.412 2.683
109 HZ3 LYS 16 3HZ LYS 16 -6.689 10.987 2.727
110 H CYS 17 H CYS 17 -3.078 6.148 -2.107
111 HA CYS 17 HA CYS 17 -1.835 3.850 -0.792
112 HB2 CYS 17 2HB CYS 17 -1.082 5.029 -2.869
113 HB3 CYS 17 3HB CYS 17 -0.861 6.484 -1.930
114 H THR 18 H THR 18 -1.550 3.751 1.395
115 HA THR 18 HA THR 18 -1.674 6.177 2.975
116 HB THR 18 HB THR 18 -2.605 3.947 3.642
117 HG1 THR 18 1HG THR 18 -0.945 5.543 5.253
118 HG21 THR 18 1HG2 THR 18 -0.522 2.662 3.040
119 HG22 THR 18 2HG2 THR 18 0.270 3.369 4.458
120 HG23 THR 18 3HG2 THR 18 -1.155 2.337 4.679
121 H ILE 19 H ILE 19 0.944 4.560 1.346
122 HA ILE 19 HA ILE 19 2.989 5.237 3.290
123 HB ILE 19 HB ILE 19 2.861 4.025 0.529
124 HG12 ILE 19 2HG1 ILE 19 4.156 2.835 2.988
125 HG13 ILE 19 3HG1 ILE 19 2.391 2.846 2.876
126 HG21 ILE 19 1HG2 ILE 19 4.894 5.294 0.420
127 HG22 ILE 19 2HG2 ILE 19 5.349 4.829 2.078
128 HG23 ILE 19 3HG2 ILE 19 5.360 3.626 0.773
129 HD11 ILE 19 1HD1 ILE 19 2.410 1.636 0.804
130 HD12 ILE 19 2HD1 ILE 19 4.179 1.717 0.695
131 HD13 ILE 19 3HD1 ILE 19 3.425 0.764 1.984
132 H CYS 20 H CYS 20 2.049 6.369 -0.021
133 HA CYS 20 HA CYS 20 3.745 8.835 0.282
134 HB2 CYS 20 2HB CYS 20 3.160 9.203 -2.022
135 HB3 CYS 20 3HB CYS 20 3.892 7.605 -1.814
136 H LEU 21 H LEU 21 0.688 7.839 1.302
137 HA LEU 21 HA LEU 21 -1.252 8.860 1.763
138 HB2 LEU 21 2HB LEU 21 0.712 11.069 2.416
139 HB3 LEU 21 3HB LEU 21 -0.979 11.064 2.934
140 HG LEU 21 HG LEU 21 0.957 8.802 3.594
141 HD11 LEU 21 1HD1 LEU 21 1.120 9.804 5.828
142 HD12 LEU 21 2HD1 LEU 21 1.785 10.865 4.575
143 HD13 LEU 21 3HD1 LEU 21 0.180 11.213 5.268
144 HD21 LEU 21 1HD2 LEU 21 -1.471 8.232 3.741
145 HD22 LEU 21 2HD2 LEU 21 -0.706 8.259 5.328
146 HD23 LEU 21 3HD2 LEU 21 -1.724 9.623 4.815
147 H SER 22 H SER 22 -1.240 8.656 -0.797
148 HA SER 22 HA SER 22 -2.396 11.220 -1.733
149 HB2 SER 22 2HB SER 22 0.054 10.921 -2.464
150 HB3 SER 22 3HB SER 22 -0.530 9.581 -3.475
151 HG SER 22 HG SER 22 -0.523 11.589 -4.585
152 H ILE 23 H ILE 23 -3.941 10.873 -3.526
153 HA ILE 23 HA ILE 23 -5.512 8.462 -3.207
154 HB ILE 23 HB ILE 23 -5.574 10.973 -4.926
155 HG12 ILE 23 2HG1 ILE 23 -6.123 11.063 -2.408
156 HG13 ILE 23 3HG1 ILE 23 -7.290 11.764 -3.523
157 HG21 ILE 23 1HG2 ILE 23 -6.637 9.395 -6.324
158 HG22 ILE 23 2HG2 ILE 23 -7.542 8.682 -4.985
159 HG23 ILE 23 3HG2 ILE 23 -7.918 10.327 -5.561
160 HD11 ILE 23 1HD1 ILE 23 -8.294 10.364 -1.674
161 HD12 ILE 23 2HD1 ILE 23 -8.781 9.897 -3.307
162 HD13 ILE 23 3HD1 ILE 23 -7.584 8.928 -2.447
163 H LEU 24 H LEU 24 -5.967 7.029 -5.035
164 HA LEU 24 HA LEU 24 -3.692 6.572 -6.846
165 HB2 LEU 24 2HB LEU 24 -6.058 4.874 -5.946
166 HB3 LEU 24 3HB LEU 24 -4.660 4.330 -6.867
167 HG LEU 24 HG LEU 24 -4.322 5.399 -4.059
168 HD11 LEU 24 1HD1 LEU 24 -4.244 3.100 -3.363
169 HD12 LEU 24 2HD1 LEU 24 -5.805 3.434 -4.154
170 HD13 LEU 24 3HD1 LEU 24 -4.543 2.543 -5.043
171 HD21 LEU 24 1HD2 LEU 24 -2.250 3.943 -4.347
172 HD22 LEU 24 2HD2 LEU 24 -2.637 3.878 -6.068
173 HD23 LEU 24 3HD2 LEU 24 -2.319 5.464 -5.299
174 H GLU 25 H GLU 25 -5.768 4.858 -8.433
175 HA GLU 25 HA GLU 25 -7.611 6.786 -9.544
176 HB2 GLU 25 2HB GLU 25 -6.562 6.767 -11.813
177 HB3 GLU 25 3HB GLU 25 -5.587 7.574 -10.591
178 HG2 GLU 25 2HG GLU 25 -4.496 5.096 -10.443
179 HG3 GLU 25 3HG GLU 25 -5.042 5.078 -12.119
180 H GLU 26 H GLU 26 -7.963 5.310 -12.065
181 HA GLU 26 HA GLU 26 -8.183 2.487 -11.085
182 HB2 GLU 26 2HB GLU 26 -10.419 3.418 -11.179
183 HB3 GLU 26 3HB GLU 26 -10.155 4.008 -12.820
184 HG2 GLU 26 2HG GLU 26 -10.809 2.045 -13.690
185 HG3 GLU 26 3HG GLU 26 -9.544 1.185 -12.823
186 H GLY 27 H GLY 27 -6.137 1.988 -11.942
187 HA2 GLY 27 2HA GLY 27 -5.872 0.483 -14.018
188 HA3 GLY 27 3HA GLY 27 -5.990 1.983 -14.946
189 H GLU 28 H GLU 28 -4.264 1.141 -11.938
190 HA GLU 28 HA GLU 28 -1.741 2.205 -13.045
191 HB2 GLU 28 2HB GLU 28 -1.485 3.504 -11.178
192 HB3 GLU 28 3HB GLU 28 -3.145 3.751 -11.691
193 HG2 GLU 28 2HG GLU 28 -2.397 1.721 -9.589
194 HG3 GLU 28 3HG GLU 28 -2.550 3.412 -9.183
195 H ASP 29 H ASP 29 0.018 1.879 -10.998
196 HA ASP 29 HA ASP 29 0.180 -1.026 -10.667
197 HB2 ASP 29 2HB ASP 29 2.438 -0.621 -10.076
198 HB3 ASP 29 3HB ASP 29 2.078 0.263 -11.528
199 H VAL 30 H VAL 30 -0.819 -1.839 -8.906
200 HA VAL 30 HA VAL 30 -0.381 -0.515 -6.328
201 HB VAL 30 HB VAL 30 -2.765 -0.977 -5.624
202 HG11 VAL 30 1HG1 VAL 30 -2.223 1.251 -5.827
203 HG12 VAL 30 2HG1 VAL 30 -2.116 1.188 -7.584
204 HG13 VAL 30 3HG1 VAL 30 -3.691 1.064 -6.805
205 HG21 VAL 30 1HG2 VAL 30 -3.303 -1.082 -8.621
206 HG22 VAL 30 2HG2 VAL 30 -3.346 -2.499 -7.539
207 HG23 VAL 30 3HG2 VAL 30 -4.488 -1.164 -7.308
208 H ARG 31 H ARG 31 -1.349 -2.240 -4.622
209 HA ARG 31 HA ARG 31 -0.647 -4.947 -5.338
210 HB2 ARG 31 2HB ARG 31 1.279 -3.024 -4.112
211 HB3 ARG 31 3HB ARG 31 1.098 -4.509 -3.183
212 HG2 ARG 31 2HG ARG 31 1.524 -4.816 -6.137
213 HG3 ARG 31 3HG ARG 31 2.890 -4.267 -5.170
214 HD2 ARG 31 2HD ARG 31 1.299 -6.661 -4.256
215 HD3 ARG 31 3HD ARG 31 2.495 -6.834 -5.552
216 HE ARG 31 HE ARG 31 3.962 -5.526 -3.745
217 HH11 ARG 31 1HH1 ARG 31 4.994 -8.098 -1.594
218 HH12 ARG 31 2HH1 ARG 31 5.404 -6.573 -2.283
219 HH21 ARG 31 1HH2 ARG 31 2.968 -9.163 -2.207
220 HH22 ARG 31 2HH2 ARG 31 1.910 -8.378 -3.321
221 H ARG 32 H ARG 32 -0.575 -6.196 -3.041
222 HA ARG 32 HA ARG 32 -2.646 -5.045 -1.295
223 HB2 ARG 32 2HB ARG 32 -3.366 -6.595 -3.401
224 HB3 ARG 32 3HB ARG 32 -2.950 -7.889 -2.288
225 HG2 ARG 32 2HG ARG 32 -4.952 -5.634 -1.763
226 HG3 ARG 32 3HG ARG 32 -5.352 -7.248 -2.343
227 HD2 ARG 32 2HD ARG 32 -3.906 -7.838 -0.044
228 HD3 ARG 32 3HD ARG 32 -4.687 -6.326 0.397
229 HE ARG 32 HE ARG 32 -6.741 -7.346 0.391
230 HH11 ARG 32 1HH1 ARG 32 -7.702 -10.626 -0.479
231 HH12 ARG 32 2HH1 ARG 32 -8.215 -9.140 0.226
232 HH21 ARG 32 1HH2 ARG 32 -5.488 -10.847 -1.289
233 HH22 ARG 32 2HH2 ARG 32 -4.410 -9.506 -1.148
234 H LEU 33 H LEU 33 -2.578 -5.990 0.801
235 HA LEU 33 HA LEU 33 -0.427 -7.921 1.419
236 HB2 LEU 33 2HB LEU 33 -0.445 -6.314 3.627
237 HB3 LEU 33 3HB LEU 33 0.732 -6.179 2.326
238 HG LEU 33 HG LEU 33 -1.836 -4.611 2.172
239 HD11 LEU 33 1HD1 LEU 33 -0.572 -2.768 3.398
240 HD12 LEU 33 2HD1 LEU 33 -1.207 -4.078 4.385
241 HD13 LEU 33 3HD1 LEU 33 0.526 -4.022 3.990
242 HD21 LEU 33 1HD2 LEU 33 -0.486 -3.056 0.939
243 HD22 LEU 33 2HD2 LEU 33 1.025 -3.772 1.548
244 HD23 LEU 33 3HD2 LEU 33 0.053 -4.635 0.350
245 HA PRO 34 HA PRO 34 -3.488 -10.019 3.606
246 HB2 PRO 34 2HB PRO 34 -2.336 -10.804 5.996
247 HB3 PRO 34 3HB PRO 34 -1.957 -11.511 4.397
248 HG2 PRO 34 2HG PRO 34 -0.412 -9.413 5.926
249 HG3 PRO 34 3HG PRO 34 0.198 -10.820 4.995
250 HD2 PRO 34 2HD PRO 34 0.124 -8.242 4.066
251 HD3 PRO 34 3HD PRO 34 0.032 -9.624 2.977
252 H CYS 35 H CYS 35 -2.084 -7.297 5.280
253 HA CYS 35 HA CYS 35 -4.242 -6.746 7.215
254 HB2 CYS 35 2HB CYS 35 -1.955 -6.036 7.524
255 HB3 CYS 35 3HB CYS 35 -1.965 -5.215 5.973
256 H MET 36 H MET 36 -4.985 -7.309 4.189
257 HA MET 36 HA MET 36 -6.416 -6.462 2.661
258 HB2 MET 36 2HB MET 36 -8.604 -5.869 3.695
259 HB3 MET 36 3HB MET 36 -7.874 -7.358 4.296
260 HG2 MET 36 2HG MET 36 -7.104 -6.224 6.319
261 HG3 MET 36 3HG MET 36 -7.766 -4.687 5.746
262 HE1 MET 36 1HE MET 36 -8.631 -4.885 8.379
263 HE2 MET 36 2HE MET 36 -9.816 -6.103 8.910
264 HE3 MET 36 3HE MET 36 -8.155 -6.594 8.507
265 H HIS 37 H HIS 37 -4.391 -4.759 2.713
266 HA HIS 37 HA HIS 37 -5.589 -2.034 2.737
267 HB2 HIS 37 1HB HIS 37 -3.399 -3.168 4.216
268 HB3 HIS 37 2HB HIS 37 -2.690 -2.119 3.002
269 HD2 HIS 37 2HD HIS 37 -5.029 0.222 3.202
270 HE1 HIS 37 1HE HIS 37 -3.319 0.725 7.070
271 HE2 HIS 37 2HE HIS 37 -4.745 1.821 5.251
272 H LEU 38 H LEU 38 -5.510 -1.046 0.712
273 HA LEU 38 HA LEU 38 -4.035 -2.430 -1.445
274 HB2 LEU 38 2HB LEU 38 -6.466 -1.824 -1.613
275 HB3 LEU 38 3HB LEU 38 -6.034 -0.122 -1.527
276 HG LEU 38 HG LEU 38 -4.956 -2.039 -3.658
277 HD11 LEU 38 1HD1 LEU 38 -7.352 -0.164 -3.740
278 HD12 LEU 38 2HD1 LEU 38 -6.717 -1.061 -5.127
279 HD13 LEU 38 3HD1 LEU 38 -7.434 -1.935 -3.762
280 HD21 LEU 38 1HD2 LEU 38 -3.609 -0.032 -3.615
281 HD22 LEU 38 2HD2 LEU 38 -4.791 0.214 -4.900
282 HD23 LEU 38 3HD2 LEU 38 -5.048 0.974 -3.320
283 H PHE 39 H PHE 39 -2.017 -1.675 -1.911
284 HA PHE 39 HA PHE 39 -1.284 1.131 -1.149
285 HB2 PHE 39 2HB PHE 39 0.318 -1.464 -0.977
286 HB3 PHE 39 3HB PHE 39 1.063 0.116 -0.971
287 HD1 PHE 39 1HD PHE 39 2.065 -1.064 1.077
288 HD2 PHE 39 2HD PHE 39 -1.965 0.416 0.989
289 HE1 PHE 39 1HE PHE 39 2.055 -0.950 3.553
290 HE2 PHE 39 2HE PHE 39 -1.980 0.519 3.423
291 HZ PHE 39 HZ PHE 39 0.027 -0.138 4.741
292 H HIS 40 H HIS 40 0.561 1.955 -2.633
293 HA HIS 40 HA HIS 40 0.080 1.289 -5.463
294 HB2 HIS 40 1HB HIS 40 2.031 2.962 -3.947
295 HB3 HIS 40 2HB HIS 40 2.460 2.497 -5.581
296 HD2 HIS 40 2HD HIS 40 0.045 3.128 -7.356
297 HE1 HIS 40 1HE HIS 40 0.251 7.018 -5.636
298 HE2 HIS 40 2HE HIS 40 -0.632 5.627 -7.613
299 H GLN 41 H GLN 41 1.920 0.424 -6.849
300 HA GLN 41 HA GLN 41 3.056 -1.940 -5.613
301 HB2 GLN 41 2HB GLN 41 2.232 -1.686 -7.990
302 HB3 GLN 41 3HB GLN 41 3.727 -0.794 -8.333
303 HG2 GLN 41 2HG GLN 41 5.098 -2.617 -8.083
304 HG3 GLN 41 3HG GLN 41 3.969 -3.488 -7.041
305 HE21 GLN 41 1HE2 GLN 41 1.586 -3.748 -8.358
306 HE22 GLN 41 2HE2 GLN 41 1.896 -4.491 -9.917
307 H VAL 42 H VAL 42 4.558 0.999 -7.172
308 HA VAL 42 HA VAL 42 7.161 0.353 -6.266
309 HB VAL 42 HB VAL 42 6.002 3.123 -6.778
310 HG11 VAL 42 1HG1 VAL 42 8.116 3.307 -5.525
311 HG12 VAL 42 2HG1 VAL 42 8.895 2.148 -6.624
312 HG13 VAL 42 3HG1 VAL 42 8.389 3.747 -7.214
313 HG21 VAL 42 1HG2 VAL 42 7.100 2.830 -9.004
314 HG22 VAL 42 2HG2 VAL 42 7.521 1.162 -8.564
315 HG23 VAL 42 3HG2 VAL 42 5.818 1.644 -8.748
316 H CYS 43 H CYS 43 4.691 2.389 -4.595
317 HA CYS 43 HA CYS 43 6.290 3.081 -2.328
318 HB2 CYS 43 2HB CYS 43 3.319 2.525 -2.298
319 HB3 CYS 43 3HB CYS 43 4.253 3.517 -1.203
320 H VAL 44 H VAL 44 4.104 0.107 -2.756
321 HA VAL 44 HA VAL 44 4.845 -0.718 -0.155
322 HB VAL 44 HB VAL 44 2.756 -1.374 -1.411
323 HG11 VAL 44 1HG1 VAL 44 4.671 -3.478 -2.513
324 HG12 VAL 44 2HG1 VAL 44 2.912 -3.563 -2.537
325 HG13 VAL 44 3HG1 VAL 44 3.746 -2.289 -3.455
326 HG21 VAL 44 1HG2 VAL 44 3.716 -2.348 0.775
327 HG22 VAL 44 2HG2 VAL 44 2.522 -3.317 -0.129
328 HG23 VAL 44 3HG2 VAL 44 4.263 -3.701 -0.207
329 H ASP 45 H ASP 45 6.464 -1.002 -3.232
330 HA ASP 45 HA ASP 45 7.972 -3.353 -2.688
331 HB2 ASP 45 2HB ASP 45 7.779 -2.095 -4.897
332 HB3 ASP 45 3HB ASP 45 8.951 -0.932 -4.259
333 H GLN 46 H GLN 46 8.864 0.108 -2.283
334 HA GLN 46 HA GLN 46 11.131 -0.567 -0.610
335 HB2 GLN 46 2HB GLN 46 9.667 2.082 -1.017
336 HB3 GLN 46 3HB GLN 46 11.153 1.884 -0.068
337 HG2 GLN 46 2HG GLN 46 12.277 0.919 -2.100
338 HG3 GLN 46 3HG GLN 46 10.824 1.294 -3.042
339 HE21 GLN 46 1HE2 GLN 46 11.449 3.028 -4.370
340 HE22 GLN 46 2HE2 GLN 46 12.229 4.470 -3.725
341 H ALA 47 H ALA 47 7.723 -0.105 0.116
342 HA ALA 47 HA ALA 47 8.046 0.275 2.929
343 HB1 ALA 47 1HB ALA 47 5.905 0.441 1.646
344 HB2 ALA 47 2HB ALA 47 5.888 -1.338 1.525
345 HB3 ALA 47 3HB ALA 47 5.785 -0.558 3.115
346 H LEU 48 H LEU 48 7.480 -2.761 1.096
347 HA LEU 48 HA LEU 48 7.720 -4.529 3.186
348 HB2 LEU 48 2HB LEU 48 6.791 -4.884 0.899
349 HB3 LEU 48 3HB LEU 48 8.421 -5.008 0.249
350 HG LEU 48 HG LEU 48 7.483 -6.823 2.502
351 HD11 LEU 48 1HD1 LEU 48 6.713 -8.449 0.846
352 HD12 LEU 48 2HD1 LEU 48 5.779 -6.950 0.721
353 HD13 LEU 48 3HD1 LEU 48 7.062 -7.299 -0.467
354 HD21 LEU 48 1HD2 LEU 48 9.909 -6.944 1.874
355 HD22 LEU 48 2HD2 LEU 48 9.061 -8.433 1.450
356 HD23 LEU 48 3HD2 LEU 48 9.448 -7.242 0.191
357 H ILE 49 H ILE 49 10.353 -3.436 0.929
358 HA ILE 49 HA ILE 49 12.309 -5.065 2.236
359 HB ILE 49 HB ILE 49 13.968 -3.894 1.041
360 HG12 ILE 49 2HG1 ILE 49 12.949 -1.894 -0.488
361 HG13 ILE 49 3HG1 ILE 49 12.098 -1.644 1.048
362 HG21 ILE 49 1HG2 ILE 49 13.235 -4.198 -1.223
363 HG22 ILE 49 2HG2 ILE 49 12.498 -5.446 -0.205
364 HG23 ILE 49 3HG2 ILE 49 11.536 -4.063 -0.760
365 HD11 ILE 49 1HD1 ILE 49 15.108 -1.830 0.687
366 HD12 ILE 49 2HD1 ILE 49 14.172 -0.353 0.999
367 HD13 ILE 49 3HD1 ILE 49 14.277 -1.615 2.242
368 H THR 50 H THR 50 11.051 -1.819 3.040
369 HA THR 50 HA THR 50 13.167 -1.216 4.884
370 HB THR 50 HB THR 50 10.344 -0.154 4.500
371 HG1 THR 50 1HG THR 50 11.731 0.516 2.977
372 HG21 THR 50 1HG2 THR 50 10.967 1.712 5.994
373 HG22 THR 50 2HG2 THR 50 10.813 0.187 6.876
374 HG23 THR 50 3HG2 THR 50 12.430 0.828 6.485
375 H ASN 51 H ASN 51 9.789 -2.401 5.351
376 HA ASN 51 HA ASN 51 10.680 -4.402 7.168
377 HB2 ASN 51 2HB ASN 51 9.485 -1.918 8.239
378 HB3 ASN 51 3HB ASN 51 8.438 -3.283 8.566
379 HD21 ASN 51 1HD2 ASN 51 10.515 -5.359 8.980
380 HD22 ASN 51 2HD2 ASN 51 11.445 -4.804 10.357
381 H LYS 52 H LYS 52 9.476 -6.141 6.440
382 HA LYS 52 HA LYS 52 7.337 -5.994 4.632
383 HB2 LYS 52 2HB LYS 52 8.014 -8.151 6.684
384 HB3 LYS 52 3HB LYS 52 6.829 -8.329 5.391
385 HG2 LYS 52 2HG LYS 52 8.456 -8.996 4.022
386 HG3 LYS 52 3HG LYS 52 9.105 -7.362 4.063
387 HD2 LYS 52 2HD LYS 52 10.562 -7.944 5.961
388 HD3 LYS 52 3HD LYS 52 9.863 -9.583 5.991
389 HE2 LYS 52 2HE LYS 52 10.580 -9.898 3.627
390 HE3 LYS 52 3HE LYS 52 11.368 -8.303 3.653
391 HZ1 LYS 52 1HZ LYS 52 11.987 -10.646 5.316
392 HZ2 LYS 52 2HZ LYS 52 12.891 -10.132 4.066
393 HZ3 LYS 52 3HZ LYS 52 12.793 -9.198 5.439
394 H LYS 53 H LYS 53 6.935 -6.723 8.102
395 HA LYS 53 HA LYS 53 4.228 -6.533 8.124
396 HB2 LYS 53 2HB LYS 53 4.415 -6.157 10.559
397 HB3 LYS 53 3HB LYS 53 5.696 -7.248 10.021
398 HG2 LYS 53 2HG LYS 53 7.035 -4.893 9.774
399 HG3 LYS 53 3HG LYS 53 5.871 -4.418 11.019
400 HD2 LYS 53 2HD LYS 53 6.642 -6.438 12.358
401 HD3 LYS 53 3HD LYS 53 7.873 -6.713 11.099
402 HE2 LYS 53 2HE LYS 53 8.634 -4.301 11.465
403 HE3 LYS 53 3HE LYS 53 7.546 -4.242 12.858
404 HZ1 LYS 53 1HZ LYS 53 8.813 -6.099 13.797
405 HZ2 LYS 53 2HZ LYS 53 9.842 -6.064 12.512
406 HZ3 LYS 53 3HZ LYS 53 9.764 -4.778 13.531
407 H CYS 54 H CYS 54 2.630 -5.161 8.150
408 HA CYS 54 HA CYS 54 2.842 -2.789 6.655
409 HB2 CYS 54 2HB CYS 54 0.797 -4.147 7.013
410 HB3 CYS 54 3HB CYS 54 0.757 -3.611 8.696
411 HA PRO 55 HA PRO 55 4.888 -0.288 9.621
412 HB2 PRO 55 2HB PRO 55 4.539 2.260 8.606
413 HB3 PRO 55 3HB PRO 55 5.575 1.011 7.856
414 HG2 PRO 55 2HG PRO 55 2.688 1.670 7.184
415 HG3 PRO 55 3HG PRO 55 4.079 1.544 6.055
416 HD2 PRO 55 2HD PRO 55 2.424 -0.545 6.397
417 HD3 PRO 55 3HD PRO 55 4.193 -0.826 6.343
418 H ILE 56 H ILE 56 1.602 -0.425 9.708
419 HA ILE 56 HA ILE 56 1.588 1.035 12.242
420 HB ILE 56 HB ILE 56 0.726 2.722 10.826
421 HG12 ILE 56 2HG1 ILE 56 -1.712 1.419 12.099
422 HG13 ILE 56 3HG1 ILE 56 -0.401 2.139 13.043
423 HG21 ILE 56 1HG2 ILE 56 -1.410 0.833 9.756
424 HG22 ILE 56 2HG2 ILE 56 -1.133 2.516 9.298
425 HG23 ILE 56 3HG2 ILE 56 0.054 1.299 8.854
426 HD11 ILE 56 1HD1 ILE 56 -2.214 3.748 12.772
427 HD12 ILE 56 2HD1 ILE 56 -0.765 4.317 11.918
428 HD13 ILE 56 3HD1 ILE 56 -2.126 3.616 11.008
429 H CYS 57 H CYS 57 -0.268 -1.080 9.978
430 HA CYS 57 HA CYS 57 -2.008 -2.137 11.967
431 HB2 CYS 57 2HB CYS 57 -1.179 -3.743 9.589
432 HB3 CYS 57 3HB CYS 57 -2.758 -3.548 10.333
433 H ARG 58 H ARG 58 1.346 -2.978 11.292
434 HA ARG 58 HA ARG 58 2.748 -4.203 12.540
435 HB2 ARG 58 2HB ARG 58 1.085 -3.483 14.380
436 HB3 ARG 58 3HB ARG 58 0.468 -5.142 14.302
437 HG2 ARG 58 2HG ARG 58 2.742 -5.999 14.842
438 HG3 ARG 58 3HG ARG 58 3.319 -4.312 14.957
439 HD2 ARG 58 2HD ARG 58 1.585 -3.857 16.678
440 HD3 ARG 58 3HD ARG 58 1.041 -5.545 16.571
441 HE ARG 58 HE ARG 58 3.787 -5.595 17.130
442 HH11 ARG 58 1HH1 ARG 58 3.529 -5.555 20.659
443 HH12 ARG 58 2HH1 ARG 58 4.556 -5.906 19.319
444 HH21 ARG 58 1HH2 ARG 58 1.324 -4.749 20.277
445 HH22 ARG 58 2HH2 ARG 58 0.793 -4.531 18.648
446 H VAL 59 H VAL 59 -0.141 -5.859 11.359
447 HA VAL 59 HA VAL 59 0.778 -8.536 11.608
448 HB VAL 59 HB VAL 59 -0.892 -7.313 9.374
449 HG11 VAL 59 1HG1 VAL 59 -0.741 -10.173 10.412
450 HG12 VAL 59 2HG1 VAL 59 -1.920 -9.574 9.226
451 HG13 VAL 59 3HG1 VAL 59 -0.208 -9.592 8.818
452 HG21 VAL 59 1HG2 VAL 59 -1.932 -6.777 11.562
453 HG22 VAL 59 2HG2 VAL 59 -2.869 -8.011 10.725
454 HG23 VAL 59 3HG2 VAL 59 -1.785 -8.480 12.051
455 H ASP 60 H ASP 60 1.992 -9.842 10.244
456 HA ASP 60 HA ASP 60 3.998 -8.394 8.693
457 HB2 ASP 60 2HB ASP 60 4.569 -10.263 10.271
458 HB3 ASP 60 3HB ASP 60 3.884 -11.373 9.072
459 H ILE 61 H ILE 61 4.331 -8.689 6.476
460 HA ILE 61 HA ILE 61 2.044 -9.847 4.979
461 HB ILE 61 HB ILE 61 2.274 -8.169 3.383
462 HG12 ILE 61 2HG1 ILE 61 4.891 -7.434 4.729
463 HG13 ILE 61 3HG1 ILE 61 4.719 -8.171 3.147
464 HG21 ILE 61 1HG2 ILE 61 1.765 -6.194 4.621
465 HG22 ILE 61 2HG2 ILE 61 1.352 -7.506 5.737
466 HG23 ILE 61 3HG2 ILE 61 2.888 -6.621 5.924
467 HD11 ILE 61 1HD1 ILE 61 5.088 -5.847 2.831
468 HD12 ILE 61 2HD1 ILE 61 3.406 -6.276 2.364
469 HD13 ILE 61 3HD1 ILE 61 3.727 -5.423 3.900
470 H GLU 62 H GLU 62 5.399 -10.126 5.609
471 HA GLU 62 HA GLU 62 6.370 -11.148 3.201
472 HB2 GLU 62 2HB GLU 62 7.684 -10.751 5.334
473 HB3 GLU 62 3HB GLU 62 7.066 -12.288 5.943
474 HG2 GLU 62 2HG GLU 62 8.014 -13.418 3.883
475 HG3 GLU 62 3HG GLU 62 8.656 -11.857 3.369
476 H ALA 63 H ALA 63 4.846 -12.334 2.068
477 HA ALA 63 HA ALA 63 3.726 -14.796 3.200
478 HB1 ALA 63 1HB ALA 63 2.523 -14.914 1.067
479 HB2 ALA 63 2HB ALA 63 2.443 -13.260 1.685
480 HB3 ALA 63 3HB ALA 63 3.571 -13.654 0.368
481 H GLN 64 H GLN 64 3.839 -16.527 0.988
482 HA GLN 64 HA GLN 64 6.377 -17.744 1.326
483 HB2 GLN 64 2HB GLN 64 4.242 -18.894 0.628
484 HB3 GLN 64 3HB GLN 64 4.390 -18.117 -0.953
485 HG2 GLN 64 2HG GLN 64 6.845 -19.224 -0.869
486 HG3 GLN 64 3HG GLN 64 6.066 -20.299 0.291
487 HE21 GLN 64 1HE2 GLN 64 6.773 -19.895 -2.985
488 HE22 GLN 64 2HE2 GLN 64 5.502 -20.931 -3.620
489 H LEU 65 H LEU 65 8.150 -16.501 0.806
490 HA LEU 65 HA LEU 65 8.402 -15.491 -1.988
491 HB2 LEU 65 2HB LEU 65 9.087 -14.409 0.685
492 HB3 LEU 65 3HB LEU 65 10.428 -14.360 -0.441
493 HG LEU 65 HG LEU 65 9.158 -12.294 -0.468
494 HD11 LEU 65 1HD1 LEU 65 9.403 -11.958 -2.709
495 HD12 LEU 65 2HD1 LEU 65 10.195 -13.536 -2.615
496 HD13 LEU 65 3HD1 LEU 65 8.515 -13.421 -3.172
497 HD21 LEU 65 1HD2 LEU 65 6.906 -13.219 0.049
498 HD22 LEU 65 2HD2 LEU 65 6.901 -12.127 -1.355
499 HD23 LEU 65 3HD2 LEU 65 6.810 -13.882 -1.594
500 HA PRO 66 HA PRO 66 11.265 -18.984 -1.820
501 HB2 PRO 66 2HB PRO 66 11.538 -19.470 -4.477
502 HB3 PRO 66 3HB PRO 66 9.997 -19.772 -3.625
503 HG2 PRO 66 2HG PRO 66 10.756 -17.307 -5.233
504 HG3 PRO 66 3HG PRO 66 9.277 -18.310 -5.383
505 HD2 PRO 66 2HD PRO 66 9.364 -16.014 -3.885
506 HD3 PRO 66 3HD PRO 66 8.361 -17.419 -3.402
507 H SER 67 H SER 67 12.630 -17.124 -0.887
508 HA SER 67 HA SER 67 14.649 -16.197 -0.685
509 HB2 SER 67 2HB SER 67 15.429 -18.228 -2.002
510 HB3 SER 67 3HB SER 67 15.481 -17.185 -3.432
511 HG SER 67 HG SER 67 16.782 -16.428 -1.040
512 H GLU 68 H GLU 68 13.933 -15.754 -4.188
513 HA GLU 68 HA GLU 68 13.719 -13.940 -5.479
514 HB2 GLU 68 2HB GLU 68 12.461 -13.048 -3.059
515 HB3 GLU 68 3HB GLU 68 13.412 -11.707 -3.680
516 HG2 GLU 68 2HG GLU 68 11.441 -13.349 -5.340
517 HG3 GLU 68 3HG GLU 68 11.011 -11.871 -4.477
518 H SER 69 H SER 69 14.799 -11.581 -5.764
519 HA SER 69 HA SER 69 17.682 -12.147 -5.386
520 HB2 SER 69 2HB SER 69 16.645 -11.929 -7.694
521 HB3 SER 69 3HB SER 69 16.286 -10.235 -7.300
522 HG SER 69 HG SER 69 18.589 -10.094 -6.791
Start of MODEL 25
1 H1 MET 1 H1 MET 1 -14.677 29.919 -30.967
2 H2 MET 1 H2 MET 1 -13.079 30.215 -31.261
3 H3 MET 1 H3 MET 1 -13.530 29.337 -29.939
4 HA MET 1 HA MET 1 -12.923 31.551 -29.263
5 HB2 MET 1 2HB MET 1 -15.132 32.309 -31.218
6 HB3 MET 1 3HB MET 1 -14.476 33.404 -29.992
7 HG2 MET 1 2HG MET 1 -12.258 33.282 -31.003
8 HG3 MET 1 3HG MET 1 -12.837 32.114 -32.205
9 HE1 MET 1 1HE MET 1 -11.859 33.625 -34.158
10 HE2 MET 1 2HE MET 1 -12.258 35.346 -34.364
11 HE3 MET 1 3HE MET 1 -11.289 34.822 -32.967
12 H LYS 2 H LYS 2 -13.612 30.458 -27.262
13 HA LYS 2 HA LYS 2 -15.840 31.818 -26.296
14 HB2 LYS 2 2HB LYS 2 -16.826 29.500 -27.372
15 HB3 LYS 2 3HB LYS 2 -16.316 28.891 -25.798
16 HG2 LYS 2 2HG LYS 2 -17.570 31.187 -25.001
17 HG3 LYS 2 3HG LYS 2 -18.416 30.943 -26.520
18 HD2 LYS 2 2HD LYS 2 -19.210 28.754 -25.782
19 HD3 LYS 2 3HD LYS 2 -18.160 28.820 -24.342
20 HE2 LYS 2 2HE LYS 2 -19.358 30.904 -23.614
21 HE3 LYS 2 3HE LYS 2 -20.476 30.707 -24.970
22 HZ1 LYS 2 1HZ LYS 2 -21.157 28.603 -24.018
23 HZ2 LYS 2 2HZ LYS 2 -20.084 28.761 -22.778
24 HZ3 LYS 2 3HZ LYS 2 -21.348 29.804 -22.910
25 H GLN 3 H GLN 3 -16.188 30.517 -23.865
26 HA GLN 3 HA GLN 3 -13.589 30.742 -22.586
27 HB2 GLN 3 2HB GLN 3 -16.084 31.359 -21.791
28 HB3 GLN 3 3HB GLN 3 -16.092 29.679 -21.250
29 HG2 GLN 3 2HG GLN 3 -14.199 30.103 -19.778
30 HG3 GLN 3 3HG GLN 3 -13.923 31.695 -20.511
31 HE21 GLN 3 1HE2 GLN 3 -15.142 33.508 -19.774
32 HE22 GLN 3 2HE2 GLN 3 -16.365 33.319 -18.526
33 H ASP 4 H ASP 4 -12.774 28.861 -21.252
34 HA ASP 4 HA ASP 4 -12.720 26.475 -22.894
35 HB2 ASP 4 2HB ASP 4 -10.799 27.629 -21.588
36 HB3 ASP 4 3HB ASP 4 -11.476 26.869 -20.144
37 H GLY 5 H GLY 5 -12.846 24.272 -21.610
38 HA2 GLY 5 2HA GLY 5 -15.310 24.238 -19.914
39 HA3 GLY 5 3HA GLY 5 -14.856 22.959 -21.059
40 H GLU 6 H GLU 6 -15.178 21.783 -18.779
41 HA GLU 6 HA GLU 6 -12.568 21.242 -17.628
42 HB2 GLU 6 2HB GLU 6 -14.442 23.147 -16.414
43 HB3 GLU 6 3HB GLU 6 -14.287 21.736 -15.380
44 HG2 GLU 6 2HG GLU 6 -11.850 23.186 -16.494
45 HG3 GLU 6 3HG GLU 6 -12.657 23.689 -15.008
46 H GLU 7 H GLU 7 -12.788 19.250 -16.222
47 HA GLU 7 HA GLU 7 -15.351 17.935 -16.143
48 HB2 GLU 7 2HB GLU 7 -14.663 17.436 -18.477
49 HB3 GLU 7 3HB GLU 7 -13.175 16.692 -17.886
50 HG2 GLU 7 2HG GLU 7 -14.248 14.766 -17.311
51 HG3 GLU 7 3HG GLU 7 -15.551 15.633 -16.500
52 H GLY 8 H GLY 8 -15.298 17.063 -14.165
53 HA2 GLY 8 2HA GLY 8 -12.689 16.257 -12.937
54 HA3 GLY 8 3HA GLY 8 -14.086 16.890 -12.050
55 H THR 9 H THR 9 -14.082 14.916 -10.683
56 HA THR 9 HA THR 9 -15.679 12.826 -11.883
57 HB THR 9 HB THR 9 -13.384 12.078 -12.384
58 HG1 THR 9 1HG THR 9 -13.712 10.035 -11.532
59 HG21 THR 9 1HG2 THR 9 -13.093 11.891 -9.363
60 HG22 THR 9 2HG2 THR 9 -11.904 11.380 -10.580
61 HG23 THR 9 3HG2 THR 9 -12.294 13.103 -10.385
62 H GLU 10 H GLU 10 -16.101 11.157 -9.995
63 HA GLU 10 HA GLU 10 -16.771 12.757 -7.560
64 HB2 GLU 10 2HB GLU 10 -17.945 10.233 -8.772
65 HB3 GLU 10 3HB GLU 10 -18.187 10.646 -7.067
66 HG2 GLU 10 2HG GLU 10 -19.072 12.886 -7.752
67 HG3 GLU 10 3HG GLU 10 -18.959 12.383 -9.444
68 H GLU 11 H GLU 11 -14.844 9.948 -8.669
69 HA GLU 11 HA GLU 11 -14.534 8.811 -6.061
70 HB2 GLU 11 2HB GLU 11 -14.042 7.644 -8.202
71 HB3 GLU 11 3HB GLU 11 -12.619 8.649 -8.436
72 HG2 GLU 11 2HG GLU 11 -13.102 6.803 -6.040
73 HG3 GLU 11 3HG GLU 11 -12.218 6.333 -7.481
74 H ASP 12 H ASP 12 -13.530 9.674 -4.347
75 HA ASP 12 HA ASP 12 -10.905 10.794 -4.618
76 HB2 ASP 12 2HB ASP 12 -12.269 12.856 -5.049
77 HB3 ASP 12 3HB ASP 12 -13.098 12.609 -3.510
78 H THR 13 H THR 13 -9.874 10.430 -2.737
79 HA THR 13 HA THR 13 -9.396 9.370 -0.736
80 HB THR 13 HB THR 13 -11.891 10.938 -0.039
81 HG1 THR 13 1HG THR 13 -10.224 12.096 -0.988
82 HG21 THR 13 1HG2 THR 13 -9.733 9.769 1.770
83 HG22 THR 13 2HG2 THR 13 -10.714 11.189 2.214
84 HG23 THR 13 3HG2 THR 13 -11.497 9.634 1.934
85 H GLU 14 H GLU 14 -11.163 7.869 -2.730
86 HA GLU 14 HA GLU 14 -12.118 5.811 -0.811
87 HB2 GLU 14 2HB GLU 14 -12.485 6.238 -3.792
88 HB3 GLU 14 3HB GLU 14 -12.882 4.724 -2.998
89 HG2 GLU 14 2HG GLU 14 -14.472 5.856 -1.522
90 HG3 GLU 14 3HG GLU 14 -13.953 7.443 -2.088
91 H GLU 15 H GLU 15 -10.090 6.007 -3.844
92 HA GLU 15 HA GLU 15 -8.506 3.767 -2.629
93 HB2 GLU 15 2HB GLU 15 -7.827 3.282 -4.972
94 HB3 GLU 15 3HB GLU 15 -9.500 2.951 -4.542
95 HG2 GLU 15 2HG GLU 15 -10.342 4.768 -5.792
96 HG3 GLU 15 3HG GLU 15 -8.779 5.561 -5.905
97 H LYS 16 H LYS 16 -7.189 5.160 -1.326
98 HA LYS 16 HA LYS 16 -5.069 6.440 -2.978
99 HB2 LYS 16 2HB LYS 16 -4.714 7.999 -0.961
100 HB3 LYS 16 3HB LYS 16 -6.027 8.348 -2.082
101 HG2 LYS 16 2HG LYS 16 -7.688 7.497 -0.600
102 HG3 LYS 16 3HG LYS 16 -6.450 6.807 0.457
103 HD2 LYS 16 2HD LYS 16 -7.465 8.903 1.353
104 HD3 LYS 16 3HD LYS 16 -5.709 9.028 1.147
105 HE2 LYS 16 2HE LYS 16 -5.886 10.408 -0.762
106 HE3 LYS 16 3HE LYS 16 -7.546 9.913 -1.085
107 HZ1 LYS 16 1HZ LYS 16 -8.282 11.161 0.807
108 HZ2 LYS 16 2HZ LYS 16 -6.736 11.646 1.158
109 HZ3 LYS 16 3HZ LYS 16 -7.514 12.113 -0.228
110 H CYS 17 H CYS 17 -3.115 6.062 -2.600
111 HA CYS 17 HA CYS 17 -1.940 3.832 -1.139
112 HB2 CYS 17 2HB CYS 17 -1.162 4.984 -3.260
113 HB3 CYS 17 3HB CYS 17 -0.877 6.424 -2.306
114 H THR 18 H THR 18 -1.766 3.840 1.094
115 HA THR 18 HA THR 18 -1.913 6.307 2.577
116 HB THR 18 HB THR 18 -2.585 3.908 3.273
117 HG1 THR 18 1HG THR 18 -2.203 4.556 5.465
118 HG21 THR 18 1HG2 THR 18 -0.229 3.017 2.971
119 HG22 THR 18 2HG2 THR 18 0.243 3.967 4.392
120 HG23 THR 18 3HG2 THR 18 -0.971 2.682 4.554
121 H ILE 19 H ILE 19 0.784 4.682 0.977
122 HA ILE 19 HA ILE 19 2.759 5.602 2.858
123 HB ILE 19 HB ILE 19 2.801 4.232 0.170
124 HG12 ILE 19 2HG1 ILE 19 3.863 3.178 2.805
125 HG13 ILE 19 3HG1 ILE 19 2.124 3.130 2.502
126 HG21 ILE 19 1HG2 ILE 19 4.812 5.538 0.213
127 HG22 ILE 19 2HG2 ILE 19 5.084 5.185 1.934
128 HG23 ILE 19 3HG2 ILE 19 5.292 3.908 0.721
129 HD11 ILE 19 1HD1 ILE 19 2.411 1.837 0.487
130 HD12 ILE 19 2HD1 ILE 19 4.178 1.946 0.607
131 HD13 ILE 19 3HD1 ILE 19 3.268 1.038 1.828
132 H CYS 20 H CYS 20 1.851 6.501 -0.542
133 HA CYS 20 HA CYS 20 3.504 9.022 -0.337
134 HB2 CYS 20 2HB CYS 20 2.977 9.272 -2.675
135 HB3 CYS 20 3HB CYS 20 3.784 7.728 -2.367
136 H LEU 21 H LEU 21 0.455 8.010 0.630
137 HA LEU 21 HA LEU 21 -1.512 9.036 1.023
138 HB2 LEU 21 2HB LEU 21 0.417 11.308 1.536
139 HB3 LEU 21 3HB LEU 21 -1.266 11.289 2.077
140 HG LEU 21 HG LEU 21 0.731 9.109 2.820
141 HD11 LEU 21 1HD1 LEU 21 1.529 11.249 3.677
142 HD12 LEU 21 2HD1 LEU 21 -0.062 11.562 4.418
143 HD13 LEU 21 3HD1 LEU 21 0.947 10.206 4.985
144 HD21 LEU 21 1HD2 LEU 21 -0.890 8.623 4.615
145 HD22 LEU 21 2HD2 LEU 21 -1.945 9.940 4.053
146 HD23 LEU 21 3HD2 LEU 21 -1.684 8.495 3.052
147 H SER 22 H SER 22 -1.392 8.701 -1.569
148 HA SER 22 HA SER 22 -2.695 11.145 -2.649
149 HB2 SER 22 2HB SER 22 -0.407 11.136 -3.548
150 HB3 SER 22 3HB SER 22 -0.599 9.453 -4.081
151 HG SER 22 HG SER 22 -2.060 10.090 -5.611
152 H ILE 23 H ILE 23 -4.268 10.630 -4.323
153 HA ILE 23 HA ILE 23 -5.577 8.075 -4.116
154 HB ILE 23 HB ILE 23 -5.815 10.605 -5.774
155 HG12 ILE 23 2HG1 ILE 23 -6.599 10.468 -3.351
156 HG13 ILE 23 3HG1 ILE 23 -7.796 11.005 -4.523
157 HG21 ILE 23 1HG2 ILE 23 -7.987 9.664 -6.673
158 HG22 ILE 23 2HG2 ILE 23 -6.492 9.057 -7.379
159 HG23 ILE 23 3HG2 ILE 23 -7.392 8.054 -6.229
160 HD11 ILE 23 1HD1 ILE 23 -7.674 8.054 -3.907
161 HD12 ILE 23 2HD1 ILE 23 -8.376 9.127 -2.722
162 HD13 ILE 23 3HD1 ILE 23 -9.046 9.064 -4.369
163 H LEU 24 H LEU 24 -5.754 6.642 -5.861
164 HA LEU 24 HA LEU 24 -3.335 6.225 -7.499
165 HB2 LEU 24 2HB LEU 24 -5.692 4.478 -6.619
166 HB3 LEU 24 3HB LEU 24 -4.274 3.878 -7.483
167 HG LEU 24 HG LEU 24 -4.053 5.204 -4.744
168 HD11 LEU 24 1HD1 LEU 24 -4.261 2.271 -5.454
169 HD12 LEU 24 2HD1 LEU 24 -3.911 2.959 -3.841
170 HD13 LEU 24 3HD1 LEU 24 -5.477 3.266 -4.615
171 HD21 LEU 24 1HD2 LEU 24 -2.205 3.726 -6.637
172 HD22 LEU 24 2HD2 LEU 24 -1.992 5.302 -5.849
173 HD23 LEU 24 3HD2 LEU 24 -1.884 3.791 -4.899
174 H GLU 25 H GLU 25 -5.000 4.385 -9.230
175 HA GLU 25 HA GLU 25 -7.257 5.725 -10.142
176 HB2 GLU 25 2HB GLU 25 -6.583 6.155 -12.466
177 HB3 GLU 25 3HB GLU 25 -5.608 7.114 -11.346
178 HG2 GLU 25 2HG GLU 25 -3.778 5.438 -11.531
179 HG3 GLU 25 3HG GLU 25 -4.746 4.541 -12.719
180 H GLU 26 H GLU 26 -8.098 4.394 -12.181
181 HA GLU 26 HA GLU 26 -8.069 1.659 -11.364
182 HB2 GLU 26 2HB GLU 26 -9.981 2.897 -12.537
183 HB3 GLU 26 3HB GLU 26 -9.035 2.786 -14.026
184 HG2 GLU 26 2HG GLU 26 -8.973 0.159 -13.190
185 HG3 GLU 26 3HG GLU 26 -10.506 0.666 -12.498
186 H GLY 27 H GLY 27 -6.646 0.068 -11.913
187 HA2 GLY 27 2HA GLY 27 -5.372 -1.266 -13.322
188 HA3 GLY 27 3HA GLY 27 -5.677 -0.116 -14.633
189 H GLU 28 H GLU 28 -4.245 0.912 -11.548
190 HA GLU 28 HA GLU 28 -1.812 1.647 -13.037
191 HB2 GLU 28 2HB GLU 28 -3.358 3.143 -11.498
192 HB3 GLU 28 3HB GLU 28 -2.425 2.441 -10.186
193 HG2 GLU 28 2HG GLU 28 -0.578 3.261 -12.264
194 HG3 GLU 28 3HG GLU 28 -1.720 4.576 -12.041
195 H ASP 29 H ASP 29 0.208 1.718 -11.104
196 HA ASP 29 HA ASP 29 0.726 -1.157 -10.901
197 HB2 ASP 29 2HB ASP 29 2.383 1.268 -10.169
198 HB3 ASP 29 3HB ASP 29 2.940 -0.401 -10.153
199 H VAL 30 H VAL 30 -0.527 -1.954 -9.162
200 HA VAL 30 HA VAL 30 -0.074 -0.692 -6.518
201 HB VAL 30 HB VAL 30 -2.467 -1.107 -5.982
202 HG11 VAL 30 1HG1 VAL 30 -1.944 0.855 -8.251
203 HG12 VAL 30 2HG1 VAL 30 -3.322 0.895 -7.141
204 HG13 VAL 30 3HG1 VAL 30 -1.682 1.144 -6.518
205 HG21 VAL 30 1HG2 VAL 30 -2.853 -1.420 -8.985
206 HG22 VAL 30 2HG2 VAL 30 -2.992 -2.736 -7.797
207 HG23 VAL 30 3HG2 VAL 30 -4.115 -1.365 -7.748
208 H ARG 31 H ARG 31 -0.937 -2.267 -4.778
209 HA ARG 31 HA ARG 31 -0.468 -5.033 -5.515
210 HB2 ARG 31 2HB ARG 31 1.335 -3.290 -3.827
211 HB3 ARG 31 3HB ARG 31 1.168 -4.977 -3.335
212 HG2 ARG 31 2HG ARG 31 2.009 -4.181 -6.142
213 HG3 ARG 31 3HG ARG 31 3.164 -4.432 -4.848
214 HD2 ARG 31 2HD ARG 31 1.142 -6.609 -5.330
215 HD3 ARG 31 3HD ARG 31 2.441 -6.394 -6.517
216 HE ARG 31 HE ARG 31 3.630 -6.387 -3.968
217 HH11 ARG 31 1HH1 ARG 31 4.536 -9.796 -3.998
218 HH12 ARG 31 2HH1 ARG 31 4.884 -8.248 -3.329
219 HH21 ARG 31 1HH2 ARG 31 2.811 -10.029 -5.608
220 HH22 ARG 31 2HH2 ARG 31 1.918 -8.628 -6.084
221 H ARG 32 H ARG 32 -0.928 -6.415 -3.491
222 HA ARG 32 HA ARG 32 -2.806 -5.032 -1.659
223 HB2 ARG 32 2HB ARG 32 -3.783 -6.313 -3.792
224 HB3 ARG 32 3HB ARG 32 -3.409 -7.761 -2.864
225 HG2 ARG 32 2HG ARG 32 -5.290 -5.479 -2.137
226 HG3 ARG 32 3HG ARG 32 -5.703 -7.142 -2.540
227 HD2 ARG 32 2HD ARG 32 -4.114 -7.588 -0.335
228 HD3 ARG 32 3HD ARG 32 -4.670 -5.972 0.023
229 HE ARG 32 HE ARG 32 -6.804 -6.750 0.381
230 HH11 ARG 32 1HH1 ARG 32 -8.276 -9.897 -0.190
231 HH12 ARG 32 2HH1 ARG 32 -8.488 -8.348 0.539
232 HH21 ARG 32 1HH2 ARG 32 -6.222 -10.443 -1.249
233 HH22 ARG 32 2HH2 ARG 32 -4.972 -9.252 -1.301
234 H LEU 33 H LEU 33 -2.191 -5.438 0.303
235 HA LEU 33 HA LEU 33 -0.441 -7.766 0.898
236 HB2 LEU 33 2HB LEU 33 0.000 -6.265 3.007
237 HB3 LEU 33 3HB LEU 33 0.824 -5.910 1.501
238 HG LEU 33 HG LEU 33 -1.813 -4.569 2.031
239 HD11 LEU 33 1HD1 LEU 33 -0.617 -2.800 3.352
240 HD12 LEU 33 2HD1 LEU 33 -0.582 -4.361 4.195
241 HD13 LEU 33 3HD1 LEU 33 0.852 -3.784 3.337
242 HD21 LEU 33 1HD2 LEU 33 0.851 -3.509 0.962
243 HD22 LEU 33 2HD2 LEU 33 -0.406 -4.167 -0.091
244 HD23 LEU 33 3HD2 LEU 33 -0.734 -2.717 0.859
245 HA PRO 34 HA PRO 34 -3.500 -9.774 2.935
246 HB2 PRO 34 2HB PRO 34 -2.406 -10.893 5.204
247 HB3 PRO 34 3HB PRO 34 -1.985 -11.382 3.532
248 HG2 PRO 34 2HG PRO 34 -0.465 -9.550 5.385
249 HG3 PRO 34 3HG PRO 34 0.164 -10.810 4.273
250 HD2 PRO 34 2HD PRO 34 0.089 -8.117 3.770
251 HD3 PRO 34 3HD PRO 34 0.113 -9.326 2.480
252 H CYS 35 H CYS 35 -2.062 -7.248 4.820
253 HA CYS 35 HA CYS 35 -4.081 -6.863 6.911
254 HB2 CYS 35 2HB CYS 35 -1.641 -6.088 6.771
255 HB3 CYS 35 3HB CYS 35 -2.218 -4.934 5.552
256 H MET 36 H MET 36 -4.916 -7.121 3.800
257 HA MET 36 HA MET 36 -6.251 -6.092 2.322
258 HB2 MET 36 2HB MET 36 -7.780 -5.615 4.903
259 HB3 MET 36 3HB MET 36 -8.446 -5.381 3.280
260 HG2 MET 36 2HG MET 36 -7.270 -7.913 3.124
261 HG3 MET 36 3HG MET 36 -7.968 -7.877 4.744
262 HE1 MET 36 1HE MET 36 -10.643 -9.951 2.812
263 HE2 MET 36 2HE MET 36 -8.884 -10.004 2.538
264 HE3 MET 36 3HE MET 36 -9.525 -9.875 4.193
265 H HIS 37 H HIS 37 -4.202 -4.565 2.436
266 HA HIS 37 HA HIS 37 -5.317 -1.813 2.527
267 HB2 HIS 37 1HB HIS 37 -2.940 -2.978 3.865
268 HB3 HIS 37 2HB HIS 37 -2.573 -1.559 2.899
269 HD2 HIS 37 2HD HIS 37 -5.116 0.224 3.421
270 HE1 HIS 37 1HE HIS 37 -4.160 0.007 7.554
271 HE2 HIS 37 2HE HIS 37 -5.502 1.262 5.780
272 H LEU 38 H LEU 38 -5.284 -0.838 0.587
273 HA LEU 38 HA LEU 38 -4.020 -2.171 -1.724
274 HB2 LEU 38 2HB LEU 38 -6.353 -1.463 -1.956
275 HB3 LEU 38 3HB LEU 38 -5.977 0.142 -1.327
276 HG LEU 38 HG LEU 38 -4.584 0.614 -3.343
277 HD11 LEU 38 1HD1 LEU 38 -4.805 -0.876 -5.304
278 HD12 LEU 38 2HD1 LEU 38 -3.945 -1.678 -3.982
279 HD13 LEU 38 3HD1 LEU 38 -5.652 -2.075 -4.308
280 HD21 LEU 38 1HD2 LEU 38 -6.942 1.296 -3.242
281 HD22 LEU 38 2HD2 LEU 38 -6.483 0.852 -4.892
282 HD23 LEU 38 3HD2 LEU 38 -7.442 -0.273 -3.911
283 H PHE 39 H PHE 39 -1.897 -1.577 -2.066
284 HA PHE 39 HA PHE 39 -1.105 1.251 -1.471
285 HB2 PHE 39 2HB PHE 39 0.417 -1.351 -1.036
286 HB3 PHE 39 3HB PHE 39 1.213 0.197 -1.095
287 HD1 PHE 39 1HD PHE 39 -1.795 0.970 0.645
288 HD2 PHE 39 2HD PHE 39 1.926 -1.120 1.123
289 HE1 PHE 39 1HE PHE 39 -2.055 1.076 3.069
290 HE2 PHE 39 2HE PHE 39 1.713 -0.933 3.581
291 HZ PHE 39 HZ PHE 39 -0.295 0.148 4.570
292 H HIS 40 H HIS 40 0.932 1.788 -2.796
293 HA HIS 40 HA HIS 40 0.511 1.175 -5.652
294 HB2 HIS 40 1HB HIS 40 2.227 2.903 -3.986
295 HB3 HIS 40 2HB HIS 40 3.027 2.330 -5.434
296 HD2 HIS 40 2HD HIS 40 1.024 2.806 -7.758
297 HE1 HIS 40 1HE HIS 40 0.738 6.758 -6.239
298 HE2 HIS 40 2HE HIS 40 0.310 5.191 -8.266
299 H GLN 41 H GLN 41 2.499 0.441 -6.901
300 HA GLN 41 HA GLN 41 3.599 -1.985 -5.755
301 HB2 GLN 41 2HB GLN 41 2.766 -1.495 -8.137
302 HB3 GLN 41 3HB GLN 41 4.335 -0.739 -8.426
303 HG2 GLN 41 2HG GLN 41 5.455 -2.775 -8.338
304 HG3 GLN 41 3HG GLN 41 4.300 -3.502 -7.217
305 HE21 GLN 41 1HE2 GLN 41 1.800 -3.511 -8.388
306 HE22 GLN 41 2HE2 GLN 41 1.941 -4.235 -9.970
307 H VAL 42 H VAL 42 5.102 1.067 -7.115
308 HA VAL 42 HA VAL 42 7.674 0.384 -6.072
309 HB VAL 42 HB VAL 42 6.611 3.148 -6.786
310 HG11 VAL 42 1HG1 VAL 42 9.472 2.073 -6.653
311 HG12 VAL 42 2HG1 VAL 42 8.986 3.709 -7.146
312 HG13 VAL 42 3HG1 VAL 42 8.752 3.188 -5.474
313 HG21 VAL 42 1HG2 VAL 42 6.386 1.632 -8.712
314 HG22 VAL 42 2HG2 VAL 42 7.777 2.689 -8.972
315 HG23 VAL 42 3HG2 VAL 42 8.031 1.013 -8.449
316 H CYS 43 H CYS 43 5.083 2.548 -4.704
317 HA CYS 43 HA CYS 43 6.484 3.292 -2.336
318 HB2 CYS 43 2HB CYS 43 3.551 2.598 -2.436
319 HB3 CYS 43 3HB CYS 43 4.388 3.655 -1.331
320 H VAL 44 H VAL 44 4.451 0.240 -2.917
321 HA VAL 44 HA VAL 44 5.073 -0.527 -0.261
322 HB VAL 44 HB VAL 44 3.011 -1.171 -1.577
323 HG11 VAL 44 1HG1 VAL 44 4.869 -3.446 -2.426
324 HG12 VAL 44 2HG1 VAL 44 3.121 -3.347 -2.662
325 HG13 VAL 44 3HG1 VAL 44 4.204 -2.225 -3.521
326 HG21 VAL 44 1HG2 VAL 44 2.717 -3.098 -0.241
327 HG22 VAL 44 2HG2 VAL 44 4.471 -3.403 -0.156
328 HG23 VAL 44 3HG2 VAL 44 3.790 -2.008 0.680
329 H ASP 45 H ASP 45 6.823 -0.897 -3.253
330 HA ASP 45 HA ASP 45 8.430 -3.158 -2.497
331 HB2 ASP 45 2HB ASP 45 8.575 -2.296 -4.756
332 HB3 ASP 45 3HB ASP 45 9.085 -0.707 -4.183
333 H GLN 46 H GLN 46 9.026 0.372 -2.126
334 HA GLN 46 HA GLN 46 11.170 -0.084 -0.266
335 HB2 GLN 46 2HB GLN 46 9.508 2.405 -0.850
336 HB3 GLN 46 3HB GLN 46 10.948 2.395 0.181
337 HG2 GLN 46 2HG GLN 46 10.907 1.570 -2.763
338 HG3 GLN 46 3HG GLN 46 11.452 3.127 -2.139
339 HE21 GLN 46 1HE2 GLN 46 12.499 -0.084 -2.929
340 HE22 GLN 46 2HE2 GLN 46 14.053 0.050 -2.134
341 H ALA 47 H ALA 47 7.711 0.073 0.250
342 HA ALA 47 HA ALA 47 7.893 0.480 3.095
343 HB1 ALA 47 1HB ALA 47 5.827 0.681 1.693
344 HB2 ALA 47 2HB ALA 47 5.799 -1.098 1.568
345 HB3 ALA 47 3HB ALA 47 5.618 -0.320 3.152
346 H LEU 48 H LEU 48 7.351 -2.510 1.227
347 HA LEU 48 HA LEU 48 7.455 -4.379 3.259
348 HB2 LEU 48 2HB LEU 48 6.555 -4.693 1.012
349 HB3 LEU 48 3HB LEU 48 8.157 -4.605 0.291
350 HG LEU 48 HG LEU 48 7.592 -6.715 2.386
351 HD11 LEU 48 1HD1 LEU 48 6.778 -6.875 -0.547
352 HD12 LEU 48 2HD1 LEU 48 6.770 -8.233 0.604
353 HD13 LEU 48 3HD1 LEU 48 5.678 -6.864 0.845
354 HD21 LEU 48 1HD2 LEU 48 9.136 -8.050 0.943
355 HD22 LEU 48 2HD2 LEU 48 9.254 -6.692 -0.189
356 HD23 LEU 48 3HD2 LEU 48 9.913 -6.543 1.448
357 H ILE 49 H ILE 49 10.184 -3.145 1.232
358 HA ILE 49 HA ILE 49 12.105 -4.855 2.546
359 HB ILE 49 HB ILE 49 13.795 -3.548 1.466
360 HG12 ILE 49 2HG1 ILE 49 12.698 -1.644 -0.128
361 HG13 ILE 49 3HG1 ILE 49 11.745 -1.471 1.359
362 HG21 ILE 49 1HG2 ILE 49 12.606 -5.220 0.138
363 HG22 ILE 49 2HG2 ILE 49 11.443 -4.000 -0.404
364 HG23 ILE 49 3HG2 ILE 49 13.142 -3.864 -0.866
365 HD11 ILE 49 1HD1 ILE 49 14.765 -1.336 1.107
366 HD12 ILE 49 2HD1 ILE 49 13.656 -0.003 1.500
367 HD13 ILE 49 3HD1 ILE 49 13.899 -1.330 2.656
368 H THR 50 H THR 50 10.812 -1.579 3.272
369 HA THR 50 HA THR 50 12.799 -0.969 5.213
370 HB THR 50 HB THR 50 10.024 0.073 4.608
371 HG1 THR 50 1HG THR 50 11.573 0.860 3.344
372 HG21 THR 50 1HG2 THR 50 10.387 1.873 6.259
373 HG22 THR 50 2HG2 THR 50 10.090 0.305 7.020
374 HG23 THR 50 3HG2 THR 50 11.750 0.957 6.943
375 H ASN 51 H ASN 51 9.589 -2.561 5.407
376 HA ASN 51 HA ASN 51 10.486 -4.296 7.471
377 HB2 ASN 51 2HB ASN 51 8.877 -1.917 8.236
378 HB3 ASN 51 3HB ASN 51 8.065 -3.423 8.630
379 HD21 ASN 51 1HD2 ASN 51 10.002 -1.191 10.040
380 HD22 ASN 51 2HD2 ASN 51 10.870 -2.233 11.146
381 H LYS 52 H LYS 52 9.350 -6.208 7.095
382 HA LYS 52 HA LYS 52 7.411 -6.414 4.981
383 HB2 LYS 52 2HB LYS 52 7.875 -8.248 7.379
384 HB3 LYS 52 3HB LYS 52 6.958 -8.651 5.932
385 HG2 LYS 52 2HG LYS 52 9.934 -7.984 5.839
386 HG3 LYS 52 3HG LYS 52 9.300 -9.600 6.144
387 HD2 LYS 52 2HD LYS 52 7.927 -9.270 3.962
388 HD3 LYS 52 3HD LYS 52 9.073 -7.973 3.606
389 HE2 LYS 52 2HE LYS 52 9.939 -10.805 4.364
390 HE3 LYS 52 3HE LYS 52 9.542 -10.371 2.702
391 HZ1 LYS 52 1HZ LYS 52 11.884 -10.189 3.044
392 HZ2 LYS 52 2HZ LYS 52 11.293 -8.692 2.795
393 HZ3 LYS 52 3HZ LYS 52 11.693 -9.181 4.321
394 H LYS 53 H LYS 53 6.724 -6.823 8.498
395 HA LYS 53 HA LYS 53 4.026 -6.623 8.126
396 HB2 LYS 53 2HB LYS 53 3.784 -6.199 10.512
397 HB3 LYS 53 3HB LYS 53 5.081 -7.348 10.246
398 HG2 LYS 53 2HG LYS 53 6.160 -4.624 10.333
399 HG3 LYS 53 3HG LYS 53 5.107 -4.894 11.705
400 HD2 LYS 53 2HD LYS 53 6.959 -5.712 12.688
401 HD3 LYS 53 3HD LYS 53 6.635 -7.205 11.788
402 HE2 LYS 53 2HE LYS 53 8.067 -6.338 9.918
403 HE3 LYS 53 3HE LYS 53 8.290 -4.839 10.820
404 HZ1 LYS 53 1HZ LYS 53 9.338 -7.483 11.560
405 HZ2 LYS 53 2HZ LYS 53 10.164 -6.123 11.090
406 HZ3 LYS 53 3HZ LYS 53 9.402 -6.150 12.540
407 H CYS 54 H CYS 54 2.413 -5.207 8.194
408 HA CYS 54 HA CYS 54 2.658 -2.860 6.620
409 HB2 CYS 54 2HB CYS 54 0.613 -4.246 7.035
410 HB3 CYS 54 3HB CYS 54 0.589 -3.625 8.682
411 HA PRO 55 HA PRO 55 4.445 -0.220 9.687
412 HB2 PRO 55 2HB PRO 55 4.096 2.278 8.562
413 HB3 PRO 55 3HB PRO 55 5.284 1.070 7.986
414 HG2 PRO 55 2HG PRO 55 2.514 1.621 6.898
415 HG3 PRO 55 3HG PRO 55 4.044 1.430 5.985
416 HD2 PRO 55 2HD PRO 55 2.284 -0.623 6.261
417 HD3 PRO 55 3HD PRO 55 4.050 -0.915 6.314
418 H ILE 56 H ILE 56 1.100 0.406 8.658
419 HA ILE 56 HA ILE 56 0.572 2.053 11.061
420 HB ILE 56 HB ILE 56 -1.195 1.085 8.777
421 HG12 ILE 56 2HG1 ILE 56 -1.030 3.954 9.031
422 HG13 ILE 56 3HG1 ILE 56 0.616 3.338 9.128
423 HG21 ILE 56 1HG2 ILE 56 -2.903 2.675 9.664
424 HG22 ILE 56 2HG2 ILE 56 -2.622 1.305 10.742
425 HG23 ILE 56 3HG2 ILE 56 -1.910 2.885 11.126
426 HD11 ILE 56 1HD1 ILE 56 -1.406 2.749 6.928
427 HD12 ILE 56 2HD1 ILE 56 0.030 3.792 6.809
428 HD13 ILE 56 3HD1 ILE 56 0.222 2.037 7.020
429 H CYS 57 H CYS 57 -0.145 -1.214 9.792
430 HA CYS 57 HA CYS 57 -1.768 -1.943 12.205
431 HB2 CYS 57 2HB CYS 57 -1.037 -3.801 9.965
432 HB3 CYS 57 3HB CYS 57 -2.505 -3.704 10.925
433 H ARG 58 H ARG 58 -0.885 -4.642 12.332
434 HA ARG 58 HA ARG 58 2.056 -4.512 12.468
435 HB2 ARG 58 2HB ARG 58 1.149 -3.934 14.773
436 HB3 ARG 58 3HB ARG 58 0.518 -5.581 14.874
437 HG2 ARG 58 2HG ARG 58 3.335 -5.565 14.026
438 HG3 ARG 58 3HG ARG 58 3.142 -4.639 15.506
439 HD2 ARG 58 2HD ARG 58 2.024 -7.454 15.185
440 HD3 ARG 58 3HD ARG 58 3.668 -7.118 15.753
441 HE ARG 58 HE ARG 58 1.906 -5.571 17.303
442 HH11 ARG 58 1HH1 ARG 58 1.584 -7.909 19.938
443 HH12 ARG 58 2HH1 ARG 58 1.439 -6.249 19.492
444 HH21 ARG 58 1HH2 ARG 58 2.294 -9.506 18.324
445 HH22 ARG 58 2HH2 ARG 58 2.629 -8.966 16.717
446 H VAL 59 H VAL 59 -0.144 -5.833 10.811
447 HA VAL 59 HA VAL 59 0.280 -8.690 11.398
448 HB VAL 59 HB VAL 59 -1.060 -7.537 8.925
449 HG11 VAL 59 1HG1 VAL 59 -1.501 -10.079 10.562
450 HG12 VAL 59 2HG1 VAL 59 -2.330 -9.652 9.051
451 HG13 VAL 59 3HG1 VAL 59 -0.593 -9.980 9.035
452 HG21 VAL 59 1HG2 VAL 59 -3.244 -7.734 10.169
453 HG22 VAL 59 2HG2 VAL 59 -2.320 -7.881 11.680
454 HG23 VAL 59 3HG2 VAL 59 -2.243 -6.390 10.705
455 H ASP 60 H ASP 60 1.720 -9.934 10.232
456 HA ASP 60 HA ASP 60 3.760 -8.491 8.755
457 HB2 ASP 60 2HB ASP 60 4.128 -10.485 10.294
458 HB3 ASP 60 3HB ASP 60 3.508 -11.488 8.970
459 H ILE 61 H ILE 61 4.123 -8.662 6.514
460 HA ILE 61 HA ILE 61 1.804 -9.631 4.945
461 HB ILE 61 HB ILE 61 2.296 -8.071 3.288
462 HG12 ILE 61 2HG1 ILE 61 4.894 -7.564 4.758
463 HG13 ILE 61 3HG1 ILE 61 4.695 -8.213 3.149
464 HG21 ILE 61 1HG2 ILE 61 2.790 -6.532 5.847
465 HG22 ILE 61 2HG2 ILE 61 1.816 -6.053 4.437
466 HG23 ILE 61 3HG2 ILE 61 1.219 -7.331 5.505
467 HD11 ILE 61 1HD1 ILE 61 3.887 -5.407 3.964
468 HD12 ILE 61 2HD1 ILE 61 5.294 -5.866 2.992
469 HD13 ILE 61 3HD1 ILE 61 3.637 -6.155 2.371
470 H GLU 62 H GLU 62 5.124 -10.153 5.636
471 HA GLU 62 HA GLU 62 6.332 -11.080 3.390
472 HB2 GLU 62 2HB GLU 62 7.315 -11.009 5.645
473 HB3 GLU 62 3HB GLU 62 6.325 -12.377 6.154
474 HG2 GLU 62 2HG GLU 62 7.458 -13.834 4.514
475 HG3 GLU 62 3HG GLU 62 8.378 -12.450 3.901
476 H ALA 63 H ALA 63 4.574 -13.300 5.520
477 HA ALA 63 HA ALA 63 3.592 -15.286 5.248
478 HB1 ALA 63 1HB ALA 63 2.066 -15.607 3.373
479 HB2 ALA 63 2HB ALA 63 1.985 -13.925 3.941
480 HB3 ALA 63 3HB ALA 63 2.874 -14.314 2.457
481 H GLN 64 H GLN 64 3.557 -17.367 3.926
482 HA GLN 64 HA GLN 64 4.747 -19.152 3.185
483 HB2 GLN 64 2HB GLN 64 5.428 -17.049 1.132
484 HB3 GLN 64 3HB GLN 64 5.951 -18.731 0.963
485 HG2 GLN 64 2HG GLN 64 3.791 -19.562 0.755
486 HG3 GLN 64 3HG GLN 64 3.050 -18.217 1.621
487 HE21 GLN 64 1HE2 GLN 64 2.579 -16.226 0.511
488 HE22 GLN 64 2HE2 GLN 64 2.614 -16.199 -1.247
489 H LEU 65 H LEU 65 5.988 -19.558 4.912
490 HA LEU 65 HA LEU 65 8.360 -18.823 5.862
491 HB2 LEU 65 2HB LEU 65 6.946 -21.366 5.549
492 HB3 LEU 65 3HB LEU 65 8.685 -21.626 5.547
493 HG LEU 65 HG LEU 65 7.393 -19.890 7.670
494 HD11 LEU 65 1HD1 LEU 65 7.742 -22.921 7.667
495 HD12 LEU 65 2HD1 LEU 65 7.370 -21.941 9.104
496 HD13 LEU 65 3HD1 LEU 65 6.213 -22.020 7.765
497 HD21 LEU 65 1HD2 LEU 65 9.406 -20.536 8.934
498 HD22 LEU 65 2HD2 LEU 65 9.925 -21.607 7.615
499 HD23 LEU 65 3HD2 LEU 65 9.888 -19.848 7.372
500 HA PRO 66 HA PRO 66 11.181 -20.408 2.471
501 HB2 PRO 66 2HB PRO 66 10.332 -21.634 0.205
502 HB3 PRO 66 3HB PRO 66 10.479 -22.518 1.756
503 HG2 PRO 66 2HG PRO 66 7.968 -21.321 0.535
504 HG3 PRO 66 3HG PRO 66 8.196 -22.958 1.222
505 HD2 PRO 66 2HD PRO 66 7.127 -20.860 2.637
506 HD3 PRO 66 3HD PRO 66 8.082 -22.157 3.414
507 H SER 67 H SER 67 11.258 -18.041 2.334
508 HA SER 67 HA SER 67 10.732 -17.265 -0.459
509 HB2 SER 67 2HB SER 67 10.144 -14.929 0.470
510 HB3 SER 67 3HB SER 67 8.890 -16.180 0.486
511 HG SER 67 HG SER 67 9.043 -16.383 2.618
512 H GLU 68 H GLU 68 12.438 -16.080 -1.322
513 HA GLU 68 HA GLU 68 14.832 -15.799 0.389
514 HB2 GLU 68 2HB GLU 68 14.671 -16.816 -2.068
515 HB3 GLU 68 3HB GLU 68 14.722 -15.114 -2.556
516 HG2 GLU 68 2HG GLU 68 16.835 -14.848 -1.225
517 HG3 GLU 68 3HG GLU 68 16.749 -16.557 -0.779
518 H SER 69 H SER 69 15.903 -13.527 0.399
519 HA SER 69 HA SER 69 14.274 -11.303 -0.371
520 HB2 SER 69 2HB SER 69 13.051 -12.189 1.682
521 HB3 SER 69 3HB SER 69 14.549 -11.935 2.602
522 HG SER 69 HG SER 69 14.403 -9.721 1.714
Start of MODEL 26
1 H1 MET 1 H1 MET 1 11.761 37.219 -10.032
2 H2 MET 1 H2 MET 1 13.162 36.410 -10.381
3 H3 MET 1 H3 MET 1 11.701 35.799 -10.859
4 HA MET 1 HA MET 1 12.450 34.577 -8.969
5 HB2 MET 1 2HB MET 1 13.792 36.689 -8.223
6 HB3 MET 1 3HB MET 1 12.314 37.189 -7.412
7 HG2 MET 1 2HG MET 1 12.760 35.823 -5.689
8 HG3 MET 1 3HG MET 1 12.867 34.413 -6.752
9 HE1 MET 1 1HE MET 1 14.603 33.869 -4.460
10 HE2 MET 1 2HE MET 1 16.122 34.773 -4.252
11 HE3 MET 1 3HE MET 1 14.566 35.580 -3.960
12 H LYS 2 H LYS 2 10.473 33.485 -8.456
13 HA LYS 2 HA LYS 2 8.361 34.900 -7.189
14 HB2 LYS 2 2HB LYS 2 6.612 34.614 -8.822
15 HB3 LYS 2 3HB LYS 2 7.865 35.619 -9.524
16 HG2 LYS 2 2HG LYS 2 8.753 33.652 -10.775
17 HG3 LYS 2 3HG LYS 2 7.456 32.641 -10.111
18 HD2 LYS 2 2HD LYS 2 6.973 35.180 -11.717
19 HD3 LYS 2 3HD LYS 2 7.021 33.558 -12.432
20 HE2 LYS 2 2HE LYS 2 5.100 32.821 -11.239
21 HE3 LYS 2 3HE LYS 2 5.159 34.176 -10.112
22 HZ1 LYS 2 1HZ LYS 2 4.530 34.408 -12.980
23 HZ2 LYS 2 2HZ LYS 2 3.448 34.478 -11.743
24 HZ3 LYS 2 3HZ LYS 2 4.584 35.655 -11.903
25 H GLN 3 H GLN 3 6.374 33.228 -7.138
26 HA GLN 3 HA GLN 3 7.207 30.433 -7.309
27 HB2 GLN 3 2HB GLN 3 6.460 29.997 -5.011
28 HB3 GLN 3 3HB GLN 3 7.856 31.067 -5.015
29 HG2 GLN 3 2HG GLN 3 4.976 32.056 -4.726
30 HG3 GLN 3 3HG GLN 3 6.008 31.636 -3.371
31 HE21 GLN 3 1HE2 GLN 3 7.856 32.996 -2.840
32 HE22 GLN 3 2HE2 GLN 3 7.927 34.621 -3.505
33 H ASP 4 H ASP 4 5.229 29.040 -6.949
34 HA ASP 4 HA ASP 4 2.630 30.180 -6.849
35 HB2 ASP 4 2HB ASP 4 1.833 29.389 -9.037
36 HB3 ASP 4 3HB ASP 4 3.043 30.646 -9.236
37 H GLY 5 H GLY 5 1.091 28.029 -7.488
38 HA2 GLY 5 2HA GLY 5 2.196 25.486 -7.109
39 HA3 GLY 5 3HA GLY 5 1.669 26.101 -5.521
40 H GLU 6 H GLU 6 0.430 23.864 -7.024
41 HA GLU 6 HA GLU 6 -2.311 24.799 -6.970
42 HB2 GLU 6 2HB GLU 6 -0.880 24.591 -9.476
43 HB3 GLU 6 3HB GLU 6 -1.978 23.219 -9.395
44 HG2 GLU 6 2HG GLU 6 -2.818 26.113 -8.919
45 HG3 GLU 6 3HG GLU 6 -2.910 25.294 -10.479
46 H GLU 7 H GLU 7 -3.697 22.936 -6.601
47 HA GLU 7 HA GLU 7 -2.625 20.269 -6.636
48 HB2 GLU 7 2HB GLU 7 -1.664 21.148 -4.456
49 HB3 GLU 7 3HB GLU 7 -3.304 21.521 -3.927
50 HG2 GLU 7 2HG GLU 7 -2.747 19.435 -2.933
51 HG3 GLU 7 3HG GLU 7 -3.863 19.045 -4.241
52 H GLY 8 H GLY 8 -4.450 19.192 -7.378
53 HA2 GLY 8 2HA GLY 8 -7.127 20.051 -6.444
54 HA3 GLY 8 3HA GLY 8 -6.756 20.174 -8.177
55 H THR 9 H THR 9 -8.845 18.459 -7.255
56 HA THR 9 HA THR 9 -7.827 15.909 -8.182
57 HB THR 9 HB THR 9 -7.322 15.775 -5.798
58 HG1 THR 9 1HG THR 9 -8.633 13.857 -5.489
59 HG21 THR 9 1HG2 THR 9 -10.312 16.145 -5.405
60 HG22 THR 9 2HG2 THR 9 -9.120 15.773 -4.137
61 HG23 THR 9 3HG2 THR 9 -9.062 17.334 -4.982
62 H GLU 10 H GLU 10 -9.584 14.500 -8.817
63 HA GLU 10 HA GLU 10 -12.322 15.388 -8.604
64 HB2 GLU 10 2HB GLU 10 -10.832 15.348 -11.262
65 HB3 GLU 10 3HB GLU 10 -12.542 14.900 -11.172
66 HG2 GLU 10 2HG GLU 10 -13.045 17.084 -10.070
67 HG3 GLU 10 3HG GLU 10 -11.359 17.570 -10.318
68 H GLU 11 H GLU 11 -13.470 13.520 -8.335
69 HA GLU 11 HA GLU 11 -13.925 11.342 -7.976
70 HB2 GLU 11 2HB GLU 11 -12.311 10.946 -10.505
71 HB3 GLU 11 3HB GLU 11 -13.229 9.673 -9.682
72 HG2 GLU 11 2HG GLU 11 -15.301 10.939 -9.879
73 HG3 GLU 11 3HG GLU 11 -14.455 12.324 -10.570
74 H ASP 12 H ASP 12 -13.030 9.154 -7.628
75 HA ASP 12 HA ASP 12 -12.421 8.063 -5.796
76 HB2 ASP 12 2HB ASP 12 -10.917 7.449 -7.590
77 HB3 ASP 12 3HB ASP 12 -9.712 8.586 -6.978
78 H THR 13 H THR 13 -12.451 8.389 -3.706
79 HA THR 13 HA THR 13 -10.398 10.144 -2.505
80 HB THR 13 HB THR 13 -13.340 10.499 -1.861
81 HG1 THR 13 1HG THR 13 -11.710 11.586 -3.825
82 HG21 THR 13 1HG2 THR 13 -12.501 12.693 -0.933
83 HG22 THR 13 2HG2 THR 13 -11.945 11.290 -0.019
84 HG23 THR 13 3HG2 THR 13 -10.840 12.106 -1.154
85 H GLU 14 H GLU 14 -11.064 7.176 -2.750
86 HA GLU 14 HA GLU 14 -11.118 6.573 0.163
87 HB2 GLU 14 2HB GLU 14 -12.708 5.378 -2.114
88 HB3 GLU 14 3HB GLU 14 -12.220 4.378 -0.742
89 HG2 GLU 14 2HG GLU 14 -13.218 6.058 0.826
90 HG3 GLU 14 3HG GLU 14 -13.809 6.974 -0.565
91 H GLU 15 H GLU 15 -10.046 5.361 -3.157
92 HA GLU 15 HA GLU 15 -8.364 3.450 -1.682
93 HB2 GLU 15 2HB GLU 15 -8.636 3.923 -4.673
94 HB3 GLU 15 3HB GLU 15 -7.683 2.661 -3.875
95 HG2 GLU 15 2HG GLU 15 -9.981 2.152 -2.631
96 HG3 GLU 15 3HG GLU 15 -10.681 2.941 -4.044
97 H LYS 16 H LYS 16 -6.981 4.776 -0.499
98 HA LYS 16 HA LYS 16 -4.920 6.169 -2.153
99 HB2 LYS 16 2HB LYS 16 -4.579 7.605 -0.012
100 HB3 LYS 16 3HB LYS 16 -5.899 8.002 -1.104
101 HG2 LYS 16 2HG LYS 16 -7.525 6.902 0.289
102 HG3 LYS 16 3HG LYS 16 -6.240 6.241 1.309
103 HD2 LYS 16 2HD LYS 16 -7.337 8.093 2.428
104 HD3 LYS 16 3HD LYS 16 -5.673 8.579 2.028
105 HE2 LYS 16 2HE LYS 16 -6.401 9.903 0.173
106 HE3 LYS 16 3HE LYS 16 -8.002 9.138 0.158
107 HZ1 LYS 16 1HZ LYS 16 -8.064 11.346 1.098
108 HZ2 LYS 16 2HZ LYS 16 -8.528 10.220 2.195
109 HZ3 LYS 16 3HZ LYS 16 -7.029 10.907 2.303
110 H CYS 17 H CYS 17 -2.939 5.807 -1.848
111 HA CYS 17 HA CYS 17 -1.800 3.467 -0.523
112 HB2 CYS 17 2HB CYS 17 -1.111 4.666 -2.657
113 HB3 CYS 17 3HB CYS 17 -0.603 6.018 -1.667
114 H THR 18 H THR 18 -1.704 3.436 1.729
115 HA THR 18 HA THR 18 -1.688 5.793 3.294
116 HB THR 18 HB THR 18 -2.281 3.333 3.889
117 HG1 THR 18 1HG THR 18 -2.394 5.210 5.282
118 HG21 THR 18 1HG2 THR 18 -0.636 2.104 5.110
119 HG22 THR 18 2HG2 THR 18 0.122 2.536 3.556
120 HG23 THR 18 3HG2 THR 18 0.528 3.439 5.032
121 H ILE 19 H ILE 19 0.974 4.246 1.600
122 HA ILE 19 HA ILE 19 3.029 5.324 3.311
123 HB ILE 19 HB ILE 19 2.900 3.885 0.660
124 HG12 ILE 19 2HG1 ILE 19 4.302 2.838 3.109
125 HG13 ILE 19 3HG1 ILE 19 2.539 2.881 3.158
126 HG21 ILE 19 1HG2 ILE 19 4.866 5.244 0.482
127 HG22 ILE 19 2HG2 ILE 19 5.343 4.879 2.159
128 HG23 ILE 19 3HG2 ILE 19 5.399 3.608 0.914
129 HD11 ILE 19 1HD1 ILE 19 4.138 1.583 0.925
130 HD12 ILE 19 2HD1 ILE 19 3.352 0.727 2.277
131 HD13 ILE 19 3HD1 ILE 19 2.375 1.625 1.093
132 H CYS 20 H CYS 20 1.840 6.076 -0.041
133 HA CYS 20 HA CYS 20 3.531 8.532 -0.232
134 HB2 CYS 20 2HB CYS 20 1.150 7.737 -1.931
135 HB3 CYS 20 3HB CYS 20 2.388 8.949 -2.262
136 H LEU 21 H LEU 21 0.552 7.666 1.297
137 HA LEU 21 HA LEU 21 -1.333 8.678 1.850
138 HB2 LEU 21 2HB LEU 21 0.593 10.959 2.372
139 HB3 LEU 21 3HB LEU 21 -1.064 10.901 2.984
140 HG LEU 21 HG LEU 21 0.974 8.704 3.550
141 HD11 LEU 21 1HD1 LEU 21 0.265 11.111 5.247
142 HD12 LEU 21 2HD1 LEU 21 1.289 9.732 5.735
143 HD13 LEU 21 3HD1 LEU 21 1.815 10.799 4.422
144 HD21 LEU 21 1HD2 LEU 21 -1.667 9.480 4.890
145 HD22 LEU 21 2HD2 LEU 21 -1.405 8.049 3.867
146 HD23 LEU 21 3HD2 LEU 21 -0.573 8.177 5.414
147 H SER 22 H SER 22 -1.205 8.467 -0.780
148 HA SER 22 HA SER 22 -2.646 10.882 -1.724
149 HB2 SER 22 2HB SER 22 -0.395 9.436 -3.179
150 HB3 SER 22 3HB SER 22 -1.541 10.538 -3.971
151 HG SER 22 HG SER 22 0.371 11.618 -3.279
152 H ILE 23 H ILE 23 -4.247 10.397 -3.304
153 HA ILE 23 HA ILE 23 -5.492 7.828 -3.196
154 HB ILE 23 HB ILE 23 -5.781 10.433 -4.700
155 HG12 ILE 23 2HG1 ILE 23 -6.564 10.146 -2.320
156 HG13 ILE 23 3HG1 ILE 23 -7.781 10.705 -3.462
157 HG21 ILE 23 1HG2 ILE 23 -7.919 9.599 -5.702
158 HG22 ILE 23 2HG2 ILE 23 -6.424 9.034 -6.437
159 HG23 ILE 23 3HG2 ILE 23 -7.346 7.940 -5.393
160 HD11 ILE 23 1HD1 ILE 23 -8.599 8.956 -1.851
161 HD12 ILE 23 2HD1 ILE 23 -8.825 8.516 -3.554
162 HD13 ILE 23 3HD1 ILE 23 -7.526 7.784 -2.616
163 H LEU 24 H LEU 24 -5.852 6.486 -5.042
164 HA LEU 24 HA LEU 24 -3.548 6.071 -6.828
165 HB2 LEU 24 2HB LEU 24 -5.891 4.341 -5.865
166 HB3 LEU 24 3HB LEU 24 -4.546 3.754 -6.842
167 HG LEU 24 HG LEU 24 -4.257 4.893 -4.013
168 HD11 LEU 24 1HD1 LEU 24 -3.770 2.590 -3.374
169 HD12 LEU 24 2HD1 LEU 24 -5.414 2.784 -4.013
170 HD13 LEU 24 3HD1 LEU 24 -4.157 2.051 -5.036
171 HD21 LEU 24 1HD2 LEU 24 -2.326 3.888 -6.089
172 HD22 LEU 24 2HD2 LEU 24 -2.280 5.358 -5.087
173 HD23 LEU 24 3HD2 LEU 24 -1.958 3.747 -4.369
174 H GLU 25 H GLU 25 -4.975 4.469 -8.668
175 HA GLU 25 HA GLU 25 -7.458 5.824 -9.365
176 HB2 GLU 25 2HB GLU 25 -6.949 6.229 -11.697
177 HB3 GLU 25 3HB GLU 25 -5.801 7.103 -10.676
178 HG2 GLU 25 2HG GLU 25 -4.096 5.370 -11.077
179 HG3 GLU 25 3HG GLU 25 -5.259 4.429 -12.037
180 H GLU 26 H GLU 26 -8.518 4.573 -11.340
181 HA GLU 26 HA GLU 26 -8.714 1.874 -10.425
182 HB2 GLU 26 2HB GLU 26 -10.645 3.077 -11.320
183 HB3 GLU 26 3HB GLU 26 -9.860 3.242 -12.901
184 HG2 GLU 26 2HG GLU 26 -9.903 0.809 -13.227
185 HG3 GLU 26 3HG GLU 26 -10.478 0.565 -11.575
186 H GLY 27 H GLY 27 -7.365 0.243 -10.881
187 HA2 GLY 27 2HA GLY 27 -6.332 -1.316 -12.276
188 HA3 GLY 27 3HA GLY 27 -6.579 -0.239 -13.657
189 H GLU 28 H GLU 28 -5.070 1.267 -10.876
190 HA GLU 28 HA GLU 28 -2.719 1.809 -12.376
191 HB2 GLU 28 2HB GLU 28 -3.900 3.197 -10.616
192 HB3 GLU 28 3HB GLU 28 -3.234 2.123 -9.400
193 HG2 GLU 28 2HG GLU 28 -0.928 2.785 -10.111
194 HG3 GLU 28 3HG GLU 28 -1.629 3.827 -11.360
195 H ASP 29 H ASP 29 -0.543 1.382 -11.661
196 HA ASP 29 HA ASP 29 0.089 -1.353 -11.080
197 HB2 ASP 29 2HB ASP 29 1.813 1.130 -10.999
198 HB3 ASP 29 3HB ASP 29 2.412 -0.532 -10.999
199 H VAL 30 H VAL 30 -0.957 -1.785 -9.116
200 HA VAL 30 HA VAL 30 0.450 -0.793 -6.702
201 HB VAL 30 HB VAL 30 -1.599 -0.525 -5.501
202 HG11 VAL 30 1HG1 VAL 30 -0.874 1.372 -7.032
203 HG12 VAL 30 2HG1 VAL 30 -2.041 0.769 -8.204
204 HG13 VAL 30 3HG1 VAL 30 -2.595 1.358 -6.635
205 HG21 VAL 30 1HG2 VAL 30 -3.824 -0.764 -6.633
206 HG22 VAL 30 2HG2 VAL 30 -3.016 -1.557 -7.991
207 HG23 VAL 30 3HG2 VAL 30 -2.995 -2.306 -6.376
208 H ARG 31 H ARG 31 -0.496 -2.325 -4.767
209 HA ARG 31 HA ARG 31 -0.773 -5.054 -5.734
210 HB2 ARG 31 2HB ARG 31 1.312 -4.226 -3.647
211 HB3 ARG 31 3HB ARG 31 0.842 -5.872 -4.009
212 HG2 ARG 31 2HG ARG 31 1.605 -5.139 -6.504
213 HG3 ARG 31 3HG ARG 31 2.636 -4.064 -5.529
214 HD2 ARG 31 2HD ARG 31 3.240 -6.146 -4.150
215 HD3 ARG 31 3HD ARG 31 2.370 -7.087 -5.382
216 HE ARG 31 HE ARG 31 4.499 -5.325 -6.358
217 HH11 ARG 31 1HH1 ARG 31 6.617 -8.012 -7.167
218 HH12 ARG 31 2HH1 ARG 31 6.333 -6.325 -7.367
219 HH21 ARG 31 1HH2 ARG 31 5.089 -9.331 -5.922
220 HH22 ARG 31 2HH2 ARG 31 3.725 -8.566 -5.194
221 H ARG 32 H ARG 32 -1.625 -6.416 -3.938
222 HA ARG 32 HA ARG 32 -3.096 -4.799 -1.893
223 HB2 ARG 32 2HB ARG 32 -4.370 -5.806 -3.922
224 HB3 ARG 32 3HB ARG 32 -4.028 -7.386 -3.216
225 HG2 ARG 32 2HG ARG 32 -5.577 -5.089 -1.929
226 HG3 ARG 32 3HG ARG 32 -6.245 -6.563 -2.630
227 HD2 ARG 32 2HD ARG 32 -4.592 -7.701 -0.788
228 HD3 ARG 32 3HD ARG 32 -4.821 -6.152 -0.019
229 HE ARG 32 HE ARG 32 -7.081 -6.535 0.247
230 HH11 ARG 32 1HH1 ARG 32 -8.913 -9.515 -0.366
231 HH12 ARG 32 2HH1 ARG 32 -8.903 -8.007 0.473
232 HH21 ARG 32 1HH2 ARG 32 -7.009 -10.174 -1.630
233 HH22 ARG 32 2HH2 ARG 32 -5.650 -9.108 -1.693
234 H LEU 33 H LEU 33 -2.076 -5.123 -0.080
235 HA LEU 33 HA LEU 33 -0.311 -7.376 0.362
236 HB2 LEU 33 2HB LEU 33 0.084 -6.104 2.511
237 HB3 LEU 33 3HB LEU 33 0.387 -5.185 1.064
238 HG LEU 33 HG LEU 33 -2.421 -4.925 1.918
239 HD11 LEU 33 1HD1 LEU 33 -0.197 -3.994 3.816
240 HD12 LEU 33 2HD1 LEU 33 -1.912 -3.658 3.991
241 HD13 LEU 33 3HD1 LEU 33 -1.327 -5.322 4.152
242 HD21 LEU 33 1HD2 LEU 33 -0.110 -3.055 1.446
243 HD22 LEU 33 2HD2 LEU 33 -1.423 -3.375 0.331
244 HD23 LEU 33 3HD2 LEU 33 -1.752 -2.484 1.824
245 HA PRO 34 HA PRO 34 -2.945 -10.098 1.901
246 HB2 PRO 34 2HB PRO 34 -1.858 -11.326 4.127
247 HB3 PRO 34 3HB PRO 34 -1.219 -11.466 2.460
248 HG2 PRO 34 2HG PRO 34 -0.261 -9.663 4.682
249 HG3 PRO 34 3HG PRO 34 0.713 -10.628 3.527
250 HD2 PRO 34 2HD PRO 34 0.214 -7.967 3.255
251 HD3 PRO 34 3HD PRO 34 0.458 -9.007 1.843
252 H CYS 35 H CYS 35 -2.443 -7.582 4.329
253 HA CYS 35 HA CYS 35 -4.407 -8.583 6.226
254 HB2 CYS 35 2HB CYS 35 -4.157 -6.598 7.346
255 HB3 CYS 35 3HB CYS 35 -2.545 -6.920 6.664
256 H MET 36 H MET 36 -4.686 -6.762 3.262
257 HA MET 36 HA MET 36 -6.962 -6.900 2.267
258 HB2 MET 36 2HB MET 36 -7.647 -5.498 4.843
259 HB3 MET 36 3HB MET 36 -8.533 -5.118 3.380
260 HG2 MET 36 2HG MET 36 -8.103 -8.034 3.938
261 HG3 MET 36 3HG MET 36 -9.242 -7.147 4.929
262 HE1 MET 36 1HE MET 36 -10.359 -9.604 3.288
263 HE2 MET 36 2HE MET 36 -11.259 -8.470 4.323
264 HE3 MET 36 3HE MET 36 -11.848 -8.834 2.687
265 H HIS 37 H HIS 37 -5.110 -4.259 3.764
266 HA HIS 37 HA HIS 37 -6.150 -2.195 2.117
267 HB2 HIS 37 1HB HIS 37 -3.443 -2.324 3.532
268 HB3 HIS 37 2HB HIS 37 -4.163 -0.883 2.870
269 HD2 HIS 37 2HD HIS 37 -6.784 -0.387 3.862
270 HE1 HIS 37 1HE HIS 37 -5.707 -1.480 7.824
271 HE2 HIS 37 2HE HIS 37 -7.409 -0.236 6.393
272 H LEU 38 H LEU 38 -4.645 -0.807 0.485
273 HA LEU 38 HA LEU 38 -2.959 -2.619 -1.099
274 HB2 LEU 38 2HB LEU 38 -3.822 -1.854 -3.182
275 HB3 LEU 38 3HB LEU 38 -5.051 -2.738 -2.302
276 HG LEU 38 HG LEU 38 -5.043 0.297 -2.166
277 HD11 LEU 38 1HD1 LEU 38 -4.765 -0.192 -4.539
278 HD12 LEU 38 2HD1 LEU 38 -6.083 -1.387 -4.479
279 HD13 LEU 38 3HD1 LEU 38 -6.427 0.331 -4.222
280 HD21 LEU 38 1HD2 LEU 38 -7.476 -0.050 -2.052
281 HD22 LEU 38 2HD2 LEU 38 -7.268 -1.788 -2.279
282 HD23 LEU 38 3HD2 LEU 38 -6.680 -1.008 -0.792
283 H PHE 39 H PHE 39 -1.233 -1.672 -1.981
284 HA PHE 39 HA PHE 39 -0.727 1.237 -1.496
285 HB2 PHE 39 2HB PHE 39 0.963 -1.197 -0.822
286 HB3 PHE 39 3HB PHE 39 1.611 0.420 -0.786
287 HD1 PHE 39 1HD PHE 39 1.786 -1.483 1.486
288 HD2 PHE 39 2HD PHE 39 -1.308 1.368 0.593
289 HE1 PHE 39 1HE PHE 39 0.943 -1.683 3.783
290 HE2 PHE 39 2HE PHE 39 -2.178 1.136 2.886
291 HZ PHE 39 HZ PHE 39 -1.053 -0.384 4.505
292 H HIS 40 H HIS 40 0.870 2.123 -3.040
293 HA HIS 40 HA HIS 40 0.684 1.057 -5.672
294 HB2 HIS 40 1HB HIS 40 2.824 2.825 -4.476
295 HB3 HIS 40 2HB HIS 40 2.802 2.391 -6.166
296 HD2 HIS 40 2HD HIS 40 0.624 3.242 -7.671
297 HE1 HIS 40 1HE HIS 40 0.112 6.706 -5.249
298 HE2 HIS 40 2HE HIS 40 -0.464 5.584 -7.501
299 H GLN 41 H GLN 41 2.338 0.072 -7.046
300 HA GLN 41 HA GLN 41 3.650 -2.122 -5.832
301 HB2 GLN 41 2HB GLN 41 2.880 -1.767 -8.258
302 HB3 GLN 41 3HB GLN 41 4.380 -0.860 -8.515
303 HG2 GLN 41 2HG GLN 41 5.689 -2.849 -7.804
304 HG3 GLN 41 3HG GLN 41 4.182 -3.721 -7.481
305 HE21 GLN 41 1HE2 GLN 41 2.556 -3.388 -9.659
306 HE22 GLN 41 2HE2 GLN 41 3.416 -3.906 -11.093
307 H VAL 42 H VAL 42 4.863 1.116 -6.850
308 HA VAL 42 HA VAL 42 7.584 0.554 -6.077
309 HB VAL 42 HB VAL 42 6.173 3.213 -6.568
310 HG11 VAL 42 1HG1 VAL 42 9.141 2.495 -6.440
311 HG12 VAL 42 2HG1 VAL 42 8.492 4.050 -7.007
312 HG13 VAL 42 3HG1 VAL 42 8.270 3.566 -5.323
313 HG21 VAL 42 1HG2 VAL 42 7.831 1.400 -8.382
314 HG22 VAL 42 2HG2 VAL 42 6.096 1.746 -8.551
315 HG23 VAL 42 3HG2 VAL 42 7.278 3.033 -8.806
316 H CYS 43 H CYS 43 5.010 2.575 -4.475
317 HA CYS 43 HA CYS 43 6.450 3.291 -2.147
318 HB2 CYS 43 2HB CYS 43 3.526 2.495 -2.302
319 HB3 CYS 43 3HB CYS 43 4.307 3.461 -1.071
320 H VAL 44 H VAL 44 4.547 0.274 -2.759
321 HA VAL 44 HA VAL 44 5.120 -0.667 -0.142
322 HB VAL 44 HB VAL 44 3.071 -1.140 -1.581
323 HG11 VAL 44 1HG1 VAL 44 4.749 -3.503 -2.457
324 HG12 VAL 44 2HG1 VAL 44 3.083 -3.049 -2.950
325 HG13 VAL 44 3HG1 VAL 44 4.474 -2.087 -3.483
326 HG21 VAL 44 1HG2 VAL 44 2.683 -3.209 -0.385
327 HG22 VAL 44 2HG2 VAL 44 4.434 -3.467 -0.189
328 HG23 VAL 44 3HG2 VAL 44 3.655 -2.127 0.652
329 H ASP 45 H ASP 45 6.806 -0.919 -3.214
330 HA ASP 45 HA ASP 45 8.400 -3.215 -2.593
331 HB2 ASP 45 2HB ASP 45 8.423 -2.172 -4.827
332 HB3 ASP 45 3HB ASP 45 9.173 -0.715 -4.159
333 H GLN 46 H GLN 46 9.133 0.305 -2.125
334 HA GLN 46 HA GLN 46 11.279 -0.346 -0.318
335 HB2 GLN 46 2HB GLN 46 9.769 2.280 -0.674
336 HB3 GLN 46 3HB GLN 46 11.155 2.048 0.407
337 HG2 GLN 46 2HG GLN 46 12.320 1.055 -1.761
338 HG3 GLN 46 3HG GLN 46 11.109 2.023 -2.609
339 HE21 GLN 46 1HE2 GLN 46 10.936 4.430 -1.435
340 HE22 GLN 46 2HE2 GLN 46 12.533 5.128 -1.177
341 H ALA 47 H ALA 47 7.817 0.024 0.283
342 HA ALA 47 HA ALA 47 8.038 0.223 3.114
343 HB1 ALA 47 1HB ALA 47 5.937 0.404 1.748
344 HB2 ALA 47 2HB ALA 47 5.963 -1.380 1.596
345 HB3 ALA 47 3HB ALA 47 5.791 -0.628 3.193
346 H LEU 48 H LEU 48 7.904 -2.669 0.984
347 HA LEU 48 HA LEU 48 7.960 -4.613 3.028
348 HB2 LEU 48 2HB LEU 48 7.285 -4.930 0.644
349 HB3 LEU 48 3HB LEU 48 8.953 -4.752 0.140
350 HG LEU 48 HG LEU 48 8.204 -7.056 0.113
351 HD11 LEU 48 1HD1 LEU 48 10.618 -6.535 0.676
352 HD12 LEU 48 2HD1 LEU 48 10.213 -6.910 2.374
353 HD13 LEU 48 3HD1 LEU 48 10.026 -8.142 1.127
354 HD21 LEU 48 1HD2 LEU 48 7.818 -6.827 3.117
355 HD22 LEU 48 2HD2 LEU 48 6.542 -7.001 1.884
356 HD23 LEU 48 3HD2 LEU 48 7.697 -8.313 2.157
357 H ILE 49 H ILE 49 10.642 -3.321 0.974
358 HA ILE 49 HA ILE 49 12.626 -4.863 2.297
359 HB ILE 49 HB ILE 49 14.258 -3.618 1.146
360 HG12 ILE 49 2HG1 ILE 49 13.204 -1.575 -0.315
361 HG13 ILE 49 3HG1 ILE 49 12.342 -1.397 1.222
362 HG21 ILE 49 1HG2 ILE 49 12.788 -5.130 -0.183
363 HG22 ILE 49 2HG2 ILE 49 11.858 -3.713 -0.706
364 HG23 ILE 49 3HG2 ILE 49 13.563 -3.848 -1.130
365 HD11 ILE 49 1HD1 ILE 49 14.511 -1.371 2.430
366 HD12 ILE 49 2HD1 ILE 49 15.355 -1.509 0.872
367 HD13 ILE 49 3HD1 ILE 49 14.383 -0.067 1.232
368 H THR 50 H THR 50 11.271 -1.665 3.125
369 HA THR 50 HA THR 50 13.241 -1.058 5.094
370 HB THR 50 HB THR 50 10.412 -0.130 4.508
371 HG1 THR 50 1HG THR 50 12.963 1.121 4.505
372 HG21 THR 50 1HG2 THR 50 10.481 0.132 6.897
373 HG22 THR 50 2HG2 THR 50 12.135 0.788 6.841
374 HG23 THR 50 3HG2 THR 50 10.768 1.708 6.164
375 H ASN 51 H ASN 51 9.862 -2.322 5.447
376 HA ASN 51 HA ASN 51 10.715 -4.171 7.485
377 HB2 ASN 51 2HB ASN 51 9.708 -1.557 8.302
378 HB3 ASN 51 3HB ASN 51 8.507 -2.767 8.711
379 HD21 ASN 51 1HD2 ASN 51 9.612 -4.921 9.714
380 HD22 ASN 51 2HD2 ASN 51 10.812 -4.501 10.943
381 H LYS 52 H LYS 52 9.597 -5.917 6.813
382 HA LYS 52 HA LYS 52 7.143 -5.923 5.354
383 HB2 LYS 52 2HB LYS 52 7.199 -8.342 5.832
384 HB3 LYS 52 3HB LYS 52 8.703 -7.695 5.194
385 HG2 LYS 52 2HG LYS 52 9.235 -7.561 7.919
386 HG3 LYS 52 3HG LYS 52 8.160 -8.959 7.832
387 HD2 LYS 52 2HD LYS 52 9.555 -9.782 5.902
388 HD3 LYS 52 3HD LYS 52 10.715 -8.512 6.229
389 HE2 LYS 52 2HE LYS 52 9.844 -10.429 8.425
390 HE3 LYS 52 3HE LYS 52 11.018 -10.953 7.221
391 HZ1 LYS 52 1HZ LYS 52 12.107 -10.060 9.137
392 HZ2 LYS 52 2HZ LYS 52 12.444 -9.173 7.801
393 HZ3 LYS 52 3HZ LYS 52 11.390 -8.586 8.923
394 H LYS 53 H LYS 53 6.092 -4.227 6.956
395 HA LYS 53 HA LYS 53 4.109 -5.726 8.474
396 HB2 LYS 53 2HB LYS 53 6.088 -3.780 9.755
397 HB3 LYS 53 3HB LYS 53 4.399 -3.790 10.262
398 HG2 LYS 53 2HG LYS 53 5.120 -5.304 11.757
399 HG3 LYS 53 3HG LYS 53 4.755 -6.399 10.425
400 HD2 LYS 53 2HD LYS 53 7.279 -6.267 9.869
401 HD3 LYS 53 3HD LYS 53 7.458 -5.518 11.466
402 HE2 LYS 53 2HE LYS 53 6.502 -7.416 12.583
403 HE3 LYS 53 3HE LYS 53 5.776 -8.019 11.085
404 HZ1 LYS 53 1HZ LYS 53 7.811 -8.647 10.258
405 HZ2 LYS 53 2HZ LYS 53 8.667 -8.090 11.602
406 HZ3 LYS 53 3HZ LYS 53 7.577 -9.358 11.646
407 H CYS 54 H CYS 54 2.170 -4.744 8.106
408 HA CYS 54 HA CYS 54 1.786 -2.736 6.048
409 HB2 CYS 54 2HB CYS 54 0.174 -4.448 6.657
410 HB3 CYS 54 3HB CYS 54 0.084 -3.808 8.299
411 HA PRO 55 HA PRO 55 3.373 0.312 8.946
412 HB2 PRO 55 2HB PRO 55 4.033 2.318 7.243
413 HB3 PRO 55 3HB PRO 55 4.844 0.726 7.168
414 HG2 PRO 55 2HG PRO 55 2.495 1.671 5.483
415 HG3 PRO 55 3HG PRO 55 4.047 0.964 4.919
416 HD2 PRO 55 2HD PRO 55 1.795 -0.528 5.302
417 HD3 PRO 55 3HD PRO 55 3.430 -1.189 5.623
418 H ILE 56 H ILE 56 1.070 0.225 9.688
419 HA ILE 56 HA ILE 56 0.024 2.692 10.365
420 HB ILE 56 HB ILE 56 -0.740 2.837 7.991
421 HG12 ILE 56 2HG1 ILE 56 -1.951 4.155 9.479
422 HG13 ILE 56 3HG1 ILE 56 -3.069 3.412 8.348
423 HG21 ILE 56 1HG2 ILE 56 -1.123 0.437 7.546
424 HG22 ILE 56 2HG2 ILE 56 -2.620 0.528 8.515
425 HG23 ILE 56 3HG2 ILE 56 -2.446 1.492 7.047
426 HD11 ILE 56 1HD1 ILE 56 -4.184 3.344 10.410
427 HD12 ILE 56 2HD1 ILE 56 -3.567 1.691 10.243
428 HD13 ILE 56 3HD1 ILE 56 -2.745 2.873 11.302
429 H CYS 57 H CYS 57 -0.789 -0.631 9.434
430 HA CYS 57 HA CYS 57 -2.121 -1.306 12.030
431 HB2 CYS 57 2HB CYS 57 -2.297 -3.540 10.592
432 HB3 CYS 57 3HB CYS 57 -3.419 -2.218 10.464
433 H ARG 58 H ARG 58 -0.383 -3.875 10.883
434 HA ARG 58 HA ARG 58 2.174 -3.410 11.845
435 HB2 ARG 58 2HB ARG 58 0.836 -3.315 14.165
436 HB3 ARG 58 3HB ARG 58 0.850 -5.072 14.003
437 HG2 ARG 58 2HG ARG 58 3.495 -4.497 13.448
438 HG3 ARG 58 3HG ARG 58 3.083 -3.147 14.500
439 HD2 ARG 58 2HD ARG 58 2.158 -4.971 16.121
440 HD3 ARG 58 3HD ARG 58 3.027 -6.123 15.083
441 HE ARG 58 HE ARG 58 4.568 -3.824 16.050
442 HH11 ARG 58 1HH1 ARG 58 6.468 -5.690 18.343
443 HH12 ARG 58 2HH1 ARG 58 6.251 -4.151 17.602
444 HH21 ARG 58 1HH2 ARG 58 5.012 -7.476 17.806
445 HH22 ARG 58 2HH2 ARG 58 3.739 -7.209 16.669
446 H VAL 59 H VAL 59 -0.479 -5.724 11.519
447 HA VAL 59 HA VAL 59 0.488 -8.169 11.350
448 HB VAL 59 HB VAL 59 -1.108 -8.431 9.439
449 HG11 VAL 59 1HG1 VAL 59 -1.837 -8.427 11.826
450 HG12 VAL 59 2HG1 VAL 59 -2.186 -6.689 11.702
451 HG13 VAL 59 3HG1 VAL 59 -3.083 -7.847 10.713
452 HG21 VAL 59 1HG2 VAL 59 -2.505 -6.400 8.880
453 HG22 VAL 59 2HG2 VAL 59 -1.278 -5.382 9.608
454 HG23 VAL 59 3HG2 VAL 59 -0.860 -6.369 8.202
455 H ASP 60 H ASP 60 1.981 -9.330 10.300
456 HA ASP 60 HA ASP 60 3.956 -7.964 8.723
457 HB2 ASP 60 2HB ASP 60 4.209 -9.934 10.393
458 HB3 ASP 60 3HB ASP 60 3.688 -10.969 9.058
459 H ILE 61 H ILE 61 4.491 -8.470 6.529
460 HA ILE 61 HA ILE 61 2.162 -9.402 4.896
461 HB ILE 61 HB ILE 61 2.847 -7.790 3.213
462 HG12 ILE 61 2HG1 ILE 61 4.727 -6.618 5.312
463 HG13 ILE 61 3HG1 ILE 61 5.279 -7.637 3.971
464 HG21 ILE 61 1HG2 ILE 61 1.169 -7.323 5.088
465 HG22 ILE 61 2HG2 ILE 61 2.459 -6.376 5.860
466 HG23 ILE 61 3HG2 ILE 61 1.820 -5.904 4.252
467 HD11 ILE 61 1HD1 ILE 61 3.836 -4.988 3.735
468 HD12 ILE 61 2HD1 ILE 61 5.528 -5.351 3.327
469 HD13 ILE 61 3HD1 ILE 61 4.202 -6.084 2.377
470 H GLU 62 H GLU 62 5.467 -9.886 5.600
471 HA GLU 62 HA GLU 62 6.385 -10.930 3.116
472 HB2 GLU 62 2HB GLU 62 7.565 -10.607 5.549
473 HB3 GLU 62 3HB GLU 62 7.208 -12.330 5.639
474 HG2 GLU 62 2HG GLU 62 8.221 -12.337 3.167
475 HG3 GLU 62 3HG GLU 62 8.972 -10.829 3.691
476 H ALA 63 H ALA 63 5.996 -12.894 2.093
477 HA ALA 63 HA ALA 63 4.694 -15.070 3.578
478 HB1 ALA 63 1HB ALA 63 3.401 -13.743 1.160
479 HB2 ALA 63 2HB ALA 63 2.875 -15.261 1.928
480 HB3 ALA 63 3HB ALA 63 2.777 -13.730 2.829
481 H GLN 64 H GLN 64 6.972 -15.677 3.122
482 HA GLN 64 HA GLN 64 6.992 -17.314 0.732
483 HB2 GLN 64 2HB GLN 64 8.146 -14.861 0.393
484 HB3 GLN 64 3HB GLN 64 9.538 -15.749 1.030
485 HG2 GLN 64 2HG GLN 64 9.253 -17.451 -0.758
486 HG3 GLN 64 3HG GLN 64 7.774 -16.644 -1.306
487 HE21 GLN 64 1HE2 GLN 64 9.732 -17.109 -3.190
488 HE22 GLN 64 2HE2 GLN 64 10.501 -15.574 -3.572
489 H LEU 65 H LEU 65 9.332 -18.576 0.860
490 HA LEU 65 HA LEU 65 9.241 -19.720 3.568
491 HB2 LEU 65 2HB LEU 65 8.981 -20.956 1.302
492 HB3 LEU 65 3HB LEU 65 10.728 -20.815 1.146
493 HG LEU 65 HG LEU 65 9.505 -21.942 3.689
494 HD11 LEU 65 1HD1 LEU 65 9.519 -24.191 2.656
495 HD12 LEU 65 2HD1 LEU 65 8.363 -23.111 1.865
496 HD13 LEU 65 3HD1 LEU 65 9.921 -23.463 1.082
497 HD21 LEU 65 1HD2 LEU 65 11.971 -21.588 3.612
498 HD22 LEU 65 2HD2 LEU 65 11.562 -23.306 3.707
499 HD23 LEU 65 3HD2 LEU 65 12.065 -22.601 2.157
500 HA PRO 66 HA PRO 66 12.842 -17.094 4.015
501 HB2 PRO 66 2HB PRO 66 13.377 -17.434 6.678
502 HB3 PRO 66 3HB PRO 66 11.954 -16.520 6.085
503 HG2 PRO 66 2HG PRO 66 12.058 -19.420 6.974
504 HG3 PRO 66 3HG PRO 66 10.895 -18.151 7.478
505 HD2 PRO 66 2HD PRO 66 10.318 -19.937 5.500
506 HD3 PRO 66 3HD PRO 66 9.769 -18.232 5.403
507 H SER 67 H SER 67 15.073 -17.379 3.896
508 HA SER 67 HA SER 67 16.106 -20.148 3.976
509 HB2 SER 67 2HB SER 67 17.292 -17.482 3.076
510 HB3 SER 67 3HB SER 67 18.154 -19.030 3.015
511 HG SER 67 HG SER 67 16.455 -19.799 1.654
512 H GLU 68 H GLU 68 18.269 -20.443 5.006
513 HA GLU 68 HA GLU 68 18.455 -19.667 7.722
514 HB2 GLU 68 2HB GLU 68 20.565 -20.553 5.693
515 HB3 GLU 68 3HB GLU 68 20.834 -20.468 7.436
516 HG2 GLU 68 2HG GLU 68 18.775 -22.248 6.045
517 HG3 GLU 68 3HG GLU 68 20.353 -22.770 6.627
518 H SER 69 H SER 69 19.168 -17.728 8.648
519 HA SER 69 HA SER 69 21.234 -16.169 7.500
520 HB2 SER 69 2HB SER 69 19.293 -15.408 6.069
521 HB3 SER 69 3HB SER 69 18.448 -14.927 7.556
522 HG SER 69 HG SER 69 20.446 -13.680 7.975
Start of MODEL 27
1 H1 MET 1 H1 MET 1 -23.742 43.495 -7.781
2 H2 MET 1 H2 MET 1 -24.949 43.127 -8.843
3 H3 MET 1 H3 MET 1 -23.592 42.193 -8.774
4 HA MET 1 HA MET 1 -23.487 43.581 -10.707
5 HB2 MET 1 2HB MET 1 -24.244 45.653 -8.684
6 HB3 MET 1 3HB MET 1 -23.121 46.157 -9.957
7 HG2 MET 1 2HG MET 1 -24.632 45.435 -11.699
8 HG3 MET 1 3HG MET 1 -25.752 44.765 -10.508
9 HE1 MET 1 1HE MET 1 -25.336 47.562 -12.906
10 HE2 MET 1 2HE MET 1 -25.493 49.070 -11.984
11 HE3 MET 1 3HE MET 1 -24.029 48.076 -11.809
12 H LYS 2 H LYS 2 -21.532 42.206 -10.461
13 HA LYS 2 HA LYS 2 -19.341 43.966 -10.411
14 HB2 LYS 2 2HB LYS 2 -19.562 43.353 -7.861
15 HB3 LYS 2 3HB LYS 2 -19.008 41.755 -8.326
16 HG2 LYS 2 2HG LYS 2 -17.011 42.870 -7.773
17 HG3 LYS 2 3HG LYS 2 -17.059 43.038 -9.537
18 HD2 LYS 2 2HD LYS 2 -18.231 45.295 -9.150
19 HD3 LYS 2 3HD LYS 2 -17.840 45.113 -7.436
20 HE2 LYS 2 2HE LYS 2 -15.586 45.464 -7.759
21 HE3 LYS 2 3HE LYS 2 -15.582 44.672 -9.342
22 HZ1 LYS 2 1HZ LYS 2 -16.612 46.611 -10.283
23 HZ2 LYS 2 2HZ LYS 2 -16.653 47.371 -8.822
24 HZ3 LYS 2 3HZ LYS 2 -15.209 47.033 -9.541
25 H GLN 3 H GLN 3 -19.644 40.445 -9.720
26 HA GLN 3 HA GLN 3 -19.428 39.735 -12.477
27 HB2 GLN 3 2HB GLN 3 -16.951 40.079 -11.376
28 HB3 GLN 3 3HB GLN 3 -17.293 38.456 -10.775
29 HG2 GLN 3 2HG GLN 3 -17.927 37.951 -13.302
30 HG3 GLN 3 3HG GLN 3 -17.084 39.459 -13.635
31 HE21 GLN 3 1HE2 GLN 3 -16.631 36.117 -13.493
32 HE22 GLN 3 2HE2 GLN 3 -14.899 36.158 -13.227
33 H ASP 4 H ASP 4 -18.965 36.970 -12.049
34 HA ASP 4 HA ASP 4 -20.544 36.060 -9.777
35 HB2 ASP 4 2HB ASP 4 -21.374 35.871 -12.677
36 HB3 ASP 4 3HB ASP 4 -21.618 34.462 -11.644
37 H GLY 5 H GLY 5 -20.308 33.528 -9.810
38 HA2 GLY 5 2HA GLY 5 -17.947 32.498 -11.140
39 HA3 GLY 5 3HA GLY 5 -17.722 32.828 -9.406
40 H GLU 6 H GLU 6 -17.440 30.224 -9.937
41 HA GLU 6 HA GLU 6 -19.913 28.929 -9.024
42 HB2 GLU 6 2HB GLU 6 -18.509 28.491 -11.668
43 HB3 GLU 6 3HB GLU 6 -19.107 27.075 -10.798
44 HG2 GLU 6 2HG GLU 6 -21.367 28.058 -10.683
45 HG3 GLU 6 3HG GLU 6 -20.809 29.462 -11.609
46 H GLU 7 H GLU 7 -19.369 26.655 -8.260
47 HA GLU 7 HA GLU 7 -16.604 25.996 -7.906
48 HB2 GLU 7 2HB GLU 7 -17.144 27.487 -5.929
49 HB3 GLU 7 3HB GLU 7 -18.413 26.340 -5.465
50 HG2 GLU 7 2HG GLU 7 -16.695 24.538 -5.305
51 HG3 GLU 7 3HG GLU 7 -15.445 25.687 -5.791
52 H GLY 8 H GLY 8 -16.614 23.824 -8.223
53 HA2 GLY 8 2HA GLY 8 -19.210 22.384 -8.426
54 HA3 GLY 8 3HA GLY 8 -17.654 21.858 -9.099
55 H THR 9 H THR 9 -18.224 19.700 -7.965
56 HA THR 9 HA THR 9 -16.913 19.762 -5.384
57 HB THR 9 HB THR 9 -19.337 20.199 -4.891
58 HG1 THR 9 1HG THR 9 -18.128 19.359 -3.291
59 HG21 THR 9 1HG2 THR 9 -20.909 18.374 -5.049
60 HG22 THR 9 2HG2 THR 9 -20.236 18.688 -6.669
61 HG23 THR 9 3HG2 THR 9 -19.664 17.299 -5.717
62 H GLU 10 H GLU 10 -15.874 17.812 -4.948
63 HA GLU 10 HA GLU 10 -16.448 15.375 -6.317
64 HB2 GLU 10 2HB GLU 10 -14.410 17.186 -7.456
65 HB3 GLU 10 3HB GLU 10 -13.686 15.679 -6.886
66 HG2 GLU 10 2HG GLU 10 -15.320 14.364 -8.182
67 HG3 GLU 10 3HG GLU 10 -16.060 15.850 -8.786
68 H GLU 11 H GLU 11 -15.109 13.641 -5.231
69 HA GLU 11 HA GLU 11 -13.231 14.477 -3.202
70 HB2 GLU 11 2HB GLU 11 -15.426 14.618 -1.988
71 HB3 GLU 11 3HB GLU 11 -15.754 12.932 -2.417
72 HG2 GLU 11 2HG GLU 11 -13.773 12.192 -1.153
73 HG3 GLU 11 3HG GLU 11 -13.317 13.870 -0.839
74 H ASP 12 H ASP 12 -11.734 12.686 -2.900
75 HA ASP 12 HA ASP 12 -12.681 10.052 -3.659
76 HB2 ASP 12 2HB ASP 12 -11.750 11.005 -5.813
77 HB3 ASP 12 3HB ASP 12 -10.173 11.100 -5.016
78 H THR 13 H THR 13 -12.054 8.852 -2.041
79 HA THR 13 HA THR 13 -9.335 8.897 -0.974
80 HB THR 13 HB THR 13 -11.743 9.751 0.626
81 HG1 THR 13 1HG THR 13 -10.147 11.185 -0.378
82 HG21 THR 13 1HG2 THR 13 -10.861 8.134 2.179
83 HG22 THR 13 2HG2 THR 13 -9.182 8.624 1.824
84 HG23 THR 13 3HG2 THR 13 -10.282 9.721 2.682
85 H GLU 14 H GLU 14 -11.392 7.086 -2.522
86 HA GLU 14 HA GLU 14 -11.918 4.949 -0.557
87 HB2 GLU 14 2HB GLU 14 -12.437 5.395 -3.507
88 HB3 GLU 14 3HB GLU 14 -12.500 3.754 -2.859
89 HG2 GLU 14 2HG GLU 14 -14.092 6.037 -1.630
90 HG3 GLU 14 3HG GLU 14 -14.710 5.035 -2.947
91 H GLU 15 H GLU 15 -9.947 5.283 -3.572
92 HA GLU 15 HA GLU 15 -8.267 3.036 -2.547
93 HB2 GLU 15 2HB GLU 15 -7.620 2.804 -4.961
94 HB3 GLU 15 3HB GLU 15 -9.261 2.337 -4.536
95 HG2 GLU 15 2HG GLU 15 -10.232 4.270 -5.529
96 HG3 GLU 15 3HG GLU 15 -8.690 5.094 -5.697
97 H LYS 16 H LYS 16 -6.787 4.264 -1.234
98 HA LYS 16 HA LYS 16 -4.945 5.772 -2.966
99 HB2 LYS 16 2HB LYS 16 -4.944 7.730 -1.840
100 HB3 LYS 16 3HB LYS 16 -6.653 7.270 -1.737
101 HG2 LYS 16 2HG LYS 16 -6.011 6.300 0.544
102 HG3 LYS 16 3HG LYS 16 -4.532 7.291 0.363
103 HD2 LYS 16 2HD LYS 16 -7.413 8.282 0.206
104 HD3 LYS 16 3HD LYS 16 -6.384 8.492 1.617
105 HE2 LYS 16 2HE LYS 16 -5.428 9.517 -1.070
106 HE3 LYS 16 3HE LYS 16 -6.696 10.410 -0.232
107 HZ1 LYS 16 1HZ LYS 16 -5.269 10.765 1.592
108 HZ2 LYS 16 2HZ LYS 16 -4.114 9.732 1.013
109 HZ3 LYS 16 3HZ LYS 16 -4.383 11.129 0.245
110 H CYS 17 H CYS 17 -2.927 5.833 -2.468
111 HA CYS 17 HA CYS 17 -1.622 3.602 -1.118
112 HB2 CYS 17 2HB CYS 17 -1.053 4.902 -3.259
113 HB3 CYS 17 3HB CYS 17 -0.567 6.214 -2.206
114 H THR 18 H THR 18 -1.577 3.598 1.171
115 HA THR 18 HA THR 18 -1.839 6.006 2.670
116 HB THR 18 HB THR 18 -2.211 3.522 3.378
117 HG1 THR 18 1HG THR 18 -2.645 5.277 4.707
118 HG21 THR 18 1HG2 THR 18 -0.442 2.585 4.746
119 HG22 THR 18 2HG2 THR 18 0.218 2.881 3.117
120 HG23 THR 18 3HG2 THR 18 0.596 3.985 4.463
121 H ILE 19 H ILE 19 0.991 4.447 1.215
122 HA ILE 19 HA ILE 19 2.907 5.769 2.873
123 HB ILE 19 HB ILE 19 2.947 4.170 0.315
124 HG12 ILE 19 2HG1 ILE 19 4.285 3.316 2.868
125 HG13 ILE 19 3HG1 ILE 19 2.525 3.319 2.873
126 HG21 ILE 19 1HG2 ILE 19 5.436 4.024 0.663
127 HG22 ILE 19 2HG2 ILE 19 4.873 5.640 0.186
128 HG23 ILE 19 3HG2 ILE 19 5.290 5.312 1.883
129 HD11 ILE 19 1HD1 ILE 19 3.417 1.134 2.168
130 HD12 ILE 19 2HD1 ILE 19 2.442 1.901 0.894
131 HD13 ILE 19 3HD1 ILE 19 4.213 1.916 0.778
132 H CYS 20 H CYS 20 1.833 6.284 -0.572
133 HA CYS 20 HA CYS 20 3.362 8.834 -0.810
134 HB2 CYS 20 2HB CYS 20 1.058 7.838 -2.511
135 HB3 CYS 20 3HB CYS 20 2.219 9.115 -2.869
136 H LEU 21 H LEU 21 0.444 7.893 0.784
137 HA LEU 21 HA LEU 21 -1.557 8.736 1.147
138 HB2 LEU 21 2HB LEU 21 0.091 11.251 1.524
139 HB3 LEU 21 3HB LEU 21 -1.582 11.080 2.064
140 HG LEU 21 HG LEU 21 0.633 9.184 2.945
141 HD11 LEU 21 1HD1 LEU 21 -0.419 11.656 4.341
142 HD12 LEU 21 2HD1 LEU 21 0.700 10.446 5.027
143 HD13 LEU 21 3HD1 LEU 21 1.205 11.422 3.638
144 HD21 LEU 21 1HD2 LEU 21 -2.144 9.792 4.086
145 HD22 LEU 21 2HD2 LEU 21 -1.685 8.308 3.214
146 HD23 LEU 21 3HD2 LEU 21 -0.955 8.662 4.772
147 H SER 22 H SER 22 -0.791 8.648 -1.650
148 HA SER 22 HA SER 22 -2.456 10.854 -2.760
149 HB2 SER 22 2HB SER 22 0.083 10.661 -3.373
150 HB3 SER 22 3HB SER 22 -0.440 9.285 -4.372
151 HG SER 22 HG SER 22 -0.496 11.306 -5.490
152 H ILE 23 H ILE 23 -3.861 10.177 -4.579
153 HA ILE 23 HA ILE 23 -5.213 7.716 -3.931
154 HB ILE 23 HB ILE 23 -5.479 9.991 -5.944
155 HG12 ILE 23 2HG1 ILE 23 -6.041 10.294 -3.470
156 HG13 ILE 23 3HG1 ILE 23 -7.285 10.755 -4.628
157 HG21 ILE 23 1HG2 ILE 23 -7.214 7.510 -5.885
158 HG22 ILE 23 2HG2 ILE 23 -7.793 9.086 -6.469
159 HG23 ILE 23 3HG2 ILE 23 -6.409 8.325 -7.233
160 HD11 ILE 23 1HD1 ILE 23 -7.862 9.275 -2.505
161 HD12 ILE 23 2HD1 ILE 23 -8.678 9.017 -4.054
162 HD13 ILE 23 3HD1 ILE 23 -7.378 7.942 -3.586
163 H LEU 24 H LEU 24 -5.642 6.057 -5.608
164 HA LEU 24 HA LEU 24 -3.364 5.484 -7.395
165 HB2 LEU 24 2HB LEU 24 -5.640 3.822 -6.210
166 HB3 LEU 24 3HB LEU 24 -4.308 3.159 -7.161
167 HG LEU 24 HG LEU 24 -3.897 4.643 -4.520
168 HD11 LEU 24 1HD1 LEU 24 -5.206 2.631 -4.212
169 HD12 LEU 24 2HD1 LEU 24 -3.973 1.686 -5.087
170 HD13 LEU 24 3HD1 LEU 24 -3.574 2.467 -3.527
171 HD21 LEU 24 1HD2 LEU 24 -1.956 4.780 -5.824
172 HD22 LEU 24 2HD2 LEU 24 -1.675 3.378 -4.755
173 HD23 LEU 24 3HD2 LEU 24 -2.129 3.127 -6.453
174 H GLU 25 H GLU 25 -5.080 3.593 -8.928
175 HA GLU 25 HA GLU 25 -7.415 4.845 -9.701
176 HB2 GLU 25 2HB GLU 25 -6.986 5.275 -12.071
177 HB3 GLU 25 3HB GLU 25 -5.924 6.268 -11.066
178 HG2 GLU 25 2HG GLU 25 -4.085 4.686 -11.431
179 HG3 GLU 25 3HG GLU 25 -5.104 3.705 -12.492
180 H GLU 26 H GLU 26 -8.445 3.481 -11.551
181 HA GLU 26 HA GLU 26 -7.978 0.679 -10.950
182 HB2 GLU 26 2HB GLU 26 -10.248 1.689 -11.181
183 HB3 GLU 26 3HB GLU 26 -9.937 1.984 -12.897
184 HG2 GLU 26 2HG GLU 26 -9.684 -0.469 -13.268
185 HG3 GLU 26 3HG GLU 26 -9.857 -0.750 -11.536
186 H GLY 27 H GLY 27 -5.768 0.688 -11.764
187 HA2 GLY 27 2HA GLY 27 -5.225 -1.092 -13.604
188 HA3 GLY 27 3HA GLY 27 -5.616 0.221 -14.721
189 H GLU 28 H GLU 28 -3.758 0.136 -11.615
190 HA GLU 28 HA GLU 28 -1.429 1.317 -13.049
191 HB2 GLU 28 2HB GLU 28 -3.160 2.562 -11.215
192 HB3 GLU 28 3HB GLU 28 -1.786 2.149 -10.231
193 HG2 GLU 28 2HG GLU 28 -1.364 3.525 -12.910
194 HG3 GLU 28 3HG GLU 28 -1.942 4.461 -11.533
195 H ASP 29 H ASP 29 0.610 1.081 -11.505
196 HA ASP 29 HA ASP 29 0.699 -1.731 -10.842
197 HB2 ASP 29 2HB ASP 29 2.935 -1.549 -10.450
198 HB3 ASP 29 3HB ASP 29 2.625 -0.616 -11.868
199 H VAL 30 H VAL 30 -0.089 -2.556 -9.061
200 HA VAL 30 HA VAL 30 0.328 -1.186 -6.517
201 HB VAL 30 HB VAL 30 -1.999 -1.545 -5.809
202 HG11 VAL 30 1HG1 VAL 30 -1.333 0.676 -6.718
203 HG12 VAL 30 2HG1 VAL 30 -1.927 0.176 -8.317
204 HG13 VAL 30 3HG1 VAL 30 -3.052 0.314 -6.958
205 HG21 VAL 30 1HG2 VAL 30 -2.678 -3.348 -7.354
206 HG22 VAL 30 2HG2 VAL 30 -3.790 -1.972 -7.447
207 HG23 VAL 30 3HG2 VAL 30 -2.587 -2.217 -8.725
208 H ARG 31 H ARG 31 -0.144 -2.731 -4.724
209 HA ARG 31 HA ARG 31 -0.124 -5.564 -5.498
210 HB2 ARG 31 2HB ARG 31 2.002 -4.060 -3.972
211 HB3 ARG 31 3HB ARG 31 1.551 -5.643 -3.360
212 HG2 ARG 31 2HG ARG 31 1.892 -5.898 -6.209
213 HG3 ARG 31 3HG ARG 31 3.267 -4.987 -5.569
214 HD2 ARG 31 2HD ARG 31 3.751 -6.712 -3.940
215 HD3 ARG 31 3HD ARG 31 2.264 -7.594 -4.370
216 HE ARG 31 HE ARG 31 3.782 -7.265 -6.712
217 HH11 ARG 31 1HH1 ARG 31 5.412 -10.398 -6.547
218 HH12 ARG 31 2HH1 ARG 31 4.854 -9.123 -7.577
219 HH21 ARG 31 1HH2 ARG 31 5.000 -10.249 -4.194
220 HH22 ARG 31 2HH2 ARG 31 4.150 -8.871 -3.594
221 H ARG 32 H ARG 32 -0.965 -6.864 -3.778
222 HA ARG 32 HA ARG 32 -2.712 -5.296 -1.955
223 HB2 ARG 32 2HB ARG 32 -3.597 -6.710 -4.054
224 HB3 ARG 32 3HB ARG 32 -3.343 -8.082 -2.976
225 HG2 ARG 32 2HG ARG 32 -5.161 -5.669 -2.559
226 HG3 ARG 32 3HG ARG 32 -5.628 -7.344 -2.860
227 HD2 ARG 32 2HD ARG 32 -4.146 -7.679 -0.584
228 HD3 ARG 32 3HD ARG 32 -4.657 -6.043 -0.336
229 HE ARG 32 HE ARG 32 -6.941 -6.700 -0.340
230 HH11 ARG 32 1HH1 ARG 32 -8.189 -9.944 0.161
231 HH12 ARG 32 2HH1 ARG 32 -8.566 -8.264 0.181
232 HH21 ARG 32 1HH2 ARG 32 -6.001 -10.666 -0.373
233 HH22 ARG 32 2HH2 ARG 32 -4.784 -9.482 -0.682
234 H LEU 33 H LEU 33 -2.516 -5.915 0.229
235 HA LEU 33 HA LEU 33 -0.520 -8.006 0.800
236 HB2 LEU 33 2HB LEU 33 -0.930 -6.083 2.940
237 HB3 LEU 33 3HB LEU 33 0.572 -6.545 2.135
238 HG LEU 33 HG LEU 33 -1.389 -4.524 1.050
239 HD11 LEU 33 1HD1 LEU 33 -0.526 -3.838 3.286
240 HD12 LEU 33 2HD1 LEU 33 1.137 -4.029 2.700
241 HD13 LEU 33 3HD1 LEU 33 0.076 -2.790 1.997
242 HD21 LEU 33 1HD2 LEU 33 0.440 -3.735 -0.335
243 HD22 LEU 33 2HD2 LEU 33 1.601 -4.813 0.476
244 HD23 LEU 33 3HD2 LEU 33 0.354 -5.484 -0.578
245 HA PRO 34 HA PRO 34 -3.346 -10.251 3.013
246 HB2 PRO 34 2HB PRO 34 -2.431 -10.565 5.640
247 HB3 PRO 34 3HB PRO 34 -1.857 -11.457 4.204
248 HG2 PRO 34 2HG PRO 34 -0.564 -9.152 5.611
249 HG3 PRO 34 3HG PRO 34 0.181 -10.522 4.728
250 HD2 PRO 34 2HD PRO 34 -0.160 -7.915 3.807
251 HD3 PRO 34 3HD PRO 34 0.148 -9.295 2.741
252 H CYS 35 H CYS 35 -2.480 -7.387 5.014
253 HA CYS 35 HA CYS 35 -5.142 -7.186 6.301
254 HB2 CYS 35 2HB CYS 35 -4.146 -5.146 7.180
255 HB3 CYS 35 3HB CYS 35 -3.095 -6.540 7.460
256 H MET 36 H MET 36 -5.166 -7.230 3.330
257 HA MET 36 HA MET 36 -5.985 -6.153 1.577
258 HB2 MET 36 2HB MET 36 -8.299 -5.411 1.920
259 HB3 MET 36 3HB MET 36 -7.932 -6.936 2.726
260 HG2 MET 36 2HG MET 36 -7.784 -5.856 4.881
261 HG3 MET 36 3HG MET 36 -7.917 -4.250 4.151
262 HE1 MET 36 1HE MET 36 -9.754 -5.767 6.596
263 HE2 MET 36 2HE MET 36 -9.620 -4.034 6.208
264 HE3 MET 36 3HE MET 36 -11.219 -4.816 6.260
265 H HIS 37 H HIS 37 -3.921 -4.565 2.496
266 HA HIS 37 HA HIS 37 -4.992 -1.816 2.153
267 HB2 HIS 37 1HB HIS 37 -2.716 -3.079 3.651
268 HB3 HIS 37 2HB HIS 37 -2.502 -1.454 3.068
269 HD2 HIS 37 2HD HIS 37 -5.427 -0.252 3.650
270 HE1 HIS 37 1HE HIS 37 -4.460 -1.035 7.718
271 HE2 HIS 37 2HE HIS 37 -5.982 0.281 6.149
272 H LEU 38 H LEU 38 -5.172 -2.062 -0.185
273 HA LEU 38 HA LEU 38 -2.862 -2.872 -1.686
274 HB2 LEU 38 2HB LEU 38 -4.058 -2.322 -3.674
275 HB3 LEU 38 3HB LEU 38 -5.088 -3.224 -2.593
276 HG LEU 38 HG LEU 38 -5.487 -0.306 -2.268
277 HD11 LEU 38 1HD1 LEU 38 -6.107 -1.552 -4.977
278 HD12 LEU 38 2HD1 LEU 38 -6.507 0.095 -4.437
279 HD13 LEU 38 3HD1 LEU 38 -4.816 -0.373 -4.677
280 HD21 LEU 38 1HD2 LEU 38 -7.810 -0.910 -2.543
281 HD22 LEU 38 2HD2 LEU 38 -7.365 -2.545 -3.070
282 HD23 LEU 38 3HD2 LEU 38 -7.031 -2.016 -1.401
283 H PHE 39 H PHE 39 -1.120 -1.754 -2.397
284 HA PHE 39 HA PHE 39 -1.154 1.228 -2.330
285 HB2 PHE 39 2HB PHE 39 0.814 -0.677 -1.016
286 HB3 PHE 39 3HB PHE 39 1.098 1.049 -1.180
287 HD1 PHE 39 1HD PHE 39 1.199 -0.613 1.382
288 HD2 PHE 39 2HD PHE 39 -2.001 1.678 -0.358
289 HE1 PHE 39 1HE PHE 39 0.174 -0.337 3.609
290 HE2 PHE 39 2HE PHE 39 -3.062 1.886 1.835
291 HZ PHE 39 HZ PHE 39 -1.972 0.904 3.850
292 H HIS 40 H HIS 40 0.778 2.108 -3.598
293 HA HIS 40 HA HIS 40 0.920 0.900 -6.150
294 HB2 HIS 40 1HB HIS 40 2.848 2.800 -4.794
295 HB3 HIS 40 2HB HIS 40 3.051 2.277 -6.455
296 HD2 HIS 40 2HD HIS 40 0.960 2.861 -8.210
297 HE1 HIS 40 1HE HIS 40 0.345 6.605 -6.281
298 HE2 HIS 40 2HE HIS 40 0.008 5.204 -8.468
299 H GLN 41 H GLN 41 2.659 -0.203 -7.271
300 HA GLN 41 HA GLN 41 4.181 -2.073 -5.624
301 HB2 GLN 41 2HB GLN 41 2.994 -2.462 -7.911
302 HB3 GLN 41 3HB GLN 41 4.418 -1.716 -8.627
303 HG2 GLN 41 2HG GLN 41 5.850 -3.443 -8.024
304 HG3 GLN 41 3HG GLN 41 4.878 -3.926 -6.642
305 HE21 GLN 41 1HE2 GLN 41 3.974 -3.472 -10.122
306 HE22 GLN 41 2HE2 GLN 41 3.375 -5.114 -10.307
307 H VAL 42 H VAL 42 4.751 1.000 -5.849
308 HA VAL 42 HA VAL 42 7.718 0.698 -6.051
309 HB VAL 42 HB VAL 42 6.011 3.124 -6.762
310 HG11 VAL 42 1HG1 VAL 42 9.042 2.787 -6.650
311 HG12 VAL 42 2HG1 VAL 42 8.201 4.159 -7.403
312 HG13 VAL 42 3HG1 VAL 42 8.059 3.892 -5.663
313 HG21 VAL 42 1HG2 VAL 42 7.817 1.317 -8.432
314 HG22 VAL 42 2HG2 VAL 42 6.047 1.430 -8.543
315 HG23 VAL 42 3HG2 VAL 42 7.042 2.810 -9.011
316 H CYS 43 H CYS 43 5.216 2.911 -4.641
317 HA CYS 43 HA CYS 43 6.499 3.698 -2.270
318 HB2 CYS 43 2HB CYS 43 3.595 2.848 -2.531
319 HB3 CYS 43 3HB CYS 43 4.301 4.008 -1.414
320 H VAL 44 H VAL 44 4.496 0.728 -2.789
321 HA VAL 44 HA VAL 44 5.052 -0.108 -0.106
322 HB VAL 44 HB VAL 44 2.936 -0.452 -1.562
323 HG11 VAL 44 1HG1 VAL 44 4.205 -3.171 -1.976
324 HG12 VAL 44 2HG1 VAL 44 2.696 -2.493 -2.652
325 HG13 VAL 44 3HG1 VAL 44 4.282 -1.940 -3.238
326 HG21 VAL 44 1HG2 VAL 44 2.362 -2.333 -0.067
327 HG22 VAL 44 2HG2 VAL 44 4.091 -2.580 0.269
328 HG23 VAL 44 3HG2 VAL 44 3.302 -1.087 0.798
329 H ASP 45 H ASP 45 6.665 -0.541 -3.066
330 HA ASP 45 HA ASP 45 8.031 -3.040 -2.494
331 HB2 ASP 45 2HB ASP 45 8.079 -2.044 -4.748
332 HB3 ASP 45 3HB ASP 45 8.962 -0.643 -4.138
333 H GLN 46 H GLN 46 9.076 0.402 -2.178
334 HA GLN 46 HA GLN 46 11.235 -0.318 -0.459
335 HB2 GLN 46 2HB GLN 46 9.861 2.395 -0.734
336 HB3 GLN 46 3HB GLN 46 11.437 2.092 0.026
337 HG2 GLN 46 2HG GLN 46 12.181 1.061 -2.189
338 HG3 GLN 46 3HG GLN 46 10.702 1.721 -2.907
339 HE21 GLN 46 1HE2 GLN 46 13.629 2.386 -3.408
340 HE22 GLN 46 2HE2 GLN 46 13.703 4.121 -3.114
341 H ALA 47 H ALA 47 7.861 0.373 0.301
342 HA ALA 47 HA ALA 47 8.204 0.613 3.117
343 HB1 ALA 47 1HB ALA 47 6.094 0.993 1.841
344 HB2 ALA 47 2HB ALA 47 5.939 -0.776 1.653
345 HB3 ALA 47 3HB ALA 47 5.884 -0.050 3.271
346 H LEU 48 H LEU 48 7.464 -2.357 1.193
347 HA LEU 48 HA LEU 48 7.512 -4.122 3.365
348 HB2 LEU 48 2HB LEU 48 6.490 -4.443 1.109
349 HB3 LEU 48 3HB LEU 48 8.086 -4.727 0.423
350 HG LEU 48 HG LEU 48 7.045 -6.386 2.756
351 HD11 LEU 48 1HD1 LEU 48 6.562 -6.908 -0.207
352 HD12 LEU 48 2HD1 LEU 48 6.147 -8.002 1.130
353 HD13 LEU 48 3HD1 LEU 48 5.320 -6.443 0.976
354 HD21 LEU 48 1HD2 LEU 48 8.463 -8.153 1.697
355 HD22 LEU 48 2HD2 LEU 48 9.008 -6.980 0.488
356 HD23 LEU 48 3HD2 LEU 48 9.418 -6.774 2.208
357 H ILE 49 H ILE 49 10.134 -3.368 0.979
358 HA ILE 49 HA ILE 49 12.008 -5.141 2.171
359 HB ILE 49 HB ILE 49 13.704 -4.047 0.919
360 HG12 ILE 49 2HG1 ILE 49 12.738 -1.941 -0.501
361 HG13 ILE 49 3HG1 ILE 49 11.984 -1.688 1.086
362 HG21 ILE 49 1HG2 ILE 49 12.849 -4.236 -1.313
363 HG22 ILE 49 2HG2 ILE 49 12.065 -5.461 -0.299
364 HG23 ILE 49 3HG2 ILE 49 11.188 -3.994 -0.776
365 HD11 ILE 49 1HD1 ILE 49 14.950 -2.005 0.519
366 HD12 ILE 49 2HD1 ILE 49 14.108 -0.522 1.018
367 HD13 ILE 49 3HD1 ILE 49 14.250 -1.885 2.146
368 H THR 50 H THR 50 11.053 -1.823 3.089
369 HA THR 50 HA THR 50 13.275 -1.461 4.875
370 HB THR 50 HB THR 50 10.557 -0.136 4.587
371 HG1 THR 50 1HG THR 50 11.992 0.477 3.095
372 HG21 THR 50 1HG2 THR 50 12.706 0.519 6.635
373 HG22 THR 50 2HG2 THR 50 11.372 1.599 6.167
374 HG23 THR 50 3HG2 THR 50 11.014 0.062 6.962
375 H ASN 51 H ASN 51 9.829 -2.408 5.382
376 HA ASN 51 HA ASN 51 10.587 -4.307 7.430
377 HB2 ASN 51 2HB ASN 51 8.761 -1.920 8.006
378 HB3 ASN 51 3HB ASN 51 8.753 -3.391 8.974
379 HD21 ASN 51 1HD2 ASN 51 11.334 -4.039 9.550
380 HD22 ASN 51 2HD2 ASN 51 12.121 -2.650 10.270
381 H LYS 52 H LYS 52 9.375 -6.071 6.831
382 HA LYS 52 HA LYS 52 7.016 -5.803 5.140
383 HB2 LYS 52 2HB LYS 52 6.949 -8.232 5.305
384 HB3 LYS 52 3HB LYS 52 8.566 -7.677 4.899
385 HG2 LYS 52 2HG LYS 52 8.399 -7.846 7.801
386 HG3 LYS 52 3HG LYS 52 7.741 -9.334 7.116
387 HD2 LYS 52 2HD LYS 52 9.761 -9.583 5.720
388 HD3 LYS 52 3HD LYS 52 10.449 -8.113 6.437
389 HE2 LYS 52 2HE LYS 52 10.419 -9.185 8.661
390 HE3 LYS 52 3HE LYS 52 9.618 -10.612 7.977
391 HZ1 LYS 52 1HZ LYS 52 11.550 -10.937 6.569
392 HZ2 LYS 52 2HZ LYS 52 12.313 -9.650 7.242
393 HZ3 LYS 52 3HZ LYS 52 11.980 -10.979 8.163
394 H LYS 53 H LYS 53 6.382 -4.244 7.316
395 HA LYS 53 HA LYS 53 4.110 -5.743 8.348
396 HB2 LYS 53 2HB LYS 53 6.279 -4.565 10.059
397 HB3 LYS 53 3HB LYS 53 4.610 -4.263 10.566
398 HG2 LYS 53 2HG LYS 53 4.123 -6.524 10.912
399 HG3 LYS 53 3HG LYS 53 5.390 -7.073 9.803
400 HD2 LYS 53 2HD LYS 53 6.092 -7.637 12.000
401 HD3 LYS 53 3HD LYS 53 7.128 -6.347 11.370
402 HE2 LYS 53 2HE LYS 53 5.433 -4.750 12.617
403 HE3 LYS 53 3HE LYS 53 4.958 -6.219 13.487
404 HZ1 LYS 53 1HZ LYS 53 7.330 -6.485 14.062
405 HZ2 LYS 53 2HZ LYS 53 7.662 -5.035 13.358
406 HZ3 LYS 53 3HZ LYS 53 6.687 -5.103 14.682
407 H CYS 54 H CYS 54 2.370 -4.519 8.155
408 HA CYS 54 HA CYS 54 2.347 -2.078 6.609
409 HB2 CYS 54 2HB CYS 54 0.485 -3.918 7.873
410 HB3 CYS 54 3HB CYS 54 0.081 -2.261 8.341
411 HA PRO 55 HA PRO 55 2.869 0.927 9.943
412 HB2 PRO 55 2HB PRO 55 1.495 3.092 8.981
413 HB3 PRO 55 3HB PRO 55 3.027 2.515 8.274
414 HG2 PRO 55 2HG PRO 55 0.222 1.948 7.275
415 HG3 PRO 55 3HG PRO 55 1.662 2.447 6.343
416 HD2 PRO 55 2HD PRO 55 0.836 -0.164 6.591
417 HD3 PRO 55 3HD PRO 55 2.553 0.289 6.384
418 H ILE 56 H ILE 56 -0.423 2.075 9.128
419 HA ILE 56 HA ILE 56 -1.325 1.249 11.779
420 HB ILE 56 HB ILE 56 -2.877 2.607 9.553
421 HG12 ILE 56 2HG1 ILE 56 -1.098 4.112 10.042
422 HG13 ILE 56 3HG1 ILE 56 -2.513 4.691 10.905
423 HG21 ILE 56 1HG2 ILE 56 -4.294 1.555 11.322
424 HG22 ILE 56 2HG2 ILE 56 -3.439 2.488 12.556
425 HG23 ILE 56 3HG2 ILE 56 -4.404 3.314 11.319
426 HD11 ILE 56 1HD1 ILE 56 -0.824 4.945 12.489
427 HD12 ILE 56 2HD1 ILE 56 -1.482 3.376 12.969
428 HD13 ILE 56 3HD1 ILE 56 0.012 3.458 12.013
429 H CYS 57 H CYS 57 -0.948 -0.885 11.408
430 HA CYS 57 HA CYS 57 -3.207 -2.136 11.958
431 HB2 CYS 57 2HB CYS 57 -3.751 -3.840 10.446
432 HB3 CYS 57 3HB CYS 57 -3.896 -2.322 9.582
433 H ARG 58 H ARG 58 0.134 -2.393 10.846
434 HA ARG 58 HA ARG 58 1.918 -3.244 11.850
435 HB2 ARG 58 2HB ARG 58 0.383 -2.318 13.851
436 HB3 ARG 58 3HB ARG 58 0.424 -4.012 14.349
437 HG2 ARG 58 2HG ARG 58 2.937 -3.907 14.310
438 HG3 ARG 58 3HG ARG 58 2.821 -2.212 13.780
439 HD2 ARG 58 2HD ARG 58 1.383 -1.827 15.889
440 HD3 ARG 58 3HD ARG 58 1.974 -3.408 16.444
441 HE ARG 58 HE ARG 58 4.206 -1.887 15.651
442 HH11 ARG 58 1HH1 ARG 58 4.795 -0.102 18.636
443 HH12 ARG 58 2HH1 ARG 58 5.460 -0.579 17.121
444 HH21 ARG 58 1HH2 ARG 58 2.587 -0.745 19.216
445 HH22 ARG 58 2HH2 ARG 58 1.686 -1.720 18.112
446 H VAL 59 H VAL 59 0.190 -5.051 10.268
447 HA VAL 59 HA VAL 59 0.787 -7.688 11.511
448 HB VAL 59 HB VAL 59 -1.019 -6.983 9.147
449 HG11 VAL 59 1HG1 VAL 59 -1.971 -9.308 9.770
450 HG12 VAL 59 2HG1 VAL 59 -0.421 -9.272 8.932
451 HG13 VAL 59 3HG1 VAL 59 -0.475 -9.550 10.689
452 HG21 VAL 59 1HG2 VAL 59 -2.892 -7.438 10.744
453 HG22 VAL 59 2HG2 VAL 59 -1.707 -7.492 12.071
454 HG23 VAL 59 3HG2 VAL 59 -1.973 -5.998 11.149
455 H ASP 60 H ASP 60 1.892 -9.267 10.268
456 HA ASP 60 HA ASP 60 4.014 -8.244 8.622
457 HB2 ASP 60 2HB ASP 60 4.163 -10.222 10.169
458 HB3 ASP 60 3HB ASP 60 3.125 -11.116 9.050
459 H ILE 61 H ILE 61 4.241 -8.395 6.405
460 HA ILE 61 HA ILE 61 1.866 -9.334 4.887
461 HB ILE 61 HB ILE 61 2.276 -7.612 3.307
462 HG12 ILE 61 2HG1 ILE 61 4.594 -6.717 5.077
463 HG13 ILE 61 3HG1 ILE 61 4.760 -7.510 3.498
464 HG21 ILE 61 1HG2 ILE 61 2.429 -6.198 5.981
465 HG22 ILE 61 2HG2 ILE 61 1.444 -5.780 4.548
466 HG23 ILE 61 3HG2 ILE 61 1.005 -7.167 5.552
467 HD11 ILE 61 1HD1 ILE 61 4.959 -5.195 3.131
468 HD12 ILE 61 2HD1 ILE 61 3.356 -5.729 2.524
469 HD13 ILE 61 3HD1 ILE 61 3.485 -4.838 4.078
470 H GLU 62 H GLU 62 5.173 -9.804 5.371
471 HA GLU 62 HA GLU 62 6.112 -10.619 2.808
472 HB2 GLU 62 2HB GLU 62 7.423 -10.371 5.040
473 HB3 GLU 62 3HB GLU 62 6.789 -11.946 5.481
474 HG2 GLU 62 2HG GLU 62 8.897 -12.419 4.603
475 HG3 GLU 62 3HG GLU 62 7.828 -12.781 3.242
476 H ALA 63 H ALA 63 4.534 -12.373 5.471
477 HA ALA 63 HA ALA 63 3.492 -14.360 5.657
478 HB1 ALA 63 1HB ALA 63 1.867 -14.967 3.962
479 HB2 ALA 63 2HB ALA 63 1.929 -13.202 4.073
480 HB3 ALA 63 3HB ALA 63 2.736 -14.027 2.726
481 H GLN 64 H GLN 64 3.184 -16.510 3.719
482 HA GLN 64 HA GLN 64 5.954 -17.557 3.758
483 HB2 GLN 64 2HB GLN 64 3.234 -18.758 3.219
484 HB3 GLN 64 3HB GLN 64 4.630 -19.442 2.382
485 HG2 GLN 64 2HG GLN 64 5.787 -19.547 4.690
486 HG3 GLN 64 3HG GLN 64 4.165 -19.322 5.365
487 HE21 GLN 64 1HE2 GLN 64 6.392 -21.571 3.809
488 HE22 GLN 64 2HE2 GLN 64 5.257 -22.912 3.763
489 H LEU 65 H LEU 65 7.223 -16.602 2.226
490 HA LEU 65 HA LEU 65 6.364 -17.187 -0.539
491 HB2 LEU 65 2HB LEU 65 6.134 -14.632 0.261
492 HB3 LEU 65 3HB LEU 65 7.865 -14.621 -0.045
493 HG LEU 65 HG LEU 65 7.140 -15.824 -2.326
494 HD11 LEU 65 1HD1 LEU 65 4.931 -15.058 -3.109
495 HD12 LEU 65 2HD1 LEU 65 4.731 -16.002 -1.619
496 HD13 LEU 65 3HD1 LEU 65 4.643 -14.235 -1.560
497 HD21 LEU 65 1HD2 LEU 65 6.761 -12.853 -1.770
498 HD22 LEU 65 2HD2 LEU 65 8.269 -13.664 -2.240
499 HD23 LEU 65 3HD2 LEU 65 6.921 -13.583 -3.389
500 HA PRO 66 HA PRO 66 10.525 -18.780 0.400
501 HB2 PRO 66 2HB PRO 66 10.567 -20.948 -1.254
502 HB3 PRO 66 3HB PRO 66 9.648 -20.925 0.280
503 HG2 PRO 66 2HG PRO 66 8.597 -20.398 -2.516
504 HG3 PRO 66 3HG PRO 66 7.910 -21.476 -1.260
505 HD2 PRO 66 2HD PRO 66 7.007 -18.921 -1.670
506 HD3 PRO 66 3HD PRO 66 7.054 -19.651 -0.034
507 H SER 67 H SER 67 11.272 -16.730 -0.534
508 HA SER 67 HA SER 67 12.742 -17.279 -2.996
509 HB2 SER 67 2HB SER 67 10.418 -16.003 -3.400
510 HB3 SER 67 3HB SER 67 11.342 -14.607 -2.817
511 HG SER 67 HG SER 67 11.903 -16.325 -5.012
512 H GLU 68 H GLU 68 14.785 -16.210 -2.861
513 HA GLU 68 HA GLU 68 15.397 -15.181 -0.181
514 HB2 GLU 68 2HB GLU 68 16.763 -16.869 -1.649
515 HB3 GLU 68 3HB GLU 68 17.363 -15.424 -2.477
516 HG2 GLU 68 2HG GLU 68 18.285 -14.576 -0.363
517 HG3 GLU 68 3HG GLU 68 17.449 -15.840 0.549
518 H SER 69 H SER 69 16.958 -13.060 -0.210
519 HA SER 69 HA SER 69 16.327 -11.191 -2.295
520 HB2 SER 69 2HB SER 69 15.432 -9.528 -0.532
521 HB3 SER 69 3HB SER 69 14.312 -10.745 -1.177
522 HG SER 69 HG SER 69 14.874 -12.031 0.684
Start of MODEL 28
1 H1 MET 1 H1 MET 1 -12.060 46.320 8.886
2 H2 MET 1 H2 MET 1 -12.698 47.840 8.801
3 H3 MET 1 H3 MET 1 -13.200 46.765 9.964
4 HA MET 1 HA MET 1 -14.861 46.916 8.288
5 HB2 MET 1 2HB MET 1 -14.348 46.108 5.997
6 HB3 MET 1 3HB MET 1 -13.526 47.603 6.402
7 HG2 MET 1 2HG MET 1 -12.168 44.889 6.615
8 HG3 MET 1 3HG MET 1 -12.182 45.859 5.144
9 HE1 MET 1 1HE MET 1 -9.667 45.870 4.886
10 HE2 MET 1 2HE MET 1 -8.505 46.414 6.116
11 HE3 MET 1 3HE MET 1 -9.410 44.903 6.359
12 H LYS 2 H LYS 2 -15.399 44.564 6.830
13 HA LYS 2 HA LYS 2 -14.514 42.344 8.587
14 HB2 LYS 2 2HB LYS 2 -17.265 43.075 7.639
15 HB3 LYS 2 3HB LYS 2 -16.771 41.430 7.264
16 HG2 LYS 2 2HG LYS 2 -17.874 41.297 9.335
17 HG3 LYS 2 3HG LYS 2 -16.153 41.078 9.668
18 HD2 LYS 2 2HD LYS 2 -16.031 43.482 10.387
19 HD3 LYS 2 3HD LYS 2 -17.783 43.623 10.090
20 HE2 LYS 2 2HE LYS 2 -18.151 41.714 11.687
21 HE3 LYS 2 3HE LYS 2 -16.414 41.691 12.021
22 HZ1 LYS 2 1HZ LYS 2 -16.624 43.955 12.853
23 HZ2 LYS 2 2HZ LYS 2 -18.250 43.938 12.573
24 HZ3 LYS 2 3HZ LYS 2 -17.594 42.923 13.688
25 H GLN 3 H GLN 3 -13.855 40.501 7.376
26 HA GLN 3 HA GLN 3 -14.245 40.206 4.585
27 HB2 GLN 3 2HB GLN 3 -11.871 41.720 5.431
28 HB3 GLN 3 3HB GLN 3 -11.384 40.172 4.735
29 HG2 GLN 3 2HG GLN 3 -12.601 40.609 2.690
30 HG3 GLN 3 3HG GLN 3 -13.342 42.064 3.372
31 HE21 GLN 3 1HE2 GLN 3 -12.335 43.999 2.862
32 HE22 GLN 3 2HE2 GLN 3 -10.648 44.093 2.358
33 H ASP 4 H ASP 4 -13.791 37.934 4.123
34 HA ASP 4 HA ASP 4 -12.147 36.391 5.874
35 HB2 ASP 4 2HB ASP 4 -14.536 36.744 7.051
36 HB3 ASP 4 3HB ASP 4 -15.044 35.508 5.899
37 H GLY 5 H GLY 5 -12.353 33.943 5.035
38 HA2 GLY 5 2HA GLY 5 -13.772 33.386 2.653
39 HA3 GLY 5 3HA GLY 5 -12.133 33.909 2.210
40 H GLU 6 H GLU 6 -13.206 31.208 1.789
41 HA GLU 6 HA GLU 6 -11.170 29.668 3.180
42 HB2 GLU 6 2HB GLU 6 -13.958 29.693 4.048
43 HB3 GLU 6 3HB GLU 6 -13.615 28.129 3.322
44 HG2 GLU 6 2HG GLU 6 -11.886 29.398 5.486
45 HG3 GLU 6 3HG GLU 6 -13.221 28.285 5.802
46 H GLU 7 H GLU 7 -10.708 27.742 1.900
47 HA GLU 7 HA GLU 7 -12.372 26.997 -0.282
48 HB2 GLU 7 2HB GLU 7 -11.244 29.088 -1.220
49 HB3 GLU 7 3HB GLU 7 -9.704 28.224 -1.124
50 HG2 GLU 7 2HG GLU 7 -10.528 26.500 -2.650
51 HG3 GLU 7 3HG GLU 7 -12.168 27.155 -2.577
52 H GLY 8 H GLY 8 -12.063 24.780 -0.260
53 HA2 GLY 8 2HA GLY 8 -9.377 23.653 0.053
54 HA3 GLY 8 3HA GLY 8 -10.527 23.331 1.368
55 H THR 9 H THR 9 -9.437 21.259 -0.279
56 HA THR 9 HA THR 9 -11.797 20.218 -1.723
57 HB THR 9 HB THR 9 -10.151 19.599 -3.565
58 HG1 THR 9 1HG THR 9 -8.291 20.024 -2.221
59 HG21 THR 9 1HG2 THR 9 -10.186 21.735 -4.701
60 HG22 THR 9 2HG2 THR 9 -11.701 21.576 -3.786
61 HG23 THR 9 3HG2 THR 9 -10.389 22.616 -3.180
62 H GLU 10 H GLU 10 -11.758 17.806 -1.691
63 HA GLU 10 HA GLU 10 -9.338 16.566 -0.688
64 HB2 GLU 10 2HB GLU 10 -10.661 17.314 1.361
65 HB3 GLU 10 3HB GLU 10 -11.950 16.209 0.847
66 HG2 GLU 10 2HG GLU 10 -10.333 14.312 0.940
67 HG3 GLU 10 3HG GLU 10 -9.049 15.433 1.408
68 H GLU 11 H GLU 11 -9.136 14.625 -1.740
69 HA GLU 11 HA GLU 11 -11.571 13.348 -2.877
70 HB2 GLU 11 2HB GLU 11 -8.837 13.879 -4.105
71 HB3 GLU 11 3HB GLU 11 -9.800 12.487 -4.583
72 HG2 GLU 11 2HG GLU 11 -10.313 14.136 -6.161
73 HG3 GLU 11 3HG GLU 11 -11.722 13.982 -5.119
74 H ASP 12 H ASP 12 -11.909 11.600 -1.605
75 HA ASP 12 HA ASP 12 -9.870 9.570 -1.390
76 HB2 ASP 12 2HB ASP 12 -9.446 11.363 0.510
77 HB3 ASP 12 3HB ASP 12 -10.851 10.661 1.283
78 H THR 13 H THR 13 -11.766 8.862 -2.658
79 HA THR 13 HA THR 13 -13.679 7.464 -0.873
80 HB THR 13 HB THR 13 -14.133 10.047 -1.813
81 HG1 THR 13 1HG THR 13 -14.888 9.075 0.021
82 HG21 THR 13 1HG2 THR 13 -16.131 8.306 -3.266
83 HG22 THR 13 2HG2 THR 13 -16.127 10.067 -3.103
84 HG23 THR 13 3HG2 THR 13 -14.839 9.276 -4.027
85 H GLU 14 H GLU 14 -11.634 7.027 -3.243
86 HA GLU 14 HA GLU 14 -13.222 4.976 -4.596
87 HB2 GLU 14 2HB GLU 14 -11.629 7.281 -5.797
88 HB3 GLU 14 3HB GLU 14 -11.894 5.758 -6.664
89 HG2 GLU 14 2HG GLU 14 -14.368 6.035 -6.352
90 HG3 GLU 14 3HG GLU 14 -14.067 7.625 -5.639
91 H GLU 15 H GLU 15 -9.868 6.360 -4.907
92 HA GLU 15 HA GLU 15 -8.735 4.070 -3.465
93 HB2 GLU 15 2HB GLU 15 -7.491 3.557 -5.719
94 HB3 GLU 15 3HB GLU 15 -9.093 2.894 -5.430
95 HG2 GLU 15 2HG GLU 15 -10.153 4.437 -6.861
96 HG3 GLU 15 3HG GLU 15 -8.794 5.551 -6.869
97 H LYS 16 H LYS 16 -6.975 4.913 -2.388
98 HA LYS 16 HA LYS 16 -5.067 6.402 -4.015
99 HB2 LYS 16 2HB LYS 16 -4.552 8.016 -2.213
100 HB3 LYS 16 3HB LYS 16 -6.140 8.279 -2.941
101 HG2 LYS 16 2HG LYS 16 -7.271 7.378 -1.106
102 HG3 LYS 16 3HG LYS 16 -5.781 6.707 -0.404
103 HD2 LYS 16 2HD LYS 16 -6.330 8.683 0.831
104 HD3 LYS 16 3HD LYS 16 -4.892 9.043 -0.132
105 HE2 LYS 16 2HE LYS 16 -6.216 10.243 -1.797
106 HE3 LYS 16 3HE LYS 16 -7.720 9.658 -1.078
107 HZ1 LYS 16 1HZ LYS 16 -5.872 11.588 0.158
108 HZ2 LYS 16 2HZ LYS 16 -7.407 11.850 -0.421
109 HZ3 LYS 16 3HZ LYS 16 -7.179 10.912 0.910
110 H CYS 17 H CYS 17 -2.973 6.207 -3.300
111 HA CYS 17 HA CYS 17 -2.071 3.890 -1.689
112 HB2 CYS 17 2HB CYS 17 -0.912 4.914 -3.697
113 HB3 CYS 17 3HB CYS 17 -0.687 6.381 -2.756
114 H THR 18 H THR 18 -1.857 3.981 0.484
115 HA THR 18 HA THR 18 -2.297 6.507 1.866
116 HB THR 18 HB THR 18 -3.377 4.556 2.706
117 HG1 THR 18 1HG THR 18 -1.975 6.201 4.165
118 HG21 THR 18 1HG2 THR 18 -0.570 3.460 3.118
119 HG22 THR 18 2HG2 THR 18 -2.046 2.795 3.852
120 HG23 THR 18 3HG2 THR 18 -1.861 2.804 2.084
121 H ILE 19 H ILE 19 0.568 4.787 0.750
122 HA ILE 19 HA ILE 19 2.307 5.911 2.785
123 HB ILE 19 HB ILE 19 2.620 4.272 0.268
124 HG12 ILE 19 2HG1 ILE 19 3.633 3.587 3.034
125 HG13 ILE 19 3HG1 ILE 19 1.901 3.446 2.707
126 HG21 ILE 19 1HG2 ILE 19 4.820 5.485 1.978
127 HG22 ILE 19 2HG2 ILE 19 5.072 4.085 0.912
128 HG23 ILE 19 3HG2 ILE 19 4.585 5.643 0.219
129 HD11 ILE 19 1HD1 ILE 19 4.010 2.135 0.951
130 HD12 ILE 19 2HD1 ILE 19 3.184 1.345 2.304
131 HD13 ILE 19 3HD1 ILE 19 2.245 1.930 0.903
132 H CYS 20 H CYS 20 1.722 6.464 -0.741
133 HA CYS 20 HA CYS 20 3.390 8.940 -0.762
134 HB2 CYS 20 2HB CYS 20 1.401 8.117 -2.878
135 HB3 CYS 20 3HB CYS 20 2.823 9.151 -3.001
136 H LEU 21 H LEU 21 0.252 8.135 0.366
137 HA LEU 21 HA LEU 21 -1.742 9.122 0.457
138 HB2 LEU 21 2HB LEU 21 0.069 11.430 1.206
139 HB3 LEU 21 3HB LEU 21 -1.680 11.424 1.475
140 HG LEU 21 HG LEU 21 0.180 9.279 2.582
141 HD11 LEU 21 1HD1 LEU 21 -0.894 11.767 3.949
142 HD12 LEU 21 2HD1 LEU 21 0.000 10.437 4.731
143 HD13 LEU 21 3HD1 LEU 21 0.803 11.439 3.510
144 HD21 LEU 21 1HD2 LEU 21 -1.710 8.814 4.101
145 HD22 LEU 21 2HD2 LEU 21 -2.671 10.097 3.335
146 HD23 LEU 21 3HD2 LEU 21 -2.235 8.637 2.427
147 H SER 22 H SER 22 -1.626 8.717 -2.000
148 HA SER 22 HA SER 22 -2.492 11.194 -3.337
149 HB2 SER 22 2HB SER 22 0.070 10.876 -3.590
150 HB3 SER 22 3HB SER 22 -0.328 9.462 -4.587
151 HG SER 22 HG SER 22 -0.819 12.196 -5.032
152 H ILE 23 H ILE 23 -3.884 10.700 -5.150
153 HA ILE 23 HA ILE 23 -5.419 8.307 -4.875
154 HB ILE 23 HB ILE 23 -5.280 10.662 -6.785
155 HG12 ILE 23 2HG1 ILE 23 -6.146 10.921 -4.363
156 HG13 ILE 23 3HG1 ILE 23 -7.110 11.579 -5.679
157 HG21 ILE 23 1HG2 ILE 23 -6.134 8.995 -8.184
158 HG22 ILE 23 2HG2 ILE 23 -7.205 8.333 -6.944
159 HG23 ILE 23 3HG2 ILE 23 -7.520 9.939 -7.660
160 HD11 ILE 23 1HD1 ILE 23 -8.438 10.367 -3.924
161 HD12 ILE 23 2HD1 ILE 23 -8.698 9.766 -5.566
162 HD13 ILE 23 3HD1 ILE 23 -7.672 8.858 -4.438
163 H LEU 24 H LEU 24 -5.710 6.737 -6.585
164 HA LEU 24 HA LEU 24 -3.230 6.111 -8.089
165 HB2 LEU 24 2HB LEU 24 -5.679 4.489 -7.252
166 HB3 LEU 24 3HB LEU 24 -4.244 3.808 -8.033
167 HG LEU 24 HG LEU 24 -4.004 5.290 -5.393
168 HD11 LEU 24 1HD1 LEU 24 -4.784 2.448 -5.934
169 HD12 LEU 24 2HD1 LEU 24 -3.920 2.935 -4.446
170 HD13 LEU 24 3HD1 LEU 24 -5.500 3.645 -4.837
171 HD21 LEU 24 1HD2 LEU 24 -1.970 3.842 -5.271
172 HD22 LEU 24 2HD2 LEU 24 -2.283 3.379 -6.958
173 HD23 LEU 24 3HD2 LEU 24 -1.996 5.084 -6.549
174 H GLU 25 H GLU 25 -4.841 4.285 -9.831
175 HA GLU 25 HA GLU 25 -6.951 5.761 -10.903
176 HB2 GLU 25 2HB GLU 25 -6.299 6.080 -13.166
177 HB3 GLU 25 3HB GLU 25 -5.052 6.829 -12.161
178 HG2 GLU 25 2HG GLU 25 -3.580 4.877 -12.512
179 HG3 GLU 25 3HG GLU 25 -4.824 4.103 -13.509
180 H GLU 26 H GLU 26 -7.914 4.424 -12.838
181 HA GLU 26 HA GLU 26 -8.465 1.842 -11.899
182 HB2 GLU 26 2HB GLU 26 -9.978 3.106 -13.344
183 HB3 GLU 26 3HB GLU 26 -8.813 3.067 -14.663
184 HG2 GLU 26 2HG GLU 26 -9.679 1.137 -15.401
185 HG3 GLU 26 3HG GLU 26 -9.229 0.332 -13.903
186 H GLY 27 H GLY 27 -6.953 0.286 -11.688
187 HA2 GLY 27 2HA GLY 27 -5.795 -1.558 -12.555
188 HA3 GLY 27 3HA GLY 27 -5.812 -0.811 -14.159
189 H GLU 28 H GLU 28 -4.659 1.261 -11.555
190 HA GLU 28 HA GLU 28 -2.065 1.405 -12.712
191 HB2 GLU 28 2HB GLU 28 -3.443 3.075 -11.199
192 HB3 GLU 28 3HB GLU 28 -2.671 2.231 -9.862
193 HG2 GLU 28 2HG GLU 28 -0.434 2.796 -10.915
194 HG3 GLU 28 3HG GLU 28 -1.293 3.642 -12.205
195 H ASP 29 H ASP 29 -0.071 0.953 -11.532
196 HA ASP 29 HA ASP 29 0.290 -1.684 -10.550
197 HB2 ASP 29 2HB ASP 29 1.884 0.862 -10.334
198 HB3 ASP 29 3HB ASP 29 2.460 -0.638 -9.639
199 H VAL 30 H VAL 30 -1.037 -2.201 -8.865
200 HA VAL 30 HA VAL 30 -0.335 -1.041 -6.247
201 HB VAL 30 HB VAL 30 -2.646 -1.079 -5.496
202 HG11 VAL 30 1HG1 VAL 30 -2.407 0.536 -8.061
203 HG12 VAL 30 2HG1 VAL 30 -3.470 0.856 -6.691
204 HG13 VAL 30 3HG1 VAL 30 -1.715 0.993 -6.487
205 HG21 VAL 30 1HG2 VAL 30 -3.406 -1.796 -8.361
206 HG22 VAL 30 2HG2 VAL 30 -3.635 -2.817 -6.926
207 HG23 VAL 30 3HG2 VAL 30 -4.533 -1.299 -7.091
208 H ARG 31 H ARG 31 -0.542 -2.545 -4.536
209 HA ARG 31 HA ARG 31 -0.694 -5.369 -5.368
210 HB2 ARG 31 2HB ARG 31 1.455 -3.844 -3.888
211 HB3 ARG 31 3HB ARG 31 1.190 -5.523 -3.421
212 HG2 ARG 31 2HG ARG 31 1.529 -4.861 -6.345
213 HG3 ARG 31 3HG ARG 31 2.959 -4.898 -5.307
214 HD2 ARG 31 2HD ARG 31 1.026 -7.208 -5.154
215 HD3 ARG 31 3HD ARG 31 2.072 -7.098 -6.562
216 HE ARG 31 HE ARG 31 2.839 -7.711 -3.807
217 HH11 ARG 31 1HH1 ARG 31 6.213 -8.224 -4.731
218 HH12 ARG 31 2HH1 ARG 31 5.046 -8.449 -3.481
219 HH21 ARG 31 1HH2 ARG 31 5.606 -7.198 -6.771
220 HH22 ARG 31 2HH2 ARG 31 3.996 -6.631 -6.967
221 H ARG 32 H ARG 32 -0.965 -6.721 -3.254
222 HA ARG 32 HA ARG 32 -2.704 -5.253 -1.362
223 HB2 ARG 32 2HB ARG 32 -4.212 -6.408 -2.856
224 HB3 ARG 32 3HB ARG 32 -3.185 -7.847 -2.892
225 HG2 ARG 32 2HG ARG 32 -5.161 -8.283 -1.541
226 HG3 ARG 32 3HG ARG 32 -3.718 -8.349 -0.547
227 HD2 ARG 32 2HD ARG 32 -4.968 -7.020 0.835
228 HD3 ARG 32 3HD ARG 32 -4.299 -5.754 -0.142
229 HE ARG 32 HE ARG 32 -6.351 -5.334 -1.079
230 HH11 ARG 32 1HH1 ARG 32 -9.449 -6.968 -0.580
231 HH12 ARG 32 2HH1 ARG 32 -8.668 -5.593 -1.264
232 HH21 ARG 32 1HH2 ARG 32 -8.161 -8.612 0.556
233 HH22 ARG 32 2HH2 ARG 32 -6.449 -8.405 0.661
234 H LEU 33 H LEU 33 -2.473 -5.928 0.778
235 HA LEU 33 HA LEU 33 -0.439 -8.005 1.313
236 HB2 LEU 33 2HB LEU 33 -0.742 -6.235 3.543
237 HB3 LEU 33 3HB LEU 33 0.698 -6.537 2.577
238 HG LEU 33 HG LEU 33 -1.439 -4.521 1.827
239 HD11 LEU 33 1HD1 LEU 33 0.022 -2.809 2.784
240 HD12 LEU 33 2HD1 LEU 33 -0.458 -3.954 4.039
241 HD13 LEU 33 3HD1 LEU 33 1.169 -4.045 3.346
242 HD21 LEU 33 1HD2 LEU 33 0.387 -3.524 0.463
243 HD22 LEU 33 2HD2 LEU 33 1.548 -4.708 1.108
244 HD23 LEU 33 3HD2 LEU 33 0.276 -5.228 0.012
245 HA PRO 34 HA PRO 34 -3.283 -10.340 3.445
246 HB2 PRO 34 2HB PRO 34 -2.256 -10.811 6.003
247 HB3 PRO 34 3HB PRO 34 -1.755 -11.641 4.500
248 HG2 PRO 34 2HG PRO 34 -0.396 -9.368 5.932
249 HG3 PRO 34 3HG PRO 34 0.314 -10.762 5.060
250 HD2 PRO 34 2HD PRO 34 0.092 -8.202 4.054
251 HD3 PRO 34 3HD PRO 34 0.160 -9.628 3.004
252 H CYS 35 H CYS 35 -2.232 -7.546 5.407
253 HA CYS 35 HA CYS 35 -4.734 -7.331 6.979
254 HB2 CYS 35 2HB CYS 35 -3.629 -5.326 7.755
255 HB3 CYS 35 3HB CYS 35 -2.505 -6.694 7.832
256 H MET 36 H MET 36 -5.057 -7.394 4.009
257 HA MET 36 HA MET 36 -6.161 -6.337 2.384
258 HB2 MET 36 2HB MET 36 -8.424 -5.652 3.072
259 HB3 MET 36 3HB MET 36 -7.914 -7.159 3.838
260 HG2 MET 36 2HG MET 36 -7.392 -5.973 5.918
261 HG3 MET 36 3HG MET 36 -7.802 -4.425 5.175
262 HE1 MET 36 1HE MET 36 -9.271 -3.932 7.295
263 HE2 MET 36 2HE MET 36 -10.538 -5.028 7.899
264 HE3 MET 36 3HE MET 36 -8.831 -5.527 7.950
265 H HIS 37 H HIS 37 -4.058 -4.851 2.692
266 HA HIS 37 HA HIS 37 -5.124 -2.079 2.513
267 HB2 HIS 37 1HB HIS 37 -2.654 -3.256 3.715
268 HB3 HIS 37 2HB HIS 37 -2.429 -1.781 2.794
269 HD2 HIS 37 2HD HIS 37 -4.799 0.010 3.498
270 HE1 HIS 37 1HE HIS 37 -4.023 -0.672 7.622
271 HE2 HIS 37 2HE HIS 37 -5.216 0.832 5.945
272 H LEU 38 H LEU 38 -4.775 -0.946 0.619
273 HA LEU 38 HA LEU 38 -3.471 -2.402 -1.620
274 HB2 LEU 38 2HB LEU 38 -5.451 -2.105 -2.574
275 HB3 LEU 38 3HB LEU 38 -6.024 -0.944 -1.406
276 HG LEU 38 HG LEU 38 -4.031 -0.053 -3.523
277 HD11 LEU 38 1HD1 LEU 38 -5.883 0.440 -5.043
278 HD12 LEU 38 2HD1 LEU 38 -5.746 -1.295 -4.748
279 HD13 LEU 38 3HD1 LEU 38 -7.026 -0.355 -3.939
280 HD21 LEU 38 1HD2 LEU 38 -6.088 1.852 -3.188
281 HD22 LEU 38 2HD2 LEU 38 -5.816 1.249 -1.548
282 HD23 LEU 38 3HD2 LEU 38 -4.479 1.930 -2.470
283 H PHE 39 H PHE 39 -1.510 -1.636 -2.022
284 HA PHE 39 HA PHE 39 -0.817 1.198 -1.357
285 HB2 PHE 39 2HB PHE 39 0.725 -1.389 -0.887
286 HB3 PHE 39 3HB PHE 39 1.504 0.172 -0.913
287 HD1 PHE 39 1HD PHE 39 -1.643 0.575 0.864
288 HD2 PHE 39 2HD PHE 39 2.359 -0.915 1.272
289 HE1 PHE 39 1HE PHE 39 -1.878 0.628 3.291
290 HE2 PHE 39 2HE PHE 39 2.148 -0.793 3.729
291 HZ PHE 39 HZ PHE 39 0.010 -0.023 4.758
292 H HIS 40 H HIS 40 0.834 2.034 -2.971
293 HA HIS 40 HA HIS 40 0.566 0.976 -5.661
294 HB2 HIS 40 1HB HIS 40 2.601 2.745 -4.313
295 HB3 HIS 40 2HB HIS 40 2.921 2.157 -5.922
296 HD2 HIS 40 2HD HIS 40 0.708 2.776 -7.773
297 HE1 HIS 40 1HE HIS 40 0.539 6.673 -6.058
298 HE2 HIS 40 2HE HIS 40 -0.145 5.204 -8.070
299 H GLN 41 H GLN 41 2.206 -0.142 -6.898
300 HA GLN 41 HA GLN 41 3.618 -2.249 -5.600
301 HB2 GLN 41 2HB GLN 41 2.758 -2.069 -7.966
302 HB3 GLN 41 3HB GLN 41 4.171 -1.060 -8.341
303 HG2 GLN 41 2HG GLN 41 5.510 -2.879 -8.528
304 HG3 GLN 41 3HG GLN 41 4.936 -3.554 -6.999
305 HE21 GLN 41 1HE2 GLN 41 3.559 -3.017 -10.410
306 HE22 GLN 41 2HE2 GLN 41 2.811 -4.580 -10.410
307 H VAL 42 H VAL 42 4.777 0.943 -6.905
308 HA VAL 42 HA VAL 42 7.492 0.476 -6.090
309 HB VAL 42 HB VAL 42 6.024 3.090 -6.643
310 HG11 VAL 42 1HG1 VAL 42 8.053 3.557 -5.329
311 HG12 VAL 42 2HG1 VAL 42 9.009 2.488 -6.377
312 HG13 VAL 42 3HG1 VAL 42 8.333 4.004 -7.014
313 HG21 VAL 42 1HG2 VAL 42 6.096 1.565 -8.594
314 HG22 VAL 42 2HG2 VAL 42 7.200 2.924 -8.835
315 HG23 VAL 42 3HG2 VAL 42 7.843 1.340 -8.362
316 H CYS 43 H CYS 43 4.890 2.477 -4.513
317 HA CYS 43 HA CYS 43 6.404 3.204 -2.233
318 HB2 CYS 43 2HB CYS 43 3.440 2.580 -2.276
319 HB3 CYS 43 3HB CYS 43 4.326 3.601 -1.155
320 H VAL 44 H VAL 44 4.465 0.133 -2.756
321 HA VAL 44 HA VAL 44 5.006 -0.641 -0.103
322 HB VAL 44 HB VAL 44 3.041 -1.366 -1.492
323 HG11 VAL 44 1HG1 VAL 44 3.277 -3.386 -2.790
324 HG12 VAL 44 2HG1 VAL 44 4.382 -2.162 -3.441
325 HG13 VAL 44 3HG1 VAL 44 5.019 -3.474 -2.436
326 HG21 VAL 44 1HG2 VAL 44 4.580 -3.630 -0.196
327 HG22 VAL 44 2HG2 VAL 44 3.781 -2.363 0.726
328 HG23 VAL 44 3HG2 VAL 44 2.821 -3.429 -0.334
329 H ASP 45 H ASP 45 6.908 -0.924 -3.064
330 HA ASP 45 HA ASP 45 8.578 -3.112 -2.259
331 HB2 ASP 45 2HB ASP 45 8.838 -2.162 -4.486
332 HB3 ASP 45 3HB ASP 45 9.268 -0.584 -3.821
333 H GLN 46 H GLN 46 9.079 0.410 -1.854
334 HA GLN 46 HA GLN 46 11.155 0.034 0.077
335 HB2 GLN 46 2HB GLN 46 9.382 2.426 -0.604
336 HB3 GLN 46 3HB GLN 46 10.712 2.526 0.561
337 HG2 GLN 46 2HG GLN 46 11.041 1.660 -2.353
338 HG3 GLN 46 3HG GLN 46 11.345 3.288 -1.738
339 HE21 GLN 46 1HE2 GLN 46 12.693 0.050 -2.094
340 HE22 GLN 46 2HE2 GLN 46 14.176 0.437 -1.217
341 H ALA 47 H ALA 47 7.667 0.194 0.469
342 HA ALA 47 HA ALA 47 7.654 0.571 3.290
343 HB1 ALA 47 1HB ALA 47 5.785 -1.205 1.693
344 HB2 ALA 47 2HB ALA 47 5.447 -0.389 3.231
345 HB3 ALA 47 3HB ALA 47 5.661 0.578 1.749
346 H LEU 48 H LEU 48 7.562 -2.507 1.397
347 HA LEU 48 HA LEU 48 7.739 -4.218 3.552
348 HB2 LEU 48 2HB LEU 48 7.066 -4.650 1.165
349 HB3 LEU 48 3HB LEU 48 8.767 -4.716 0.722
350 HG LEU 48 HG LEU 48 7.486 -6.532 2.821
351 HD11 LEU 48 1HD1 LEU 48 6.339 -6.792 0.652
352 HD12 LEU 48 2HD1 LEU 48 7.906 -7.040 -0.152
353 HD13 LEU 48 3HD1 LEU 48 7.311 -8.221 1.038
354 HD21 LEU 48 1HD2 LEU 48 9.394 -8.057 2.191
355 HD22 LEU 48 2HD2 LEU 48 10.079 -6.739 1.219
356 HD23 LEU 48 3HD2 LEU 48 9.925 -6.589 2.984
357 H ILE 49 H ILE 49 10.453 -3.033 1.446
358 HA ILE 49 HA ILE 49 12.417 -4.505 2.873
359 HB ILE 49 HB ILE 49 14.069 -3.223 1.777
360 HG12 ILE 49 2HG1 ILE 49 12.983 -1.295 0.197
361 HG13 ILE 49 3HG1 ILE 49 12.081 -1.084 1.708
362 HG21 ILE 49 1HG2 ILE 49 11.779 -3.513 -0.183
363 HG22 ILE 49 2HG2 ILE 49 13.509 -3.575 -0.517
364 HG23 ILE 49 3HG2 ILE 49 12.752 -4.857 0.445
365 HD11 ILE 49 1HD1 ILE 49 14.230 -0.966 2.957
366 HD12 ILE 49 2HD1 ILE 49 15.107 -1.113 1.420
367 HD13 ILE 49 3HD1 ILE 49 14.086 0.308 1.729
368 H THR 50 H THR 50 10.966 -1.322 3.606
369 HA THR 50 HA THR 50 12.982 -0.720 5.589
370 HB THR 50 HB THR 50 10.214 0.444 5.073
371 HG1 THR 50 1HG THR 50 11.593 0.928 3.455
372 HG21 THR 50 1HG2 THR 50 12.460 1.461 6.871
373 HG22 THR 50 2HG2 THR 50 11.011 2.380 6.406
374 HG23 THR 50 3HG2 THR 50 10.849 0.930 7.409
375 H ASN 51 H ASN 51 9.616 -1.889 5.686
376 HA ASN 51 HA ASN 51 10.112 -3.623 7.912
377 HB2 ASN 51 2HB ASN 51 8.319 -2.715 9.361
378 HB3 ASN 51 3HB ASN 51 9.712 -1.649 9.224
379 HD21 ASN 51 1HD2 ASN 51 6.257 -2.005 8.387
380 HD22 ASN 51 2HD2 ASN 51 6.062 -0.300 8.023
381 H LYS 52 H LYS 52 9.498 -5.191 6.363
382 HA LYS 52 HA LYS 52 7.285 -5.614 4.922
383 HB2 LYS 52 2HB LYS 52 7.253 -7.981 5.709
384 HB3 LYS 52 3HB LYS 52 8.747 -7.329 5.052
385 HG2 LYS 52 2HG LYS 52 9.555 -6.984 7.468
386 HG3 LYS 52 3HG LYS 52 8.147 -7.949 7.975
387 HD2 LYS 52 2HD LYS 52 8.839 -9.793 6.598
388 HD3 LYS 52 3HD LYS 52 10.127 -8.830 5.852
389 HE2 LYS 52 2HE LYS 52 10.042 -9.614 8.786
390 HE3 LYS 52 3HE LYS 52 10.912 -10.497 7.511
391 HZ1 LYS 52 1HZ LYS 52 12.187 -8.544 7.057
392 HZ2 LYS 52 2HZ LYS 52 11.420 -7.684 8.236
393 HZ3 LYS 52 3HZ LYS 52 12.374 -8.969 8.637
394 H LYS 53 H LYS 53 7.091 -6.223 8.439
395 HA LYS 53 HA LYS 53 4.342 -6.620 8.383
396 HB2 LYS 53 2HB LYS 53 6.069 -5.419 10.614
397 HB3 LYS 53 3HB LYS 53 4.428 -6.024 10.880
398 HG2 LYS 53 2HG LYS 53 5.058 -8.277 10.533
399 HG3 LYS 53 3HG LYS 53 6.528 -7.842 9.673
400 HD2 LYS 53 2HD LYS 53 7.618 -8.290 11.541
401 HD3 LYS 53 3HD LYS 53 7.036 -6.748 12.162
402 HE2 LYS 53 2HE LYS 53 5.726 -9.487 12.504
403 HE3 LYS 53 3HE LYS 53 6.664 -8.626 13.732
404 HZ1 LYS 53 1HZ LYS 53 4.089 -7.721 12.589
405 HZ2 LYS 53 2HZ LYS 53 4.318 -8.321 14.090
406 HZ3 LYS 53 3HZ LYS 53 4.974 -6.873 13.668
407 H CYS 54 H CYS 54 2.694 -5.426 8.006
408 HA CYS 54 HA CYS 54 2.953 -3.048 6.639
409 HB2 CYS 54 2HB CYS 54 1.128 -4.389 6.160
410 HB3 CYS 54 3HB CYS 54 0.680 -4.586 7.852
411 HA PRO 55 HA PRO 55 3.592 -0.031 9.659
412 HB2 PRO 55 2HB PRO 55 2.920 2.289 8.315
413 HB3 PRO 55 3HB PRO 55 4.363 1.296 7.946
414 HG2 PRO 55 2HG PRO 55 1.672 1.244 6.551
415 HG3 PRO 55 3HG PRO 55 3.302 1.311 5.815
416 HD2 PRO 55 2HD PRO 55 1.970 -1.034 6.067
417 HD3 PRO 55 3HD PRO 55 3.737 -0.949 6.336
418 H ILE 56 H ILE 56 0.384 0.533 8.047
419 HA ILE 56 HA ILE 56 -0.556 1.760 10.586
420 HB ILE 56 HB ILE 56 -0.868 3.147 8.706
421 HG12 ILE 56 2HG1 ILE 56 -3.611 1.996 9.358
422 HG13 ILE 56 3HG1 ILE 56 -2.648 3.002 10.445
423 HG21 ILE 56 1HG2 ILE 56 -0.736 1.812 6.795
424 HG22 ILE 56 2HG2 ILE 56 -2.044 0.740 7.321
425 HG23 ILE 56 3HG2 ILE 56 -2.396 2.389 6.767
426 HD11 ILE 56 1HD1 ILE 56 -3.823 3.776 7.751
427 HD12 ILE 56 2HD1 ILE 56 -4.220 4.418 9.348
428 HD13 ILE 56 3HD1 ILE 56 -2.638 4.779 8.627
429 H CYS 57 H CYS 57 -0.118 -0.568 11.237
430 HA CYS 57 HA CYS 57 -2.257 -2.101 12.129
431 HB2 CYS 57 2HB CYS 57 -2.243 -3.985 10.425
432 HB3 CYS 57 3HB CYS 57 -3.117 -2.544 9.994
433 H ARG 58 H ARG 58 -0.682 -4.628 11.354
434 HA ARG 58 HA ARG 58 1.954 -4.051 12.488
435 HB2 ARG 58 2HB ARG 58 -0.137 -4.310 14.325
436 HB3 ARG 58 3HB ARG 58 0.432 -5.956 14.223
437 HG2 ARG 58 2HG ARG 58 1.753 -5.206 15.919
438 HG3 ARG 58 3HG ARG 58 2.837 -4.806 14.577
439 HD2 ARG 58 2HD ARG 58 2.149 -2.474 14.648
440 HD3 ARG 58 3HD ARG 58 0.783 -2.868 15.709
441 HE ARG 58 HE ARG 58 3.394 -3.544 16.809
442 HH11 ARG 58 1HH1 ARG 58 3.046 -1.155 19.378
443 HH12 ARG 58 2HH1 ARG 58 3.894 -2.563 18.862
444 HH21 ARG 58 1HH2 ARG 58 1.318 -0.250 18.023
445 HH22 ARG 58 2HH2 ARG 58 0.990 -0.989 16.494
446 H VAL 59 H VAL 59 0.340 -5.938 10.315
447 HA VAL 59 HA VAL 59 1.175 -8.582 11.394
448 HB VAL 59 HB VAL 59 -0.749 -7.936 9.121
449 HG11 VAL 59 1HG1 VAL 59 0.076 -10.268 9.186
450 HG12 VAL 59 2HG1 VAL 59 -0.397 -10.397 10.899
451 HG13 VAL 59 3HG1 VAL 59 -1.629 -10.199 9.637
452 HG21 VAL 59 1HG2 VAL 59 -1.685 -6.856 11.107
453 HG22 VAL 59 2HG2 VAL 59 -2.575 -8.344 10.801
454 HG23 VAL 59 3HG2 VAL 59 -1.355 -8.302 12.090
455 H ASP 60 H ASP 60 2.392 -9.995 10.141
456 HA ASP 60 HA ASP 60 4.232 -8.593 8.390
457 HB2 ASP 60 2HB ASP 60 4.719 -10.534 10.066
458 HB3 ASP 60 3HB ASP 60 4.217 -11.555 8.728
459 H ILE 61 H ILE 61 4.508 -8.917 6.265
460 HA ILE 61 HA ILE 61 2.174 -9.948 4.739
461 HB ILE 61 HB ILE 61 2.413 -8.097 3.292
462 HG12 ILE 61 2HG1 ILE 61 4.923 -7.332 4.848
463 HG13 ILE 61 3HG1 ILE 61 4.944 -8.049 3.278
464 HG21 ILE 61 1HG2 ILE 61 1.437 -7.713 5.718
465 HG22 ILE 61 2HG2 ILE 61 2.925 -6.789 5.989
466 HG23 ILE 61 3HG2 ILE 61 1.786 -6.298 4.713
467 HD11 ILE 61 1HD1 ILE 61 3.542 -6.244 2.372
468 HD12 ILE 61 2HD1 ILE 61 3.698 -5.386 3.923
469 HD13 ILE 61 3HD1 ILE 61 5.154 -5.698 2.944
470 H GLU 62 H GLU 62 5.544 -10.217 5.241
471 HA GLU 62 HA GLU 62 6.448 -10.920 2.660
472 HB2 GLU 62 2HB GLU 62 7.712 -10.203 4.681
473 HB3 GLU 62 3HB GLU 62 7.496 -11.805 5.387
474 HG2 GLU 62 2HG GLU 62 8.935 -12.797 3.758
475 HG3 GLU 62 3HG GLU 62 8.717 -11.450 2.632
476 H ALA 63 H ALA 63 4.867 -12.189 1.759
477 HA ALA 63 HA ALA 63 3.726 -13.926 1.068
478 HB1 ALA 63 1HB ALA 63 5.867 -15.153 1.257
479 HB2 ALA 63 2HB ALA 63 5.386 -15.697 2.878
480 HB3 ALA 63 3HB ALA 63 4.433 -16.186 1.455
481 H GLN 64 H GLN 64 2.324 -15.884 2.059
482 HA GLN 64 HA GLN 64 0.864 -14.674 4.369
483 HB2 GLN 64 2HB GLN 64 -0.256 -16.081 1.907
484 HB3 GLN 64 3HB GLN 64 -1.177 -15.467 3.281
485 HG2 GLN 64 2HG GLN 64 -1.439 -13.646 1.985
486 HG3 GLN 64 3HG GLN 64 0.132 -13.184 2.637
487 HE21 GLN 64 1HE2 GLN 64 -1.604 -13.345 -0.213
488 HE22 GLN 64 2HE2 GLN 64 -0.251 -13.562 -1.314
489 H LEU 65 H LEU 65 2.475 -16.163 5.503
490 HA LEU 65 HA LEU 65 0.879 -18.503 6.284
491 HB2 LEU 65 2HB LEU 65 2.872 -19.984 6.348
492 HB3 LEU 65 3HB LEU 65 2.275 -19.630 4.738
493 HG LEU 65 HG LEU 65 4.412 -17.756 5.641
494 HD11 LEU 65 1HD1 LEU 65 5.036 -20.707 5.183
495 HD12 LEU 65 2HD1 LEU 65 6.229 -19.392 5.304
496 HD13 LEU 65 3HD1 LEU 65 5.239 -19.811 6.708
497 HD21 LEU 65 1HD2 LEU 65 5.249 -18.188 3.382
498 HD22 LEU 65 2HD2 LEU 65 4.093 -19.521 3.174
499 HD23 LEU 65 3HD2 LEU 65 3.509 -17.851 3.321
500 HA PRO 66 HA PRO 66 2.877 -15.874 9.528
501 HB2 PRO 66 2HB PRO 66 0.667 -15.138 10.964
502 HB3 PRO 66 3HB PRO 66 1.147 -14.333 9.438
503 HG2 PRO 66 2HG PRO 66 -0.901 -16.550 9.794
504 HG3 PRO 66 3HG PRO 66 -1.093 -14.997 8.917
505 HD2 PRO 66 2HD PRO 66 -0.442 -17.305 7.623
506 HD3 PRO 66 3HD PRO 66 0.261 -15.734 7.130
507 H SER 67 H SER 67 3.907 -17.829 10.307
508 HA SER 67 HA SER 67 2.728 -18.602 12.875
509 HB2 SER 67 2HB SER 67 1.968 -20.299 11.086
510 HB3 SER 67 3HB SER 67 3.675 -20.747 10.924
511 HG SER 67 HG SER 67 1.987 -20.938 13.198
512 H GLU 68 H GLU 68 4.417 -18.190 14.257
513 HA GLU 68 HA GLU 68 6.456 -17.562 14.951
514 HB2 GLU 68 2HB GLU 68 6.907 -20.305 13.783
515 HB3 GLU 68 3HB GLU 68 8.260 -19.423 14.500
516 HG2 GLU 68 2HG GLU 68 5.654 -19.814 16.010
517 HG3 GLU 68 3HG GLU 68 6.944 -21.020 16.022
518 H SER 69 H SER 69 8.063 -19.070 12.135
519 HA SER 69 HA SER 69 8.492 -16.622 10.723
520 HB2 SER 69 2HB SER 69 10.762 -17.894 12.326
521 HB3 SER 69 3HB SER 69 11.009 -16.772 10.974
522 HG SER 69 HG SER 69 9.247 -15.918 12.930
Start of MODEL 29
1 H1 MET 1 H1 MET 1 8.177 4.116 -29.157
2 H2 MET 1 H2 MET 1 7.171 3.150 -30.036
3 H3 MET 1 H3 MET 1 7.069 3.161 -28.396
4 HA MET 1 HA MET 1 8.159 1.182 -29.088
5 HB2 MET 1 2HB MET 1 10.113 1.199 -30.466
6 HB3 MET 1 3HB MET 1 8.874 2.166 -31.262
7 HG2 MET 1 2HG MET 1 10.158 4.139 -29.875
8 HG3 MET 1 3HG MET 1 11.480 2.991 -30.054
9 HE1 MET 1 1HE MET 1 9.716 5.947 -31.466
10 HE2 MET 1 2HE MET 1 9.628 5.709 -33.223
11 HE3 MET 1 3HE MET 1 8.576 4.758 -32.150
12 H LYS 2 H LYS 2 8.022 2.799 -26.603
13 HA LYS 2 HA LYS 2 10.434 1.869 -25.407
14 HB2 LYS 2 2HB LYS 2 10.761 4.366 -26.476
15 HB3 LYS 2 3HB LYS 2 10.003 4.821 -24.949
16 HG2 LYS 2 2HG LYS 2 11.767 3.577 -23.715
17 HG3 LYS 2 3HG LYS 2 12.459 3.028 -25.255
18 HD2 LYS 2 2HD LYS 2 13.035 5.281 -25.899
19 HD3 LYS 2 3HD LYS 2 12.211 5.971 -24.489
20 HE2 LYS 2 2HE LYS 2 14.354 3.881 -24.067
21 HE3 LYS 2 3HE LYS 2 14.860 5.515 -24.516
22 HZ1 LYS 2 1HZ LYS 2 13.758 6.384 -22.614
23 HZ2 LYS 2 2HZ LYS 2 13.116 4.925 -22.209
24 HZ3 LYS 2 3HZ LYS 2 14.742 5.168 -22.112
25 H GLN 3 H GLN 3 10.184 2.565 -22.904
26 HA GLN 3 HA GLN 3 7.369 2.354 -22.108
27 HB2 GLN 3 2HB GLN 3 10.031 2.406 -20.725
28 HB3 GLN 3 3HB GLN 3 8.757 3.276 -19.893
29 HG2 GLN 3 2HG GLN 3 7.501 0.860 -20.622
30 HG3 GLN 3 3HG GLN 3 9.138 0.385 -20.168
31 HE21 GLN 3 1HE2 GLN 3 6.001 1.221 -18.946
32 HE22 GLN 3 2HE2 GLN 3 6.513 1.468 -17.289
33 H ASP 4 H ASP 4 6.500 4.104 -20.616
34 HA ASP 4 HA ASP 4 7.309 6.819 -21.318
35 HB2 ASP 4 2HB ASP 4 5.453 5.768 -22.923
36 HB3 ASP 4 3HB ASP 4 4.387 6.047 -21.542
37 H GLY 5 H GLY 5 5.778 8.312 -19.754
38 HA2 GLY 5 2HA GLY 5 4.914 6.924 -17.336
39 HA3 GLY 5 3HA GLY 5 6.469 7.760 -17.168
40 H GLU 6 H GLU 6 4.291 8.574 -15.586
41 HA GLU 6 HA GLU 6 3.888 11.288 -16.533
42 HB2 GLU 6 2HB GLU 6 1.517 11.255 -16.456
43 HB3 GLU 6 3HB GLU 6 1.978 9.884 -17.448
44 HG2 GLU 6 2HG GLU 6 0.482 8.763 -16.165
45 HG3 GLU 6 3HG GLU 6 1.826 8.609 -15.040
46 H GLU 7 H GLU 7 2.623 12.471 -14.580
47 HA GLU 7 HA GLU 7 2.663 11.051 -12.107
48 HB2 GLU 7 2HB GLU 7 5.052 11.711 -12.179
49 HB3 GLU 7 3HB GLU 7 4.593 13.407 -12.384
50 HG2 GLU 7 2HG GLU 7 3.547 13.430 -10.168
51 HG3 GLU 7 3HG GLU 7 3.738 11.679 -10.019
52 H GLY 8 H GLY 8 0.467 11.576 -11.913
53 HA2 GLY 8 2HA GLY 8 -0.050 14.374 -11.095
54 HA3 GLY 8 3HA GLY 8 -1.024 13.700 -12.420
55 H THR 9 H THR 9 -1.816 14.508 -9.581
56 HA THR 9 HA THR 9 -3.252 12.014 -8.914
57 HB THR 9 HB THR 9 -2.657 12.396 -6.480
58 HG1 THR 9 1HG THR 9 -1.759 14.497 -6.865
59 HG21 THR 9 1HG2 THR 9 -1.650 10.569 -7.830
60 HG22 THR 9 2HG2 THR 9 -0.295 11.648 -8.243
61 HG23 THR 9 3HG2 THR 9 -0.564 11.187 -6.558
62 H GLU 10 H GLU 10 -5.308 12.872 -9.274
63 HA GLU 10 HA GLU 10 -6.256 14.915 -7.480
64 HB2 GLU 10 2HB GLU 10 -6.931 16.512 -9.231
65 HB3 GLU 10 3HB GLU 10 -5.182 16.340 -9.145
66 HG2 GLU 10 2HG GLU 10 -5.510 14.566 -11.086
67 HG3 GLU 10 3HG GLU 10 -7.074 15.360 -11.292
68 H GLU 11 H GLU 11 -8.614 15.145 -7.715
69 HA GLU 11 HA GLU 11 -10.573 14.081 -7.464
70 HB2 GLU 11 2HB GLU 11 -9.931 13.394 -10.314
71 HB3 GLU 11 3HB GLU 11 -11.289 12.576 -9.535
72 HG2 GLU 11 2HG GLU 11 -12.187 14.782 -8.797
73 HG3 GLU 11 3HG GLU 11 -10.902 15.592 -9.699
74 H ASP 12 H ASP 12 -11.679 11.759 -7.707
75 HA ASP 12 HA ASP 12 -11.988 9.848 -6.681
76 HB2 ASP 12 2HB ASP 12 -10.476 9.193 -8.464
77 HB3 ASP 12 3HB ASP 12 -9.116 9.285 -7.376
78 H THR 13 H THR 13 -12.198 9.040 -4.712
79 HA THR 13 HA THR 13 -10.091 9.390 -2.704
80 HB THR 13 HB THR 13 -12.694 10.902 -2.616
81 HG1 THR 13 1HG THR 13 -10.560 11.721 -3.185
82 HG21 THR 13 1HG2 THR 13 -12.248 11.486 -0.221
83 HG22 THR 13 2HG2 THR 13 -12.877 9.850 -0.451
84 HG23 THR 13 3HG2 THR 13 -11.147 10.097 -0.123
85 H GLU 14 H GLU 14 -11.757 7.239 -4.251
86 HA GLU 14 HA GLU 14 -13.119 5.839 -2.062
87 HB2 GLU 14 2HB GLU 14 -12.636 5.403 -5.033
88 HB3 GLU 14 3HB GLU 14 -13.181 4.087 -3.993
89 HG2 GLU 14 2HG GLU 14 -15.118 5.201 -5.060
90 HG3 GLU 14 3HG GLU 14 -15.163 5.349 -3.305
91 H GLU 15 H GLU 15 -10.192 5.683 -4.188
92 HA GLU 15 HA GLU 15 -8.992 4.038 -2.044
93 HB2 GLU 15 2HB GLU 15 -7.965 2.546 -3.654
94 HB3 GLU 15 3HB GLU 15 -9.705 2.387 -3.529
95 HG2 GLU 15 2HG GLU 15 -10.100 3.440 -5.639
96 HG3 GLU 15 3HG GLU 15 -8.439 3.999 -5.772
97 H LYS 16 H LYS 16 -7.374 4.977 -1.297
98 HA LYS 16 HA LYS 16 -5.422 6.278 -3.088
99 HB2 LYS 16 2HB LYS 16 -5.018 8.027 -1.322
100 HB3 LYS 16 3HB LYS 16 -6.497 8.198 -2.287
101 HG2 LYS 16 2HG LYS 16 -7.906 7.594 -0.599
102 HG3 LYS 16 3HG LYS 16 -6.643 6.748 0.322
103 HD2 LYS 16 2HD LYS 16 -7.125 8.788 1.520
104 HD3 LYS 16 3HD LYS 16 -5.537 8.936 0.771
105 HE2 LYS 16 2HE LYS 16 -6.401 10.976 0.156
106 HE3 LYS 16 3HE LYS 16 -6.919 10.014 -1.235
107 HZ1 LYS 16 1HZ LYS 16 -8.562 10.765 1.095
108 HZ2 LYS 16 2HZ LYS 16 -8.753 11.287 -0.456
109 HZ3 LYS 16 3HZ LYS 16 -9.062 9.723 -0.080
110 H CYS 17 H CYS 17 -3.346 6.129 -2.425
111 HA CYS 17 HA CYS 17 -2.333 3.864 -0.844
112 HB2 CYS 17 2HB CYS 17 -1.393 5.021 -2.925
113 HB3 CYS 17 3HB CYS 17 -1.142 6.430 -1.926
114 H THR 18 H THR 18 -1.177 4.154 1.139
115 HA THR 18 HA THR 18 -1.972 6.591 2.669
116 HB THR 18 HB THR 18 -2.949 4.439 3.411
117 HG1 THR 18 1HG THR 18 -1.283 5.994 5.087
118 HG21 THR 18 1HG2 THR 18 -0.865 3.093 2.997
119 HG22 THR 18 2HG2 THR 18 -0.122 3.876 4.403
120 HG23 THR 18 3HG2 THR 18 -1.571 2.880 4.626
121 H ILE 19 H ILE 19 0.794 5.020 1.313
122 HA ILE 19 HA ILE 19 2.673 5.889 3.363
123 HB ILE 19 HB ILE 19 2.748 4.513 0.683
124 HG12 ILE 19 2HG1 ILE 19 3.931 3.456 3.247
125 HG13 ILE 19 3HG1 ILE 19 2.170 3.438 3.054
126 HG21 ILE 19 1HG2 ILE 19 5.142 5.404 2.343
127 HG22 ILE 19 2HG2 ILE 19 5.225 4.177 1.058
128 HG23 ILE 19 3HG2 ILE 19 4.783 5.828 0.650
129 HD11 ILE 19 1HD1 ILE 19 2.278 2.149 1.060
130 HD12 ILE 19 2HD1 ILE 19 4.038 2.311 0.941
131 HD13 ILE 19 3HD1 ILE 19 3.342 1.361 2.263
132 H CYS 20 H CYS 20 2.414 6.496 -0.190
133 HA CYS 20 HA CYS 20 3.592 9.221 0.136
134 HB2 CYS 20 2HB CYS 20 3.147 9.013 -2.476
135 HB3 CYS 20 3HB CYS 20 4.573 8.428 -1.669
136 H LEU 21 H LEU 21 0.617 8.148 0.871
137 HA LEU 21 HA LEU 21 -1.477 8.715 0.617
138 HB2 LEU 21 2HB LEU 21 -0.113 11.372 1.093
139 HB3 LEU 21 3HB LEU 21 -1.865 11.172 1.216
140 HG LEU 21 HG LEU 21 0.069 9.443 2.805
141 HD11 LEU 21 1HD1 LEU 21 -0.434 10.917 4.720
142 HD12 LEU 21 2HD1 LEU 21 0.421 11.787 3.432
143 HD13 LEU 21 3HD1 LEU 21 -1.332 12.015 3.643
144 HD21 LEU 21 1HD2 LEU 21 -2.869 10.125 3.272
145 HD22 LEU 21 2HD2 LEU 21 -2.315 8.649 2.475
146 HD23 LEU 21 3HD2 LEU 21 -1.875 8.944 4.160
147 H SER 22 H SER 22 -0.028 8.722 -2.017
148 HA SER 22 HA SER 22 -1.356 10.608 -3.707
149 HB2 SER 22 2HB SER 22 -0.232 7.876 -4.361
150 HB3 SER 22 3HB SER 22 -0.245 9.300 -5.427
151 HG SER 22 HG SER 22 1.199 10.190 -3.680
152 H ILE 23 H ILE 23 -3.586 10.427 -4.368
153 HA ILE 23 HA ILE 23 -5.228 8.212 -3.964
154 HB ILE 23 HB ILE 23 -5.016 10.528 -5.922
155 HG12 ILE 23 2HG1 ILE 23 -6.804 11.489 -4.692
156 HG13 ILE 23 3HG1 ILE 23 -7.092 9.991 -3.795
157 HG21 ILE 23 1HG2 ILE 23 -7.213 8.420 -5.797
158 HG22 ILE 23 2HG2 ILE 23 -7.365 10.037 -6.516
159 HG23 ILE 23 3HG2 ILE 23 -6.218 8.913 -7.185
160 HD11 ILE 23 1HD1 ILE 23 -6.107 11.771 -2.415
161 HD12 ILE 23 2HD1 ILE 23 -5.092 10.326 -2.482
162 HD13 ILE 23 3HD1 ILE 23 -4.668 11.779 -3.444
163 H LEU 24 H LEU 24 -5.904 6.688 -5.556
164 HA LEU 24 HA LEU 24 -3.759 5.764 -7.383
165 HB2 LEU 24 2HB LEU 24 -6.204 4.318 -6.260
166 HB3 LEU 24 3HB LEU 24 -4.840 3.563 -7.098
167 HG LEU 24 HG LEU 24 -4.592 5.031 -4.439
168 HD11 LEU 24 1HD1 LEU 24 -5.908 3.024 -4.239
169 HD12 LEU 24 2HD1 LEU 24 -4.647 2.109 -5.066
170 HD13 LEU 24 3HD1 LEU 24 -4.309 2.864 -3.460
171 HD21 LEU 24 1HD2 LEU 24 -2.563 5.149 -5.585
172 HD22 LEU 24 2HD2 LEU 24 -2.390 3.770 -4.455
173 HD23 LEU 24 3HD2 LEU 24 -2.692 3.476 -6.181
174 H GLU 25 H GLU 25 -5.676 4.059 -8.813
175 HA GLU 25 HA GLU 25 -7.827 5.718 -9.670
176 HB2 GLU 25 2HB GLU 25 -7.375 5.798 -12.042
177 HB3 GLU 25 3HB GLU 25 -6.069 6.603 -11.163
178 HG2 GLU 25 2HG GLU 25 -4.559 4.778 -11.521
179 HG3 GLU 25 3HG GLU 25 -5.850 3.724 -12.128
180 H GLU 26 H GLU 26 -9.057 4.451 -11.533
181 HA GLU 26 HA GLU 26 -9.689 1.833 -10.619
182 HB2 GLU 26 2HB GLU 26 -11.280 3.343 -11.732
183 HB3 GLU 26 3HB GLU 26 -10.314 3.331 -13.201
184 HG2 GLU 26 2HG GLU 26 -12.237 1.915 -13.507
185 HG3 GLU 26 3HG GLU 26 -10.804 0.898 -13.502
186 H GLY 27 H GLY 27 -7.817 0.584 -10.596
187 HA2 GLY 27 2HA GLY 27 -7.115 -1.435 -11.689
188 HA3 GLY 27 3HA GLY 27 -7.244 -0.632 -13.255
189 H GLU 28 H GLU 28 -5.523 0.931 -10.522
190 HA GLU 28 HA GLU 28 -3.185 1.142 -12.168
191 HB2 GLU 28 2HB GLU 28 -4.162 2.811 -10.497
192 HB3 GLU 28 3HB GLU 28 -3.485 1.801 -9.220
193 HG2 GLU 28 2HG GLU 28 -1.204 2.148 -10.183
194 HG3 GLU 28 3HG GLU 28 -1.909 3.113 -11.490
195 H ASP 29 H ASP 29 -1.016 0.578 -11.454
196 HA ASP 29 HA ASP 29 -0.670 -2.108 -10.487
197 HB2 ASP 29 2HB ASP 29 1.423 0.066 -10.813
198 HB3 ASP 29 3HB ASP 29 1.698 -1.651 -10.629
199 H VAL 30 H VAL 30 -1.405 -2.357 -8.466
200 HA VAL 30 HA VAL 30 0.037 -1.076 -6.232
201 HB VAL 30 HB VAL 30 -2.075 -0.985 -4.989
202 HG11 VAL 30 1HG1 VAL 30 -2.716 0.344 -7.618
203 HG12 VAL 30 2HG1 VAL 30 -2.939 0.941 -5.965
204 HG13 VAL 30 3HG1 VAL 30 -1.328 0.893 -6.683
205 HG21 VAL 30 1HG2 VAL 30 -3.354 -2.033 -7.553
206 HG22 VAL 30 2HG2 VAL 30 -3.342 -2.824 -5.960
207 HG23 VAL 30 3HG2 VAL 30 -4.240 -1.316 -6.222
208 H ARG 31 H ARG 31 -0.325 -2.566 -4.204
209 HA ARG 31 HA ARG 31 -0.696 -5.385 -4.955
210 HB2 ARG 31 2HB ARG 31 1.752 -4.135 -3.701
211 HB3 ARG 31 3HB ARG 31 1.261 -5.704 -3.109
212 HG2 ARG 31 2HG ARG 31 1.295 -5.589 -6.055
213 HG3 ARG 31 3HG ARG 31 2.859 -5.217 -5.354
214 HD2 ARG 31 2HD ARG 31 1.388 -7.665 -4.354
215 HD3 ARG 31 3HD ARG 31 2.139 -7.704 -5.957
216 HE ARG 31 HE ARG 31 4.042 -6.691 -4.150
217 HH11 ARG 31 1HH1 ARG 31 5.751 -9.717 -3.659
218 HH12 ARG 31 2HH1 ARG 31 5.877 -7.994 -3.593
219 HH21 ARG 31 1HH2 ARG 31 3.788 -10.779 -4.386
220 HH22 ARG 31 2HH2 ARG 31 2.447 -9.799 -4.847
221 H ARG 32 H ARG 32 -2.202 -6.203 -3.582
222 HA ARG 32 HA ARG 32 -3.072 -4.569 -1.263
223 HB2 ARG 32 2HB ARG 32 -4.602 -5.656 -3.075
224 HB3 ARG 32 3HB ARG 32 -4.265 -7.189 -2.275
225 HG2 ARG 32 2HG ARG 32 -5.490 -4.701 -0.986
226 HG3 ARG 32 3HG ARG 32 -6.367 -6.115 -1.558
227 HD2 ARG 32 2HD ARG 32 -4.618 -7.326 0.200
228 HD3 ARG 32 3HD ARG 32 -4.723 -5.753 0.915
229 HE ARG 32 HE ARG 32 -6.906 -6.019 1.453
230 HH11 ARG 32 1HH1 ARG 32 -9.148 -8.682 0.839
231 HH12 ARG 32 2HH1 ARG 32 -8.878 -7.221 1.720
232 HH21 ARG 32 1HH2 ARG 32 -7.447 -9.496 -0.627
233 HH22 ARG 32 2HH2 ARG 32 -5.967 -8.607 -0.738
234 H LEU 33 H LEU 33 -2.027 -4.889 0.507
235 HA LEU 33 HA LEU 33 -0.280 -7.206 0.885
236 HB2 LEU 33 2HB LEU 33 -0.032 -6.038 3.232
237 HB3 LEU 33 3HB LEU 33 0.757 -5.349 1.815
238 HG LEU 33 HG LEU 33 -2.027 -4.434 2.450
239 HD11 LEU 33 1HD1 LEU 33 0.380 -4.022 4.205
240 HD12 LEU 33 2HD1 LEU 33 -0.566 -2.586 3.848
241 HD13 LEU 33 3HD1 LEU 33 -1.357 -3.971 4.598
242 HD21 LEU 33 1HD2 LEU 33 -0.611 -3.560 0.453
243 HD22 LEU 33 2HD2 LEU 33 -1.165 -2.306 1.571
244 HD23 LEU 33 3HD2 LEU 33 0.504 -2.912 1.645
245 HA PRO 34 HA PRO 34 -3.137 -9.813 2.585
246 HB2 PRO 34 2HB PRO 34 -1.757 -11.345 4.403
247 HB3 PRO 34 3HB PRO 34 -1.470 -11.387 2.636
248 HG2 PRO 34 2HG PRO 34 0.082 -9.866 4.739
249 HG3 PRO 34 3HG PRO 34 0.709 -10.849 3.372
250 HD2 PRO 34 2HD PRO 34 0.473 -8.117 3.314
251 HD3 PRO 34 3HD PRO 34 0.343 -9.099 1.854
252 H CYS 35 H CYS 35 -1.684 -7.629 4.836
253 HA CYS 35 HA CYS 35 -3.236 -7.850 7.251
254 HB2 CYS 35 2HB CYS 35 -1.478 -6.320 7.236
255 HB3 CYS 35 3HB CYS 35 -1.907 -5.696 5.649
256 H MET 36 H MET 36 -3.963 -6.122 4.204
257 HA MET 36 HA MET 36 -6.471 -6.486 3.655
258 HB2 MET 36 2HB MET 36 -7.883 -4.764 4.825
259 HB3 MET 36 3HB MET 36 -7.529 -6.188 5.772
260 HG2 MET 36 2HG MET 36 -6.024 -5.017 7.183
261 HG3 MET 36 3HG MET 36 -5.817 -3.692 6.039
262 HE1 MET 36 1HE MET 36 -7.418 -2.294 9.406
263 HE2 MET 36 2HE MET 36 -6.591 -3.869 9.361
264 HE3 MET 36 3HE MET 36 -5.915 -2.490 8.475
265 H HIS 37 H HIS 37 -4.221 -3.912 4.468
266 HA HIS 37 HA HIS 37 -5.545 -1.887 2.949
267 HB2 HIS 37 1HB HIS 37 -2.703 -2.119 4.010
268 HB3 HIS 37 2HB HIS 37 -3.307 -0.692 3.180
269 HD2 HIS 37 2HD HIS 37 -5.599 0.454 4.275
270 HE1 HIS 37 1HE HIS 37 -4.530 -0.568 8.261
271 HE2 HIS 37 2HE HIS 37 -6.027 0.911 6.815
272 H LEU 38 H LEU 38 -4.279 -0.582 1.140
273 HA LEU 38 HA LEU 38 -3.193 -2.465 -0.874
274 HB2 LEU 38 2HB LEU 38 -5.613 -2.330 -1.171
275 HB3 LEU 38 3HB LEU 38 -5.573 -0.577 -1.136
276 HG LEU 38 HG LEU 38 -3.782 -1.793 -3.184
277 HD11 LEU 38 1HD1 LEU 38 -5.681 -2.338 -4.712
278 HD12 LEU 38 2HD1 LEU 38 -5.606 -3.423 -3.315
279 HD13 LEU 38 3HD1 LEU 38 -6.810 -2.111 -3.368
280 HD21 LEU 38 1HD2 LEU 38 -5.998 0.316 -3.229
281 HD22 LEU 38 2HD2 LEU 38 -4.256 0.623 -3.043
282 HD23 LEU 38 3HD2 LEU 38 -4.902 -0.034 -4.559
283 H PHE 39 H PHE 39 -1.311 -1.623 -1.587
284 HA PHE 39 HA PHE 39 -0.799 1.298 -1.192
285 HB2 PHE 39 2HB PHE 39 0.901 -1.176 -0.709
286 HB3 PHE 39 3HB PHE 39 1.589 0.426 -0.782
287 HD1 PHE 39 1HD PHE 39 2.455 -0.786 1.435
288 HD2 PHE 39 2HD PHE 39 -1.481 0.888 1.003
289 HE1 PHE 39 1HE PHE 39 2.216 -0.737 3.876
290 HE2 PHE 39 2HE PHE 39 -1.737 0.889 3.440
291 HZ PHE 39 HZ PHE 39 0.105 0.097 4.905
292 H HIS 40 H HIS 40 0.581 2.219 -2.863
293 HA HIS 40 HA HIS 40 0.374 1.183 -5.531
294 HB2 HIS 40 1HB HIS 40 2.268 3.077 -4.100
295 HB3 HIS 40 2HB HIS 40 2.628 2.593 -5.743
296 HD2 HIS 40 2HD HIS 40 0.336 2.892 -7.497
297 HE1 HIS 40 1HE HIS 40 -0.410 6.722 -5.892
298 HE2 HIS 40 2HE HIS 40 -0.847 5.165 -7.822
299 H GLN 41 H GLN 41 1.848 0.020 -6.844
300 HA GLN 41 HA GLN 41 3.472 -1.943 -5.567
301 HB2 GLN 41 2HB GLN 41 2.819 -1.078 -8.328
302 HB3 GLN 41 3HB GLN 41 4.449 -1.714 -8.181
303 HG2 GLN 41 2HG GLN 41 3.657 -3.735 -7.108
304 HG3 GLN 41 3HG GLN 41 2.007 -3.096 -7.006
305 HE21 GLN 41 1HE2 GLN 41 0.643 -4.086 -8.523
306 HE22 GLN 41 2HE2 GLN 41 1.193 -4.448 -10.160
307 H VAL 42 H VAL 42 4.169 1.398 -6.516
308 HA VAL 42 HA VAL 42 7.028 0.993 -6.067
309 HB VAL 42 HB VAL 42 5.433 3.529 -6.610
310 HG11 VAL 42 1HG1 VAL 42 8.444 3.003 -6.581
311 HG12 VAL 42 2HG1 VAL 42 7.675 4.477 -7.210
312 HG13 VAL 42 3HG1 VAL 42 7.555 4.088 -5.489
313 HG21 VAL 42 1HG2 VAL 42 5.373 1.930 -8.497
314 HG22 VAL 42 2HG2 VAL 42 6.440 3.282 -8.888
315 HG23 VAL 42 3HG2 VAL 42 7.134 1.724 -8.395
316 H CYS 43 H CYS 43 4.445 2.964 -4.341
317 HA CYS 43 HA CYS 43 6.050 3.743 -2.154
318 HB2 CYS 43 2HB CYS 43 3.128 2.948 -1.954
319 HB3 CYS 43 3HB CYS 43 4.062 4.007 -0.925
320 H VAL 44 H VAL 44 4.204 0.663 -2.554
321 HA VAL 44 HA VAL 44 4.756 -0.336 0.001
322 HB VAL 44 HB VAL 44 2.980 -1.079 -1.653
323 HG11 VAL 44 1HG1 VAL 44 3.510 -2.710 -3.261
324 HG12 VAL 44 2HG1 VAL 44 4.745 -1.447 -3.451
325 HG13 VAL 44 3HG1 VAL 44 5.162 -2.942 -2.601
326 HG21 VAL 44 1HG2 VAL 44 2.928 -3.387 -0.890
327 HG22 VAL 44 2HG2 VAL 44 4.630 -3.294 -0.387
328 HG23 VAL 44 3HG2 VAL 44 3.415 -2.337 0.453
329 H ASP 45 H ASP 45 6.819 -0.171 -2.861
330 HA ASP 45 HA ASP 45 8.451 -2.455 -2.309
331 HB2 ASP 45 2HB ASP 45 8.458 -1.231 -4.473
332 HB3 ASP 45 3HB ASP 45 9.196 0.169 -3.680
333 H GLN 46 H GLN 46 9.055 1.033 -1.685
334 HA GLN 46 HA GLN 46 11.168 0.441 0.189
335 HB2 GLN 46 2HB GLN 46 9.575 3.012 -0.208
336 HB3 GLN 46 3HB GLN 46 11.040 2.843 0.782
337 HG2 GLN 46 2HG GLN 46 12.219 1.952 -1.298
338 HG3 GLN 46 3HG GLN 46 10.810 2.470 -2.236
339 HE21 GLN 46 1HE2 GLN 46 13.636 3.444 -2.404
340 HE22 GLN 46 2HE2 GLN 46 13.520 5.164 -2.046
341 H ALA 47 H ALA 47 7.668 0.671 0.558
342 HA ALA 47 HA ALA 47 7.640 0.881 3.395
343 HB1 ALA 47 1HB ALA 47 5.680 0.922 1.804
344 HB2 ALA 47 2HB ALA 47 5.806 -0.850 1.704
345 HB3 ALA 47 3HB ALA 47 5.442 -0.080 3.261
346 H LEU 48 H LEU 48 7.654 -2.071 1.341
347 HA LEU 48 HA LEU 48 7.756 -3.969 3.358
348 HB2 LEU 48 2HB LEU 48 7.132 -4.248 0.976
349 HB3 LEU 48 3HB LEU 48 8.815 -4.102 0.488
350 HG LEU 48 HG LEU 48 7.924 -6.237 2.458
351 HD11 LEU 48 1HD1 LEU 48 7.844 -6.428 -0.578
352 HD12 LEU 48 2HD1 LEU 48 7.562 -7.765 0.562
353 HD13 LEU 48 3HD1 LEU 48 6.433 -6.405 0.501
354 HD21 LEU 48 1HD2 LEU 48 10.160 -6.134 0.371
355 HD22 LEU 48 2HD2 LEU 48 10.387 -6.018 2.127
356 HD23 LEU 48 3HD2 LEU 48 9.796 -7.521 1.417
357 H ILE 49 H ILE 49 10.517 -2.516 1.487
358 HA ILE 49 HA ILE 49 12.459 -4.076 2.878
359 HB ILE 49 HB ILE 49 14.130 -2.678 1.966
360 HG12 ILE 49 2HG1 ILE 49 13.127 -0.647 0.478
361 HG13 ILE 49 3HG1 ILE 49 12.059 -0.600 1.887
362 HG21 ILE 49 1HG2 ILE 49 11.915 -2.878 -0.097
363 HG22 ILE 49 2HG2 ILE 49 13.657 -2.842 -0.385
364 HG23 ILE 49 3HG2 ILE 49 12.931 -4.227 0.449
365 HD11 ILE 49 1HD1 ILE 49 15.086 -0.409 1.892
366 HD12 ILE 49 2HD1 ILE 49 13.920 0.878 2.275
367 HD13 ILE 49 3HD1 ILE 49 14.096 -0.512 3.363
368 H THR 50 H THR 50 10.989 -0.877 3.690
369 HA THR 50 HA THR 50 12.795 -0.394 5.820
370 HB THR 50 HB THR 50 10.038 0.650 5.096
371 HG1 THR 50 1HG THR 50 12.648 1.776 5.159
372 HG21 THR 50 1HG2 THR 50 10.640 2.531 6.754
373 HG22 THR 50 2HG2 THR 50 9.974 1.035 7.418
374 HG23 THR 50 3HG2 THR 50 11.723 1.345 7.524
375 H ASN 51 H ASN 51 9.543 -1.939 5.739
376 HA ASN 51 HA ASN 51 10.392 -3.797 7.705
377 HB2 ASN 51 2HB ASN 51 8.514 -3.374 9.335
378 HB3 ASN 51 3HB ASN 51 9.831 -2.210 9.375
379 HD21 ASN 51 1HD2 ASN 51 6.472 -2.585 7.951
380 HD22 ASN 51 2HD2 ASN 51 6.135 -0.892 8.173
381 H LYS 52 H LYS 52 9.598 -5.637 6.791
382 HA LYS 52 HA LYS 52 7.626 -5.720 4.816
383 HB2 LYS 52 2HB LYS 52 8.474 -7.919 6.761
384 HB3 LYS 52 3HB LYS 52 7.309 -8.149 5.459
385 HG2 LYS 52 2HG LYS 52 9.025 -8.688 4.152
386 HG3 LYS 52 3HG LYS 52 9.307 -6.959 4.057
387 HD2 LYS 52 2HD LYS 52 11.389 -7.910 4.480
388 HD3 LYS 52 3HD LYS 52 10.917 -7.210 6.028
389 HE2 LYS 52 2HE LYS 52 10.004 -10.021 5.625
390 HE3 LYS 52 3HE LYS 52 11.757 -9.844 5.503
391 HZ1 LYS 52 1HZ LYS 52 11.124 -10.310 7.733
392 HZ2 LYS 52 2HZ LYS 52 11.739 -8.785 7.672
393 HZ3 LYS 52 3HZ LYS 52 10.105 -9.026 7.799
394 H LYS 53 H LYS 53 6.988 -6.687 8.228
395 HA LYS 53 HA LYS 53 4.268 -6.932 7.843
396 HB2 LYS 53 2HB LYS 53 4.017 -6.627 10.321
397 HB3 LYS 53 3HB LYS 53 5.385 -7.653 9.907
398 HG2 LYS 53 2HG LYS 53 6.419 -6.356 11.470
399 HG3 LYS 53 3HG LYS 53 6.750 -5.352 10.063
400 HD2 LYS 53 2HD LYS 53 4.549 -4.088 10.708
401 HD3 LYS 53 3HD LYS 53 4.662 -4.937 12.243
402 HE2 LYS 53 2HE LYS 53 6.911 -3.272 11.020
403 HE3 LYS 53 3HE LYS 53 5.710 -2.606 12.127
404 HZ1 LYS 53 1HZ LYS 53 7.532 -4.830 12.797
405 HZ2 LYS 53 2HZ LYS 53 7.748 -3.262 13.245
406 HZ3 LYS 53 3HZ LYS 53 6.458 -4.106 13.816
407 H CYS 54 H CYS 54 2.486 -5.694 7.793
408 HA CYS 54 HA CYS 54 2.605 -3.272 6.427
409 HB2 CYS 54 2HB CYS 54 0.601 -4.670 6.587
410 HB3 CYS 54 3HB CYS 54 0.469 -4.285 8.306
411 HA PRO 55 HA PRO 55 4.135 -0.623 9.692
412 HB2 PRO 55 2HB PRO 55 3.748 1.856 8.505
413 HB3 PRO 55 3HB PRO 55 5.088 0.752 8.101
414 HG2 PRO 55 2HG PRO 55 2.449 1.098 6.663
415 HG3 PRO 55 3HG PRO 55 4.093 0.978 5.955
416 HD2 PRO 55 2HD PRO 55 2.404 -1.146 6.055
417 HD3 PRO 55 3HD PRO 55 4.166 -1.365 6.312
418 H ILE 56 H ILE 56 0.884 -0.446 8.399
419 HA ILE 56 HA ILE 56 0.011 1.118 10.780
420 HB ILE 56 HB ILE 56 -0.131 2.188 8.492
421 HG12 ILE 56 2HG1 ILE 56 -2.667 2.805 8.771
422 HG13 ILE 56 3HG1 ILE 56 -2.533 1.939 10.299
423 HG21 ILE 56 1HG2 ILE 56 -2.207 0.052 8.046
424 HG22 ILE 56 2HG2 ILE 56 -2.020 1.493 7.030
425 HG23 ILE 56 3HG2 ILE 56 -0.709 0.316 7.126
426 HD11 ILE 56 1HD1 ILE 56 -0.569 3.400 10.894
427 HD12 ILE 56 2HD1 ILE 56 -0.820 4.283 9.369
428 HD13 ILE 56 3HD1 ILE 56 -2.070 4.315 10.627
429 H CYS 57 H CYS 57 0.433 -1.916 10.304
430 HA CYS 57 HA CYS 57 -1.897 -2.668 11.908
431 HB2 CYS 57 2HB CYS 57 -1.186 -4.524 9.620
432 HB3 CYS 57 3HB CYS 57 -2.488 -4.640 10.799
433 H ARG 58 H ARG 58 -0.965 -5.462 11.783
434 HA ARG 58 HA ARG 58 1.877 -5.409 12.484
435 HB2 ARG 58 2HB ARG 58 -0.334 -5.360 14.468
436 HB3 ARG 58 3HB ARG 58 0.790 -6.680 14.746
437 HG2 ARG 58 2HG ARG 58 2.581 -5.341 15.198
438 HG3 ARG 58 3HG ARG 58 1.982 -3.956 14.279
439 HD2 ARG 58 2HD ARG 58 0.502 -3.272 15.919
440 HD3 ARG 58 3HD ARG 58 0.348 -4.872 16.637
441 HE ARG 58 HE ARG 58 2.322 -2.833 17.240
442 HH11 ARG 58 1HH1 ARG 58 3.851 -4.858 19.707
443 HH12 ARG 58 2HH1 ARG 58 3.700 -3.256 19.084
444 HH21 ARG 58 1HH2 ARG 58 2.628 -6.634 18.714
445 HH22 ARG 58 2HH2 ARG 58 1.624 -6.292 17.351
446 H VAL 59 H VAL 59 1.114 -6.580 10.289
447 HA VAL 59 HA VAL 59 1.142 -9.454 10.942
448 HB VAL 59 HB VAL 59 -0.570 -8.413 8.653
449 HG11 VAL 59 1HG1 VAL 59 0.166 -10.781 8.617
450 HG12 VAL 59 2HG1 VAL 59 -0.542 -11.027 10.232
451 HG13 VAL 59 3HG1 VAL 59 -1.583 -10.661 8.841
452 HG21 VAL 59 1HG2 VAL 59 -1.673 -7.450 10.592
453 HG22 VAL 59 2HG2 VAL 59 -2.591 -8.851 10.047
454 HG23 VAL 59 3HG2 VAL 59 -1.548 -8.993 11.478
455 H ASP 60 H ASP 60 2.549 -10.538 9.577
456 HA ASP 60 HA ASP 60 4.410 -8.905 8.092
457 HB2 ASP 60 2HB ASP 60 5.096 -10.923 9.302
458 HB3 ASP 60 3HB ASP 60 4.099 -11.909 8.214
459 H ILE 61 H ILE 61 4.777 -9.006 5.828
460 HA ILE 61 HA ILE 61 2.419 -9.833 4.222
461 HB ILE 61 HB ILE 61 2.810 -8.026 2.778
462 HG12 ILE 61 2HG1 ILE 61 5.301 -7.412 4.411
463 HG13 ILE 61 3HG1 ILE 61 5.288 -8.051 2.789
464 HG21 ILE 61 1HG2 ILE 61 1.663 -7.667 5.065
465 HG22 ILE 61 2HG2 ILE 61 3.158 -6.836 5.552
466 HG23 ILE 61 3HG2 ILE 61 2.192 -6.214 4.201
467 HD11 ILE 61 1HD1 ILE 61 4.150 -5.360 3.562
468 HD12 ILE 61 2HD1 ILE 61 5.652 -5.669 2.675
469 HD13 ILE 61 3HD1 ILE 61 4.077 -6.116 1.951
470 H GLU 62 H GLU 62 5.808 -10.285 4.720
471 HA GLU 62 HA GLU 62 6.710 -11.069 2.198
472 HB2 GLU 62 2HB GLU 62 7.777 -10.937 4.657
473 HB3 GLU 62 3HB GLU 62 7.496 -12.675 4.634
474 HG2 GLU 62 2HG GLU 62 9.004 -11.148 2.462
475 HG3 GLU 62 3HG GLU 62 9.783 -11.785 3.905
476 H ALA 63 H ALA 63 4.834 -12.907 4.596
477 HA ALA 63 HA ALA 63 3.381 -14.641 4.373
478 HB1 ALA 63 1HB ALA 63 3.200 -13.755 1.475
479 HB2 ALA 63 2HB ALA 63 1.997 -14.698 2.388
480 HB3 ALA 63 3HB ALA 63 2.332 -13.017 2.832
481 H GLN 64 H GLN 64 3.424 -15.972 1.366
482 HA GLN 64 HA GLN 64 5.435 -17.981 2.322
483 HB2 GLN 64 2HB GLN 64 3.020 -18.193 0.513
484 HB3 GLN 64 3HB GLN 64 4.329 -19.391 0.462
485 HG2 GLN 64 2HG GLN 64 4.121 -19.792 2.878
486 HG3 GLN 64 3HG GLN 64 2.819 -18.600 2.990
487 HE21 GLN 64 1HE2 GLN 64 3.136 -21.796 3.258
488 HE22 GLN 64 2HE2 GLN 64 1.682 -22.292 2.399
489 H LEU 65 H LEU 65 7.383 -17.434 1.618
490 HA LEU 65 HA LEU 65 8.286 -16.069 -0.510
491 HB2 LEU 65 2HB LEU 65 9.299 -18.426 0.994
492 HB3 LEU 65 3HB LEU 65 10.065 -18.187 -0.576
493 HG LEU 65 HG LEU 65 9.786 -15.942 1.437
494 HD11 LEU 65 1HD1 LEU 65 12.122 -17.864 1.051
495 HD12 LEU 65 2HD1 LEU 65 12.121 -16.409 2.078
496 HD13 LEU 65 3HD1 LEU 65 11.060 -17.765 2.480
497 HD21 LEU 65 1HD2 LEU 65 11.633 -16.394 -0.966
498 HD22 LEU 65 2HD2 LEU 65 10.271 -15.249 -0.894
499 HD23 LEU 65 3HD2 LEU 65 11.678 -14.989 0.130
500 HA PRO 66 HA PRO 66 7.813 -19.388 -3.811
501 HB2 PRO 66 2HB PRO 66 6.646 -21.810 -3.366
502 HB3 PRO 66 3HB PRO 66 8.364 -21.489 -2.965
503 HG2 PRO 66 2HG PRO 66 5.976 -21.414 -1.093
504 HG3 PRO 66 3HG PRO 66 7.549 -22.235 -0.848
505 HD2 PRO 66 2HD PRO 66 6.999 -19.762 0.176
506 HD3 PRO 66 3HD PRO 66 8.640 -20.212 -0.379
507 H SER 67 H SER 67 6.227 -18.925 -5.237
508 HA SER 67 HA SER 67 4.242 -18.676 -6.242
509 HB2 SER 67 2HB SER 67 3.048 -20.188 -3.892
510 HB3 SER 67 3HB SER 67 2.317 -19.934 -5.478
511 HG SER 67 HG SER 67 3.394 -21.957 -5.272
512 H GLU 68 H GLU 68 5.115 -16.432 -4.638
513 HA GLU 68 HA GLU 68 2.433 -15.180 -4.240
514 HB2 GLU 68 2HB GLU 68 3.584 -16.043 -2.119
515 HB3 GLU 68 3HB GLU 68 4.771 -14.755 -2.364
516 HG2 GLU 68 2HG GLU 68 3.344 -13.536 -1.076
517 HG3 GLU 68 3HG GLU 68 2.399 -13.349 -2.553
518 H SER 69 H SER 69 4.315 -15.085 -6.507
519 HA SER 69 HA SER 69 5.181 -12.246 -6.485
520 HB2 SER 69 2HB SER 69 7.206 -13.117 -7.730
521 HB3 SER 69 3HB SER 69 7.151 -13.604 -6.019
522 HG SER 69 HG SER 69 6.103 -15.171 -8.128
Start of MODEL 30
1 H1 MET 1 H1 MET 1 -23.177 38.549 -27.234
2 H2 MET 1 H2 MET 1 -22.307 39.851 -27.774
3 H3 MET 1 H3 MET 1 -22.141 38.359 -28.480
4 HA MET 1 HA MET 1 -20.261 38.802 -27.089
5 HB2 MET 1 2HB MET 1 -22.462 39.334 -25.101
6 HB3 MET 1 3HB MET 1 -20.933 38.663 -24.507
7 HG2 MET 1 2HG MET 1 -19.649 40.429 -25.526
8 HG3 MET 1 3HG MET 1 -21.083 41.095 -26.314
9 HE1 MET 1 1HE MET 1 -20.511 43.482 -25.501
10 HE2 MET 1 2HE MET 1 -20.125 43.898 -23.816
11 HE3 MET 1 3HE MET 1 -19.036 42.840 -24.742
12 H LYS 2 H LYS 2 -19.793 37.028 -25.037
13 HA LYS 2 HA LYS 2 -21.001 34.467 -25.829
14 HB2 LYS 2 2HB LYS 2 -18.151 35.376 -26.180
15 HB3 LYS 2 3HB LYS 2 -18.381 33.753 -25.527
16 HG2 LYS 2 2HG LYS 2 -19.432 32.937 -27.421
17 HG3 LYS 2 3HG LYS 2 -19.960 34.527 -27.977
18 HD2 LYS 2 2HD LYS 2 -18.078 34.937 -29.123
19 HD3 LYS 2 3HD LYS 2 -17.007 34.298 -27.876
20 HE2 LYS 2 2HE LYS 2 -18.696 32.390 -29.506
21 HE3 LYS 2 3HE LYS 2 -17.249 33.099 -30.234
22 HZ1 LYS 2 1HZ LYS 2 -15.933 32.209 -28.468
23 HZ2 LYS 2 2HZ LYS 2 -17.251 31.601 -27.691
24 HZ3 LYS 2 3HZ LYS 2 -16.796 30.989 -29.148
25 H GLN 3 H GLN 3 -20.153 32.805 -24.116
26 HA GLN 3 HA GLN 3 -19.700 33.972 -21.472
27 HB2 GLN 3 2HB GLN 3 -22.243 32.684 -22.460
28 HB3 GLN 3 3HB GLN 3 -21.699 32.236 -20.845
29 HG2 GLN 3 2HG GLN 3 -22.150 34.253 -19.925
30 HG3 GLN 3 3HG GLN 3 -21.589 35.156 -21.326
31 HE21 GLN 3 1HE2 GLN 3 -23.406 36.607 -21.149
32 HE22 GLN 3 2HE2 GLN 3 -24.992 36.053 -21.679
33 H ASP 4 H ASP 4 -19.521 31.984 -19.922
34 HA ASP 4 HA ASP 4 -17.777 30.042 -21.335
35 HB2 ASP 4 2HB ASP 4 -17.137 31.860 -19.327
36 HB3 ASP 4 3HB ASP 4 -17.429 30.378 -18.413
37 H GLY 5 H GLY 5 -17.536 28.141 -19.299
38 HA2 GLY 5 2HA GLY 5 -20.355 27.224 -18.867
39 HA3 GLY 5 3HA GLY 5 -19.140 26.152 -19.589
40 H GLU 6 H GLU 6 -20.106 25.026 -17.459
41 HA GLU 6 HA GLU 6 -18.118 25.412 -15.321
42 HB2 GLU 6 2HB GLU 6 -21.155 25.298 -15.049
43 HB3 GLU 6 3HB GLU 6 -20.093 24.792 -13.738
44 HG2 GLU 6 2HG GLU 6 -19.922 27.564 -14.996
45 HG3 GLU 6 3HG GLU 6 -20.977 27.178 -13.636
46 H GLU 7 H GLU 7 -17.983 23.430 -14.034
47 HA GLU 7 HA GLU 7 -19.385 21.071 -14.992
48 HB2 GLU 7 2HB GLU 7 -17.600 21.102 -16.606
49 HB3 GLU 7 3HB GLU 7 -16.369 21.219 -15.348
50 HG2 GLU 7 2HG GLU 7 -16.681 18.987 -14.668
51 HG3 GLU 7 3HG GLU 7 -18.353 18.941 -15.237
52 H GLY 8 H GLY 8 -16.335 20.940 -13.374
53 HA2 GLY 8 2HA GLY 8 -16.717 21.382 -10.726
54 HA3 GLY 8 3HA GLY 8 -17.615 19.866 -10.966
55 H THR 9 H THR 9 -15.991 18.926 -9.472
56 HA THR 9 HA THR 9 -13.799 17.724 -10.992
57 HB THR 9 HB THR 9 -12.305 17.960 -8.974
58 HG1 THR 9 1HG THR 9 -13.771 18.524 -7.413
59 HG21 THR 9 1HG2 THR 9 -11.548 20.221 -9.415
60 HG22 THR 9 2HG2 THR 9 -12.023 19.457 -10.947
61 HG23 THR 9 3HG2 THR 9 -13.094 20.647 -10.169
62 H GLU 10 H GLU 10 -12.950 15.851 -9.416
63 HA GLU 10 HA GLU 10 -15.294 14.646 -8.044
64 HB2 GLU 10 2HB GLU 10 -14.508 12.478 -8.865
65 HB3 GLU 10 3HB GLU 10 -14.951 13.543 -10.186
66 HG2 GLU 10 2HG GLU 10 -12.055 13.243 -9.280
67 HG3 GLU 10 3HG GLU 10 -12.805 12.116 -10.402
68 H GLU 11 H GLU 11 -14.236 12.561 -6.740
69 HA GLU 11 HA GLU 11 -11.798 13.317 -5.363
70 HB2 GLU 11 2HB GLU 11 -12.853 13.425 -3.172
71 HB3 GLU 11 3HB GLU 11 -13.567 14.652 -4.223
72 HG2 GLU 11 2HG GLU 11 -15.465 12.977 -4.684
73 HG3 GLU 11 3HG GLU 11 -14.792 11.991 -3.379
74 H ASP 12 H ASP 12 -11.045 11.405 -4.038
75 HA ASP 12 HA ASP 12 -12.693 9.041 -4.013
76 HB2 ASP 12 2HB ASP 12 -11.546 8.910 -6.264
77 HB3 ASP 12 3HB ASP 12 -9.994 8.947 -5.425
78 H THR 13 H THR 13 -12.065 7.869 -2.224
79 HA THR 13 HA THR 13 -9.366 8.143 -1.118
80 HB THR 13 HB THR 13 -11.855 9.042 0.345
81 HG1 THR 13 1HG THR 13 -10.295 10.416 -0.809
82 HG21 THR 13 1HG2 THR 13 -10.456 9.307 2.411
83 HG22 THR 13 2HG2 THR 13 -10.902 7.636 2.064
84 HG23 THR 13 3HG2 THR 13 -9.257 8.208 1.690
85 H GLU 14 H GLU 14 -11.322 6.063 -2.450
86 HA GLU 14 HA GLU 14 -11.448 4.003 -0.345
87 HB2 GLU 14 2HB GLU 14 -12.246 4.104 -3.288
88 HB3 GLU 14 3HB GLU 14 -12.110 2.593 -2.388
89 HG2 GLU 14 2HG GLU 14 -13.627 3.858 -0.599
90 HG3 GLU 14 3HG GLU 14 -14.052 4.882 -1.971
91 H GLU 15 H GLU 15 -9.648 4.784 -3.401
92 HA GLU 15 HA GLU 15 -7.681 2.713 -2.500
93 HB2 GLU 15 2HB GLU 15 -7.123 2.483 -4.935
94 HB3 GLU 15 3HB GLU 15 -8.603 1.737 -4.346
95 HG2 GLU 15 2HG GLU 15 -9.991 3.307 -5.419
96 HG3 GLU 15 3HG GLU 15 -8.684 4.464 -5.659
97 H LYS 16 H LYS 16 -6.151 3.821 -1.488
98 HA LYS 16 HA LYS 16 -4.728 5.818 -3.109
99 HB2 LYS 16 2HB LYS 16 -4.687 7.492 -1.441
100 HB3 LYS 16 3HB LYS 16 -6.384 7.002 -1.627
101 HG2 LYS 16 2HG LYS 16 -5.838 5.360 0.331
102 HG3 LYS 16 3HG LYS 16 -4.412 6.399 0.557
103 HD2 LYS 16 2HD LYS 16 -7.342 7.203 0.727
104 HD3 LYS 16 3HD LYS 16 -6.189 7.073 2.071
105 HE2 LYS 16 2HE LYS 16 -4.786 8.853 0.908
106 HE3 LYS 16 3HE LYS 16 -6.127 9.058 -0.235
107 HZ1 LYS 16 1HZ LYS 16 -6.219 10.652 1.559
108 HZ2 LYS 16 2HZ LYS 16 -7.542 9.680 1.593
109 HZ3 LYS 16 3HZ LYS 16 -6.318 9.454 2.681
110 H CYS 17 H CYS 17 -2.590 5.805 -2.848
111 HA CYS 17 HA CYS 17 -0.988 3.761 -1.441
112 HB2 CYS 17 2HB CYS 17 -0.390 5.036 -3.533
113 HB3 CYS 17 3HB CYS 17 -0.458 6.502 -2.622
114 H THR 18 H THR 18 -1.969 3.929 0.758
115 HA THR 18 HA THR 18 -1.991 6.423 2.089
116 HB THR 18 HB THR 18 -3.100 4.251 2.803
117 HG1 THR 18 1HG THR 18 -1.714 5.952 4.596
118 HG21 THR 18 1HG2 THR 18 -0.533 3.881 4.391
119 HG22 THR 18 2HG2 THR 18 -1.924 2.790 4.258
120 HG23 THR 18 3HG2 THR 18 -0.824 3.027 2.869
121 H ILE 19 H ILE 19 0.739 4.561 1.124
122 HA ILE 19 HA ILE 19 2.583 5.262 3.192
123 HB ILE 19 HB ILE 19 2.713 4.205 0.355
124 HG12 ILE 19 2HG1 ILE 19 3.699 2.680 2.742
125 HG13 ILE 19 3HG1 ILE 19 1.952 2.932 2.655
126 HG21 ILE 19 1HG2 ILE 19 5.020 4.693 2.264
127 HG22 ILE 19 2HG2 ILE 19 5.106 3.648 0.824
128 HG23 ILE 19 3HG2 ILE 19 4.790 5.382 0.639
129 HD11 ILE 19 1HD1 ILE 19 2.701 0.833 1.541
130 HD12 ILE 19 2HD1 ILE 19 1.806 1.949 0.480
131 HD13 ILE 19 3HD1 ILE 19 3.577 1.814 0.348
132 H CYS 20 H CYS 20 1.993 6.494 -0.179
133 HA CYS 20 HA CYS 20 3.603 8.970 0.388
134 HB2 CYS 20 2HB CYS 20 3.418 9.309 -1.984
135 HB3 CYS 20 3HB CYS 20 4.104 7.716 -1.638
136 H LEU 21 H LEU 21 0.502 7.916 0.974
137 HA LEU 21 HA LEU 21 -1.506 8.816 1.225
138 HB2 LEU 21 2HB LEU 21 0.165 11.268 1.846
139 HB3 LEU 21 3HB LEU 21 -1.560 11.130 2.205
140 HG LEU 21 HG LEU 21 0.495 9.136 3.261
141 HD11 LEU 21 1HD1 LEU 21 -0.615 11.634 4.569
142 HD12 LEU 21 2HD1 LEU 21 0.377 10.377 5.363
143 HD13 LEU 21 3HD1 LEU 21 1.066 11.338 4.042
144 HD21 LEU 21 1HD2 LEU 21 -1.814 8.310 3.270
145 HD22 LEU 21 2HD2 LEU 21 -1.307 8.677 4.918
146 HD23 LEU 21 3HD2 LEU 21 -2.381 9.805 4.057
147 H SER 22 H SER 22 -0.777 8.536 -1.380
148 HA SER 22 HA SER 22 -2.042 10.910 -2.679
149 HB2 SER 22 2HB SER 22 0.552 10.253 -3.003
150 HB3 SER 22 3HB SER 22 -0.149 9.124 -4.178
151 HG SER 22 HG SER 22 -0.288 11.946 -4.074
152 H ILE 23 H ILE 23 -3.964 10.357 -3.869
153 HA ILE 23 HA ILE 23 -5.023 7.801 -3.591
154 HB ILE 23 HB ILE 23 -5.574 10.295 -5.254
155 HG12 ILE 23 2HG1 ILE 23 -7.404 10.633 -3.750
156 HG13 ILE 23 3HG1 ILE 23 -7.169 9.042 -3.006
157 HG21 ILE 23 1HG2 ILE 23 -7.264 7.762 -5.140
158 HG22 ILE 23 2HG2 ILE 23 -7.820 9.350 -5.733
159 HG23 ILE 23 3HG2 ILE 23 -6.530 8.509 -6.564
160 HD11 ILE 23 1HD1 ILE 23 -5.179 9.794 -1.888
161 HD12 ILE 23 2HD1 ILE 23 -5.261 11.377 -2.725
162 HD13 ILE 23 3HD1 ILE 23 -6.507 10.908 -1.552
163 H LEU 24 H LEU 24 -5.444 6.340 -5.288
164 HA LEU 24 HA LEU 24 -3.236 6.035 -7.243
165 HB2 LEU 24 2HB LEU 24 -5.488 4.189 -6.308
166 HB3 LEU 24 3HB LEU 24 -4.146 3.688 -7.348
167 HG LEU 24 HG LEU 24 -3.694 4.841 -4.570
168 HD11 LEU 24 1HD1 LEU 24 -3.862 1.955 -5.404
169 HD12 LEU 24 2HD1 LEU 24 -3.324 2.568 -3.813
170 HD13 LEU 24 3HD1 LEU 24 -4.986 2.844 -4.353
171 HD21 LEU 24 1HD2 LEU 24 -1.772 5.103 -5.850
172 HD22 LEU 24 2HD2 LEU 24 -1.520 3.601 -4.912
173 HD23 LEU 24 3HD2 LEU 24 -1.967 3.507 -6.634
174 H GLU 25 H GLU 25 -4.894 4.384 -9.030
175 HA GLU 25 HA GLU 25 -7.221 5.780 -9.685
176 HB2 GLU 25 2HB GLU 25 -6.755 6.510 -11.932
177 HB3 GLU 25 3HB GLU 25 -5.597 7.279 -10.842
178 HG2 GLU 25 2HG GLU 25 -3.863 5.665 -11.509
179 HG3 GLU 25 3HG GLU 25 -5.017 4.845 -12.579
180 H GLU 26 H GLU 26 -8.272 4.673 -11.659
181 HA GLU 26 HA GLU 26 -8.231 1.921 -11.031
182 HB2 GLU 26 2HB GLU 26 -10.263 3.081 -11.681
183 HB3 GLU 26 3HB GLU 26 -9.622 3.423 -13.295
184 HG2 GLU 26 2HG GLU 26 -9.655 1.092 -13.906
185 HG3 GLU 26 3HG GLU 26 -9.893 0.584 -12.231
186 H GLY 27 H GLY 27 -6.531 0.682 -11.519
187 HA2 GLY 27 2HA GLY 27 -5.692 -0.867 -13.173
188 HA3 GLY 27 3HA GLY 27 -5.806 0.393 -14.404
189 H GLU 28 H GLU 28 -4.550 1.752 -11.515
190 HA GLU 28 HA GLU 28 -1.990 2.207 -12.570
191 HB2 GLU 28 2HB GLU 28 -3.199 3.592 -10.908
192 HB3 GLU 28 3HB GLU 28 -3.132 2.272 -9.748
193 HG2 GLU 28 2HG GLU 28 -1.595 3.957 -9.095
194 HG3 GLU 28 3HG GLU 28 -0.684 2.541 -9.563
195 H ASP 29 H ASP 29 0.058 1.596 -11.458
196 HA ASP 29 HA ASP 29 0.273 -1.274 -11.006
197 HB2 ASP 29 2HB ASP 29 2.576 -0.899 -10.603
198 HB3 ASP 29 3HB ASP 29 2.108 0.000 -12.027
199 H VAL 30 H VAL 30 -0.484 -2.149 -9.190
200 HA VAL 30 HA VAL 30 0.081 -0.846 -6.606
201 HB VAL 30 HB VAL 30 -2.199 -1.164 -5.829
202 HG11 VAL 30 1HG1 VAL 30 -3.347 0.579 -7.092
203 HG12 VAL 30 2HG1 VAL 30 -1.636 1.011 -6.880
204 HG13 VAL 30 3HG1 VAL 30 -2.230 0.402 -8.436
205 HG21 VAL 30 1HG2 VAL 30 -2.888 -2.024 -8.673
206 HG22 VAL 30 2HG2 VAL 30 -2.904 -3.074 -7.233
207 HG23 VAL 30 3HG2 VAL 30 -4.042 -1.726 -7.363
208 H ARG 31 H ARG 31 -0.897 -2.567 -4.890
209 HA ARG 31 HA ARG 31 -0.607 -5.326 -5.744
210 HB2 ARG 31 2HB ARG 31 1.248 -3.983 -3.747
211 HB3 ARG 31 3HB ARG 31 0.971 -5.724 -3.739
212 HG2 ARG 31 2HG ARG 31 1.675 -5.776 -6.167
213 HG3 ARG 31 3HG ARG 31 2.258 -4.114 -5.960
214 HD2 ARG 31 2HD ARG 31 4.091 -4.774 -4.786
215 HD3 ARG 31 3HD ARG 31 3.159 -5.925 -3.811
216 HE ARG 31 HE ARG 31 3.381 -6.970 -6.422
217 HH11 ARG 31 1HH1 ARG 31 6.082 -9.105 -5.708
218 HH12 ARG 31 2HH1 ARG 31 4.731 -8.825 -6.741
219 HH21 ARG 31 1HH2 ARG 31 6.554 -7.587 -3.940
220 HH22 ARG 31 2HH2 ARG 31 5.517 -6.229 -3.711
221 H ARG 32 H ARG 32 -0.949 -6.686 -3.699
222 HA ARG 32 HA ARG 32 -2.870 -5.416 -1.841
223 HB2 ARG 32 2HB ARG 32 -4.165 -6.841 -3.357
224 HB3 ARG 32 3HB ARG 32 -2.918 -8.091 -3.340
225 HG2 ARG 32 2HG ARG 32 -4.787 -8.855 -2.016
226 HG3 ARG 32 3HG ARG 32 -3.408 -8.588 -0.964
227 HD2 ARG 32 2HD ARG 32 -5.071 -7.568 0.248
228 HD3 ARG 32 3HD ARG 32 -4.434 -6.190 -0.628
229 HE ARG 32 HE ARG 32 -6.703 -7.704 -1.805
230 HH11 ARG 32 1HH1 ARG 32 -8.858 -4.932 -1.601
231 HH12 ARG 32 2HH1 ARG 32 -8.734 -6.589 -2.063
232 HH21 ARG 32 1HH2 ARG 32 -7.102 -3.937 -0.358
233 HH22 ARG 32 2HH2 ARG 32 -5.535 -4.654 -0.462
234 H LEU 33 H LEU 33 -2.521 -6.012 0.319
235 HA LEU 33 HA LEU 33 -0.390 -7.905 0.910
236 HB2 LEU 33 2HB LEU 33 -0.068 -6.235 2.915
237 HB3 LEU 33 3HB LEU 33 0.680 -5.847 1.380
238 HG LEU 33 HG LEU 33 -2.094 -4.779 1.878
239 HD11 LEU 33 1HD1 LEU 33 -0.935 -4.388 4.034
240 HD12 LEU 33 2HD1 LEU 33 0.449 -3.686 3.173
241 HD13 LEU 33 3HD1 LEU 33 -1.122 -2.871 3.141
242 HD21 LEU 33 1HD2 LEU 33 -1.210 -2.828 0.691
243 HD22 LEU 33 2HD2 LEU 33 0.426 -3.522 0.706
244 HD23 LEU 33 3HD2 LEU 33 -0.853 -4.264 -0.261
245 HA PRO 34 HA PRO 34 -3.287 -10.105 2.837
246 HB2 PRO 34 2HB PRO 34 -2.369 -10.782 5.398
247 HB3 PRO 34 3HB PRO 34 -1.851 -11.509 3.850
248 HG2 PRO 34 2HG PRO 34 -0.450 -9.445 5.511
249 HG3 PRO 34 3HG PRO 34 0.244 -10.728 4.474
250 HD2 PRO 34 2HD PRO 34 0.025 -8.045 3.840
251 HD3 PRO 34 3HD PRO 34 0.220 -9.306 2.621
252 H CYS 35 H CYS 35 -2.455 -7.337 4.733
253 HA CYS 35 HA CYS 35 -4.794 -7.067 6.481
254 HB2 CYS 35 2HB CYS 35 -2.477 -6.219 6.742
255 HB3 CYS 35 3HB CYS 35 -2.725 -5.164 5.369
256 H MET 36 H MET 36 -5.164 -7.396 3.285
257 HA MET 36 HA MET 36 -6.603 -6.564 1.735
258 HB2 MET 36 2HB MET 36 -8.019 -6.137 4.364
259 HB3 MET 36 3HB MET 36 -8.802 -5.653 2.855
260 HG2 MET 36 2HG MET 36 -7.529 -8.382 3.092
261 HG3 MET 36 3HG MET 36 -9.137 -8.084 3.739
262 HE1 MET 36 1HE MET 36 -8.740 -9.830 -0.120
263 HE2 MET 36 2HE MET 36 -7.224 -9.211 0.577
264 HE3 MET 36 3HE MET 36 -8.315 -10.217 1.563
265 H HIS 37 H HIS 37 -4.497 -4.672 2.734
266 HA HIS 37 HA HIS 37 -5.774 -2.085 2.064
267 HB2 HIS 37 1HB HIS 37 -3.324 -2.972 3.555
268 HB3 HIS 37 2HB HIS 37 -3.165 -1.505 2.593
269 HD2 HIS 37 2HD HIS 37 -5.894 -0.088 3.039
270 HE1 HIS 37 1HE HIS 37 -5.138 -0.255 7.215
271 HE2 HIS 37 2HE HIS 37 -6.525 0.858 5.381
272 H LEU 38 H LEU 38 -4.904 -0.819 0.229
273 HA LEU 38 HA LEU 38 -3.807 -2.584 -1.915
274 HB2 LEU 38 2HB LEU 38 -6.290 -1.837 -2.128
275 HB3 LEU 38 3HB LEU 38 -5.687 -0.202 -2.247
276 HG LEU 38 HG LEU 38 -4.130 -1.238 -4.157
277 HD11 LEU 38 1HD1 LEU 38 -6.523 -3.136 -4.128
278 HD12 LEU 38 2HD1 LEU 38 -5.250 -3.067 -5.361
279 HD13 LEU 38 3HD1 LEU 38 -4.851 -3.591 -3.714
280 HD21 LEU 38 1HD2 LEU 38 -5.796 0.503 -4.550
281 HD22 LEU 38 2HD2 LEU 38 -5.904 -0.720 -5.820
282 HD23 LEU 38 3HD2 LEU 38 -7.110 -0.689 -4.518
283 H PHE 39 H PHE 39 -1.700 -1.874 -2.274
284 HA PHE 39 HA PHE 39 -1.178 1.046 -1.835
285 HB2 PHE 39 2HB PHE 39 0.444 -1.379 -1.007
286 HB3 PHE 39 3HB PHE 39 1.086 0.250 -1.023
287 HD1 PHE 39 1HD PHE 39 -2.016 1.127 0.145
288 HD2 PHE 39 2HD PHE 39 1.337 -1.281 1.386
289 HE1 PHE 39 1HE PHE 39 -2.753 1.295 2.464
290 HE2 PHE 39 2HE PHE 39 0.660 -0.998 3.734
291 HZ PHE 39 HZ PHE 39 -1.406 0.272 4.296
292 H HIS 40 H HIS 40 0.147 2.025 -3.243
293 HA HIS 40 HA HIS 40 0.475 1.381 -5.947
294 HB2 HIS 40 1HB HIS 40 1.584 3.211 -3.929
295 HB3 HIS 40 2HB HIS 40 2.852 2.710 -5.005
296 HD2 HIS 40 2HD HIS 40 0.757 2.886 -7.721
297 HE1 HIS 40 1HE HIS 40 1.531 6.982 -6.920
298 HE2 HIS 40 2HE HIS 40 0.704 5.293 -8.667
299 H GLN 41 H GLN 41 2.206 0.336 -7.195
300 HA GLN 41 HA GLN 41 3.320 -1.877 -5.747
301 HB2 GLN 41 2HB GLN 41 2.574 -1.840 -8.151
302 HB3 GLN 41 3HB GLN 41 4.074 -0.983 -8.549
303 HG2 GLN 41 2HG GLN 41 5.447 -2.782 -7.959
304 HG3 GLN 41 3HG GLN 41 4.183 -3.589 -7.030
305 HE21 GLN 41 1HE2 GLN 41 1.990 -3.919 -8.610
306 HE22 GLN 41 2HE2 GLN 41 2.473 -4.692 -10.110
307 H VAL 42 H VAL 42 4.784 1.095 -7.174
308 HA VAL 42 HA VAL 42 7.428 0.526 -6.266
309 HB VAL 42 HB VAL 42 6.060 3.218 -6.687
310 HG11 VAL 42 1HG1 VAL 42 8.396 4.069 -7.014
311 HG12 VAL 42 2HG1 VAL 42 8.093 3.549 -5.353
312 HG13 VAL 42 3HG1 VAL 42 9.019 2.502 -6.450
313 HG21 VAL 42 1HG2 VAL 42 6.065 1.812 -8.717
314 HG22 VAL 42 2HG2 VAL 42 7.235 3.123 -8.887
315 HG23 VAL 42 3HG2 VAL 42 7.799 1.482 -8.501
316 H CYS 43 H CYS 43 4.906 2.534 -4.654
317 HA CYS 43 HA CYS 43 6.461 3.223 -2.374
318 HB2 CYS 43 2HB CYS 43 3.451 2.912 -2.531
319 HB3 CYS 43 3HB CYS 43 4.384 3.914 -1.415
320 H VAL 44 H VAL 44 4.266 0.349 -2.853
321 HA VAL 44 HA VAL 44 4.680 -0.492 -0.164
322 HB VAL 44 HB VAL 44 2.738 -1.085 -1.717
323 HG11 VAL 44 1HG1 VAL 44 2.966 -3.127 -2.964
324 HG12 VAL 44 2HG1 VAL 44 4.165 -1.973 -3.549
325 HG13 VAL 44 3HG1 VAL 44 4.664 -3.310 -2.485
326 HG21 VAL 44 1HG2 VAL 44 3.178 -2.030 0.557
327 HG22 VAL 44 2HG2 VAL 44 2.362 -3.171 -0.551
328 HG23 VAL 44 3HG2 VAL 44 4.095 -3.339 -0.197
329 H ASP 45 H ASP 45 6.543 -0.904 -3.169
330 HA ASP 45 HA ASP 45 7.990 -3.218 -2.329
331 HB2 ASP 45 2HB ASP 45 7.999 -2.162 -4.645
332 HB3 ASP 45 3HB ASP 45 9.086 -0.920 -4.006
333 H GLN 46 H GLN 46 8.725 0.274 -2.070
334 HA GLN 46 HA GLN 46 10.918 -0.073 -0.242
335 HB2 GLN 46 2HB GLN 46 9.027 2.285 -0.715
336 HB3 GLN 46 3HB GLN 46 10.481 2.392 0.280
337 HG2 GLN 46 2HG GLN 46 10.576 1.559 -2.654
338 HG3 GLN 46 3HG GLN 46 10.640 3.242 -2.123
339 HE21 GLN 46 1HE2 GLN 46 12.815 3.446 -3.059
340 HE22 GLN 46 2HE2 GLN 46 14.161 2.749 -2.164
341 H ALA 47 H ALA 47 7.425 0.103 0.334
342 HA ALA 47 HA ALA 47 7.611 0.486 3.146
343 HB1 ALA 47 1HB ALA 47 5.535 0.589 1.760
344 HB2 ALA 47 2HB ALA 47 5.578 -1.188 1.632
345 HB3 ALA 47 3HB ALA 47 5.364 -0.423 3.219
346 H LEU 48 H LEU 48 7.378 -2.565 1.265
347 HA LEU 48 HA LEU 48 7.530 -4.327 3.447
348 HB2 LEU 48 2HB LEU 48 6.662 -4.781 1.172
349 HB3 LEU 48 3HB LEU 48 8.294 -4.761 0.517
350 HG LEU 48 HG LEU 48 7.609 -6.647 2.797
351 HD11 LEU 48 1HD1 LEU 48 5.796 -6.937 1.152
352 HD12 LEU 48 2HD1 LEU 48 6.992 -7.119 -0.151
353 HD13 LEU 48 3HD1 LEU 48 6.879 -8.336 1.141
354 HD21 LEU 48 1HD2 LEU 48 9.230 -8.124 1.598
355 HD22 LEU 48 2HD2 LEU 48 9.468 -6.859 0.375
356 HD23 LEU 48 3HD2 LEU 48 9.973 -6.595 2.058
357 H ILE 49 H ILE 49 10.161 -3.167 1.219
358 HA ILE 49 HA ILE 49 12.163 -4.684 2.588
359 HB ILE 49 HB ILE 49 13.785 -3.433 1.394
360 HG12 ILE 49 2HG1 ILE 49 12.705 -1.533 -0.199
361 HG13 ILE 49 3HG1 ILE 49 11.801 -1.298 1.307
362 HG21 ILE 49 1HG2 ILE 49 12.460 -5.109 0.164
363 HG22 ILE 49 2HG2 ILE 49 11.405 -3.820 -0.441
364 HG23 ILE 49 3HG2 ILE 49 13.116 -3.834 -0.878
365 HD11 ILE 49 1HD1 ILE 49 13.800 0.094 1.333
366 HD12 ILE 49 2HD1 ILE 49 13.971 -1.172 2.556
367 HD13 ILE 49 3HD1 ILE 49 14.826 -1.319 1.007
368 H THR 50 H THR 50 10.805 -1.417 3.212
369 HA THR 50 HA THR 50 12.741 -0.693 5.148
370 HB THR 50 HB THR 50 9.916 0.144 4.497
371 HG1 THR 50 1HG THR 50 12.400 1.492 4.774
372 HG21 THR 50 1HG2 THR 50 11.366 1.019 7.017
373 HG22 THR 50 2HG2 THR 50 10.013 1.894 6.257
374 HG23 THR 50 3HG2 THR 50 9.753 0.268 6.883
375 H ASN 51 H ASN 51 9.631 -2.516 5.378
376 HA ASN 51 HA ASN 51 10.636 -4.067 7.535
377 HB2 ASN 51 2HB ASN 51 9.453 -1.586 8.336
378 HB3 ASN 51 3HB ASN 51 8.190 -2.782 8.560
379 HD21 ASN 51 1HD2 ASN 51 11.788 -2.696 9.025
380 HD22 ASN 51 2HD2 ASN 51 11.722 -3.318 10.670
381 H LYS 52 H LYS 52 9.536 -5.990 7.423
382 HA LYS 52 HA LYS 52 7.250 -6.356 5.647
383 HB2 LYS 52 2HB LYS 52 7.338 -8.645 6.503
384 HB3 LYS 52 3HB LYS 52 8.857 -8.095 5.823
385 HG2 LYS 52 2HG LYS 52 9.971 -8.592 7.698
386 HG3 LYS 52 3HG LYS 52 8.976 -7.494 8.662
387 HD2 LYS 52 2HD LYS 52 7.475 -9.161 9.297
388 HD3 LYS 52 3HD LYS 52 7.890 -10.170 7.919
389 HE2 LYS 52 2HE LYS 52 10.239 -10.355 8.981
390 HE3 LYS 52 3HE LYS 52 9.384 -9.892 10.483
391 HZ1 LYS 52 1HZ LYS 52 9.313 -12.261 10.275
392 HZ2 LYS 52 2HZ LYS 52 7.797 -11.737 9.827
393 HZ3 LYS 52 3HZ LYS 52 8.889 -12.181 8.698
394 H LYS 53 H LYS 53 6.049 -4.531 6.797
395 HA LYS 53 HA LYS 53 3.896 -5.915 8.005
396 HB2 LYS 53 2HB LYS 53 3.686 -4.402 10.005
397 HB3 LYS 53 3HB LYS 53 4.984 -5.580 10.135
398 HG2 LYS 53 2HG LYS 53 6.648 -4.000 10.080
399 HG3 LYS 53 3HG LYS 53 5.786 -2.966 8.937
400 HD2 LYS 53 2HD LYS 53 4.194 -2.366 10.847
401 HD3 LYS 53 3HD LYS 53 5.372 -3.115 11.935
402 HE2 LYS 53 2HE LYS 53 6.223 -1.081 9.855
403 HE3 LYS 53 3HE LYS 53 5.478 -0.521 11.356
404 HZ1 LYS 53 1HZ LYS 53 7.813 -2.315 11.317
405 HZ2 LYS 53 2HZ LYS 53 7.955 -0.680 11.375
406 HZ3 LYS 53 3HZ LYS 53 7.215 -1.493 12.600
407 H CYS 54 H CYS 54 2.046 -4.435 8.130
408 HA CYS 54 HA CYS 54 1.815 -2.374 6.019
409 HB2 CYS 54 2HB CYS 54 0.014 -3.817 7.134
410 HB3 CYS 54 3HB CYS 54 0.234 -2.785 8.561
411 HA PRO 55 HA PRO 55 3.845 0.761 8.515
412 HB2 PRO 55 2HB PRO 55 2.899 3.115 7.465
413 HB3 PRO 55 3HB PRO 55 4.050 2.044 6.610
414 HG2 PRO 55 2HG PRO 55 1.042 2.196 6.267
415 HG3 PRO 55 3HG PRO 55 2.304 2.157 4.999
416 HD2 PRO 55 2HD PRO 55 0.949 -0.079 5.767
417 HD3 PRO 55 3HD PRO 55 2.675 -0.153 5.301
418 H ILE 56 H ILE 56 0.319 1.150 8.059
419 HA ILE 56 HA ILE 56 -0.071 2.732 10.484
420 HB ILE 56 HB ILE 56 -1.956 1.213 8.624
421 HG12 ILE 56 2HG1 ILE 56 -1.842 4.220 8.873
422 HG13 ILE 56 3HG1 ILE 56 -0.639 3.395 7.879
423 HG21 ILE 56 1HG2 ILE 56 -3.795 2.555 9.705
424 HG22 ILE 56 2HG2 ILE 56 -3.066 1.378 10.792
425 HG23 ILE 56 3HG2 ILE 56 -2.628 3.094 10.929
426 HD11 ILE 56 1HD1 ILE 56 -2.393 2.311 6.550
427 HD12 ILE 56 2HD1 ILE 56 -3.653 3.095 7.525
428 HD13 ILE 56 3HD1 ILE 56 -2.572 4.078 6.525
429 H CYS 57 H CYS 57 -0.699 -0.595 9.419
430 HA CYS 57 HA CYS 57 -1.706 -1.520 12.057
431 HB2 CYS 57 2HB CYS 57 -1.283 -3.442 9.874
432 HB3 CYS 57 3HB CYS 57 -2.722 -3.101 10.803
433 H ARG 58 H ARG 58 -0.640 -3.875 12.601
434 HA ARG 58 HA ARG 58 2.252 -3.786 11.883
435 HB2 ARG 58 2HB ARG 58 1.735 -3.035 14.351
436 HB3 ARG 58 3HB ARG 58 1.521 -4.779 14.622
437 HG2 ARG 58 2HG ARG 58 3.838 -4.939 13.307
438 HG3 ARG 58 3HG ARG 58 3.983 -3.241 13.722
439 HD2 ARG 58 2HD ARG 58 3.321 -5.134 15.971
440 HD3 ARG 58 3HD ARG 58 4.899 -5.307 15.221
441 HE ARG 58 HE ARG 58 5.634 -3.392 16.126
442 HH11 ARG 58 1HH1 ARG 58 4.064 -0.945 18.102
443 HH12 ARG 58 2HH1 ARG 58 5.568 -1.524 17.495
444 HH21 ARG 58 1HH2 ARG 58 2.047 -2.064 17.530
445 HH22 ARG 58 2HH2 ARG 58 2.136 -3.460 16.516
446 H VAL 59 H VAL 59 -0.237 -5.240 10.988
447 HA VAL 59 HA VAL 59 0.098 -8.035 11.311
448 HB VAL 59 HB VAL 59 -1.091 -7.999 9.089
449 HG11 VAL 59 1HG1 VAL 59 -3.133 -6.948 9.889
450 HG12 VAL 59 2HG1 VAL 59 -2.336 -7.783 11.230
451 HG13 VAL 59 3HG1 VAL 59 -2.242 -6.014 11.105
452 HG21 VAL 59 1HG2 VAL 59 -0.501 -6.285 7.757
453 HG22 VAL 59 2HG2 VAL 59 -1.801 -5.413 8.627
454 HG23 VAL 59 3HG2 VAL 59 -0.113 -5.186 9.057
455 H ASP 60 H ASP 60 1.632 -9.376 10.464
456 HA ASP 60 HA ASP 60 3.913 -8.315 9.003
457 HB2 ASP 60 2HB ASP 60 3.897 -10.228 10.706
458 HB3 ASP 60 3HB ASP 60 3.111 -11.217 9.469
459 H ILE 61 H ILE 61 4.285 -8.680 6.808
460 HA ILE 61 HA ILE 61 1.985 -9.634 5.163
461 HB ILE 61 HB ILE 61 2.613 -8.048 3.486
462 HG12 ILE 61 2HG1 ILE 61 4.841 -7.202 5.401
463 HG13 ILE 61 3HG1 ILE 61 5.041 -7.978 3.817
464 HG21 ILE 61 1HG2 ILE 61 2.572 -6.418 6.018
465 HG22 ILE 61 2HG2 ILE 61 1.714 -6.123 4.469
466 HG23 ILE 61 3HG2 ILE 61 1.161 -7.399 5.565
467 HD11 ILE 61 1HD1 ILE 61 3.780 -6.088 2.809
468 HD12 ILE 61 2HD1 ILE 61 3.905 -5.240 4.379
469 HD13 ILE 61 3HD1 ILE 61 5.392 -5.675 3.498
470 H GLU 62 H GLU 62 5.246 -10.143 5.925
471 HA GLU 62 HA GLU 62 6.552 -10.946 3.642
472 HB2 GLU 62 2HB GLU 62 7.085 -10.900 6.205
473 HB3 GLU 62 3HB GLU 62 6.719 -12.613 6.159
474 HG2 GLU 62 2HG GLU 62 8.579 -12.906 4.530
475 HG3 GLU 62 3HG GLU 62 8.825 -11.145 4.504
476 H ALA 63 H ALA 63 6.137 -12.465 2.073
477 HA ALA 63 HA ALA 63 4.792 -14.959 2.746
478 HB1 ALA 63 1HB ALA 63 3.015 -14.587 1.044
479 HB2 ALA 63 2HB ALA 63 2.897 -13.395 2.355
480 HB3 ALA 63 3HB ALA 63 3.602 -12.926 0.793
481 H GLN 64 H GLN 64 4.835 -16.368 0.835
482 HA GLN 64 HA GLN 64 6.059 -17.533 -0.640
483 HB2 GLN 64 2HB GLN 64 6.318 -14.807 -1.789
484 HB3 GLN 64 3HB GLN 64 7.640 -15.894 -2.204
485 HG2 GLN 64 2HG GLN 64 6.078 -17.562 -3.049
486 HG3 GLN 64 3HG GLN 64 4.694 -16.592 -2.514
487 HE21 GLN 64 1HE2 GLN 64 6.321 -17.412 -5.303
488 HE22 GLN 64 2HE2 GLN 64 6.037 -15.915 -6.178
489 H LEU 65 H LEU 65 8.390 -18.036 -1.280
490 HA LEU 65 HA LEU 65 10.361 -17.182 0.748
491 HB2 LEU 65 2HB LEU 65 9.231 -19.951 0.360
492 HB3 LEU 65 3HB LEU 65 10.945 -19.788 0.734
493 HG LEU 65 HG LEU 65 8.891 -18.367 2.451
494 HD11 LEU 65 1HD1 LEU 65 8.185 -20.700 2.409
495 HD12 LEU 65 2HD1 LEU 65 9.845 -21.239 2.750
496 HD13 LEU 65 3HD1 LEU 65 8.933 -20.315 3.967
497 HD21 LEU 65 1HD2 LEU 65 11.322 -17.793 2.685
498 HD22 LEU 65 2HD2 LEU 65 10.667 -18.558 4.140
499 HD23 LEU 65 3HD2 LEU 65 11.670 -19.502 3.018
500 HA PRO 66 HA PRO 66 11.792 -17.337 -3.604
501 HB2 PRO 66 2HB PRO 66 13.424 -15.130 -3.544
502 HB3 PRO 66 3HB PRO 66 11.646 -15.024 -3.744
503 HG2 PRO 66 2HG PRO 66 13.256 -14.692 -1.200
504 HG3 PRO 66 3HG PRO 66 11.941 -13.645 -1.820
505 HD2 PRO 66 2HD PRO 66 11.545 -15.577 0.071
506 HD3 PRO 66 3HD PRO 66 10.290 -15.194 -1.150
507 H SER 67 H SER 67 13.747 -18.233 -4.367
508 HA SER 67 HA SER 67 15.646 -19.195 -2.327
509 HB2 SER 67 2HB SER 67 15.562 -19.479 -5.359
510 HB3 SER 67 3HB SER 67 16.717 -20.288 -4.274
511 HG SER 67 HG SER 67 14.005 -20.528 -3.658
512 H GLU 68 H GLU 68 16.272 -17.066 -1.593
513 HA GLU 68 HA GLU 68 17.770 -15.282 -3.332
514 HB2 GLU 68 2HB GLU 68 17.565 -15.600 -0.305
515 HB3 GLU 68 3HB GLU 68 18.537 -14.341 -1.097
516 HG2 GLU 68 2HG GLU 68 16.568 -13.428 -2.208
517 HG3 GLU 68 3HG GLU 68 15.558 -14.739 -1.596
518 H SER 69 H SER 69 20.183 -14.845 -2.925
519 HA SER 69 HA SER 69 21.779 -17.138 -2.104
520 HB2 SER 69 2HB SER 69 22.890 -17.133 -4.378
521 HB3 SER 69 3HB SER 69 21.231 -17.780 -4.399
522 HG SER 69 HG SER 69 21.736 -15.046 -4.842
Start of MODEL 31
1 H1 MET 1 H1 MET 1 9.004 10.769 12.415
2 H2 MET 1 H2 MET 1 8.496 10.653 13.972
3 H3 MET 1 H3 MET 1 8.305 12.054 13.110
4 HA MET 1 HA MET 1 10.148 12.049 14.772
5 HB2 MET 1 2HB MET 1 11.350 10.238 12.633
6 HB3 MET 1 3HB MET 1 12.270 11.064 13.905
7 HG2 MET 1 2HG MET 1 11.926 8.883 14.705
8 HG3 MET 1 3HG MET 1 10.871 9.948 15.626
9 HE1 MET 1 1HE MET 1 10.523 8.055 12.068
10 HE2 MET 1 2HE MET 1 11.250 6.952 13.267
11 HE3 MET 1 3HE MET 1 9.613 6.646 12.649
12 H LYS 2 H LYS 2 12.362 12.272 12.240
13 HA LYS 2 HA LYS 2 11.349 14.947 11.440
14 HB2 LYS 2 2HB LYS 2 13.605 15.854 11.691
15 HB3 LYS 2 3HB LYS 2 12.951 15.298 13.230
16 HG2 LYS 2 2HG LYS 2 14.281 13.194 13.037
17 HG3 LYS 2 3HG LYS 2 14.990 13.774 11.530
18 HD2 LYS 2 2HD LYS 2 15.210 15.150 14.240
19 HD3 LYS 2 3HD LYS 2 16.452 14.122 13.527
20 HE2 LYS 2 2HE LYS 2 15.428 16.744 12.343
21 HE3 LYS 2 3HE LYS 2 16.930 16.539 13.250
22 HZ1 LYS 2 1HZ LYS 2 17.682 15.016 11.529
23 HZ2 LYS 2 2HZ LYS 2 16.296 15.256 10.667
24 HZ3 LYS 2 3HZ LYS 2 17.347 16.498 10.905
25 H GLN 3 H GLN 3 10.974 12.590 10.052
26 HA GLN 3 HA GLN 3 12.312 13.150 7.518
27 HB2 GLN 3 2HB GLN 3 12.854 10.731 7.210
28 HB3 GLN 3 3HB GLN 3 13.853 11.508 8.437
29 HG2 GLN 3 2HG GLN 3 12.630 10.491 10.244
30 HG3 GLN 3 3HG GLN 3 11.361 9.905 9.166
31 HE21 GLN 3 1HE2 GLN 3 12.374 7.981 10.751
32 HE22 GLN 3 2HE2 GLN 3 13.478 6.978 9.819
33 H ASP 4 H ASP 4 9.732 13.727 8.441
34 HA ASP 4 HA ASP 4 8.028 11.417 7.638
35 HB2 ASP 4 2HB ASP 4 7.573 13.582 9.731
36 HB3 ASP 4 3HB ASP 4 6.432 12.309 9.294
37 H GLY 5 H GLY 5 7.268 14.864 8.257
38 HA2 GLY 5 2HA GLY 5 7.042 16.144 5.961
39 HA3 GLY 5 3HA GLY 5 5.721 14.961 5.771
40 H GLU 6 H GLU 6 4.004 16.437 6.013
41 HA GLU 6 HA GLU 6 3.535 17.309 8.811
42 HB2 GLU 6 2HB GLU 6 3.054 18.966 6.291
43 HB3 GLU 6 3HB GLU 6 2.266 19.280 7.840
44 HG2 GLU 6 2HG GLU 6 4.511 19.500 8.929
45 HG3 GLU 6 3HG GLU 6 5.282 19.281 7.352
46 H GLU 7 H GLU 7 1.773 17.487 5.674
47 HA GLU 7 HA GLU 7 0.175 15.194 6.369
48 HB2 GLU 7 2HB GLU 7 -0.827 17.330 7.522
49 HB3 GLU 7 3HB GLU 7 -1.344 17.787 5.895
50 HG2 GLU 7 2HG GLU 7 -2.490 15.535 5.719
51 HG3 GLU 7 3HG GLU 7 -1.965 15.168 7.358
52 H GLY 8 H GLY 8 -1.729 16.580 4.252
53 HA2 GLY 8 2HA GLY 8 -1.043 17.023 1.782
54 HA3 GLY 8 3HA GLY 8 -0.167 15.487 1.945
55 H THR 9 H THR 9 -3.461 16.937 2.430
56 HA THR 9 HA THR 9 -4.707 14.380 1.639
57 HB THR 9 HB THR 9 -6.281 14.959 3.600
58 HG1 THR 9 1HG THR 9 -5.089 16.115 5.274
59 HG21 THR 9 1HG2 THR 9 -3.438 14.033 4.214
60 HG22 THR 9 2HG2 THR 9 -4.860 13.773 5.238
61 HG23 THR 9 3HG2 THR 9 -4.767 13.009 3.640
62 H GLU 10 H GLU 10 -6.906 14.716 0.858
63 HA GLU 10 HA GLU 10 -7.974 17.351 0.604
64 HB2 GLU 10 2HB GLU 10 -6.011 16.875 -1.307
65 HB3 GLU 10 3HB GLU 10 -7.463 16.331 -2.155
66 HG2 GLU 10 2HG GLU 10 -8.572 18.502 -1.548
67 HG3 GLU 10 3HG GLU 10 -7.062 19.034 -0.796
68 H GLU 11 H GLU 11 -7.796 14.221 -1.191
69 HA GLU 11 HA GLU 11 -10.598 13.643 -0.450
70 HB2 GLU 11 2HB GLU 11 -10.476 14.662 -2.714
71 HB3 GLU 11 3HB GLU 11 -9.321 13.418 -3.214
72 HG2 GLU 11 2HG GLU 11 -11.012 11.671 -2.919
73 HG3 GLU 11 3HG GLU 11 -12.139 12.835 -2.204
74 H ASP 12 H ASP 12 -10.948 11.425 -0.103
75 HA ASP 12 HA ASP 12 -9.209 9.340 -0.962
76 HB2 ASP 12 2HB ASP 12 -7.853 10.313 0.987
77 HB3 ASP 12 3HB ASP 12 -9.184 9.891 2.046
78 H THR 13 H THR 13 -11.162 8.415 -1.624
79 HA THR 13 HA THR 13 -12.616 7.126 0.623
80 HB THR 13 HB THR 13 -13.593 9.355 0.140
81 HG1 THR 13 1HG THR 13 -15.178 7.025 -0.034
82 HG21 THR 13 1HG2 THR 13 -15.188 9.695 -1.613
83 HG22 THR 13 2HG2 THR 13 -13.622 9.299 -2.342
84 HG23 THR 13 3HG2 THR 13 -14.913 8.078 -2.264
85 H GLU 14 H GLU 14 -11.275 6.645 -2.284
86 HA GLU 14 HA GLU 14 -13.099 4.447 -3.090
87 HB2 GLU 14 2HB GLU 14 -11.991 6.805 -4.626
88 HB3 GLU 14 3HB GLU 14 -12.292 5.274 -5.470
89 HG2 GLU 14 2HG GLU 14 -14.601 5.311 -5.065
90 HG3 GLU 14 3HG GLU 14 -14.456 6.410 -3.704
91 H GLU 15 H GLU 15 -9.884 5.846 -4.102
92 HA GLU 15 HA GLU 15 -8.570 3.394 -3.142
93 HB2 GLU 15 2HB GLU 15 -7.625 3.100 -5.501
94 HB3 GLU 15 3HB GLU 15 -9.275 2.572 -5.208
95 HG2 GLU 15 2HG GLU 15 -10.182 4.597 -6.224
96 HG3 GLU 15 3HG GLU 15 -8.571 5.256 -6.458
97 H LYS 16 H LYS 16 -6.954 4.345 -1.886
98 HA LYS 16 HA LYS 16 -5.251 6.295 -3.271
99 HB2 LYS 16 2HB LYS 16 -7.047 7.109 -1.420
100 HB3 LYS 16 3HB LYS 16 -5.725 6.644 -0.322
101 HG2 LYS 16 2HG LYS 16 -4.195 7.976 -1.855
102 HG3 LYS 16 3HG LYS 16 -5.666 8.497 -2.711
103 HD2 LYS 16 2HD LYS 16 -6.430 9.334 -0.381
104 HD3 LYS 16 3HD LYS 16 -4.706 9.229 0.050
105 HE2 LYS 16 2HE LYS 16 -4.264 10.611 -2.065
106 HE3 LYS 16 3HE LYS 16 -6.028 10.803 -2.211
107 HZ1 LYS 16 1HZ LYS 16 -4.348 11.718 0.014
108 HZ2 LYS 16 2HZ LYS 16 -5.052 12.657 -1.123
109 HZ3 LYS 16 3HZ LYS 16 -6.031 11.839 -0.076
110 H CYS 17 H CYS 17 -3.150 6.199 -2.749
111 HA CYS 17 HA CYS 17 -2.006 3.692 -1.533
112 HB2 CYS 17 2HB CYS 17 -1.119 4.815 -3.617
113 HB3 CYS 17 3HB CYS 17 -0.771 6.233 -2.656
114 H THR 18 H THR 18 -2.212 3.739 0.719
115 HA THR 18 HA THR 18 -2.286 6.103 2.245
116 HB THR 18 HB THR 18 -2.762 3.560 2.818
117 HG1 THR 18 1HG THR 18 -2.945 4.265 4.930
118 HG21 THR 18 1HG2 THR 18 -1.191 2.633 4.404
119 HG22 THR 18 2HG2 THR 18 -0.313 2.952 2.889
120 HG23 THR 18 3HG2 THR 18 -0.134 4.049 4.276
121 H ILE 19 H ILE 19 0.533 4.527 0.797
122 HA ILE 19 HA ILE 19 2.437 5.697 2.607
123 HB ILE 19 HB ILE 19 2.558 4.176 0.002
124 HG12 ILE 19 2HG1 ILE 19 3.684 3.363 2.699
125 HG13 ILE 19 3HG1 ILE 19 1.960 3.166 2.379
126 HG21 ILE 19 1HG2 ILE 19 4.467 5.595 -0.088
127 HG22 ILE 19 2HG2 ILE 19 4.800 5.382 1.648
128 HG23 ILE 19 3HG2 ILE 19 5.059 4.039 0.515
129 HD11 ILE 19 1HD1 ILE 19 3.187 1.116 1.843
130 HD12 ILE 19 2HD1 ILE 19 2.404 1.814 0.407
131 HD13 ILE 19 3HD1 ILE 19 4.152 1.996 0.639
132 H CYS 20 H CYS 20 1.464 6.349 -0.824
133 HA CYS 20 HA CYS 20 3.164 8.806 -0.990
134 HB2 CYS 20 2HB CYS 20 0.953 7.864 -2.845
135 HB3 CYS 20 3HB CYS 20 2.173 9.108 -3.131
136 H LEU 21 H LEU 21 0.063 7.986 0.295
137 HA LEU 21 HA LEU 21 -1.875 8.997 0.635
138 HB2 LEU 21 2HB LEU 21 -0.051 11.366 1.119
139 HB3 LEU 21 3HB LEU 21 -1.743 11.295 1.617
140 HG LEU 21 HG LEU 21 0.304 9.199 2.482
141 HD11 LEU 21 1HD1 LEU 21 1.060 11.365 3.245
142 HD12 LEU 21 2HD1 LEU 21 -0.547 11.723 3.926
143 HD13 LEU 21 3HD1 LEU 21 0.448 10.403 4.601
144 HD21 LEU 21 1HD2 LEU 21 -2.429 10.002 3.589
145 HD22 LEU 21 2HD2 LEU 21 -2.066 8.505 2.700
146 HD23 LEU 21 3HD2 LEU 21 -1.341 8.775 4.279
147 H SER 22 H SER 22 -1.115 8.785 -2.102
148 HA SER 22 HA SER 22 -2.624 11.061 -3.300
149 HB2 SER 22 2HB SER 22 -0.195 9.598 -4.390
150 HB3 SER 22 3HB SER 22 -1.207 10.720 -5.329
151 HG SER 22 HG SER 22 0.728 11.602 -4.162
152 H ILE 23 H ILE 23 -4.012 10.507 -5.028
153 HA ILE 23 HA ILE 23 -5.440 8.070 -4.772
154 HB ILE 23 HB ILE 23 -5.350 10.404 -6.673
155 HG12 ILE 23 2HG1 ILE 23 -6.286 10.696 -4.340
156 HG13 ILE 23 3HG1 ILE 23 -7.347 11.163 -5.661
157 HG21 ILE 23 1HG2 ILE 23 -7.540 9.602 -7.626
158 HG22 ILE 23 2HG2 ILE 23 -6.063 8.800 -8.153
159 HG23 ILE 23 3HG2 ILE 23 -7.128 7.992 -6.984
160 HD11 ILE 23 1HD1 ILE 23 -8.663 9.121 -5.425
161 HD12 ILE 23 2HD1 ILE 23 -7.550 8.500 -4.187
162 HD13 ILE 23 3HD1 ILE 23 -8.536 9.935 -3.859
163 H LEU 24 H LEU 24 -5.680 6.438 -6.205
164 HA LEU 24 HA LEU 24 -3.363 5.749 -7.901
165 HB2 LEU 24 2HB LEU 24 -5.778 4.175 -6.893
166 HB3 LEU 24 3HB LEU 24 -4.396 3.481 -7.744
167 HG LEU 24 HG LEU 24 -4.204 4.904 -5.027
168 HD11 LEU 24 1HD1 LEU 24 -4.287 1.991 -5.765
169 HD12 LEU 24 2HD1 LEU 24 -3.935 2.665 -4.130
170 HD13 LEU 24 3HD1 LEU 24 -5.527 2.913 -4.878
171 HD21 LEU 24 1HD2 LEU 24 -2.116 5.020 -6.053
172 HD22 LEU 24 2HD2 LEU 24 -2.015 3.518 -5.072
173 HD23 LEU 24 3HD2 LEU 24 -2.269 3.419 -6.820
174 H GLU 25 H GLU 25 -4.321 4.236 -9.781
175 HA GLU 25 HA GLU 25 -6.917 5.275 -10.703
176 HB2 GLU 25 2HB GLU 25 -6.302 5.763 -12.955
177 HB3 GLU 25 3HB GLU 25 -5.251 6.694 -11.881
178 HG2 GLU 25 2HG GLU 25 -3.427 5.079 -12.237
179 HG3 GLU 25 3HG GLU 25 -4.492 4.066 -13.238
180 H GLU 26 H GLU 26 -7.785 3.993 -12.630
181 HA GLU 26 HA GLU 26 -7.873 1.319 -11.739
182 HB2 GLU 26 2HB GLU 26 -9.787 2.449 -12.769
183 HB3 GLU 26 3HB GLU 26 -8.921 2.585 -14.310
184 HG2 GLU 26 2HG GLU 26 -8.881 0.131 -14.538
185 HG3 GLU 26 3HG GLU 26 -9.572 -0.056 -12.924
186 H GLY 27 H GLY 27 -6.265 -0.104 -11.960
187 HA2 GLY 27 2HA GLY 27 -5.123 -1.720 -13.244
188 HA3 GLY 27 3HA GLY 27 -5.302 -0.712 -14.687
189 H GLU 28 H GLU 28 -4.196 1.136 -11.959
190 HA GLU 28 HA GLU 28 -1.613 1.554 -13.081
191 HB2 GLU 28 2HB GLU 28 -3.110 3.002 -11.527
192 HB3 GLU 28 3HB GLU 28 -2.463 2.038 -10.207
193 HG2 GLU 28 2HG GLU 28 -0.145 2.801 -10.933
194 HG3 GLU 28 3HG GLU 28 -0.919 3.799 -12.172
195 H ASP 29 H ASP 29 0.408 1.118 -11.866
196 HA ASP 29 HA ASP 29 0.765 -1.590 -11.054
197 HB2 ASP 29 2HB ASP 29 2.510 0.810 -10.412
198 HB3 ASP 29 3HB ASP 29 2.993 -0.886 -10.394
199 H VAL 30 H VAL 30 -0.348 -2.345 -9.266
200 HA VAL 30 HA VAL 30 -0.029 -0.898 -6.726
201 HB VAL 30 HB VAL 30 -2.365 -1.377 -6.152
202 HG11 VAL 30 1HG1 VAL 30 -3.406 0.399 -7.469
203 HG12 VAL 30 2HG1 VAL 30 -1.749 0.842 -7.018
204 HG13 VAL 30 3HG1 VAL 30 -2.114 0.300 -8.669
205 HG21 VAL 30 1HG2 VAL 30 -2.821 -3.264 -7.685
206 HG22 VAL 30 2HG2 VAL 30 -4.019 -1.970 -7.845
207 HG23 VAL 30 3HG2 VAL 30 -2.753 -2.150 -9.068
208 H ARG 31 H ARG 31 -0.928 -2.487 -4.961
209 HA ARG 31 HA ARG 31 -0.313 -5.264 -5.512
210 HB2 ARG 31 2HB ARG 31 1.484 -3.331 -4.086
211 HB3 ARG 31 3HB ARG 31 1.264 -4.867 -3.254
212 HG2 ARG 31 2HG ARG 31 2.014 -4.916 -6.175
213 HG3 ARG 31 3HG ARG 31 3.232 -4.478 -4.989
214 HD2 ARG 31 2HD ARG 31 1.564 -7.010 -4.763
215 HD3 ARG 31 3HD ARG 31 3.088 -6.958 -5.648
216 HE ARG 31 HE ARG 31 2.736 -7.103 -2.809
217 HH11 ARG 31 1HH1 ARG 31 6.101 -6.390 -2.039
218 HH12 ARG 31 2HH1 ARG 31 4.609 -7.007 -1.406
219 HH21 ARG 31 1HH2 ARG 31 6.252 -5.551 -4.217
220 HH22 ARG 31 2HH2 ARG 31 4.947 -5.820 -5.292
221 H ARG 32 H ARG 32 -0.787 -6.527 -3.421
222 HA ARG 32 HA ARG 32 -2.702 -5.083 -1.681
223 HB2 ARG 32 2HB ARG 32 -3.631 -6.602 -3.657
224 HB3 ARG 32 3HB ARG 32 -3.145 -7.941 -2.627
225 HG2 ARG 32 2HG ARG 32 -5.145 -5.733 -1.955
226 HG3 ARG 32 3HG ARG 32 -5.516 -7.390 -2.425
227 HD2 ARG 32 2HD ARG 32 -3.915 -7.846 -0.235
228 HD3 ARG 32 3HD ARG 32 -4.631 -6.302 0.196
229 HE ARG 32 HE ARG 32 -6.757 -7.253 0.280
230 HH11 ARG 32 1HH1 ARG 32 -7.577 -10.677 0.379
231 HH12 ARG 32 2HH1 ARG 32 -8.111 -9.091 0.774
232 HH21 ARG 32 1HH2 ARG 32 -5.425 -11.018 -0.543
233 HH22 ARG 32 2HH2 ARG 32 -4.421 -9.648 -0.854
234 H LEU 33 H LEU 33 -2.499 -5.736 0.492
235 HA LEU 33 HA LEU 33 -0.422 -7.750 1.112
236 HB2 LEU 33 2HB LEU 33 -0.200 -6.160 3.198
237 HB3 LEU 33 3HB LEU 33 0.685 -5.815 1.722
238 HG LEU 33 HG LEU 33 -2.038 -4.562 2.040
239 HD11 LEU 33 1HD1 LEU 33 -1.073 -4.258 4.249
240 HD12 LEU 33 2HD1 LEU 33 0.499 -3.785 3.560
241 HD13 LEU 33 3HD1 LEU 33 -0.897 -2.722 3.379
242 HD21 LEU 33 1HD2 LEU 33 -0.979 -2.689 0.919
243 HD22 LEU 33 2HD2 LEU 33 0.619 -3.453 1.058
244 HD23 LEU 33 3HD2 LEU 33 -0.619 -4.148 -0.006
245 HA PRO 34 HA PRO 34 -3.230 -10.081 3.022
246 HB2 PRO 34 2HB PRO 34 -2.106 -11.004 5.379
247 HB3 PRO 34 3HB PRO 34 -1.611 -11.520 3.739
248 HG2 PRO 34 2HG PRO 34 -0.310 -9.471 5.531
249 HG3 PRO 34 3HG PRO 34 0.458 -10.714 4.489
250 HD2 PRO 34 2HD PRO 34 0.200 -8.075 3.814
251 HD3 PRO 34 3HD PRO 34 0.251 -9.344 2.592
252 H CYS 35 H CYS 35 -2.052 -7.512 5.134
253 HA CYS 35 HA CYS 35 -4.709 -7.289 6.562
254 HB2 CYS 35 2HB CYS 35 -2.901 -6.960 8.033
255 HB3 CYS 35 3HB CYS 35 -2.057 -5.902 6.881
256 H MET 36 H MET 36 -5.029 -7.404 4.036
257 HA MET 36 HA MET 36 -6.013 -6.369 2.295
258 HB2 MET 36 2HB MET 36 -7.826 -5.987 4.706
259 HB3 MET 36 3HB MET 36 -8.323 -5.964 3.002
260 HG2 MET 36 2HG MET 36 -7.071 -8.269 2.873
261 HG3 MET 36 3HG MET 36 -7.281 -8.293 4.621
262 HE1 MET 36 1HE MET 36 -9.606 -8.500 5.833
263 HE2 MET 36 2HE MET 36 -10.149 -6.982 5.078
264 HE3 MET 36 3HE MET 36 -11.176 -8.429 5.006
265 H HIS 37 H HIS 37 -4.278 -4.787 2.235
266 HA HIS 37 HA HIS 37 -5.672 -2.203 2.048
267 HB2 HIS 37 1HB HIS 37 -3.056 -2.831 3.364
268 HB3 HIS 37 2HB HIS 37 -3.179 -1.319 2.478
269 HD2 HIS 37 2HD HIS 37 -5.290 0.357 3.301
270 HE1 HIS 37 1HE HIS 37 -4.877 -0.871 7.366
271 HE2 HIS 37 2HE HIS 37 -5.833 0.921 5.805
272 H LEU 38 H LEU 38 -4.719 -0.836 0.312
273 HA LEU 38 HA LEU 38 -3.711 -2.481 -1.951
274 HB2 LEU 38 2HB LEU 38 -6.214 -1.963 -1.847
275 HB3 LEU 38 3HB LEU 38 -5.813 -0.261 -1.964
276 HG LEU 38 HG LEU 38 -5.259 -2.428 -4.043
277 HD11 LEU 38 1HD1 LEU 38 -7.641 -1.706 -3.821
278 HD12 LEU 38 2HD1 LEU 38 -7.143 -0.014 -4.058
279 HD13 LEU 38 3HD1 LEU 38 -6.941 -1.191 -5.366
280 HD21 LEU 38 1HD2 LEU 38 -4.704 -0.407 -5.503
281 HD22 LEU 38 2HD2 LEU 38 -4.623 0.528 -3.994
282 HD23 LEU 38 3HD2 LEU 38 -3.488 -0.811 -4.284
283 H PHE 39 H PHE 39 -1.661 -1.682 -2.258
284 HA PHE 39 HA PHE 39 -1.187 1.267 -1.921
285 HB2 PHE 39 2HB PHE 39 0.597 -1.134 -1.339
286 HB3 PHE 39 3HB PHE 39 1.182 0.511 -1.350
287 HD1 PHE 39 1HD PHE 39 -1.873 1.141 0.159
288 HD2 PHE 39 2HD PHE 39 1.762 -1.023 0.919
289 HE1 PHE 39 1HE PHE 39 -2.388 1.119 2.555
290 HE2 PHE 39 2HE PHE 39 1.281 -0.986 3.345
291 HZ PHE 39 HZ PHE 39 -0.829 0.056 4.170
292 H HIS 40 H HIS 40 0.722 2.031 -3.331
293 HA HIS 40 HA HIS 40 0.513 0.975 -6.062
294 HB2 HIS 40 1HB HIS 40 2.604 2.720 -4.758
295 HB3 HIS 40 2HB HIS 40 2.706 2.198 -6.421
296 HD2 HIS 40 2HD HIS 40 0.500 2.999 -8.061
297 HE1 HIS 40 1HE HIS 40 0.355 6.739 -6.022
298 HE2 HIS 40 2HE HIS 40 -0.329 5.452 -8.158
299 H GLN 41 H GLN 41 2.261 -0.128 -7.137
300 HA GLN 41 HA GLN 41 3.513 -2.225 -5.675
301 HB2 GLN 41 2HB GLN 41 2.790 -2.046 -8.130
302 HB3 GLN 41 3HB GLN 41 4.318 -1.220 -8.436
303 HG2 GLN 41 2HG GLN 41 5.590 -3.151 -7.914
304 HG3 GLN 41 3HG GLN 41 4.284 -3.885 -6.983
305 HE21 GLN 41 1HE2 GLN 41 2.048 -4.071 -8.544
306 HE22 GLN 41 2HE2 GLN 41 2.482 -4.865 -10.046
307 H VAL 42 H VAL 42 4.958 0.710 -7.238
308 HA VAL 42 HA VAL 42 7.569 0.312 -6.269
309 HB VAL 42 HB VAL 42 6.138 2.957 -6.833
310 HG11 VAL 42 1HG1 VAL 42 8.267 3.341 -5.653
311 HG12 VAL 42 2HG1 VAL 42 9.112 2.269 -6.793
312 HG13 VAL 42 3HG1 VAL 42 8.421 3.809 -7.350
313 HG21 VAL 42 1HG2 VAL 42 6.001 1.491 -8.799
314 HG22 VAL 42 2HG2 VAL 42 7.195 2.754 -9.088
315 HG23 VAL 42 3HG2 VAL 42 7.734 1.116 -8.667
316 H CYS 43 H CYS 43 4.943 2.302 -4.778
317 HA CYS 43 HA CYS 43 6.388 3.190 -2.489
318 HB2 CYS 43 2HB CYS 43 3.445 2.465 -2.642
319 HB3 CYS 43 3HB CYS 43 4.239 3.503 -1.478
320 H VAL 44 H VAL 44 4.352 0.135 -2.852
321 HA VAL 44 HA VAL 44 4.948 -0.485 -0.153
322 HB VAL 44 HB VAL 44 2.899 -1.160 -1.437
323 HG11 VAL 44 1HG1 VAL 44 4.748 -3.417 -2.305
324 HG12 VAL 44 2HG1 VAL 44 2.982 -3.366 -2.481
325 HG13 VAL 44 3HG1 VAL 44 3.997 -2.211 -3.376
326 HG21 VAL 44 1HG2 VAL 44 4.319 -3.420 -0.001
327 HG22 VAL 44 2HG2 VAL 44 3.671 -2.007 0.837
328 HG23 VAL 44 3HG2 VAL 44 2.573 -3.078 -0.080
329 H ASP 45 H ASP 45 6.700 -1.067 -3.130
330 HA ASP 45 HA ASP 45 8.216 -3.301 -2.118
331 HB2 ASP 45 2HB ASP 45 8.666 -1.268 -4.317
332 HB3 ASP 45 3HB ASP 45 9.932 -2.392 -3.861
333 H GLN 46 H GLN 46 8.903 0.267 -2.143
334 HA GLN 46 HA GLN 46 11.150 -0.142 -0.341
335 HB2 GLN 46 2HB GLN 46 9.556 2.381 -0.986
336 HB3 GLN 46 3HB GLN 46 10.962 2.334 0.092
337 HG2 GLN 46 2HG GLN 46 12.283 1.284 -1.811
338 HG3 GLN 46 3HG GLN 46 10.930 1.688 -2.879
339 HE21 GLN 46 1HE2 GLN 46 10.185 4.182 -2.565
340 HE22 GLN 46 2HE2 GLN 46 11.556 5.286 -2.486
341 H ALA 47 H ALA 47 7.701 0.145 0.236
342 HA ALA 47 HA ALA 47 7.898 0.717 3.031
343 HB1 ALA 47 1HB ALA 47 5.852 -1.049 1.640
344 HB2 ALA 47 2HB ALA 47 5.656 -0.187 3.176
345 HB3 ALA 47 3HB ALA 47 5.806 0.733 1.658
346 H LEU 48 H LEU 48 7.561 -2.417 1.327
347 HA LEU 48 HA LEU 48 7.742 -4.103 3.529
348 HB2 LEU 48 2HB LEU 48 6.926 -4.600 1.234
349 HB3 LEU 48 3HB LEU 48 8.580 -4.640 0.637
350 HG LEU 48 HG LEU 48 7.649 -6.453 2.907
351 HD11 LEU 48 1HD1 LEU 48 7.486 -7.001 -0.087
352 HD12 LEU 48 2HD1 LEU 48 7.120 -8.160 1.211
353 HD13 LEU 48 3HD1 LEU 48 6.095 -6.734 0.997
354 HD21 LEU 48 1HD2 LEU 48 9.392 -7.983 1.933
355 HD22 LEU 48 2HD2 LEU 48 9.854 -6.696 0.802
356 HD23 LEU 48 3HD2 LEU 48 10.081 -6.490 2.553
357 H ILE 49 H ILE 49 10.415 -3.059 1.292
358 HA ILE 49 HA ILE 49 12.392 -4.520 2.747
359 HB ILE 49 HB ILE 49 14.036 -3.309 1.546
360 HG12 ILE 49 2HG1 ILE 49 12.913 -1.469 -0.128
361 HG13 ILE 49 3HG1 ILE 49 12.050 -1.183 1.398
362 HG21 ILE 49 1HG2 ILE 49 13.398 -3.771 -0.729
363 HG22 ILE 49 2HG2 ILE 49 12.753 -5.027 0.343
364 HG23 ILE 49 3HG2 ILE 49 11.681 -3.774 -0.303
365 HD11 ILE 49 1HD1 ILE 49 14.050 0.210 1.285
366 HD12 ILE 49 2HD1 ILE 49 14.218 -0.989 2.584
367 HD13 ILE 49 3HD1 ILE 49 15.064 -1.229 1.040
368 H THR 50 H THR 50 10.956 -1.298 3.342
369 HA THR 50 HA THR 50 12.980 -0.578 5.253
370 HB THR 50 HB THR 50 10.167 0.444 4.715
371 HG1 THR 50 1HG THR 50 11.610 1.041 3.203
372 HG21 THR 50 1HG2 THR 50 10.564 0.897 7.081
373 HG22 THR 50 2HG2 THR 50 12.203 1.494 6.719
374 HG23 THR 50 3HG2 THR 50 10.775 2.384 6.146
375 H ASN 51 H ASN 51 9.801 -2.249 5.411
376 HA ASN 51 HA ASN 51 10.567 -3.728 7.695
377 HB2 ASN 51 2HB ASN 51 9.377 -1.205 8.333
378 HB3 ASN 51 3HB ASN 51 8.074 -2.376 8.496
379 HD21 ASN 51 1HD2 ASN 51 11.559 -1.983 9.304
380 HD22 ASN 51 2HD2 ASN 51 11.424 -2.715 10.901
381 H LYS 52 H LYS 52 9.491 -5.663 7.399
382 HA LYS 52 HA LYS 52 7.341 -5.844 5.412
383 HB2 LYS 52 2HB LYS 52 7.451 -8.228 5.868
384 HB3 LYS 52 3HB LYS 52 8.991 -7.522 5.389
385 HG2 LYS 52 2HG LYS 52 9.868 -7.634 7.645
386 HG3 LYS 52 3HG LYS 52 8.271 -8.081 8.308
387 HD2 LYS 52 2HD LYS 52 8.255 -10.098 6.946
388 HD3 LYS 52 3HD LYS 52 9.787 -9.639 6.187
389 HE2 LYS 52 2HE LYS 52 10.312 -11.301 7.797
390 HE3 LYS 52 3HE LYS 52 10.823 -9.768 8.527
391 HZ1 LYS 52 1HZ LYS 52 8.263 -11.168 9.027
392 HZ2 LYS 52 2HZ LYS 52 9.536 -11.130 10.085
393 HZ3 LYS 52 3HZ LYS 52 8.620 -9.795 9.689
394 H LYS 53 H LYS 53 6.269 -4.121 7.242
395 HA LYS 53 HA LYS 53 4.066 -5.822 8.143
396 HB2 LYS 53 2HB LYS 53 5.297 -3.698 9.951
397 HB3 LYS 53 3HB LYS 53 3.769 -4.549 10.228
398 HG2 LYS 53 2HG LYS 53 5.075 -6.730 10.250
399 HG3 LYS 53 3HG LYS 53 6.561 -5.760 10.201
400 HD2 LYS 53 2HD LYS 53 5.643 -4.550 12.279
401 HD3 LYS 53 3HD LYS 53 4.423 -5.846 12.361
402 HE2 LYS 53 2HE LYS 53 6.296 -7.527 12.375
403 HE3 LYS 53 3HE LYS 53 7.456 -6.187 12.376
404 HZ1 LYS 53 1HZ LYS 53 7.114 -6.976 14.590
405 HZ2 LYS 53 2HZ LYS 53 6.482 -5.463 14.480
406 HZ3 LYS 53 3HZ LYS 53 5.484 -6.775 14.490
407 H CYS 54 H CYS 54 2.164 -4.883 7.753
408 HA CYS 54 HA CYS 54 1.750 -2.606 6.004
409 HB2 CYS 54 2HB CYS 54 0.248 -4.509 6.163
410 HB3 CYS 54 3HB CYS 54 0.062 -4.282 7.902
411 HA PRO 55 HA PRO 55 2.614 0.321 9.212
412 HB2 PRO 55 2HB PRO 55 1.497 2.644 8.185
413 HB3 PRO 55 3HB PRO 55 3.023 1.903 7.626
414 HG2 PRO 55 2HG PRO 55 0.267 1.620 6.402
415 HG3 PRO 55 3HG PRO 55 1.827 1.919 5.581
416 HD2 PRO 55 2HD PRO 55 0.736 -0.576 5.733
417 HD3 PRO 55 3HD PRO 55 2.508 -0.326 5.851
418 H ILE 56 H ILE 56 -0.707 1.264 8.087
419 HA ILE 56 HA ILE 56 -1.503 1.605 10.901
420 HB ILE 56 HB ILE 56 -3.081 2.113 8.349
421 HG12 ILE 56 2HG1 ILE 56 -1.059 3.537 8.394
422 HG13 ILE 56 3HG1 ILE 56 -2.545 4.453 8.550
423 HG21 ILE 56 1HG2 ILE 56 -4.592 1.939 10.239
424 HG22 ILE 56 2HG2 ILE 56 -3.543 2.939 11.253
425 HG23 ILE 56 3HG2 ILE 56 -4.403 3.652 9.867
426 HD11 ILE 56 1HD1 ILE 56 -0.722 3.725 10.886
427 HD12 ILE 56 2HD1 ILE 56 -0.771 5.288 10.051
428 HD13 ILE 56 3HD1 ILE 56 -2.182 4.745 10.963
429 H CYS 57 H CYS 57 -1.026 -0.684 11.110
430 HA CYS 57 HA CYS 57 -3.184 -2.205 11.832
431 HB2 CYS 57 2HB CYS 57 -3.061 -4.097 10.199
432 HB3 CYS 57 3HB CYS 57 -4.063 -2.705 9.804
433 H ARG 58 H ARG 58 0.155 -2.250 10.601
434 HA ARG 58 HA ARG 58 2.019 -3.223 11.376
435 HB2 ARG 58 2HB ARG 58 1.460 -1.732 13.217
436 HB3 ARG 58 3HB ARG 58 0.581 -3.018 14.047
437 HG2 ARG 58 2HG ARG 58 2.546 -4.189 14.599
438 HG3 ARG 58 3HG ARG 58 3.499 -3.417 13.319
439 HD2 ARG 58 2HD ARG 58 2.348 -1.899 15.689
440 HD3 ARG 58 3HD ARG 58 3.940 -2.686 15.730
441 HE ARG 58 HE ARG 58 3.849 -1.097 13.414
442 HH11 ARG 58 1HH1 ARG 58 5.338 1.773 14.823
443 HH12 ARG 58 2HH1 ARG 58 5.027 0.906 13.365
444 HH21 ARG 58 1HH2 ARG 58 4.595 0.884 16.902
445 HH22 ARG 58 2HH2 ARG 58 3.744 -0.620 16.904
446 H VAL 59 H VAL 59 0.292 -5.024 10.178
447 HA VAL 59 HA VAL 59 0.895 -7.554 11.664
448 HB VAL 59 HB VAL 59 -1.012 -7.088 9.337
449 HG11 VAL 59 1HG1 VAL 59 -0.173 -9.396 9.398
450 HG12 VAL 59 2HG1 VAL 59 -0.557 -9.513 11.135
451 HG13 VAL 59 3HG1 VAL 59 -1.853 -9.359 9.931
452 HG21 VAL 59 1HG2 VAL 59 -1.579 -7.433 12.316
453 HG22 VAL 59 2HG2 VAL 59 -1.924 -6.000 11.331
454 HG23 VAL 59 3HG2 VAL 59 -2.815 -7.490 11.039
455 H ASP 60 H ASP 60 2.090 -9.141 10.505
456 HA ASP 60 HA ASP 60 4.069 -7.965 8.769
457 HB2 ASP 60 2HB ASP 60 4.352 -9.825 10.523
458 HB3 ASP 60 3HB ASP 60 3.690 -10.915 9.312
459 H ILE 61 H ILE 61 4.517 -8.617 6.587
460 HA ILE 61 HA ILE 61 2.078 -9.510 5.121
461 HB ILE 61 HB ILE 61 2.597 -7.922 3.410
462 HG12 ILE 61 2HG1 ILE 61 4.894 -6.964 5.178
463 HG13 ILE 61 3HG1 ILE 61 5.086 -7.893 3.681
464 HG21 ILE 61 1HG2 ILE 61 1.809 -5.987 4.500
465 HG22 ILE 61 2HG2 ILE 61 1.271 -7.308 5.548
466 HG23 ILE 61 3HG2 ILE 61 2.721 -6.374 5.993
467 HD11 ILE 61 1HD1 ILE 61 5.373 -5.606 3.151
468 HD12 ILE 61 2HD1 ILE 61 3.810 -6.163 2.477
469 HD13 ILE 61 3HD1 ILE 61 3.850 -5.153 3.954
470 H GLU 62 H GLU 62 5.368 -10.107 5.613
471 HA GLU 62 HA GLU 62 6.216 -11.071 3.084
472 HB2 GLU 62 2HB GLU 62 7.659 -10.696 5.005
473 HB3 GLU 62 3HB GLU 62 6.935 -12.080 5.857
474 HG2 GLU 62 2HG GLU 62 7.723 -13.463 3.781
475 HG3 GLU 62 3HG GLU 62 8.677 -12.034 3.372
476 H ALA 63 H ALA 63 4.465 -12.098 2.070
477 HA ALA 63 HA ALA 63 3.355 -14.570 3.084
478 HB1 ALA 63 1HB ALA 63 3.519 -13.483 0.232
479 HB2 ALA 63 2HB ALA 63 2.477 -14.814 0.782
480 HB3 ALA 63 3HB ALA 63 2.201 -13.168 1.387
481 H GLN 64 H GLN 64 3.715 -16.671 1.953
482 HA GLN 64 HA GLN 64 6.420 -17.450 2.188
483 HB2 GLN 64 2HB GLN 64 4.345 -18.827 2.532
484 HB3 GLN 64 3HB GLN 64 4.145 -18.919 0.779
485 HG2 GLN 64 2HG GLN 64 6.306 -20.080 0.569
486 HG3 GLN 64 3HG GLN 64 6.612 -19.878 2.302
487 HE21 GLN 64 1HE2 GLN 64 4.707 -20.787 3.776
488 HE22 GLN 64 2HE2 GLN 64 4.092 -22.341 3.230
489 H LEU 65 H LEU 65 7.912 -16.569 0.863
490 HA LEU 65 HA LEU 65 7.919 -17.179 -1.953
491 HB2 LEU 65 2HB LEU 65 6.521 -14.882 -1.447
492 HB3 LEU 65 3HB LEU 65 8.150 -14.227 -1.549
493 HG LEU 65 HG LEU 65 8.372 -15.596 -3.751
494 HD11 LEU 65 1HD1 LEU 65 6.210 -15.963 -4.921
495 HD12 LEU 65 2HD1 LEU 65 6.302 -16.957 -3.458
496 HD13 LEU 65 3HD1 LEU 65 5.330 -15.479 -3.453
497 HD21 LEU 65 1HD2 LEU 65 8.254 -13.149 -3.688
498 HD22 LEU 65 2HD2 LEU 65 7.279 -13.768 -5.031
499 HD23 LEU 65 3HD2 LEU 65 6.481 -13.213 -3.540
500 HA PRO 66 HA PRO 66 12.098 -15.321 -0.820
501 HB2 PRO 66 2HB PRO 66 12.692 -14.203 1.585
502 HB3 PRO 66 3HB PRO 66 11.850 -13.273 0.304
503 HG2 PRO 66 2HG PRO 66 10.602 -14.755 2.642
504 HG3 PRO 66 3HG PRO 66 10.336 -13.052 2.143
505 HD2 PRO 66 2HD PRO 66 8.668 -15.042 1.402
506 HD3 PRO 66 3HD PRO 66 9.050 -13.699 0.292
507 H SER 67 H SER 67 13.945 -16.179 0.459
508 HA SER 67 HA SER 67 13.420 -18.078 2.592
509 HB2 SER 67 2HB SER 67 12.766 -19.381 0.538
510 HB3 SER 67 3HB SER 67 14.433 -19.208 -0.044
511 HG SER 67 HG SER 67 14.989 -20.173 2.102
512 H GLU 68 H GLU 68 15.667 -16.111 0.708
513 HA GLU 68 HA GLU 68 17.770 -16.644 2.600
514 HB2 GLU 68 2HB GLU 68 17.784 -17.657 -0.207
515 HB3 GLU 68 3HB GLU 68 19.142 -16.601 0.142
516 HG2 GLU 68 2HG GLU 68 18.394 -19.041 1.807
517 HG3 GLU 68 3HG GLU 68 19.627 -19.004 0.544
518 H SER 69 H SER 69 19.341 -14.906 2.396
519 HA SER 69 HA SER 69 19.735 -12.668 2.538
520 HB2 SER 69 2HB SER 69 18.216 -12.401 -0.077
521 HB3 SER 69 3HB SER 69 19.348 -11.231 0.622
522 HG SER 69 HG SER 69 20.045 -13.916 0.073