NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
281658 |
2kt8   |
16688 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 1H ALA 1 7.575 8.794 11.587
2 H2 ALA 1 2H ALA 1 8.881 9.545 12.372
3 H3 ALA 1 3H ALA 1 8.528 7.911 12.677
4 HA ALA 1 HA ALA 1 9.919 9.136 10.431
5 HB1 ALA 1 3HB ALA 1 10.062 6.337 11.576
6 HB2 ALA 1 1HB ALA 1 10.943 7.702 12.264
7 HB3 ALA 1 2HB ALA 1 11.281 7.174 10.615
8 H GLU 2 H GLU 2 8.700 9.196 8.600
9 HA GLU 2 HA GLU 2 6.664 7.251 7.958
10 HB2 GLU 2 1HB GLU 2 8.089 9.299 6.240
11 HB3 GLU 2 2HB GLU 2 6.688 8.366 5.715
12 HG2 GLU 2 1HG GLU 2 6.734 10.177 8.146
13 HG3 GLU 2 2HG GLU 2 6.075 10.629 6.572
14 H LYS 3 H LYS 3 6.717 5.640 6.326
15 HA LYS 3 HA LYS 3 9.461 4.773 5.459
16 HB2 LYS 3 1HB LYS 3 7.160 3.081 6.466
17 HB3 LYS 3 2HB LYS 3 8.617 2.425 5.720
18 HG2 LYS 3 1HG LYS 3 9.992 3.496 7.466
19 HG3 LYS 3 2HG LYS 3 8.535 4.151 8.212
20 HD2 LYS 3 1HD LYS 3 7.697 1.881 8.617
21 HD3 LYS 3 2HD LYS 3 9.119 1.202 7.824
22 HE2 LYS 3 1HE LYS 3 9.400 1.176 10.270
23 HE3 LYS 3 2HE LYS 3 10.570 2.262 9.521
24 HZ1 LYS 3 3HZ LYS 3 9.249 3.078 11.548
25 HZ2 LYS 3 1HZ LYS 3 7.966 3.279 10.457
26 HZ3 LYS 3 2HZ LYS 3 9.421 4.124 10.220
27 H THR 4 H THR 4 9.589 3.988 3.357
28 HA THR 4 HA THR 4 7.094 4.219 1.701
29 HB THR 4 HB THR 4 8.706 4.759 -0.173
30 HG1 THR 4 HG1 THR 4 10.545 3.903 0.987
31 HG21 THR 4 3HG2 THR 4 8.816 6.651 2.188
32 HG22 THR 4 1HG2 THR 4 7.406 6.464 1.146
33 HG23 THR 4 2HG2 THR 4 8.919 7.079 0.481
34 H GLY 5 H GLY 5 6.437 2.347 0.899
35 HA2 GLY 5 1HA GLY 5 8.338 0.060 0.710
36 HA3 GLY 5 2HA GLY 5 6.586 -0.068 0.778
37 H ILE 6 H ILE 6 8.803 -0.884 -1.245
38 HA ILE 6 HA ILE 6 7.909 0.525 -3.679
39 HB ILE 6 HB ILE 6 9.757 -1.862 -3.447
40 HG12 ILE 6 1HG1 ILE 6 10.669 -0.114 -2.036
41 HG13 ILE 6 2HG1 ILE 6 11.584 -0.121 -3.541
42 HG21 ILE 6 1HG2 ILE 6 8.869 -1.328 -5.704
43 HG22 ILE 6 2HG2 ILE 6 10.608 -1.054 -5.598
44 HG23 ILE 6 3HG2 ILE 6 9.495 0.313 -5.544
45 HD11 ILE 6 3HD1 ILE 6 9.908 1.687 -4.339
46 HD12 ILE 6 1HD1 ILE 6 11.128 2.167 -3.161
47 HD13 ILE 6 2HD1 ILE 6 9.479 1.843 -2.635
48 H VAL 7 H VAL 7 6.202 -0.135 -4.822
49 HA VAL 7 HA VAL 7 4.784 -2.577 -4.158
50 HB VAL 7 HB VAL 7 4.425 -0.554 -6.382
51 HG11 VAL 7 1HG1 VAL 7 2.098 -1.641 -6.478
52 HG12 VAL 7 2HG1 VAL 7 2.814 -2.990 -5.597
53 HG13 VAL 7 3HG1 VAL 7 3.424 -2.557 -7.194
54 HG21 VAL 7 3HG2 VAL 7 2.691 -1.035 -3.951
55 HG22 VAL 7 1HG2 VAL 7 2.726 0.379 -5.004
56 HG23 VAL 7 2HG2 VAL 7 4.067 0.068 -3.902
57 H ASN 8 H ASN 8 4.888 -4.532 -5.151
58 HA ASN 8 HA ASN 8 6.468 -4.774 -7.688
59 HB2 ASN 8 1HB ASN 8 7.795 -5.537 -5.736
60 HB3 ASN 8 2HB ASN 8 6.509 -6.673 -5.324
61 HD21 ASN 8 2HD2 ASN 8 7.395 -8.697 -5.866
62 HD22 ASN 8 1HD2 ASN 8 8.055 -9.072 -7.384
63 H VAL 9 H VAL 9 4.764 -5.107 -9.082
64 HA VAL 9 HA VAL 9 3.121 -7.556 -8.610
65 HB VAL 9 HB VAL 9 1.145 -6.358 -9.572
66 HG11 VAL 9 1HG1 VAL 9 1.675 -6.599 -7.060
67 HG12 VAL 9 2HG1 VAL 9 0.503 -5.364 -7.515
68 HG13 VAL 9 3HG1 VAL 9 2.160 -4.904 -7.124
69 HG21 VAL 9 3HG2 VAL 9 1.276 -3.817 -9.437
70 HG22 VAL 9 1HG2 VAL 9 2.186 -4.547 -10.759
71 HG23 VAL 9 2HG2 VAL 9 3.025 -3.995 -9.310
72 H SER 10 H SER 10 2.208 -8.420 -10.605
73 HA SER 10 HA SER 10 4.119 -8.197 -12.825
74 HB2 SER 10 1HB SER 10 2.881 -10.095 -13.758
75 HB3 SER 10 2HB SER 10 3.214 -10.394 -12.053
76 HG SER 10 HG SER 10 1.128 -10.660 -11.947
77 H SER 11 H SER 11 1.229 -6.675 -11.931
78 HA SER 11 HA SER 11 0.965 -5.502 -14.648
79 HB2 SER 11 1HB SER 11 -1.507 -5.815 -14.591
80 HB3 SER 11 2HB SER 11 -0.647 -7.352 -14.673
81 HG SER 11 HG SER 11 -2.406 -6.664 -12.904
82 H SER 12 H SER 12 -0.932 -5.515 -11.616
83 HA SER 12 HA SER 12 -0.116 -2.754 -11.034
84 HB2 SER 12 1HB SER 12 -2.508 -1.945 -11.044
85 HB3 SER 12 2HB SER 12 -1.851 -2.279 -12.645
86 HG SER 12 HG SER 12 -3.425 -3.642 -12.849
87 H LEU 13 H LEU 13 -1.194 -1.996 -8.973
88 HA LEU 13 HA LEU 13 -1.772 -4.344 -7.202
89 HB2 LEU 13 1HB LEU 13 0.314 -3.172 -6.631
90 HB3 LEU 13 2HB LEU 13 -0.563 -1.647 -6.517
91 HG LEU 13 HG LEU 13 -1.912 -2.539 -4.659
92 HD11 LEU 13 1HD1 LEU 13 -0.442 -5.068 -5.363
93 HD12 LEU 13 2HD1 LEU 13 -2.142 -4.838 -4.958
94 HD13 LEU 13 3HD1 LEU 13 -0.924 -4.802 -3.686
95 HD21 LEU 13 3HD2 LEU 13 -0.213 -2.484 -2.986
96 HD22 LEU 13 1HD2 LEU 13 0.385 -1.481 -4.308
97 HD23 LEU 13 2HD2 LEU 13 1.003 -3.120 -4.094
98 H ASN 14 H ASN 14 -3.718 -4.395 -6.230
99 HA ASN 14 HA ASN 14 -5.616 -2.190 -6.687
100 HB2 ASN 14 1HB ASN 14 -5.885 -4.918 -5.402
101 HB3 ASN 14 2HB ASN 14 -7.218 -3.769 -5.532
102 HD21 ASN 14 2HD2 ASN 14 -7.267 -2.802 -7.997
103 HD22 ASN 14 1HD2 ASN 14 -7.224 -4.005 -9.194
104 H VAL 15 H VAL 15 -6.557 -0.956 -5.040
105 HA VAL 15 HA VAL 15 -5.166 -1.049 -2.383
106 HB VAL 15 HB VAL 15 -6.427 1.231 -3.926
107 HG11 VAL 15 1HG1 VAL 15 -5.544 1.039 -1.038
108 HG12 VAL 15 2HG1 VAL 15 -7.078 1.635 -1.669
109 HG13 VAL 15 3HG1 VAL 15 -5.606 2.582 -1.890
110 HG21 VAL 15 3HG2 VAL 15 -4.141 0.667 -4.576
111 HG22 VAL 15 1HG2 VAL 15 -3.633 0.657 -2.888
112 HG23 VAL 15 2HG2 VAL 15 -4.120 2.170 -3.654
113 H ARG 16 H ARG 16 -6.397 -1.480 -0.644
114 HA ARG 16 HA ARG 16 -9.373 -1.574 -0.985
115 HB2 ARG 16 1HB ARG 16 -7.501 -3.115 0.827
116 HB3 ARG 16 2HB ARG 16 -9.260 -3.182 0.953
117 HG2 ARG 16 1HG ARG 16 -9.409 -3.979 -1.369
118 HG3 ARG 16 2HG ARG 16 -7.655 -3.886 -1.524
119 HD2 ARG 16 1HD ARG 16 -7.400 -5.545 0.278
120 HD3 ARG 16 2HD ARG 16 -9.150 -5.624 0.458
121 HE ARG 16 HE ARG 16 -9.278 -6.873 -1.569
122 HH11 ARG 16 1HH2 ARG 16 -6.105 -5.662 -0.935
123 HH12 ARG 16 2HH2 ARG 16 -5.353 -6.648 -2.142
124 HH21 ARG 16 1HH1 ARG 16 -8.308 -8.156 -3.136
125 HH22 ARG 16 2HH1 ARG 16 -6.597 -8.057 -3.388
126 H GLU 17 H GLU 17 -10.662 -0.648 0.592
127 HA GLU 17 HA GLU 17 -9.393 1.453 2.232
128 HB2 GLU 17 1HB GLU 17 -11.449 1.916 0.894
129 HB3 GLU 17 2HB GLU 17 -12.310 0.710 1.850
130 HG2 GLU 17 1HG GLU 17 -11.951 1.997 3.883
131 HG3 GLU 17 2HG GLU 17 -10.969 3.168 3.005
132 H GLY 18 H GLY 18 -10.554 -1.748 2.549
133 HA2 GLY 18 1HA GLY 18 -10.969 -1.508 5.487
134 HA3 GLY 18 2HA GLY 18 -11.354 -2.920 4.501
135 H ALA 19 H ALA 19 -10.100 -4.544 5.248
136 HA ALA 19 HA ALA 19 -7.167 -4.254 5.113
137 HB1 ALA 19 3HB ALA 19 -7.789 -3.591 7.451
138 HB2 ALA 19 1HB ALA 19 -6.813 -5.060 7.402
139 HB3 ALA 19 2HB ALA 19 -8.555 -5.165 7.656
140 H SER 20 H SER 20 -10.005 -5.965 4.698
141 HA SER 20 HA SER 20 -8.905 -8.663 5.009
142 HB2 SER 20 1HB SER 20 -11.053 -9.439 4.518
143 HB3 SER 20 2HB SER 20 -11.393 -7.865 5.232
144 HG SER 20 HG SER 20 -12.498 -7.851 3.359
145 H THR 21 H THR 21 -9.200 -10.195 3.068
146 HA THR 21 HA THR 21 -7.440 -9.377 0.952
147 HB THR 21 HB THR 21 -8.086 -11.565 -0.069
148 HG1 THR 21 HG1 THR 21 -10.294 -11.400 0.712
149 HG21 THR 21 3HG2 THR 21 -6.411 -11.325 1.834
150 HG22 THR 21 1HG2 THR 21 -7.135 -12.924 1.656
151 HG23 THR 21 2HG2 THR 21 -7.706 -11.833 2.918
152 H SER 22 H SER 22 -10.946 -9.429 1.258
153 HA SER 22 HA SER 22 -11.132 -8.010 -1.366
154 HB2 SER 22 1HB SER 22 -12.959 -10.271 -0.498
155 HB3 SER 22 2HB SER 22 -13.087 -9.349 -1.993
156 HG SER 22 HG SER 22 -10.953 -11.036 -1.165
157 H SER 23 H SER 23 -11.130 -6.497 0.758
158 HA SER 23 HA SER 23 -13.720 -6.259 2.084
159 HB2 SER 23 1HB SER 23 -11.200 -4.612 2.019
160 HB3 SER 23 2HB SER 23 -12.651 -3.998 2.804
161 HG SER 23 HG SER 23 -11.754 -5.092 4.405
162 H LYS 24 H LYS 24 -12.050 -3.624 0.393
163 HA LYS 24 HA LYS 24 -14.251 -3.319 -1.523
164 HB2 LYS 24 1HB LYS 24 -15.148 -2.262 0.544
165 HB3 LYS 24 2HB LYS 24 -13.764 -1.168 0.558
166 HG2 LYS 24 1HG LYS 24 -14.414 -0.284 -1.638
167 HG3 LYS 24 2HG LYS 24 -15.769 -1.412 -1.707
168 HD2 LYS 24 1HD LYS 24 -16.733 -0.377 0.318
169 HD3 LYS 24 2HD LYS 24 -15.385 0.760 0.375
170 HE2 LYS 24 1HE LYS 24 -17.315 1.815 -0.704
171 HE3 LYS 24 2HE LYS 24 -16.019 1.591 -1.879
172 HZ1 LYS 24 3HZ LYS 24 -18.642 0.467 -1.839
173 HZ2 LYS 24 1HZ LYS 24 -17.451 -0.733 -1.983
174 HZ3 LYS 24 2HZ LYS 24 -17.516 0.537 -3.109
175 H VAL 25 H VAL 25 -13.103 -2.957 -3.336
176 HA VAL 25 HA VAL 25 -10.488 -1.646 -3.258
177 HB VAL 25 HB VAL 25 -12.202 -2.619 -5.562
178 HG11 VAL 25 1HG1 VAL 25 -9.412 -1.457 -5.450
179 HG12 VAL 25 2HG1 VAL 25 -10.761 -0.951 -6.467
180 HG13 VAL 25 3HG1 VAL 25 -9.947 -2.484 -6.781
181 HG21 VAL 25 3HG2 VAL 25 -9.709 -3.778 -4.276
182 HG22 VAL 25 1HG2 VAL 25 -10.625 -4.493 -5.603
183 HG23 VAL 25 2HG2 VAL 25 -11.349 -4.365 -4.000
184 H ILE 26 H ILE 26 -10.135 0.485 -3.578
185 HA ILE 26 HA ILE 26 -12.400 2.196 -4.535
186 HB ILE 26 HB ILE 26 -11.273 4.023 -3.290
187 HG12 ILE 26 1HG1 ILE 26 -9.411 1.835 -2.297
188 HG13 ILE 26 2HG1 ILE 26 -8.953 3.061 -3.478
189 HG21 ILE 26 1HG2 ILE 26 -11.903 3.270 -1.094
190 HG22 ILE 26 2HG2 ILE 26 -11.637 1.582 -1.533
191 HG23 ILE 26 3HG2 ILE 26 -12.983 2.475 -2.239
192 HD11 ILE 26 3HD1 ILE 26 -8.224 3.813 -1.295
193 HD12 ILE 26 1HD1 ILE 26 -9.830 3.537 -0.619
194 HD13 ILE 26 2HD1 ILE 26 -9.579 4.821 -1.801
195 H GLY 27 H GLY 27 -9.467 0.872 -5.482
196 HA2 GLY 27 1HA GLY 27 -9.320 2.085 -7.973
197 HA3 GLY 27 2HA GLY 27 -8.408 3.167 -6.921
198 H SER 28 H SER 28 -6.505 2.588 -8.202
199 HA SER 28 HA SER 28 -5.136 0.227 -7.085
200 HB2 SER 28 1HB SER 28 -4.567 -0.735 -9.242
201 HB3 SER 28 2HB SER 28 -6.322 -0.622 -9.125
202 HG SER 28 HG SER 28 -6.277 1.168 -10.429
203 H LEU 29 H LEU 29 -2.816 0.215 -7.752
204 HA LEU 29 HA LEU 29 -1.810 2.947 -8.478
205 HB2 LEU 29 1HB LEU 29 -0.685 1.038 -6.407
206 HB3 LEU 29 2HB LEU 29 0.031 2.584 -6.865
207 HG LEU 29 HG LEU 29 -2.740 2.227 -5.678
208 HD11 LEU 29 1HD1 LEU 29 -0.154 3.245 -4.459
209 HD12 LEU 29 2HD1 LEU 29 -0.983 1.746 -4.039
210 HD13 LEU 29 3HD1 LEU 29 -1.732 3.300 -3.674
211 HD21 LEU 29 3HD2 LEU 29 -1.177 4.598 -6.694
212 HD22 LEU 29 1HD2 LEU 29 -2.303 4.819 -5.353
213 HD23 LEU 29 2HD2 LEU 29 -2.888 4.221 -6.901
214 H SER 30 H SER 30 0.154 2.980 -9.623
215 HA SER 30 HA SER 30 0.532 0.778 -11.448
216 HB2 SER 30 1HB SER 30 0.962 3.029 -12.199
217 HB3 SER 30 2HB SER 30 2.140 3.281 -10.915
218 HG SER 30 HG SER 30 3.562 2.068 -11.961
219 H GLY 31 H GLY 31 2.580 -0.352 -11.769
220 HA2 GLY 31 1HA GLY 31 3.540 -1.575 -9.356
221 HA3 GLY 31 2HA GLY 31 4.211 -1.824 -10.964
222 H ASN 32 H ASN 32 5.777 -1.631 -8.638
223 HA ASN 32 HA ASN 32 7.686 -0.576 -7.812
224 HB2 ASN 32 1HB ASN 32 7.567 0.675 -10.574
225 HB3 ASN 32 2HB ASN 32 8.894 0.944 -9.449
226 HD21 ASN 32 2HD2 ASN 32 9.253 -0.398 -11.981
227 HD22 ASN 32 1HD2 ASN 32 9.688 -2.006 -11.657
228 H THR 33 H THR 33 4.829 0.918 -8.127
229 HA THR 33 HA THR 33 5.529 3.689 -7.694
230 HB THR 33 HB THR 33 2.978 2.219 -6.985
231 HG1 THR 33 HG1 THR 33 2.902 3.854 -9.116
232 HG21 THR 33 3HG2 THR 33 2.009 4.538 -7.189
233 HG22 THR 33 1HG2 THR 33 3.658 5.159 -7.247
234 HG23 THR 33 2HG2 THR 33 3.081 4.323 -5.806
235 H LYS 34 H LYS 34 5.962 4.758 -5.834
236 HA LYS 34 HA LYS 34 6.521 3.175 -3.431
237 HB2 LYS 34 1HB LYS 34 6.846 6.103 -4.111
238 HB3 LYS 34 2HB LYS 34 7.307 5.408 -2.556
239 HG2 LYS 34 1HG LYS 34 8.877 3.903 -3.637
240 HG3 LYS 34 2HG LYS 34 8.340 4.434 -5.230
241 HD2 LYS 34 1HD LYS 34 10.414 5.583 -4.681
242 HD3 LYS 34 2HD LYS 34 9.092 6.748 -4.673
243 HE2 LYS 34 1HE LYS 34 9.838 5.378 -2.102
244 HE3 LYS 34 2HE LYS 34 10.825 6.717 -2.683
245 HZ1 LYS 34 3HZ LYS 34 8.272 7.592 -3.017
246 HZ2 LYS 34 1HZ LYS 34 9.316 8.030 -1.754
247 HZ3 LYS 34 2HZ LYS 34 8.205 6.762 -1.537
248 H VAL 35 H VAL 35 5.391 3.257 -1.509
249 HA VAL 35 HA VAL 35 2.962 5.022 -1.404
250 HB VAL 35 HB VAL 35 1.813 3.167 -0.204
251 HG11 VAL 35 1HG1 VAL 35 1.308 1.904 -2.196
252 HG12 VAL 35 2HG1 VAL 35 2.866 2.315 -2.913
253 HG13 VAL 35 3HG1 VAL 35 1.640 3.563 -2.694
254 HG21 VAL 35 3HG2 VAL 35 2.866 0.866 -0.545
255 HG22 VAL 35 1HG2 VAL 35 3.648 1.884 0.664
256 HG23 VAL 35 2HG2 VAL 35 4.367 1.704 -0.937
257 H THR 36 H THR 36 2.835 6.226 0.404
258 HA THR 36 HA THR 36 4.964 6.044 2.396
259 HB THR 36 HB THR 36 3.499 7.952 3.446
260 HG1 THR 36 HG1 THR 36 2.489 8.109 0.837
261 HG21 THR 36 3HG2 THR 36 4.293 9.515 1.551
262 HG22 THR 36 1HG2 THR 36 4.952 8.060 0.803
263 HG23 THR 36 2HG2 THR 36 5.521 8.570 2.394
264 H ILE 37 H ILE 37 4.852 4.996 4.290
265 HA ILE 37 HA ILE 37 2.201 3.935 5.200
266 HB ILE 37 HB ILE 37 5.013 2.884 5.598
267 HG12 ILE 37 1HG1 ILE 37 2.604 1.603 4.285
268 HG13 ILE 37 2HG1 ILE 37 3.820 2.509 3.386
269 HG21 ILE 37 1HG2 ILE 37 3.733 0.955 6.701
270 HG22 ILE 37 2HG2 ILE 37 2.366 2.066 6.806
271 HG23 ILE 37 3HG2 ILE 37 3.874 2.440 7.641
272 HD11 ILE 37 3HD1 ILE 37 4.284 0.076 3.356
273 HD12 ILE 37 1HD1 ILE 37 4.375 0.082 5.117
274 HD13 ILE 37 2HD1 ILE 37 5.568 0.971 4.170
275 H VAL 38 H VAL 38 1.466 4.664 7.098
276 HA VAL 38 HA VAL 38 3.304 6.230 8.868
277 HB VAL 38 HB VAL 38 1.261 7.355 9.677
278 HG11 VAL 38 1HG1 VAL 38 2.395 8.356 7.778
279 HG12 VAL 38 2HG1 VAL 38 0.655 8.496 7.526
280 HG13 VAL 38 3HG1 VAL 38 1.575 7.263 6.663
281 HG21 VAL 38 3HG2 VAL 38 -0.882 6.923 8.425
282 HG22 VAL 38 1HG2 VAL 38 -0.361 5.562 9.418
283 HG23 VAL 38 2HG2 VAL 38 -0.107 5.529 7.673
284 H GLY 39 H GLY 39 1.858 3.243 8.579
285 HA2 GLY 39 1HA GLY 39 2.511 2.435 11.227
286 HA3 GLY 39 2HA GLY 39 0.786 2.791 11.186
287 H GLU 40 H GLU 40 1.224 0.273 11.766
288 HA GLU 40 HA GLU 40 0.676 -1.227 9.240
289 HB2 GLU 40 1HB GLU 40 2.958 -1.771 9.898
290 HB3 GLU 40 2HB GLU 40 2.437 -2.096 11.551
291 HG2 GLU 40 1HG GLU 40 1.168 -3.594 9.267
292 HG3 GLU 40 2HG GLU 40 2.740 -4.102 9.871
293 H GLU 41 H GLU 41 -0.685 -3.083 9.559
294 HA GLU 41 HA GLU 41 -1.872 -3.541 12.196
295 HB2 GLU 41 1HB GLU 41 -3.144 -1.569 11.299
296 HB3 GLU 41 2HB GLU 41 -3.629 -2.561 9.924
297 HG2 GLU 41 1HG GLU 41 -5.420 -2.645 11.538
298 HG3 GLU 41 2HG GLU 41 -4.612 -4.211 11.576
299 H GLY 42 H GLY 42 -1.884 -5.691 12.264
300 HA2 GLY 42 1HA GLY 42 -2.235 -7.921 11.667
301 HA3 GLY 42 2HA GLY 42 -3.367 -7.329 10.457
302 H ALA 43 H ALA 43 -2.744 -8.632 8.767
303 HA ALA 43 HA ALA 43 0.104 -8.787 7.996
304 HB1 ALA 43 3HB ALA 43 -2.414 -10.073 6.906
305 HB2 ALA 43 1HB ALA 43 -1.153 -10.852 7.861
306 HB3 ALA 43 2HB ALA 43 -0.814 -10.328 6.210
307 H PHE 44 H PHE 44 -1.733 -6.325 7.784
308 HA PHE 44 HA PHE 44 -1.134 -5.724 4.909
309 HB2 PHE 44 1HB PHE 44 -3.588 -4.864 6.465
310 HB3 PHE 44 2HB PHE 44 -3.204 -4.402 4.807
311 HD1 PHE 44 HD1 PHE 44 -4.098 -7.242 7.015
312 HD2 PHE 44 HD2 PHE 44 -3.526 -5.920 2.971
313 HE1 PHE 44 HE1 PHE 44 -5.160 -9.323 6.183
314 HE2 PHE 44 HE2 PHE 44 -4.582 -8.000 2.137
315 HZ PHE 44 HZ PHE 44 -5.401 -9.703 3.743
316 H TYR 45 H TYR 45 -0.544 -3.567 4.483
317 HA TYR 45 HA TYR 45 0.434 -2.083 6.882
318 HB2 TYR 45 1HB TYR 45 1.243 -2.096 3.972
319 HB3 TYR 45 2HB TYR 45 1.777 -0.829 5.076
320 HD1 TYR 45 HD1 TYR 45 2.674 -1.759 7.426
321 HD2 TYR 45 HD2 TYR 45 2.636 -3.966 3.742
322 HE1 TYR 45 HE1 TYR 45 4.458 -3.237 8.297
323 HE2 TYR 45 HE2 TYR 45 4.429 -5.445 4.613
324 HH TYR 45 HH TYR 45 6.056 -5.590 6.251
325 H LYS 46 H LYS 46 -0.191 -0.003 7.273
326 HA LYS 46 HA LYS 46 -2.547 0.979 5.774
327 HB2 LYS 46 1HB LYS 46 -2.571 0.967 8.256
328 HB3 LYS 46 2HB LYS 46 -1.191 2.064 8.260
329 HG2 LYS 46 1HG LYS 46 -2.503 3.761 7.069
330 HG3 LYS 46 2HG LYS 46 -3.879 2.662 6.990
331 HD2 LYS 46 1HD LYS 46 -3.978 2.616 9.459
332 HD3 LYS 46 2HD LYS 46 -2.614 3.734 9.529
333 HE2 LYS 46 1HE LYS 46 -3.925 5.415 8.283
334 HE3 LYS 46 2HE LYS 46 -5.289 4.300 8.214
335 HZ1 LYS 46 3HZ LYS 46 -4.572 6.053 10.284
336 HZ2 LYS 46 1HZ LYS 46 -4.456 4.466 10.869
337 HZ3 LYS 46 2HZ LYS 46 -5.915 5.016 10.194
338 H ILE 47 H ILE 47 -2.403 2.610 4.316
339 HA ILE 47 HA ILE 47 0.078 4.287 4.285
340 HB ILE 47 HB ILE 47 -0.169 4.276 1.764
341 HG12 ILE 47 1HG1 ILE 47 -1.873 1.825 2.287
342 HG13 ILE 47 2HG1 ILE 47 -2.563 3.397 1.879
343 HG21 ILE 47 1HG2 ILE 47 1.592 2.985 2.701
344 HG22 ILE 47 2HG2 ILE 47 0.758 1.891 1.597
345 HG23 ILE 47 3HG2 ILE 47 0.474 1.775 3.333
346 HD11 ILE 47 3HD1 ILE 47 -2.185 1.822 -0.092
347 HD12 ILE 47 1HD1 ILE 47 -0.456 2.044 0.178
348 HD13 ILE 47 2HD1 ILE 47 -1.465 3.425 -0.252
349 H GLU 48 H GLU 48 -0.189 6.384 3.338
350 HA GLU 48 HA GLU 48 -2.800 7.554 3.981
351 HB2 GLU 48 1HB GLU 48 -0.686 8.703 4.566
352 HB3 GLU 48 2HB GLU 48 -0.291 8.831 2.853
353 HG2 GLU 48 1HG GLU 48 -2.296 10.185 2.465
354 HG3 GLU 48 2HG GLU 48 -2.758 10.016 4.159
355 H TYR 49 H TYR 49 -4.274 6.897 2.422
356 HA TYR 49 HA TYR 49 -3.606 7.099 -0.434
357 HB2 TYR 49 1HB TYR 49 -5.014 5.249 0.335
358 HB3 TYR 49 2HB TYR 49 -6.204 6.393 0.956
359 HD1 TYR 49 HD2 TYR 49 -4.446 5.323 -2.156
360 HD2 TYR 49 HD1 TYR 49 -7.863 7.305 -0.471
361 HE1 TYR 49 HE2 TYR 49 -5.473 5.463 -4.408
362 HE2 TYR 49 HE1 TYR 49 -8.890 7.447 -2.724
363 HH TYR 49 HH TYR 49 -8.046 5.654 -5.244
364 H LYS 50 H LYS 50 -4.473 8.600 -1.857
365 HA LYS 50 HA LYS 50 -5.031 11.210 -0.809
366 HB2 LYS 50 1HB LYS 50 -5.382 10.040 -3.579
367 HB3 LYS 50 2HB LYS 50 -5.557 11.756 -3.204
368 HG2 LYS 50 1HG LYS 50 -3.245 11.812 -2.348
369 HG3 LYS 50 2HG LYS 50 -3.067 10.095 -2.706
370 HD2 LYS 50 1HD LYS 50 -3.504 10.575 -5.108
371 HD3 LYS 50 2HD LYS 50 -3.591 12.295 -4.727
372 HE2 LYS 50 1HE LYS 50 -1.179 10.547 -4.157
373 HE3 LYS 50 2HE LYS 50 -1.338 11.587 -5.573
374 HZ1 LYS 50 3HZ LYS 50 -1.879 13.359 -3.740
375 HZ2 LYS 50 1HZ LYS 50 -0.276 12.991 -4.154
376 HZ3 LYS 50 2HZ LYS 50 -0.969 12.311 -2.759
377 H GLY 51 H GLY 51 -6.854 11.350 0.437
378 HA2 GLY 51 1HA GLY 51 -9.241 12.056 0.196
379 HA3 GLY 51 2HA GLY 51 -9.480 10.647 -0.839
380 H SER 52 H SER 52 -7.615 9.095 1.036
381 HA SER 52 HA SER 52 -8.942 9.019 3.610
382 HB2 SER 52 1HB SER 52 -10.681 8.009 2.056
383 HB3 SER 52 2HB SER 52 -9.544 6.692 1.779
384 HG SER 52 HG SER 52 -10.072 7.442 4.414
385 H HIS 53 H HIS 53 -8.567 6.190 4.046
386 HA HIS 53 HA HIS 53 -5.573 6.064 3.983
387 HB2 HIS 53 1HB HIS 53 -7.574 4.746 5.833
388 HB3 HIS 53 2HB HIS 53 -5.828 4.508 5.905
389 HD1 HIS 53 HD1 HIS 53 -4.409 6.837 6.210
390 HD2 HIS 53 HD2 HIS 53 -8.437 6.950 7.277
391 HE1 HIS 53 HE1 HIS 53 -4.703 8.882 7.673
392 H GLY 54 H GLY 54 -4.723 4.612 2.633
393 HA2 GLY 54 1HA GLY 54 -6.438 2.511 1.444
394 HA3 GLY 54 2HA GLY 54 -4.836 2.984 0.885
395 H TYR 55 H TYR 55 -5.916 0.299 1.547
396 HA TYR 55 HA TYR 55 -3.840 -0.493 3.566
397 HB2 TYR 55 1HB TYR 55 -6.648 -1.566 3.205
398 HB3 TYR 55 2HB TYR 55 -5.412 -2.370 4.175
399 HD1 TYR 55 HD1 TYR 55 -4.410 -1.187 6.144
400 HD2 TYR 55 HD2 TYR 55 -7.794 0.375 4.015
401 HE1 TYR 55 HE1 TYR 55 -4.915 0.314 8.052
402 HE2 TYR 55 HE2 TYR 55 -8.303 1.876 5.923
403 HH TYR 55 HH TYR 55 -7.848 2.280 8.114
404 H VAL 56 H VAL 56 -2.452 -2.032 2.836
405 HA VAL 56 HA VAL 56 -3.264 -3.716 0.503
406 HB VAL 56 HB VAL 56 -0.985 -3.346 -0.480
407 HG11 VAL 56 1HG1 VAL 56 -2.941 -2.168 -1.363
408 HG12 VAL 56 2HG1 VAL 56 -1.535 -1.103 -1.393
409 HG13 VAL 56 3HG1 VAL 56 -2.760 -0.912 -0.138
410 HG21 VAL 56 3HG2 VAL 56 0.238 -1.315 0.276
411 HG22 VAL 56 1HG2 VAL 56 0.153 -2.541 1.540
412 HG23 VAL 56 2HG2 VAL 56 -0.912 -1.137 1.601
413 H ALA 57 H ALA 57 -2.106 -5.682 0.338
414 HA ALA 57 HA ALA 57 -1.350 -6.827 2.886
415 HB1 ALA 57 3HB ALA 57 -1.242 -8.886 1.740
416 HB2 ALA 57 1HB ALA 57 -0.885 -8.104 0.199
417 HB3 ALA 57 2HB ALA 57 -2.499 -7.980 0.898
418 H LYS 58 H LYS 58 0.693 -7.678 3.479
419 HA LYS 58 HA LYS 58 2.968 -6.064 2.771
420 HB2 LYS 58 1HB LYS 58 4.241 -7.750 4.128
421 HB3 LYS 58 2HB LYS 58 2.831 -7.100 4.963
422 HG2 LYS 58 1HG LYS 58 1.553 -9.076 4.568
423 HG3 LYS 58 2HG LYS 58 2.707 -9.680 3.381
424 HD2 LYS 58 1HD LYS 58 3.017 -10.876 5.491
425 HD3 LYS 58 2HD LYS 58 4.423 -9.859 5.178
426 HE2 LYS 58 1HE LYS 58 3.759 -8.248 6.779
427 HE3 LYS 58 2HE LYS 58 2.113 -8.872 6.847
428 HZ1 LYS 58 3HZ LYS 58 3.214 -9.635 8.771
429 HZ2 LYS 58 1HZ LYS 58 4.578 -10.137 7.896
430 HZ3 LYS 58 2HZ LYS 58 3.109 -10.976 7.733
431 H GLU 59 H GLU 59 1.636 -8.932 1.392
432 HA GLU 59 HA GLU 59 4.013 -10.044 0.249
433 HB2 GLU 59 1HB GLU 59 1.855 -11.253 0.422
434 HB3 GLU 59 2HB GLU 59 1.176 -10.170 -0.793
435 HG2 GLU 59 1HG GLU 59 2.807 -10.930 -2.442
436 HG3 GLU 59 2HG GLU 59 3.589 -11.950 -1.234
437 H TYR 60 H TYR 60 1.859 -7.470 -0.846
438 HA TYR 60 HA TYR 60 3.229 -7.311 -3.460
439 HB2 TYR 60 1HB TYR 60 1.123 -5.512 -2.224
440 HB3 TYR 60 2HB TYR 60 1.662 -5.466 -3.903
441 HD1 TYR 60 HD1 TYR 60 1.638 -7.880 -5.094
442 HD2 TYR 60 HD2 TYR 60 -0.830 -6.725 -1.771
443 HE1 TYR 60 HE1 TYR 60 0.021 -9.665 -5.676
444 HE2 TYR 60 HE2 TYR 60 -2.448 -8.513 -2.356
445 HH TYR 60 HH TYR 60 -3.014 -9.780 -4.713
446 H ILE 61 H ILE 61 4.033 -6.406 -0.413
447 HA ILE 61 HA ILE 61 5.344 -3.848 -1.271
448 HB ILE 61 HB ILE 61 4.888 -4.895 1.535
449 HG12 ILE 61 1HG1 ILE 61 2.738 -4.408 0.519
450 HG13 ILE 61 2HG1 ILE 61 3.136 -3.094 1.619
451 HG21 ILE 61 1HG2 ILE 61 6.779 -3.345 1.334
452 HG22 ILE 61 2HG2 ILE 61 5.433 -2.557 2.160
453 HG23 ILE 61 3HG2 ILE 61 5.759 -2.201 0.464
454 HD11 ILE 61 3HD1 ILE 61 3.144 -3.109 -1.391
455 HD12 ILE 61 1HD1 ILE 61 4.167 -1.966 -0.522
456 HD13 ILE 61 2HD1 ILE 61 2.421 -1.938 -0.292
457 H LYS 62 H LYS 62 7.476 -3.872 -1.571
458 HA LYS 62 HA LYS 62 9.130 -5.907 -0.150
459 HB2 LYS 62 1HB LYS 62 8.562 -6.797 -2.405
460 HB3 LYS 62 2HB LYS 62 9.287 -5.358 -3.123
461 HG2 LYS 62 1HG LYS 62 11.451 -5.904 -2.156
462 HG3 LYS 62 2HG LYS 62 10.754 -7.269 -1.286
463 HD2 LYS 62 1HD LYS 62 11.819 -8.177 -3.237
464 HD3 LYS 62 2HD LYS 62 10.083 -8.232 -3.535
465 HE2 LYS 62 1HE LYS 62 10.162 -6.373 -5.008
466 HE3 LYS 62 2HE LYS 62 11.766 -5.895 -4.453
467 HZ1 LYS 62 3HZ LYS 62 10.989 -7.979 -6.330
468 HZ2 LYS 62 1HZ LYS 62 12.292 -8.334 -5.304
469 HZ3 LYS 62 2HZ LYS 62 12.360 -6.976 -6.324
470 H ASP 63 H ASP 63 11.289 -5.312 0.120
471 HA ASP 63 HA ASP 63 13.000 -3.805 0.592
472 HB2 ASP 63 1HB ASP 63 12.089 -2.853 -2.133
473 HB3 ASP 63 2HB ASP 63 13.488 -2.163 -1.307
474 H ILE 64 H ILE 64 11.494 -3.059 2.354
475 HA ILE 64 HA ILE 64 10.271 -0.405 1.900
476 HB ILE 64 HB ILE 64 10.388 -2.183 4.349
477 HG12 ILE 64 1HG1 ILE 64 8.056 -1.471 2.546
478 HG13 ILE 64 2HG1 ILE 64 9.015 -2.939 2.359
479 HG21 ILE 64 1HG2 ILE 64 9.108 0.509 3.834
480 HG22 ILE 64 2HG2 ILE 64 10.184 0.051 5.153
481 HG23 ILE 64 3HG2 ILE 64 8.535 -0.570 5.105
482 HD11 ILE 64 3HD1 ILE 64 8.442 -3.598 4.677
483 HD12 ILE 64 1HD1 ILE 64 6.998 -3.399 3.685
484 HD13 ILE 64 2HD1 ILE 64 7.456 -2.145 4.836
485 H LYS 65 H LYS 65 11.578 1.329 2.030
486 HA LYS 65 HA LYS 65 13.537 1.481 4.270
487 HB2 LYS 65 1HB LYS 65 14.174 1.883 1.341
488 HB3 LYS 65 2HB LYS 65 15.207 2.478 2.643
489 HG2 LYS 65 1HG LYS 65 15.397 0.181 3.536
490 HG3 LYS 65 2HG LYS 65 14.385 -0.410 2.218
491 HD2 LYS 65 1HD LYS 65 16.030 0.314 0.572
492 HD3 LYS 65 2HD LYS 65 17.019 1.041 1.840
493 HE2 LYS 65 1HE LYS 65 17.923 -1.156 1.237
494 HE3 LYS 65 2HE LYS 65 17.293 -1.195 2.883
495 HZ1 LYS 65 3HZ LYS 65 16.066 -2.907 2.234
496 HZ2 LYS 65 1HZ LYS 65 16.461 -2.677 0.601
497 HZ3 LYS 65 2HZ LYS 65 15.158 -1.830 1.286
498 H ASP 66 H ASP 66 13.996 3.605 4.926
499 HA ASP 66 HA ASP 66 11.881 5.513 4.547
500 HB2 ASP 66 1HB ASP 66 14.621 5.683 5.808
501 HB3 ASP 66 2HB ASP 66 13.509 7.052 5.784
502 H GLU 67 H GLU 67 11.799 7.358 3.294
503 HA GLU 67 HA GLU 67 14.084 8.410 1.867
504 HB2 GLU 67 1HB GLU 67 13.619 6.376 0.495
505 HB3 GLU 67 2HB GLU 67 11.978 6.963 0.221
506 HG2 GLU 67 1HG GLU 67 12.832 8.958 -0.887
507 HG3 GLU 67 2HG GLU 67 14.491 8.485 -0.524
508 H VAL 68 H VAL 68 13.042 10.166 3.159
509 HA VAL 68 HA VAL 68 10.476 11.201 2.069
510 HB VAL 68 HB VAL 68 12.185 12.246 4.346
511 HG11 VAL 68 1HG1 VAL 68 10.787 14.019 3.629
512 HG12 VAL 68 2HG1 VAL 68 9.890 13.280 4.955
513 HG13 VAL 68 3HG1 VAL 68 9.439 12.934 3.285
514 HG21 VAL 68 3HG2 VAL 68 11.249 9.912 4.651
515 HG22 VAL 68 1HG2 VAL 68 9.637 10.608 4.489
516 HG23 VAL 68 2HG2 VAL 68 10.675 11.089 5.832
517 H LEU 69 H LEU 69 13.767 11.494 1.504
518 HA LEU 69 HA LEU 69 15.044 12.987 0.240
519 HB2 LEU 69 1HB LEU 69 12.366 14.071 -0.683
520 HB3 LEU 69 2HB LEU 69 13.915 14.231 -1.508
521 HG LEU 69 HG LEU 69 12.506 11.609 -0.927
522 HD11 LEU 69 1HD1 LEU 69 12.979 12.956 -3.596
523 HD12 LEU 69 2HD1 LEU 69 11.476 13.125 -2.688
524 HD13 LEU 69 3HD1 LEU 69 11.983 11.538 -3.267
525 HD21 LEU 69 3HD2 LEU 69 14.796 11.065 -0.996
526 HD22 LEU 69 1HD2 LEU 69 15.164 12.332 -2.168
527 HD23 LEU 69 2HD2 LEU 69 14.323 10.869 -2.680
528 H GLU 70 H GLU 70 16.164 14.561 1.125
529 HA GLU 70 HA GLU 70 15.208 16.291 3.167
530 HB2 GLU 70 1HB GLU 70 17.641 16.458 1.378
531 HB3 GLU 70 2HB GLU 70 17.361 17.549 2.736
532 HG2 GLU 70 1HG GLU 70 17.277 15.647 4.280
533 HG3 GLU 70 2HG GLU 70 17.479 14.525 2.935
534 H HIS 71 H HIS 71 14.705 18.489 3.148
535 HA HIS 71 HA HIS 71 13.191 19.427 0.904
536 HB2 HIS 71 1HB HIS 71 12.862 20.047 3.335
537 HB3 HIS 71 2HB HIS 71 14.272 21.095 3.178
538 HD1 HIS 71 HD1 HIS 71 14.054 23.176 1.607
539 HD2 HIS 71 HD2 HIS 71 10.528 20.998 2.051
540 HE1 HIS 71 HE1 HIS 71 12.196 24.623 0.675
541 H HIS 72 H HIS 72 13.593 21.672 -0.025
542 HA HIS 72 HA HIS 72 14.875 22.959 -1.488
543 HB2 HIS 72 1HB HIS 72 15.743 23.766 0.699
544 HB3 HIS 72 2HB HIS 72 17.003 22.534 0.635
545 HD1 HIS 72 HD1 HIS 72 15.703 25.339 -1.618
546 HD2 HIS 72 HD2 HIS 72 19.286 23.476 -0.586
547 HE1 HIS 72 HE1 HIS 72 17.535 26.579 -2.850
548 H HIS 73 H HIS 73 14.837 21.213 -3.041
549 HA HIS 73 HA HIS 73 16.901 19.217 -3.226
550 HB2 HIS 73 1HB HIS 73 14.998 20.413 -5.250
551 HB3 HIS 73 2HB HIS 73 16.122 19.117 -5.656
552 HD1 HIS 73 HD1 HIS 73 13.171 19.857 -3.393
553 HD2 HIS 73 HD2 HIS 73 15.339 16.575 -4.775
554 HE1 HIS 73 HE1 HIS 73 11.910 17.794 -2.636
555 H HIS 74 H HIS 74 16.544 22.482 -4.551
556 HA HIS 74 HA HIS 74 18.741 22.466 -6.335
557 HB2 HIS 74 1HB HIS 74 17.030 24.276 -6.150
558 HB3 HIS 74 2HB HIS 74 17.806 24.806 -4.659
559 HD1 HIS 74 HD1 HIS 74 20.257 25.767 -4.870
560 HD2 HIS 74 HD2 HIS 74 18.375 25.009 -8.512
561 HE1 HIS 74 HE1 HIS 74 21.634 26.937 -6.644
562 H HIS 75 H HIS 75 20.856 22.220 -5.966
563 HA HIS 75 HA HIS 75 21.904 22.249 -3.235
564 HB2 HIS 75 1HB HIS 75 22.700 20.536 -4.751
565 HB3 HIS 75 2HB HIS 75 23.207 21.752 -5.924
566 HD1 HIS 75 HD1 HIS 75 23.967 20.730 -2.333
567 HD2 HIS 75 HD2 HIS 75 25.816 22.616 -5.558
568 HE1 HIS 75 HE1 HIS 75 26.366 21.148 -1.638
569 H HIS 76 H HIS 76 22.936 23.911 -2.291
570 HA HIS 76 HA HIS 76 22.965 26.540 -3.275
571 HB2 HIS 76 1HB HIS 76 24.830 25.212 -1.290
572 HB3 HIS 76 2HB HIS 76 24.686 26.957 -1.505
573 HD1 HIS 76 HD1 HIS 76 23.945 26.023 1.230
574 HD2 HIS 76 HD2 HIS 76 21.167 26.030 -1.879
575 HE1 HIS 76 HE1 HIS 76 21.655 26.058 2.313
Start of MODEL 2
1 H1 ALA 1 1H ALA 1 7.815 8.248 12.039
2 H2 ALA 1 2H ALA 1 8.270 9.683 11.254
3 H3 ALA 1 3H ALA 1 9.150 9.132 12.599
4 HA ALA 1 HA ALA 1 10.162 8.743 10.317
5 HB1 ALA 1 3HB ALA 1 11.068 6.592 11.038
6 HB2 ALA 1 1HB ALA 1 9.716 6.362 12.147
7 HB3 ALA 1 2HB ALA 1 10.890 7.644 12.442
8 H GLU 2 H GLU 2 8.464 8.892 8.683
9 HA GLU 2 HA GLU 2 6.591 6.724 8.272
10 HB2 GLU 2 1HB GLU 2 6.128 7.844 6.121
11 HB3 GLU 2 2HB GLU 2 6.137 8.998 7.453
12 HG2 GLU 2 1HG GLU 2 8.487 9.585 6.902
13 HG3 GLU 2 2HG GLU 2 8.424 8.479 5.529
14 H LYS 3 H LYS 3 6.650 5.117 6.635
15 HA LYS 3 HA LYS 3 9.382 4.520 5.528
16 HB2 LYS 3 1HB LYS 3 7.225 2.497 6.172
17 HB3 LYS 3 2HB LYS 3 8.925 2.193 5.831
18 HG2 LYS 3 1HG LYS 3 7.889 3.697 8.252
19 HG3 LYS 3 2HG LYS 3 8.408 2.014 8.258
20 HD2 LYS 3 1HD LYS 3 10.661 2.768 7.447
21 HD3 LYS 3 2HD LYS 3 10.122 4.435 7.640
22 HE2 LYS 3 1HE LYS 3 9.734 4.100 10.009
23 HE3 LYS 3 2HE LYS 3 10.151 2.392 9.863
24 HZ1 LYS 3 3HZ LYS 3 12.044 4.474 8.988
25 HZ2 LYS 3 1HZ LYS 3 12.360 2.876 9.458
26 HZ3 LYS 3 2HZ LYS 3 11.949 4.037 10.628
27 H THR 4 H THR 4 9.439 3.659 3.404
28 HA THR 4 HA THR 4 6.905 4.032 1.832
29 HB THR 4 HB THR 4 8.504 4.535 -0.084
30 HG1 THR 4 HG1 THR 4 10.281 3.695 1.479
31 HG21 THR 4 3HG2 THR 4 7.268 6.310 1.005
32 HG22 THR 4 1HG2 THR 4 8.921 6.868 0.745
33 HG23 THR 4 2HG2 THR 4 8.411 6.334 2.347
34 H GLY 5 H GLY 5 6.134 2.120 1.191
35 HA2 GLY 5 1HA GLY 5 7.964 -0.204 0.919
36 HA3 GLY 5 2HA GLY 5 6.201 -0.264 0.938
37 H ILE 6 H ILE 6 8.699 -0.825 -1.051
38 HA ILE 6 HA ILE 6 7.725 0.537 -3.454
39 HB ILE 6 HB ILE 6 9.881 -1.515 -2.910
40 HG12 ILE 6 1HG1 ILE 6 11.333 0.356 -3.635
41 HG13 ILE 6 2HG1 ILE 6 9.907 1.352 -3.911
42 HG21 ILE 6 1HG2 ILE 6 8.856 -0.453 -5.553
43 HG22 ILE 6 2HG2 ILE 6 9.144 -2.132 -5.090
44 HG23 ILE 6 3HG2 ILE 6 10.507 -1.046 -5.364
45 HD11 ILE 6 3HD1 ILE 6 10.354 0.092 -1.211
46 HD12 ILE 6 1HD1 ILE 6 9.431 1.538 -1.624
47 HD13 ILE 6 2HD1 ILE 6 11.192 1.582 -1.643
48 H VAL 7 H VAL 7 6.112 -0.201 -4.705
49 HA VAL 7 HA VAL 7 4.848 -2.767 -4.160
50 HB VAL 7 HB VAL 7 4.366 -0.657 -6.278
51 HG11 VAL 7 1HG1 VAL 7 2.122 -1.881 -6.448
52 HG12 VAL 7 2HG1 VAL 7 2.905 -3.217 -5.602
53 HG13 VAL 7 3HG1 VAL 7 3.507 -2.695 -7.174
54 HG21 VAL 7 3HG2 VAL 7 2.503 -0.016 -4.866
55 HG22 VAL 7 1HG2 VAL 7 3.960 -0.051 -3.873
56 HG23 VAL 7 2HG2 VAL 7 2.800 -1.376 -3.785
57 H ASN 8 H ASN 8 5.165 -4.661 -5.250
58 HA ASN 8 HA ASN 8 6.748 -4.585 -7.806
59 HB2 ASN 8 1HB ASN 8 8.008 -5.394 -5.718
60 HB3 ASN 8 2HB ASN 8 6.932 -6.791 -5.746
61 HD21 ASN 8 2HD2 ASN 8 8.543 -8.343 -6.393
62 HD22 ASN 8 1HD2 ASN 8 9.297 -8.292 -7.914
63 H VAL 9 H VAL 9 4.991 -4.898 -9.180
64 HA VAL 9 HA VAL 9 3.622 -7.545 -8.943
65 HB VAL 9 HB VAL 9 1.496 -6.463 -9.685
66 HG11 VAL 9 1HG1 VAL 9 0.932 -5.519 -7.495
67 HG12 VAL 9 2HG1 VAL 9 2.646 -5.333 -7.117
68 HG13 VAL 9 3HG1 VAL 9 1.952 -6.944 -7.295
69 HG21 VAL 9 3HG2 VAL 9 2.381 -4.445 -10.714
70 HG22 VAL 9 1HG2 VAL 9 3.091 -3.930 -9.184
71 HG23 VAL 9 2HG2 VAL 9 1.339 -3.973 -9.372
72 H SER 10 H SER 10 2.773 -8.301 -11.009
73 HA SER 10 HA SER 10 4.534 -7.525 -13.240
74 HB2 SER 10 1HB SER 10 2.528 -9.727 -12.763
75 HB3 SER 10 2HB SER 10 3.188 -9.437 -14.371
76 HG SER 10 HG SER 10 4.381 -10.970 -13.073
77 H SER 11 H SER 11 1.440 -6.693 -12.089
78 HA SER 11 HA SER 11 0.760 -5.419 -14.717
79 HB2 SER 11 1HB SER 11 -1.134 -6.866 -12.835
80 HB3 SER 11 2HB SER 11 -1.636 -5.908 -14.226
81 HG SER 11 HG SER 11 -1.398 -7.758 -15.219
82 H SER 12 H SER 12 -0.965 -5.441 -11.608
83 HA SER 12 HA SER 12 0.012 -2.761 -10.933
84 HB2 SER 12 1HB SER 12 -1.971 -1.551 -11.262
85 HB3 SER 12 2HB SER 12 -1.883 -2.549 -12.711
86 HG SER 12 HG SER 12 -3.244 -3.325 -10.346
87 H LEU 13 H LEU 13 -1.032 -1.989 -8.872
88 HA LEU 13 HA LEU 13 -1.839 -4.330 -7.175
89 HB2 LEU 13 1HB LEU 13 0.298 -3.398 -6.474
90 HB3 LEU 13 2HB LEU 13 -0.382 -1.772 -6.438
91 HG LEU 13 HG LEU 13 -1.878 -2.386 -4.608
92 HD11 LEU 13 1HD1 LEU 13 -1.415 -4.755 -3.575
93 HD12 LEU 13 2HD1 LEU 13 -0.840 -5.157 -5.194
94 HD13 LEU 13 3HD1 LEU 13 -2.503 -4.620 -4.956
95 HD21 LEU 13 3HD2 LEU 13 0.269 -1.645 -3.863
96 HD22 LEU 13 1HD2 LEU 13 1.013 -3.195 -4.250
97 HD23 LEU 13 2HD2 LEU 13 -0.110 -3.072 -2.900
98 H ASN 14 H ASN 14 -3.790 -4.241 -6.212
99 HA ASN 14 HA ASN 14 -5.468 -1.846 -6.652
100 HB2 ASN 14 1HB ASN 14 -6.056 -4.652 -5.698
101 HB3 ASN 14 2HB ASN 14 -7.274 -3.372 -5.742
102 HD21 ASN 14 2HD2 ASN 14 -7.564 -5.672 -7.397
103 HD22 ASN 14 1HD2 ASN 14 -7.356 -5.210 -9.017
104 H VAL 15 H VAL 15 -6.355 -0.630 -4.991
105 HA VAL 15 HA VAL 15 -5.015 -0.868 -2.356
106 HB VAL 15 HB VAL 15 -6.792 1.247 -3.604
107 HG11 VAL 15 1HG1 VAL 15 -6.032 2.598 -1.576
108 HG12 VAL 15 2HG1 VAL 15 -5.533 1.066 -0.858
109 HG13 VAL 15 3HG1 VAL 15 -7.230 1.344 -1.254
110 HG21 VAL 15 3HG2 VAL 15 -4.781 2.525 -3.796
111 HG22 VAL 15 1HG2 VAL 15 -4.381 0.913 -4.389
112 HG23 VAL 15 2HG2 VAL 15 -3.890 1.404 -2.768
113 H ARG 16 H ARG 16 -6.071 -1.627 -0.570
114 HA ARG 16 HA ARG 16 -8.943 -2.386 -0.877
115 HB2 ARG 16 1HB ARG 16 -6.754 -3.296 1.002
116 HB3 ARG 16 2HB ARG 16 -8.439 -3.794 1.163
117 HG2 ARG 16 1HG ARG 16 -8.398 -4.728 -1.114
118 HG3 ARG 16 2HG ARG 16 -6.727 -4.198 -1.311
119 HD2 ARG 16 1HD ARG 16 -6.040 -5.647 0.561
120 HD3 ARG 16 2HD ARG 16 -7.710 -6.162 0.775
121 HE ARG 16 HE ARG 16 -7.526 -7.504 -1.184
122 HH11 ARG 16 1HH2 ARG 16 -4.792 -5.450 -0.692
123 HH12 ARG 16 2HH2 ARG 16 -3.812 -6.260 -1.868
124 HH21 ARG 16 1HH1 ARG 16 -6.257 -8.563 -2.716
125 HH22 ARG 16 2HH1 ARG 16 -4.641 -8.018 -3.013
126 H GLU 17 H GLU 17 -10.469 -1.353 0.266
127 HA GLU 17 HA GLU 17 -9.848 0.969 1.863
128 HB2 GLU 17 1HB GLU 17 -11.939 0.684 0.529
129 HB3 GLU 17 2HB GLU 17 -12.443 -0.587 1.642
130 HG2 GLU 17 1HG GLU 17 -12.425 0.995 3.508
131 HG3 GLU 17 2HG GLU 17 -11.848 2.276 2.442
132 H GLY 18 H GLY 18 -10.923 -2.336 2.621
133 HA2 GLY 18 1HA GLY 18 -10.584 -1.763 5.539
134 HA3 GLY 18 2HA GLY 18 -11.526 -3.089 4.865
135 H ALA 19 H ALA 19 -10.071 -4.181 6.569
136 HA ALA 19 HA ALA 19 -7.381 -4.861 5.457
137 HB1 ALA 19 3HB ALA 19 -6.834 -5.631 7.665
138 HB2 ALA 19 1HB ALA 19 -8.523 -5.577 8.169
139 HB3 ALA 19 2HB ALA 19 -7.648 -4.079 7.861
140 H SER 20 H SER 20 -9.168 -6.018 3.883
141 HA SER 20 HA SER 20 -8.875 -8.856 4.483
142 HB2 SER 20 1HB SER 20 -10.924 -8.421 5.752
143 HB3 SER 20 2HB SER 20 -11.654 -7.641 4.351
144 HG SER 20 HG SER 20 -10.709 -10.046 3.653
145 H THR 21 H THR 21 -9.381 -10.180 2.628
146 HA THR 21 HA THR 21 -8.796 -8.941 0.104
147 HB THR 21 HB THR 21 -9.268 -11.192 -0.824
148 HG1 THR 21 HG1 THR 21 -11.058 -11.585 0.599
149 HG21 THR 21 3HG2 THR 21 -7.648 -12.448 0.596
150 HG22 THR 21 1HG2 THR 21 -7.766 -11.175 1.811
151 HG23 THR 21 2HG2 THR 21 -7.091 -10.817 0.221
152 H SER 22 H SER 22 -11.810 -9.887 1.680
153 HA SER 22 HA SER 22 -13.429 -9.419 -0.709
154 HB2 SER 22 1HB SER 22 -14.147 -11.018 1.035
155 HB3 SER 22 2HB SER 22 -14.227 -9.707 2.207
156 HG SER 22 HG SER 22 -15.831 -8.744 0.915
157 H SER 23 H SER 23 -11.671 -7.339 0.961
158 HA SER 23 HA SER 23 -13.536 -5.293 1.747
159 HB2 SER 23 1HB SER 23 -11.564 -3.850 1.875
160 HB3 SER 23 2HB SER 23 -11.213 -5.421 2.589
161 HG SER 23 HG SER 23 -10.427 -4.359 0.096
162 H LYS 24 H LYS 24 -13.790 -3.191 0.682
163 HA LYS 24 HA LYS 24 -14.245 -3.520 -2.196
164 HB2 LYS 24 1HB LYS 24 -15.906 -2.408 -0.743
165 HB3 LYS 24 2HB LYS 24 -14.734 -1.138 -0.390
166 HG2 LYS 24 1HG LYS 24 -14.645 -0.521 -2.759
167 HG3 LYS 24 2HG LYS 24 -15.752 -1.836 -3.161
168 HD2 LYS 24 1HD LYS 24 -17.488 -0.803 -1.737
169 HD3 LYS 24 2HD LYS 24 -16.383 0.519 -1.357
170 HE2 LYS 24 1HE LYS 24 -16.262 1.118 -3.742
171 HE3 LYS 24 2HE LYS 24 -17.349 -0.214 -4.136
172 HZ1 LYS 24 3HZ LYS 24 -18.974 0.847 -2.580
173 HZ2 LYS 24 1HZ LYS 24 -18.661 1.725 -3.997
174 HZ3 LYS 24 2HZ LYS 24 -17.950 2.202 -2.530
175 H VAL 25 H VAL 25 -13.124 -2.536 -3.826
176 HA VAL 25 HA VAL 25 -10.537 -1.293 -3.130
177 HB VAL 25 HB VAL 25 -11.776 -2.169 -5.752
178 HG11 VAL 25 1HG1 VAL 25 -9.370 -1.783 -6.584
179 HG12 VAL 25 2HG1 VAL 25 -9.152 -0.795 -5.139
180 HG13 VAL 25 3HG1 VAL 25 -10.363 -0.346 -6.340
181 HG21 VAL 25 3HG2 VAL 25 -10.997 -3.915 -4.107
182 HG22 VAL 25 1HG2 VAL 25 -9.378 -3.222 -4.222
183 HG23 VAL 25 2HG2 VAL 25 -10.132 -3.944 -5.644
184 H ILE 26 H ILE 26 -10.175 0.865 -3.250
185 HA ILE 26 HA ILE 26 -12.351 2.619 -4.310
186 HB ILE 26 HB ILE 26 -11.201 4.396 -2.987
187 HG12 ILE 26 1HG1 ILE 26 -9.490 2.112 -1.950
188 HG13 ILE 26 2HG1 ILE 26 -8.920 3.315 -3.106
189 HG21 ILE 26 1HG2 ILE 26 -11.909 1.851 -1.498
190 HG22 ILE 26 2HG2 ILE 26 -13.028 3.128 -1.972
191 HG23 ILE 26 3HG2 ILE 26 -11.792 3.448 -0.756
192 HD11 ILE 26 3HD1 ILE 26 -9.524 5.102 -1.450
193 HD12 ILE 26 1HD1 ILE 26 -8.249 4.021 -0.888
194 HD13 ILE 26 2HD1 ILE 26 -9.895 3.831 -0.286
195 H GLY 27 H GLY 27 -9.378 1.325 -5.202
196 HA2 GLY 27 1HA GLY 27 -9.183 2.675 -7.638
197 HA3 GLY 27 2HA GLY 27 -8.228 3.631 -6.506
198 H SER 28 H SER 28 -6.695 2.721 -8.391
199 HA SER 28 HA SER 28 -5.272 0.370 -7.209
200 HB2 SER 28 1HB SER 28 -5.881 0.869 -10.134
201 HB3 SER 28 2HB SER 28 -4.719 -0.325 -9.563
202 HG SER 28 HG SER 28 -6.446 -1.278 -8.374
203 H LEU 29 H LEU 29 -2.971 0.359 -7.679
204 HA LEU 29 HA LEU 29 -1.891 3.059 -8.439
205 HB2 LEU 29 1HB LEU 29 -0.804 1.119 -6.377
206 HB3 LEU 29 2HB LEU 29 -0.112 2.688 -6.791
207 HG LEU 29 HG LEU 29 -2.888 2.244 -5.649
208 HD11 LEU 29 1HD1 LEU 29 -1.119 1.800 -4.007
209 HD12 LEU 29 2HD1 LEU 29 -1.943 3.310 -3.622
210 HD13 LEU 29 3HD1 LEU 29 -0.357 3.344 -4.390
211 HD21 LEU 29 3HD2 LEU 29 -3.073 4.242 -6.867
212 HD22 LEU 29 1HD2 LEU 29 -1.384 4.679 -6.608
213 HD23 LEU 29 2HD2 LEU 29 -2.552 4.839 -5.297
214 H SER 30 H SER 30 0.025 3.075 -9.622
215 HA SER 30 HA SER 30 0.395 0.844 -11.408
216 HB2 SER 30 1HB SER 30 2.043 3.342 -10.956
217 HB3 SER 30 2HB SER 30 2.289 2.210 -12.284
218 HG SER 30 HG SER 30 0.621 3.041 -13.256
219 H GLY 31 H GLY 31 2.209 -0.516 -11.609
220 HA2 GLY 31 1HA GLY 31 3.302 -1.513 -9.173
221 HA3 GLY 31 2HA GLY 31 3.849 -1.961 -10.786
222 H ASN 32 H ASN 32 5.628 -1.692 -8.680
223 HA ASN 32 HA ASN 32 7.726 -0.781 -8.227
224 HB2 ASN 32 1HB ASN 32 7.766 -0.666 -10.806
225 HB3 ASN 32 2HB ASN 32 7.374 1.042 -10.611
226 HD21 ASN 32 2HD2 ASN 32 9.914 0.019 -11.676
227 HD22 ASN 32 1HD2 ASN 32 11.132 0.534 -10.613
228 H THR 33 H THR 33 4.941 1.225 -8.615
229 HA THR 33 HA THR 33 6.064 3.684 -7.658
230 HB THR 33 HB THR 33 3.207 2.720 -7.376
231 HG1 THR 33 HG1 THR 33 3.801 2.606 -9.513
232 HG21 THR 33 3HG2 THR 33 4.527 5.443 -7.363
233 HG22 THR 33 1HG2 THR 33 3.600 4.695 -6.062
234 HG23 THR 33 2HG2 THR 33 2.787 5.212 -7.541
235 H LYS 34 H LYS 34 6.414 4.402 -5.608
236 HA LYS 34 HA LYS 34 6.194 2.432 -3.415
237 HB2 LYS 34 1HB LYS 34 7.552 4.054 -2.158
238 HB3 LYS 34 2HB LYS 34 8.294 3.700 -3.716
239 HG2 LYS 34 1HG LYS 34 7.234 5.760 -4.649
240 HG3 LYS 34 2HG LYS 34 6.620 6.138 -3.038
241 HD2 LYS 34 1HD LYS 34 8.911 6.205 -2.157
242 HD3 LYS 34 2HD LYS 34 9.546 5.788 -3.748
243 HE2 LYS 34 1HE LYS 34 9.608 8.260 -3.195
244 HE3 LYS 34 2HE LYS 34 8.770 7.857 -4.692
245 HZ1 LYS 34 3HZ LYS 34 6.815 8.518 -3.868
246 HZ2 LYS 34 1HZ LYS 34 7.738 9.361 -2.722
247 HZ3 LYS 34 2HZ LYS 34 7.099 7.835 -2.339
248 H VAL 35 H VAL 35 5.017 2.849 -1.492
249 HA VAL 35 HA VAL 35 3.046 5.113 -1.639
250 HB VAL 35 HB VAL 35 1.449 3.597 -0.463
251 HG11 VAL 35 1HG1 VAL 35 1.514 3.920 -2.962
252 HG12 VAL 35 2HG1 VAL 35 0.824 2.378 -2.455
253 HG13 VAL 35 3HG1 VAL 35 2.476 2.446 -3.071
254 HG21 VAL 35 3HG2 VAL 35 2.895 1.994 0.572
255 HG22 VAL 35 1HG2 VAL 35 3.681 1.608 -0.958
256 HG23 VAL 35 2HG2 VAL 35 2.016 1.109 -0.675
257 H THR 36 H THR 36 3.013 6.395 0.096
258 HA THR 36 HA THR 36 4.971 6.140 2.169
259 HB THR 36 HB THR 36 2.471 7.849 2.185
260 HG1 THR 36 HG1 THR 36 3.504 8.358 0.340
261 HG21 THR 36 3HG2 THR 36 3.667 7.755 4.325
262 HG22 THR 36 1HG2 THR 36 3.876 9.337 3.575
263 HG23 THR 36 2HG2 THR 36 5.179 8.152 3.509
264 H ILE 37 H ILE 37 4.862 5.103 4.081
265 HA ILE 37 HA ILE 37 2.236 3.944 4.944
266 HB ILE 37 HB ILE 37 5.088 3.052 5.431
267 HG12 ILE 37 1HG1 ILE 37 2.782 1.615 4.096
268 HG13 ILE 37 2HG1 ILE 37 3.974 2.564 3.207
269 HG21 ILE 37 1HG2 ILE 37 2.472 2.141 6.636
270 HG22 ILE 37 2HG2 ILE 37 3.969 2.571 7.466
271 HG23 ILE 37 3HG2 ILE 37 3.870 1.071 6.544
272 HD11 ILE 37 3HD1 ILE 37 5.777 1.140 4.037
273 HD12 ILE 37 1HD1 ILE 37 4.546 0.140 3.268
274 HD13 ILE 37 2HD1 ILE 37 4.636 0.230 5.027
275 H VAL 38 H VAL 38 1.413 4.656 6.821
276 HA VAL 38 HA VAL 38 3.145 6.316 8.624
277 HB VAL 38 HB VAL 38 0.957 7.332 9.348
278 HG11 VAL 38 1HG1 VAL 38 2.382 8.434 7.671
279 HG12 VAL 38 2HG1 VAL 38 0.680 8.675 7.278
280 HG13 VAL 38 3HG1 VAL 38 1.629 7.481 6.392
281 HG21 VAL 38 3HG2 VAL 38 -1.047 6.891 8.119
282 HG22 VAL 38 1HG2 VAL 38 -0.381 5.304 8.498
283 HG23 VAL 38 2HG2 VAL 38 -0.177 5.981 6.884
284 H GLY 39 H GLY 39 1.830 3.290 8.344
285 HA2 GLY 39 1HA GLY 39 2.313 2.606 11.064
286 HA3 GLY 39 2HA GLY 39 0.581 2.855 10.861
287 H GLU 40 H GLU 40 1.014 0.394 11.560
288 HA GLU 40 HA GLU 40 0.746 -1.189 9.048
289 HB2 GLU 40 1HB GLU 40 2.178 -2.962 9.945
290 HB3 GLU 40 2HB GLU 40 3.084 -1.452 9.858
291 HG2 GLU 40 1HG GLU 40 2.586 -1.054 12.268
292 HG3 GLU 40 2HG GLU 40 1.789 -2.626 12.338
293 H GLU 41 H GLU 41 -0.500 -3.143 9.333
294 HA GLU 41 HA GLU 41 -1.698 -3.658 11.968
295 HB2 GLU 41 1HB GLU 41 -3.134 -1.846 11.030
296 HB3 GLU 41 2HB GLU 41 -3.462 -2.866 9.627
297 HG2 GLU 41 1HG GLU 41 -4.461 -4.578 11.064
298 HG3 GLU 41 2HG GLU 41 -4.065 -3.635 12.499
299 H GLY 42 H GLY 42 -1.303 -5.795 12.028
300 HA2 GLY 42 1HA GLY 42 -1.338 -8.060 11.456
301 HA3 GLY 42 2HA GLY 42 -2.726 -7.663 10.448
302 H ALA 43 H ALA 43 -2.200 -8.879 8.660
303 HA ALA 43 HA ALA 43 0.483 -8.781 7.483
304 HB1 ALA 43 3HB ALA 43 -0.593 -10.881 7.259
305 HB2 ALA 43 1HB ALA 43 -0.739 -10.155 5.657
306 HB3 ALA 43 2HB ALA 43 -2.115 -10.142 6.760
307 H PHE 44 H PHE 44 -1.511 -6.398 7.659
308 HA PHE 44 HA PHE 44 -1.212 -5.563 4.794
309 HB2 PHE 44 1HB PHE 44 -3.571 -5.112 6.642
310 HB3 PHE 44 2HB PHE 44 -3.343 -4.265 5.110
311 HD1 PHE 44 HD1 PHE 44 -3.987 -7.538 6.689
312 HD2 PHE 44 HD2 PHE 44 -3.587 -5.404 2.984
313 HE1 PHE 44 HE1 PHE 44 -4.959 -9.468 5.472
314 HE2 PHE 44 HE2 PHE 44 -4.559 -7.333 1.766
315 HZ PHE 44 HZ PHE 44 -5.244 -9.366 3.011
316 H TYR 45 H TYR 45 -0.609 -3.437 4.477
317 HA TYR 45 HA TYR 45 0.296 -1.982 6.930
318 HB2 TYR 45 1HB TYR 45 1.268 -1.957 4.069
319 HB3 TYR 45 2HB TYR 45 1.754 -0.737 5.246
320 HD1 TYR 45 HD1 TYR 45 2.511 -1.742 7.605
321 HD2 TYR 45 HD2 TYR 45 2.634 -3.854 3.866
322 HE1 TYR 45 HE1 TYR 45 4.224 -3.273 8.528
323 HE2 TYR 45 HE2 TYR 45 4.352 -5.382 4.791
324 HH TYR 45 HH TYR 45 4.902 -5.980 7.709
325 H LYS 46 H LYS 46 -0.176 0.213 7.155
326 HA LYS 46 HA LYS 46 -2.569 1.114 5.660
327 HB2 LYS 46 1HB LYS 46 -1.131 1.974 8.166
328 HB3 LYS 46 2HB LYS 46 -2.278 3.067 7.389
329 HG2 LYS 46 1HG LYS 46 -4.048 1.427 7.573
330 HG3 LYS 46 2HG LYS 46 -2.923 0.213 8.174
331 HD2 LYS 46 1HD LYS 46 -4.025 1.056 10.109
332 HD3 LYS 46 2HD LYS 46 -2.438 1.820 10.104
333 HE2 LYS 46 1HE LYS 46 -3.334 3.883 9.270
334 HE3 LYS 46 2HE LYS 46 -4.888 3.135 8.899
335 HZ1 LYS 46 3HZ LYS 46 -5.296 4.166 10.895
336 HZ2 LYS 46 1HZ LYS 46 -3.748 3.855 11.512
337 HZ3 LYS 46 2HZ LYS 46 -4.888 2.599 11.409
338 H ILE 47 H ILE 47 -2.542 2.844 4.245
339 HA ILE 47 HA ILE 47 0.028 4.332 3.908
340 HB ILE 47 HB ILE 47 -0.248 4.171 1.452
341 HG12 ILE 47 1HG1 ILE 47 -2.391 2.120 2.103
342 HG13 ILE 47 2HG1 ILE 47 -2.726 3.745 1.505
343 HG21 ILE 47 1HG2 ILE 47 1.226 2.608 2.632
344 HG22 ILE 47 2HG2 ILE 47 0.442 1.799 1.275
345 HG23 ILE 47 3HG2 ILE 47 -0.133 1.522 2.919
346 HD11 ILE 47 3HD1 ILE 47 -1.144 1.590 0.083
347 HD12 ILE 47 1HD1 ILE 47 -1.295 3.250 -0.491
348 HD13 ILE 47 2HD1 ILE 47 -2.722 2.220 -0.384
349 H GLU 48 H GLU 48 -0.208 6.377 2.821
350 HA GLU 48 HA GLU 48 -2.723 7.706 3.565
351 HB2 GLU 48 1HB GLU 48 -0.132 8.705 2.347
352 HB3 GLU 48 2HB GLU 48 -1.486 9.754 2.768
353 HG2 GLU 48 1HG GLU 48 -0.069 7.916 4.722
354 HG3 GLU 48 2HG GLU 48 0.258 9.642 4.565
355 H TYR 49 H TYR 49 -4.268 6.919 2.086
356 HA TYR 49 HA TYR 49 -3.718 7.293 -0.820
357 HB2 TYR 49 1HB TYR 49 -4.663 5.129 -0.070
358 HB3 TYR 49 2HB TYR 49 -6.068 5.978 0.577
359 HD1 TYR 49 HD1 TYR 49 -4.188 5.198 -2.530
360 HD2 TYR 49 HD2 TYR 49 -7.820 6.756 -0.852
361 HE1 TYR 49 HE1 TYR 49 -5.234 5.177 -4.778
362 HE2 TYR 49 HE2 TYR 49 -8.868 6.735 -3.099
363 HH TYR 49 HH TYR 49 -8.027 6.828 -5.519
364 H LYS 50 H LYS 50 -4.716 8.882 -1.974
365 HA LYS 50 HA LYS 50 -5.754 11.177 -0.792
366 HB2 LYS 50 1HB LYS 50 -5.069 10.693 -3.254
367 HB3 LYS 50 2HB LYS 50 -6.757 10.239 -3.477
368 HG2 LYS 50 1HG LYS 50 -7.497 12.443 -2.757
369 HG3 LYS 50 2HG LYS 50 -5.848 12.903 -2.338
370 HD2 LYS 50 1HD LYS 50 -6.306 13.871 -4.488
371 HD3 LYS 50 2HD LYS 50 -5.218 12.511 -4.758
372 HE2 LYS 50 1HE LYS 50 -6.962 11.141 -5.604
373 HE3 LYS 50 2HE LYS 50 -8.219 12.195 -4.955
374 HZ1 LYS 50 3HZ LYS 50 -7.572 12.312 -7.454
375 HZ2 LYS 50 1HZ LYS 50 -6.295 13.277 -6.892
376 HZ3 LYS 50 2HZ LYS 50 -7.903 13.740 -6.593
377 H GLY 51 H GLY 51 -7.408 11.149 0.647
378 HA2 GLY 51 1HA GLY 51 -9.928 11.376 0.618
379 HA3 GLY 51 2HA GLY 51 -9.967 9.778 -0.128
380 H SER 52 H SER 52 -8.201 8.313 1.340
381 HA SER 52 HA SER 52 -8.628 8.765 4.204
382 HB2 SER 52 1HB SER 52 -9.795 6.536 4.478
383 HB3 SER 52 2HB SER 52 -10.770 7.788 3.711
384 HG SER 52 HG SER 52 -9.233 5.828 2.344
385 H HIS 53 H HIS 53 -8.118 6.217 5.145
386 HA HIS 53 HA HIS 53 -5.301 5.866 4.310
387 HB2 HIS 53 1HB HIS 53 -6.946 4.744 6.592
388 HB3 HIS 53 2HB HIS 53 -5.261 4.307 6.299
389 HD1 HIS 53 HD1 HIS 53 -7.435 7.216 7.304
390 HD2 HIS 53 HD2 HIS 53 -3.379 6.336 6.911
391 HE1 HIS 53 HE1 HIS 53 -6.177 9.142 8.368
392 H GLY 54 H GLY 54 -4.863 4.444 2.730
393 HA2 GLY 54 1HA GLY 54 -6.773 2.314 2.039
394 HA3 GLY 54 2HA GLY 54 -5.305 2.723 1.152
395 H TYR 55 H TYR 55 -6.022 0.059 1.800
396 HA TYR 55 HA TYR 55 -3.850 -0.675 3.742
397 HB2 TYR 55 1HB TYR 55 -6.519 -2.024 3.248
398 HB3 TYR 55 2HB TYR 55 -5.216 -2.721 4.215
399 HD1 TYR 55 HD1 TYR 55 -7.668 0.040 3.986
400 HD2 TYR 55 HD2 TYR 55 -4.652 -1.848 6.391
401 HE1 TYR 55 HE1 TYR 55 -8.392 1.379 5.945
402 HE2 TYR 55 HE2 TYR 55 -5.374 -0.511 8.349
403 HH TYR 55 HH TYR 55 -6.766 2.035 8.424
404 H VAL 56 H VAL 56 -2.359 -2.116 2.985
405 HA VAL 56 HA VAL 56 -2.944 -3.587 0.450
406 HB VAL 56 HB VAL 56 -0.590 -3.024 -0.290
407 HG11 VAL 56 1HG1 VAL 56 -1.231 -0.897 -1.229
408 HG12 VAL 56 2HG1 VAL 56 -2.372 -0.601 0.082
409 HG13 VAL 56 3HG1 VAL 56 -2.698 -1.867 -1.101
410 HG21 VAL 56 3HG2 VAL 56 0.298 -2.329 1.891
411 HG22 VAL 56 1HG2 VAL 56 -0.860 -1.001 1.958
412 HG23 VAL 56 2HG2 VAL 56 0.417 -0.994 0.745
413 H ALA 57 H ALA 57 -2.161 -5.638 0.440
414 HA ALA 57 HA ALA 57 -1.337 -6.851 2.886
415 HB1 ALA 57 3HB ALA 57 -1.286 -7.788 0.017
416 HB2 ALA 57 1HB ALA 57 -2.440 -8.216 1.279
417 HB3 ALA 57 2HB ALA 57 -0.784 -8.817 1.358
418 H LYS 58 H LYS 58 0.679 -7.521 3.610
419 HA LYS 58 HA LYS 58 2.987 -6.004 2.885
420 HB2 LYS 58 1HB LYS 58 4.201 -7.651 4.317
421 HB3 LYS 58 2HB LYS 58 2.733 -7.050 5.092
422 HG2 LYS 58 1HG LYS 58 1.516 -9.067 4.319
423 HG3 LYS 58 2HG LYS 58 3.005 -9.678 3.596
424 HD2 LYS 58 1HD LYS 58 4.089 -9.680 5.812
425 HD3 LYS 58 2HD LYS 58 2.608 -9.062 6.541
426 HE2 LYS 58 1HE LYS 58 1.400 -11.090 5.785
427 HE3 LYS 58 2HE LYS 58 2.896 -11.711 5.087
428 HZ1 LYS 58 3HZ LYS 58 2.746 -12.692 7.187
429 HZ2 LYS 58 1HZ LYS 58 2.257 -11.252 7.938
430 HZ3 LYS 58 2HZ LYS 58 3.858 -11.424 7.398
431 H GLU 59 H GLU 59 1.518 -8.685 1.392
432 HA GLU 59 HA GLU 59 3.831 -10.001 0.313
433 HB2 GLU 59 1HB GLU 59 1.575 -11.024 0.412
434 HB3 GLU 59 2HB GLU 59 1.021 -9.876 -0.807
435 HG2 GLU 59 1HG GLU 59 2.627 -10.743 -2.423
436 HG3 GLU 59 2HG GLU 59 3.306 -11.828 -1.209
437 H TYR 60 H TYR 60 1.972 -7.186 -0.774
438 HA TYR 60 HA TYR 60 3.435 -7.171 -3.362
439 HB2 TYR 60 1HB TYR 60 1.417 -5.185 -2.271
440 HB3 TYR 60 2HB TYR 60 1.987 -5.304 -3.935
441 HD1 TYR 60 HD2 TYR 60 1.680 -7.657 -5.086
442 HD2 TYR 60 HD1 TYR 60 -0.534 -6.334 -1.652
443 HE1 TYR 60 HE2 TYR 60 -0.078 -9.336 -5.572
444 HE2 TYR 60 HE1 TYR 60 -2.291 -8.015 -2.135
445 HH TYR 60 HH TYR 60 -2.650 -10.011 -3.321
446 H ILE 61 H ILE 61 3.822 -5.951 -0.210
447 HA ILE 61 HA ILE 61 5.383 -3.580 -1.095
448 HB ILE 61 HB ILE 61 4.412 -4.578 1.590
449 HG12 ILE 61 1HG1 ILE 61 3.277 -2.443 1.659
450 HG13 ILE 61 2HG1 ILE 61 4.149 -1.876 0.236
451 HG21 ILE 61 1HG2 ILE 61 6.594 -3.872 2.170
452 HG22 ILE 61 2HG2 ILE 61 5.601 -2.446 2.468
453 HG23 ILE 61 3HG2 ILE 61 6.576 -2.556 1.001
454 HD11 ILE 61 3HD1 ILE 61 1.740 -2.716 -0.123
455 HD12 ILE 61 1HD1 ILE 61 2.397 -4.328 0.135
456 HD13 ILE 61 2HD1 ILE 61 2.979 -3.345 -1.205
457 H LYS 62 H LYS 62 7.567 -3.601 -1.186
458 HA LYS 62 HA LYS 62 9.057 -5.802 0.190
459 HB2 LYS 62 1HB LYS 62 8.734 -6.398 -2.205
460 HB3 LYS 62 2HB LYS 62 9.523 -4.888 -2.664
461 HG2 LYS 62 1HG LYS 62 11.580 -5.566 -1.563
462 HG3 LYS 62 2HG LYS 62 10.808 -7.024 -0.937
463 HD2 LYS 62 1HD LYS 62 10.436 -7.803 -3.258
464 HD3 LYS 62 2HD LYS 62 11.251 -6.358 -3.861
465 HE2 LYS 62 1HE LYS 62 12.529 -8.365 -1.985
466 HE3 LYS 62 2HE LYS 62 12.749 -8.371 -3.734
467 HZ1 LYS 62 3HZ LYS 62 13.672 -6.398 -1.755
468 HZ2 LYS 62 1HZ LYS 62 13.404 -5.915 -3.360
469 HZ3 LYS 62 2HZ LYS 62 14.534 -7.138 -3.019
470 H ASP 63 H ASP 63 11.262 -5.286 0.618
471 HA ASP 63 HA ASP 63 13.108 -3.896 1.030
472 HB2 ASP 63 1HB ASP 63 12.277 -2.774 -1.236
473 HB3 ASP 63 2HB ASP 63 11.725 -1.492 -0.158
474 H ILE 64 H ILE 64 10.259 -1.748 1.194
475 HA ILE 64 HA ILE 64 9.418 -0.481 2.963
476 HB ILE 64 HB ILE 64 10.520 -2.795 4.591
477 HG12 ILE 64 1HG1 ILE 64 7.713 -2.272 3.575
478 HG13 ILE 64 2HG1 ILE 64 8.860 -3.337 2.762
479 HG21 ILE 64 1HG2 ILE 64 8.736 -2.034 6.208
480 HG22 ILE 64 2HG2 ILE 64 8.553 -0.582 5.225
481 HG23 ILE 64 3HG2 ILE 64 10.083 -0.910 6.037
482 HD11 ILE 64 3HD1 ILE 64 9.061 -4.655 4.881
483 HD12 ILE 64 1HD1 ILE 64 7.435 -4.685 4.197
484 HD13 ILE 64 2HD1 ILE 64 7.790 -3.649 5.579
485 H LYS 65 H LYS 65 10.999 1.195 2.556
486 HA LYS 65 HA LYS 65 12.918 1.492 4.814
487 HB2 LYS 65 1HB LYS 65 14.191 0.586 2.877
488 HB3 LYS 65 2HB LYS 65 13.662 1.966 1.913
489 HG2 LYS 65 1HG LYS 65 14.763 3.512 3.453
490 HG3 LYS 65 2HG LYS 65 15.228 2.172 4.501
491 HD2 LYS 65 1HD LYS 65 16.565 1.204 2.663
492 HD3 LYS 65 2HD LYS 65 16.113 2.558 1.627
493 HE2 LYS 65 1HE LYS 65 17.184 4.129 3.187
494 HE3 LYS 65 2HE LYS 65 17.612 2.790 4.253
495 HZ1 LYS 65 3HZ LYS 65 19.457 2.582 3.070
496 HZ2 LYS 65 1HZ LYS 65 18.932 3.709 1.916
497 HZ3 LYS 65 2HZ LYS 65 18.511 2.071 1.754
498 H ASP 66 H ASP 66 13.414 3.690 5.295
499 HA ASP 66 HA ASP 66 11.267 5.545 4.606
500 HB2 ASP 66 1HB ASP 66 12.253 5.456 6.874
501 HB3 ASP 66 2HB ASP 66 13.805 5.970 6.211
502 H GLU 67 H GLU 67 11.340 6.494 2.629
503 HA GLU 67 HA GLU 67 13.921 7.084 1.337
504 HB2 GLU 67 1HB GLU 67 11.965 6.162 0.074
505 HB3 GLU 67 2HB GLU 67 11.101 7.666 0.387
506 HG2 GLU 67 1HG GLU 67 12.087 7.845 -1.803
507 HG3 GLU 67 2HG GLU 67 13.016 8.891 -0.732
508 H VAL 68 H VAL 68 14.712 9.151 0.957
509 HA VAL 68 HA VAL 68 13.829 11.229 2.783
510 HB VAL 68 HB VAL 68 15.656 12.551 1.803
511 HG11 VAL 68 1HG1 VAL 68 16.306 10.971 3.497
512 HG12 VAL 68 2HG1 VAL 68 17.507 10.864 2.209
513 HG13 VAL 68 3HG1 VAL 68 16.252 9.633 2.351
514 HG21 VAL 68 3HG2 VAL 68 17.055 11.372 0.014
515 HG22 VAL 68 1HG2 VAL 68 15.509 12.023 -0.530
516 HG23 VAL 68 2HG2 VAL 68 15.677 10.296 -0.219
517 H LEU 69 H LEU 69 12.801 13.180 2.267
518 HA LEU 69 HA LEU 69 11.142 13.127 -0.160
519 HB2 LEU 69 1HB LEU 69 11.317 14.875 2.296
520 HB3 LEU 69 2HB LEU 69 10.371 15.398 0.902
521 HG LEU 69 HG LEU 69 9.090 13.274 0.995
522 HD11 LEU 69 1HD1 LEU 69 10.910 12.796 3.361
523 HD12 LEU 69 2HD1 LEU 69 10.630 11.746 1.973
524 HD13 LEU 69 3HD1 LEU 69 9.369 11.959 3.186
525 HD21 LEU 69 3HD2 LEU 69 7.841 13.789 3.067
526 HD22 LEU 69 1HD2 LEU 69 8.256 15.266 2.199
527 HD23 LEU 69 2HD2 LEU 69 9.179 14.793 3.625
528 H GLU 70 H GLU 70 14.241 14.158 0.550
529 HA GLU 70 HA GLU 70 14.125 16.498 -1.300
530 HB2 GLU 70 1HB GLU 70 15.312 16.535 1.007
531 HB3 GLU 70 2HB GLU 70 16.563 15.571 0.227
532 HG2 GLU 70 1HG GLU 70 15.580 18.235 -0.852
533 HG3 GLU 70 2HG GLU 70 17.001 18.055 0.177
534 H HIS 71 H HIS 71 14.609 16.143 -3.378
535 HA HIS 71 HA HIS 71 16.841 14.389 -4.121
536 HB2 HIS 71 1HB HIS 71 14.821 12.864 -3.953
537 HB3 HIS 71 2HB HIS 71 14.082 13.813 -5.244
538 HD1 HIS 71 HD1 HIS 71 15.066 13.579 -7.625
539 HD2 HIS 71 HD2 HIS 71 17.040 11.257 -4.780
540 HE1 HIS 71 HE1 HIS 71 16.576 12.002 -8.909
541 H HIS 72 H HIS 72 16.689 17.111 -4.363
542 HA HIS 72 HA HIS 72 16.631 17.428 -7.306
543 HB2 HIS 72 1HB HIS 72 14.348 18.114 -6.316
544 HB3 HIS 72 2HB HIS 72 15.209 19.462 -5.571
545 HD1 HIS 72 HD1 HIS 72 14.602 21.449 -6.997
546 HD2 HIS 72 HD2 HIS 72 15.652 18.140 -9.307
547 HE1 HIS 72 HE1 HIS 72 14.652 22.240 -9.404
548 H HIS 73 H HIS 73 18.036 19.028 -8.027
549 HA HIS 73 HA HIS 73 20.175 19.778 -6.228
550 HB2 HIS 73 1HB HIS 73 20.862 21.183 -8.314
551 HB3 HIS 73 2HB HIS 73 20.856 19.426 -8.459
552 HD1 HIS 73 HD1 HIS 73 18.396 18.450 -9.356
553 HD2 HIS 73 HD2 HIS 73 19.367 22.391 -10.306
554 HE1 HIS 73 HE1 HIS 73 16.912 19.104 -11.300
555 H HIS 74 H HIS 74 17.141 21.154 -6.984
556 HA HIS 74 HA HIS 74 17.950 23.717 -5.651
557 HB2 HIS 74 1HB HIS 74 16.390 23.299 -8.204
558 HB3 HIS 74 2HB HIS 74 16.115 24.736 -7.217
559 HD1 HIS 74 HD1 HIS 74 19.268 22.886 -8.343
560 HD2 HIS 74 HD2 HIS 74 17.727 26.754 -8.158
561 HE1 HIS 74 HE1 HIS 74 21.073 24.418 -9.240
562 H HIS 75 H HIS 75 16.449 24.547 -4.225
563 HA HIS 75 HA HIS 75 14.373 22.655 -3.332
564 HB2 HIS 75 1HB HIS 75 15.370 25.284 -2.206
565 HB3 HIS 75 2HB HIS 75 14.126 24.288 -1.448
566 HD1 HIS 75 HD1 HIS 75 14.982 21.626 -1.159
567 HD2 HIS 75 HD2 HIS 75 17.891 24.610 -1.309
568 HE1 HIS 75 HE1 HIS 75 17.085 20.628 -0.160
569 H HIS 76 H HIS 76 12.185 23.026 -3.429
570 HA HIS 76 HA HIS 76 10.191 23.870 -4.314
571 HB2 HIS 76 1HB HIS 76 11.564 26.489 -3.636
572 HB3 HIS 76 2HB HIS 76 9.845 26.300 -3.983
573 HD1 HIS 76 HD1 HIS 76 8.736 24.241 -2.362
574 HD2 HIS 76 HD2 HIS 76 12.025 26.363 -0.926
575 HE1 HIS 76 HE1 HIS 76 8.752 23.924 0.152
Start of MODEL 3
1 H1 ALA 1 1H ALA 1 9.275 9.564 12.609
2 H2 ALA 1 2H ALA 1 8.012 9.481 11.477
3 H3 ALA 1 3H ALA 1 9.450 10.298 11.090
4 HA ALA 1 HA ALA 1 10.694 8.283 11.053
5 HB1 ALA 1 3HB ALA 1 8.115 7.128 12.133
6 HB2 ALA 1 1HB ALA 1 9.719 7.066 12.862
7 HB3 ALA 1 2HB ALA 1 9.371 6.119 11.416
8 H GLU 2 H GLU 2 7.394 7.272 10.299
9 HA GLU 2 HA GLU 2 6.358 6.762 8.279
10 HB2 GLU 2 1HB GLU 2 8.050 9.116 7.404
11 HB3 GLU 2 2HB GLU 2 6.836 8.350 6.382
12 HG2 GLU 2 1HG GLU 2 5.106 8.814 8.061
13 HG3 GLU 2 2HG GLU 2 6.313 9.555 9.114
14 H LYS 3 H LYS 3 6.656 5.442 6.489
15 HA LYS 3 HA LYS 3 9.456 4.856 5.628
16 HB2 LYS 3 1HB LYS 3 7.401 2.841 6.581
17 HB3 LYS 3 2HB LYS 3 8.880 2.409 5.719
18 HG2 LYS 3 1HG LYS 3 10.226 3.492 7.473
19 HG3 LYS 3 2HG LYS 3 8.753 3.934 8.335
20 HD2 LYS 3 1HD LYS 3 8.174 1.550 8.577
21 HD3 LYS 3 2HD LYS 3 9.651 1.106 7.717
22 HE2 LYS 3 1HE LYS 3 11.007 2.198 9.453
23 HE3 LYS 3 2HE LYS 3 9.540 2.672 10.311
24 HZ1 LYS 3 3HZ LYS 3 10.599 0.623 11.173
25 HZ2 LYS 3 1HZ LYS 3 10.266 -0.137 9.694
26 HZ3 LYS 3 2HZ LYS 3 8.989 0.401 10.678
27 H THR 4 H THR 4 9.545 3.880 3.504
28 HA THR 4 HA THR 4 7.026 4.272 1.909
29 HB THR 4 HB THR 4 9.752 4.284 0.639
30 HG1 THR 4 HG1 THR 4 10.208 5.768 2.109
31 HG21 THR 4 3HG2 THR 4 8.664 5.928 -0.825
32 HG22 THR 4 1HG2 THR 4 7.209 5.860 0.169
33 HG23 THR 4 2HG2 THR 4 7.720 4.439 -0.741
34 H GLY 5 H GLY 5 6.222 2.473 1.012
35 HA2 GLY 5 1HA GLY 5 7.832 -0.031 1.069
36 HA3 GLY 5 2HA GLY 5 6.082 0.062 0.910
37 H ILE 6 H ILE 6 8.334 -1.170 -0.816
38 HA ILE 6 HA ILE 6 7.881 0.304 -3.367
39 HB ILE 6 HB ILE 6 9.536 -2.187 -2.881
40 HG12 ILE 6 1HG1 ILE 6 10.377 -0.499 -1.375
41 HG13 ILE 6 2HG1 ILE 6 11.463 -0.550 -2.762
42 HG21 ILE 6 1HG2 ILE 6 8.989 -1.649 -5.238
43 HG22 ILE 6 2HG2 ILE 6 10.710 -1.443 -4.911
44 HG23 ILE 6 3HG2 ILE 6 9.657 -0.033 -5.012
45 HD11 ILE 6 3HD1 ILE 6 9.392 1.526 -2.067
46 HD12 ILE 6 1HD1 ILE 6 9.952 1.338 -3.729
47 HD13 ILE 6 2HD1 ILE 6 11.097 1.754 -2.454
48 H VAL 7 H VAL 7 6.096 -0.244 -4.495
49 HA VAL 7 HA VAL 7 4.714 -2.771 -3.988
50 HB VAL 7 HB VAL 7 4.218 -0.529 -5.967
51 HG11 VAL 7 1HG1 VAL 7 3.203 -2.477 -6.898
52 HG12 VAL 7 2HG1 VAL 7 1.908 -1.629 -6.053
53 HG13 VAL 7 3HG1 VAL 7 2.666 -3.042 -5.318
54 HG21 VAL 7 3HG2 VAL 7 2.531 0.183 -4.410
55 HG22 VAL 7 1HG2 VAL 7 4.001 -0.084 -3.473
56 HG23 VAL 7 2HG2 VAL 7 2.712 -1.286 -3.451
57 H ASN 8 H ASN 8 4.870 -4.615 -5.197
58 HA ASN 8 HA ASN 8 6.227 -4.472 -7.866
59 HB2 ASN 8 1HB ASN 8 7.830 -5.257 -6.129
60 HB3 ASN 8 2HB ASN 8 6.729 -6.579 -5.743
61 HD21 ASN 8 2HD2 ASN 8 8.393 -8.139 -6.477
62 HD22 ASN 8 1HD2 ASN 8 8.670 -8.381 -8.134
63 H VAL 9 H VAL 9 4.558 -4.974 -9.188
64 HA VAL 9 HA VAL 9 3.290 -7.618 -8.881
65 HB VAL 9 HB VAL 9 1.003 -6.612 -9.204
66 HG11 VAL 9 1HG1 VAL 9 2.017 -7.287 -6.945
67 HG12 VAL 9 2HG1 VAL 9 0.662 -6.160 -6.887
68 HG13 VAL 9 3HG1 VAL 9 2.310 -5.568 -6.683
69 HG21 VAL 9 3HG2 VAL 9 2.485 -4.051 -8.526
70 HG22 VAL 9 1HG2 VAL 9 0.734 -4.214 -8.640
71 HG23 VAL 9 2HG2 VAL 9 1.735 -4.423 -10.075
72 H SER 10 H SER 10 4.441 -4.997 -10.689
73 HA SER 10 HA SER 10 4.474 -4.505 -12.988
74 HB2 SER 10 1HB SER 10 5.339 -6.283 -14.270
75 HB3 SER 10 2HB SER 10 5.832 -6.680 -12.626
76 HG SER 10 HG SER 10 4.775 -8.464 -12.932
77 H SER 11 H SER 11 1.774 -5.252 -11.656
78 HA SER 11 HA SER 11 0.240 -5.217 -14.172
79 HB2 SER 11 1HB SER 11 -0.268 -7.326 -12.054
80 HB3 SER 11 2HB SER 11 -1.174 -7.101 -13.547
81 HG SER 11 HG SER 11 1.621 -7.578 -13.474
82 H SER 12 H SER 12 0.743 -3.318 -12.063
83 HA SER 12 HA SER 12 -0.420 -1.757 -10.774
84 HB2 SER 12 1HB SER 12 -1.937 -1.877 -12.817
85 HB3 SER 12 2HB SER 12 -2.938 -2.999 -11.901
86 HG SER 12 HG SER 12 -2.279 -0.821 -10.438
87 H LEU 13 H LEU 13 -1.337 -1.621 -8.709
88 HA LEU 13 HA LEU 13 -2.151 -4.223 -7.450
89 HB2 LEU 13 1HB LEU 13 -0.033 -3.423 -6.543
90 HB3 LEU 13 2HB LEU 13 -0.725 -1.830 -6.242
91 HG LEU 13 HG LEU 13 -2.266 -2.759 -4.590
92 HD11 LEU 13 1HD1 LEU 13 -1.801 -5.267 -3.968
93 HD12 LEU 13 2HD1 LEU 13 -1.184 -5.380 -5.616
94 HD13 LEU 13 3HD1 LEU 13 -2.858 -4.903 -5.330
95 HD21 LEU 13 3HD2 LEU 13 0.631 -3.575 -4.304
96 HD22 LEU 13 1HD2 LEU 13 -0.525 -3.736 -2.984
97 HD23 LEU 13 2HD2 LEU 13 -0.165 -2.143 -3.651
98 H ASN 14 H ASN 14 -4.114 -4.280 -6.488
99 HA ASN 14 HA ASN 14 -5.867 -1.955 -6.732
100 HB2 ASN 14 1HB ASN 14 -7.602 -3.470 -5.891
101 HB3 ASN 14 2HB ASN 14 -6.674 -4.262 -7.164
102 HD21 ASN 14 2HD2 ASN 14 -5.781 -6.271 -6.637
103 HD22 ASN 14 1HD2 ASN 14 -5.618 -6.872 -5.059
104 H VAL 15 H VAL 15 -6.526 -0.617 -5.083
105 HA VAL 15 HA VAL 15 -5.089 -0.854 -2.503
106 HB VAL 15 HB VAL 15 -6.843 1.309 -3.708
107 HG11 VAL 15 1HG1 VAL 15 -5.477 1.101 -1.017
108 HG12 VAL 15 2HG1 VAL 15 -7.166 1.482 -1.351
109 HG13 VAL 15 3HG1 VAL 15 -5.905 2.654 -1.734
110 HG21 VAL 15 3HG2 VAL 15 -3.899 1.369 -3.012
111 HG22 VAL 15 1HG2 VAL 15 -4.796 2.504 -4.022
112 HG23 VAL 15 2HG2 VAL 15 -4.484 0.866 -4.598
113 H ARG 16 H ARG 16 -6.086 -1.559 -0.664
114 HA ARG 16 HA ARG 16 -8.954 -2.312 -0.852
115 HB2 ARG 16 1HB ARG 16 -6.779 -2.986 1.143
116 HB3 ARG 16 2HB ARG 16 -8.449 -3.535 1.283
117 HG2 ARG 16 1HG ARG 16 -8.261 -4.599 -0.955
118 HG3 ARG 16 2HG ARG 16 -6.569 -4.107 -1.026
119 HD2 ARG 16 1HD ARG 16 -6.148 -5.399 1.068
120 HD3 ARG 16 2HD ARG 16 -7.819 -5.960 1.022
121 HE ARG 16 HE ARG 16 -5.644 -6.869 -0.724
122 HH11 ARG 16 1HH2 ARG 16 -9.038 -6.525 -0.197
123 HH12 ARG 16 2HH2 ARG 16 -9.465 -7.844 -1.236
124 HH21 ARG 16 1HH1 ARG 16 -6.184 -8.591 -2.080
125 HH22 ARG 16 2HH1 ARG 16 -7.849 -9.012 -2.304
126 H GLU 17 H GLU 17 -10.518 -1.392 0.419
127 HA GLU 17 HA GLU 17 -10.048 1.194 1.575
128 HB2 GLU 17 1HB GLU 17 -12.222 0.420 0.628
129 HB3 GLU 17 2HB GLU 17 -12.386 -0.695 1.981
130 HG2 GLU 17 1HG GLU 17 -13.660 1.270 2.510
131 HG3 GLU 17 2HG GLU 17 -12.226 1.303 3.530
132 H GLY 18 H GLY 18 -10.568 -2.035 3.001
133 HA2 GLY 18 1HA GLY 18 -9.646 -0.950 5.648
134 HA3 GLY 18 2HA GLY 18 -10.840 -2.235 5.485
135 H ALA 19 H ALA 19 -9.222 -3.317 6.947
136 HA ALA 19 HA ALA 19 -6.849 -4.399 5.499
137 HB1 ALA 19 3HB ALA 19 -6.524 -3.435 7.771
138 HB2 ALA 19 1HB ALA 19 -6.120 -5.151 7.715
139 HB3 ALA 19 2HB ALA 19 -7.651 -4.628 8.420
140 H SER 20 H SER 20 -9.033 -5.471 4.372
141 HA SER 20 HA SER 20 -8.956 -8.272 5.302
142 HB2 SER 20 1HB SER 20 -10.839 -7.418 6.588
143 HB3 SER 20 2HB SER 20 -11.529 -6.676 5.148
144 HG SER 20 HG SER 20 -11.179 -9.430 5.721
145 H THR 21 H THR 21 -9.603 -9.745 3.657
146 HA THR 21 HA THR 21 -9.148 -8.840 0.963
147 HB THR 21 HB THR 21 -9.823 -11.180 0.361
148 HG1 THR 21 HG1 THR 21 -10.465 -11.162 3.109
149 HG21 THR 21 3HG2 THR 21 -8.009 -12.284 1.653
150 HG22 THR 21 1HG2 THR 21 -7.949 -10.887 2.727
151 HG23 THR 21 2HG2 THR 21 -7.510 -10.711 1.027
152 H SER 22 H SER 22 -11.976 -9.150 2.948
153 HA SER 22 HA SER 22 -13.856 -9.135 0.696
154 HB2 SER 22 1HB SER 22 -15.568 -9.109 2.411
155 HB3 SER 22 2HB SER 22 -14.323 -10.257 2.898
156 HG SER 22 HG SER 22 -13.709 -8.946 4.465
157 H SER 23 H SER 23 -11.882 -6.831 2.013
158 HA SER 23 HA SER 23 -13.628 -4.593 2.349
159 HB2 SER 23 1HB SER 23 -11.612 -3.235 2.160
160 HB3 SER 23 2HB SER 23 -11.275 -4.659 3.141
161 HG SER 23 HG SER 23 -10.165 -3.872 0.816
162 H LYS 24 H LYS 24 -13.837 -2.730 0.888
163 HA LYS 24 HA LYS 24 -14.234 -3.618 -1.910
164 HB2 LYS 24 1HB LYS 24 -15.480 -1.496 -2.136
165 HB3 LYS 24 2HB LYS 24 -16.071 -2.451 -0.780
166 HG2 LYS 24 1HG LYS 24 -14.662 -1.096 0.753
167 HG3 LYS 24 2HG LYS 24 -14.173 -0.097 -0.619
168 HD2 LYS 24 1HD LYS 24 -16.452 0.607 -1.008
169 HD3 LYS 24 2HD LYS 24 -17.058 -0.534 0.192
170 HE2 LYS 24 1HE LYS 24 -16.961 1.740 1.125
171 HE3 LYS 24 2HE LYS 24 -15.831 0.675 1.958
172 HZ1 LYS 24 3HZ LYS 24 -14.881 2.858 1.334
173 HZ2 LYS 24 1HZ LYS 24 -15.090 2.453 -0.300
174 HZ3 LYS 24 2HZ LYS 24 -14.036 1.542 0.671
175 H VAL 25 H VAL 25 -13.131 -2.767 -3.649
176 HA VAL 25 HA VAL 25 -10.642 -1.301 -3.060
177 HB VAL 25 HB VAL 25 -11.729 -2.253 -5.726
178 HG11 VAL 25 1HG1 VAL 25 -9.850 -0.548 -5.703
179 HG12 VAL 25 2HG1 VAL 25 -9.450 -2.076 -6.482
180 HG13 VAL 25 3HG1 VAL 25 -8.873 -1.742 -4.849
181 HG21 VAL 25 3HG2 VAL 25 -9.971 -3.635 -3.677
182 HG22 VAL 25 1HG2 VAL 25 -10.207 -4.208 -5.329
183 HG23 VAL 25 2HG2 VAL 25 -11.572 -4.146 -4.214
184 H ILE 26 H ILE 26 -10.397 0.858 -3.354
185 HA ILE 26 HA ILE 26 -12.623 2.380 -4.644
186 HB ILE 26 HB ILE 26 -11.615 4.340 -3.478
187 HG12 ILE 26 1HG1 ILE 26 -9.791 2.269 -2.215
188 HG13 ILE 26 2HG1 ILE 26 -9.275 3.420 -3.445
189 HG21 ILE 26 1HG2 ILE 26 -12.453 3.773 -1.326
190 HG22 ILE 26 2HG2 ILE 26 -12.000 2.078 -1.506
191 HG23 ILE 26 3HG2 ILE 26 -13.344 2.735 -2.439
192 HD11 ILE 26 3HD1 ILE 26 -8.714 4.295 -1.243
193 HD12 ILE 26 1HD1 ILE 26 -10.383 4.100 -0.710
194 HD13 ILE 26 2HD1 ILE 26 -9.987 5.284 -1.957
195 H GLY 27 H GLY 27 -9.543 1.180 -5.303
196 HA2 GLY 27 1HA GLY 27 -9.341 2.304 -7.865
197 HA3 GLY 27 2HA GLY 27 -8.438 3.378 -6.798
198 H SER 28 H SER 28 -6.556 2.645 -8.133
199 HA SER 28 HA SER 28 -5.239 0.346 -6.831
200 HB2 SER 28 1HB SER 28 -4.592 -0.600 -9.085
201 HB3 SER 28 2HB SER 28 -6.298 -0.785 -8.685
202 HG SER 28 HG SER 28 -6.237 0.036 -10.723
203 H LEU 29 H LEU 29 -2.893 0.267 -7.470
204 HA LEU 29 HA LEU 29 -1.883 2.952 -8.371
205 HB2 LEU 29 1HB LEU 29 -0.703 1.134 -6.249
206 HB3 LEU 29 2HB LEU 29 -0.054 2.692 -6.761
207 HG LEU 29 HG LEU 29 -2.796 2.271 -5.533
208 HD11 LEU 29 1HD1 LEU 29 -1.803 3.428 -3.568
209 HD12 LEU 29 2HD1 LEU 29 -0.231 3.394 -4.367
210 HD13 LEU 29 3HD1 LEU 29 -1.016 1.885 -3.900
211 HD21 LEU 29 3HD2 LEU 29 -3.002 4.225 -6.817
212 HD22 LEU 29 1HD2 LEU 29 -1.312 4.676 -6.591
213 HD23 LEU 29 2HD2 LEU 29 -2.466 4.873 -5.271
214 H SER 30 H SER 30 -0.003 2.922 -9.640
215 HA SER 30 HA SER 30 0.327 0.606 -11.315
216 HB2 SER 30 1HB SER 30 0.701 2.833 -12.201
217 HB3 SER 30 2HB SER 30 1.981 3.124 -11.026
218 HG SER 30 HG SER 30 1.935 1.419 -13.264
219 H GLY 31 H GLY 31 2.184 -0.741 -11.533
220 HA2 GLY 31 1HA GLY 31 3.316 -1.689 -9.099
221 HA3 GLY 31 2HA GLY 31 3.878 -2.126 -10.708
222 H ASN 32 H ASN 32 5.621 -1.735 -8.521
223 HA ASN 32 HA ASN 32 7.607 -0.642 -7.952
224 HB2 ASN 32 1HB ASN 32 7.391 0.574 -10.722
225 HB3 ASN 32 2HB ASN 32 8.854 0.366 -9.761
226 HD21 ASN 32 2HD2 ASN 32 8.375 -2.303 -8.812
227 HD22 ASN 32 1HD2 ASN 32 8.442 -3.356 -10.140
228 H THR 33 H THR 33 5.053 0.640 -7.327
229 HA THR 33 HA THR 33 5.750 3.541 -7.552
230 HB THR 33 HB THR 33 3.145 2.139 -6.876
231 HG1 THR 33 HG1 THR 33 2.578 3.367 -8.825
232 HG21 THR 33 3HG2 THR 33 3.948 5.053 -6.825
233 HG22 THR 33 1HG2 THR 33 3.166 4.118 -5.550
234 HG23 THR 33 2HG2 THR 33 2.268 4.547 -7.006
235 H LYS 34 H LYS 34 6.209 4.707 -5.747
236 HA LYS 34 HA LYS 34 6.727 3.272 -3.247
237 HB2 LYS 34 1HB LYS 34 7.209 6.018 -4.356
238 HB3 LYS 34 2HB LYS 34 7.194 5.856 -2.604
239 HG2 LYS 34 1HG LYS 34 9.477 5.602 -3.579
240 HG3 LYS 34 2HG LYS 34 8.949 4.161 -2.710
241 HD2 LYS 34 1HD LYS 34 8.494 2.979 -4.712
242 HD3 LYS 34 2HD LYS 34 8.520 4.450 -5.684
243 HE2 LYS 34 1HE LYS 34 10.900 4.681 -5.397
244 HE3 LYS 34 2HE LYS 34 10.938 3.379 -4.211
245 HZ1 LYS 34 3HZ LYS 34 11.495 2.969 -6.737
246 HZ2 LYS 34 1HZ LYS 34 9.812 2.792 -6.842
247 HZ3 LYS 34 2HZ LYS 34 10.705 1.793 -5.798
248 H VAL 35 H VAL 35 5.513 3.424 -1.352
249 HA VAL 35 HA VAL 35 3.041 5.140 -1.451
250 HB VAL 35 HB VAL 35 1.853 3.341 -0.247
251 HG11 VAL 35 1HG1 VAL 35 1.621 1.845 -2.157
252 HG12 VAL 35 2HG1 VAL 35 3.195 2.345 -2.778
253 HG13 VAL 35 3HG1 VAL 35 1.855 3.491 -2.747
254 HG21 VAL 35 3HG2 VAL 35 4.521 1.947 -0.574
255 HG22 VAL 35 1HG2 VAL 35 3.026 1.050 -0.301
256 HG23 VAL 35 2HG2 VAL 35 3.602 2.197 0.910
257 H THR 36 H THR 36 2.823 6.449 0.277
258 HA THR 36 HA THR 36 4.876 6.527 2.315
259 HB THR 36 HB THR 36 2.200 7.950 2.224
260 HG1 THR 36 HG1 THR 36 4.325 8.127 0.651
261 HG21 THR 36 3HG2 THR 36 4.762 8.413 3.762
262 HG22 THR 36 1HG2 THR 36 3.144 8.148 4.413
263 HG23 THR 36 2HG2 THR 36 3.522 9.653 3.573
264 H ILE 37 H ILE 37 4.897 5.411 4.198
265 HA ILE 37 HA ILE 37 2.381 4.047 5.088
266 HB ILE 37 HB ILE 37 5.288 3.459 5.725
267 HG12 ILE 37 1HG1 ILE 37 3.301 1.839 4.115
268 HG13 ILE 37 2HG1 ILE 37 4.448 2.959 3.380
269 HG21 ILE 37 1HG2 ILE 37 4.252 1.336 6.672
270 HG22 ILE 37 2HG2 ILE 37 2.691 2.151 6.564
271 HG23 ILE 37 3HG2 ILE 37 3.957 2.802 7.606
272 HD11 ILE 37 3HD1 ILE 37 6.314 1.712 4.440
273 HD12 ILE 37 1HD1 ILE 37 5.365 0.684 3.366
274 HD13 ILE 37 2HD1 ILE 37 5.148 0.571 5.112
275 H VAL 38 H VAL 38 1.439 4.784 6.902
276 HA VAL 38 HA VAL 38 3.016 6.559 8.739
277 HB VAL 38 HB VAL 38 0.779 7.439 9.423
278 HG11 VAL 38 1HG1 VAL 38 2.097 8.570 7.661
279 HG12 VAL 38 2HG1 VAL 38 0.368 8.703 7.339
280 HG13 VAL 38 3HG1 VAL 38 1.345 7.541 6.442
281 HG21 VAL 38 3HG2 VAL 38 -0.151 5.624 7.176
282 HG22 VAL 38 1HG2 VAL 38 -1.149 6.874 7.917
283 HG23 VAL 38 2HG2 VAL 38 -0.597 5.502 8.878
284 H GLY 39 H GLY 39 1.826 3.460 8.429
285 HA2 GLY 39 1HA GLY 39 2.411 2.715 11.095
286 HA3 GLY 39 2HA GLY 39 0.670 2.971 10.995
287 H GLU 40 H GLU 40 0.954 0.509 11.565
288 HA GLU 40 HA GLU 40 0.665 -0.989 9.002
289 HB2 GLU 40 1HB GLU 40 2.004 -2.857 9.903
290 HB3 GLU 40 2HB GLU 40 2.975 -1.393 9.770
291 HG2 GLU 40 1HG GLU 40 2.600 -0.937 12.177
292 HG3 GLU 40 2HG GLU 40 1.665 -2.427 12.305
293 H GLU 41 H GLU 41 -0.645 -2.932 9.247
294 HA GLU 41 HA GLU 41 -1.924 -3.376 11.873
295 HB2 GLU 41 1HB GLU 41 -3.262 -1.559 10.775
296 HB3 GLU 41 2HB GLU 41 -3.579 -2.654 9.430
297 HG2 GLU 41 1HG GLU 41 -5.473 -2.776 10.921
298 HG3 GLU 41 2HG GLU 41 -4.571 -4.278 11.104
299 H GLY 42 H GLY 42 -1.665 -5.528 12.051
300 HA2 GLY 42 1HA GLY 42 -1.795 -7.812 11.563
301 HA3 GLY 42 2HA GLY 42 -3.014 -7.378 10.367
302 H ALA 43 H ALA 43 -2.288 -8.758 8.750
303 HA ALA 43 HA ALA 43 0.521 -8.739 7.901
304 HB1 ALA 43 3HB ALA 43 -0.959 -10.790 7.852
305 HB2 ALA 43 1HB ALA 43 -0.157 -10.435 6.322
306 HB3 ALA 43 2HB ALA 43 -1.860 -10.030 6.541
307 H PHE 44 H PHE 44 -1.251 -6.287 7.719
308 HA PHE 44 HA PHE 44 -0.797 -5.711 4.812
309 HB2 PHE 44 1HB PHE 44 -3.170 -4.889 6.519
310 HB3 PHE 44 2HB PHE 44 -2.853 -4.299 4.888
311 HD1 PHE 44 HD1 PHE 44 -3.692 -7.282 6.909
312 HD2 PHE 44 HD2 PHE 44 -3.243 -5.676 2.952
313 HE1 PHE 44 HE1 PHE 44 -4.808 -9.287 5.970
314 HE2 PHE 44 HE2 PHE 44 -4.357 -7.682 2.011
315 HZ PHE 44 HZ PHE 44 -5.141 -9.487 3.520
316 H TYR 45 H TYR 45 -0.243 -3.514 4.370
317 HA TYR 45 HA TYR 45 0.857 -2.064 6.745
318 HB2 TYR 45 1HB TYR 45 1.620 -2.250 3.846
319 HB3 TYR 45 2HB TYR 45 1.968 -0.740 4.685
320 HD1 TYR 45 HD1 TYR 45 2.945 -1.152 7.186
321 HD2 TYR 45 HD2 TYR 45 3.350 -3.840 3.857
322 HE1 TYR 45 HE1 TYR 45 4.941 -2.163 8.246
323 HE2 TYR 45 HE2 TYR 45 5.352 -4.850 4.923
324 HH TYR 45 HH TYR 45 6.599 -3.611 8.026
325 H LYS 46 H LYS 46 0.165 -0.015 7.211
326 HA LYS 46 HA LYS 46 -2.270 0.915 5.808
327 HB2 LYS 46 1HB LYS 46 -2.218 0.868 8.285
328 HB3 LYS 46 2HB LYS 46 -0.850 1.982 8.274
329 HG2 LYS 46 1HG LYS 46 -2.211 3.694 7.179
330 HG3 LYS 46 2HG LYS 46 -3.574 2.579 7.084
331 HD2 LYS 46 1HD LYS 46 -3.628 2.439 9.549
332 HD3 LYS 46 2HD LYS 46 -2.274 3.569 9.638
333 HE2 LYS 46 1HE LYS 46 -4.388 4.770 9.961
334 HE3 LYS 46 2HE LYS 46 -3.635 5.265 8.446
335 HZ1 LYS 46 3HZ LYS 46 -5.064 3.729 7.263
336 HZ2 LYS 46 1HZ LYS 46 -5.995 4.822 8.165
337 HZ3 LYS 46 2HZ LYS 46 -5.782 3.231 8.720
338 H ILE 47 H ILE 47 -2.215 2.561 4.350
339 HA ILE 47 HA ILE 47 0.172 4.370 4.311
340 HB ILE 47 HB ILE 47 0.050 4.328 1.824
341 HG12 ILE 47 1HG1 ILE 47 -1.760 1.926 2.215
342 HG13 ILE 47 2HG1 ILE 47 -2.361 3.522 1.767
343 HG21 ILE 47 1HG2 ILE 47 1.730 2.971 2.821
344 HG22 ILE 47 2HG2 ILE 47 0.943 1.937 1.629
345 HG23 ILE 47 3HG2 ILE 47 0.556 1.763 3.342
346 HD11 ILE 47 3HD1 ILE 47 -0.443 1.780 0.202
347 HD12 ILE 47 1HD1 ILE 47 -0.766 3.467 -0.197
348 HD13 ILE 47 2HD1 ILE 47 -2.067 2.278 -0.272
349 H GLU 48 H GLU 48 -0.248 6.474 3.445
350 HA GLU 48 HA GLU 48 -2.977 7.382 4.040
351 HB2 GLU 48 1HB GLU 48 -0.914 8.641 4.730
352 HB3 GLU 48 2HB GLU 48 -0.595 8.968 3.026
353 HG2 GLU 48 1HG GLU 48 -1.746 10.882 3.929
354 HG3 GLU 48 2HG GLU 48 -2.886 10.026 2.891
355 H TYR 49 H TYR 49 -4.376 6.765 2.401
356 HA TYR 49 HA TYR 49 -3.597 7.051 -0.416
357 HB2 TYR 49 1HB TYR 49 -5.015 5.173 0.293
358 HB3 TYR 49 2HB TYR 49 -6.254 6.303 0.837
359 HD1 TYR 49 HD1 TYR 49 -4.292 5.264 -2.164
360 HD2 TYR 49 HD2 TYR 49 -7.844 7.171 -0.682
361 HE1 TYR 49 HE1 TYR 49 -5.196 5.373 -4.470
362 HE2 TYR 49 HE2 TYR 49 -8.749 7.278 -2.988
363 HH TYR 49 HH TYR 49 -6.927 6.916 -5.692
364 H LYS 50 H LYS 50 -4.497 8.553 -1.873
365 HA LYS 50 HA LYS 50 -5.005 11.168 -0.871
366 HB2 LYS 50 1HB LYS 50 -5.555 9.919 -3.577
367 HB3 LYS 50 2HB LYS 50 -5.690 11.648 -3.244
368 HG2 LYS 50 1HG LYS 50 -3.331 11.694 -2.517
369 HG3 LYS 50 2HG LYS 50 -3.190 9.971 -2.866
370 HD2 LYS 50 1HD LYS 50 -3.928 12.091 -4.906
371 HD3 LYS 50 2HD LYS 50 -2.317 11.401 -4.715
372 HE2 LYS 50 1HE LYS 50 -3.102 9.979 -6.358
373 HE3 LYS 50 2HE LYS 50 -3.728 9.102 -4.962
374 HZ1 LYS 50 3HZ LYS 50 -5.537 11.138 -5.631
375 HZ2 LYS 50 1HZ LYS 50 -5.770 9.460 -5.698
376 HZ3 LYS 50 2HZ LYS 50 -5.158 10.285 -7.051
377 H GLY 51 H GLY 51 -6.771 11.455 0.463
378 HA2 GLY 51 1HA GLY 51 -9.098 12.145 0.532
379 HA3 GLY 51 2HA GLY 51 -9.457 10.999 -0.759
380 H SER 52 H SER 52 -7.539 9.168 1.085
381 HA SER 52 HA SER 52 -9.220 8.648 3.385
382 HB2 SER 52 1HB SER 52 -9.485 6.855 0.962
383 HB3 SER 52 2HB SER 52 -9.951 6.354 2.584
384 HG SER 52 HG SER 52 -11.583 7.748 2.561
385 H HIS 53 H HIS 53 -8.667 5.970 3.813
386 HA HIS 53 HA HIS 53 -5.667 5.944 3.917
387 HB2 HIS 53 1HB HIS 53 -7.735 4.649 5.723
388 HB3 HIS 53 2HB HIS 53 -5.992 4.411 5.865
389 HD1 HIS 53 HD1 HIS 53 -4.606 6.820 6.040
390 HD2 HIS 53 HD2 HIS 53 -8.617 6.829 7.173
391 HE1 HIS 53 HE1 HIS 53 -4.946 8.892 7.458
392 H GLY 54 H GLY 54 -4.825 4.570 2.432
393 HA2 GLY 54 1HA GLY 54 -6.467 2.321 1.408
394 HA3 GLY 54 2HA GLY 54 -4.937 2.879 0.733
395 H TYR 55 H TYR 55 -5.710 0.141 1.449
396 HA TYR 55 HA TYR 55 -3.533 -0.451 3.431
397 HB2 TYR 55 1HB TYR 55 -6.227 -1.804 3.094
398 HB3 TYR 55 2HB TYR 55 -4.907 -2.469 4.058
399 HD1 TYR 55 HD2 TYR 55 -7.281 0.360 3.731
400 HD2 TYR 55 HD1 TYR 55 -4.301 -1.526 6.182
401 HE1 TYR 55 HE2 TYR 55 -7.920 1.820 5.633
402 HE2 TYR 55 HE1 TYR 55 -4.938 -0.066 8.082
403 HH TYR 55 HH TYR 55 -6.910 1.230 8.819
404 H VAL 56 H VAL 56 -2.070 -2.008 2.753
405 HA VAL 56 HA VAL 56 -2.723 -3.558 0.273
406 HB VAL 56 HB VAL 56 -0.320 -3.118 -0.444
407 HG11 VAL 56 1HG1 VAL 56 -2.343 -0.866 -0.277
408 HG12 VAL 56 2HG1 VAL 56 -2.138 -2.021 -1.595
409 HG13 VAL 56 3HG1 VAL 56 -0.901 -0.802 -1.291
410 HG21 VAL 56 3HG2 VAL 56 0.742 -1.106 0.497
411 HG22 VAL 56 1HG2 VAL 56 0.459 -2.294 1.769
412 HG23 VAL 56 2HG2 VAL 56 -0.609 -0.899 1.609
413 H ALA 57 H ALA 57 -1.961 -5.628 0.281
414 HA ALA 57 HA ALA 57 -1.158 -6.788 2.779
415 HB1 ALA 57 3HB ALA 57 -1.359 -8.839 1.695
416 HB2 ALA 57 1HB ALA 57 -0.755 -8.207 0.162
417 HB3 ALA 57 2HB ALA 57 -2.391 -7.820 0.693
418 H LYS 58 H LYS 58 0.846 -7.727 3.364
419 HA LYS 58 HA LYS 58 3.192 -6.275 2.643
420 HB2 LYS 58 1HB LYS 58 2.837 -8.966 3.996
421 HB3 LYS 58 2HB LYS 58 4.388 -8.135 3.860
422 HG2 LYS 58 1HG LYS 58 3.425 -6.183 5.048
423 HG3 LYS 58 2HG LYS 58 1.904 -7.053 5.222
424 HD2 LYS 58 1HD LYS 58 2.984 -8.781 6.544
425 HD3 LYS 58 2HD LYS 58 4.565 -8.043 6.282
426 HE2 LYS 58 1HE LYS 58 3.712 -7.417 8.492
427 HE3 LYS 58 2HE LYS 58 3.779 -5.996 7.449
428 HZ1 LYS 58 3HZ LYS 58 1.298 -7.237 7.091
429 HZ2 LYS 58 1HZ LYS 58 1.623 -5.711 7.755
430 HZ3 LYS 58 2HZ LYS 58 1.560 -7.078 8.762
431 H GLU 59 H GLU 59 1.814 -9.286 1.450
432 HA GLU 59 HA GLU 59 4.010 -10.344 0.058
433 HB2 GLU 59 1HB GLU 59 1.070 -10.367 -0.706
434 HB3 GLU 59 2HB GLU 59 2.305 -11.377 -1.456
435 HG2 GLU 59 1HG GLU 59 1.443 -12.810 0.183
436 HG3 GLU 59 2HG GLU 59 2.839 -12.120 1.006
437 H TYR 60 H TYR 60 1.913 -7.638 -0.803
438 HA TYR 60 HA TYR 60 3.153 -7.462 -3.493
439 HB2 TYR 60 1HB TYR 60 1.127 -5.620 -2.188
440 HB3 TYR 60 2HB TYR 60 1.541 -5.697 -3.901
441 HD1 TYR 60 HD2 TYR 60 1.449 -8.275 -4.848
442 HD2 TYR 60 HD1 TYR 60 -0.877 -6.673 -1.607
443 HE1 TYR 60 HE2 TYR 60 -0.242 -10.056 -5.177
444 HE2 TYR 60 HE1 TYR 60 -2.566 -8.455 -1.939
445 HH TYR 60 HH TYR 60 -1.992 -11.151 -4.070
446 H ILE 61 H ILE 61 3.903 -6.487 -0.390
447 HA ILE 61 HA ILE 61 5.360 -4.040 -1.353
448 HB ILE 61 HB ILE 61 4.542 -4.778 1.471
449 HG12 ILE 61 1HG1 ILE 61 2.555 -4.272 0.163
450 HG13 ILE 61 2HG1 ILE 61 2.909 -2.894 1.201
451 HG21 ILE 61 1HG2 ILE 61 6.485 -3.389 1.526
452 HG22 ILE 61 2HG2 ILE 61 5.114 -2.327 1.842
453 HG23 ILE 61 3HG2 ILE 61 5.862 -2.350 0.245
454 HD11 ILE 61 3HD1 ILE 61 4.252 -2.016 -0.891
455 HD12 ILE 61 1HD1 ILE 61 2.497 -1.853 -0.850
456 HD13 ILE 61 2HD1 ILE 61 3.238 -3.155 -1.776
457 H LYS 62 H LYS 62 7.530 -4.151 -1.358
458 HA LYS 62 HA LYS 62 8.903 -6.070 0.461
459 HB2 LYS 62 1HB LYS 62 10.295 -6.908 -1.353
460 HB3 LYS 62 2HB LYS 62 8.599 -7.213 -1.725
461 HG2 LYS 62 1HG LYS 62 8.577 -5.118 -3.100
462 HG3 LYS 62 2HG LYS 62 10.310 -4.956 -2.821
463 HD2 LYS 62 1HD LYS 62 9.041 -7.410 -4.063
464 HD3 LYS 62 2HD LYS 62 9.701 -6.076 -5.003
465 HE2 LYS 62 1HE LYS 62 11.883 -6.445 -3.686
466 HE3 LYS 62 2HE LYS 62 11.177 -7.979 -3.178
467 HZ1 LYS 62 3HZ LYS 62 10.841 -7.624 -5.960
468 HZ2 LYS 62 1HZ LYS 62 11.647 -8.864 -5.131
469 HZ3 LYS 62 2HZ LYS 62 12.480 -7.445 -5.552
470 H ASP 63 H ASP 63 11.448 -5.711 -0.168
471 HA ASP 63 HA ASP 63 13.248 -4.266 0.151
472 HB2 ASP 63 1HB ASP 63 11.458 -2.569 -1.597
473 HB3 ASP 63 2HB ASP 63 13.058 -2.041 -1.085
474 H ILE 64 H ILE 64 10.634 -1.858 0.163
475 HA ILE 64 HA ILE 64 10.007 -0.307 1.778
476 HB ILE 64 HB ILE 64 10.861 -2.536 3.642
477 HG12 ILE 64 1HG1 ILE 64 8.100 -1.727 2.692
478 HG13 ILE 64 2HG1 ILE 64 9.038 -3.022 1.948
479 HG21 ILE 64 1HG2 ILE 64 9.265 -1.334 5.207
480 HG22 ILE 64 2HG2 ILE 64 9.300 0.019 4.078
481 HG23 ILE 64 3HG2 ILE 64 10.779 -0.487 4.894
482 HD11 ILE 64 3HD1 ILE 64 8.396 -2.947 4.906
483 HD12 ILE 64 1HD1 ILE 64 9.044 -4.300 3.980
484 HD13 ILE 64 2HD1 ILE 64 7.381 -3.772 3.723
485 H LYS 65 H LYS 65 10.869 1.316 3.137
486 HA LYS 65 HA LYS 65 13.868 1.285 3.361
487 HB2 LYS 65 1HB LYS 65 11.946 3.578 2.873
488 HB3 LYS 65 2HB LYS 65 13.668 3.779 3.198
489 HG2 LYS 65 1HG LYS 65 14.209 2.398 1.230
490 HG3 LYS 65 2HG LYS 65 12.488 2.187 0.903
491 HD2 LYS 65 1HD LYS 65 12.239 4.627 0.627
492 HD3 LYS 65 2HD LYS 65 13.963 4.836 0.940
493 HE2 LYS 65 1HE LYS 65 14.501 3.454 -1.025
494 HE3 LYS 65 2HE LYS 65 12.782 3.218 -1.336
495 HZ1 LYS 65 3HZ LYS 65 14.286 5.215 -2.352
496 HZ2 LYS 65 1HZ LYS 65 13.541 5.975 -1.033
497 HZ3 LYS 65 2HZ LYS 65 12.592 5.235 -2.232
498 H ASP 66 H ASP 66 14.305 0.855 5.470
499 HA ASP 66 HA ASP 66 12.527 1.866 7.603
500 HB2 ASP 66 1HB ASP 66 14.984 0.099 7.579
501 HB3 ASP 66 2HB ASP 66 14.223 0.648 9.072
502 H GLU 67 H GLU 67 12.838 3.938 8.239
503 HA GLU 67 HA GLU 67 15.476 5.218 7.914
504 HB2 GLU 67 1HB GLU 67 12.786 6.237 8.866
505 HB3 GLU 67 2HB GLU 67 14.238 7.238 8.787
506 HG2 GLU 67 1HG GLU 67 14.430 6.826 6.381
507 HG3 GLU 67 2HG GLU 67 13.037 5.745 6.436
508 H VAL 68 H VAL 68 14.076 3.269 10.199
509 HA VAL 68 HA VAL 68 16.027 4.098 12.229
510 HB VAL 68 HB VAL 68 14.218 5.570 12.860
511 HG11 VAL 68 1HG1 VAL 68 11.955 4.928 13.076
512 HG12 VAL 68 2HG1 VAL 68 12.346 3.209 13.093
513 HG13 VAL 68 3HG1 VAL 68 12.470 4.128 11.593
514 HG21 VAL 68 3HG2 VAL 68 13.943 3.164 14.670
515 HG22 VAL 68 1HG2 VAL 68 13.892 4.870 15.110
516 HG23 VAL 68 2HG2 VAL 68 15.417 4.131 14.624
517 H LEU 69 H LEU 69 16.934 2.173 12.722
518 HA LEU 69 HA LEU 69 15.454 -0.326 12.387
519 HB2 LEU 69 1HB LEU 69 18.229 0.184 13.502
520 HB3 LEU 69 2HB LEU 69 17.574 -1.388 13.044
521 HG LEU 69 HG LEU 69 17.941 0.969 11.169
522 HD11 LEU 69 1HD1 LEU 69 19.449 -1.655 11.223
523 HD12 LEU 69 2HD1 LEU 69 20.039 -0.188 12.003
524 HD13 LEU 69 3HD1 LEU 69 19.810 -0.226 10.255
525 HD21 LEU 69 3HD2 LEU 69 17.580 -1.041 9.484
526 HD22 LEU 69 1HD2 LEU 69 16.185 -0.248 10.209
527 HD23 LEU 69 2HD2 LEU 69 16.756 -1.787 10.855
528 H GLU 70 H GLU 70 14.698 -1.671 13.992
529 HA GLU 70 HA GLU 70 14.238 -0.434 16.612
530 HB2 GLU 70 1HB GLU 70 13.376 -3.069 15.396
531 HB3 GLU 70 2HB GLU 70 12.915 -2.538 17.014
532 HG2 GLU 70 1HG GLU 70 11.865 -0.530 16.086
533 HG3 GLU 70 2HG GLU 70 12.372 -0.995 14.462
534 H HIS 71 H HIS 71 14.646 -1.663 18.624
535 HA HIS 71 HA HIS 71 16.030 -2.809 20.106
536 HB2 HIS 71 1HB HIS 71 15.521 -4.703 18.416
537 HB3 HIS 71 2HB HIS 71 17.130 -4.386 17.773
538 HD1 HIS 71 HD1 HIS 71 15.412 -5.392 21.004
539 HD2 HIS 71 HD2 HIS 71 19.221 -5.414 19.313
540 HE1 HIS 71 HE1 HIS 71 16.895 -6.685 22.597
541 H HIS 72 H HIS 72 17.158 -0.987 17.516
542 HA HIS 72 HA HIS 72 20.014 -1.189 18.262
543 HB2 HIS 72 1HB HIS 72 18.502 0.424 16.191
544 HB3 HIS 72 2HB HIS 72 20.232 0.614 16.480
545 HD1 HIS 72 HD1 HIS 72 17.700 -1.864 15.199
546 HD2 HIS 72 HD2 HIS 72 21.840 -1.519 15.534
547 HE1 HIS 72 HE1 HIS 72 18.689 -3.770 13.855
548 H HIS 73 H HIS 73 17.281 0.446 19.340
549 HA HIS 73 HA HIS 73 18.430 3.032 19.922
550 HB2 HIS 73 1HB HIS 73 16.064 1.552 21.109
551 HB3 HIS 73 2HB HIS 73 16.474 3.226 21.489
552 HD1 HIS 73 HD1 HIS 73 14.997 1.077 18.832
553 HD2 HIS 73 HD2 HIS 73 16.152 5.057 19.282
554 HE1 HIS 73 HE1 HIS 73 14.004 2.335 16.871
555 H HIS 74 H HIS 74 19.428 3.755 21.812
556 HA HIS 74 HA HIS 74 19.893 1.751 23.991
557 HB2 HIS 74 1HB HIS 74 22.252 2.843 24.120
558 HB3 HIS 74 2HB HIS 74 21.952 1.652 22.857
559 HD1 HIS 74 HD1 HIS 74 23.865 2.848 21.451
560 HD2 HIS 74 HD2 HIS 74 20.476 5.176 22.146
561 HE1 HIS 74 HE1 HIS 74 23.997 4.803 19.848
562 H HIS 75 H HIS 75 18.338 2.853 25.256
563 HA HIS 75 HA HIS 75 17.428 4.596 26.555
564 HB2 HIS 75 1HB HIS 75 19.234 3.691 27.960
565 HB3 HIS 75 2HB HIS 75 20.377 4.815 27.225
566 HD1 HIS 75 HD1 HIS 75 17.095 4.927 29.179
567 HD2 HIS 75 HD2 HIS 75 20.496 7.251 28.531
568 HE1 HIS 75 HE1 HIS 75 16.897 6.932 30.714
569 H HIS 76 H HIS 76 16.757 6.013 24.857
570 HA HIS 76 HA HIS 76 18.383 7.936 23.545
571 HB2 HIS 76 1HB HIS 76 16.013 7.312 22.950
572 HB3 HIS 76 2HB HIS 76 15.474 8.260 24.336
573 HD1 HIS 76 HD1 HIS 76 15.778 10.850 24.214
574 HD2 HIS 76 HD2 HIS 76 16.899 8.844 20.736
575 HE1 HIS 76 HE1 HIS 76 16.048 12.619 22.421
Start of MODEL 4
1 H1 ALA 1 1H ALA 1 4.999 5.730 12.603
2 H2 ALA 1 2H ALA 1 5.769 5.408 14.083
3 H3 ALA 1 3H ALA 1 5.378 4.134 13.031
4 HA ALA 1 HA ALA 1 7.530 6.123 12.834
5 HB1 ALA 1 3HB ALA 1 8.725 4.011 12.048
6 HB2 ALA 1 1HB ALA 1 7.262 3.128 12.490
7 HB3 ALA 1 2HB ALA 1 8.174 3.999 13.723
8 H GLU 2 H GLU 2 8.112 6.973 10.882
9 HA GLU 2 HA GLU 2 6.325 6.559 8.609
10 HB2 GLU 2 1HB GLU 2 8.794 8.262 9.007
11 HB3 GLU 2 2HB GLU 2 7.858 8.239 7.509
12 HG2 GLU 2 1HG GLU 2 5.840 8.912 8.752
13 HG3 GLU 2 2HG GLU 2 6.764 8.924 10.254
14 H LYS 3 H LYS 3 6.639 5.132 6.995
15 HA LYS 3 HA LYS 3 9.400 4.250 6.322
16 HB2 LYS 3 1HB LYS 3 7.090 2.411 7.016
17 HB3 LYS 3 2HB LYS 3 8.584 1.877 6.244
18 HG2 LYS 3 1HG LYS 3 9.868 2.793 8.166
19 HG3 LYS 3 2HG LYS 3 8.350 3.216 8.954
20 HD2 LYS 3 1HD LYS 3 9.154 0.418 8.106
21 HD3 LYS 3 2HD LYS 3 9.251 1.041 9.752
22 HE2 LYS 3 1HE LYS 3 7.167 0.040 9.865
23 HE3 LYS 3 2HE LYS 3 6.663 1.620 9.268
24 HZ1 LYS 3 3HZ LYS 3 5.837 0.580 7.512
25 HZ2 LYS 3 1HZ LYS 3 6.492 -0.906 8.002
26 HZ3 LYS 3 2HZ LYS 3 7.416 0.156 7.050
27 H THR 4 H THR 4 9.490 3.274 4.159
28 HA THR 4 HA THR 4 7.131 4.008 2.444
29 HB THR 4 HB THR 4 8.722 4.592 0.689
30 HG1 THR 4 HG1 THR 4 10.864 4.403 2.454
31 HG21 THR 4 3HG2 THR 4 9.819 6.542 1.839
32 HG22 THR 4 1HG2 THR 4 9.308 5.854 3.381
33 HG23 THR 4 2HG2 THR 4 8.102 6.380 2.205
34 H GLY 5 H GLY 5 6.268 2.320 1.413
35 HA2 GLY 5 1HA GLY 5 7.821 -0.222 1.220
36 HA3 GLY 5 2HA GLY 5 6.064 -0.087 1.155
37 H ILE 6 H ILE 6 8.305 -1.102 -0.772
38 HA ILE 6 HA ILE 6 7.655 0.550 -3.160
39 HB ILE 6 HB ILE 6 9.475 -1.861 -3.028
40 HG12 ILE 6 1HG1 ILE 6 10.266 -0.342 -1.318
41 HG13 ILE 6 2HG1 ILE 6 11.310 -0.148 -2.727
42 HG21 ILE 6 1HG2 ILE 6 9.443 0.584 -4.823
43 HG22 ILE 6 2HG2 ILE 6 8.780 -0.991 -5.262
44 HG23 ILE 6 3HG2 ILE 6 10.511 -0.810 -4.973
45 HD11 ILE 6 3HD1 ILE 6 10.815 2.062 -2.045
46 HD12 ILE 6 1HD1 ILE 6 9.119 1.685 -1.757
47 HD13 ILE 6 2HD1 ILE 6 9.735 1.774 -3.407
48 H VAL 7 H VAL 7 5.956 -0.024 -4.364
49 HA VAL 7 HA VAL 7 4.584 -2.551 -3.992
50 HB VAL 7 HB VAL 7 4.205 -0.269 -5.944
51 HG11 VAL 7 1HG1 VAL 7 1.907 -1.393 -6.233
52 HG12 VAL 7 2HG1 VAL 7 2.656 -2.835 -5.551
53 HG13 VAL 7 3HG1 VAL 7 3.269 -2.153 -7.056
54 HG21 VAL 7 3HG2 VAL 7 2.390 0.355 -4.498
55 HG22 VAL 7 1HG2 VAL 7 3.785 0.064 -3.459
56 HG23 VAL 7 2HG2 VAL 7 2.515 -1.152 -3.591
57 H ASN 8 H ASN 8 4.741 -4.389 -5.212
58 HA ASN 8 HA ASN 8 6.180 -4.266 -7.824
59 HB2 ASN 8 1HB ASN 8 7.347 -6.424 -7.124
60 HB3 ASN 8 2HB ASN 8 7.914 -4.952 -6.340
61 HD21 ASN 8 2HD2 ASN 8 6.451 -8.061 -5.783
62 HD22 ASN 8 1HD2 ASN 8 6.252 -7.895 -4.105
63 H VAL 9 H VAL 9 4.366 -4.752 -9.037
64 HA VAL 9 HA VAL 9 3.173 -7.456 -8.587
65 HB VAL 9 HB VAL 9 0.966 -6.429 -9.380
66 HG11 VAL 9 1HG1 VAL 9 0.337 -5.779 -7.140
67 HG12 VAL 9 2HG1 VAL 9 2.010 -5.412 -6.723
68 HG13 VAL 9 3HG1 VAL 9 1.517 -7.080 -7.005
69 HG21 VAL 9 3HG2 VAL 9 0.721 -3.996 -8.926
70 HG22 VAL 9 1HG2 VAL 9 1.877 -4.307 -10.219
71 HG23 VAL 9 2HG2 VAL 9 2.449 -3.893 -8.603
72 H SER 10 H SER 10 2.972 -8.635 -10.418
73 HA SER 10 HA SER 10 4.289 -7.836 -12.820
74 HB2 SER 10 1HB SER 10 3.272 -9.889 -13.770
75 HB3 SER 10 2HB SER 10 3.967 -10.189 -12.179
76 HG SER 10 HG SER 10 1.972 -10.239 -11.306
77 H SER 11 H SER 11 0.856 -7.891 -11.898
78 HA SER 11 HA SER 11 0.132 -6.605 -14.495
79 HB2 SER 11 1HB SER 11 -1.538 -7.872 -12.310
80 HB3 SER 11 2HB SER 11 -2.211 -7.077 -13.730
81 HG SER 11 HG SER 11 -1.497 -8.674 -14.976
82 H SER 12 H SER 12 -1.393 -6.251 -11.306
83 HA SER 12 HA SER 12 -0.516 -3.480 -11.031
84 HB2 SER 12 1HB SER 12 -3.429 -4.050 -11.648
85 HB3 SER 12 2HB SER 12 -2.746 -2.481 -11.228
86 HG SER 12 HG SER 12 -1.324 -2.868 -13.107
87 H LEU 13 H LEU 13 -1.612 -2.465 -9.078
88 HA LEU 13 HA LEU 13 -2.337 -4.587 -7.083
89 HB2 LEU 13 1HB LEU 13 -0.171 -3.575 -6.576
90 HB3 LEU 13 2HB LEU 13 -0.870 -1.963 -6.678
91 HG LEU 13 HG LEU 13 -2.296 -2.407 -4.746
92 HD11 LEU 13 1HD1 LEU 13 -1.239 -5.209 -5.089
93 HD12 LEU 13 2HD1 LEU 13 -2.898 -4.669 -4.825
94 HD13 LEU 13 3HD1 LEU 13 -1.747 -4.654 -3.492
95 HD21 LEU 13 3HD2 LEU 13 0.628 -3.107 -4.428
96 HD22 LEU 13 1HD2 LEU 13 -0.444 -2.917 -3.043
97 HD23 LEU 13 2HD2 LEU 13 -0.158 -1.558 -4.129
98 H ASN 14 H ASN 14 -4.293 -4.380 -6.132
99 HA ASN 14 HA ASN 14 -5.941 -2.009 -6.778
100 HB2 ASN 14 1HB ASN 14 -6.564 -4.669 -5.477
101 HB3 ASN 14 2HB ASN 14 -7.753 -3.383 -5.681
102 HD21 ASN 14 2HD2 ASN 14 -6.191 -2.699 -8.340
103 HD22 ASN 14 1HD2 ASN 14 -6.824 -3.822 -9.439
104 H VAL 15 H VAL 15 -6.716 -0.575 -5.235
105 HA VAL 15 HA VAL 15 -5.278 -0.565 -2.654
106 HB VAL 15 HB VAL 15 -7.197 1.407 -3.932
107 HG11 VAL 15 1HG1 VAL 15 -6.223 2.949 -2.158
108 HG12 VAL 15 2HG1 VAL 15 -5.580 1.506 -1.375
109 HG13 VAL 15 3HG1 VAL 15 -7.323 1.709 -1.555
110 HG21 VAL 15 3HG2 VAL 15 -4.185 1.231 -3.706
111 HG22 VAL 15 1HG2 VAL 15 -5.017 2.734 -4.099
112 HG23 VAL 15 2HG2 VAL 15 -5.155 1.343 -5.174
113 H ARG 16 H ARG 16 -6.202 -1.282 -0.790
114 HA ARG 16 HA ARG 16 -9.134 -1.895 -0.807
115 HB2 ARG 16 1HB ARG 16 -6.818 -3.019 0.789
116 HB3 ARG 16 2HB ARG 16 -8.509 -3.402 1.122
117 HG2 ARG 16 1HG ARG 16 -8.800 -4.336 -1.095
118 HG3 ARG 16 2HG ARG 16 -7.190 -3.801 -1.576
119 HD2 ARG 16 1HD ARG 16 -7.182 -6.200 -1.021
120 HD3 ARG 16 2HD ARG 16 -6.184 -5.285 0.109
121 HE ARG 16 HE ARG 16 -8.983 -5.803 0.923
122 HH11 ARG 16 1HH2 ARG 16 -5.622 -6.604 1.113
123 HH12 ARG 16 2HH2 ARG 16 -5.786 -7.451 2.609
124 HH21 ARG 16 1HH1 ARG 16 -9.188 -6.910 2.869
125 HH22 ARG 16 2HH1 ARG 16 -7.791 -7.627 3.600
126 H GLU 17 H GLU 17 -10.447 -0.851 0.592
127 HA GLU 17 HA GLU 17 -9.464 1.402 2.113
128 HB2 GLU 17 1HB GLU 17 -11.795 1.639 2.834
129 HB3 GLU 17 2HB GLU 17 -11.735 1.297 1.105
130 HG2 GLU 17 1HG GLU 17 -12.118 -1.125 1.614
131 HG3 GLU 17 2HG GLU 17 -12.314 -0.704 3.315
132 H GLY 18 H GLY 18 -10.384 -1.912 2.917
133 HA2 GLY 18 1HA GLY 18 -9.530 -1.422 5.758
134 HA3 GLY 18 2HA GLY 18 -10.816 -2.539 5.310
135 H ALA 19 H ALA 19 -9.767 -4.321 6.243
136 HA ALA 19 HA ALA 19 -7.629 -5.483 4.551
137 HB1 ALA 19 3HB ALA 19 -6.395 -4.353 6.345
138 HB2 ALA 19 1HB ALA 19 -6.307 -6.100 6.571
139 HB3 ALA 19 2HB ALA 19 -7.405 -5.137 7.560
140 H SER 20 H SER 20 -9.670 -6.697 4.027
141 HA SER 20 HA SER 20 -9.927 -9.042 5.841
142 HB2 SER 20 1HB SER 20 -12.328 -7.627 4.633
143 HB3 SER 20 2HB SER 20 -12.347 -8.995 5.742
144 HG SER 20 HG SER 20 -11.926 -6.297 6.215
145 H THR 21 H THR 21 -8.442 -8.898 3.501
146 HA THR 21 HA THR 21 -8.168 -9.880 1.390
147 HB THR 21 HB THR 21 -9.200 -12.088 1.142
148 HG1 THR 21 HG1 THR 21 -10.715 -11.275 3.396
149 HG21 THR 21 3HG2 THR 21 -8.483 -13.055 3.351
150 HG22 THR 21 1HG2 THR 21 -8.283 -11.406 3.943
151 HG23 THR 21 2HG2 THR 21 -7.290 -11.990 2.607
152 H SER 22 H SER 22 -11.560 -10.818 1.620
153 HA SER 22 HA SER 22 -12.133 -9.731 -0.993
154 HB2 SER 22 1HB SER 22 -13.274 -11.718 0.038
155 HB3 SER 22 2HB SER 22 -14.073 -10.622 1.161
156 HG SER 22 HG SER 22 -14.420 -9.606 -1.224
157 H SER 23 H SER 23 -11.088 -7.672 0.586
158 HA SER 23 HA SER 23 -13.228 -6.059 1.718
159 HB2 SER 23 1HB SER 23 -11.544 -4.531 2.295
160 HB3 SER 23 2HB SER 23 -10.699 -6.075 2.327
161 HG SER 23 HG SER 23 -10.763 -4.176 0.216
162 H LYS 24 H LYS 24 -13.618 -3.811 0.917
163 HA LYS 24 HA LYS 24 -14.307 -3.880 -1.904
164 HB2 LYS 24 1HB LYS 24 -15.750 -2.812 -0.202
165 HB3 LYS 24 2HB LYS 24 -14.492 -1.613 0.096
166 HG2 LYS 24 1HG LYS 24 -14.642 -0.828 -2.215
167 HG3 LYS 24 2HG LYS 24 -15.831 -2.079 -2.586
168 HD2 LYS 24 1HD LYS 24 -17.369 -1.104 -0.913
169 HD3 LYS 24 2HD LYS 24 -16.185 0.157 -0.566
170 HE2 LYS 24 1HE LYS 24 -16.303 0.932 -2.895
171 HE3 LYS 24 2HE LYS 24 -17.457 -0.347 -3.273
172 HZ1 LYS 24 3HZ LYS 24 -18.464 1.862 -2.784
173 HZ2 LYS 24 1HZ LYS 24 -17.916 1.710 -1.186
174 HZ3 LYS 24 2HZ LYS 24 -19.040 0.597 -1.806
175 H VAL 25 H VAL 25 -13.330 -2.832 -3.579
176 HA VAL 25 HA VAL 25 -10.653 -1.665 -3.082
177 HB VAL 25 HB VAL 25 -12.110 -2.479 -5.612
178 HG11 VAL 25 1HG1 VAL 25 -9.421 -1.166 -5.176
179 HG12 VAL 25 2HG1 VAL 25 -10.717 -0.660 -6.261
180 HG13 VAL 25 3HG1 VAL 25 -9.778 -2.106 -6.624
181 HG21 VAL 25 3HG2 VAL 25 -10.276 -4.183 -5.680
182 HG22 VAL 25 1HG2 VAL 25 -11.328 -4.359 -4.275
183 HG23 VAL 25 2HG2 VAL 25 -9.739 -3.614 -4.100
184 H ILE 26 H ILE 26 -10.317 0.503 -3.166
185 HA ILE 26 HA ILE 26 -12.547 2.256 -4.136
186 HB ILE 26 HB ILE 26 -11.529 3.983 -2.675
187 HG12 ILE 26 1HG1 ILE 26 -9.700 1.734 -1.763
188 HG13 ILE 26 2HG1 ILE 26 -9.188 3.073 -2.791
189 HG21 ILE 26 1HG2 ILE 26 -12.011 1.365 -1.224
190 HG22 ILE 26 2HG2 ILE 26 -13.290 2.409 -1.843
191 HG23 ILE 26 3HG2 ILE 26 -12.221 2.988 -0.564
192 HD11 ILE 26 3HD1 ILE 26 -8.605 3.705 -0.563
193 HD12 ILE 26 1HD1 ILE 26 -10.179 3.210 0.061
194 HD13 ILE 26 2HD1 ILE 26 -10.047 4.634 -0.969
195 H GLY 27 H GLY 27 -9.490 1.113 -4.998
196 HA2 GLY 27 1HA GLY 27 -9.318 2.772 -7.296
197 HA3 GLY 27 2HA GLY 27 -8.268 3.455 -6.057
198 H SER 28 H SER 28 -6.720 2.823 -7.954
199 HA SER 28 HA SER 28 -5.502 0.210 -7.226
200 HB2 SER 28 1HB SER 28 -6.261 1.064 -10.029
201 HB3 SER 28 2HB SER 28 -5.114 -0.231 -9.688
202 HG SER 28 HG SER 28 -6.785 -1.259 -8.496
203 H LEU 29 H LEU 29 -3.239 0.097 -7.737
204 HA LEU 29 HA LEU 29 -1.974 2.733 -8.417
205 HB2 LEU 29 1HB LEU 29 -1.049 0.672 -6.392
206 HB3 LEU 29 2HB LEU 29 -0.173 2.140 -6.826
207 HG LEU 29 HG LEU 29 -2.965 2.061 -5.640
208 HD11 LEU 29 1HD1 LEU 29 -1.222 1.353 -4.043
209 HD12 LEU 29 2HD1 LEU 29 -1.879 2.931 -3.605
210 HD13 LEU 29 3HD1 LEU 29 -0.304 2.820 -4.391
211 HD21 LEU 29 3HD2 LEU 29 -2.920 4.088 -6.800
212 HD22 LEU 29 1HD2 LEU 29 -1.172 4.266 -6.644
213 HD23 LEU 29 2HD2 LEU 29 -2.220 4.592 -5.266
214 H SER 30 H SER 30 -0.080 2.628 -9.641
215 HA SER 30 HA SER 30 0.116 0.305 -11.385
216 HB2 SER 30 1HB SER 30 1.778 1.619 -12.578
217 HB3 SER 30 2HB SER 30 0.404 2.647 -12.181
218 HG SER 30 HG SER 30 2.735 3.320 -11.680
219 H GLY 31 H GLY 31 2.252 -0.700 -11.853
220 HA2 GLY 31 1HA GLY 31 3.398 -1.842 -9.497
221 HA3 GLY 31 2HA GLY 31 4.025 -2.037 -11.131
222 H ASN 32 H ASN 32 5.578 -1.677 -8.736
223 HA ASN 32 HA ASN 32 7.423 -0.483 -7.959
224 HB2 ASN 32 1HB ASN 32 7.346 0.832 -10.691
225 HB3 ASN 32 2HB ASN 32 8.735 0.714 -9.612
226 HD21 ASN 32 2HD2 ASN 32 8.332 -2.053 -8.795
227 HD22 ASN 32 1HD2 ASN 32 8.638 -3.032 -10.148
228 H THR 33 H THR 33 4.720 0.616 -7.529
229 HA THR 33 HA THR 33 5.133 3.547 -7.686
230 HB THR 33 HB THR 33 2.795 1.869 -6.731
231 HG1 THR 33 HG1 THR 33 1.873 2.718 -8.622
232 HG21 THR 33 3HG2 THR 33 3.211 4.866 -6.826
233 HG22 THR 33 1HG2 THR 33 2.748 3.887 -5.435
234 HG23 THR 33 2HG2 THR 33 1.612 4.126 -6.761
235 H LYS 34 H LYS 34 5.846 4.725 -6.000
236 HA LYS 34 HA LYS 34 6.616 3.396 -3.513
237 HB2 LYS 34 1HB LYS 34 8.003 5.158 -4.591
238 HB3 LYS 34 2HB LYS 34 6.714 6.324 -4.296
239 HG2 LYS 34 1HG LYS 34 6.917 6.005 -1.889
240 HG3 LYS 34 2HG LYS 34 8.126 4.742 -2.129
241 HD2 LYS 34 1HD LYS 34 9.613 6.391 -3.229
242 HD3 LYS 34 2HD LYS 34 8.411 7.651 -2.942
243 HE2 LYS 34 1HE LYS 34 9.812 6.020 -0.805
244 HE3 LYS 34 2HE LYS 34 10.143 7.706 -1.197
245 HZ1 LYS 34 3HZ LYS 34 7.942 8.310 -0.539
246 HZ2 LYS 34 1HZ LYS 34 8.642 7.416 0.721
247 HZ3 LYS 34 2HZ LYS 34 7.502 6.685 -0.305
248 H VAL 35 H VAL 35 5.470 3.443 -1.593
249 HA VAL 35 HA VAL 35 3.138 5.327 -1.403
250 HB VAL 35 HB VAL 35 2.009 3.444 -0.095
251 HG11 VAL 35 1HG1 VAL 35 2.587 3.246 -3.059
252 HG12 VAL 35 2HG1 VAL 35 1.206 4.018 -2.281
253 HG13 VAL 35 3HG1 VAL 35 1.364 2.262 -2.255
254 HG21 VAL 35 3HG2 VAL 35 4.035 1.755 -1.594
255 HG22 VAL 35 1HG2 VAL 35 2.778 1.185 -0.496
256 HG23 VAL 35 2HG2 VAL 35 4.146 2.104 0.132
257 H THR 36 H THR 36 3.024 6.452 0.442
258 HA THR 36 HA THR 36 5.176 6.172 2.401
259 HB THR 36 HB THR 36 2.814 8.055 2.167
260 HG1 THR 36 HG1 THR 36 4.195 9.241 1.139
261 HG21 THR 36 3HG2 THR 36 4.960 7.821 4.279
262 HG22 THR 36 1HG2 THR 36 3.216 7.957 4.501
263 HG23 THR 36 2HG2 THR 36 4.145 9.351 3.952
264 H ILE 37 H ILE 37 5.017 5.129 4.334
265 HA ILE 37 HA ILE 37 2.356 3.998 5.098
266 HB ILE 37 HB ILE 37 5.161 3.204 5.925
267 HG12 ILE 37 1HG1 ILE 37 3.166 1.756 4.164
268 HG13 ILE 37 2HG1 ILE 37 4.476 2.752 3.533
269 HG21 ILE 37 1HG2 ILE 37 3.964 1.195 6.849
270 HG22 ILE 37 2HG2 ILE 37 2.437 2.019 6.537
271 HG23 ILE 37 3HG2 ILE 37 3.583 2.692 7.698
272 HD11 ILE 37 3HD1 ILE 37 5.110 0.360 3.606
273 HD12 ILE 37 1HD1 ILE 37 4.829 0.347 5.346
274 HD13 ILE 37 2HD1 ILE 37 6.128 1.331 4.670
275 H VAL 38 H VAL 38 1.356 4.842 6.820
276 HA VAL 38 HA VAL 38 2.923 6.520 8.748
277 HB VAL 38 HB VAL 38 0.650 7.489 9.304
278 HG11 VAL 38 1HG1 VAL 38 1.538 7.706 6.409
279 HG12 VAL 38 2HG1 VAL 38 2.222 8.616 7.757
280 HG13 VAL 38 3HG1 VAL 38 0.546 8.881 7.274
281 HG21 VAL 38 3HG2 VAL 38 -0.191 6.058 6.764
282 HG22 VAL 38 1HG2 VAL 38 -1.203 7.068 7.798
283 HG23 VAL 38 2HG2 VAL 38 -0.622 5.509 8.384
284 H GLY 39 H GLY 39 1.638 3.492 8.367
285 HA2 GLY 39 1HA GLY 39 1.953 2.763 11.091
286 HA3 GLY 39 2HA GLY 39 0.236 3.032 10.800
287 H GLU 40 H GLU 40 0.557 0.554 11.456
288 HA GLU 40 HA GLU 40 0.421 -0.970 8.902
289 HB2 GLU 40 1HB GLU 40 1.789 -2.789 9.854
290 HB3 GLU 40 2HB GLU 40 2.717 -1.293 9.754
291 HG2 GLU 40 1HG GLU 40 2.222 -0.848 12.146
292 HG3 GLU 40 2HG GLU 40 1.349 -2.378 12.238
293 H GLU 41 H GLU 41 -0.693 -3.071 9.196
294 HA GLU 41 HA GLU 41 -2.143 -3.455 11.731
295 HB2 GLU 41 1HB GLU 41 -3.541 -1.812 10.486
296 HB3 GLU 41 2HB GLU 41 -3.644 -2.949 9.141
297 HG2 GLU 41 1HG GLU 41 -4.725 -4.607 10.600
298 HG3 GLU 41 2HG GLU 41 -4.591 -3.505 11.970
299 H GLY 42 H GLY 42 -1.768 -5.566 12.048
300 HA2 GLY 42 1HA GLY 42 -1.584 -7.863 11.666
301 HA3 GLY 42 2HA GLY 42 -2.875 -7.627 10.491
302 H ALA 43 H ALA 43 -2.213 -8.772 8.744
303 HA ALA 43 HA ALA 43 0.609 -8.702 7.881
304 HB1 ALA 43 3HB ALA 43 -0.409 -10.858 7.739
305 HB2 ALA 43 1HB ALA 43 -0.322 -10.273 6.079
306 HB3 ALA 43 2HB ALA 43 -1.849 -10.204 6.958
307 H PHE 44 H PHE 44 -1.238 -6.321 7.742
308 HA PHE 44 HA PHE 44 -0.900 -5.737 4.820
309 HB2 PHE 44 1HB PHE 44 -3.235 -4.836 6.538
310 HB3 PHE 44 2HB PHE 44 -3.014 -4.546 4.812
311 HD1 PHE 44 HD2 PHE 44 -3.232 -6.376 3.182
312 HD2 PHE 44 HD1 PHE 44 -3.899 -7.012 7.375
313 HE1 PHE 44 HE2 PHE 44 -4.308 -8.552 2.679
314 HE2 PHE 44 HE1 PHE 44 -4.987 -9.183 6.873
315 HZ PHE 44 HZ PHE 44 -5.189 -9.954 4.526
316 H TYR 45 H TYR 45 -0.416 -3.545 4.353
317 HA TYR 45 HA TYR 45 0.597 -1.991 6.703
318 HB2 TYR 45 1HB TYR 45 1.452 -2.175 3.815
319 HB3 TYR 45 2HB TYR 45 1.891 -0.772 4.791
320 HD1 TYR 45 HD1 TYR 45 2.780 -1.409 7.241
321 HD2 TYR 45 HD2 TYR 45 2.970 -3.963 3.791
322 HE1 TYR 45 HE1 TYR 45 4.629 -2.680 8.285
323 HE2 TYR 45 HE2 TYR 45 4.827 -5.229 4.839
324 HH TYR 45 HH TYR 45 6.684 -4.233 7.103
325 H LYS 46 H LYS 46 -0.093 0.072 7.035
326 HA LYS 46 HA LYS 46 -2.425 0.975 5.444
327 HB2 LYS 46 1HB LYS 46 -2.503 0.983 7.944
328 HB3 LYS 46 2HB LYS 46 -1.192 2.162 7.947
329 HG2 LYS 46 1HG LYS 46 -2.564 3.741 6.682
330 HG3 LYS 46 2HG LYS 46 -3.870 2.559 6.583
331 HD2 LYS 46 1HD LYS 46 -4.048 2.558 9.052
332 HD3 LYS 46 2HD LYS 46 -2.761 3.762 9.138
333 HE2 LYS 46 1HE LYS 46 -4.130 5.335 7.826
334 HE3 LYS 46 2HE LYS 46 -5.415 4.131 7.717
335 HZ1 LYS 46 3HZ LYS 46 -5.772 5.763 9.498
336 HZ2 LYS 46 1HZ LYS 46 -4.350 5.235 10.258
337 HZ3 LYS 46 2HZ LYS 46 -5.665 4.172 10.085
338 H ILE 47 H ILE 47 -2.271 2.651 4.006
339 HA ILE 47 HA ILE 47 0.225 4.314 4.029
340 HB ILE 47 HB ILE 47 0.125 4.299 1.544
341 HG12 ILE 47 1HG1 ILE 47 -1.893 2.063 1.901
342 HG13 ILE 47 2HG1 ILE 47 -2.338 3.706 1.439
343 HG21 ILE 47 1HG2 ILE 47 0.905 1.925 1.300
344 HG22 ILE 47 2HG2 ILE 47 0.335 1.618 2.941
345 HG23 ILE 47 3HG2 ILE 47 1.640 2.772 2.662
346 HD11 ILE 47 3HD1 ILE 47 -2.077 2.239 -0.544
347 HD12 ILE 47 1HD1 ILE 47 -0.402 1.936 -0.081
348 HD13 ILE 47 2HD1 ILE 47 -0.908 3.560 -0.548
349 H GLU 48 H GLU 48 -0.017 6.430 3.107
350 HA GLU 48 HA GLU 48 -2.632 7.596 3.727
351 HB2 GLU 48 1HB GLU 48 -0.505 8.720 4.347
352 HB3 GLU 48 2HB GLU 48 -0.120 8.896 2.634
353 HG2 GLU 48 1HG GLU 48 -2.135 10.246 2.292
354 HG3 GLU 48 2HG GLU 48 -2.587 10.030 3.983
355 H TYR 49 H TYR 49 -4.088 6.973 2.139
356 HA TYR 49 HA TYR 49 -3.393 7.209 -0.707
357 HB2 TYR 49 1HB TYR 49 -4.826 5.362 0.084
358 HB3 TYR 49 2HB TYR 49 -6.024 6.531 0.641
359 HD1 TYR 49 HD2 TYR 49 -4.195 5.355 -2.392
360 HD2 TYR 49 HD1 TYR 49 -7.624 7.435 -0.856
361 HE1 TYR 49 HE2 TYR 49 -5.167 5.435 -4.671
362 HE2 TYR 49 HE1 TYR 49 -8.597 7.515 -3.136
363 HH TYR 49 HH TYR 49 -7.990 7.337 -5.399
364 H LYS 50 H LYS 50 -4.772 8.528 -2.171
365 HA LYS 50 HA LYS 50 -5.002 11.238 -1.203
366 HB2 LYS 50 1HB LYS 50 -5.864 9.911 -3.781
367 HB3 LYS 50 2HB LYS 50 -6.003 11.646 -3.485
368 HG2 LYS 50 1HG LYS 50 -3.576 11.782 -3.080
369 HG3 LYS 50 2HG LYS 50 -3.429 10.045 -3.352
370 HD2 LYS 50 1HD LYS 50 -4.249 10.321 -5.656
371 HD3 LYS 50 2HD LYS 50 -4.430 12.056 -5.391
372 HE2 LYS 50 1HE LYS 50 -2.014 12.262 -4.978
373 HE3 LYS 50 2HE LYS 50 -1.818 10.524 -5.205
374 HZ1 LYS 50 3HZ LYS 50 -1.943 12.565 -7.155
375 HZ2 LYS 50 1HZ LYS 50 -3.204 11.460 -7.411
376 HZ3 LYS 50 2HZ LYS 50 -1.596 10.915 -7.359
377 H GLY 51 H GLY 51 -6.591 11.727 0.227
378 HA2 GLY 51 1HA GLY 51 -8.889 12.391 0.590
379 HA3 GLY 51 2HA GLY 51 -9.409 11.149 -0.550
380 H SER 52 H SER 52 -7.271 9.395 1.006
381 HA SER 52 HA SER 52 -8.442 9.052 3.625
382 HB2 SER 52 1HB SER 52 -9.642 6.988 3.284
383 HB3 SER 52 2HB SER 52 -10.268 8.162 2.129
384 HG SER 52 HG SER 52 -8.107 6.833 1.167
385 H HIS 53 H HIS 53 -7.959 6.291 3.945
386 HA HIS 53 HA HIS 53 -5.005 6.122 3.434
387 HB2 HIS 53 1HB HIS 53 -6.658 5.094 5.755
388 HB3 HIS 53 2HB HIS 53 -4.948 4.734 5.509
389 HD1 HIS 53 HD1 HIS 53 -7.284 7.490 6.496
390 HD2 HIS 53 HD2 HIS 53 -3.191 6.962 5.905
391 HE1 HIS 53 HE1 HIS 53 -6.149 9.536 7.465
392 H GLY 54 H GLY 54 -4.477 4.529 2.053
393 HA2 GLY 54 1HA GLY 54 -6.435 2.406 1.433
394 HA3 GLY 54 2HA GLY 54 -4.944 2.734 0.552
395 H TYR 55 H TYR 55 -5.655 0.135 1.280
396 HA TYR 55 HA TYR 55 -3.500 -0.531 3.250
397 HB2 TYR 55 1HB TYR 55 -6.286 -1.705 3.068
398 HB3 TYR 55 2HB TYR 55 -4.968 -2.458 3.969
399 HD1 TYR 55 HD1 TYR 55 -7.139 0.538 3.735
400 HD2 TYR 55 HD2 TYR 55 -4.183 -1.552 6.045
401 HE1 TYR 55 HE1 TYR 55 -7.567 2.052 5.653
402 HE2 TYR 55 HE2 TYR 55 -4.612 -0.043 7.963
403 HH TYR 55 HH TYR 55 -5.749 1.705 8.705
404 H VAL 56 H VAL 56 -2.157 -2.167 2.584
405 HA VAL 56 HA VAL 56 -2.997 -3.833 0.249
406 HB VAL 56 HB VAL 56 -0.734 -3.499 -0.755
407 HG11 VAL 56 1HG1 VAL 56 -2.658 -2.218 -1.577
408 HG12 VAL 56 2HG1 VAL 56 -1.206 -1.219 -1.616
409 HG13 VAL 56 3HG1 VAL 56 -2.394 -0.996 -0.333
410 HG21 VAL 56 3HG2 VAL 56 0.548 -1.490 0.036
411 HG22 VAL 56 1HG2 VAL 56 0.496 -2.796 1.221
412 HG23 VAL 56 2HG2 VAL 56 -0.548 -1.389 1.415
413 H ALA 57 H ALA 57 -1.771 -5.808 0.060
414 HA ALA 57 HA ALA 57 -1.078 -6.949 2.635
415 HB1 ALA 57 3HB ALA 57 -0.624 -8.152 -0.100
416 HB2 ALA 57 1HB ALA 57 -2.183 -8.181 0.722
417 HB3 ALA 57 2HB ALA 57 -0.797 -9.008 1.431
418 H LYS 58 H LYS 58 0.944 -7.594 3.369
419 HA LYS 58 HA LYS 58 3.200 -6.006 2.548
420 HB2 LYS 58 1HB LYS 58 4.451 -7.415 4.165
421 HB3 LYS 58 2HB LYS 58 2.949 -6.789 4.851
422 HG2 LYS 58 1HG LYS 58 1.879 -9.001 4.085
423 HG3 LYS 58 2HG LYS 58 3.526 -9.584 3.851
424 HD2 LYS 58 1HD LYS 58 2.385 -8.485 6.433
425 HD3 LYS 58 2HD LYS 58 2.699 -10.186 6.093
426 HE2 LYS 58 1HE LYS 58 4.689 -7.945 6.428
427 HE3 LYS 58 2HE LYS 58 4.585 -9.457 7.327
428 HZ1 LYS 58 3HZ LYS 58 6.356 -9.603 5.742
429 HZ2 LYS 58 1HZ LYS 58 5.331 -9.142 4.471
430 HZ3 LYS 58 2HZ LYS 58 5.103 -10.637 5.246
431 H GLU 59 H GLU 59 1.889 -8.914 1.334
432 HA GLU 59 HA GLU 59 4.294 -10.229 0.469
433 HB2 GLU 59 1HB GLU 59 2.009 -11.271 0.591
434 HB3 GLU 59 2HB GLU 59 1.560 -10.328 -0.829
435 HG2 GLU 59 1HG GLU 59 2.233 -12.506 -1.602
436 HG3 GLU 59 2HG GLU 59 3.519 -11.384 -2.038
437 H TYR 60 H TYR 60 2.250 -7.738 -1.011
438 HA TYR 60 HA TYR 60 3.902 -7.782 -3.471
439 HB2 TYR 60 1HB TYR 60 1.508 -6.096 -2.678
440 HB3 TYR 60 2HB TYR 60 2.293 -6.063 -4.258
441 HD1 TYR 60 HD1 TYR 60 2.604 -8.413 -5.416
442 HD2 TYR 60 HD2 TYR 60 -0.282 -7.584 -2.346
443 HE1 TYR 60 HE1 TYR 60 1.273 -10.376 -6.136
444 HE2 TYR 60 HE2 TYR 60 -1.613 -9.551 -3.064
445 HH TYR 60 HH TYR 60 -0.426 -11.958 -5.008
446 H ILE 61 H ILE 61 4.255 -6.500 -0.461
447 HA ILE 61 HA ILE 61 5.582 -4.000 -1.472
448 HB ILE 61 HB ILE 61 4.607 -4.629 1.324
449 HG12 ILE 61 1HG1 ILE 61 2.700 -4.389 -0.165
450 HG13 ILE 61 2HG1 ILE 61 2.847 -2.925 0.802
451 HG21 ILE 61 1HG2 ILE 61 6.445 -3.073 1.369
452 HG22 ILE 61 2HG2 ILE 61 4.961 -2.151 1.607
453 HG23 ILE 61 3HG2 ILE 61 5.759 -2.145 0.035
454 HD11 ILE 61 3HD1 ILE 61 3.433 -3.335 -2.116
455 HD12 ILE 61 1HD1 ILE 61 4.281 -2.061 -1.241
456 HD13 ILE 61 2HD1 ILE 61 2.523 -2.044 -1.337
457 H LYS 62 H LYS 62 7.740 -4.000 -1.407
458 HA LYS 62 HA LYS 62 9.143 -5.586 0.685
459 HB2 LYS 62 1HB LYS 62 10.595 -6.659 -0.906
460 HB3 LYS 62 2HB LYS 62 8.943 -6.965 -1.433
461 HG2 LYS 62 1HG LYS 62 9.137 -5.035 -3.015
462 HG3 LYS 62 2HG LYS 62 10.831 -4.865 -2.553
463 HD2 LYS 62 1HD LYS 62 11.249 -7.201 -3.274
464 HD3 LYS 62 2HD LYS 62 9.571 -7.314 -3.808
465 HE2 LYS 62 1HE LYS 62 9.946 -5.420 -5.354
466 HE3 LYS 62 2HE LYS 62 11.626 -5.339 -4.838
467 HZ1 LYS 62 3HZ LYS 62 10.598 -6.895 -6.852
468 HZ2 LYS 62 1HZ LYS 62 10.907 -7.982 -5.587
469 HZ3 LYS 62 2HZ LYS 62 12.156 -6.995 -6.183
470 H ASP 63 H ASP 63 11.543 -5.051 0.630
471 HA ASP 63 HA ASP 63 13.242 -3.465 0.792
472 HB2 ASP 63 1HB ASP 63 12.855 -3.440 -1.727
473 HB3 ASP 63 2HB ASP 63 11.863 -2.015 -1.474
474 H ILE 64 H ILE 64 11.385 -3.147 2.683
475 HA ILE 64 HA ILE 64 10.186 -0.501 2.704
476 HB ILE 64 HB ILE 64 10.705 -2.488 4.938
477 HG12 ILE 64 1HG1 ILE 64 8.130 -1.796 3.495
478 HG13 ILE 64 2HG1 ILE 64 9.156 -3.157 3.041
479 HG21 ILE 64 1HG2 ILE 64 10.458 -0.301 5.918
480 HG22 ILE 64 2HG2 ILE 64 8.908 -1.121 6.097
481 HG23 ILE 64 3HG2 ILE 64 9.122 0.093 4.836
482 HD11 ILE 64 3HD1 ILE 64 8.825 -4.235 5.147
483 HD12 ILE 64 1HD1 ILE 64 7.228 -3.698 4.625
484 HD13 ILE 64 2HD1 ILE 64 8.106 -2.787 5.854
485 H LYS 65 H LYS 65 11.140 1.387 3.338
486 HA LYS 65 HA LYS 65 13.887 1.225 4.554
487 HB2 LYS 65 1HB LYS 65 12.621 3.316 2.764
488 HB3 LYS 65 2HB LYS 65 14.200 3.491 3.535
489 HG2 LYS 65 1HG LYS 65 14.993 1.456 2.398
490 HG3 LYS 65 2HG LYS 65 13.412 1.259 1.639
491 HD2 LYS 65 1HD LYS 65 13.687 3.473 0.544
492 HD3 LYS 65 2HD LYS 65 15.299 3.598 1.250
493 HE2 LYS 65 1HE LYS 65 14.410 1.334 -0.557
494 HE3 LYS 65 2HE LYS 65 15.311 2.744 -1.110
495 HZ1 LYS 65 3HZ LYS 65 16.758 1.929 1.006
496 HZ2 LYS 65 1HZ LYS 65 17.093 1.520 -0.605
497 HZ3 LYS 65 2HZ LYS 65 16.216 0.447 0.377
498 H ASP 66 H ASP 66 14.213 2.210 6.472
499 HA ASP 66 HA ASP 66 11.932 3.702 7.691
500 HB2 ASP 66 1HB ASP 66 13.049 3.193 9.847
501 HB3 ASP 66 2HB ASP 66 12.663 1.729 8.944
502 H GLU 67 H GLU 67 12.137 5.845 7.930
503 HA GLU 67 HA GLU 67 14.802 7.101 7.489
504 HB2 GLU 67 1HB GLU 67 11.985 8.239 7.546
505 HB3 GLU 67 2HB GLU 67 13.439 9.187 7.248
506 HG2 GLU 67 1HG GLU 67 12.707 8.704 5.071
507 HG3 GLU 67 2HG GLU 67 13.901 7.439 5.349
508 H VAL 68 H VAL 68 12.549 6.329 9.968
509 HA VAL 68 HA VAL 68 13.561 8.445 11.783
510 HB VAL 68 HB VAL 68 11.892 7.445 13.386
511 HG11 VAL 68 1HG1 VAL 68 11.286 9.368 12.037
512 HG12 VAL 68 2HG1 VAL 68 9.915 8.260 12.067
513 HG13 VAL 68 3HG1 VAL 68 10.956 8.338 10.644
514 HG21 VAL 68 3HG2 VAL 68 10.279 5.834 12.519
515 HG22 VAL 68 1HG2 VAL 68 11.900 5.165 12.341
516 HG23 VAL 68 2HG2 VAL 68 11.067 5.844 10.942
517 H LEU 69 H LEU 69 14.884 8.039 13.523
518 HA LEU 69 HA LEU 69 16.326 5.473 13.536
519 HB2 LEU 69 1HB LEU 69 16.638 8.130 14.939
520 HB3 LEU 69 2HB LEU 69 17.562 6.723 15.469
521 HG LEU 69 HG LEU 69 18.438 6.455 13.157
522 HD11 LEU 69 1HD1 LEU 69 16.744 7.392 11.787
523 HD12 LEU 69 2HD1 LEU 69 18.087 8.527 11.655
524 HD13 LEU 69 3HD1 LEU 69 16.718 8.899 12.704
525 HD21 LEU 69 3HD2 LEU 69 19.895 8.468 13.177
526 HD22 LEU 69 1HD2 LEU 69 19.726 7.773 14.789
527 HD23 LEU 69 2HD2 LEU 69 18.819 9.221 14.353
528 H GLU 70 H GLU 70 13.493 6.549 14.843
529 HA GLU 70 HA GLU 70 12.166 5.869 16.646
530 HB2 GLU 70 1HB GLU 70 12.476 3.683 15.537
531 HB3 GLU 70 2HB GLU 70 13.953 3.424 16.462
532 HG2 GLU 70 1HG GLU 70 12.699 3.473 18.560
533 HG3 GLU 70 2HG GLU 70 11.212 3.856 17.690
534 H HIS 71 H HIS 71 14.866 3.993 17.887
535 HA HIS 71 HA HIS 71 15.448 6.081 19.924
536 HB2 HIS 71 1HB HIS 71 14.512 3.258 20.508
537 HB3 HIS 71 2HB HIS 71 15.265 4.309 21.709
538 HD1 HIS 71 HD1 HIS 71 12.030 3.451 20.350
539 HD2 HIS 71 HD2 HIS 71 13.738 6.916 21.917
540 HE1 HIS 71 HE1 HIS 71 10.108 4.986 20.958
541 H HIS 72 H HIS 72 17.479 5.763 20.967
542 HA HIS 72 HA HIS 72 19.449 4.452 19.274
543 HB2 HIS 72 1HB HIS 72 19.916 6.594 20.392
544 HB3 HIS 72 2HB HIS 72 19.748 5.813 21.965
545 HD1 HIS 72 HD1 HIS 72 21.801 5.315 18.783
546 HD2 HIS 72 HD2 HIS 72 22.151 4.846 22.910
547 HE1 HIS 72 HE1 HIS 72 24.172 4.542 19.217
548 H HIS 73 H HIS 73 21.068 2.918 20.164
549 HA HIS 73 HA HIS 73 19.783 0.671 21.432
550 HB2 HIS 73 1HB HIS 73 22.666 1.271 20.735
551 HB3 HIS 73 2HB HIS 73 22.148 -0.260 21.442
552 HD1 HIS 73 HD1 HIS 73 21.889 1.795 18.299
553 HD2 HIS 73 HD2 HIS 73 20.659 -1.938 19.692
554 HE1 HIS 73 HE1 HIS 73 21.036 0.521 16.281
555 H HIS 74 H HIS 74 19.708 0.118 23.551
556 HA HIS 74 HA HIS 74 20.802 1.980 25.548
557 HB2 HIS 74 1HB HIS 74 19.552 0.595 27.157
558 HB3 HIS 74 2HB HIS 74 18.522 1.068 25.806
559 HD1 HIS 74 HD1 HIS 74 17.997 -0.793 23.998
560 HD2 HIS 74 HD2 HIS 74 20.003 -2.178 27.380
561 HE1 HIS 74 HE1 HIS 74 17.794 -3.319 23.969
562 H HIS 75 H HIS 75 21.783 -0.898 24.001
563 HA HIS 75 HA HIS 75 23.272 -2.131 26.127
564 HB2 HIS 75 1HB HIS 75 23.575 -2.194 23.114
565 HB3 HIS 75 2HB HIS 75 24.582 -3.153 24.198
566 HD1 HIS 75 HD1 HIS 75 21.040 -2.811 22.969
567 HD2 HIS 75 HD2 HIS 75 23.266 -5.355 25.410
568 HE1 HIS 75 HE1 HIS 75 19.578 -4.827 23.425
569 H HIS 76 H HIS 76 24.089 0.335 23.706
570 HA HIS 76 HA HIS 76 26.860 0.526 24.643
571 HB2 HIS 76 1HB HIS 76 25.257 2.269 22.748
572 HB3 HIS 76 2HB HIS 76 26.992 2.413 23.033
573 HD1 HIS 76 HD1 HIS 76 28.008 -0.377 22.934
574 HD2 HIS 76 HD2 HIS 76 25.003 0.922 20.353
575 HE1 HIS 76 HE1 HIS 76 28.039 -1.950 20.949
Start of MODEL 5
1 H1 ALA 1 1H ALA 1 9.944 7.712 12.081
2 H2 ALA 1 2H ALA 1 9.597 8.940 10.960
3 H3 ALA 1 3H ALA 1 10.084 7.405 10.419
4 HA ALA 1 HA ALA 1 8.003 6.560 11.653
5 HB1 ALA 1 3HB ALA 1 6.199 8.308 11.587
6 HB2 ALA 1 1HB ALA 1 7.440 9.512 11.242
7 HB3 ALA 1 2HB ALA 1 7.452 8.649 12.779
8 H GLU 2 H GLU 2 8.382 9.066 9.137
9 HA GLU 2 HA GLU 2 6.511 7.897 7.314
10 HB2 GLU 2 1HB GLU 2 7.322 10.242 7.169
11 HB3 GLU 2 2HB GLU 2 8.908 9.642 6.688
12 HG2 GLU 2 1HG GLU 2 7.937 8.587 4.699
13 HG3 GLU 2 2HG GLU 2 6.325 9.105 5.190
14 H LYS 3 H LYS 3 6.744 6.262 5.846
15 HA LYS 3 HA LYS 3 9.486 5.245 5.238
16 HB2 LYS 3 1HB LYS 3 7.115 3.614 6.177
17 HB3 LYS 3 2HB LYS 3 8.555 2.910 5.440
18 HG2 LYS 3 1HG LYS 3 9.947 3.933 7.215
19 HG3 LYS 3 2HG LYS 3 8.495 4.598 7.959
20 HD2 LYS 3 1HD LYS 3 7.613 2.350 8.325
21 HD3 LYS 3 2HD LYS 3 9.001 1.647 7.494
22 HE2 LYS 3 1HE LYS 3 9.357 1.518 9.905
23 HE3 LYS 3 2HE LYS 3 10.500 2.665 9.207
24 HZ1 LYS 3 3HZ LYS 3 8.909 4.449 9.800
25 HZ2 LYS 3 1HZ LYS 3 9.546 3.637 11.145
26 HZ3 LYS 3 2HZ LYS 3 7.967 3.297 10.620
27 H THR 4 H THR 4 9.647 4.242 3.185
28 HA THR 4 HA THR 4 7.249 4.562 1.403
29 HB THR 4 HB THR 4 9.020 4.967 -0.412
30 HG1 THR 4 HG1 THR 4 11.021 5.466 0.257
31 HG21 THR 4 3HG2 THR 4 7.588 6.748 0.462
32 HG22 THR 4 1HG2 THR 4 9.223 7.363 0.216
33 HG23 THR 4 2HG2 THR 4 8.666 6.963 1.841
34 H GLY 5 H GLY 5 6.558 2.591 0.857
35 HA2 GLY 5 1HA GLY 5 8.483 0.332 0.709
36 HA3 GLY 5 2HA GLY 5 6.732 0.184 0.776
37 H ILE 6 H ILE 6 8.880 -0.793 -1.198
38 HA ILE 6 HA ILE 6 7.964 0.546 -3.688
39 HB ILE 6 HB ILE 6 9.951 -1.723 -3.394
40 HG12 ILE 6 1HG1 ILE 6 10.741 0.094 -2.000
41 HG13 ILE 6 2HG1 ILE 6 11.670 0.128 -3.496
42 HG21 ILE 6 1HG2 ILE 6 10.723 -0.979 -5.567
43 HG22 ILE 6 2HG2 ILE 6 9.664 0.429 -5.514
44 HG23 ILE 6 3HG2 ILE 6 8.974 -1.186 -5.662
45 HD11 ILE 6 3HD1 ILE 6 9.855 1.817 -4.315
46 HD12 ILE 6 1HD1 ILE 6 11.080 2.387 -3.181
47 HD13 ILE 6 2HD1 ILE 6 9.464 1.979 -2.603
48 H VAL 7 H VAL 7 6.208 -0.258 -4.692
49 HA VAL 7 HA VAL 7 5.131 -2.871 -3.972
50 HB VAL 7 HB VAL 7 4.247 -1.040 -6.214
51 HG11 VAL 7 1HG1 VAL 7 2.578 -2.909 -4.525
52 HG12 VAL 7 2HG1 VAL 7 3.371 -3.458 -5.996
53 HG13 VAL 7 3HG1 VAL 7 2.164 -2.176 -6.074
54 HG21 VAL 7 3HG2 VAL 7 2.766 0.026 -4.611
55 HG22 VAL 7 1HG2 VAL 7 4.409 0.133 -3.984
56 HG23 VAL 7 2HG2 VAL 7 3.294 -1.067 -3.334
57 H ASN 8 H ASN 8 5.647 -4.754 -4.951
58 HA ASN 8 HA ASN 8 7.074 -4.659 -7.583
59 HB2 ASN 8 1HB ASN 8 8.243 -5.734 -5.670
60 HB3 ASN 8 2HB ASN 8 6.924 -6.898 -5.547
61 HD21 ASN 8 2HD2 ASN 8 8.450 -8.659 -6.108
62 HD22 ASN 8 1HD2 ASN 8 8.966 -8.864 -7.713
63 H VAL 9 H VAL 9 5.300 -4.604 -8.987
64 HA VAL 9 HA VAL 9 3.792 -7.149 -9.187
65 HB VAL 9 HB VAL 9 2.200 -5.840 -7.978
66 HG11 VAL 9 1HG1 VAL 9 3.362 -3.658 -8.307
67 HG12 VAL 9 2HG1 VAL 9 1.621 -3.547 -8.542
68 HG13 VAL 9 3HG1 VAL 9 2.699 -3.586 -9.938
69 HG21 VAL 9 3HG2 VAL 9 0.379 -5.751 -9.485
70 HG22 VAL 9 1HG2 VAL 9 1.462 -6.951 -10.186
71 HG23 VAL 9 2HG2 VAL 9 1.414 -5.313 -10.841
72 H SER 10 H SER 10 3.562 -7.771 -11.275
73 HA SER 10 HA SER 10 4.812 -6.121 -13.361
74 HB2 SER 10 1HB SER 10 4.424 -8.121 -14.777
75 HB3 SER 10 2HB SER 10 5.251 -8.539 -13.278
76 HG SER 10 HG SER 10 2.480 -8.787 -13.865
77 H SER 11 H SER 11 1.672 -6.619 -12.111
78 HA SER 11 HA SER 11 0.420 -5.523 -14.619
79 HB2 SER 11 1HB SER 11 -0.798 -7.231 -12.436
80 HB3 SER 11 2HB SER 11 -1.688 -6.542 -13.789
81 HG SER 11 HG SER 11 -1.016 -8.165 -14.922
82 H SER 12 H SER 12 -1.134 -5.728 -11.479
83 HA SER 12 HA SER 12 -0.628 -2.909 -10.863
84 HB2 SER 12 1HB SER 12 -3.084 -2.344 -10.927
85 HB3 SER 12 2HB SER 12 -2.360 -2.591 -12.513
86 HG SER 12 HG SER 12 -3.096 -4.938 -11.889
87 H LEU 13 H LEU 13 -1.756 -2.277 -8.820
88 HA LEU 13 HA LEU 13 -2.372 -4.670 -7.117
89 HB2 LEU 13 1HB LEU 13 -0.231 -3.722 -6.461
90 HB3 LEU 13 2HB LEU 13 -0.933 -2.107 -6.379
91 HG LEU 13 HG LEU 13 -2.385 -2.793 -4.528
92 HD11 LEU 13 1HD1 LEU 13 -2.937 -5.043 -4.889
93 HD12 LEU 13 2HD1 LEU 13 -1.811 -5.160 -3.539
94 HD13 LEU 13 3HD1 LEU 13 -1.262 -5.514 -5.178
95 HD21 LEU 13 3HD2 LEU 13 -0.675 -3.157 -2.828
96 HD22 LEU 13 1HD2 LEU 13 -0.060 -2.036 -4.043
97 HD23 LEU 13 2HD2 LEU 13 0.458 -3.720 -4.052
98 H ASN 14 H ASN 14 -4.301 -4.626 -6.109
99 HA ASN 14 HA ASN 14 -6.057 -2.294 -6.495
100 HB2 ASN 14 1HB ASN 14 -6.474 -5.064 -5.359
101 HB3 ASN 14 2HB ASN 14 -7.738 -3.832 -5.360
102 HD21 ASN 14 2HD2 ASN 14 -8.044 -6.242 -6.871
103 HD22 ASN 14 1HD2 ASN 14 -8.007 -5.849 -8.521
104 H VAL 15 H VAL 15 -6.949 -1.074 -4.795
105 HA VAL 15 HA VAL 15 -5.472 -1.260 -2.198
106 HB VAL 15 HB VAL 15 -6.992 0.997 -3.524
107 HG11 VAL 15 1HG1 VAL 15 -5.730 0.762 -0.787
108 HG12 VAL 15 2HG1 VAL 15 -7.384 1.230 -1.174
109 HG13 VAL 15 3HG1 VAL 15 -6.049 2.318 -1.552
110 HG21 VAL 15 3HG2 VAL 15 -4.811 2.040 -3.687
111 HG22 VAL 15 1HG2 VAL 15 -4.692 0.419 -4.370
112 HG23 VAL 15 2HG2 VAL 15 -4.072 0.741 -2.751
113 H ARG 16 H ARG 16 -6.579 -1.899 -0.429
114 HA ARG 16 HA ARG 16 -9.560 -2.123 -0.615
115 HB2 ARG 16 1HB ARG 16 -7.531 -3.571 1.115
116 HB3 ARG 16 2HB ARG 16 -9.273 -3.789 1.228
117 HG2 ARG 16 1HG ARG 16 -8.838 -5.514 -0.252
118 HG3 ARG 16 2HG ARG 16 -8.992 -4.220 -1.434
119 HD2 ARG 16 1HD ARG 16 -6.961 -5.492 -1.886
120 HD3 ARG 16 2HD ARG 16 -6.513 -3.883 -1.320
121 HE ARG 16 HE ARG 16 -6.677 -5.722 0.889
122 HH11 ARG 16 1HH2 ARG 16 -4.772 -4.763 -1.821
123 HH12 ARG 16 2HH2 ARG 16 -3.283 -5.311 -1.132
124 HH21 ARG 16 1HH1 ARG 16 -4.748 -6.434 1.799
125 HH22 ARG 16 2HH1 ARG 16 -3.268 -6.261 0.916
126 H GLU 17 H GLU 17 -10.811 -1.107 0.878
127 HA GLU 17 HA GLU 17 -9.469 0.832 2.679
128 HB2 GLU 17 1HB GLU 17 -11.334 1.562 1.195
129 HB3 GLU 17 2HB GLU 17 -12.402 0.439 2.037
130 HG2 GLU 17 1HG GLU 17 -12.024 1.611 4.151
131 HG3 GLU 17 2HG GLU 17 -10.890 2.707 3.361
132 H GLY 18 H GLY 18 -11.170 -2.192 2.780
133 HA2 GLY 18 1HA GLY 18 -11.549 -1.979 5.740
134 HA3 GLY 18 2HA GLY 18 -12.298 -3.190 4.699
135 H ALA 19 H ALA 19 -9.119 -2.729 3.758
136 HA ALA 19 HA ALA 19 -7.227 -4.108 3.917
137 HB1 ALA 19 3HB ALA 19 -8.125 -4.591 6.770
138 HB2 ALA 19 1HB ALA 19 -7.311 -3.112 6.259
139 HB3 ALA 19 2HB ALA 19 -6.483 -4.663 6.135
140 H SER 20 H SER 20 -10.271 -5.235 3.928
141 HA SER 20 HA SER 20 -9.785 -8.030 4.625
142 HB2 SER 20 1HB SER 20 -12.116 -6.906 3.071
143 HB3 SER 20 2HB SER 20 -12.066 -8.394 4.009
144 HG SER 20 HG SER 20 -12.931 -7.012 5.415
145 H THR 21 H THR 21 -9.941 -9.782 3.085
146 HA THR 21 HA THR 21 -8.318 -9.460 0.778
147 HB THR 21 HB THR 21 -8.886 -11.761 0.275
148 HG1 THR 21 HG1 THR 21 -10.707 -12.140 2.237
149 HG21 THR 21 3HG2 THR 21 -8.989 -11.486 3.283
150 HG22 THR 21 1HG2 THR 21 -7.522 -11.178 2.354
151 HG23 THR 21 2HG2 THR 21 -8.255 -12.782 2.339
152 H SER 22 H SER 22 -9.014 -8.023 -0.725
153 HA SER 22 HA SER 22 -10.157 -7.401 -2.683
154 HB2 SER 22 1HB SER 22 -12.361 -9.390 -2.221
155 HB3 SER 22 2HB SER 22 -11.600 -8.891 -3.727
156 HG SER 22 HG SER 22 -10.800 -10.781 -1.839
157 H SER 23 H SER 23 -10.660 -6.463 0.085
158 HA SER 23 HA SER 23 -13.390 -5.960 0.592
159 HB2 SER 23 1HB SER 23 -11.020 -5.285 1.812
160 HB3 SER 23 2HB SER 23 -11.596 -3.714 1.270
161 HG SER 23 HG SER 23 -13.678 -5.019 2.216
162 H LYS 24 H LYS 24 -13.563 -3.137 0.727
163 HA LYS 24 HA LYS 24 -14.659 -2.546 -1.844
164 HB2 LYS 24 1HB LYS 24 -15.339 -1.488 0.322
165 HB3 LYS 24 2HB LYS 24 -13.831 -0.575 0.303
166 HG2 LYS 24 1HG LYS 24 -14.479 0.360 -1.927
167 HG3 LYS 24 2HG LYS 24 -16.027 -0.469 -1.787
168 HD2 LYS 24 1HD LYS 24 -15.007 1.504 0.274
169 HD3 LYS 24 2HD LYS 24 -16.048 1.966 -1.070
170 HE2 LYS 24 1HE LYS 24 -17.654 0.127 -0.234
171 HE3 LYS 24 2HE LYS 24 -16.690 0.132 1.242
172 HZ1 LYS 24 3HZ LYS 24 -18.756 1.722 0.897
173 HZ2 LYS 24 1HZ LYS 24 -17.556 2.719 0.229
174 HZ3 LYS 24 2HZ LYS 24 -17.408 2.169 1.830
175 H VAL 25 H VAL 25 -13.688 -1.804 -3.646
176 HA VAL 25 HA VAL 25 -10.811 -1.115 -3.545
177 HB VAL 25 HB VAL 25 -12.705 -1.491 -5.884
178 HG11 VAL 25 1HG1 VAL 25 -10.531 -1.657 -7.161
179 HG12 VAL 25 2HG1 VAL 25 -9.710 -1.070 -5.715
180 HG13 VAL 25 3HG1 VAL 25 -10.884 -0.045 -6.539
181 HG21 VAL 25 3HG2 VAL 25 -12.244 -3.530 -4.503
182 HG22 VAL 25 1HG2 VAL 25 -10.521 -3.292 -4.790
183 HG23 VAL 25 2HG2 VAL 25 -11.598 -3.652 -6.140
184 H ILE 26 H ILE 26 -10.324 0.970 -3.212
185 HA ILE 26 HA ILE 26 -12.194 3.101 -4.151
186 HB ILE 26 HB ILE 26 -10.919 4.557 -2.583
187 HG12 ILE 26 1HG1 ILE 26 -9.523 1.981 -1.778
188 HG13 ILE 26 2HG1 ILE 26 -8.770 3.247 -2.745
189 HG21 ILE 26 1HG2 ILE 26 -11.821 3.592 -0.548
190 HG22 ILE 26 2HG2 ILE 26 -11.855 1.986 -1.276
191 HG23 ILE 26 3HG2 ILE 26 -12.938 3.244 -1.867
192 HD11 ILE 26 3HD1 ILE 26 -9.923 3.659 0.029
193 HD12 ILE 26 1HD1 ILE 26 -9.068 4.861 -0.936
194 HD13 ILE 26 2HD1 ILE 26 -8.209 3.446 -0.326
195 H GLY 27 H GLY 27 -9.439 1.483 -5.127
196 HA2 GLY 27 1HA GLY 27 -8.910 3.044 -7.367
197 HA3 GLY 27 2HA GLY 27 -7.900 3.736 -6.101
198 H SER 28 H SER 28 -6.115 3.016 -7.553
199 HA SER 28 HA SER 28 -5.159 0.357 -6.720
200 HB2 SER 28 1HB SER 28 -4.738 -0.429 -8.994
201 HB3 SER 28 2HB SER 28 -6.455 -0.084 -8.812
202 HG SER 28 HG SER 28 -5.827 0.905 -10.675
203 H LEU 29 H LEU 29 -2.841 0.070 -7.378
204 HA LEU 29 HA LEU 29 -1.455 2.702 -7.799
205 HB2 LEU 29 1HB LEU 29 -0.593 0.397 -6.032
206 HB3 LEU 29 2HB LEU 29 0.293 1.903 -6.267
207 HG LEU 29 HG LEU 29 -2.510 1.692 -5.124
208 HD11 LEU 29 1HD1 LEU 29 -1.259 2.514 -3.030
209 HD12 LEU 29 2HD1 LEU 29 0.213 2.003 -3.856
210 HD13 LEU 29 3HD1 LEU 29 -1.040 0.822 -3.477
211 HD21 LEU 29 3HD2 LEU 29 -1.798 4.141 -4.429
212 HD22 LEU 29 1HD2 LEU 29 -2.409 3.846 -6.053
213 HD23 LEU 29 2HD2 LEU 29 -0.672 3.995 -5.778
214 H SER 30 H SER 30 0.372 2.671 -9.080
215 HA SER 30 HA SER 30 0.556 0.444 -10.970
216 HB2 SER 30 1HB SER 30 1.839 3.156 -10.749
217 HB3 SER 30 2HB SER 30 2.412 1.979 -11.928
218 HG SER 30 HG SER 30 -0.155 1.920 -12.162
219 H GLY 31 H GLY 31 2.663 -0.508 -11.522
220 HA2 GLY 31 1HA GLY 31 3.973 -1.616 -9.239
221 HA3 GLY 31 2HA GLY 31 4.510 -1.794 -10.905
222 H ASN 32 H ASN 32 6.226 -1.469 -8.680
223 HA ASN 32 HA ASN 32 8.127 -0.282 -8.032
224 HB2 ASN 32 1HB ASN 32 8.512 -0.330 -10.521
225 HB3 ASN 32 2HB ASN 32 7.732 1.248 -10.621
226 HD21 ASN 32 2HD2 ASN 32 10.580 -0.445 -9.305
227 HD22 ASN 32 1HD2 ASN 32 11.494 0.959 -9.036
228 H THR 33 H THR 33 5.139 1.062 -8.195
229 HA THR 33 HA THR 33 5.748 3.844 -7.699
230 HB THR 33 HB THR 33 3.254 2.315 -6.928
231 HG1 THR 33 HG1 THR 33 3.683 3.811 -9.279
232 HG21 THR 33 3HG2 THR 33 2.195 4.535 -7.143
233 HG22 THR 33 1HG2 THR 33 3.765 5.247 -7.514
234 HG23 THR 33 2HG2 THR 33 3.466 4.556 -5.920
235 H LYS 34 H LYS 34 5.999 4.917 -5.773
236 HA LYS 34 HA LYS 34 6.671 3.282 -3.415
237 HB2 LYS 34 1HB LYS 34 6.883 6.240 -4.022
238 HB3 LYS 34 2HB LYS 34 7.338 5.535 -2.470
239 HG2 LYS 34 1HG LYS 34 8.947 4.054 -3.618
240 HG3 LYS 34 2HG LYS 34 8.495 4.766 -5.166
241 HD2 LYS 34 1HD LYS 34 9.260 6.973 -4.391
242 HD3 LYS 34 2HD LYS 34 9.689 6.282 -2.826
243 HE2 LYS 34 1HE LYS 34 11.314 4.791 -3.916
244 HE3 LYS 34 2HE LYS 34 10.881 5.455 -5.491
245 HZ1 LYS 34 3HZ LYS 34 11.526 7.503 -3.614
246 HZ2 LYS 34 1HZ LYS 34 12.178 7.209 -5.153
247 HZ3 LYS 34 2HZ LYS 34 12.809 6.404 -3.796
248 H VAL 35 H VAL 35 5.556 3.383 -1.436
249 HA VAL 35 HA VAL 35 2.967 4.909 -1.441
250 HB VAL 35 HB VAL 35 2.130 2.940 -0.003
251 HG11 VAL 35 1HG1 VAL 35 2.766 2.665 -2.952
252 HG12 VAL 35 2HG1 VAL 35 1.283 3.291 -2.231
253 HG13 VAL 35 3HG1 VAL 35 1.679 1.577 -2.088
254 HG21 VAL 35 3HG2 VAL 35 3.263 0.838 -0.240
255 HG22 VAL 35 1HG2 VAL 35 4.495 2.005 0.245
256 HG23 VAL 35 2HG2 VAL 35 4.374 1.497 -1.439
257 H THR 36 H THR 36 2.637 6.155 0.294
258 HA THR 36 HA THR 36 4.714 6.460 2.287
259 HB THR 36 HB THR 36 1.900 7.580 2.321
260 HG1 THR 36 HG1 THR 36 4.051 9.058 1.389
261 HG21 THR 36 3HG2 THR 36 4.503 8.579 3.509
262 HG22 THR 36 1HG2 THR 36 3.194 7.820 4.415
263 HG23 THR 36 2HG2 THR 36 2.935 9.378 3.631
264 H ILE 37 H ILE 37 4.942 4.763 3.679
265 HA ILE 37 HA ILE 37 2.515 3.564 4.928
266 HB ILE 37 HB ILE 37 5.410 2.664 4.877
267 HG12 ILE 37 1HG1 ILE 37 2.974 1.365 3.640
268 HG13 ILE 37 2HG1 ILE 37 3.988 2.503 2.754
269 HG21 ILE 37 1HG2 ILE 37 4.445 1.917 6.945
270 HG22 ILE 37 2HG2 ILE 37 4.381 0.544 5.841
271 HG23 ILE 37 3HG2 ILE 37 2.928 1.493 6.155
272 HD11 ILE 37 3HD1 ILE 37 4.932 -0.081 4.033
273 HD12 ILE 37 1HD1 ILE 37 5.952 1.058 3.153
274 HD13 ILE 37 2HD1 ILE 37 4.677 0.180 2.308
275 H VAL 38 H VAL 38 2.050 3.985 7.016
276 HA VAL 38 HA VAL 38 4.164 5.045 8.828
277 HB VAL 38 HB VAL 38 2.666 6.823 9.614
278 HG11 VAL 38 1HG1 VAL 38 4.185 7.215 7.644
279 HG12 VAL 38 2HG1 VAL 38 2.775 8.274 7.685
280 HG13 VAL 38 3HG1 VAL 38 2.809 6.893 6.589
281 HG21 VAL 38 3HG2 VAL 38 0.774 5.566 7.618
282 HG22 VAL 38 1HG2 VAL 38 0.579 7.244 8.126
283 HG23 VAL 38 2HG2 VAL 38 0.481 5.949 9.316
284 H GLY 39 H GLY 39 0.781 3.957 8.530
285 HA2 GLY 39 1HA GLY 39 0.850 2.973 11.330
286 HA3 GLY 39 2HA GLY 39 -0.582 3.082 10.309
287 H GLU 40 H GLU 40 -0.036 0.746 11.737
288 HA GLU 40 HA GLU 40 0.503 -1.162 9.510
289 HB2 GLU 40 1HB GLU 40 2.480 -0.946 11.081
290 HB3 GLU 40 2HB GLU 40 1.440 -1.570 12.359
291 HG2 GLU 40 1HG GLU 40 1.804 -3.040 9.745
292 HG3 GLU 40 2HG GLU 40 2.893 -3.281 11.107
293 H GLU 41 H GLU 41 -0.768 -3.019 9.567
294 HA GLU 41 HA GLU 41 -2.545 -3.510 11.861
295 HB2 GLU 41 1HB GLU 41 -3.771 -1.805 10.535
296 HB3 GLU 41 2HB GLU 41 -3.679 -2.859 9.124
297 HG2 GLU 41 1HG GLU 41 -4.953 -4.592 10.298
298 HG3 GLU 41 2HG GLU 41 -4.994 -3.598 11.755
299 H GLY 42 H GLY 42 -2.092 -5.623 12.109
300 HA2 GLY 42 1HA GLY 42 -1.718 -7.881 11.612
301 HA3 GLY 42 2HA GLY 42 -3.059 -7.665 10.493
302 H ALA 43 H ALA 43 -2.302 -8.900 8.813
303 HA ALA 43 HA ALA 43 0.433 -8.603 7.809
304 HB1 ALA 43 3HB ALA 43 -0.370 -10.204 6.049
305 HB2 ALA 43 1HB ALA 43 -1.976 -10.127 6.773
306 HB3 ALA 43 2HB ALA 43 -0.626 -10.794 7.692
307 H PHE 44 H PHE 44 -1.413 -6.267 7.842
308 HA PHE 44 HA PHE 44 -1.211 -5.567 4.940
309 HB2 PHE 44 1HB PHE 44 -3.519 -4.867 6.779
310 HB3 PHE 44 2HB PHE 44 -3.337 -4.349 5.104
311 HD1 PHE 44 HD2 PHE 44 -3.476 -5.988 3.253
312 HD2 PHE 44 HD1 PHE 44 -4.191 -7.118 7.334
313 HE1 PHE 44 HE2 PHE 44 -4.543 -8.091 2.483
314 HE2 PHE 44 HE1 PHE 44 -5.259 -9.219 6.565
315 HZ PHE 44 HZ PHE 44 -5.435 -9.706 4.140
316 H TYR 45 H TYR 45 -0.437 -3.517 4.574
317 HA TYR 45 HA TYR 45 0.422 -1.978 6.981
318 HB2 TYR 45 1HB TYR 45 1.375 -2.112 4.122
319 HB3 TYR 45 2HB TYR 45 1.775 -0.718 5.125
320 HD1 TYR 45 HD2 TYR 45 2.588 -1.389 7.600
321 HD2 TYR 45 HD1 TYR 45 2.906 -3.884 4.120
322 HE1 TYR 45 HE2 TYR 45 4.406 -2.669 8.686
323 HE2 TYR 45 HE1 TYR 45 4.735 -5.162 5.204
324 HH TYR 45 HH TYR 45 5.304 -5.397 8.158
325 H LYS 46 H LYS 46 -0.197 0.138 7.270
326 HA LYS 46 HA LYS 46 -2.570 0.997 5.735
327 HB2 LYS 46 1HB LYS 46 -2.530 1.107 8.230
328 HB3 LYS 46 2HB LYS 46 -1.225 2.289 8.123
329 HG2 LYS 46 1HG LYS 46 -2.657 3.821 6.881
330 HG3 LYS 46 2HG LYS 46 -3.954 2.627 6.847
331 HD2 LYS 46 1HD LYS 46 -4.057 2.683 9.322
332 HD3 LYS 46 2HD LYS 46 -2.789 3.910 9.336
333 HE2 LYS 46 1HE LYS 46 -5.492 4.195 7.995
334 HE3 LYS 46 2HE LYS 46 -5.024 4.945 9.519
335 HZ1 LYS 46 3HZ LYS 46 -3.088 5.895 8.156
336 HZ2 LYS 46 1HZ LYS 46 -4.623 6.595 7.974
337 HZ3 LYS 46 2HZ LYS 46 -4.038 5.514 6.800
338 H ILE 47 H ILE 47 -2.462 2.508 4.167
339 HA ILE 47 HA ILE 47 -0.031 4.246 4.007
340 HB ILE 47 HB ILE 47 -0.247 4.086 1.526
341 HG12 ILE 47 1HG1 ILE 47 -2.134 1.788 2.121
342 HG13 ILE 47 2HG1 ILE 47 -2.683 3.381 1.596
343 HG21 ILE 47 1HG2 ILE 47 1.400 2.717 2.606
344 HG22 ILE 47 2HG2 ILE 47 0.594 1.705 1.409
345 HG23 ILE 47 3HG2 ILE 47 0.183 1.549 3.116
346 HD11 ILE 47 3HD1 ILE 47 -1.507 3.188 -0.491
347 HD12 ILE 47 1HD1 ILE 47 -2.398 1.683 -0.269
348 HD13 ILE 47 2HD1 ILE 47 -0.665 1.736 0.049
349 H GLU 48 H GLU 48 -0.354 6.328 3.127
350 HA GLU 48 HA GLU 48 -3.055 7.386 3.639
351 HB2 GLU 48 1HB GLU 48 -0.430 8.678 2.864
352 HB3 GLU 48 2HB GLU 48 -1.921 9.589 3.117
353 HG2 GLU 48 1HG GLU 48 -2.077 8.737 5.414
354 HG3 GLU 48 2HG GLU 48 -0.630 7.761 5.166
355 H TYR 49 H TYR 49 -4.314 6.556 1.923
356 HA TYR 49 HA TYR 49 -3.487 6.891 -0.852
357 HB2 TYR 49 1HB TYR 49 -4.916 5.005 -0.110
358 HB3 TYR 49 2HB TYR 49 -6.195 6.152 0.288
359 HD1 TYR 49 HD1 TYR 49 -4.172 4.724 -2.470
360 HD2 TYR 49 HD2 TYR 49 -7.548 7.163 -1.424
361 HE1 TYR 49 HE1 TYR 49 -4.921 4.696 -4.833
362 HE2 TYR 49 HE2 TYR 49 -8.299 7.136 -3.787
363 HH TYR 49 HH TYR 49 -7.437 6.767 -5.983
364 H LYS 50 H LYS 50 -4.211 8.426 -2.303
365 HA LYS 50 HA LYS 50 -4.863 11.018 -1.375
366 HB2 LYS 50 1HB LYS 50 -5.456 9.849 -4.102
367 HB3 LYS 50 2HB LYS 50 -5.246 11.558 -3.715
368 HG2 LYS 50 1HG LYS 50 -3.113 9.431 -3.348
369 HG3 LYS 50 2HG LYS 50 -3.193 10.540 -4.715
370 HD2 LYS 50 1HD LYS 50 -3.188 12.425 -2.949
371 HD3 LYS 50 2HD LYS 50 -2.663 11.183 -1.812
372 HE2 LYS 50 1HE LYS 50 -0.737 10.658 -3.230
373 HE3 LYS 50 2HE LYS 50 -1.251 11.877 -4.397
374 HZ1 LYS 50 3HZ LYS 50 -0.575 12.407 -1.554
375 HZ2 LYS 50 1HZ LYS 50 -1.016 13.569 -2.707
376 HZ3 LYS 50 2HZ LYS 50 0.446 12.720 -2.876
377 H GLY 51 H GLY 51 -6.647 11.083 -0.033
378 HA2 GLY 51 1HA GLY 51 -9.037 11.864 -0.319
379 HA3 GLY 51 2HA GLY 51 -9.299 10.390 -1.251
380 H SER 52 H SER 52 -7.675 8.686 0.473
381 HA SER 52 HA SER 52 -8.831 8.891 3.160
382 HB2 SER 52 1HB SER 52 -10.013 6.706 3.008
383 HB3 SER 52 2HB SER 52 -10.721 7.920 1.944
384 HG SER 52 HG SER 52 -9.770 5.555 1.291
385 H HIS 53 H HIS 53 -8.499 6.210 3.917
386 HA HIS 53 HA HIS 53 -5.540 5.880 3.608
387 HB2 HIS 53 1HB HIS 53 -7.445 4.921 5.757
388 HB3 HIS 53 2HB HIS 53 -5.722 4.550 5.705
389 HD1 HIS 53 HD1 HIS 53 -4.145 6.831 5.527
390 HD2 HIS 53 HD2 HIS 53 -7.976 7.275 7.109
391 HE1 HIS 53 HE1 HIS 53 -4.142 9.016 6.804
392 H GLY 54 H GLY 54 -4.965 4.297 2.246
393 HA2 GLY 54 1HA GLY 54 -6.875 2.108 1.627
394 HA3 GLY 54 2HA GLY 54 -5.434 2.520 0.700
395 H TYR 55 H TYR 55 -5.995 -0.119 1.492
396 HA TYR 55 HA TYR 55 -3.775 -0.629 3.443
397 HB2 TYR 55 1HB TYR 55 -6.436 -2.039 3.158
398 HB3 TYR 55 2HB TYR 55 -5.075 -2.710 4.061
399 HD1 TYR 55 HD1 TYR 55 -4.083 -1.372 5.966
400 HD2 TYR 55 HD2 TYR 55 -7.813 -0.340 4.105
401 HE1 TYR 55 HE1 TYR 55 -4.671 0.030 7.925
402 HE2 TYR 55 HE2 TYR 55 -8.404 1.060 6.064
403 HH TYR 55 HH TYR 55 -6.960 0.842 8.979
404 H VAL 56 H VAL 56 -2.265 -2.075 2.774
405 HA VAL 56 HA VAL 56 -2.830 -3.706 0.327
406 HB VAL 56 HB VAL 56 -0.468 -3.194 -0.402
407 HG11 VAL 56 1HG1 VAL 56 -1.070 -0.886 -1.226
408 HG12 VAL 56 2HG1 VAL 56 -2.494 -0.951 -0.187
409 HG13 VAL 56 3HG1 VAL 56 -2.315 -2.102 -1.512
410 HG21 VAL 56 3HG2 VAL 56 0.456 -2.398 1.696
411 HG22 VAL 56 1HG2 VAL 56 -0.750 -1.116 1.792
412 HG23 VAL 56 2HG2 VAL 56 0.487 -1.064 0.542
413 H ALA 57 H ALA 57 -2.052 -5.762 0.434
414 HA ALA 57 HA ALA 57 -1.173 -6.795 2.969
415 HB1 ALA 57 3HB ALA 57 -1.127 -8.088 0.231
416 HB2 ALA 57 1HB ALA 57 -2.477 -8.130 1.364
417 HB3 ALA 57 2HB ALA 57 -0.960 -8.934 1.770
418 H LYS 58 H LYS 58 0.862 -7.586 3.575
419 HA LYS 58 HA LYS 58 3.147 -6.147 2.634
420 HB2 LYS 58 1HB LYS 58 3.270 -8.788 4.093
421 HB3 LYS 58 2HB LYS 58 4.385 -7.426 4.207
422 HG2 LYS 58 1HG LYS 58 2.425 -6.076 5.127
423 HG3 LYS 58 2HG LYS 58 1.559 -7.599 5.259
424 HD2 LYS 58 1HD LYS 58 4.241 -7.024 6.546
425 HD3 LYS 58 2HD LYS 58 2.691 -6.988 7.386
426 HE2 LYS 58 1HE LYS 58 3.429 -9.158 7.853
427 HE3 LYS 58 2HE LYS 58 2.432 -9.432 6.425
428 HZ1 LYS 58 3HZ LYS 58 4.273 -10.397 5.631
429 HZ2 LYS 58 1HZ LYS 58 5.295 -9.634 6.750
430 HZ3 LYS 58 2HZ LYS 58 4.809 -8.811 5.344
431 H GLU 59 H GLU 59 1.520 -8.763 1.255
432 HA GLU 59 HA GLU 59 3.733 -10.254 0.159
433 HB2 GLU 59 1HB GLU 59 0.856 -9.962 -0.725
434 HB3 GLU 59 2HB GLU 59 1.992 -11.099 -1.450
435 HG2 GLU 59 1HG GLU 59 2.319 -12.199 0.710
436 HG3 GLU 59 2HG GLU 59 1.263 -11.022 1.491
437 H TYR 60 H TYR 60 1.888 -7.454 -0.972
438 HA TYR 60 HA TYR 60 3.416 -7.412 -3.515
439 HB2 TYR 60 1HB TYR 60 1.229 -5.586 -2.468
440 HB3 TYR 60 2HB TYR 60 1.921 -5.535 -4.094
441 HD1 TYR 60 HD1 TYR 60 1.641 -7.479 -5.634
442 HD2 TYR 60 HD2 TYR 60 -0.386 -7.264 -1.852
443 HE1 TYR 60 HE1 TYR 60 0.094 -9.275 -6.360
444 HE2 TYR 60 HE2 TYR 60 -1.936 -9.059 -2.581
445 HH TYR 60 HH TYR 60 -1.455 -10.771 -5.632
446 H ILE 61 H ILE 61 4.092 -6.546 -0.456
447 HA ILE 61 HA ILE 61 5.382 -3.938 -1.161
448 HB ILE 61 HB ILE 61 4.993 -5.243 1.541
449 HG12 ILE 61 1HG1 ILE 61 2.838 -4.629 0.605
450 HG13 ILE 61 2HG1 ILE 61 3.262 -3.465 1.852
451 HG21 ILE 61 1HG2 ILE 61 6.096 -2.581 0.650
452 HG22 ILE 61 2HG2 ILE 61 6.840 -3.777 1.712
453 HG23 ILE 61 3HG2 ILE 61 5.468 -2.827 2.279
454 HD11 ILE 61 3HD1 ILE 61 2.550 -2.063 0.128
455 HD12 ILE 61 1HD1 ILE 61 3.202 -3.108 -1.129
456 HD13 ILE 61 2HD1 ILE 61 4.283 -2.104 -0.167
457 H LYS 62 H LYS 62 7.538 -3.867 -1.446
458 HA LYS 62 HA LYS 62 9.266 -5.875 -0.135
459 HB2 LYS 62 1HB LYS 62 8.598 -6.918 -2.279
460 HB3 LYS 62 2HB LYS 62 9.217 -5.508 -3.140
461 HG2 LYS 62 1HG LYS 62 11.467 -5.929 -2.351
462 HG3 LYS 62 2HG LYS 62 10.905 -7.217 -1.290
463 HD2 LYS 62 1HD LYS 62 11.743 -8.394 -3.142
464 HD3 LYS 62 2HD LYS 62 10.017 -8.321 -3.483
465 HE2 LYS 62 1HE LYS 62 11.364 -7.734 -5.476
466 HE3 LYS 62 2HE LYS 62 10.379 -6.373 -4.948
467 HZ1 LYS 62 3HZ LYS 62 12.213 -5.314 -4.011
468 HZ2 LYS 62 1HZ LYS 62 12.809 -5.928 -5.475
469 HZ3 LYS 62 2HZ LYS 62 13.160 -6.725 -4.016
470 H ASP 63 H ASP 63 11.521 -5.307 -0.234
471 HA ASP 63 HA ASP 63 13.254 -3.774 0.012
472 HB2 ASP 63 1HB ASP 63 11.903 -2.701 -2.479
473 HB3 ASP 63 2HB ASP 63 13.413 -2.043 -1.846
474 H ILE 64 H ILE 64 11.395 -3.323 1.851
475 HA ILE 64 HA ILE 64 10.228 -0.688 1.793
476 HB ILE 64 HB ILE 64 10.853 -2.545 4.099
477 HG12 ILE 64 1HG1 ILE 64 8.209 -1.886 2.774
478 HG13 ILE 64 2HG1 ILE 64 9.193 -3.281 2.332
479 HG21 ILE 64 1HG2 ILE 64 9.084 -1.081 5.253
480 HG22 ILE 64 2HG2 ILE 64 9.376 0.092 3.969
481 HG23 ILE 64 3HG2 ILE 64 10.685 -0.370 5.056
482 HD11 ILE 64 3HD1 ILE 64 9.040 -4.164 4.597
483 HD12 ILE 64 1HD1 ILE 64 7.415 -3.838 3.998
484 HD13 ILE 64 2HD1 ILE 64 8.175 -2.723 5.132
485 H LYS 65 H LYS 65 11.153 1.241 2.259
486 HA LYS 65 HA LYS 65 13.780 1.255 3.690
487 HB2 LYS 65 1HB LYS 65 13.983 1.501 1.154
488 HB3 LYS 65 2HB LYS 65 13.148 3.042 1.337
489 HG2 LYS 65 1HG LYS 65 15.361 3.751 1.499
490 HG3 LYS 65 2HG LYS 65 14.995 3.471 3.200
491 HD2 LYS 65 1HD LYS 65 15.952 1.158 2.967
492 HD3 LYS 65 2HD LYS 65 16.418 1.563 1.317
493 HE2 LYS 65 1HE LYS 65 17.300 3.096 3.774
494 HE3 LYS 65 2HE LYS 65 18.274 1.880 2.948
495 HZ1 LYS 65 3HZ LYS 65 18.160 3.196 0.934
496 HZ2 LYS 65 1HZ LYS 65 18.818 4.112 2.199
497 HZ3 LYS 65 2HZ LYS 65 17.207 4.363 1.719
498 H ASP 66 H ASP 66 13.999 2.829 5.179
499 HA ASP 66 HA ASP 66 11.646 4.507 5.757
500 HB2 ASP 66 1HB ASP 66 12.912 3.177 7.508
501 HB3 ASP 66 2HB ASP 66 14.239 4.318 7.301
502 H GLU 67 H GLU 67 11.526 6.439 4.789
503 HA GLU 67 HA GLU 67 13.594 7.758 3.404
504 HB2 GLU 67 1HB GLU 67 11.115 8.901 4.713
505 HB3 GLU 67 2HB GLU 67 12.118 9.767 3.549
506 HG2 GLU 67 1HG GLU 67 10.761 7.112 3.000
507 HG3 GLU 67 2HG GLU 67 10.129 8.679 2.495
508 H VAL 68 H VAL 68 14.750 9.704 3.910
509 HA VAL 68 HA VAL 68 16.131 11.023 5.242
510 HB VAL 68 HB VAL 68 14.180 10.521 7.503
511 HG11 VAL 68 1HG1 VAL 68 16.232 11.749 8.056
512 HG12 VAL 68 2HG1 VAL 68 14.847 12.841 8.087
513 HG13 VAL 68 3HG1 VAL 68 15.949 12.853 6.709
514 HG21 VAL 68 3HG2 VAL 68 13.965 12.340 5.088
515 HG22 VAL 68 1HG2 VAL 68 13.022 12.587 6.557
516 HG23 VAL 68 2HG2 VAL 68 12.810 11.114 5.609
517 H LEU 69 H LEU 69 17.639 9.196 5.071
518 HA LEU 69 HA LEU 69 17.824 7.349 7.344
519 HB2 LEU 69 1HB LEU 69 20.093 6.842 6.010
520 HB3 LEU 69 2HB LEU 69 18.540 6.229 5.448
521 HG LEU 69 HG LEU 69 19.357 8.974 4.531
522 HD11 LEU 69 1HD1 LEU 69 21.409 7.685 4.194
523 HD12 LEU 69 2HD1 LEU 69 20.627 7.990 2.643
524 HD13 LEU 69 3HD1 LEU 69 20.496 6.402 3.399
525 HD21 LEU 69 3HD2 LEU 69 18.150 6.717 2.919
526 HD22 LEU 69 1HD2 LEU 69 18.014 8.455 2.650
527 HD23 LEU 69 2HD2 LEU 69 17.155 7.698 3.990
528 H GLU 70 H GLU 70 19.740 7.201 8.674
529 HA GLU 70 HA GLU 70 20.557 9.662 9.828
530 HB2 GLU 70 1HB GLU 70 21.831 6.911 9.931
531 HB3 GLU 70 2HB GLU 70 22.290 8.253 10.979
532 HG2 GLU 70 1HG GLU 70 19.490 7.103 10.784
533 HG3 GLU 70 2HG GLU 70 20.647 6.711 12.056
534 H HIS 71 H HIS 71 22.341 10.948 9.528
535 HA HIS 71 HA HIS 71 23.776 10.699 6.989
536 HB2 HIS 71 1HB HIS 71 23.008 12.889 7.966
537 HB3 HIS 71 2HB HIS 71 24.197 12.674 9.251
538 HD1 HIS 71 HD1 HIS 71 26.690 12.941 8.638
539 HD2 HIS 71 HD2 HIS 71 24.117 13.489 5.405
540 HE1 HIS 71 HE1 HIS 71 28.090 13.915 6.767
541 H HIS 72 H HIS 72 24.206 9.656 10.203
542 HA HIS 72 HA HIS 72 25.990 8.658 11.334
543 HB2 HIS 72 1HB HIS 72 26.811 8.096 8.469
544 HB3 HIS 72 2HB HIS 72 27.573 7.365 9.882
545 HD1 HIS 72 HD1 HIS 72 25.992 5.845 11.417
546 HD2 HIS 72 HD2 HIS 72 24.372 6.930 7.731
547 HE1 HIS 72 HE1 HIS 72 24.023 4.302 11.017
548 H HIS 73 H HIS 73 27.195 10.145 12.413
549 HA HIS 73 HA HIS 73 29.598 11.218 11.058
550 HB2 HIS 73 1HB HIS 73 29.150 13.514 11.909
551 HB3 HIS 73 2HB HIS 73 27.958 12.999 10.717
552 HD1 HIS 73 HD1 HIS 73 25.556 12.465 11.573
553 HD2 HIS 73 HD2 HIS 73 28.141 13.831 14.546
554 HE1 HIS 73 HE1 HIS 73 24.109 13.050 13.567
555 H HIS 74 H HIS 74 31.177 12.040 12.624
556 HA HIS 74 HA HIS 74 30.906 10.664 15.259
557 HB2 HIS 74 1HB HIS 74 33.323 11.677 13.737
558 HB3 HIS 74 2HB HIS 74 33.395 10.934 15.335
559 HD1 HIS 74 HD1 HIS 74 32.318 8.421 15.446
560 HD2 HIS 74 HD2 HIS 74 33.335 9.837 11.658
561 HE1 HIS 74 HE1 HIS 74 32.431 6.395 13.930
562 H HIS 75 H HIS 75 30.844 11.817 17.109
563 HA HIS 75 HA HIS 75 30.455 14.663 17.093
564 HB2 HIS 75 1HB HIS 75 29.531 13.109 18.809
565 HB3 HIS 75 2HB HIS 75 31.168 12.837 19.404
566 HD1 HIS 75 HD1 HIS 75 32.281 14.709 20.770
567 HD2 HIS 75 HD2 HIS 75 28.487 15.719 19.371
568 HE1 HIS 75 HE1 HIS 75 31.629 16.852 21.952
569 H HIS 76 H HIS 76 33.215 12.610 18.006
570 HA HIS 76 HA HIS 76 35.461 13.138 18.394
571 HB2 HIS 76 1HB HIS 76 34.668 15.272 16.399
572 HB3 HIS 76 2HB HIS 76 36.311 15.138 17.018
573 HD1 HIS 76 HD1 HIS 76 37.029 12.314 16.952
574 HD2 HIS 76 HD2 HIS 76 34.529 13.903 14.019
575 HE1 HIS 76 HE1 HIS 76 37.173 10.750 14.965
Start of MODEL 6
1 H1 ALA 1 1H ALA 1 9.076 11.252 9.766
2 H2 ALA 1 2H ALA 1 10.396 11.629 10.768
3 H3 ALA 1 3H ALA 1 9.037 10.840 11.412
4 HA ALA 1 HA ALA 1 11.144 9.766 9.653
5 HB1 ALA 1 3HB ALA 1 11.138 9.614 12.219
6 HB2 ALA 1 1HB ALA 1 11.328 8.095 11.342
7 HB3 ALA 1 2HB ALA 1 9.764 8.522 12.039
8 H GLU 2 H GLU 2 9.206 10.088 8.002
9 HA GLU 2 HA GLU 2 7.054 8.154 8.147
10 HB2 GLU 2 1HB GLU 2 8.137 9.815 5.853
11 HB3 GLU 2 2HB GLU 2 6.679 8.828 5.754
12 HG2 GLU 2 1HG GLU 2 7.116 11.056 7.764
13 HG3 GLU 2 2HG GLU 2 6.187 11.219 6.273
14 H LYS 3 H LYS 3 6.785 6.286 6.831
15 HA LYS 3 HA LYS 3 9.368 5.046 5.939
16 HB2 LYS 3 1HB LYS 3 6.807 3.813 6.978
17 HB3 LYS 3 2HB LYS 3 8.141 2.882 6.296
18 HG2 LYS 3 1HG LYS 3 9.661 3.804 8.009
19 HG3 LYS 3 2HG LYS 3 8.326 4.736 8.691
20 HD2 LYS 3 1HD LYS 3 7.097 2.618 9.117
21 HD3 LYS 3 2HD LYS 3 8.483 1.714 8.509
22 HE2 LYS 3 1HE LYS 3 8.622 3.659 10.828
23 HE3 LYS 3 2HE LYS 3 8.433 1.916 11.016
24 HZ1 LYS 3 3HZ LYS 3 10.716 2.298 11.171
25 HZ2 LYS 3 1HZ LYS 3 10.724 3.402 9.883
26 HZ3 LYS 3 2HZ LYS 3 10.498 1.746 9.579
27 H THR 4 H THR 4 9.265 3.702 4.022
28 HA THR 4 HA THR 4 6.914 4.224 2.246
29 HB THR 4 HB THR 4 8.408 4.668 0.373
30 HG1 THR 4 HG1 THR 4 10.466 4.283 0.506
31 HG21 THR 4 3HG2 THR 4 9.363 6.829 1.157
32 HG22 THR 4 1HG2 THR 4 9.045 6.336 2.820
33 HG23 THR 4 2HG2 THR 4 7.704 6.588 1.705
34 H GLY 5 H GLY 5 6.575 2.612 0.657
35 HA2 GLY 5 1HA GLY 5 8.183 0.107 0.941
36 HA3 GLY 5 2HA GLY 5 6.425 0.051 1.062
37 H ILE 6 H ILE 6 8.755 -0.686 -1.006
38 HA ILE 6 HA ILE 6 7.739 0.586 -3.441
39 HB ILE 6 HB ILE 6 9.776 -1.604 -2.940
40 HG12 ILE 6 1HG1 ILE 6 11.337 0.213 -3.729
41 HG13 ILE 6 2HG1 ILE 6 9.969 1.322 -3.734
42 HG21 ILE 6 1HG2 ILE 6 8.797 -0.342 -5.510
43 HG22 ILE 6 2HG2 ILE 6 8.921 -2.057 -5.118
44 HG23 ILE 6 3HG2 ILE 6 10.382 -1.106 -5.382
45 HD11 ILE 6 3HD1 ILE 6 10.532 -0.229 -1.223
46 HD12 ILE 6 1HD1 ILE 6 9.825 1.376 -1.418
47 HD13 ILE 6 2HD1 ILE 6 11.560 1.144 -1.618
48 H VAL 7 H VAL 7 6.036 -0.166 -4.582
49 HA VAL 7 HA VAL 7 4.825 -2.744 -3.849
50 HB VAL 7 HB VAL 7 4.010 -0.623 -5.856
51 HG11 VAL 7 1HG1 VAL 7 1.788 -1.843 -5.703
52 HG12 VAL 7 2HG1 VAL 7 2.650 -3.151 -4.891
53 HG13 VAL 7 3HG1 VAL 7 3.061 -2.721 -6.549
54 HG21 VAL 7 3HG2 VAL 7 2.258 -0.166 -4.114
55 HG22 VAL 7 1HG2 VAL 7 3.898 0.174 -3.558
56 HG23 VAL 7 2HG2 VAL 7 3.082 -1.305 -3.049
57 H ASN 8 H ASN 8 5.517 -4.577 -4.799
58 HA ASN 8 HA ASN 8 6.603 -4.443 -7.597
59 HB2 ASN 8 1HB ASN 8 7.127 -6.346 -5.307
60 HB3 ASN 8 2HB ASN 8 7.617 -6.692 -6.968
61 HD21 ASN 8 2HD2 ASN 8 9.558 -6.338 -4.889
62 HD22 ASN 8 1HD2 ASN 8 10.426 -4.913 -5.204
63 H VAL 9 H VAL 9 4.950 -4.927 -8.958
64 HA VAL 9 HA VAL 9 3.521 -7.505 -8.520
65 HB VAL 9 HB VAL 9 1.412 -6.385 -9.364
66 HG11 VAL 9 1HG1 VAL 9 1.865 -6.924 -6.963
67 HG12 VAL 9 2HG1 VAL 9 0.808 -5.532 -7.173
68 HG13 VAL 9 3HG1 VAL 9 2.506 -5.294 -6.756
69 HG21 VAL 9 3HG2 VAL 9 2.852 -3.839 -8.579
70 HG22 VAL 9 1HG2 VAL 9 1.243 -3.985 -9.283
71 HG23 VAL 9 2HG2 VAL 9 2.669 -4.362 -10.250
72 H SER 10 H SER 10 2.684 -8.410 -10.496
73 HA SER 10 HA SER 10 4.433 -7.966 -12.764
74 HB2 SER 10 1HB SER 10 3.061 -9.717 -13.839
75 HB3 SER 10 2HB SER 10 3.521 -10.197 -12.208
76 HG SER 10 HG SER 10 1.204 -10.390 -12.922
77 H SER 11 H SER 11 1.531 -6.529 -11.685
78 HA SER 11 HA SER 11 1.342 -4.974 -14.183
79 HB2 SER 11 1HB SER 11 -0.976 -5.470 -14.602
80 HB3 SER 11 2HB SER 11 -0.131 -7.011 -14.488
81 HG SER 11 HG SER 11 -0.774 -6.951 -12.207
82 H SER 12 H SER 12 -1.584 -4.795 -12.673
83 HA SER 12 HA SER 12 -0.763 -2.351 -11.179
84 HB2 SER 12 1HB SER 12 -3.375 -3.303 -12.349
85 HB3 SER 12 2HB SER 12 -3.299 -1.956 -11.217
86 HG SER 12 HG SER 12 -2.169 -0.798 -12.653
87 H LEU 13 H LEU 13 -1.849 -1.919 -9.117
88 HA LEU 13 HA LEU 13 -2.502 -4.420 -7.599
89 HB2 LEU 13 1HB LEU 13 -0.323 -3.499 -6.932
90 HB3 LEU 13 2HB LEU 13 -1.062 -1.929 -6.637
91 HG LEU 13 HG LEU 13 -2.491 -2.930 -4.880
92 HD11 LEU 13 1HD1 LEU 13 -2.837 -5.173 -5.449
93 HD12 LEU 13 2HD1 LEU 13 -1.662 -5.319 -4.148
94 HD13 LEU 13 3HD1 LEU 13 -1.135 -5.448 -5.825
95 HD21 LEU 13 3HD2 LEU 13 -0.206 -2.013 -4.374
96 HD22 LEU 13 1HD2 LEU 13 0.417 -3.659 -4.476
97 HD23 LEU 13 2HD2 LEU 13 -0.753 -3.238 -3.228
98 H ASN 14 H ASN 14 -4.398 -4.406 -6.518
99 HA ASN 14 HA ASN 14 -6.131 -2.026 -6.738
100 HB2 ASN 14 1HB ASN 14 -6.582 -4.870 -5.805
101 HB3 ASN 14 2HB ASN 14 -7.828 -3.624 -5.714
102 HD21 ASN 14 2HD2 ASN 14 -8.107 -5.956 -7.391
103 HD22 ASN 14 1HD2 ASN 14 -8.102 -5.443 -9.010
104 H VAL 15 H VAL 15 -6.480 -0.647 -5.076
105 HA VAL 15 HA VAL 15 -5.198 -1.184 -2.467
106 HB VAL 15 HB VAL 15 -6.608 1.254 -3.594
107 HG11 VAL 15 1HG1 VAL 15 -6.881 1.327 -1.213
108 HG12 VAL 15 2HG1 VAL 15 -5.511 2.373 -1.584
109 HG13 VAL 15 3HG1 VAL 15 -5.236 0.753 -0.942
110 HG21 VAL 15 3HG2 VAL 15 -4.296 2.168 -3.626
111 HG22 VAL 15 1HG2 VAL 15 -4.453 0.743 -4.654
112 HG23 VAL 15 2HG2 VAL 15 -3.689 0.609 -3.069
113 H ARG 16 H ARG 16 -6.332 -1.750 -0.664
114 HA ARG 16 HA ARG 16 -9.291 -2.027 -0.929
115 HB2 ARG 16 1HB ARG 16 -7.260 -3.278 0.932
116 HB3 ARG 16 2HB ARG 16 -9.001 -3.505 1.094
117 HG2 ARG 16 1HG ARG 16 -9.116 -4.439 -1.172
118 HG3 ARG 16 2HG ARG 16 -7.388 -4.158 -1.392
119 HD2 ARG 16 1HD ARG 16 -6.898 -5.691 0.478
120 HD3 ARG 16 2HD ARG 16 -8.623 -5.967 0.703
121 HE ARG 16 HE ARG 16 -8.642 -7.316 -1.259
122 HH11 ARG 16 1HH2 ARG 16 -5.641 -5.659 -0.794
123 HH12 ARG 16 2HH2 ARG 16 -4.796 -6.597 -1.978
124 HH21 ARG 16 1HH1 ARG 16 -7.544 -8.540 -2.797
125 HH22 ARG 16 2HH1 ARG 16 -5.870 -8.226 -3.111
126 H GLU 17 H GLU 17 -10.648 -0.875 0.305
127 HA GLU 17 HA GLU 17 -9.722 1.377 1.844
128 HB2 GLU 17 1HB GLU 17 -11.961 1.054 0.588
129 HB3 GLU 17 2HB GLU 17 -12.483 0.149 2.008
130 HG2 GLU 17 1HG GLU 17 -11.395 2.978 2.123
131 HG3 GLU 17 2HG GLU 17 -13.113 2.584 2.056
132 H GLY 18 H GLY 18 -11.104 -1.789 2.710
133 HA2 GLY 18 1HA GLY 18 -10.571 -1.230 5.591
134 HA3 GLY 18 2HA GLY 18 -11.600 -2.514 4.969
135 H ALA 19 H ALA 19 -10.024 -3.484 6.743
136 HA ALA 19 HA ALA 19 -7.434 -4.345 5.579
137 HB1 ALA 19 3HB ALA 19 -6.926 -5.153 7.776
138 HB2 ALA 19 1HB ALA 19 -8.622 -5.112 8.256
139 HB3 ALA 19 2HB ALA 19 -7.740 -3.605 8.009
140 H SER 20 H SER 20 -10.607 -5.343 5.421
141 HA SER 20 HA SER 20 -10.147 -8.225 5.680
142 HB2 SER 20 1HB SER 20 -12.536 -6.812 4.469
143 HB3 SER 20 2HB SER 20 -12.470 -8.467 5.068
144 HG SER 20 HG SER 20 -11.911 -6.198 6.672
145 H THR 21 H THR 21 -10.213 -9.725 3.945
146 HA THR 21 HA THR 21 -8.860 -8.937 1.539
147 HB THR 21 HB THR 21 -10.520 -11.438 1.943
148 HG1 THR 21 HG1 THR 21 -8.568 -10.606 3.441
149 HG21 THR 21 3HG2 THR 21 -7.989 -10.946 0.354
150 HG22 THR 21 1HG2 THR 21 -9.612 -10.945 -0.337
151 HG23 THR 21 2HG2 THR 21 -8.958 -12.421 0.373
152 H SER 22 H SER 22 -12.248 -9.777 2.220
153 HA SER 22 HA SER 22 -13.109 -9.257 -0.513
154 HB2 SER 22 1HB SER 22 -14.212 -10.845 1.159
155 HB3 SER 22 2HB SER 22 -14.850 -9.412 1.959
156 HG SER 22 HG SER 22 -16.100 -10.548 0.170
157 H SER 23 H SER 23 -11.728 -7.110 1.120
158 HA SER 23 HA SER 23 -13.691 -5.084 1.723
159 HB2 SER 23 1HB SER 23 -10.703 -5.072 1.352
160 HB3 SER 23 2HB SER 23 -11.592 -3.572 1.603
161 HG SER 23 HG SER 23 -10.934 -4.413 3.586
162 H LYS 24 H LYS 24 -14.162 -3.184 0.528
163 HA LYS 24 HA LYS 24 -14.370 -3.594 -2.325
164 HB2 LYS 24 1HB LYS 24 -16.080 -2.392 -0.994
165 HB3 LYS 24 2HB LYS 24 -14.919 -1.095 -0.702
166 HG2 LYS 24 1HG LYS 24 -14.761 -0.640 -3.091
167 HG3 LYS 24 2HG LYS 24 -15.812 -2.010 -3.453
168 HD2 LYS 24 1HD LYS 24 -17.644 -0.926 -2.186
169 HD3 LYS 24 2HD LYS 24 -16.594 0.455 -1.867
170 HE2 LYS 24 1HE LYS 24 -17.288 -0.519 -4.650
171 HE3 LYS 24 2HE LYS 24 -18.145 0.784 -3.826
172 HZ1 LYS 24 3HZ LYS 24 -16.115 2.030 -3.680
173 HZ2 LYS 24 1HZ LYS 24 -16.366 1.585 -5.297
174 HZ3 LYS 24 2HZ LYS 24 -15.223 0.752 -4.355
175 H VAL 25 H VAL 25 -13.168 -2.771 -3.951
176 HA VAL 25 HA VAL 25 -10.593 -1.526 -3.282
177 HB VAL 25 HB VAL 25 -11.819 -2.406 -5.909
178 HG11 VAL 25 1HG1 VAL 25 -9.400 -2.183 -6.694
179 HG12 VAL 25 2HG1 VAL 25 -9.109 -1.245 -5.229
180 HG13 VAL 25 3HG1 VAL 25 -10.261 -0.667 -6.432
181 HG21 VAL 25 3HG2 VAL 25 -10.105 -4.209 -5.708
182 HG22 VAL 25 1HG2 VAL 25 -11.289 -4.254 -4.402
183 HG23 VAL 25 2HG2 VAL 25 -9.681 -3.589 -4.112
184 H ILE 26 H ILE 26 -10.149 0.601 -3.494
185 HA ILE 26 HA ILE 26 -12.096 2.354 -4.958
186 HB ILE 26 HB ILE 26 -11.399 4.105 -3.215
187 HG12 ILE 26 1HG1 ILE 26 -10.534 1.594 -1.736
188 HG13 ILE 26 2HG1 ILE 26 -9.442 2.836 -2.336
189 HG21 ILE 26 1HG2 ILE 26 -13.077 3.324 -1.620
190 HG22 ILE 26 2HG2 ILE 26 -12.934 1.679 -2.239
191 HG23 ILE 26 3HG2 ILE 26 -13.604 2.950 -3.259
192 HD11 ILE 26 3HD1 ILE 26 -11.606 3.217 -0.258
193 HD12 ILE 26 1HD1 ILE 26 -10.620 4.517 -0.928
194 HD13 ILE 26 2HD1 ILE 26 -9.863 3.237 0.021
195 H GLY 27 H GLY 27 -8.749 2.013 -3.777
196 HA2 GLY 27 1HA GLY 27 -7.852 3.991 -5.817
197 HA3 GLY 27 2HA GLY 27 -6.910 3.445 -4.434
198 H SER 28 H SER 28 -5.645 3.423 -6.799
199 HA SER 28 HA SER 28 -5.094 0.577 -7.173
200 HB2 SER 28 1HB SER 28 -5.384 0.728 -9.675
201 HB3 SER 28 2HB SER 28 -6.894 0.764 -8.769
202 HG SER 28 HG SER 28 -5.940 3.248 -8.995
203 H LEU 29 H LEU 29 -3.095 0.244 -8.347
204 HA LEU 29 HA LEU 29 -1.485 2.713 -8.859
205 HB2 LEU 29 1HB LEU 29 -0.610 0.265 -7.295
206 HB3 LEU 29 2HB LEU 29 0.453 1.584 -7.774
207 HG LEU 29 HG LEU 29 -2.037 1.940 -6.079
208 HD11 LEU 29 1HD1 LEU 29 -0.278 0.564 -4.958
209 HD12 LEU 29 2HD1 LEU 29 -0.546 2.114 -4.163
210 HD13 LEU 29 3HD1 LEU 29 0.864 1.887 -5.196
211 HD21 LEU 29 3HD2 LEU 29 -1.587 4.050 -7.008
212 HD22 LEU 29 1HD2 LEU 29 0.154 3.774 -7.056
213 HD23 LEU 29 2HD2 LEU 29 -0.646 4.116 -5.527
214 H SER 30 H SER 30 0.140 2.462 -10.425
215 HA SER 30 HA SER 30 -0.418 0.386 -12.417
216 HB2 SER 30 1HB SER 30 0.106 2.788 -12.987
217 HB3 SER 30 2HB SER 30 1.749 2.505 -12.423
218 HG SER 30 HG SER 30 2.135 1.617 -14.274
219 H GLY 31 H GLY 31 1.374 0.454 -9.640
220 HA2 GLY 31 1HA GLY 31 2.696 -1.429 -8.923
221 HA3 GLY 31 2HA GLY 31 3.096 -1.771 -10.603
222 H ASN 32 H ASN 32 5.075 -1.712 -8.695
223 HA ASN 32 HA ASN 32 7.141 -0.760 -8.164
224 HB2 ASN 32 1HB ASN 32 6.662 0.507 -10.878
225 HB3 ASN 32 2HB ASN 32 8.204 0.528 -10.024
226 HD21 ASN 32 2HD2 ASN 32 7.435 -2.326 -8.972
227 HD22 ASN 32 1HD2 ASN 32 7.843 -3.335 -10.274
228 H THR 33 H THR 33 4.391 0.962 -8.037
229 HA THR 33 HA THR 33 5.479 3.656 -7.796
230 HB THR 33 HB THR 33 2.801 2.636 -6.818
231 HG1 THR 33 HG1 THR 33 3.823 3.122 -9.335
232 HG21 THR 33 3HG2 THR 33 3.797 5.379 -7.646
233 HG22 THR 33 1HG2 THR 33 3.459 4.861 -5.993
234 HG23 THR 33 2HG2 THR 33 2.146 4.997 -7.161
235 H LYS 34 H LYS 34 5.989 4.747 -5.931
236 HA LYS 34 HA LYS 34 6.496 3.102 -3.535
237 HB2 LYS 34 1HB LYS 34 8.202 4.697 -4.442
238 HB3 LYS 34 2HB LYS 34 7.111 6.024 -4.043
239 HG2 LYS 34 1HG LYS 34 7.172 5.436 -1.685
240 HG3 LYS 34 2HG LYS 34 8.126 3.999 -2.032
241 HD2 LYS 34 1HD LYS 34 9.721 5.604 -1.309
242 HD3 LYS 34 2HD LYS 34 9.864 5.593 -3.063
243 HE2 LYS 34 1HE LYS 34 8.618 7.622 -3.275
244 HE3 LYS 34 2HE LYS 34 8.084 7.556 -1.595
245 HZ1 LYS 34 3HZ LYS 34 9.884 9.127 -1.863
246 HZ2 LYS 34 1HZ LYS 34 10.881 7.922 -2.522
247 HZ3 LYS 34 2HZ LYS 34 10.388 7.821 -0.899
248 H VAL 35 H VAL 35 5.271 3.207 -1.697
249 HA VAL 35 HA VAL 35 3.211 5.387 -1.499
250 HB VAL 35 HB VAL 35 1.808 3.650 -0.299
251 HG11 VAL 35 1HG1 VAL 35 1.358 4.359 -2.608
252 HG12 VAL 35 2HG1 VAL 35 1.036 2.635 -2.423
253 HG13 VAL 35 3HG1 VAL 35 2.520 3.177 -3.208
254 HG21 VAL 35 3HG2 VAL 35 3.802 1.768 -1.605
255 HG22 VAL 35 1HG2 VAL 35 2.332 1.292 -0.755
256 HG23 VAL 35 2HG2 VAL 35 3.659 2.044 0.131
257 H THR 36 H THR 36 3.163 6.466 0.372
258 HA THR 36 HA THR 36 5.239 5.984 2.347
259 HB THR 36 HB THR 36 3.979 7.928 3.521
260 HG1 THR 36 HG1 THR 36 2.731 9.016 1.715
261 HG21 THR 36 3HG2 THR 36 4.781 9.541 1.699
262 HG22 THR 36 1HG2 THR 36 5.233 8.105 0.778
263 HG23 THR 36 2HG2 THR 36 5.982 8.424 2.344
264 H ILE 37 H ILE 37 5.060 4.977 4.261
265 HA ILE 37 HA ILE 37 2.382 3.912 5.073
266 HB ILE 37 HB ILE 37 5.185 2.868 5.572
267 HG12 ILE 37 1HG1 ILE 37 2.866 1.552 4.148
268 HG13 ILE 37 2HG1 ILE 37 4.059 2.535 3.297
269 HG21 ILE 37 1HG2 ILE 37 2.491 2.049 6.667
270 HG22 ILE 37 2HG2 ILE 37 3.987 2.352 7.551
271 HG23 ILE 37 3HG2 ILE 37 3.827 0.903 6.559
272 HD11 ILE 37 3HD1 ILE 37 4.655 0.073 4.965
273 HD12 ILE 37 1HD1 ILE 37 5.858 1.062 4.137
274 HD13 ILE 37 2HD1 ILE 37 4.670 0.154 3.203
275 H VAL 38 H VAL 38 1.578 4.636 6.948
276 HA VAL 38 HA VAL 38 3.370 6.163 8.805
277 HB VAL 38 HB VAL 38 1.251 7.257 9.560
278 HG11 VAL 38 1HG1 VAL 38 0.911 8.568 7.443
279 HG12 VAL 38 2HG1 VAL 38 1.916 7.385 6.605
280 HG13 VAL 38 3HG1 VAL 38 2.607 8.378 7.889
281 HG21 VAL 38 3HG2 VAL 38 -0.272 5.397 8.881
282 HG22 VAL 38 1HG2 VAL 38 0.044 5.787 7.190
283 HG23 VAL 38 2HG2 VAL 38 -0.784 6.952 8.225
284 H GLY 39 H GLY 39 1.843 3.208 8.449
285 HA2 GLY 39 1HA GLY 39 2.343 2.455 11.167
286 HA3 GLY 39 2HA GLY 39 0.618 2.736 10.948
287 H GLU 40 H GLU 40 1.163 0.256 11.640
288 HA GLU 40 HA GLU 40 0.819 -1.324 9.129
289 HB2 GLU 40 1HB GLU 40 2.206 -3.135 10.149
290 HB3 GLU 40 2HB GLU 40 3.133 -1.677 9.808
291 HG2 GLU 40 1HG GLU 40 3.809 -2.275 11.990
292 HG3 GLU 40 2HG GLU 40 2.616 -1.009 12.258
293 H GLU 41 H GLU 41 -0.448 -3.252 9.429
294 HA GLU 41 HA GLU 41 -1.618 -3.762 12.074
295 HB2 GLU 41 1HB GLU 41 -2.951 -1.853 10.995
296 HB3 GLU 41 2HB GLU 41 -3.488 -3.040 9.806
297 HG2 GLU 41 1HG GLU 41 -3.796 -3.449 12.795
298 HG3 GLU 41 2HG GLU 41 -5.046 -2.724 11.788
299 H GLY 42 H GLY 42 -1.424 -5.904 12.164
300 HA2 GLY 42 1HA GLY 42 -1.541 -8.164 11.605
301 HA3 GLY 42 2HA GLY 42 -2.892 -7.708 10.571
302 H ALA 43 H ALA 43 -2.480 -8.833 8.737
303 HA ALA 43 HA ALA 43 0.245 -8.909 7.592
304 HB1 ALA 43 3HB ALA 43 -2.376 -10.170 6.727
305 HB2 ALA 43 1HB ALA 43 -1.051 -10.977 7.567
306 HB3 ALA 43 2HB ALA 43 -0.833 -10.416 5.909
307 H PHE 44 H PHE 44 -1.512 -6.425 7.724
308 HA PHE 44 HA PHE 44 -1.330 -5.742 4.817
309 HB2 PHE 44 1HB PHE 44 -3.572 -4.992 6.718
310 HB3 PHE 44 2HB PHE 44 -3.379 -4.365 5.081
311 HD1 PHE 44 HD2 PHE 44 -4.179 -7.336 7.108
312 HD2 PHE 44 HD1 PHE 44 -3.777 -5.770 3.130
313 HE1 PHE 44 HE2 PHE 44 -5.342 -9.331 6.204
314 HE2 PHE 44 HE1 PHE 44 -4.936 -7.765 2.225
315 HZ PHE 44 HZ PHE 44 -5.722 -9.545 3.762
316 H TYR 45 H TYR 45 -0.688 -3.618 4.393
317 HA TYR 45 HA TYR 45 0.436 -2.140 6.739
318 HB2 TYR 45 1HB TYR 45 1.221 -2.344 3.835
319 HB3 TYR 45 2HB TYR 45 1.712 -0.936 4.777
320 HD1 TYR 45 HD1 TYR 45 2.633 -1.571 7.227
321 HD2 TYR 45 HD2 TYR 45 2.724 -4.139 3.788
322 HE1 TYR 45 HE1 TYR 45 4.488 -2.858 8.240
323 HE2 TYR 45 HE2 TYR 45 4.584 -5.429 4.803
324 HH TYR 45 HH TYR 45 5.599 -4.886 8.110
325 H LYS 46 H LYS 46 0.059 0.066 6.951
326 HA LYS 46 HA LYS 46 -2.392 1.044 5.584
327 HB2 LYS 46 1HB LYS 46 -2.252 1.157 8.063
328 HB3 LYS 46 2HB LYS 46 -0.837 2.202 7.920
329 HG2 LYS 46 1HG LYS 46 -2.151 3.887 6.744
330 HG3 LYS 46 2HG LYS 46 -3.564 2.832 6.753
331 HD2 LYS 46 1HD LYS 46 -3.567 2.873 9.229
332 HD3 LYS 46 2HD LYS 46 -2.178 3.961 9.204
333 HE2 LYS 46 1HE LYS 46 -4.872 4.548 7.943
334 HE3 LYS 46 2HE LYS 46 -4.308 5.204 9.479
335 HZ1 LYS 46 3HZ LYS 46 -3.200 6.768 8.400
336 HZ2 LYS 46 1HZ LYS 46 -3.835 6.203 6.933
337 HZ3 LYS 46 2HZ LYS 46 -2.347 5.609 7.496
338 H ILE 47 H ILE 47 -2.201 2.448 3.923
339 HA ILE 47 HA ILE 47 0.236 4.176 3.763
340 HB ILE 47 HB ILE 47 0.071 3.858 1.246
341 HG12 ILE 47 1HG1 ILE 47 -1.520 1.405 2.044
342 HG13 ILE 47 2HG1 ILE 47 -2.254 2.859 1.367
343 HG21 ILE 47 1HG2 ILE 47 1.856 2.815 2.474
344 HG22 ILE 47 2HG2 ILE 47 1.213 1.606 1.364
345 HG23 ILE 47 3HG2 ILE 47 0.781 1.552 3.073
346 HD11 ILE 47 3HD1 ILE 47 -1.851 1.277 -0.439
347 HD12 ILE 47 1HD1 ILE 47 -0.163 1.105 0.044
348 HD13 ILE 47 2HD1 ILE 47 -0.739 2.635 -0.616
349 H GLU 48 H GLU 48 -0.059 6.157 2.647
350 HA GLU 48 HA GLU 48 -2.834 7.175 2.861
351 HB2 GLU 48 1HB GLU 48 -0.159 8.521 2.410
352 HB3 GLU 48 2HB GLU 48 -1.696 9.392 2.412
353 HG2 GLU 48 1HG GLU 48 -2.159 8.609 4.692
354 HG3 GLU 48 2HG GLU 48 -0.660 7.681 4.692
355 H TYR 49 H TYR 49 -4.033 6.716 1.084
356 HA TYR 49 HA TYR 49 -2.833 7.220 -1.621
357 HB2 TYR 49 1HB TYR 49 -3.578 4.897 -1.272
358 HB3 TYR 49 2HB TYR 49 -5.187 5.473 -0.838
359 HD1 TYR 49 HD1 TYR 49 -2.684 5.344 -3.588
360 HD2 TYR 49 HD2 TYR 49 -6.771 6.099 -2.507
361 HE1 TYR 49 HE1 TYR 49 -3.304 5.421 -5.988
362 HE2 TYR 49 HE2 TYR 49 -7.391 6.176 -4.906
363 HH TYR 49 HH TYR 49 -5.132 5.274 -7.418
364 H LYS 50 H LYS 50 -3.453 9.136 -2.384
365 HA LYS 50 HA LYS 50 -4.721 11.049 -2.803
366 HB2 LYS 50 1HB LYS 50 -6.995 9.046 -2.696
367 HB3 LYS 50 2HB LYS 50 -7.045 10.630 -3.466
368 HG2 LYS 50 1HG LYS 50 -4.981 8.572 -4.258
369 HG3 LYS 50 2HG LYS 50 -6.586 8.582 -4.984
370 HD2 LYS 50 1HD LYS 50 -6.222 10.965 -5.653
371 HD3 LYS 50 2HD LYS 50 -4.578 10.860 -5.031
372 HE2 LYS 50 1HE LYS 50 -4.485 10.451 -7.404
373 HE3 LYS 50 2HE LYS 50 -4.182 8.922 -6.578
374 HZ1 LYS 50 3HZ LYS 50 -6.118 8.055 -7.280
375 HZ2 LYS 50 1HZ LYS 50 -5.982 9.216 -8.509
376 HZ3 LYS 50 2HZ LYS 50 -6.962 9.524 -7.155
377 H GLY 51 H GLY 51 -4.211 10.376 0.012
378 HA2 GLY 51 1HA GLY 51 -4.735 11.613 1.973
379 HA3 GLY 51 2HA GLY 51 -6.185 12.219 1.176
380 H SER 52 H SER 52 -6.505 9.126 0.496
381 HA SER 52 HA SER 52 -8.251 8.629 2.828
382 HB2 SER 52 1HB SER 52 -9.175 8.208 0.612
383 HB3 SER 52 2HB SER 52 -7.850 7.108 0.236
384 HG SER 52 HG SER 52 -10.113 6.731 1.764
385 H HIS 53 H HIS 53 -8.271 6.296 3.662
386 HA HIS 53 HA HIS 53 -5.460 5.489 4.262
387 HB2 HIS 53 1HB HIS 53 -8.041 4.631 5.606
388 HB3 HIS 53 2HB HIS 53 -6.401 4.331 6.180
389 HD1 HIS 53 HD1 HIS 53 -4.954 6.687 6.532
390 HD2 HIS 53 HD2 HIS 53 -9.112 6.950 6.661
391 HE1 HIS 53 HE1 HIS 53 -5.497 8.867 7.702
392 H GLY 54 H GLY 54 -4.986 4.265 2.412
393 HA2 GLY 54 1HA GLY 54 -6.781 2.012 1.696
394 HA3 GLY 54 2HA GLY 54 -5.397 2.567 0.760
395 H TYR 55 H TYR 55 -6.282 -0.089 2.136
396 HA TYR 55 HA TYR 55 -3.699 -0.643 3.560
397 HB2 TYR 55 1HB TYR 55 -6.407 -1.988 3.766
398 HB3 TYR 55 2HB TYR 55 -4.943 -2.563 4.567
399 HD1 TYR 55 HD2 TYR 55 -7.416 0.187 4.396
400 HD2 TYR 55 HD1 TYR 55 -4.011 -1.410 6.470
401 HE1 TYR 55 HE2 TYR 55 -7.792 1.791 6.251
402 HE2 TYR 55 HE1 TYR 55 -4.386 0.194 8.323
403 HH TYR 55 HH TYR 55 -6.253 1.505 9.266
404 H VAL 56 H VAL 56 -2.411 -2.270 2.784
405 HA VAL 56 HA VAL 56 -3.461 -3.986 0.569
406 HB VAL 56 HB VAL 56 -1.078 -3.641 -0.455
407 HG11 VAL 56 1HG1 VAL 56 -2.985 -2.883 -1.665
408 HG12 VAL 56 2HG1 VAL 56 -1.916 -1.483 -1.563
409 HG13 VAL 56 3HG1 VAL 56 -3.315 -1.606 -0.496
410 HG21 VAL 56 3HG2 VAL 56 -1.370 -1.060 1.112
411 HG22 VAL 56 1HG2 VAL 56 -0.034 -1.520 0.058
412 HG23 VAL 56 2HG2 VAL 56 -0.287 -2.368 1.585
413 H ALA 57 H ALA 57 -2.276 -5.948 0.284
414 HA ALA 57 HA ALA 57 -1.463 -7.162 2.758
415 HB1 ALA 57 3HB ALA 57 -0.820 -8.372 0.077
416 HB2 ALA 57 1HB ALA 57 -2.501 -8.213 0.584
417 HB3 ALA 57 2HB ALA 57 -1.372 -9.161 1.552
418 H LYS 58 H LYS 58 0.590 -7.996 3.325
419 HA LYS 58 HA LYS 58 2.815 -6.263 2.847
420 HB2 LYS 58 1HB LYS 58 2.804 -9.119 3.864
421 HB3 LYS 58 2HB LYS 58 4.120 -7.961 4.059
422 HG2 LYS 58 1HG LYS 58 2.386 -6.449 5.217
423 HG3 LYS 58 2HG LYS 58 1.367 -7.876 5.284
424 HD2 LYS 58 1HD LYS 58 4.176 -7.734 6.402
425 HD3 LYS 58 2HD LYS 58 2.705 -7.575 7.362
426 HE2 LYS 58 1HE LYS 58 2.011 -9.847 6.386
427 HE3 LYS 58 2HE LYS 58 3.684 -9.995 5.845
428 HZ1 LYS 58 3HZ LYS 58 3.237 -9.223 8.624
429 HZ2 LYS 58 1HZ LYS 58 4.454 -10.195 7.950
430 HZ3 LYS 58 2HZ LYS 58 2.901 -10.835 8.204
431 H GLU 59 H GLU 59 1.881 -9.386 1.449
432 HA GLU 59 HA GLU 59 4.184 -10.067 0.029
433 HB2 GLU 59 1HB GLU 59 1.281 -10.311 -0.796
434 HB3 GLU 59 2HB GLU 59 2.610 -11.086 -1.660
435 HG2 GLU 59 1HG GLU 59 3.250 -12.305 0.368
436 HG3 GLU 59 2HG GLU 59 1.977 -11.492 1.278
437 H TYR 60 H TYR 60 2.479 -7.179 -0.281
438 HA TYR 60 HA TYR 60 3.382 -6.752 -3.102
439 HB2 TYR 60 1HB TYR 60 1.477 -5.156 -1.359
440 HB3 TYR 60 2HB TYR 60 1.877 -4.786 -3.035
441 HD1 TYR 60 HD1 TYR 60 1.684 -6.968 -4.648
442 HD2 TYR 60 HD2 TYR 60 -0.523 -6.329 -1.018
443 HE1 TYR 60 HE1 TYR 60 -0.049 -8.554 -5.425
444 HE2 TYR 60 HE2 TYR 60 -2.260 -7.920 -1.799
445 HH TYR 60 HH TYR 60 -2.723 -9.528 -3.332
446 H ILE 61 H ILE 61 3.883 -5.770 0.208
447 HA ILE 61 HA ILE 61 5.496 -3.424 -0.579
448 HB ILE 61 HB ILE 61 4.679 -4.614 2.078
449 HG12 ILE 61 1HG1 ILE 61 3.536 -2.482 2.341
450 HG13 ILE 61 2HG1 ILE 61 4.271 -1.862 0.865
451 HG21 ILE 61 1HG2 ILE 61 6.760 -2.503 1.480
452 HG22 ILE 61 2HG2 ILE 61 6.883 -3.889 2.564
453 HG23 ILE 61 3HG2 ILE 61 5.879 -2.510 3.009
454 HD11 ILE 61 3HD1 ILE 61 2.993 -3.295 -0.514
455 HD12 ILE 61 1HD1 ILE 61 1.851 -2.748 0.709
456 HD13 ILE 61 2HD1 ILE 61 2.564 -4.353 0.835
457 H LYS 62 H LYS 62 7.648 -3.482 -0.853
458 HA LYS 62 HA LYS 62 9.261 -5.576 0.487
459 HB2 LYS 62 1HB LYS 62 8.630 -6.543 -1.702
460 HB3 LYS 62 2HB LYS 62 9.308 -5.132 -2.513
461 HG2 LYS 62 1HG LYS 62 11.524 -5.633 -1.633
462 HG3 LYS 62 2HG LYS 62 10.879 -6.977 -0.689
463 HD2 LYS 62 1HD LYS 62 10.178 -8.096 -2.783
464 HD3 LYS 62 2HD LYS 62 10.863 -6.764 -3.713
465 HE2 LYS 62 1HE LYS 62 12.465 -8.451 -1.773
466 HE3 LYS 62 2HE LYS 62 12.389 -8.759 -3.508
467 HZ1 LYS 62 3HZ LYS 62 13.441 -6.347 -2.144
468 HZ2 LYS 62 1HZ LYS 62 13.142 -6.412 -3.813
469 HZ3 LYS 62 2HZ LYS 62 14.295 -7.447 -3.117
470 H ASP 63 H ASP 63 11.479 -5.036 0.617
471 HA ASP 63 HA ASP 63 13.252 -3.568 0.953
472 HB2 ASP 63 1HB ASP 63 12.121 -2.455 -1.627
473 HB3 ASP 63 2HB ASP 63 13.610 -1.866 -0.893
474 H ILE 64 H ILE 64 11.413 -3.015 2.720
475 HA ILE 64 HA ILE 64 10.265 -0.370 2.554
476 HB ILE 64 HB ILE 64 10.800 -2.186 4.922
477 HG12 ILE 64 1HG1 ILE 64 8.199 -1.498 3.530
478 HG13 ILE 64 2HG1 ILE 64 9.169 -2.908 3.105
479 HG21 ILE 64 1HG2 ILE 64 9.017 -0.660 5.984
480 HG22 ILE 64 2HG2 ILE 64 9.392 0.481 4.694
481 HG23 ILE 64 3HG2 ILE 64 10.644 0.002 5.840
482 HD11 ILE 64 3HD1 ILE 64 8.283 -2.386 5.946
483 HD12 ILE 64 1HD1 ILE 64 8.865 -3.896 5.244
484 HD13 ILE 64 2HD1 ILE 64 7.274 -3.275 4.805
485 H LYS 65 H LYS 65 11.179 1.555 3.023
486 HA LYS 65 HA LYS 65 13.814 1.600 4.454
487 HB2 LYS 65 1HB LYS 65 13.019 3.101 1.941
488 HB3 LYS 65 2HB LYS 65 14.472 3.445 2.883
489 HG2 LYS 65 1HG LYS 65 15.255 1.134 2.537
490 HG3 LYS 65 2HG LYS 65 13.798 0.776 1.607
491 HD2 LYS 65 1HD LYS 65 14.423 2.553 -0.014
492 HD3 LYS 65 2HD LYS 65 15.910 2.833 0.893
493 HE2 LYS 65 1HE LYS 65 15.139 0.157 -0.307
494 HE3 LYS 65 2HE LYS 65 16.212 1.318 -1.091
495 HZ1 LYS 65 3HZ LYS 65 17.313 1.165 1.328
496 HZ2 LYS 65 1HZ LYS 65 17.781 0.186 0.023
497 HZ3 LYS 65 2HZ LYS 65 16.696 -0.412 1.187
498 H ASP 66 H ASP 66 14.026 3.236 5.931
499 HA ASP 66 HA ASP 66 11.589 4.816 6.502
500 HB2 ASP 66 1HB ASP 66 12.723 5.330 8.643
501 HB3 ASP 66 2HB ASP 66 12.579 3.597 8.359
502 H GLU 67 H GLU 67 11.426 6.768 5.642
503 HA GLU 67 HA GLU 67 11.973 8.856 4.774
504 HB2 GLU 67 1HB GLU 67 12.608 9.187 7.159
505 HB3 GLU 67 2HB GLU 67 14.250 8.674 6.770
506 HG2 GLU 67 1HG GLU 67 12.939 10.926 5.238
507 HG3 GLU 67 2HG GLU 67 13.721 11.229 6.786
508 H VAL 68 H VAL 68 12.547 8.364 2.676
509 HA VAL 68 HA VAL 68 15.275 7.436 2.070
510 HB VAL 68 HB VAL 68 13.096 8.241 0.129
511 HG11 VAL 68 1HG1 VAL 68 15.586 6.523 -0.049
512 HG12 VAL 68 2HG1 VAL 68 15.236 8.003 -0.943
513 HG13 VAL 68 3HG1 VAL 68 14.327 6.531 -1.283
514 HG21 VAL 68 3HG2 VAL 68 12.615 5.756 0.089
515 HG22 VAL 68 1HG2 VAL 68 12.145 6.564 1.585
516 HG23 VAL 68 2HG2 VAL 68 13.623 5.602 1.528
517 H LEU 69 H LEU 69 16.767 8.999 2.314
518 HA LEU 69 HA LEU 69 17.946 10.980 2.021
519 HB2 LEU 69 1HB LEU 69 16.388 10.692 -0.538
520 HB3 LEU 69 2HB LEU 69 17.351 12.146 -0.269
521 HG LEU 69 HG LEU 69 19.353 10.790 0.114
522 HD11 LEU 69 1HD1 LEU 69 19.166 8.300 -0.402
523 HD12 LEU 69 2HD1 LEU 69 17.419 8.495 -0.269
524 HD13 LEU 69 3HD1 LEU 69 18.451 8.816 1.124
525 HD21 LEU 69 3HD2 LEU 69 19.487 9.715 -2.186
526 HD22 LEU 69 1HD2 LEU 69 18.995 11.408 -2.181
527 HD23 LEU 69 2HD2 LEU 69 17.789 10.140 -2.398
528 H GLU 70 H GLU 70 17.843 13.206 2.374
529 HA GLU 70 HA GLU 70 15.258 14.585 2.352
530 HB2 GLU 70 1HB GLU 70 15.345 13.295 4.543
531 HB3 GLU 70 2HB GLU 70 16.730 14.292 4.987
532 HG2 GLU 70 1HG GLU 70 14.086 15.496 4.131
533 HG3 GLU 70 2HG GLU 70 14.443 15.104 5.811
534 H HIS 71 H HIS 71 15.828 16.449 1.417
535 HA HIS 71 HA HIS 71 18.535 17.503 1.582
536 HB2 HIS 71 1HB HIS 71 17.409 19.454 0.308
537 HB3 HIS 71 2HB HIS 71 17.454 17.882 -0.486
538 HD1 HIS 71 HD1 HIS 71 15.090 20.144 1.425
539 HD2 HIS 71 HD2 HIS 71 14.939 16.741 -0.977
540 HE1 HIS 71 HE1 HIS 71 12.640 19.715 0.940
541 H HIS 72 H HIS 72 19.255 18.697 3.246
542 HA HIS 72 HA HIS 72 17.306 20.121 4.998
543 HB2 HIS 72 1HB HIS 72 19.047 20.121 6.662
544 HB3 HIS 72 2HB HIS 72 18.997 18.501 5.971
545 HD1 HIS 72 HD1 HIS 72 21.074 21.646 5.999
546 HD2 HIS 72 HD2 HIS 72 21.297 17.770 4.477
547 HE1 HIS 72 HE1 HIS 72 23.449 21.334 5.174
548 H HIS 73 H HIS 73 19.441 20.672 2.447
549 HA HIS 73 HA HIS 73 20.518 23.241 3.146
550 HB2 HIS 73 1HB HIS 73 19.906 21.991 0.451
551 HB3 HIS 73 2HB HIS 73 20.805 23.492 0.662
552 HD1 HIS 73 HD1 HIS 73 23.094 23.280 2.072
553 HD2 HIS 73 HD2 HIS 73 21.430 19.681 0.784
554 HE1 HIS 73 HE1 HIS 73 24.919 21.535 2.271
555 H HIS 74 H HIS 74 17.495 22.211 1.623
556 HA HIS 74 HA HIS 74 16.557 24.756 0.768
557 HB2 HIS 74 1HB HIS 74 15.497 22.582 0.164
558 HB3 HIS 74 2HB HIS 74 14.920 22.426 1.823
559 HD1 HIS 74 HD1 HIS 74 14.815 25.202 -0.805
560 HD2 HIS 74 HD2 HIS 74 12.331 23.348 1.982
561 HE1 HIS 74 HE1 HIS 74 12.564 26.347 -0.980
562 H HIS 75 H HIS 75 16.156 23.066 3.887
563 HA HIS 75 HA HIS 75 15.682 25.699 5.176
564 HB2 HIS 75 1HB HIS 75 13.783 23.342 5.289
565 HB3 HIS 75 2HB HIS 75 13.778 24.627 6.497
566 HD1 HIS 75 HD1 HIS 75 11.691 23.857 3.974
567 HD2 HIS 75 HD2 HIS 75 14.080 27.235 4.493
568 HE1 HIS 75 HE1 HIS 75 10.649 25.695 2.578
569 H HIS 76 H HIS 76 16.434 25.790 7.271
570 HA HIS 76 HA HIS 76 18.192 23.596 8.111
571 HB2 HIS 76 1HB HIS 76 18.886 25.153 9.885
572 HB3 HIS 76 2HB HIS 76 18.917 25.951 8.315
573 HD1 HIS 76 HD1 HIS 76 16.757 27.498 7.766
574 HD2 HIS 76 HD2 HIS 76 17.243 26.395 11.758
575 HE1 HIS 76 HE1 HIS 76 15.309 29.070 9.128
Start of MODEL 7
1 H1 ALA 1 1H ALA 1 10.502 8.959 11.937
2 H2 ALA 1 2H ALA 1 10.576 8.202 13.457
3 H3 ALA 1 3H ALA 1 9.073 8.622 12.786
4 HA ALA 1 HA ALA 1 10.873 6.405 12.081
5 HB1 ALA 1 3HB ALA 1 7.900 6.793 12.513
6 HB2 ALA 1 1HB ALA 1 9.015 5.850 13.501
7 HB3 ALA 1 2HB ALA 1 8.585 5.296 11.882
8 H GLU 2 H GLU 2 7.768 7.063 10.638
9 HA GLU 2 HA GLU 2 7.105 7.297 8.417
10 HB2 GLU 2 1HB GLU 2 8.243 9.492 8.677
11 HB3 GLU 2 2HB GLU 2 9.750 8.757 8.131
12 HG2 GLU 2 1HG GLU 2 8.739 8.183 5.983
13 HG3 GLU 2 2HG GLU 2 7.182 8.812 6.523
14 H LYS 3 H LYS 3 7.065 5.649 7.009
15 HA LYS 3 HA LYS 3 9.645 4.507 6.014
16 HB2 LYS 3 1HB LYS 3 7.262 2.972 7.089
17 HB3 LYS 3 2HB LYS 3 8.575 2.234 6.169
18 HG2 LYS 3 1HG LYS 3 10.199 3.024 7.849
19 HG3 LYS 3 2HG LYS 3 8.886 3.756 8.773
20 HD2 LYS 3 1HD LYS 3 7.848 1.556 9.085
21 HD3 LYS 3 2HD LYS 3 9.119 0.807 8.118
22 HE2 LYS 3 1HE LYS 3 9.602 0.547 10.512
23 HE3 LYS 3 2HE LYS 3 10.808 1.582 9.749
24 HZ1 LYS 3 3HZ LYS 3 9.989 3.445 10.754
25 HZ2 LYS 3 1HZ LYS 3 9.656 2.297 11.958
26 HZ3 LYS 3 2HZ LYS 3 8.418 2.817 10.917
27 H THR 4 H THR 4 9.427 3.480 3.912
28 HA THR 4 HA THR 4 6.910 4.214 2.446
29 HB THR 4 HB THR 4 8.161 5.002 0.608
30 HG1 THR 4 HG1 THR 4 9.726 3.174 0.959
31 HG21 THR 4 3HG2 THR 4 9.693 5.838 3.090
32 HG22 THR 4 1HG2 THR 4 8.181 6.553 2.536
33 HG23 THR 4 2HG2 THR 4 9.642 6.719 1.563
34 H GLY 5 H GLY 5 5.986 2.505 1.488
35 HA2 GLY 5 1HA GLY 5 7.477 -0.054 1.325
36 HA3 GLY 5 2HA GLY 5 5.735 0.140 1.162
37 H ILE 6 H ILE 6 8.215 -0.861 -0.593
38 HA ILE 6 HA ILE 6 7.614 0.690 -3.056
39 HB ILE 6 HB ILE 6 9.668 -1.424 -2.366
40 HG12 ILE 6 1HG1 ILE 6 11.237 0.413 -2.848
41 HG13 ILE 6 2HG1 ILE 6 9.889 1.468 -3.268
42 HG21 ILE 6 1HG2 ILE 6 10.525 -0.848 -4.744
43 HG22 ILE 6 2HG2 ILE 6 8.889 -0.259 -5.044
44 HG23 ILE 6 3HG2 ILE 6 9.154 -1.950 -4.620
45 HD11 ILE 6 3HD1 ILE 6 10.918 1.600 -0.861
46 HD12 ILE 6 1HD1 ILE 6 9.959 0.155 -0.560
47 HD13 ILE 6 2HD1 ILE 6 9.169 1.651 -1.052
48 H VAL 7 H VAL 7 6.013 -0.000 -4.363
49 HA VAL 7 HA VAL 7 4.782 -2.615 -4.011
50 HB VAL 7 HB VAL 7 4.384 -0.432 -6.074
51 HG11 VAL 7 1HG1 VAL 7 2.962 -3.062 -5.614
52 HG12 VAL 7 2HG1 VAL 7 3.642 -2.439 -7.118
53 HG13 VAL 7 3HG1 VAL 7 2.187 -1.709 -6.439
54 HG21 VAL 7 3HG2 VAL 7 2.859 -1.277 -3.594
55 HG22 VAL 7 1HG2 VAL 7 2.273 -0.093 -4.762
56 HG23 VAL 7 2HG2 VAL 7 3.734 0.236 -3.829
57 H ASN 8 H ASN 8 5.224 -4.458 -5.168
58 HA ASN 8 HA ASN 8 6.878 -4.222 -7.656
59 HB2 ASN 8 1HB ASN 8 8.338 -4.816 -5.723
60 HB3 ASN 8 2HB ASN 8 7.330 -6.233 -5.429
61 HD21 ASN 8 2HD2 ASN 8 8.902 -7.836 -6.002
62 HD22 ASN 8 1HD2 ASN 8 9.521 -7.993 -7.575
63 H VAL 9 H VAL 9 4.864 -4.605 -8.783
64 HA VAL 9 HA VAL 9 4.004 -7.476 -8.691
65 HB VAL 9 HB VAL 9 1.688 -6.693 -9.217
66 HG11 VAL 9 1HG1 VAL 9 2.612 -7.132 -6.846
67 HG12 VAL 9 2HG1 VAL 9 1.114 -6.212 -6.967
68 HG13 VAL 9 3HG1 VAL 9 2.640 -5.379 -6.667
69 HG21 VAL 9 3HG2 VAL 9 1.233 -4.247 -8.662
70 HG22 VAL 9 1HG2 VAL 9 2.096 -4.528 -10.173
71 HG23 VAL 9 2HG2 VAL 9 2.973 -3.992 -8.741
72 H SER 10 H SER 10 3.995 -8.443 -10.649
73 HA SER 10 HA SER 10 5.126 -7.180 -12.942
74 HB2 SER 10 1HB SER 10 3.411 -9.673 -12.794
75 HB3 SER 10 2HB SER 10 4.471 -9.230 -14.129
76 HG SER 10 HG SER 10 6.111 -9.929 -13.013
77 H SER 11 H SER 11 1.745 -7.878 -12.066
78 HA SER 11 HA SER 11 0.785 -6.569 -14.547
79 HB2 SER 11 1HB SER 11 -1.450 -7.250 -13.724
80 HB3 SER 11 2HB SER 11 -0.341 -8.617 -13.781
81 HG SER 11 HG SER 11 0.034 -8.284 -11.547
82 H SER 12 H SER 12 -0.646 -6.278 -11.323
83 HA SER 12 HA SER 12 0.123 -3.502 -10.992
84 HB2 SER 12 1HB SER 12 -1.585 -3.243 -12.769
85 HB3 SER 12 2HB SER 12 -2.749 -4.103 -11.766
86 HG SER 12 HG SER 12 -1.363 -1.807 -10.860
87 H LEU 13 H LEU 13 -1.082 -2.555 -9.055
88 HA LEU 13 HA LEU 13 -1.914 -4.753 -7.184
89 HB2 LEU 13 1HB LEU 13 0.265 -3.827 -6.543
90 HB3 LEU 13 2HB LEU 13 -0.404 -2.196 -6.563
91 HG LEU 13 HG LEU 13 -1.943 -2.769 -4.738
92 HD11 LEU 13 1HD1 LEU 13 -1.384 -5.086 -3.595
93 HD12 LEU 13 2HD1 LEU 13 -0.848 -5.532 -5.215
94 HD13 LEU 13 3HD1 LEU 13 -2.514 -5.020 -4.946
95 HD21 LEU 13 3HD2 LEU 13 0.965 -3.478 -4.286
96 HD22 LEU 13 1HD2 LEU 13 -0.192 -3.291 -2.969
97 HD23 LEU 13 2HD2 LEU 13 0.179 -1.922 -4.019
98 H ASN 14 H ASN 14 -3.857 -4.515 -6.238
99 HA ASN 14 HA ASN 14 -5.451 -2.109 -6.878
100 HB2 ASN 14 1HB ASN 14 -6.113 -4.800 -5.672
101 HB3 ASN 14 2HB ASN 14 -7.292 -3.492 -5.799
102 HD21 ASN 14 2HD2 ASN 14 -7.634 -5.946 -7.243
103 HD22 ASN 14 1HD2 ASN 14 -7.474 -5.616 -8.900
104 H VAL 15 H VAL 15 -6.528 -0.887 -5.226
105 HA VAL 15 HA VAL 15 -5.104 -0.922 -2.595
106 HB VAL 15 HB VAL 15 -6.688 1.204 -4.058
107 HG11 VAL 15 1HG1 VAL 15 -7.282 1.542 -1.782
108 HG12 VAL 15 2HG1 VAL 15 -5.924 2.635 -2.052
109 HG13 VAL 15 3HG1 VAL 15 -5.672 1.103 -1.213
110 HG21 VAL 15 3HG2 VAL 15 -3.812 1.049 -3.110
111 HG22 VAL 15 1HG2 VAL 15 -4.534 2.392 -3.997
112 HG23 VAL 15 2HG2 VAL 15 -4.350 0.819 -4.774
113 H ARG 16 H ARG 16 -6.220 -1.516 -0.797
114 HA ARG 16 HA ARG 16 -9.176 -1.943 -1.060
115 HB2 ARG 16 1HB ARG 16 -7.084 -3.274 0.672
116 HB3 ARG 16 2HB ARG 16 -8.818 -3.535 0.856
117 HG2 ARG 16 1HG ARG 16 -8.949 -4.274 -1.505
118 HG3 ARG 16 2HG ARG 16 -7.206 -4.048 -1.660
119 HD2 ARG 16 1HD ARG 16 -8.510 -5.908 0.345
120 HD3 ARG 16 2HD ARG 16 -7.860 -6.425 -1.211
121 HE ARG 16 HE ARG 16 -6.296 -5.660 1.151
122 HH11 ARG 16 1HH2 ARG 16 -6.420 -6.111 -2.270
123 HH12 ARG 16 2HH2 ARG 16 -4.713 -6.363 -2.428
124 HH21 ARG 16 1HH1 ARG 16 -4.075 -5.991 0.958
125 HH22 ARG 16 2HH1 ARG 16 -3.387 -6.295 -0.602
126 H GLU 17 H GLU 17 -10.512 -0.887 0.287
127 HA GLU 17 HA GLU 17 -9.536 1.280 1.927
128 HB2 GLU 17 1HB GLU 17 -11.729 1.313 0.764
129 HB3 GLU 17 2HB GLU 17 -12.283 -0.002 1.798
130 HG2 GLU 17 1HG GLU 17 -12.005 1.398 3.784
131 HG3 GLU 17 2HG GLU 17 -11.368 2.711 2.795
132 H GLY 18 H GLY 18 -10.710 -2.000 2.568
133 HA2 GLY 18 1HA GLY 18 -10.341 -1.595 5.498
134 HA3 GLY 18 2HA GLY 18 -11.172 -2.952 4.742
135 H ALA 19 H ALA 19 -9.570 -3.920 6.470
136 HA ALA 19 HA ALA 19 -6.915 -4.481 5.190
137 HB1 ALA 19 3HB ALA 19 -7.796 -4.946 8.058
138 HB2 ALA 19 1HB ALA 19 -6.936 -3.507 7.513
139 HB3 ALA 19 2HB ALA 19 -6.157 -5.087 7.420
140 H SER 20 H SER 20 -9.656 -5.710 4.649
141 HA SER 20 HA SER 20 -9.420 -8.441 5.696
142 HB2 SER 20 1HB SER 20 -11.528 -8.814 4.775
143 HB3 SER 20 2HB SER 20 -11.590 -7.077 5.065
144 HG SER 20 HG SER 20 -10.777 -8.301 2.633
145 H THR 21 H THR 21 -9.622 -10.270 4.007
146 HA THR 21 HA THR 21 -7.288 -10.304 2.357
147 HB THR 21 HB THR 21 -9.718 -12.077 2.032
148 HG1 THR 21 HG1 THR 21 -9.345 -12.498 4.057
149 HG21 THR 21 3HG2 THR 21 -6.749 -12.495 1.596
150 HG22 THR 21 1HG2 THR 21 -7.978 -12.356 0.339
151 HG23 THR 21 2HG2 THR 21 -7.981 -13.745 1.425
152 H SER 22 H SER 22 -10.733 -9.835 1.577
153 HA SER 22 HA SER 22 -9.896 -8.595 -1.014
154 HB2 SER 22 1HB SER 22 -11.888 -9.728 -2.068
155 HB3 SER 22 2HB SER 22 -10.596 -10.832 -1.603
156 HG SER 22 HG SER 22 -13.128 -10.434 -0.487
157 H SER 23 H SER 23 -10.294 -6.804 0.720
158 HA SER 23 HA SER 23 -13.072 -6.212 1.349
159 HB2 SER 23 1HB SER 23 -10.434 -4.899 1.813
160 HB3 SER 23 2HB SER 23 -11.859 -3.868 1.880
161 HG SER 23 HG SER 23 -12.482 -6.034 3.194
162 H LYS 24 H LYS 24 -13.649 -3.728 0.827
163 HA LYS 24 HA LYS 24 -14.300 -3.648 -1.946
164 HB2 LYS 24 1HB LYS 24 -14.306 -1.511 0.197
165 HB3 LYS 24 2HB LYS 24 -14.961 -1.271 -1.424
166 HG2 LYS 24 1HG LYS 24 -16.532 -3.113 -1.103
167 HG3 LYS 24 2HG LYS 24 -15.826 -3.472 0.469
168 HD2 LYS 24 1HD LYS 24 -17.759 -2.201 0.974
169 HD3 LYS 24 2HD LYS 24 -16.427 -1.056 1.114
170 HE2 LYS 24 1HE LYS 24 -16.913 -0.097 -1.036
171 HE3 LYS 24 2HE LYS 24 -18.048 -1.389 -1.427
172 HZ1 LYS 24 3HZ LYS 24 -18.349 0.784 0.553
173 HZ2 LYS 24 1HZ LYS 24 -19.305 -0.614 0.616
174 HZ3 LYS 24 2HZ LYS 24 -19.365 0.393 -0.752
175 H VAL 25 H VAL 25 -13.341 -2.637 -3.666
176 HA VAL 25 HA VAL 25 -10.597 -1.557 -3.244
177 HB VAL 25 HB VAL 25 -12.101 -2.481 -5.709
178 HG11 VAL 25 1HG1 VAL 25 -9.784 -2.195 -6.779
179 HG12 VAL 25 2HG1 VAL 25 -9.390 -1.181 -5.391
180 HG13 VAL 25 3HG1 VAL 25 -10.698 -0.719 -6.479
181 HG21 VAL 25 3HG2 VAL 25 -11.162 -4.160 -4.016
182 HG22 VAL 25 1HG2 VAL 25 -9.564 -3.575 -4.481
183 HG23 VAL 25 2HG2 VAL 25 -10.607 -4.341 -5.679
184 H ILE 26 H ILE 26 -10.319 0.609 -3.281
185 HA ILE 26 HA ILE 26 -12.496 2.334 -4.389
186 HB ILE 26 HB ILE 26 -11.457 4.116 -3.002
187 HG12 ILE 26 1HG1 ILE 26 -9.676 1.885 -1.965
188 HG13 ILE 26 2HG1 ILE 26 -9.131 3.146 -3.070
189 HG21 ILE 26 1HG2 ILE 26 -12.087 1.529 -1.547
190 HG22 ILE 26 2HG2 ILE 26 -13.257 2.747 -2.056
191 HG23 ILE 26 3HG2 ILE 26 -12.077 3.127 -0.802
192 HD11 ILE 26 3HD1 ILE 26 -10.280 3.604 -0.303
193 HD12 ILE 26 1HD1 ILE 26 -9.754 4.868 -1.414
194 HD13 ILE 26 2HD1 ILE 26 -8.578 3.737 -0.745
195 H GLY 27 H GLY 27 -9.523 1.066 -5.245
196 HA2 GLY 27 1HA GLY 27 -9.274 2.558 -7.612
197 HA3 GLY 27 2HA GLY 27 -8.270 3.371 -6.414
198 H SER 28 H SER 28 -6.570 2.674 -8.063
199 HA SER 28 HA SER 28 -5.306 0.203 -7.081
200 HB2 SER 28 1HB SER 28 -6.669 -0.655 -8.930
201 HB3 SER 28 2HB SER 28 -6.029 0.585 -10.004
202 HG SER 28 HG SER 28 -4.175 -0.978 -8.650
203 H LEU 29 H LEU 29 -3.038 0.118 -7.643
204 HA LEU 29 HA LEU 29 -1.933 2.703 -8.703
205 HB2 LEU 29 1HB LEU 29 -0.813 0.950 -6.497
206 HB3 LEU 29 2HB LEU 29 -0.079 2.432 -7.110
207 HG LEU 29 HG LEU 29 -2.818 2.247 -5.821
208 HD11 LEU 29 1HD1 LEU 29 -1.836 3.215 -3.870
209 HD12 LEU 29 2HD1 LEU 29 -0.319 3.542 -4.711
210 HD13 LEU 29 3HD1 LEU 29 -0.777 1.882 -4.331
211 HD21 LEU 29 3HD2 LEU 29 -1.230 4.493 -7.063
212 HD22 LEU 29 1HD2 LEU 29 -2.338 4.841 -5.736
213 HD23 LEU 29 2HD2 LEU 29 -2.949 4.127 -7.222
214 H SER 30 H SER 30 -0.013 2.541 -9.908
215 HA SER 30 HA SER 30 0.222 0.070 -11.426
216 HB2 SER 30 1HB SER 30 0.464 2.174 -12.584
217 HB3 SER 30 2HB SER 30 1.751 2.678 -11.494
218 HG SER 30 HG SER 30 2.802 1.870 -13.215
219 H GLY 31 H GLY 31 2.420 -0.893 -11.828
220 HA2 GLY 31 1HA GLY 31 3.565 -1.827 -9.387
221 HA3 GLY 31 2HA GLY 31 4.237 -2.101 -10.991
222 H ASN 32 H ASN 32 5.783 -1.593 -8.671
223 HA ASN 32 HA ASN 32 7.580 -0.298 -7.936
224 HB2 ASN 32 1HB ASN 32 7.406 0.970 -10.687
225 HB3 ASN 32 2HB ASN 32 8.811 0.934 -9.622
226 HD21 ASN 32 2HD2 ASN 32 8.027 -0.397 -12.406
227 HD22 ASN 32 1HD2 ASN 32 8.582 -1.990 -12.205
228 H THR 33 H THR 33 4.855 0.659 -7.456
229 HA THR 33 HA THR 33 5.122 3.611 -7.666
230 HB THR 33 HB THR 33 2.860 1.809 -6.761
231 HG1 THR 33 HG1 THR 33 1.913 2.724 -8.639
232 HG21 THR 33 3HG2 THR 33 2.590 3.734 -5.415
233 HG22 THR 33 1HG2 THR 33 1.587 4.062 -6.827
234 HG23 THR 33 2HG2 THR 33 3.175 4.812 -6.683
235 H LYS 34 H LYS 34 5.803 4.813 -5.980
236 HA LYS 34 HA LYS 34 6.545 3.496 -3.470
237 HB2 LYS 34 1HB LYS 34 7.990 5.211 -4.535
238 HB3 LYS 34 2HB LYS 34 6.719 6.409 -4.298
239 HG2 LYS 34 1HG LYS 34 6.852 6.125 -1.876
240 HG3 LYS 34 2HG LYS 34 8.048 4.842 -2.066
241 HD2 LYS 34 1HD LYS 34 9.586 6.452 -3.155
242 HD3 LYS 34 2HD LYS 34 8.397 7.733 -2.919
243 HE2 LYS 34 1HE LYS 34 9.717 6.117 -0.719
244 HE3 LYS 34 2HE LYS 34 10.091 7.788 -1.135
245 HZ1 LYS 34 3HZ LYS 34 7.604 6.701 0.032
246 HZ2 LYS 34 1HZ LYS 34 7.629 8.210 -0.742
247 HZ3 LYS 34 2HZ LYS 34 8.598 7.943 0.627
248 H VAL 35 H VAL 35 5.382 3.574 -1.582
249 HA VAL 35 HA VAL 35 3.082 5.500 -1.417
250 HB VAL 35 HB VAL 35 1.948 3.625 -0.068
251 HG11 VAL 35 1HG1 VAL 35 1.311 4.328 -2.380
252 HG12 VAL 35 2HG1 VAL 35 1.052 2.606 -2.103
253 HG13 VAL 35 3HG1 VAL 35 2.456 3.149 -3.021
254 HG21 VAL 35 3HG2 VAL 35 3.856 1.878 -1.641
255 HG22 VAL 35 1HG2 VAL 35 2.708 1.383 -0.396
256 HG23 VAL 35 2HG2 VAL 35 4.148 2.302 0.046
257 H THR 36 H THR 36 2.970 6.630 0.447
258 HA THR 36 HA THR 36 5.170 6.407 2.341
259 HB THR 36 HB THR 36 2.674 8.117 2.501
260 HG1 THR 36 HG1 THR 36 3.718 8.574 0.603
261 HG21 THR 36 3HG2 THR 36 4.069 9.554 3.914
262 HG22 THR 36 1HG2 THR 36 5.428 8.448 3.720
263 HG23 THR 36 2HG2 THR 36 3.988 7.929 4.594
264 H ILE 37 H ILE 37 5.150 5.278 4.224
265 HA ILE 37 HA ILE 37 2.561 4.077 5.128
266 HB ILE 37 HB ILE 37 5.434 3.271 5.655
267 HG12 ILE 37 1HG1 ILE 37 3.244 1.790 4.182
268 HG13 ILE 37 2HG1 ILE 37 4.418 2.823 3.365
269 HG21 ILE 37 1HG2 ILE 37 4.233 1.211 6.639
270 HG22 ILE 37 2HG2 ILE 37 2.798 2.233 6.703
271 HG23 ILE 37 3HG2 ILE 37 4.241 2.678 7.618
272 HD11 ILE 37 3HD1 ILE 37 6.248 1.447 4.071
273 HD12 ILE 37 1HD1 ILE 37 5.013 0.349 3.455
274 HD13 ILE 37 2HD1 ILE 37 5.225 0.552 5.194
275 H VAL 38 H VAL 38 1.696 4.845 6.945
276 HA VAL 38 HA VAL 38 3.425 6.340 8.892
277 HB VAL 38 HB VAL 38 1.330 7.600 9.455
278 HG11 VAL 38 1HG1 VAL 38 1.303 8.939 7.343
279 HG12 VAL 38 2HG1 VAL 38 2.235 7.664 6.561
280 HG13 VAL 38 3HG1 VAL 38 2.939 8.576 7.897
281 HG21 VAL 38 3HG2 VAL 38 0.262 6.144 7.013
282 HG22 VAL 38 1HG2 VAL 38 -0.567 7.443 7.871
283 HG23 VAL 38 2HG2 VAL 38 -0.282 5.896 8.672
284 H GLY 39 H GLY 39 2.101 3.445 8.447
285 HA2 GLY 39 1HA GLY 39 1.995 2.808 11.246
286 HA3 GLY 39 2HA GLY 39 0.362 2.911 10.584
287 H GLU 40 H GLU 40 0.999 0.462 11.479
288 HA GLU 40 HA GLU 40 1.452 -1.105 8.971
289 HB2 GLU 40 1HB GLU 40 2.788 -2.740 10.229
290 HB3 GLU 40 2HB GLU 40 3.541 -1.148 10.293
291 HG2 GLU 40 1HG GLU 40 2.526 -0.767 12.520
292 HG3 GLU 40 2HG GLU 40 1.809 -2.379 12.461
293 H GLU 41 H GLU 41 0.442 -3.197 8.986
294 HA GLU 41 HA GLU 41 -1.555 -3.669 11.147
295 HB2 GLU 41 1HB GLU 41 -2.128 -3.466 8.183
296 HB3 GLU 41 2HB GLU 41 -3.236 -4.219 9.329
297 HG2 GLU 41 1HG GLU 41 -2.201 -1.377 9.550
298 HG3 GLU 41 2HG GLU 41 -3.764 -1.821 8.865
299 H GLY 42 H GLY 42 -2.262 -5.859 11.281
300 HA2 GLY 42 1HA GLY 42 -0.214 -7.779 10.773
301 HA3 GLY 42 2HA GLY 42 -1.853 -8.161 11.296
302 H ALA 43 H ALA 43 0.332 -8.327 8.719
303 HA ALA 43 HA ALA 43 0.124 -9.477 6.686
304 HB1 ALA 43 3HB ALA 43 -1.999 -10.486 7.984
305 HB2 ALA 43 1HB ALA 43 -1.746 -10.775 6.264
306 HB3 ALA 43 2HB ALA 43 -2.873 -9.527 6.792
307 H PHE 44 H PHE 44 -0.815 -6.490 7.506
308 HA PHE 44 HA PHE 44 -1.055 -5.663 4.680
309 HB2 PHE 44 1HB PHE 44 -3.127 -5.023 6.791
310 HB3 PHE 44 2HB PHE 44 -3.011 -4.191 5.242
311 HD1 PHE 44 HD2 PHE 44 -3.771 -7.370 6.926
312 HD2 PHE 44 HD1 PHE 44 -3.603 -5.312 3.164
313 HE1 PHE 44 HE2 PHE 44 -5.084 -9.191 5.873
314 HE2 PHE 44 HE1 PHE 44 -4.911 -7.133 2.106
315 HZ PHE 44 HZ PHE 44 -5.653 -9.071 3.462
316 H TYR 45 H TYR 45 -0.710 -3.338 4.422
317 HA TYR 45 HA TYR 45 0.775 -2.129 6.730
318 HB2 TYR 45 1HB TYR 45 1.324 -2.069 3.760
319 HB3 TYR 45 2HB TYR 45 1.995 -0.852 4.846
320 HD1 TYR 45 HD2 TYR 45 3.049 -1.890 7.097
321 HD2 TYR 45 HD1 TYR 45 2.648 -3.954 3.351
322 HE1 TYR 45 HE2 TYR 45 4.848 -3.452 7.767
323 HE2 TYR 45 HE1 TYR 45 4.453 -5.517 4.022
324 HH TYR 45 HH TYR 45 6.194 -5.776 5.511
325 H LYS 46 H LYS 46 0.446 0.069 7.118
326 HA LYS 46 HA LYS 46 -2.092 1.130 6.022
327 HB2 LYS 46 1HB LYS 46 -1.312 1.112 8.533
328 HB3 LYS 46 2HB LYS 46 -0.375 2.530 8.074
329 HG2 LYS 46 1HG LYS 46 -3.368 2.214 7.669
330 HG3 LYS 46 2HG LYS 46 -2.611 3.139 8.967
331 HD2 LYS 46 1HD LYS 46 -1.370 4.385 7.027
332 HD3 LYS 46 2HD LYS 46 -2.645 3.715 6.008
333 HE2 LYS 46 1HE LYS 46 -2.872 5.695 8.258
334 HE3 LYS 46 2HE LYS 46 -3.575 5.762 6.641
335 HZ1 LYS 46 3HZ LYS 46 -4.723 3.567 7.552
336 HZ2 LYS 46 1HZ LYS 46 -5.399 5.108 7.762
337 HZ3 LYS 46 2HZ LYS 46 -4.518 4.388 9.025
338 H ILE 47 H ILE 47 -1.985 2.400 4.251
339 HA ILE 47 HA ILE 47 0.389 4.198 3.908
340 HB ILE 47 HB ILE 47 0.129 3.871 1.455
341 HG12 ILE 47 1HG1 ILE 47 -1.711 1.584 2.220
342 HG13 ILE 47 2HG1 ILE 47 -2.293 3.131 1.606
343 HG21 ILE 47 1HG2 ILE 47 1.835 2.598 2.518
344 HG22 ILE 47 2HG2 ILE 47 0.974 1.457 1.487
345 HG23 ILE 47 3HG2 ILE 47 0.670 1.481 3.224
346 HD11 ILE 47 3HD1 ILE 47 -0.866 2.811 -0.422
347 HD12 ILE 47 1HD1 ILE 47 -2.112 1.573 -0.253
348 HD13 ILE 47 2HD1 ILE 47 -0.441 1.207 0.176
349 H GLU 48 H GLU 48 -0.050 6.203 2.882
350 HA GLU 48 HA GLU 48 -2.772 7.184 3.426
351 HB2 GLU 48 1HB GLU 48 -0.782 8.519 4.060
352 HB3 GLU 48 2HB GLU 48 -0.332 8.633 2.358
353 HG2 GLU 48 1HG GLU 48 -2.408 9.809 1.845
354 HG3 GLU 48 2HG GLU 48 -2.958 9.620 3.511
355 H TYR 49 H TYR 49 -4.307 7.056 1.882
356 HA TYR 49 HA TYR 49 -3.477 7.115 -1.003
357 HB2 TYR 49 1HB TYR 49 -4.614 5.039 -0.285
358 HB3 TYR 49 2HB TYR 49 -5.989 5.993 0.275
359 HD1 TYR 49 HD1 TYR 49 -3.930 5.236 -2.747
360 HD2 TYR 49 HD2 TYR 49 -7.690 6.651 -1.230
361 HE1 TYR 49 HE1 TYR 49 -4.858 5.235 -5.046
362 HE2 TYR 49 HE2 TYR 49 -8.619 6.650 -3.529
363 HH TYR 49 HH TYR 49 -6.604 5.717 -6.321
364 H LYS 50 H LYS 50 -3.957 8.987 -2.005
365 HA LYS 50 HA LYS 50 -4.809 11.174 -2.269
366 HB2 LYS 50 1HB LYS 50 -6.454 9.760 -3.436
367 HB3 LYS 50 2HB LYS 50 -7.356 9.563 -1.935
368 HG2 LYS 50 1HG LYS 50 -7.792 11.972 -1.840
369 HG3 LYS 50 2HG LYS 50 -6.796 12.230 -3.268
370 HD2 LYS 50 1HD LYS 50 -9.050 12.215 -4.049
371 HD3 LYS 50 2HD LYS 50 -8.374 10.652 -4.501
372 HE2 LYS 50 1HE LYS 50 -9.528 9.525 -2.756
373 HE3 LYS 50 2HE LYS 50 -9.895 11.030 -1.912
374 HZ1 LYS 50 3HZ LYS 50 -11.820 10.981 -2.986
375 HZ2 LYS 50 1HZ LYS 50 -11.312 9.745 -4.030
376 HZ3 LYS 50 2HZ LYS 50 -10.960 11.365 -4.401
377 H GLY 51 H GLY 51 -7.562 10.255 -0.307
378 HA2 GLY 51 1HA GLY 51 -6.614 12.039 1.907
379 HA3 GLY 51 2HA GLY 51 -8.248 12.176 1.251
380 H SER 52 H SER 52 -8.255 9.151 0.853
381 HA SER 52 HA SER 52 -9.231 8.535 3.575
382 HB2 SER 52 1HB SER 52 -9.480 7.158 0.900
383 HB3 SER 52 2HB SER 52 -9.983 6.380 2.398
384 HG SER 52 HG SER 52 -11.642 7.682 2.509
385 H HIS 53 H HIS 53 -8.693 6.394 4.533
386 HA HIS 53 HA HIS 53 -5.793 5.945 4.439
387 HB2 HIS 53 1HB HIS 53 -7.992 4.630 6.061
388 HB3 HIS 53 2HB HIS 53 -6.265 4.369 6.298
389 HD1 HIS 53 HD1 HIS 53 -8.000 5.643 8.545
390 HD2 HIS 53 HD2 HIS 53 -5.853 7.853 5.734
391 HE1 HIS 53 HE1 HIS 53 -7.622 7.931 9.564
392 H GLY 54 H GLY 54 -4.999 4.663 2.856
393 HA2 GLY 54 1HA GLY 54 -6.674 2.445 1.785
394 HA3 GLY 54 2HA GLY 54 -5.233 3.112 1.018
395 H TYR 55 H TYR 55 -6.030 0.302 1.939
396 HA TYR 55 HA TYR 55 -3.560 -0.268 3.555
397 HB2 TYR 55 1HB TYR 55 -6.231 -1.701 3.542
398 HB3 TYR 55 2HB TYR 55 -4.791 -2.267 4.391
399 HD1 TYR 55 HD1 TYR 55 -7.334 0.420 4.216
400 HD2 TYR 55 HD2 TYR 55 -4.017 -1.205 6.407
401 HE1 TYR 55 HE1 TYR 55 -7.863 1.913 6.123
402 HE2 TYR 55 HE2 TYR 55 -4.545 0.289 8.314
403 HH TYR 55 HH TYR 55 -6.484 2.933 8.097
404 H VAL 56 H VAL 56 -2.200 -1.836 2.755
405 HA VAL 56 HA VAL 56 -3.097 -3.365 0.334
406 HB VAL 56 HB VAL 56 -0.714 -3.020 -0.526
407 HG11 VAL 56 1HG1 VAL 56 -1.278 -0.663 -1.327
408 HG12 VAL 56 2HG1 VAL 56 -2.698 -0.747 -0.285
409 HG13 VAL 56 3HG1 VAL 56 -2.517 -1.885 -1.621
410 HG21 VAL 56 3HG2 VAL 56 0.494 -1.087 0.332
411 HG22 VAL 56 1HG2 VAL 56 0.161 -2.184 1.672
412 HG23 VAL 56 2HG2 VAL 56 -0.813 -0.730 1.460
413 H ALA 57 H ALA 57 -2.463 -5.478 0.322
414 HA ALA 57 HA ALA 57 -1.612 -6.716 2.729
415 HB1 ALA 57 3HB ALA 57 -1.528 -7.766 -0.105
416 HB2 ALA 57 1HB ALA 57 -2.874 -7.918 1.025
417 HB3 ALA 57 2HB ALA 57 -1.353 -8.751 1.348
418 H LYS 58 H LYS 58 0.373 -7.505 3.417
419 HA LYS 58 HA LYS 58 2.738 -6.130 2.549
420 HB2 LYS 58 1HB LYS 58 3.897 -7.829 4.042
421 HB3 LYS 58 2HB LYS 58 2.626 -6.884 4.819
422 HG2 LYS 58 1HG LYS 58 1.072 -8.681 4.709
423 HG3 LYS 58 2HG LYS 58 2.071 -9.575 3.563
424 HD2 LYS 58 1HD LYS 58 2.211 -10.487 5.890
425 HD3 LYS 58 2HD LYS 58 3.772 -9.954 5.264
426 HE2 LYS 58 1HE LYS 58 3.741 -7.971 6.566
427 HE3 LYS 58 2HE LYS 58 2.018 -8.120 6.907
428 HZ1 LYS 58 3HZ LYS 58 4.018 -8.960 8.526
429 HZ2 LYS 58 1HZ LYS 58 3.561 -10.397 7.747
430 HZ3 LYS 58 2HZ LYS 58 2.406 -9.492 8.604
431 H GLU 59 H GLU 59 1.118 -8.829 1.274
432 HA GLU 59 HA GLU 59 3.349 -10.360 0.313
433 HB2 GLU 59 1HB GLU 59 0.966 -11.148 0.444
434 HB3 GLU 59 2HB GLU 59 0.598 -10.106 -0.930
435 HG2 GLU 59 1HG GLU 59 1.010 -12.309 -1.802
436 HG3 GLU 59 2HG GLU 59 2.413 -11.326 -2.215
437 H TYR 60 H TYR 60 1.558 -7.610 -1.046
438 HA TYR 60 HA TYR 60 3.209 -7.729 -3.517
439 HB2 TYR 60 1HB TYR 60 0.983 -5.816 -2.750
440 HB3 TYR 60 2HB TYR 60 1.691 -6.023 -4.354
441 HD1 TYR 60 HD2 TYR 60 1.714 -8.543 -5.231
442 HD2 TYR 60 HD1 TYR 60 -0.978 -7.006 -2.259
443 HE1 TYR 60 HE2 TYR 60 0.145 -10.402 -5.693
444 HE2 TYR 60 HE1 TYR 60 -2.547 -8.872 -2.717
445 HH TYR 60 HH TYR 60 -1.769 -11.370 -5.145
446 H ILE 61 H ILE 61 3.425 -6.375 -0.456
447 HA ILE 61 HA ILE 61 5.000 -4.015 -1.438
448 HB ILE 61 HB ILE 61 3.886 -4.523 1.332
449 HG12 ILE 61 1HG1 ILE 61 2.026 -4.254 -0.202
450 HG13 ILE 61 2HG1 ILE 61 2.222 -2.751 0.695
451 HG21 ILE 61 1HG2 ILE 61 5.796 -3.035 1.354
452 HG22 ILE 61 2HG2 ILE 61 4.339 -2.068 1.572
453 HG23 ILE 61 3HG2 ILE 61 5.143 -2.109 0.003
454 HD11 ILE 61 3HD1 ILE 61 3.725 -2.031 -1.330
455 HD12 ILE 61 1HD1 ILE 61 1.972 -1.995 -1.512
456 HD13 ILE 61 2HD1 ILE 61 2.901 -3.335 -2.180
457 H LYS 62 H LYS 62 7.159 -4.074 -1.180
458 HA LYS 62 HA LYS 62 8.316 -5.840 0.928
459 HB2 LYS 62 1HB LYS 62 9.887 -6.822 -0.619
460 HB3 LYS 62 2HB LYS 62 8.263 -7.089 -1.249
461 HG2 LYS 62 1HG LYS 62 8.564 -5.026 -2.672
462 HG3 LYS 62 2HG LYS 62 10.249 -4.983 -2.156
463 HD2 LYS 62 1HD LYS 62 8.965 -7.382 -3.488
464 HD3 LYS 62 2HD LYS 62 9.877 -6.151 -4.361
465 HE2 LYS 62 1HE LYS 62 11.795 -6.640 -2.714
466 HE3 LYS 62 2HE LYS 62 10.885 -8.083 -2.267
467 HZ1 LYS 62 3HZ LYS 62 10.857 -8.694 -4.640
468 HZ2 LYS 62 1HZ LYS 62 12.419 -8.649 -3.982
469 HZ3 LYS 62 2HZ LYS 62 11.879 -7.377 -4.970
470 H ASP 63 H ASP 63 10.768 -5.466 1.003
471 HA ASP 63 HA ASP 63 12.616 -4.041 1.173
472 HB2 ASP 63 1HB ASP 63 11.681 -3.193 -1.150
473 HB3 ASP 63 2HB ASP 63 11.141 -1.804 -0.211
474 H ILE 64 H ILE 64 9.899 -1.733 1.214
475 HA ILE 64 HA ILE 64 9.131 -0.318 2.904
476 HB ILE 64 HB ILE 64 10.376 -2.259 4.862
477 HG12 ILE 64 1HG1 ILE 64 7.647 -2.403 3.540
478 HG13 ILE 64 2HG1 ILE 64 9.003 -3.458 3.141
479 HG21 ILE 64 1HG2 ILE 64 8.730 -1.427 6.370
480 HG22 ILE 64 2HG2 ILE 64 7.824 -0.651 5.072
481 HG23 ILE 64 3HG2 ILE 64 9.383 0.003 5.572
482 HD11 ILE 64 3HD1 ILE 64 7.701 -4.686 4.704
483 HD12 ILE 64 1HD1 ILE 64 7.491 -3.281 5.749
484 HD13 ILE 64 2HD1 ILE 64 9.067 -4.065 5.630
485 H LYS 65 H LYS 65 11.202 0.770 1.799
486 HA LYS 65 HA LYS 65 12.795 1.842 4.072
487 HB2 LYS 65 1HB LYS 65 14.194 0.076 3.044
488 HB3 LYS 65 2HB LYS 65 14.033 0.869 1.476
489 HG2 LYS 65 1HG LYS 65 15.139 2.876 2.340
490 HG3 LYS 65 2HG LYS 65 15.228 2.159 3.949
491 HD2 LYS 65 1HD LYS 65 16.644 0.342 3.056
492 HD3 LYS 65 2HD LYS 65 16.568 1.076 1.453
493 HE2 LYS 65 1HE LYS 65 17.627 2.498 3.910
494 HE3 LYS 65 2HE LYS 65 18.650 1.665 2.740
495 HZ1 LYS 65 3HZ LYS 65 17.042 3.235 1.207
496 HZ2 LYS 65 1HZ LYS 65 18.648 3.578 1.632
497 HZ3 LYS 65 2HZ LYS 65 17.371 4.221 2.551
498 H ASP 66 H ASP 66 13.074 4.026 3.912
499 HA ASP 66 HA ASP 66 11.638 5.484 1.897
500 HB2 ASP 66 1HB ASP 66 12.008 6.332 4.192
501 HB3 ASP 66 2HB ASP 66 13.733 6.471 3.851
502 H GLU 67 H GLU 67 12.325 6.325 -0.023
503 HA GLU 67 HA GLU 67 14.859 5.450 -1.108
504 HB2 GLU 67 1HB GLU 67 12.736 7.357 -2.118
505 HB3 GLU 67 2HB GLU 67 14.154 6.895 -3.061
506 HG2 GLU 67 1HG GLU 67 13.512 4.528 -2.901
507 HG3 GLU 67 2HG GLU 67 12.117 4.964 -1.913
508 H VAL 68 H VAL 68 16.556 6.365 0.081
509 HA VAL 68 HA VAL 68 16.821 9.353 -0.075
510 HB VAL 68 HB VAL 68 18.270 9.113 1.979
511 HG11 VAL 68 1HG1 VAL 68 15.991 9.944 2.146
512 HG12 VAL 68 2HG1 VAL 68 16.297 8.857 3.501
513 HG13 VAL 68 3HG1 VAL 68 15.354 8.300 2.119
514 HG21 VAL 68 3HG2 VAL 68 17.040 6.336 1.944
515 HG22 VAL 68 1HG2 VAL 68 17.868 7.040 3.330
516 HG23 VAL 68 2HG2 VAL 68 18.756 6.725 1.840
517 H LEU 69 H LEU 69 18.588 10.066 -1.124
518 HA LEU 69 HA LEU 69 20.373 8.135 -2.369
519 HB2 LEU 69 1HB LEU 69 20.093 11.132 -2.414
520 HB3 LEU 69 2HB LEU 69 21.491 10.360 -3.159
521 HG LEU 69 HG LEU 69 19.568 10.778 -4.741
522 HD11 LEU 69 1HD1 LEU 69 19.828 7.793 -4.589
523 HD12 LEU 69 2HD1 LEU 69 21.307 8.729 -4.790
524 HD13 LEU 69 3HD1 LEU 69 20.008 8.874 -5.967
525 HD21 LEU 69 3HD2 LEU 69 17.526 9.565 -4.522
526 HD22 LEU 69 1HD2 LEU 69 17.851 10.226 -2.920
527 HD23 LEU 69 2HD2 LEU 69 18.189 8.528 -3.257
528 H GLU 70 H GLU 70 22.530 7.780 -1.924
529 HA GLU 70 HA GLU 70 23.928 9.369 0.097
530 HB2 GLU 70 1HB GLU 70 22.577 7.804 1.473
531 HB3 GLU 70 2HB GLU 70 23.304 6.444 0.616
532 HG2 GLU 70 1HG GLU 70 25.523 7.083 1.412
533 HG3 GLU 70 2HG GLU 70 24.854 8.512 2.199
534 H HIS 71 H HIS 71 25.791 9.647 -1.020
535 HA HIS 71 HA HIS 71 26.795 7.680 -2.912
536 HB2 HIS 71 1HB HIS 71 27.968 10.227 -1.765
537 HB3 HIS 71 2HB HIS 71 28.768 9.260 -3.002
538 HD1 HIS 71 HD1 HIS 71 25.520 11.157 -2.441
539 HD2 HIS 71 HD2 HIS 71 27.872 9.765 -5.587
540 HE1 HIS 71 HE1 HIS 71 24.491 12.077 -4.564
541 H HIS 72 H HIS 72 28.592 9.159 -0.207
542 HA HIS 72 HA HIS 72 30.167 6.708 0.088
543 HB2 HIS 72 1HB HIS 72 30.187 9.296 1.673
544 HB3 HIS 72 2HB HIS 72 31.371 7.996 1.827
545 HD1 HIS 72 HD1 HIS 72 32.704 7.402 -0.474
546 HD2 HIS 72 HD2 HIS 72 30.750 11.084 -0.379
547 HE1 HIS 72 HE1 HIS 72 33.674 8.777 -2.367
548 H HIS 73 H HIS 73 29.853 5.147 1.597
549 HA HIS 73 HA HIS 73 27.435 5.059 3.150
550 HB2 HIS 73 1HB HIS 73 29.969 3.400 3.209
551 HB3 HIS 73 2HB HIS 73 28.547 3.028 4.183
552 HD1 HIS 73 HD1 HIS 73 26.242 2.761 2.703
553 HD2 HIS 73 HD2 HIS 73 29.847 2.347 0.649
554 HE1 HIS 73 HE1 HIS 73 25.696 1.590 0.525
555 H HIS 74 H HIS 74 30.825 5.818 3.948
556 HA HIS 74 HA HIS 74 29.926 7.271 6.337
557 HB2 HIS 74 1HB HIS 74 31.741 4.850 6.596
558 HB3 HIS 74 2HB HIS 74 31.329 5.966 7.898
559 HD1 HIS 74 HD1 HIS 74 28.639 6.148 8.386
560 HD2 HIS 74 HD2 HIS 74 29.947 2.768 6.329
561 HE1 HIS 74 HE1 HIS 74 26.777 4.442 8.558
562 H HIS 75 H HIS 75 32.929 6.427 7.129
563 HA HIS 75 HA HIS 75 34.135 8.900 6.312
564 HB2 HIS 75 1HB HIS 75 35.282 6.324 7.420
565 HB3 HIS 75 2HB HIS 75 36.248 7.775 7.152
566 HD1 HIS 75 HD1 HIS 75 33.263 6.564 9.163
567 HD2 HIS 75 HD2 HIS 75 35.969 9.735 9.129
568 HE1 HIS 75 HE1 HIS 75 32.846 7.884 11.285
569 H HIS 76 H HIS 76 34.343 5.576 5.054
570 HA HIS 76 HA HIS 76 36.435 5.919 3.199
571 HB2 HIS 76 1HB HIS 76 33.918 4.243 3.048
572 HB3 HIS 76 2HB HIS 76 35.229 4.123 1.875
573 HD1 HIS 76 HD1 HIS 76 37.571 3.292 2.792
574 HD2 HIS 76 HD2 HIS 76 34.431 3.002 5.521
575 HE1 HIS 76 HE1 HIS 76 38.382 1.788 4.662
Start of MODEL 8
1 H1 ALA 1 1H ALA 1 9.408 9.423 10.722
2 H2 ALA 1 2H ALA 1 10.378 8.180 10.089
3 H3 ALA 1 3H ALA 1 10.601 8.704 11.690
4 HA ALA 1 HA ALA 1 9.420 6.733 11.940
5 HB1 ALA 1 3HB ALA 1 7.232 7.450 12.752
6 HB2 ALA 1 1HB ALA 1 7.319 8.921 11.782
7 HB3 ALA 1 2HB ALA 1 8.419 8.695 13.141
8 H GLU 2 H GLU 2 8.541 8.599 9.161
9 HA GLU 2 HA GLU 2 6.555 6.699 8.154
10 HB2 GLU 2 1HB GLU 2 7.915 9.081 6.841
11 HB3 GLU 2 2HB GLU 2 6.617 8.139 6.109
12 HG2 GLU 2 1HG GLU 2 5.445 9.914 7.103
13 HG3 GLU 2 2HG GLU 2 5.308 8.647 8.318
14 H LYS 3 H LYS 3 6.788 5.353 6.401
15 HA LYS 3 HA LYS 3 9.580 4.809 5.449
16 HB2 LYS 3 1HB LYS 3 7.515 2.798 6.358
17 HB3 LYS 3 2HB LYS 3 9.015 2.377 5.536
18 HG2 LYS 3 1HG LYS 3 10.282 3.536 7.349
19 HG3 LYS 3 2HG LYS 3 8.762 3.801 8.199
20 HD2 LYS 3 1HD LYS 3 9.742 1.058 7.371
21 HD3 LYS 3 2HD LYS 3 10.063 1.756 8.957
22 HE2 LYS 3 1HE LYS 3 7.505 2.096 9.121
23 HE3 LYS 3 2HE LYS 3 7.400 0.988 7.754
24 HZ1 LYS 3 3HZ LYS 3 7.707 0.357 10.437
25 HZ2 LYS 3 1HZ LYS 3 9.154 -0.073 9.667
26 HZ3 LYS 3 2HZ LYS 3 7.678 -0.703 9.110
27 H THR 4 H THR 4 9.705 3.886 3.378
28 HA THR 4 HA THR 4 7.233 4.217 1.697
29 HB THR 4 HB THR 4 8.811 4.707 -0.166
30 HG1 THR 4 HG1 THR 4 10.980 5.355 0.764
31 HG21 THR 4 3HG2 THR 4 9.400 6.964 0.594
32 HG22 THR 4 1HG2 THR 4 9.146 6.475 2.271
33 HG23 THR 4 2HG2 THR 4 7.784 6.526 1.152
34 H GLY 5 H GLY 5 6.486 2.399 0.915
35 HA2 GLY 5 1HA GLY 5 8.226 -0.020 0.760
36 HA3 GLY 5 2HA GLY 5 6.464 -0.022 0.793
37 H ILE 6 H ILE 6 8.535 -1.113 -1.123
38 HA ILE 6 HA ILE 6 7.869 0.319 -3.642
39 HB ILE 6 HB ILE 6 9.570 -2.172 -3.314
40 HG12 ILE 6 1HG1 ILE 6 10.531 -0.496 -1.846
41 HG13 ILE 6 2HG1 ILE 6 11.505 -0.551 -3.315
42 HG21 ILE 6 1HG2 ILE 6 8.801 -1.541 -5.602
43 HG22 ILE 6 2HG2 ILE 6 10.551 -1.418 -5.422
44 HG23 ILE 6 3HG2 ILE 6 9.557 0.037 -5.390
45 HD11 ILE 6 3HD1 ILE 6 9.482 1.530 -2.488
46 HD12 ILE 6 1HD1 ILE 6 9.980 1.361 -4.170
47 HD13 ILE 6 2HD1 ILE 6 11.171 1.760 -2.935
48 H VAL 7 H VAL 7 6.140 -0.252 -4.750
49 HA VAL 7 HA VAL 7 4.665 -2.708 -4.141
50 HB VAL 7 HB VAL 7 4.197 -0.511 -6.187
51 HG11 VAL 7 1HG1 VAL 7 1.852 -1.567 -6.177
52 HG12 VAL 7 2HG1 VAL 7 2.613 -2.977 -5.441
53 HG13 VAL 7 3HG1 VAL 7 3.109 -2.446 -7.047
54 HG21 VAL 7 3HG2 VAL 7 4.009 0.075 -3.738
55 HG22 VAL 7 1HG2 VAL 7 2.755 -1.155 -3.595
56 HG23 VAL 7 2HG2 VAL 7 2.497 0.249 -4.629
57 H ASN 8 H ASN 8 5.596 -4.521 -4.882
58 HA ASN 8 HA ASN 8 6.732 -4.585 -7.641
59 HB2 ASN 8 1HB ASN 8 7.992 -5.489 -5.581
60 HB3 ASN 8 2HB ASN 8 6.837 -6.823 -5.606
61 HD21 ASN 8 2HD2 ASN 8 8.323 -8.456 -6.334
62 HD22 ASN 8 1HD2 ASN 8 9.044 -8.417 -7.870
63 H VAL 9 H VAL 9 5.105 -4.883 -9.035
64 HA VAL 9 HA VAL 9 3.443 -7.346 -8.750
65 HB VAL 9 HB VAL 9 1.484 -6.083 -9.645
66 HG11 VAL 9 1HG1 VAL 9 1.994 -6.487 -7.151
67 HG12 VAL 9 2HG1 VAL 9 0.817 -5.236 -7.537
68 HG13 VAL 9 3HG1 VAL 9 2.466 -4.788 -7.097
69 HG21 VAL 9 3HG2 VAL 9 1.612 -3.550 -9.324
70 HG22 VAL 9 1HG2 VAL 9 2.506 -4.190 -10.703
71 HG23 VAL 9 2HG2 VAL 9 3.362 -3.742 -9.227
72 H SER 10 H SER 10 2.553 -8.056 -10.798
73 HA SER 10 HA SER 10 4.473 -7.677 -13.002
74 HB2 SER 10 1HB SER 10 3.231 -9.520 -14.067
75 HB3 SER 10 2HB SER 10 3.653 -9.943 -12.412
76 HG SER 10 HG SER 10 1.229 -8.641 -12.772
77 H SER 11 H SER 11 1.508 -6.364 -11.996
78 HA SER 11 HA SER 11 1.173 -5.008 -14.637
79 HB2 SER 11 1HB SER 11 -0.929 -6.577 -13.128
80 HB3 SER 11 2HB SER 11 -1.370 -5.288 -14.246
81 HG SER 11 HG SER 11 -0.993 -6.624 -15.804
82 H SER 12 H SER 12 -0.827 -5.096 -11.698
83 HA SER 12 HA SER 12 0.136 -2.460 -10.815
84 HB2 SER 12 1HB SER 12 -2.194 -1.499 -10.903
85 HB3 SER 12 2HB SER 12 -1.451 -1.739 -12.480
86 HG SER 12 HG SER 12 -3.479 -2.601 -12.601
87 H LEU 13 H LEU 13 -1.047 -1.785 -8.810
88 HA LEU 13 HA LEU 13 -1.868 -4.194 -7.233
89 HB2 LEU 13 1HB LEU 13 0.246 -3.239 -6.458
90 HB3 LEU 13 2HB LEU 13 -0.495 -1.645 -6.317
91 HG LEU 13 HG LEU 13 -2.041 -2.501 -4.598
92 HD11 LEU 13 1HD1 LEU 13 -0.745 -5.116 -5.351
93 HD12 LEU 13 2HD1 LEU 13 -2.453 -4.750 -5.089
94 HD13 LEU 13 3HD1 LEU 13 -1.366 -4.894 -3.714
95 HD21 LEU 13 3HD2 LEU 13 0.223 -1.657 -3.955
96 HD22 LEU 13 1HD2 LEU 13 0.806 -3.322 -3.981
97 HD23 LEU 13 2HD2 LEU 13 -0.432 -2.840 -2.823
98 H ASN 14 H ASN 14 -3.777 -4.183 -6.277
99 HA ASN 14 HA ASN 14 -5.569 -1.857 -6.644
100 HB2 ASN 14 1HB ASN 14 -6.032 -4.714 -5.755
101 HB3 ASN 14 2HB ASN 14 -7.299 -3.488 -5.757
102 HD21 ASN 14 2HD2 ASN 14 -7.422 -5.817 -7.449
103 HD22 ASN 14 1HD2 ASN 14 -7.308 -5.301 -9.062
104 H VAL 15 H VAL 15 -6.465 -0.725 -4.993
105 HA VAL 15 HA VAL 15 -5.202 -1.042 -2.308
106 HB VAL 15 HB VAL 15 -6.713 1.246 -3.612
107 HG11 VAL 15 1HG1 VAL 15 -5.947 2.468 -1.485
108 HG12 VAL 15 2HG1 VAL 15 -5.682 0.865 -0.795
109 HG13 VAL 15 3HG1 VAL 15 -7.300 1.350 -1.306
110 HG21 VAL 15 3HG2 VAL 15 -3.829 0.778 -2.805
111 HG22 VAL 15 1HG2 VAL 15 -4.464 2.367 -3.232
112 HG23 VAL 15 2HG2 VAL 15 -4.454 1.071 -4.428
113 H ARG 16 H ARG 16 -6.336 -1.773 -0.648
114 HA ARG 16 HA ARG 16 -9.216 -2.391 -0.990
115 HB2 ARG 16 1HB ARG 16 -7.189 -3.175 1.127
116 HB3 ARG 16 2HB ARG 16 -8.886 -3.651 1.157
117 HG2 ARG 16 1HG ARG 16 -8.633 -4.756 -1.024
118 HG3 ARG 16 2HG ARG 16 -6.940 -4.267 -1.083
119 HD2 ARG 16 1HD ARG 16 -6.493 -5.561 0.976
120 HD3 ARG 16 2HD ARG 16 -8.187 -6.047 1.029
121 HE ARG 16 HE ARG 16 -7.797 -7.537 -0.790
122 HH11 ARG 16 1HH2 ARG 16 -5.068 -5.493 -0.129
123 HH12 ARG 16 2HH2 ARG 16 -3.991 -6.418 -1.125
124 HH21 ARG 16 1HH1 ARG 16 -6.394 -8.724 -2.073
125 HH22 ARG 16 2HH1 ARG 16 -4.739 -8.236 -2.219
126 H GLU 17 H GLU 17 -10.756 -1.781 0.566
127 HA GLU 17 HA GLU 17 -10.610 0.938 1.444
128 HB2 GLU 17 1HB GLU 17 -12.730 -0.282 0.913
129 HB3 GLU 17 2HB GLU 17 -12.510 -1.252 2.371
130 HG2 GLU 17 1HG GLU 17 -12.570 0.794 3.747
131 HG3 GLU 17 2HG GLU 17 -12.773 1.769 2.293
132 H GLY 18 H GLY 18 -10.360 -2.154 3.201
133 HA2 GLY 18 1HA GLY 18 -8.684 -0.882 5.247
134 HA3 GLY 18 2HA GLY 18 -10.254 -1.422 5.838
135 H ALA 19 H ALA 19 -7.097 -2.356 4.989
136 HA ALA 19 HA ALA 19 -6.020 -4.448 4.793
137 HB1 ALA 19 3HB ALA 19 -6.187 -4.150 7.205
138 HB2 ALA 19 1HB ALA 19 -6.457 -5.850 6.817
139 HB3 ALA 19 2HB ALA 19 -7.825 -4.804 7.205
140 H SER 20 H SER 20 -8.209 -6.443 6.258
141 HA SER 20 HA SER 20 -9.479 -8.240 5.517
142 HB2 SER 20 1HB SER 20 -10.257 -6.023 3.660
143 HB3 SER 20 2HB SER 20 -10.919 -7.637 3.422
144 HG SER 20 HG SER 20 -11.163 -7.257 5.947
145 H THR 21 H THR 21 -9.512 -9.941 4.004
146 HA THR 21 HA THR 21 -7.048 -10.341 2.590
147 HB THR 21 HB THR 21 -9.649 -11.904 2.452
148 HG1 THR 21 HG1 THR 21 -7.948 -11.592 4.403
149 HG21 THR 21 3HG2 THR 21 -6.862 -12.432 1.427
150 HG22 THR 21 1HG2 THR 21 -8.396 -12.568 0.566
151 HG23 THR 21 2HG2 THR 21 -7.968 -13.756 1.797
152 H SER 22 H SER 22 -10.372 -9.725 1.495
153 HA SER 22 HA SER 22 -9.323 -8.494 -0.970
154 HB2 SER 22 1HB SER 22 -10.783 -9.933 -2.415
155 HB3 SER 22 2HB SER 22 -9.447 -10.805 -1.675
156 HG SER 22 HG SER 22 -11.038 -11.323 0.031
157 H SER 23 H SER 23 -10.408 -6.988 0.762
158 HA SER 23 HA SER 23 -13.320 -6.855 0.745
159 HB2 SER 23 1HB SER 23 -12.821 -4.505 1.706
160 HB3 SER 23 2HB SER 23 -12.318 -5.896 2.650
161 HG SER 23 HG SER 23 -10.231 -5.649 1.643
162 H LYS 24 H LYS 24 -14.003 -4.322 0.264
163 HA LYS 24 HA LYS 24 -14.176 -4.197 -2.592
164 HB2 LYS 24 1HB LYS 24 -14.804 -2.117 -0.475
165 HB3 LYS 24 2HB LYS 24 -15.238 -1.974 -2.178
166 HG2 LYS 24 1HG LYS 24 -16.610 -3.981 -2.051
167 HG3 LYS 24 2HG LYS 24 -16.099 -4.266 -0.390
168 HD2 LYS 24 1HD LYS 24 -18.206 -3.216 -0.151
169 HD3 LYS 24 2HD LYS 24 -17.053 -1.909 0.115
170 HE2 LYS 24 1HE LYS 24 -17.369 -1.063 -2.107
171 HE3 LYS 24 2HE LYS 24 -18.275 -2.493 -2.597
172 HZ1 LYS 24 3HZ LYS 24 -20.084 -1.881 -1.306
173 HZ2 LYS 24 1HZ LYS 24 -19.576 -0.416 -1.991
174 HZ3 LYS 24 2HZ LYS 24 -19.187 -0.777 -0.377
175 H VAL 25 H VAL 25 -13.154 -2.914 -4.057
176 HA VAL 25 HA VAL 25 -10.593 -1.675 -3.171
177 HB VAL 25 HB VAL 25 -11.624 -2.512 -5.899
178 HG11 VAL 25 1HG1 VAL 25 -9.207 -1.934 -6.562
179 HG12 VAL 25 2HG1 VAL 25 -9.132 -1.023 -5.055
180 HG13 VAL 25 3HG1 VAL 25 -10.298 -0.572 -6.299
181 HG21 VAL 25 3HG2 VAL 25 -10.849 -4.305 -4.331
182 HG22 VAL 25 1HG2 VAL 25 -9.289 -3.488 -4.222
183 HG23 VAL 25 2HG2 VAL 25 -9.826 -4.162 -5.761
184 H ILE 26 H ILE 26 -10.410 0.451 -3.080
185 HA ILE 26 HA ILE 26 -12.569 2.171 -4.239
186 HB ILE 26 HB ILE 26 -11.633 3.899 -2.676
187 HG12 ILE 26 1HG1 ILE 26 -10.007 1.579 -1.574
188 HG13 ILE 26 2HG1 ILE 26 -9.329 2.876 -2.558
189 HG21 ILE 26 1HG2 ILE 26 -13.544 2.476 -2.039
190 HG22 ILE 26 2HG2 ILE 26 -12.536 2.834 -0.638
191 HG23 ILE 26 3HG2 ILE 26 -12.435 1.254 -1.417
192 HD11 ILE 26 3HD1 ILE 26 -8.946 3.528 -0.293
193 HD12 ILE 26 1HD1 ILE 26 -10.586 3.090 0.186
194 HD13 ILE 26 2HD1 ILE 26 -10.313 4.499 -0.838
195 H GLY 27 H GLY 27 -9.502 1.076 -4.938
196 HA2 GLY 27 1HA GLY 27 -9.111 2.709 -7.193
197 HA3 GLY 27 2HA GLY 27 -8.216 3.474 -5.881
198 H SER 28 H SER 28 -6.510 2.866 -7.583
199 HA SER 28 HA SER 28 -5.094 0.480 -6.603
200 HB2 SER 28 1HB SER 28 -4.691 -0.325 -8.958
201 HB3 SER 28 2HB SER 28 -6.343 -0.540 -8.390
202 HG SER 28 HG SER 28 -6.686 0.442 -10.256
203 H LEU 29 H LEU 29 -2.874 0.426 -7.407
204 HA LEU 29 HA LEU 29 -1.859 3.095 -8.341
205 HB2 LEU 29 1HB LEU 29 -0.602 1.273 -6.262
206 HB3 LEU 29 2HB LEU 29 0.067 2.794 -6.847
207 HG LEU 29 HG LEU 29 -2.610 2.512 -5.450
208 HD11 LEU 29 1HD1 LEU 29 -1.483 3.608 -3.551
209 HD12 LEU 29 2HD1 LEU 29 0.038 3.601 -4.443
210 HD13 LEU 29 3HD1 LEU 29 -0.695 2.078 -3.941
211 HD21 LEU 29 3HD2 LEU 29 -2.117 5.108 -5.268
212 HD22 LEU 29 1HD2 LEU 29 -2.808 4.451 -6.746
213 HD23 LEU 29 2HD2 LEU 29 -1.085 4.815 -6.666
214 H SER 30 H SER 30 -0.002 3.047 -9.580
215 HA SER 30 HA SER 30 0.272 0.762 -11.332
216 HB2 SER 30 1HB SER 30 1.920 2.103 -12.489
217 HB3 SER 30 2HB SER 30 0.596 3.163 -12.020
218 HG SER 30 HG SER 30 3.176 3.333 -11.387
219 H GLY 31 H GLY 31 2.414 -0.201 -11.784
220 HA2 GLY 31 1HA GLY 31 3.505 -1.422 -9.429
221 HA3 GLY 31 2HA GLY 31 4.140 -1.598 -11.063
222 H ASN 32 H ASN 32 5.828 -1.423 -8.927
223 HA ASN 32 HA ASN 32 7.721 -0.326 -8.134
224 HB2 ASN 32 1HB ASN 32 7.328 1.052 -10.795
225 HB3 ASN 32 2HB ASN 32 8.715 1.367 -9.753
226 HD21 ASN 32 2HD2 ASN 32 9.038 0.176 -12.339
227 HD22 ASN 32 1HD2 ASN 32 9.574 -1.422 -12.132
228 H THR 33 H THR 33 4.784 1.082 -8.192
229 HA THR 33 HA THR 33 5.420 3.841 -7.592
230 HB THR 33 HB THR 33 2.926 2.284 -6.842
231 HG1 THR 33 HG1 THR 33 2.328 3.634 -8.855
232 HG21 THR 33 3HG2 THR 33 1.937 4.629 -7.043
233 HG22 THR 33 1HG2 THR 33 3.597 5.225 -7.049
234 HG23 THR 33 2HG2 THR 33 2.978 4.353 -5.646
235 H LYS 34 H LYS 34 5.870 4.788 -5.708
236 HA LYS 34 HA LYS 34 6.472 3.076 -3.378
237 HB2 LYS 34 1HB LYS 34 7.000 5.994 -4.012
238 HB3 LYS 34 2HB LYS 34 7.408 5.254 -2.463
239 HG2 LYS 34 1HG LYS 34 8.807 3.583 -3.637
240 HG3 LYS 34 2HG LYS 34 8.420 4.350 -5.177
241 HD2 LYS 34 1HD LYS 34 9.482 6.426 -4.461
242 HD3 LYS 34 2HD LYS 34 9.779 5.754 -2.858
243 HE2 LYS 34 1HE LYS 34 11.818 5.612 -4.206
244 HE3 LYS 34 2HE LYS 34 11.201 3.993 -3.883
245 HZ1 LYS 34 3HZ LYS 34 10.398 3.783 -6.035
246 HZ2 LYS 34 1HZ LYS 34 11.884 4.569 -6.262
247 HZ3 LYS 34 2HZ LYS 34 10.436 5.455 -6.331
248 H VAL 35 H VAL 35 5.462 3.240 -1.414
249 HA VAL 35 HA VAL 35 3.067 5.051 -1.232
250 HB VAL 35 HB VAL 35 1.913 3.244 -0.010
251 HG11 VAL 35 1HG1 VAL 35 1.414 3.389 -2.337
252 HG12 VAL 35 2HG1 VAL 35 1.703 1.678 -2.019
253 HG13 VAL 35 3HG1 VAL 35 2.954 2.656 -2.787
254 HG21 VAL 35 3HG2 VAL 35 4.448 1.717 -0.667
255 HG22 VAL 35 1HG2 VAL 35 2.931 0.909 -0.274
256 HG23 VAL 35 2HG2 VAL 35 3.707 1.953 0.916
257 H THR 36 H THR 36 3.000 6.263 0.514
258 HA THR 36 HA THR 36 5.136 6.128 2.506
259 HB THR 36 HB THR 36 2.697 7.934 2.384
260 HG1 THR 36 HG1 THR 36 4.947 7.815 0.919
261 HG21 THR 36 3HG2 THR 36 4.206 9.407 3.789
262 HG22 THR 36 1HG2 THR 36 5.279 8.018 3.958
263 HG23 THR 36 2HG2 THR 36 3.636 7.945 4.595
264 H ILE 37 H ILE 37 5.036 5.054 4.347
265 HA ILE 37 HA ILE 37 2.404 3.998 5.304
266 HB ILE 37 HB ILE 37 5.237 3.118 5.954
267 HG12 ILE 37 1HG1 ILE 37 3.092 1.676 4.374
268 HG13 ILE 37 2HG1 ILE 37 4.351 2.650 3.612
269 HG21 ILE 37 1HG2 ILE 37 2.512 2.091 6.783
270 HG22 ILE 37 2HG2 ILE 37 3.802 2.672 7.837
271 HG23 ILE 37 3HG2 ILE 37 3.994 1.153 6.962
272 HD11 ILE 37 3HD1 ILE 37 4.765 0.219 5.375
273 HD12 ILE 37 1HD1 ILE 37 6.067 1.241 4.770
274 HD13 ILE 37 2HD1 ILE 37 5.068 0.324 3.641
275 H VAL 38 H VAL 38 1.568 4.792 7.097
276 HA VAL 38 HA VAL 38 3.315 6.302 9.022
277 HB VAL 38 HB VAL 38 1.406 7.790 9.443
278 HG11 VAL 38 1HG1 VAL 38 1.615 9.093 7.469
279 HG12 VAL 38 2HG1 VAL 38 1.846 7.668 6.456
280 HG13 VAL 38 3HG1 VAL 38 3.119 8.176 7.566
281 HG21 VAL 38 3HG2 VAL 38 -0.463 6.321 8.945
282 HG22 VAL 38 1HG2 VAL 38 0.061 6.148 7.268
283 HG23 VAL 38 2HG2 VAL 38 -0.543 7.700 7.848
284 H GLY 39 H GLY 39 1.769 3.507 8.629
285 HA2 GLY 39 1HA GLY 39 1.551 2.970 11.447
286 HA3 GLY 39 2HA GLY 39 -0.054 3.185 10.752
287 H GLU 40 H GLU 40 0.520 0.790 11.818
288 HA GLU 40 HA GLU 40 0.794 -1.012 9.432
289 HB2 GLU 40 1HB GLU 40 1.924 -1.420 12.223
290 HB3 GLU 40 2HB GLU 40 1.845 -2.680 10.989
291 HG2 GLU 40 1HG GLU 40 3.234 -1.345 9.487
292 HG3 GLU 40 2HG GLU 40 3.265 -0.022 10.651
293 H GLU 41 H GLU 41 -0.473 -2.908 9.536
294 HA GLU 41 HA GLU 41 -2.369 -3.264 11.765
295 HB2 GLU 41 1HB GLU 41 -3.414 -1.538 10.275
296 HB3 GLU 41 2HB GLU 41 -3.383 -2.714 8.960
297 HG2 GLU 41 1HG GLU 41 -5.578 -2.789 9.986
298 HG3 GLU 41 2HG GLU 41 -4.727 -4.273 10.409
299 H GLY 42 H GLY 42 -1.995 -5.339 12.112
300 HA2 GLY 42 1HA GLY 42 -1.726 -7.635 11.783
301 HA3 GLY 42 2HA GLY 42 -3.006 -7.431 10.592
302 H ALA 43 H ALA 43 -2.314 -8.691 8.976
303 HA ALA 43 HA ALA 43 0.485 -8.706 8.092
304 HB1 ALA 43 3HB ALA 43 -0.694 -10.814 8.033
305 HB2 ALA 43 1HB ALA 43 -0.420 -10.319 6.363
306 HB3 ALA 43 2HB ALA 43 -2.011 -10.112 7.094
307 H PHE 44 H PHE 44 -1.421 -6.312 7.853
308 HA PHE 44 HA PHE 44 -0.901 -5.771 4.943
309 HB2 PHE 44 1HB PHE 44 -3.300 -4.857 6.563
310 HB3 PHE 44 2HB PHE 44 -2.965 -4.446 4.881
311 HD1 PHE 44 HD2 PHE 44 -3.753 -7.252 7.190
312 HD2 PHE 44 HD1 PHE 44 -3.434 -5.974 3.103
313 HE1 PHE 44 HE2 PHE 44 -4.864 -9.342 6.448
314 HE2 PHE 44 HE1 PHE 44 -4.543 -8.062 2.360
315 HZ PHE 44 HZ PHE 44 -5.259 -9.746 4.034
316 H TYR 45 H TYR 45 -0.345 -3.644 4.448
317 HA TYR 45 HA TYR 45 0.720 -2.072 6.758
318 HB2 TYR 45 1HB TYR 45 1.430 -2.126 3.815
319 HB3 TYR 45 2HB TYR 45 2.028 -0.889 4.922
320 HD1 TYR 45 HD1 TYR 45 2.974 -1.871 7.231
321 HD2 TYR 45 HD2 TYR 45 2.775 -4.026 3.520
322 HE1 TYR 45 HE1 TYR 45 4.749 -3.405 8.028
323 HE2 TYR 45 HE2 TYR 45 4.554 -5.555 4.317
324 HH TYR 45 HH TYR 45 5.501 -6.330 6.431
325 H LYS 46 H LYS 46 0.163 0.006 7.076
326 HA LYS 46 HA LYS 46 -2.273 0.982 5.680
327 HB2 LYS 46 1HB LYS 46 -2.188 0.941 8.170
328 HB3 LYS 46 2HB LYS 46 -0.826 2.057 8.127
329 HG2 LYS 46 1HG LYS 46 -2.210 3.743 7.010
330 HG3 LYS 46 2HG LYS 46 -3.572 2.622 6.974
331 HD2 LYS 46 1HD LYS 46 -3.554 2.527 9.447
332 HD3 LYS 46 2HD LYS 46 -2.216 3.674 9.474
333 HE2 LYS 46 1HE LYS 46 -4.916 4.245 8.219
334 HE3 LYS 46 2HE LYS 46 -4.453 4.748 9.844
335 HZ1 LYS 46 3HZ LYS 46 -3.345 5.629 7.256
336 HZ2 LYS 46 1HZ LYS 46 -2.446 5.789 8.685
337 HZ3 LYS 46 2HZ LYS 46 -3.946 6.573 8.534
338 H ILE 47 H ILE 47 -2.076 2.401 4.090
339 HA ILE 47 HA ILE 47 0.234 4.302 4.072
340 HB ILE 47 HB ILE 47 0.264 4.097 1.592
341 HG12 ILE 47 1HG1 ILE 47 -1.493 1.662 2.016
342 HG13 ILE 47 2HG1 ILE 47 -2.122 3.210 1.452
343 HG21 ILE 47 1HG2 ILE 47 0.769 1.664 3.308
344 HG22 ILE 47 2HG2 ILE 47 1.932 2.852 2.720
345 HG23 ILE 47 3HG2 ILE 47 1.206 1.701 1.600
346 HD11 ILE 47 3HD1 ILE 47 0.003 1.530 0.090
347 HD12 ILE 47 1HD1 ILE 47 -0.509 3.129 -0.450
348 HD13 ILE 47 2HD1 ILE 47 -1.649 1.784 -0.471
349 H GLU 48 H GLU 48 -0.154 6.287 3.025
350 HA GLU 48 HA GLU 48 -2.917 7.238 3.365
351 HB2 GLU 48 1HB GLU 48 -0.336 8.638 2.594
352 HB3 GLU 48 2HB GLU 48 -1.885 9.464 2.773
353 HG2 GLU 48 1HG GLU 48 -2.044 8.740 5.103
354 HG3 GLU 48 2HG GLU 48 -0.547 7.820 4.943
355 H TYR 49 H TYR 49 -4.328 6.977 1.771
356 HA TYR 49 HA TYR 49 -3.389 7.050 -1.077
357 HB2 TYR 49 1HB TYR 49 -4.577 4.993 -0.371
358 HB3 TYR 49 2HB TYR 49 -5.976 5.965 0.089
359 HD1 TYR 49 HD1 TYR 49 -3.805 4.997 -2.776
360 HD2 TYR 49 HD2 TYR 49 -7.533 6.744 -1.546
361 HE1 TYR 49 HE1 TYR 49 -4.599 4.959 -5.126
362 HE2 TYR 49 HE2 TYR 49 -8.325 6.706 -3.897
363 HH TYR 49 HH TYR 49 -7.879 6.069 -5.975
364 H LYS 50 H LYS 50 -3.648 8.951 -1.975
365 HA LYS 50 HA LYS 50 -4.417 11.136 -2.379
366 HB2 LYS 50 1HB LYS 50 -6.928 9.446 -2.479
367 HB3 LYS 50 2HB LYS 50 -6.872 11.128 -3.006
368 HG2 LYS 50 1HG LYS 50 -5.095 10.563 -4.629
369 HG3 LYS 50 2HG LYS 50 -5.157 8.879 -4.110
370 HD2 LYS 50 1HD LYS 50 -7.483 8.702 -4.844
371 HD3 LYS 50 2HD LYS 50 -7.500 10.410 -5.280
372 HE2 LYS 50 1HE LYS 50 -7.146 9.069 -7.290
373 HE3 LYS 50 2HE LYS 50 -5.675 9.971 -6.926
374 HZ1 LYS 50 3HZ LYS 50 -6.187 7.109 -6.776
375 HZ2 LYS 50 1HZ LYS 50 -5.210 7.762 -5.553
376 HZ3 LYS 50 2HZ LYS 50 -4.762 7.941 -7.183
377 H GLY 51 H GLY 51 -7.387 10.190 -0.796
378 HA2 GLY 51 1HA GLY 51 -6.870 12.242 1.344
379 HA3 GLY 51 2HA GLY 51 -8.459 11.896 0.660
380 H SER 52 H SER 52 -8.294 9.088 0.584
381 HA SER 52 HA SER 52 -8.764 8.486 3.438
382 HB2 SER 52 1HB SER 52 -9.600 6.289 2.478
383 HB3 SER 52 2HB SER 52 -10.476 7.720 1.949
384 HG SER 52 HG SER 52 -8.287 6.643 0.509
385 H HIS 53 H HIS 53 -8.036 6.286 4.195
386 HA HIS 53 HA HIS 53 -5.128 5.997 3.623
387 HB2 HIS 53 1HB HIS 53 -6.876 4.927 5.861
388 HB3 HIS 53 2HB HIS 53 -5.145 4.621 5.708
389 HD1 HIS 53 HD1 HIS 53 -7.602 7.233 6.694
390 HD2 HIS 53 HD2 HIS 53 -3.493 6.969 6.051
391 HE1 HIS 53 HE1 HIS 53 -6.585 9.335 7.677
392 H GLY 54 H GLY 54 -4.689 4.613 2.074
393 HA2 GLY 54 1HA GLY 54 -6.419 2.354 1.402
394 HA3 GLY 54 2HA GLY 54 -4.917 2.797 0.593
395 H TYR 55 H TYR 55 -5.963 0.212 1.698
396 HA TYR 55 HA TYR 55 -3.621 -0.464 3.461
397 HB2 TYR 55 1HB TYR 55 -6.425 -1.616 3.435
398 HB3 TYR 55 2HB TYR 55 -5.071 -2.314 4.328
399 HD1 TYR 55 HD2 TYR 55 -7.152 0.754 3.955
400 HD2 TYR 55 HD1 TYR 55 -4.327 -1.383 6.385
401 HE1 TYR 55 HE2 TYR 55 -7.520 2.367 5.802
402 HE2 TYR 55 HE1 TYR 55 -4.694 0.231 8.231
403 HH TYR 55 HH TYR 55 -6.935 2.982 7.849
404 H VAL 56 H VAL 56 -2.342 -2.059 2.796
405 HA VAL 56 HA VAL 56 -3.212 -3.822 0.543
406 HB VAL 56 HB VAL 56 -0.944 -3.514 -0.472
407 HG11 VAL 56 1HG1 VAL 56 -1.445 -1.220 -1.378
408 HG12 VAL 56 2HG1 VAL 56 -2.728 -1.082 -0.178
409 HG13 VAL 56 3HG1 VAL 56 -2.819 -2.323 -1.427
410 HG21 VAL 56 3HG2 VAL 56 -0.784 -1.228 1.526
411 HG22 VAL 56 1HG2 VAL 56 0.354 -1.513 0.210
412 HG23 VAL 56 2HG2 VAL 56 0.226 -2.674 1.531
413 H ALA 57 H ALA 57 -2.013 -5.760 0.378
414 HA ALA 57 HA ALA 57 -1.223 -6.878 2.946
415 HB1 ALA 57 3HB ALA 57 -1.457 -7.952 0.144
416 HB2 ALA 57 1HB ALA 57 -2.362 -8.414 1.584
417 HB3 ALA 57 2HB ALA 57 -0.682 -8.911 1.408
418 H LYS 58 H LYS 58 0.812 -7.824 3.407
419 HA LYS 58 HA LYS 58 3.069 -6.208 2.623
420 HB2 LYS 58 1HB LYS 58 4.396 -7.860 3.956
421 HB3 LYS 58 2HB LYS 58 3.009 -7.230 4.838
422 HG2 LYS 58 1HG LYS 58 1.765 -9.242 4.519
423 HG3 LYS 58 2HG LYS 58 2.884 -9.834 3.295
424 HD2 LYS 58 1HD LYS 58 3.331 -11.003 5.380
425 HD3 LYS 58 2HD LYS 58 4.679 -9.918 5.041
426 HE2 LYS 58 1HE LYS 58 3.960 -8.344 6.669
427 HE3 LYS 58 2HE LYS 58 2.363 -9.078 6.786
428 HZ1 LYS 58 3HZ LYS 58 3.987 -9.605 8.627
429 HZ2 LYS 58 1HZ LYS 58 4.834 -10.545 7.498
430 HZ3 LYS 58 2HZ LYS 58 3.229 -10.937 7.895
431 H GLU 59 H GLU 59 1.589 -8.989 1.293
432 HA GLU 59 HA GLU 59 3.834 -10.267 0.063
433 HB2 GLU 59 1HB GLU 59 2.209 -11.438 -1.274
434 HB3 GLU 59 2HB GLU 59 1.481 -11.203 0.313
435 HG2 GLU 59 1HG GLU 59 0.421 -9.080 -0.645
436 HG3 GLU 59 2HG GLU 59 0.924 -9.659 -2.229
437 H TYR 60 H TYR 60 1.783 -7.570 -0.940
438 HA TYR 60 HA TYR 60 3.149 -7.397 -3.572
439 HB2 TYR 60 1HB TYR 60 0.977 -5.667 -2.325
440 HB3 TYR 60 2HB TYR 60 1.560 -5.542 -3.986
441 HD1 TYR 60 HD1 TYR 60 1.597 -7.868 -5.308
442 HD2 TYR 60 HD2 TYR 60 -0.934 -6.979 -1.950
443 HE1 TYR 60 HE1 TYR 60 0.032 -9.657 -6.013
444 HE2 TYR 60 HE2 TYR 60 -2.496 -8.769 -2.657
445 HH TYR 60 HH TYR 60 -1.806 -11.171 -4.540
446 H ILE 61 H ILE 61 3.569 -6.272 -0.406
447 HA ILE 61 HA ILE 61 5.159 -3.891 -1.326
448 HB ILE 61 HB ILE 61 4.139 -4.505 1.464
449 HG12 ILE 61 1HG1 ILE 61 2.225 -4.109 0.018
450 HG13 ILE 61 2HG1 ILE 61 2.505 -2.655 0.974
451 HG21 ILE 61 1HG2 ILE 61 5.415 -2.078 0.184
452 HG22 ILE 61 2HG2 ILE 61 6.088 -3.072 1.476
453 HG23 ILE 61 3HG2 ILE 61 4.670 -2.068 1.783
454 HD11 ILE 61 3HD1 ILE 61 3.054 -3.129 -1.946
455 HD12 ILE 61 1HD1 ILE 61 3.962 -1.895 -1.074
456 HD13 ILE 61 2HD1 ILE 61 2.211 -1.785 -1.183
457 H LYS 62 H LYS 62 7.254 -4.175 -1.372
458 HA LYS 62 HA LYS 62 8.624 -5.660 0.786
459 HB2 LYS 62 1HB LYS 62 9.928 -7.015 -0.832
460 HB3 LYS 62 2HB LYS 62 8.214 -7.410 -0.855
461 HG2 LYS 62 1HG LYS 62 7.882 -6.068 -2.864
462 HG3 LYS 62 2HG LYS 62 9.551 -5.510 -2.811
463 HD2 LYS 62 1HD LYS 62 9.538 -7.282 -4.410
464 HD3 LYS 62 2HD LYS 62 10.242 -7.969 -2.948
465 HE2 LYS 62 1HE LYS 62 8.240 -9.129 -2.397
466 HE3 LYS 62 2HE LYS 62 7.282 -8.185 -3.535
467 HZ1 LYS 62 3HZ LYS 62 7.854 -9.503 -5.211
468 HZ2 LYS 62 1HZ LYS 62 8.367 -10.606 -4.030
469 HZ3 LYS 62 2HZ LYS 62 9.490 -9.556 -4.754
470 H ASP 63 H ASP 63 11.063 -5.531 0.370
471 HA ASP 63 HA ASP 63 12.958 -4.181 0.248
472 HB2 ASP 63 1HB ASP 63 11.484 -3.295 -2.241
473 HB3 ASP 63 2HB ASP 63 13.098 -2.727 -1.831
474 H ILE 64 H ILE 64 11.149 -3.327 2.081
475 HA ILE 64 HA ILE 64 10.363 -0.559 1.749
476 HB ILE 64 HB ILE 64 10.657 -2.274 4.237
477 HG12 ILE 64 1HG1 ILE 64 8.164 -1.382 2.760
478 HG13 ILE 64 2HG1 ILE 64 8.954 -2.931 2.462
479 HG21 ILE 64 1HG2 ILE 64 9.543 0.503 3.796
480 HG22 ILE 64 2HG2 ILE 64 10.778 0.004 4.951
481 HG23 ILE 64 3HG2 ILE 64 9.099 -0.482 5.189
482 HD11 ILE 64 3HD1 ILE 64 7.921 -1.996 5.158
483 HD12 ILE 64 1HD1 ILE 64 8.649 -3.565 4.812
484 HD13 ILE 64 2HD1 ILE 64 7.095 -3.138 4.098
485 H LYS 65 H LYS 65 11.534 1.220 2.045
486 HA LYS 65 HA LYS 65 14.325 0.954 3.097
487 HB2 LYS 65 1HB LYS 65 13.103 3.257 1.542
488 HB3 LYS 65 2HB LYS 65 14.810 2.968 1.863
489 HG2 LYS 65 1HG LYS 65 13.086 1.045 0.285
490 HG3 LYS 65 2HG LYS 65 14.049 2.314 -0.465
491 HD2 LYS 65 1HD LYS 65 16.080 1.357 0.652
492 HD3 LYS 65 2HD LYS 65 15.087 0.028 1.239
493 HE2 LYS 65 1HE LYS 65 14.517 -0.609 -1.052
494 HE3 LYS 65 2HE LYS 65 15.475 0.735 -1.672
495 HZ1 LYS 65 3HZ LYS 65 16.366 -1.807 -1.056
496 HZ2 LYS 65 1HZ LYS 65 16.999 -0.798 0.152
497 HZ3 LYS 65 2HZ LYS 65 17.310 -0.462 -1.485
498 H ASP 66 H ASP 66 15.033 2.112 4.769
499 HA ASP 66 HA ASP 66 12.997 3.525 6.424
500 HB2 ASP 66 1HB ASP 66 15.752 2.417 7.049
501 HB3 ASP 66 2HB ASP 66 14.805 3.369 8.193
502 H GLU 67 H GLU 67 12.894 5.633 6.100
503 HA GLU 67 HA GLU 67 15.157 7.182 5.038
504 HB2 GLU 67 1HB GLU 67 12.338 7.965 5.880
505 HB3 GLU 67 2HB GLU 67 13.504 9.072 5.153
506 HG2 GLU 67 1HG GLU 67 12.286 8.351 3.289
507 HG3 GLU 67 2HG GLU 67 13.672 7.271 3.257
508 H VAL 68 H VAL 68 14.171 6.179 8.066
509 HA VAL 68 HA VAL 68 14.941 8.593 9.562
510 HB VAL 68 HB VAL 68 14.231 5.782 10.457
511 HG11 VAL 68 1HG1 VAL 68 14.942 8.284 11.998
512 HG12 VAL 68 2HG1 VAL 68 15.642 6.672 12.158
513 HG13 VAL 68 3HG1 VAL 68 13.997 6.979 12.715
514 HG21 VAL 68 3HG2 VAL 68 12.132 6.837 11.173
515 HG22 VAL 68 1HG2 VAL 68 12.390 7.124 9.451
516 HG23 VAL 68 2HG2 VAL 68 12.713 8.407 10.618
517 H LEU 69 H LEU 69 16.891 8.991 10.428
518 HA LEU 69 HA LEU 69 19.219 7.552 9.580
519 HB2 LEU 69 1HB LEU 69 18.994 9.477 11.919
520 HB3 LEU 69 2HB LEU 69 20.457 9.057 11.031
521 HG LEU 69 HG LEU 69 18.034 10.447 9.848
522 HD11 LEU 69 1HD1 LEU 69 19.395 12.438 9.813
523 HD12 LEU 69 2HD1 LEU 69 20.814 11.543 10.360
524 HD13 LEU 69 3HD1 LEU 69 19.455 11.796 11.455
525 HD21 LEU 69 3HD2 LEU 69 20.639 9.429 8.709
526 HD22 LEU 69 1HD2 LEU 69 19.848 10.828 7.982
527 HD23 LEU 69 2HD2 LEU 69 19.008 9.283 8.053
528 H GLU 70 H GLU 70 20.321 5.942 10.486
529 HA GLU 70 HA GLU 70 19.142 4.415 12.648
530 HB2 GLU 70 1HB GLU 70 21.798 4.120 11.210
531 HB3 GLU 70 2HB GLU 70 21.125 2.937 12.331
532 HG2 GLU 70 1HG GLU 70 19.696 3.887 9.834
533 HG3 GLU 70 2HG GLU 70 20.672 2.421 9.905
534 H HIS 71 H HIS 71 19.829 4.199 14.719
535 HA HIS 71 HA HIS 71 21.250 6.409 15.916
536 HB2 HIS 71 1HB HIS 71 19.444 5.256 17.109
537 HB3 HIS 71 2HB HIS 71 20.371 3.755 17.097
538 HD1 HIS 71 HD1 HIS 71 20.658 7.321 18.403
539 HD2 HIS 71 HD2 HIS 71 22.128 3.510 19.239
540 HE1 HIS 71 HE1 HIS 71 22.006 7.526 20.537
541 H HIS 72 H HIS 72 23.234 6.379 16.982
542 HA HIS 72 HA HIS 72 25.314 4.847 15.705
543 HB2 HIS 72 1HB HIS 72 25.387 6.605 18.182
544 HB3 HIS 72 2HB HIS 72 26.809 5.979 17.345
545 HD1 HIS 72 HD1 HIS 72 27.058 6.746 14.767
546 HD2 HIS 72 HD2 HIS 72 24.337 8.928 17.051
547 HE1 HIS 72 HE1 HIS 72 26.594 8.880 13.483
548 H HIS 73 H HIS 73 26.403 3.095 16.393
549 HA HIS 73 HA HIS 73 26.663 1.026 17.458
550 HB2 HIS 73 1HB HIS 73 26.543 2.910 19.824
551 HB3 HIS 73 2HB HIS 73 27.101 1.239 19.905
552 HD1 HIS 73 HD1 HIS 73 29.157 0.683 18.156
553 HD2 HIS 73 HD2 HIS 73 28.557 4.690 19.141
554 HE1 HIS 73 HE1 HIS 73 31.289 1.900 17.536
555 H HIS 74 H HIS 74 24.497 0.424 16.702
556 HA HIS 74 HA HIS 74 22.129 0.711 18.270
557 HB2 HIS 74 1HB HIS 74 22.103 -0.005 15.902
558 HB3 HIS 74 2HB HIS 74 22.889 -1.521 16.350
559 HD1 HIS 74 HD1 HIS 74 19.725 0.433 17.185
560 HD2 HIS 74 HD2 HIS 74 21.102 -3.501 17.110
561 HE1 HIS 74 HE1 HIS 74 17.740 -1.030 17.760
562 H HIS 75 H HIS 75 24.606 -1.834 18.164
563 HA HIS 75 HA HIS 75 23.838 -2.653 20.911
564 HB2 HIS 75 1HB HIS 75 22.572 -4.071 19.189
565 HB3 HIS 75 2HB HIS 75 24.142 -4.732 18.732
566 HD1 HIS 75 HD1 HIS 75 25.293 -6.339 20.385
567 HD2 HIS 75 HD2 HIS 75 21.719 -4.766 21.844
568 HE1 HIS 75 HE1 HIS 75 24.734 -7.651 22.479
569 H HIS 76 H HIS 76 25.546 -3.361 22.077
570 HA HIS 76 HA HIS 76 27.996 -4.397 20.953
571 HB2 HIS 76 1HB HIS 76 29.468 -2.522 21.533
572 HB3 HIS 76 2HB HIS 76 28.270 -2.009 20.346
573 HD1 HIS 76 HD1 HIS 76 26.366 -0.422 21.172
574 HD2 HIS 76 HD2 HIS 76 29.193 -1.330 24.097
575 HE1 HIS 76 HE1 HIS 76 25.984 1.212 23.070
Start of MODEL 9
1 H1 ALA 1 1H ALA 1 7.898 5.768 14.178
2 H2 ALA 1 2H ALA 1 9.243 4.866 13.667
3 H3 ALA 1 3H ALA 1 7.774 4.762 12.818
4 HA ALA 1 HA ALA 1 8.447 7.451 12.885
5 HB1 ALA 1 3HB ALA 1 10.663 7.546 12.025
6 HB2 ALA 1 1HB ALA 1 10.734 5.796 11.807
7 HB3 ALA 1 2HB ALA 1 10.753 6.485 13.431
8 H GLU 2 H GLU 2 9.043 8.078 10.474
9 HA GLU 2 HA GLU 2 6.960 7.014 8.818
10 HB2 GLU 2 1HB GLU 2 9.347 8.764 8.191
11 HB3 GLU 2 2HB GLU 2 8.084 8.384 7.018
12 HG2 GLU 2 1HG GLU 2 6.382 9.343 8.502
13 HG3 GLU 2 2HG GLU 2 7.613 9.676 9.719
14 H LYS 3 H LYS 3 7.021 5.563 7.121
15 HA LYS 3 HA LYS 3 9.622 4.235 6.481
16 HB2 LYS 3 1HB LYS 3 7.016 2.881 7.223
17 HB3 LYS 3 2HB LYS 3 8.379 2.046 6.476
18 HG2 LYS 3 1HG LYS 3 9.822 2.709 8.365
19 HG3 LYS 3 2HG LYS 3 8.456 3.539 9.115
20 HD2 LYS 3 1HD LYS 3 7.219 1.406 9.221
21 HD3 LYS 3 2HD LYS 3 8.588 0.577 8.481
22 HE2 LYS 3 1HE LYS 3 10.020 1.238 10.377
23 HE3 LYS 3 2HE LYS 3 8.652 2.066 11.121
24 HZ1 LYS 3 3HZ LYS 3 8.422 -0.769 10.365
25 HZ2 LYS 3 1HZ LYS 3 7.578 0.095 11.557
26 HZ3 LYS 3 2HZ LYS 3 9.201 -0.341 11.813
27 H THR 4 H THR 4 9.697 3.338 4.366
28 HA THR 4 HA THR 4 7.400 4.066 2.572
29 HB THR 4 HB THR 4 9.069 4.661 0.848
30 HG1 THR 4 HG1 THR 4 11.184 4.596 1.287
31 HG21 THR 4 3HG2 THR 4 8.173 6.458 2.191
32 HG22 THR 4 1HG2 THR 4 9.898 6.752 1.980
33 HG23 THR 4 2HG2 THR 4 9.295 6.097 3.502
34 H GLY 5 H GLY 5 6.723 2.411 1.326
35 HA2 GLY 5 1HA GLY 5 8.479 -0.012 1.070
36 HA3 GLY 5 2HA GLY 5 6.735 -0.107 1.277
37 H ILE 6 H ILE 6 8.818 -0.763 -0.971
38 HA ILE 6 HA ILE 6 7.736 0.823 -3.207
39 HB ILE 6 HB ILE 6 9.751 -1.435 -3.056
40 HG12 ILE 6 1HG1 ILE 6 11.296 0.426 -3.741
41 HG13 ILE 6 2HG1 ILE 6 9.950 1.550 -3.580
42 HG21 ILE 6 1HG2 ILE 6 8.752 -1.653 -5.210
43 HG22 ILE 6 2HG2 ILE 6 10.210 -0.696 -5.472
44 HG23 ILE 6 3HG2 ILE 6 8.634 0.095 -5.416
45 HD11 ILE 6 3HD1 ILE 6 11.644 1.145 -1.569
46 HD12 ILE 6 1HD1 ILE 6 10.583 -0.226 -1.243
47 HD13 ILE 6 2HD1 ILE 6 9.930 1.413 -1.268
48 H VAL 7 H VAL 7 6.041 0.180 -4.440
49 HA VAL 7 HA VAL 7 4.691 -2.345 -3.812
50 HB VAL 7 HB VAL 7 4.081 -0.176 -5.840
51 HG11 VAL 7 1HG1 VAL 7 2.586 -2.651 -4.965
52 HG12 VAL 7 2HG1 VAL 7 2.966 -2.127 -6.605
53 HG13 VAL 7 3HG1 VAL 7 1.751 -1.263 -5.663
54 HG21 VAL 7 3HG2 VAL 7 2.701 -0.756 -3.212
55 HG22 VAL 7 1HG2 VAL 7 2.550 0.681 -4.223
56 HG23 VAL 7 2HG2 VAL 7 4.045 0.380 -3.337
57 H ASN 8 H ASN 8 5.716 -4.121 -4.653
58 HA ASN 8 HA ASN 8 6.598 -4.048 -7.520
59 HB2 ASN 8 1HB ASN 8 8.336 -4.628 -5.864
60 HB3 ASN 8 2HB ASN 8 7.340 -5.966 -5.290
61 HD21 ASN 8 2HD2 ASN 8 8.992 -4.743 -8.237
62 HD22 ASN 8 1HD2 ASN 8 9.205 -6.273 -8.940
63 H VAL 9 H VAL 9 4.868 -4.722 -8.732
64 HA VAL 9 HA VAL 9 3.660 -7.366 -8.028
65 HB VAL 9 HB VAL 9 1.424 -6.478 -8.680
66 HG11 VAL 9 1HG1 VAL 9 2.566 -4.760 -6.473
67 HG12 VAL 9 2HG1 VAL 9 2.374 -6.503 -6.275
68 HG13 VAL 9 3HG1 VAL 9 0.968 -5.491 -6.580
69 HG21 VAL 9 3HG2 VAL 9 2.201 -4.597 -10.074
70 HG22 VAL 9 1HG2 VAL 9 2.874 -3.809 -8.646
71 HG23 VAL 9 2HG2 VAL 9 1.131 -4.019 -8.797
72 H SER 10 H SER 10 2.570 -8.360 -9.889
73 HA SER 10 HA SER 10 4.175 -8.318 -12.248
74 HB2 SER 10 1HB SER 10 2.933 -10.298 -11.780
75 HB3 SER 10 2HB SER 10 1.424 -9.403 -11.624
76 HG SER 10 HG SER 10 1.915 -10.586 -13.683
77 H SER 11 H SER 11 0.989 -6.860 -11.539
78 HA SER 11 HA SER 11 1.507 -4.768 -13.507
79 HB2 SER 11 1HB SER 11 -0.644 -6.837 -14.032
80 HB3 SER 11 2HB SER 11 -0.548 -5.285 -14.858
81 HG SER 11 HG SER 11 1.467 -7.291 -14.792
82 H SER 12 H SER 12 0.940 -3.107 -12.244
83 HA SER 12 HA SER 12 -0.301 -1.712 -10.847
84 HB2 SER 12 1HB SER 12 -1.801 -1.851 -12.839
85 HB3 SER 12 2HB SER 12 -2.659 -3.175 -12.054
86 HG SER 12 HG SER 12 -3.265 -1.789 -10.425
87 H LEU 13 H LEU 13 -1.678 -1.604 -8.947
88 HA LEU 13 HA LEU 13 -2.180 -4.231 -7.605
89 HB2 LEU 13 1HB LEU 13 -0.074 -3.403 -6.713
90 HB3 LEU 13 2HB LEU 13 -0.774 -1.812 -6.429
91 HG LEU 13 HG LEU 13 -2.301 -2.734 -4.758
92 HD11 LEU 13 1HD1 LEU 13 -1.808 -5.230 -4.103
93 HD12 LEU 13 2HD1 LEU 13 -1.199 -5.357 -5.752
94 HD13 LEU 13 3HD1 LEU 13 -2.873 -4.895 -5.464
95 HD21 LEU 13 3HD2 LEU 13 -0.093 -2.078 -3.967
96 HD22 LEU 13 1HD2 LEU 13 0.561 -3.660 -4.392
97 HD23 LEU 13 2HD2 LEU 13 -0.620 -3.514 -3.091
98 H ASN 14 H ASN 14 -4.136 -4.331 -6.629
99 HA ASN 14 HA ASN 14 -5.933 -2.036 -6.856
100 HB2 ASN 14 1HB ASN 14 -7.644 -3.568 -6.048
101 HB3 ASN 14 2HB ASN 14 -6.675 -4.379 -7.277
102 HD21 ASN 14 2HD2 ASN 14 -8.117 -5.898 -5.359
103 HD22 ASN 14 1HD2 ASN 14 -7.012 -6.664 -4.323
104 H VAL 15 H VAL 15 -6.736 -0.799 -5.168
105 HA VAL 15 HA VAL 15 -5.207 -0.928 -2.628
106 HB VAL 15 HB VAL 15 -7.110 1.124 -3.787
107 HG11 VAL 15 1HG1 VAL 15 -7.373 1.308 -1.430
108 HG12 VAL 15 2HG1 VAL 15 -6.166 2.523 -1.844
109 HG13 VAL 15 3HG1 VAL 15 -5.664 0.988 -1.135
110 HG21 VAL 15 3HG2 VAL 15 -4.150 1.333 -3.192
111 HG22 VAL 15 1HG2 VAL 15 -5.138 2.427 -4.163
112 HG23 VAL 15 2HG2 VAL 15 -4.768 0.809 -4.760
113 H ARG 16 H ARG 16 -6.106 -1.605 -0.736
114 HA ARG 16 HA ARG 16 -8.971 -2.457 -0.787
115 HB2 ARG 16 1HB ARG 16 -6.617 -3.196 0.966
116 HB3 ARG 16 2HB ARG 16 -8.265 -3.744 1.273
117 HG2 ARG 16 1HG ARG 16 -8.344 -4.805 -0.943
118 HG3 ARG 16 2HG ARG 16 -6.719 -4.216 -1.296
119 HD2 ARG 16 1HD ARG 16 -5.822 -5.527 0.587
120 HD3 ARG 16 2HD ARG 16 -7.444 -6.098 0.967
121 HE ARG 16 HE ARG 16 -7.363 -7.538 -0.934
122 HH11 ARG 16 1HH2 ARG 16 -4.673 -5.374 -0.758
123 HH12 ARG 16 2HH2 ARG 16 -3.755 -6.220 -1.958
124 HH21 ARG 16 1HH1 ARG 16 -6.174 -8.640 -2.494
125 HH22 ARG 16 2HH1 ARG 16 -4.603 -8.065 -2.940
126 H GLU 17 H GLU 17 -10.435 -1.386 0.436
127 HA GLU 17 HA GLU 17 -9.679 0.995 1.916
128 HB2 GLU 17 1HB GLU 17 -11.834 0.764 0.694
129 HB3 GLU 17 2HB GLU 17 -12.323 -0.487 1.835
130 HG2 GLU 17 1HG GLU 17 -12.183 1.096 3.690
131 HG3 GLU 17 2HG GLU 17 -11.601 2.355 2.601
132 H GLY 18 H GLY 18 -10.787 -2.267 2.804
133 HA2 GLY 18 1HA GLY 18 -10.464 -1.614 5.687
134 HA3 GLY 18 2HA GLY 18 -11.199 -3.079 5.035
135 H ALA 19 H ALA 19 -9.980 -4.767 5.686
136 HA ALA 19 HA ALA 19 -7.036 -4.700 5.147
137 HB1 ALA 19 3HB ALA 19 -6.688 -5.894 7.313
138 HB2 ALA 19 1HB ALA 19 -8.396 -5.659 7.688
139 HB3 ALA 19 2HB ALA 19 -7.325 -4.265 7.544
140 H SER 20 H SER 20 -10.050 -6.289 4.994
141 HA SER 20 HA SER 20 -9.091 -9.015 4.923
142 HB2 SER 20 1HB SER 20 -11.621 -7.942 3.657
143 HB3 SER 20 2HB SER 20 -11.304 -9.592 4.183
144 HG SER 20 HG SER 20 -12.527 -8.060 5.629
145 H THR 21 H THR 21 -8.861 -10.370 3.069
146 HA THR 21 HA THR 21 -7.488 -9.215 0.838
147 HB THR 21 HB THR 21 -8.882 -11.901 0.896
148 HG1 THR 21 HG1 THR 21 -7.679 -11.995 2.666
149 HG21 THR 21 3HG2 THR 21 -7.961 -11.283 -1.268
150 HG22 THR 21 1HG2 THR 21 -6.953 -12.536 -0.545
151 HG23 THR 21 2HG2 THR 21 -6.421 -10.855 -0.524
152 H SER 22 H SER 22 -10.808 -10.490 1.158
153 HA SER 22 HA SER 22 -11.482 -9.542 -1.562
154 HB2 SER 22 1HB SER 22 -13.066 -10.981 0.585
155 HB3 SER 22 2HB SER 22 -13.742 -10.505 -0.970
156 HG SER 22 HG SER 22 -11.587 -11.675 -1.646
157 H SER 23 H SER 23 -10.707 -7.584 0.441
158 HA SER 23 HA SER 23 -13.077 -6.303 1.502
159 HB2 SER 23 1HB SER 23 -11.461 -4.379 1.882
160 HB3 SER 23 2HB SER 23 -10.999 -5.909 2.624
161 HG SER 23 HG SER 23 -9.209 -5.477 1.564
162 H LYS 24 H LYS 24 -13.770 -4.101 0.856
163 HA LYS 24 HA LYS 24 -14.363 -3.967 -1.946
164 HB2 LYS 24 1HB LYS 24 -15.776 -2.976 -0.142
165 HB3 LYS 24 2HB LYS 24 -14.539 -1.743 0.106
166 HG2 LYS 24 1HG LYS 24 -14.799 -0.975 -2.206
167 HG3 LYS 24 2HG LYS 24 -15.983 -2.247 -2.515
168 HD2 LYS 24 1HD LYS 24 -17.467 -1.289 -0.789
169 HD3 LYS 24 2HD LYS 24 -16.287 -0.013 -0.485
170 HE2 LYS 24 1HE LYS 24 -18.039 0.805 -1.996
171 HE3 LYS 24 2HE LYS 24 -16.495 0.725 -2.843
172 HZ1 LYS 24 3HZ LYS 24 -18.154 -0.225 -4.235
173 HZ2 LYS 24 1HZ LYS 24 -18.725 -1.228 -2.991
174 HZ3 LYS 24 2HZ LYS 24 -17.187 -1.498 -3.661
175 H VAL 25 H VAL 25 -13.356 -2.896 -3.595
176 HA VAL 25 HA VAL 25 -10.757 -1.567 -2.969
177 HB VAL 25 HB VAL 25 -11.925 -2.724 -5.513
178 HG11 VAL 25 1HG1 VAL 25 -9.422 -1.095 -5.029
179 HG12 VAL 25 2HG1 VAL 25 -10.674 -0.831 -6.243
180 HG13 VAL 25 3HG1 VAL 25 -9.569 -2.198 -6.398
181 HG21 VAL 25 3HG2 VAL 25 -9.422 -3.449 -3.967
182 HG22 VAL 25 1HG2 VAL 25 -10.166 -4.356 -5.284
183 HG23 VAL 25 2HG2 VAL 25 -10.976 -4.247 -3.720
184 H ILE 26 H ILE 26 -10.605 0.594 -3.134
185 HA ILE 26 HA ILE 26 -12.868 2.116 -4.350
186 HB ILE 26 HB ILE 26 -11.913 4.036 -3.086
187 HG12 ILE 26 1HG1 ILE 26 -9.999 1.968 -1.950
188 HG13 ILE 26 2HG1 ILE 26 -9.538 3.197 -3.127
189 HG21 ILE 26 1HG2 ILE 26 -13.626 2.623 -2.041
190 HG22 ILE 26 2HG2 ILE 26 -12.464 3.157 -0.827
191 HG23 ILE 26 3HG2 ILE 26 -12.381 1.514 -1.464
192 HD11 ILE 26 3HD1 ILE 26 -10.664 3.722 -0.363
193 HD12 ILE 26 1HD1 ILE 26 -10.270 4.965 -1.550
194 HD13 ILE 26 2HD1 ILE 26 -8.990 3.962 -0.865
195 H GLY 27 H GLY 27 -9.857 0.957 -5.201
196 HA2 GLY 27 1HA GLY 27 -9.706 2.298 -7.653
197 HA3 GLY 27 2HA GLY 27 -8.769 3.277 -6.528
198 H SER 28 H SER 28 -6.956 2.651 -8.021
199 HA SER 28 HA SER 28 -5.550 0.309 -6.924
200 HB2 SER 28 1HB SER 28 -6.800 -0.713 -8.772
201 HB3 SER 28 2HB SER 28 -6.218 0.528 -9.878
202 HG SER 28 HG SER 28 -4.235 -0.329 -9.817
203 H LEU 29 H LEU 29 -3.257 0.323 -7.572
204 HA LEU 29 HA LEU 29 -2.330 3.000 -8.583
205 HB2 LEU 29 1HB LEU 29 -1.040 1.243 -6.474
206 HB3 LEU 29 2HB LEU 29 -0.440 2.805 -7.032
207 HG LEU 29 HG LEU 29 -3.124 2.339 -5.696
208 HD11 LEU 29 1HD1 LEU 29 -2.175 3.336 -3.733
209 HD12 LEU 29 2HD1 LEU 29 -0.701 3.783 -4.594
210 HD13 LEU 29 3HD1 LEU 29 -1.044 2.087 -4.253
211 HD21 LEU 29 3HD2 LEU 29 -1.764 4.759 -6.882
212 HD22 LEU 29 1HD2 LEU 29 -2.860 4.959 -5.516
213 HD23 LEU 29 2HD2 LEU 29 -3.449 4.253 -7.015
214 H SER 30 H SER 30 -0.472 2.994 -9.868
215 HA SER 30 HA SER 30 -0.148 0.700 -11.566
216 HB2 SER 30 1HB SER 30 0.208 2.931 -12.433
217 HB3 SER 30 2HB SER 30 1.490 3.225 -11.261
218 HG SER 30 HG SER 30 1.628 1.019 -13.006
219 H GLY 31 H GLY 31 1.754 -0.568 -11.880
220 HA2 GLY 31 1HA GLY 31 2.911 -1.617 -9.504
221 HA3 GLY 31 2HA GLY 31 3.475 -1.957 -11.137
222 H ASN 32 H ASN 32 5.144 -1.620 -8.853
223 HA ASN 32 HA ASN 32 7.123 -0.559 -8.217
224 HB2 ASN 32 1HB ASN 32 7.566 -0.895 -10.686
225 HB3 ASN 32 2HB ASN 32 6.999 0.754 -10.946
226 HD21 ASN 32 2HD2 ASN 32 9.365 -1.024 -8.870
227 HD22 ASN 32 1HD2 ASN 32 10.529 0.210 -8.891
228 H THR 33 H THR 33 4.576 0.714 -7.591
229 HA THR 33 HA THR 33 5.202 3.621 -7.807
230 HB THR 33 HB THR 33 2.742 2.126 -6.857
231 HG1 THR 33 HG1 THR 33 2.290 3.875 -8.766
232 HG21 THR 33 3HG2 THR 33 1.772 4.507 -6.839
233 HG22 THR 33 1HG2 THR 33 3.444 5.064 -6.809
234 HG23 THR 33 2HG2 THR 33 2.822 4.070 -5.493
235 H LYS 34 H LYS 34 6.056 4.707 -6.118
236 HA LYS 34 HA LYS 34 6.709 3.273 -3.655
237 HB2 LYS 34 1HB LYS 34 8.244 4.931 -4.717
238 HB3 LYS 34 2HB LYS 34 7.074 6.200 -4.355
239 HG2 LYS 34 1HG LYS 34 7.268 5.746 -1.962
240 HG3 LYS 34 2HG LYS 34 8.373 4.409 -2.284
241 HD2 LYS 34 1HD LYS 34 9.975 5.987 -3.316
242 HD3 LYS 34 2HD LYS 34 8.875 7.321 -2.969
243 HE2 LYS 34 1HE LYS 34 10.420 7.349 -1.170
244 HE3 LYS 34 2HE LYS 34 8.993 6.550 -0.512
245 HZ1 LYS 34 3HZ LYS 34 10.108 4.409 -1.239
246 HZ2 LYS 34 1HZ LYS 34 10.788 5.203 0.096
247 HZ3 LYS 34 2HZ LYS 34 11.526 5.324 -1.428
248 H VAL 35 H VAL 35 5.539 3.343 -1.771
249 HA VAL 35 HA VAL 35 3.432 5.464 -1.489
250 HB VAL 35 HB VAL 35 2.008 3.725 -0.387
251 HG11 VAL 35 1HG1 VAL 35 1.216 2.797 -2.464
252 HG12 VAL 35 2HG1 VAL 35 2.802 2.980 -3.213
253 HG13 VAL 35 3HG1 VAL 35 1.840 4.406 -2.824
254 HG21 VAL 35 3HG2 VAL 35 3.680 2.091 0.242
255 HG22 VAL 35 1HG2 VAL 35 4.203 1.909 -1.433
256 HG23 VAL 35 2HG2 VAL 35 2.613 1.331 -0.939
257 H THR 36 H THR 36 3.348 6.430 0.461
258 HA THR 36 HA THR 36 5.500 5.871 2.357
259 HB THR 36 HB THR 36 3.245 7.891 2.292
260 HG1 THR 36 HG1 THR 36 6.006 7.875 1.765
261 HG21 THR 36 3HG2 THR 36 5.347 7.357 4.391
262 HG22 THR 36 1HG2 THR 36 3.615 7.610 4.607
263 HG23 THR 36 2HG2 THR 36 4.656 8.965 4.172
264 H ILE 37 H ILE 37 5.318 4.643 4.158
265 HA ILE 37 HA ILE 37 2.590 3.716 4.994
266 HB ILE 37 HB ILE 37 5.315 2.446 5.382
267 HG12 ILE 37 1HG1 ILE 37 2.932 1.504 3.764
268 HG13 ILE 37 2HG1 ILE 37 4.278 2.404 3.065
269 HG21 ILE 37 1HG2 ILE 37 3.903 0.517 6.213
270 HG22 ILE 37 2HG2 ILE 37 2.527 1.619 6.239
271 HG23 ILE 37 3HG2 ILE 37 3.918 1.919 7.281
272 HD11 ILE 37 3HD1 ILE 37 4.734 0.065 2.724
273 HD12 ILE 37 1HD1 ILE 37 4.389 -0.303 4.413
274 HD13 ILE 37 2HD1 ILE 37 5.824 0.630 3.989
275 H VAL 38 H VAL 38 1.901 4.330 6.955
276 HA VAL 38 HA VAL 38 3.885 5.328 8.975
277 HB VAL 38 HB VAL 38 2.145 7.000 9.647
278 HG11 VAL 38 1HG1 VAL 38 3.271 7.042 6.846
279 HG12 VAL 38 2HG1 VAL 38 3.881 7.863 8.282
280 HG13 VAL 38 3HG1 VAL 38 2.394 8.419 7.515
281 HG21 VAL 38 3HG2 VAL 38 0.095 6.104 8.861
282 HG22 VAL 38 1HG2 VAL 38 0.736 5.810 7.247
283 HG23 VAL 38 2HG2 VAL 38 0.399 7.454 7.776
284 H GLY 39 H GLY 39 0.527 4.211 8.489
285 HA2 GLY 39 1HA GLY 39 0.426 3.266 11.289
286 HA3 GLY 39 2HA GLY 39 -0.920 3.288 10.154
287 H GLU 40 H GLU 40 -0.482 1.029 11.668
288 HA GLU 40 HA GLU 40 0.309 -0.943 9.568
289 HB2 GLU 40 1HB GLU 40 1.232 -0.931 12.457
290 HB3 GLU 40 2HB GLU 40 1.396 -2.314 11.370
291 HG2 GLU 40 1HG GLU 40 2.736 -0.968 9.821
292 HG3 GLU 40 2HG GLU 40 2.544 0.444 10.861
293 H GLU 41 H GLU 41 -0.882 -2.863 9.646
294 HA GLU 41 HA GLU 41 -2.754 -3.332 11.866
295 HB2 GLU 41 1HB GLU 41 -3.888 -1.693 10.256
296 HB3 GLU 41 2HB GLU 41 -3.876 -2.999 9.072
297 HG2 GLU 41 1HG GLU 41 -5.079 -3.311 11.837
298 HG3 GLU 41 2HG GLU 41 -6.015 -2.792 10.437
299 H GLY 42 H GLY 42 -2.258 -5.415 12.213
300 HA2 GLY 42 1HA GLY 42 -1.848 -7.686 11.835
301 HA3 GLY 42 2HA GLY 42 -3.022 -7.523 10.533
302 H ALA 43 H ALA 43 -2.056 -8.690 8.936
303 HA ALA 43 HA ALA 43 0.810 -8.385 8.352
304 HB1 ALA 43 3HB ALA 43 0.474 -10.157 6.764
305 HB2 ALA 43 1HB ALA 43 -1.271 -9.899 6.755
306 HB3 ALA 43 2HB ALA 43 -0.487 -10.574 8.184
307 H PHE 44 H PHE 44 -1.608 -6.357 7.858
308 HA PHE 44 HA PHE 44 -0.907 -5.704 5.009
309 HB2 PHE 44 1HB PHE 44 -3.341 -5.049 6.691
310 HB3 PHE 44 2HB PHE 44 -3.027 -4.337 5.108
311 HD1 PHE 44 HD2 PHE 44 -3.570 -7.548 6.898
312 HD2 PHE 44 HD1 PHE 44 -3.431 -5.559 3.094
313 HE1 PHE 44 HE2 PHE 44 -4.522 -9.562 5.810
314 HE2 PHE 44 HE1 PHE 44 -4.383 -7.575 2.005
315 HZ PHE 44 HZ PHE 44 -4.929 -9.576 3.365
316 H TYR 45 H TYR 45 -0.202 -3.623 4.537
317 HA TYR 45 HA TYR 45 0.596 -1.960 6.890
318 HB2 TYR 45 1HB TYR 45 1.630 -2.164 4.056
319 HB3 TYR 45 2HB TYR 45 2.092 -0.846 5.134
320 HD1 TYR 45 HD1 TYR 45 2.773 -1.677 7.602
321 HD2 TYR 45 HD2 TYR 45 3.034 -4.045 4.025
322 HE1 TYR 45 HE1 TYR 45 4.460 -3.125 8.685
323 HE2 TYR 45 HE2 TYR 45 4.731 -5.490 5.114
324 HH TYR 45 HH TYR 45 5.190 -5.973 7.932
325 H LYS 46 H LYS 46 -0.058 0.163 7.051
326 HA LYS 46 HA LYS 46 -2.306 0.961 5.297
327 HB2 LYS 46 1HB LYS 46 -2.401 1.196 7.792
328 HB3 LYS 46 2HB LYS 46 -1.114 2.395 7.687
329 HG2 LYS 46 1HG LYS 46 -2.550 3.737 6.138
330 HG3 LYS 46 2HG LYS 46 -3.846 2.571 6.388
331 HD2 LYS 46 1HD LYS 46 -2.512 4.087 8.647
332 HD3 LYS 46 2HD LYS 46 -3.980 4.641 7.850
333 HE2 LYS 46 1HE LYS 46 -4.961 2.329 8.419
334 HE3 LYS 46 2HE LYS 46 -3.587 2.148 9.510
335 HZ1 LYS 46 3HZ LYS 46 -5.838 3.234 10.286
336 HZ2 LYS 46 1HZ LYS 46 -5.109 4.632 9.661
337 HZ3 LYS 46 2HZ LYS 46 -4.337 3.751 10.892
338 H ILE 47 H ILE 47 -2.155 2.628 3.810
339 HA ILE 47 HA ILE 47 0.441 4.128 3.666
340 HB ILE 47 HB ILE 47 0.118 4.053 1.158
341 HG12 ILE 47 1HG1 ILE 47 -1.768 1.773 1.820
342 HG13 ILE 47 2HG1 ILE 47 -2.325 3.378 1.344
343 HG21 ILE 47 1HG2 ILE 47 0.847 1.582 1.057
344 HG22 ILE 47 2HG2 ILE 47 0.632 1.573 2.806
345 HG23 ILE 47 3HG2 ILE 47 1.807 2.661 2.067
346 HD11 ILE 47 3HD1 ILE 47 -1.290 3.205 -0.803
347 HD12 ILE 47 1HD1 ILE 47 -2.119 1.669 -0.547
348 HD13 ILE 47 2HD1 ILE 47 -0.373 1.777 -0.323
349 H GLU 48 H GLU 48 0.301 6.235 2.758
350 HA GLU 48 HA GLU 48 -2.245 7.564 3.369
351 HB2 GLU 48 1HB GLU 48 -0.014 8.535 3.965
352 HB3 GLU 48 2HB GLU 48 0.328 8.711 2.245
353 HG2 GLU 48 1HG GLU 48 -0.492 10.832 3.048
354 HG3 GLU 48 2HG GLU 48 -1.765 10.119 2.060
355 H TYR 49 H TYR 49 -3.801 7.316 1.820
356 HA TYR 49 HA TYR 49 -3.018 7.608 -1.061
357 HB2 TYR 49 1HB TYR 49 -4.106 5.490 -0.544
358 HB3 TYR 49 2HB TYR 49 -5.449 6.337 0.224
359 HD1 TYR 49 HD1 TYR 49 -3.582 6.150 -3.018
360 HD2 TYR 49 HD2 TYR 49 -7.325 6.935 -1.061
361 HE1 TYR 49 HE1 TYR 49 -4.692 6.379 -5.225
362 HE2 TYR 49 HE2 TYR 49 -8.432 7.160 -3.268
363 HH TYR 49 HH TYR 49 -8.195 6.939 -5.471
364 H LYS 50 H LYS 50 -3.573 9.444 -2.023
365 HA LYS 50 HA LYS 50 -4.399 11.666 -2.173
366 HB2 LYS 50 1HB LYS 50 -6.804 9.834 -2.173
367 HB3 LYS 50 2HB LYS 50 -6.914 11.552 -2.564
368 HG2 LYS 50 1HG LYS 50 -5.273 11.262 -4.372
369 HG3 LYS 50 2HG LYS 50 -5.128 9.549 -3.976
370 HD2 LYS 50 1HD LYS 50 -7.541 9.246 -4.459
371 HD3 LYS 50 2HD LYS 50 -7.655 10.950 -4.903
372 HE2 LYS 50 1HE LYS 50 -5.779 8.979 -6.241
373 HE3 LYS 50 2HE LYS 50 -7.368 9.410 -6.872
374 HZ1 LYS 50 3HZ LYS 50 -4.974 11.108 -6.577
375 HZ2 LYS 50 1HZ LYS 50 -6.520 11.802 -6.663
376 HZ3 LYS 50 2HZ LYS 50 -5.942 10.857 -7.951
377 H GLY 51 H GLY 51 -7.236 10.581 -0.409
378 HA2 GLY 51 1HA GLY 51 -6.558 12.510 1.798
379 HA3 GLY 51 2HA GLY 51 -8.188 12.294 1.166
380 H SER 52 H SER 52 -7.841 9.338 0.941
381 HA SER 52 HA SER 52 -8.310 8.730 3.829
382 HB2 SER 52 1HB SER 52 -9.022 7.184 1.324
383 HB3 SER 52 2HB SER 52 -9.379 6.663 2.970
384 HG SER 52 HG SER 52 -10.137 9.230 2.120
385 H HIS 53 H HIS 53 -7.718 6.303 4.329
386 HA HIS 53 HA HIS 53 -4.851 5.929 3.537
387 HB2 HIS 53 1HB HIS 53 -6.404 5.025 5.975
388 HB3 HIS 53 2HB HIS 53 -4.730 4.584 5.637
389 HD1 HIS 53 HD1 HIS 53 -6.863 7.425 6.779
390 HD2 HIS 53 HD2 HIS 53 -2.869 6.785 5.769
391 HE1 HIS 53 HE1 HIS 53 -5.585 9.456 7.588
392 H GLY 54 H GLY 54 -4.502 4.323 2.128
393 HA2 GLY 54 1HA GLY 54 -6.554 2.221 1.728
394 HA3 GLY 54 2HA GLY 54 -5.166 2.529 0.685
395 H TYR 55 H TYR 55 -5.900 -0.059 1.652
396 HA TYR 55 HA TYR 55 -3.631 -0.681 3.523
397 HB2 TYR 55 1HB TYR 55 -6.279 -2.079 3.080
398 HB3 TYR 55 2HB TYR 55 -4.958 -2.755 4.038
399 HD1 TYR 55 HD1 TYR 55 -7.461 -0.047 3.821
400 HD2 TYR 55 HD2 TYR 55 -4.334 -1.810 6.178
401 HE1 TYR 55 HE1 TYR 55 -8.161 1.318 5.771
402 HE2 TYR 55 HE2 TYR 55 -5.035 -0.448 8.128
403 HH TYR 55 HH TYR 55 -7.895 0.961 8.448
404 H VAL 56 H VAL 56 -2.119 -2.129 2.838
405 HA VAL 56 HA VAL 56 -2.634 -3.673 0.330
406 HB VAL 56 HB VAL 56 -0.235 -3.113 -0.322
407 HG11 VAL 56 1HG1 VAL 56 -2.232 -0.834 -0.168
408 HG12 VAL 56 2HG1 VAL 56 -2.225 -2.100 -1.395
409 HG13 VAL 56 3HG1 VAL 56 -0.889 -0.953 -1.306
410 HG21 VAL 56 3HG2 VAL 56 0.689 -1.037 0.649
411 HG22 VAL 56 1HG2 VAL 56 0.477 -2.269 1.893
412 HG23 VAL 56 2HG2 VAL 56 -0.678 -0.943 1.757
413 H ALA 57 H ALA 57 -1.836 -5.721 0.401
414 HA ALA 57 HA ALA 57 -0.993 -6.816 2.918
415 HB1 ALA 57 3HB ALA 57 -0.925 -7.982 0.121
416 HB2 ALA 57 1HB ALA 57 -2.226 -8.158 1.298
417 HB3 ALA 57 2HB ALA 57 -0.658 -8.906 1.599
418 H LYS 58 H LYS 58 1.049 -7.624 3.539
419 HA LYS 58 HA LYS 58 3.347 -6.143 2.704
420 HB2 LYS 58 1HB LYS 58 4.611 -7.761 4.087
421 HB3 LYS 58 2HB LYS 58 3.163 -7.196 4.920
422 HG2 LYS 58 1HG LYS 58 1.959 -9.228 4.306
423 HG3 LYS 58 2HG LYS 58 3.335 -9.798 3.362
424 HD2 LYS 58 1HD LYS 58 3.332 -10.882 5.552
425 HD3 LYS 58 2HD LYS 58 4.727 -9.813 5.410
426 HE2 LYS 58 1HE LYS 58 2.242 -8.611 6.557
427 HE3 LYS 58 2HE LYS 58 3.105 -9.770 7.566
428 HZ1 LYS 58 3HZ LYS 58 4.284 -7.948 8.101
429 HZ2 LYS 58 1HZ LYS 58 3.923 -7.135 6.658
430 HZ3 LYS 58 2HZ LYS 58 5.135 -8.325 6.680
431 H GLU 59 H GLU 59 1.784 -8.869 1.352
432 HA GLU 59 HA GLU 59 4.032 -10.159 0.107
433 HB2 GLU 59 1HB GLU 59 1.089 -10.084 -0.593
434 HB3 GLU 59 2HB GLU 59 2.261 -11.113 -1.417
435 HG2 GLU 59 1HG GLU 59 2.823 -12.216 0.694
436 HG3 GLU 59 2HG GLU 59 1.730 -11.143 1.569
437 H TYR 60 H TYR 60 1.921 -7.491 -0.887
438 HA TYR 60 HA TYR 60 3.292 -7.327 -3.516
439 HB2 TYR 60 1HB TYR 60 1.209 -5.432 -2.406
440 HB3 TYR 60 2HB TYR 60 1.620 -5.731 -4.096
441 HD1 TYR 60 HD2 TYR 60 1.550 -8.412 -4.671
442 HD2 TYR 60 HD1 TYR 60 -0.811 -6.392 -1.703
443 HE1 TYR 60 HE2 TYR 60 -0.136 -10.224 -4.778
444 HE2 TYR 60 HE1 TYR 60 -2.497 -8.207 -1.810
445 HH TYR 60 HH TYR 60 -3.221 -9.945 -3.528
446 H ILE 61 H ILE 61 3.832 -6.248 -0.388
447 HA ILE 61 HA ILE 61 5.271 -3.780 -1.332
448 HB ILE 61 HB ILE 61 4.411 -4.488 1.484
449 HG12 ILE 61 1HG1 ILE 61 2.421 -4.150 0.135
450 HG13 ILE 61 2HG1 ILE 61 2.677 -2.709 1.113
451 HG21 ILE 61 1HG2 ILE 61 4.943 -2.153 1.962
452 HG22 ILE 61 2HG2 ILE 61 5.368 -1.880 0.273
453 HG23 ILE 61 3HG2 ILE 61 6.355 -2.949 1.268
454 HD11 ILE 61 3HD1 ILE 61 2.234 -1.803 -1.006
455 HD12 ILE 61 1HD1 ILE 61 3.103 -3.086 -1.844
456 HD13 ILE 61 2HD1 ILE 61 3.994 -1.831 -0.984
457 H LYS 62 H LYS 62 7.420 -3.945 -1.403
458 HA LYS 62 HA LYS 62 8.810 -5.694 0.567
459 HB2 LYS 62 1HB LYS 62 10.124 -6.775 -1.129
460 HB3 LYS 62 2HB LYS 62 8.429 -6.985 -1.564
461 HG2 LYS 62 1HG LYS 62 8.654 -4.958 -3.058
462 HG3 LYS 62 2HG LYS 62 10.389 -4.995 -2.747
463 HD2 LYS 62 1HD LYS 62 8.816 -7.325 -3.879
464 HD3 LYS 62 2HD LYS 62 9.739 -6.186 -4.856
465 HE2 LYS 62 1HE LYS 62 11.746 -6.801 -3.351
466 HE3 LYS 62 2HE LYS 62 10.770 -8.176 -2.836
467 HZ1 LYS 62 3HZ LYS 62 11.102 -7.624 -5.701
468 HZ2 LYS 62 1HZ LYS 62 10.788 -9.095 -4.919
469 HZ3 LYS 62 2HZ LYS 62 12.342 -8.414 -4.850
470 H ASP 63 H ASP 63 11.243 -5.345 0.370
471 HA ASP 63 HA ASP 63 13.038 -3.877 0.593
472 HB2 ASP 63 1HB ASP 63 11.638 -2.619 -1.789
473 HB3 ASP 63 2HB ASP 63 13.198 -2.070 -1.180
474 H ILE 64 H ILE 64 10.875 -3.476 2.342
475 HA ILE 64 HA ILE 64 10.180 -0.655 2.458
476 HB ILE 64 HB ILE 64 9.945 -2.874 4.505
477 HG12 ILE 64 1HG1 ILE 64 7.814 -1.541 2.813
478 HG13 ILE 64 2HG1 ILE 64 8.623 -3.037 2.344
479 HG21 ILE 64 1HG2 ILE 64 8.247 -1.245 5.514
480 HG22 ILE 64 2HG2 ILE 64 8.983 -0.004 4.501
481 HG23 ILE 64 3HG2 ILE 64 9.945 -0.825 5.732
482 HD11 ILE 64 3HD1 ILE 64 7.740 -4.223 4.206
483 HD12 ILE 64 1HD1 ILE 64 6.387 -3.277 3.589
484 HD13 ILE 64 2HD1 ILE 64 7.258 -2.737 5.024
485 H LYS 65 H LYS 65 11.332 0.966 3.376
486 HA LYS 65 HA LYS 65 13.498 0.277 5.323
487 HB2 LYS 65 1HB LYS 65 13.719 2.055 2.882
488 HB3 LYS 65 2HB LYS 65 14.900 2.034 4.193
489 HG2 LYS 65 1HG LYS 65 15.329 -0.343 3.817
490 HG3 LYS 65 2HG LYS 65 14.076 -0.395 2.581
491 HD2 LYS 65 1HD LYS 65 16.102 -0.190 1.364
492 HD3 LYS 65 2HD LYS 65 15.410 1.430 1.363
493 HE2 LYS 65 1HE LYS 65 16.912 2.173 3.079
494 HE3 LYS 65 2HE LYS 65 17.441 0.527 3.426
495 HZ1 LYS 65 3HZ LYS 65 17.952 2.106 0.970
496 HZ2 LYS 65 1HZ LYS 65 18.285 0.448 1.101
497 HZ3 LYS 65 2HZ LYS 65 19.093 1.556 2.103
498 H ASP 66 H ASP 66 13.886 1.841 6.881
499 HA ASP 66 HA ASP 66 11.692 3.717 7.363
500 HB2 ASP 66 1HB ASP 66 12.658 2.385 9.192
501 HB3 ASP 66 2HB ASP 66 14.218 3.170 8.941
502 H GLU 67 H GLU 67 11.717 5.783 6.655
503 HA GLU 67 HA GLU 67 13.690 7.004 5.129
504 HB2 GLU 67 1HB GLU 67 11.680 8.256 7.014
505 HB3 GLU 67 2HB GLU 67 12.650 9.188 5.871
506 HG2 GLU 67 1HG GLU 67 11.734 7.900 3.999
507 HG3 GLU 67 2HG GLU 67 10.812 6.896 5.117
508 H VAL 68 H VAL 68 15.340 8.553 5.571
509 HA VAL 68 HA VAL 68 16.972 7.955 7.856
510 HB VAL 68 HB VAL 68 18.432 9.730 7.021
511 HG11 VAL 68 1HG1 VAL 68 18.714 8.924 4.702
512 HG12 VAL 68 2HG1 VAL 68 17.117 8.181 4.768
513 HG13 VAL 68 3HG1 VAL 68 18.412 7.581 5.805
514 HG21 VAL 68 3HG2 VAL 68 17.594 11.011 4.958
515 HG22 VAL 68 1HG2 VAL 68 16.904 11.495 6.507
516 HG23 VAL 68 2HG2 VAL 68 15.977 10.471 5.411
517 H LEU 69 H LEU 69 17.024 8.793 9.815
518 HA LEU 69 HA LEU 69 15.226 11.095 10.436
519 HB2 LEU 69 1HB LEU 69 15.087 8.767 11.603
520 HB3 LEU 69 2HB LEU 69 16.544 9.273 12.454
521 HG LEU 69 HG LEU 69 15.147 11.482 12.883
522 HD11 LEU 69 1HD1 LEU 69 12.737 10.973 13.216
523 HD12 LEU 69 2HD1 LEU 69 12.987 9.391 12.482
524 HD13 LEU 69 3HD1 LEU 69 13.205 10.853 11.522
525 HD21 LEU 69 3HD2 LEU 69 15.973 9.991 14.657
526 HD22 LEU 69 1HD2 LEU 69 14.626 8.888 14.372
527 HD23 LEU 69 2HD2 LEU 69 14.324 10.504 15.009
528 H GLU 70 H GLU 70 18.532 10.153 10.233
529 HA GLU 70 HA GLU 70 20.520 11.267 10.714
530 HB2 GLU 70 1HB GLU 70 18.648 13.656 10.648
531 HB3 GLU 70 2HB GLU 70 20.403 13.777 10.725
532 HG2 GLU 70 1HG GLU 70 18.893 12.298 8.557
533 HG3 GLU 70 2HG GLU 70 19.507 13.943 8.392
534 H HIS 71 H HIS 71 21.536 11.041 12.577
535 HA HIS 71 HA HIS 71 20.187 11.295 15.127
536 HB2 HIS 71 1HB HIS 71 23.087 10.835 14.387
537 HB3 HIS 71 2HB HIS 71 22.473 10.788 16.041
538 HD1 HIS 71 HD1 HIS 71 20.481 8.979 16.454
539 HD2 HIS 71 HD2 HIS 71 22.761 8.444 13.005
540 HE1 HIS 71 HE1 HIS 71 20.061 6.605 15.681
541 H HIS 72 H HIS 72 20.566 12.802 16.756
542 HA HIS 72 HA HIS 72 20.939 14.912 17.661
543 HB2 HIS 72 1HB HIS 72 23.386 14.814 15.867
544 HB3 HIS 72 2HB HIS 72 23.128 15.951 17.189
545 HD1 HIS 72 HD1 HIS 72 24.050 12.415 16.476
546 HD2 HIS 72 HD2 HIS 72 23.162 14.745 19.818
547 HE1 HIS 72 HE1 HIS 72 24.774 11.073 18.498
548 H HIS 73 H HIS 73 19.792 16.682 17.217
549 HA HIS 73 HA HIS 73 19.126 17.372 14.458
550 HB2 HIS 73 1HB HIS 73 17.473 17.521 16.305
551 HB3 HIS 73 2HB HIS 73 18.445 18.790 17.051
552 HD1 HIS 73 HD1 HIS 73 18.450 21.119 15.922
553 HD2 HIS 73 HD2 HIS 73 16.065 18.323 13.956
554 HE1 HIS 73 HE1 HIS 73 17.065 22.414 14.244
555 H HIS 74 H HIS 74 20.734 18.369 13.324
556 HA HIS 74 HA HIS 74 21.696 20.982 14.292
557 HB2 HIS 74 1HB HIS 74 23.554 18.656 13.704
558 HB3 HIS 74 2HB HIS 74 24.090 20.337 13.774
559 HD1 HIS 74 HD1 HIS 74 22.600 17.623 15.951
560 HD2 HIS 74 HD2 HIS 74 24.321 21.397 16.374
561 HE1 HIS 74 HE1 HIS 74 22.942 17.980 18.435
562 H HIS 75 H HIS 75 20.034 21.047 12.376
563 HA HIS 75 HA HIS 75 20.839 20.364 9.722
564 HB2 HIS 75 1HB HIS 75 18.524 21.005 10.371
565 HB3 HIS 75 2HB HIS 75 19.077 22.654 10.653
566 HD1 HIS 75 HD1 HIS 75 19.039 20.115 7.804
567 HD2 HIS 75 HD2 HIS 75 18.928 24.239 8.400
568 HE1 HIS 75 HE1 HIS 75 18.718 21.160 5.520
569 H HIS 76 H HIS 76 21.281 23.312 11.652
570 HA HIS 76 HA HIS 76 22.627 24.772 9.544
571 HB2 HIS 76 1HB HIS 76 23.232 26.343 11.375
572 HB3 HIS 76 2HB HIS 76 21.513 25.951 11.376
573 HD1 HIS 76 HD1 HIS 76 20.614 24.484 13.316
574 HD2 HIS 76 HD2 HIS 76 24.699 25.272 13.584
575 HE1 HIS 76 HE1 HIS 76 21.327 23.787 15.645
Start of MODEL 10
1 H1 ALA 1 1H ALA 1 8.537 8.072 12.730
2 H2 ALA 1 2H ALA 1 8.104 6.770 13.733
3 H3 ALA 1 3H ALA 1 7.339 6.982 12.230
4 HA ALA 1 HA ALA 1 10.244 6.458 12.515
5 HB1 ALA 1 3HB ALA 1 8.731 4.589 13.364
6 HB2 ALA 1 1HB ALA 1 9.787 4.150 12.021
7 HB3 ALA 1 2HB ALA 1 8.082 4.487 11.727
8 H GLU 2 H GLU 2 7.379 7.079 10.655
9 HA GLU 2 HA GLU 2 7.024 7.334 8.347
10 HB2 GLU 2 1HB GLU 2 9.714 8.666 8.778
11 HB3 GLU 2 2HB GLU 2 8.793 8.803 7.281
12 HG2 GLU 2 1HG GLU 2 8.106 10.707 8.477
13 HG3 GLU 2 2HG GLU 2 6.821 9.554 8.833
14 H LYS 3 H LYS 3 6.996 5.326 7.456
15 HA LYS 3 HA LYS 3 9.594 4.272 6.368
16 HB2 LYS 3 1HB LYS 3 7.126 2.767 7.271
17 HB3 LYS 3 2HB LYS 3 8.487 2.029 6.429
18 HG2 LYS 3 1HG LYS 3 10.002 2.766 8.241
19 HG3 LYS 3 2HG LYS 3 8.628 3.472 9.094
20 HD2 LYS 3 1HD LYS 3 7.560 1.251 9.224
21 HD3 LYS 3 2HD LYS 3 8.930 0.541 8.366
22 HE2 LYS 3 1HE LYS 3 10.441 1.251 10.183
23 HE3 LYS 3 2HE LYS 3 9.075 1.962 11.043
24 HZ1 LYS 3 3HZ LYS 3 9.482 -0.903 10.382
25 HZ2 LYS 3 1HZ LYS 3 8.039 -0.277 11.017
26 HZ3 LYS 3 2HZ LYS 3 9.472 -0.197 11.927
27 H THR 4 H THR 4 9.466 3.299 4.271
28 HA THR 4 HA THR 4 7.038 4.050 2.672
29 HB THR 4 HB THR 4 8.502 4.701 0.828
30 HG1 THR 4 HG1 THR 4 10.496 4.096 0.851
31 HG21 THR 4 3HG2 THR 4 9.111 5.990 3.497
32 HG22 THR 4 1HG2 THR 4 7.901 6.486 2.314
33 HG23 THR 4 2HG2 THR 4 9.617 6.679 1.954
34 H GLY 5 H GLY 5 6.193 2.352 1.686
35 HA2 GLY 5 1HA GLY 5 7.786 -0.153 1.416
36 HA3 GLY 5 2HA GLY 5 6.027 -0.039 1.374
37 H ILE 6 H ILE 6 8.250 -1.016 -0.560
38 HA ILE 6 HA ILE 6 7.618 0.623 -2.952
39 HB ILE 6 HB ILE 6 9.533 -1.675 -2.479
40 HG12 ILE 6 1HG1 ILE 6 11.220 0.119 -2.923
41 HG13 ILE 6 2HG1 ILE 6 9.907 1.289 -3.019
42 HG21 ILE 6 1HG2 ILE 6 10.359 -0.981 -4.808
43 HG22 ILE 6 2HG2 ILE 6 8.815 -0.146 -4.987
44 HG23 ILE 6 3HG2 ILE 6 8.850 -1.893 -4.752
45 HD11 ILE 6 3HD1 ILE 6 11.224 0.902 -0.742
46 HD12 ILE 6 1HD1 ILE 6 10.081 -0.431 -0.568
47 HD13 ILE 6 2HD1 ILE 6 9.492 1.224 -0.741
48 H VAL 7 H VAL 7 5.906 0.089 -4.140
49 HA VAL 7 HA VAL 7 4.552 -2.481 -3.829
50 HB VAL 7 HB VAL 7 4.056 -0.119 -5.661
51 HG11 VAL 7 1HG1 VAL 7 2.563 -2.720 -5.275
52 HG12 VAL 7 2HG1 VAL 7 3.128 -2.008 -6.785
53 HG13 VAL 7 3HG1 VAL 7 1.781 -1.275 -5.915
54 HG21 VAL 7 3HG2 VAL 7 3.721 0.130 -3.152
55 HG22 VAL 7 1HG2 VAL 7 2.481 -1.119 -3.272
56 HG23 VAL 7 2HG2 VAL 7 2.276 0.412 -4.125
57 H ASN 8 H ASN 8 4.742 -4.227 -5.139
58 HA ASN 8 HA ASN 8 6.070 -3.923 -7.792
59 HB2 ASN 8 1HB ASN 8 7.823 -4.552 -6.170
60 HB3 ASN 8 2HB ASN 8 6.872 -5.960 -5.693
61 HD21 ASN 8 2HD2 ASN 8 8.329 -7.571 -6.526
62 HD22 ASN 8 1HD2 ASN 8 8.655 -7.736 -8.183
63 H VAL 9 H VAL 9 4.433 -4.572 -9.074
64 HA VAL 9 HA VAL 9 3.293 -7.292 -8.619
65 HB VAL 9 HB VAL 9 1.053 -6.419 -9.339
66 HG11 VAL 9 1HG1 VAL 9 2.073 -5.013 -6.865
67 HG12 VAL 9 2HG1 VAL 9 1.792 -6.751 -6.925
68 HG13 VAL 9 3HG1 VAL 9 0.451 -5.634 -7.164
69 HG21 VAL 9 3HG2 VAL 9 1.625 -4.375 -10.453
70 HG22 VAL 9 1HG2 VAL 9 2.513 -3.777 -9.051
71 HG23 VAL 9 2HG2 VAL 9 0.756 -3.905 -8.994
72 H SER 10 H SER 10 2.638 -8.338 -10.541
73 HA SER 10 HA SER 10 4.172 -7.635 -12.900
74 HB2 SER 10 1HB SER 10 1.993 -9.689 -12.448
75 HB3 SER 10 2HB SER 10 2.961 -9.581 -13.915
76 HG SER 10 HG SER 10 3.561 -10.926 -11.810
77 H SER 11 H SER 11 0.723 -7.538 -12.060
78 HA SER 11 HA SER 11 0.155 -6.073 -14.610
79 HB2 SER 11 1HB SER 11 -1.658 -7.433 -12.605
80 HB3 SER 11 2HB SER 11 -2.239 -6.518 -13.991
81 HG SER 11 HG SER 11 -1.985 -8.855 -14.282
82 H SER 12 H SER 12 -1.438 -5.918 -11.436
83 HA SER 12 HA SER 12 -0.545 -3.166 -10.982
84 HB2 SER 12 1HB SER 12 -2.293 -2.766 -12.644
85 HB3 SER 12 2HB SER 12 -3.431 -3.736 -11.712
86 HG SER 12 HG SER 12 -2.104 -1.584 -10.490
87 H LEU 13 H LEU 13 -1.661 -2.268 -8.982
88 HA LEU 13 HA LEU 13 -2.293 -4.502 -7.085
89 HB2 LEU 13 1HB LEU 13 -0.149 -3.445 -6.572
90 HB3 LEU 13 2HB LEU 13 -0.904 -1.853 -6.582
91 HG LEU 13 HG LEU 13 -2.274 -2.444 -4.646
92 HD11 LEU 13 1HD1 LEU 13 -1.111 -5.178 -5.158
93 HD12 LEU 13 2HD1 LEU 13 -2.782 -4.723 -4.825
94 HD13 LEU 13 3HD1 LEU 13 -1.599 -4.731 -3.521
95 HD21 LEU 13 3HD2 LEU 13 -0.527 -2.587 -2.984
96 HD22 LEU 13 1HD2 LEU 13 0.091 -1.632 -4.332
97 HD23 LEU 13 2HD2 LEU 13 0.585 -3.315 -4.143
98 H ASN 14 H ASN 14 -4.215 -4.411 -6.091
99 HA ASN 14 HA ASN 14 -5.978 -2.090 -6.582
100 HB2 ASN 14 1HB ASN 14 -6.481 -4.830 -5.418
101 HB3 ASN 14 2HB ASN 14 -7.725 -3.594 -5.591
102 HD21 ASN 14 2HD2 ASN 14 -7.225 -6.304 -7.038
103 HD22 ASN 14 1HD2 ASN 14 -7.337 -5.895 -8.681
104 H VAL 15 H VAL 15 -6.690 -0.733 -5.013
105 HA VAL 15 HA VAL 15 -5.340 -0.843 -2.389
106 HB VAL 15 HB VAL 15 -7.250 1.239 -3.478
107 HG11 VAL 15 1HG1 VAL 15 -6.100 2.684 -1.819
108 HG12 VAL 15 2HG1 VAL 15 -5.162 1.292 -1.279
109 HG13 VAL 15 3HG1 VAL 15 -6.910 1.321 -1.049
110 HG21 VAL 15 3HG2 VAL 15 -5.227 2.468 -4.153
111 HG22 VAL 15 1HG2 VAL 15 -5.287 0.904 -4.966
112 HG23 VAL 15 2HG2 VAL 15 -4.217 1.138 -3.583
113 H ARG 16 H ARG 16 -6.322 -1.519 -0.569
114 HA ARG 16 HA ARG 16 -9.257 -2.102 -0.652
115 HB2 ARG 16 1HB ARG 16 -7.103 -3.213 1.166
116 HB3 ARG 16 2HB ARG 16 -8.794 -3.717 1.139
117 HG2 ARG 16 1HG ARG 16 -7.065 -3.859 -1.337
118 HG3 ARG 16 2HG ARG 16 -7.110 -5.177 -0.169
119 HD2 ARG 16 1HD ARG 16 -9.613 -5.242 -0.439
120 HD3 ARG 16 2HD ARG 16 -9.456 -4.064 -1.739
121 HE ARG 16 HE ARG 16 -7.722 -6.260 -2.276
122 HH11 ARG 16 1HH2 ARG 16 -11.060 -5.362 -2.131
123 HH12 ARG 16 2HH2 ARG 16 -11.555 -6.549 -3.291
124 HH21 ARG 16 1HH1 ARG 16 -8.363 -7.802 -3.775
125 HH22 ARG 16 2HH1 ARG 16 -10.032 -7.926 -4.218
126 H GLU 17 H GLU 17 -10.569 -1.012 0.645
127 HA GLU 17 HA GLU 17 -9.610 1.205 2.233
128 HB2 GLU 17 1HB GLU 17 -11.839 1.119 1.072
129 HB3 GLU 17 2HB GLU 17 -12.346 -0.102 2.236
130 HG2 GLU 17 1HG GLU 17 -13.149 2.056 2.994
131 HG3 GLU 17 2HG GLU 17 -11.859 1.535 4.078
132 H GLY 18 H GLY 18 -10.854 -2.029 2.979
133 HA2 GLY 18 1HA GLY 18 -10.458 -1.566 5.884
134 HA3 GLY 18 2HA GLY 18 -11.227 -2.975 5.157
135 H ALA 19 H ALA 19 -9.528 -3.627 7.025
136 HA ALA 19 HA ALA 19 -6.806 -4.011 5.956
137 HB1 ALA 19 3HB ALA 19 -6.391 -5.089 8.159
138 HB2 ALA 19 1HB ALA 19 -8.103 -4.914 8.548
139 HB3 ALA 19 2HB ALA 19 -7.098 -3.482 8.340
140 H SER 20 H SER 20 -8.875 -5.232 4.435
141 HA SER 20 HA SER 20 -7.938 -8.028 4.545
142 HB2 SER 20 1HB SER 20 -10.329 -8.867 4.403
143 HB3 SER 20 2HB SER 20 -9.850 -8.238 5.978
144 HG SER 20 HG SER 20 -11.452 -7.049 3.978
145 H THR 21 H THR 21 -8.376 -9.169 2.573
146 HA THR 21 HA THR 21 -8.315 -7.492 0.213
147 HB THR 21 HB THR 21 -8.324 -9.669 -1.011
148 HG1 THR 21 HG1 THR 21 -8.310 -10.954 1.480
149 HG21 THR 21 3HG2 THR 21 -6.226 -8.728 -0.040
150 HG22 THR 21 1HG2 THR 21 -6.210 -10.489 -0.127
151 HG23 THR 21 2HG2 THR 21 -6.509 -9.685 1.414
152 H SER 22 H SER 22 -10.781 -9.242 1.941
153 HA SER 22 HA SER 22 -12.757 -9.055 -0.221
154 HB2 SER 22 1HB SER 22 -14.276 -10.079 1.385
155 HB3 SER 22 2HB SER 22 -12.729 -10.914 1.480
156 HG SER 22 HG SER 22 -12.471 -8.981 3.152
157 H SER 23 H SER 23 -11.430 -6.897 1.913
158 HA SER 23 HA SER 23 -13.527 -5.409 3.034
159 HB2 SER 23 1HB SER 23 -11.241 -4.806 3.506
160 HB3 SER 23 2HB SER 23 -10.924 -4.486 1.802
161 HG SER 23 HG SER 23 -12.112 -2.672 1.908
162 H LYS 24 H LYS 24 -11.976 -3.600 0.521
163 HA LYS 24 HA LYS 24 -14.088 -3.799 -1.443
164 HB2 LYS 24 1HB LYS 24 -15.311 -2.583 0.337
165 HB3 LYS 24 2HB LYS 24 -14.088 -1.312 0.286
166 HG2 LYS 24 1HG LYS 24 -14.623 -0.858 -2.063
167 HG3 LYS 24 2HG LYS 24 -15.798 -2.174 -2.068
168 HD2 LYS 24 1HD LYS 24 -17.096 -1.011 -0.317
169 HD3 LYS 24 2HD LYS 24 -15.927 0.310 -0.335
170 HE2 LYS 24 1HE LYS 24 -16.438 0.739 -2.710
171 HE3 LYS 24 2HE LYS 24 -17.605 -0.584 -2.698
172 HZ1 LYS 24 3HZ LYS 24 -18.111 1.163 -0.542
173 HZ2 LYS 24 1HZ LYS 24 -19.123 0.756 -1.840
174 HZ3 LYS 24 2HZ LYS 24 -18.041 2.058 -1.986
175 H VAL 25 H VAL 25 -13.287 -3.101 -3.336
176 HA VAL 25 HA VAL 25 -10.633 -1.857 -3.410
177 HB VAL 25 HB VAL 25 -12.550 -2.700 -5.603
178 HG11 VAL 25 1HG1 VAL 25 -11.163 -0.991 -6.533
179 HG12 VAL 25 2HG1 VAL 25 -10.424 -2.518 -7.014
180 HG13 VAL 25 3HG1 VAL 25 -9.739 -1.587 -5.683
181 HG21 VAL 25 3HG2 VAL 25 -10.122 -3.954 -4.301
182 HG22 VAL 25 1HG2 VAL 25 -10.703 -4.468 -5.886
183 HG23 VAL 25 2HG2 VAL 25 -11.740 -4.635 -4.469
184 H ILE 26 H ILE 26 -10.225 0.255 -3.755
185 HA ILE 26 HA ILE 26 -12.501 2.063 -4.499
186 HB ILE 26 HB ILE 26 -11.329 3.808 -3.183
187 HG12 ILE 26 1HG1 ILE 26 -9.510 1.552 -2.267
188 HG13 ILE 26 2HG1 ILE 26 -9.026 2.783 -3.433
189 HG21 ILE 26 1HG2 ILE 26 -11.768 2.786 -0.939
190 HG22 ILE 26 2HG2 ILE 26 -11.930 1.217 -1.728
191 HG23 ILE 26 3HG2 ILE 26 -13.071 2.511 -2.096
192 HD11 ILE 26 3HD1 ILE 26 -9.874 3.239 -0.560
193 HD12 ILE 26 1HD1 ILE 26 -9.600 4.535 -1.725
194 HD13 ILE 26 2HD1 ILE 26 -8.267 3.486 -1.242
195 H GLY 27 H GLY 27 -9.497 0.813 -5.454
196 HA2 GLY 27 1HA GLY 27 -9.421 2.168 -7.916
197 HA3 GLY 27 2HA GLY 27 -8.435 3.130 -6.815
198 H SER 28 H SER 28 -6.883 2.341 -8.644
199 HA SER 28 HA SER 28 -5.477 -0.104 -7.648
200 HB2 SER 28 1HB SER 28 -6.018 0.655 -10.522
201 HB3 SER 28 2HB SER 28 -4.877 -0.594 -10.035
202 HG SER 28 HG SER 28 -6.670 -1.577 -8.910
203 H LEU 29 H LEU 29 -3.193 -0.096 -8.043
204 HA LEU 29 HA LEU 29 -2.039 2.629 -8.552
205 HB2 LEU 29 1HB LEU 29 -1.078 0.520 -6.600
206 HB3 LEU 29 2HB LEU 29 -0.308 2.081 -6.886
207 HG LEU 29 HG LEU 29 -3.140 1.690 -5.870
208 HD11 LEU 29 1HD1 LEU 29 -0.623 2.604 -4.443
209 HD12 LEU 29 2HD1 LEU 29 -1.440 1.059 -4.201
210 HD13 LEU 29 3HD1 LEU 29 -2.239 2.562 -3.741
211 HD21 LEU 29 3HD2 LEU 29 -2.662 4.247 -5.329
212 HD22 LEU 29 1HD2 LEU 29 -3.213 3.770 -6.933
213 HD23 LEU 29 2HD2 LEU 29 -1.503 4.095 -6.650
214 H SER 30 H SER 30 -0.120 2.715 -9.671
215 HA SER 30 HA SER 30 0.339 0.574 -11.569
216 HB2 SER 30 1HB SER 30 0.635 2.878 -12.263
217 HB3 SER 30 2HB SER 30 1.844 3.138 -11.010
218 HG SER 30 HG SER 30 2.706 1.072 -12.270
219 H GLY 31 H GLY 31 2.371 -0.496 -11.898
220 HA2 GLY 31 1HA GLY 31 3.450 -1.673 -9.516
221 HA3 GLY 31 2HA GLY 31 4.083 -1.893 -11.142
222 H ASN 32 H ASN 32 5.634 -1.593 -8.765
223 HA ASN 32 HA ASN 32 7.509 -0.455 -7.969
224 HB2 ASN 32 1HB ASN 32 7.405 0.631 -10.801
225 HB3 ASN 32 2HB ASN 32 8.716 0.981 -9.681
226 HD21 ASN 32 2HD2 ASN 32 8.571 -1.778 -8.444
227 HD22 ASN 32 1HD2 ASN 32 9.255 -2.813 -9.602
228 H THR 33 H THR 33 4.871 0.676 -7.500
229 HA THR 33 HA THR 33 5.326 3.609 -7.629
230 HB THR 33 HB THR 33 2.940 1.958 -6.769
231 HG1 THR 33 HG1 THR 33 3.756 2.468 -9.084
232 HG21 THR 33 3HG2 THR 33 3.465 4.929 -6.712
233 HG22 THR 33 1HG2 THR 33 2.776 3.908 -5.450
234 HG23 THR 33 2HG2 THR 33 1.828 4.295 -6.884
235 H LYS 34 H LYS 34 6.153 4.681 -5.974
236 HA LYS 34 HA LYS 34 6.733 3.363 -3.433
237 HB2 LYS 34 1HB LYS 34 8.288 4.991 -4.506
238 HB3 LYS 34 2HB LYS 34 7.090 6.260 -4.253
239 HG2 LYS 34 1HG LYS 34 7.198 5.914 -1.827
240 HG3 LYS 34 2HG LYS 34 8.346 4.596 -2.051
241 HD2 LYS 34 1HD LYS 34 9.947 6.168 -3.092
242 HD3 LYS 34 2HD LYS 34 8.803 7.488 -2.849
243 HE2 LYS 34 1HE LYS 34 10.426 7.525 -1.038
244 HE3 LYS 34 2HE LYS 34 8.869 7.017 -0.387
245 HZ1 LYS 34 3HZ LYS 34 11.271 5.397 -0.920
246 HZ2 LYS 34 1HZ LYS 34 9.742 4.664 -0.881
247 HZ3 LYS 34 2HZ LYS 34 10.326 5.481 0.490
248 H VAL 35 H VAL 35 5.549 3.508 -1.592
249 HA VAL 35 HA VAL 35 3.397 5.592 -1.429
250 HB VAL 35 HB VAL 35 2.026 3.833 -0.219
251 HG11 VAL 35 1HG1 VAL 35 1.470 4.509 -2.476
252 HG12 VAL 35 2HG1 VAL 35 1.330 2.754 -2.379
253 HG13 VAL 35 3HG1 VAL 35 2.742 3.484 -3.142
254 HG21 VAL 35 3HG2 VAL 35 3.922 2.255 0.181
255 HG22 VAL 35 1HG2 VAL 35 4.017 1.969 -1.557
256 HG23 VAL 35 2HG2 VAL 35 2.576 1.491 -0.661
257 H THR 36 H THR 36 3.321 6.662 0.439
258 HA THR 36 HA THR 36 5.411 6.208 2.424
259 HB THR 36 HB THR 36 3.097 8.162 2.463
260 HG1 THR 36 HG1 THR 36 4.939 8.045 0.731
261 HG21 THR 36 3HG2 THR 36 4.108 7.921 4.649
262 HG22 THR 36 1HG2 THR 36 4.669 9.439 3.948
263 HG23 THR 36 2HG2 THR 36 5.726 8.027 3.957
264 H ILE 37 H ILE 37 5.220 5.039 4.219
265 HA ILE 37 HA ILE 37 2.534 4.022 5.023
266 HB ILE 37 HB ILE 37 5.340 3.075 5.661
267 HG12 ILE 37 1HG1 ILE 37 3.122 1.703 4.120
268 HG13 ILE 37 2HG1 ILE 37 4.370 2.676 3.342
269 HG21 ILE 37 1HG2 ILE 37 2.623 2.122 6.587
270 HG22 ILE 37 2HG2 ILE 37 4.004 2.585 7.581
271 HG23 ILE 37 3HG2 ILE 37 4.057 1.095 6.639
272 HD11 ILE 37 3HD1 ILE 37 6.111 1.212 4.116
273 HD12 ILE 37 1HD1 ILE 37 4.853 0.186 3.429
274 HD13 ILE 37 2HD1 ILE 37 4.997 0.353 5.179
275 H VAL 38 H VAL 38 1.618 4.894 6.768
276 HA VAL 38 HA VAL 38 3.317 6.360 8.754
277 HB VAL 38 HB VAL 38 1.232 7.608 9.300
278 HG11 VAL 38 1HG1 VAL 38 2.697 8.656 7.727
279 HG12 VAL 38 2HG1 VAL 38 1.075 8.802 7.051
280 HG13 VAL 38 3HG1 VAL 38 2.184 7.580 6.428
281 HG21 VAL 38 3HG2 VAL 38 -0.385 5.857 8.611
282 HG22 VAL 38 1HG2 VAL 38 0.091 6.087 6.927
283 HG23 VAL 38 2HG2 VAL 38 -0.716 7.389 7.803
284 H GLY 39 H GLY 39 1.764 3.484 8.272
285 HA2 GLY 39 1HA GLY 39 1.893 2.757 11.055
286 HA3 GLY 39 2HA GLY 39 0.215 3.029 10.587
287 H GLU 40 H GLU 40 0.648 0.567 11.367
288 HA GLU 40 HA GLU 40 0.543 -1.032 8.864
289 HB2 GLU 40 1HB GLU 40 1.998 -2.778 9.834
290 HB3 GLU 40 2HB GLU 40 2.866 -1.252 9.659
291 HG2 GLU 40 1HG GLU 40 2.429 -0.747 12.054
292 HG3 GLU 40 2HG GLU 40 1.610 -2.299 12.218
293 H GLU 41 H GLU 41 -0.599 -3.045 9.155
294 HA GLU 41 HA GLU 41 -1.892 -3.551 11.751
295 HB2 GLU 41 1HB GLU 41 -3.352 -1.844 10.698
296 HB3 GLU 41 2HB GLU 41 -3.544 -2.894 9.294
297 HG2 GLU 41 1HG GLU 41 -4.558 -4.629 10.696
298 HG3 GLU 41 2HG GLU 41 -4.305 -3.641 12.134
299 H GLY 42 H GLY 42 -1.352 -5.644 11.891
300 HA2 GLY 42 1HA GLY 42 -1.271 -7.931 11.429
301 HA3 GLY 42 2HA GLY 42 -2.637 -7.652 10.358
302 H ALA 43 H ALA 43 -2.099 -8.761 8.565
303 HA ALA 43 HA ALA 43 0.648 -8.700 7.494
304 HB1 ALA 43 3HB ALA 43 -1.842 -10.025 6.382
305 HB2 ALA 43 1HB ALA 43 -0.726 -10.795 7.507
306 HB3 ALA 43 2HB ALA 43 -0.178 -10.344 5.891
307 H PHE 44 H PHE 44 -1.065 -6.262 7.568
308 HA PHE 44 HA PHE 44 -0.899 -5.596 4.655
309 HB2 PHE 44 1HB PHE 44 -3.197 -4.968 6.521
310 HB3 PHE 44 2HB PHE 44 -2.983 -4.234 4.931
311 HD1 PHE 44 HD2 PHE 44 -3.425 -7.484 6.694
312 HD2 PHE 44 HD1 PHE 44 -3.568 -5.399 2.943
313 HE1 PHE 44 HE2 PHE 44 -4.470 -9.466 5.633
314 HE2 PHE 44 HE1 PHE 44 -4.610 -7.381 1.880
315 HZ PHE 44 HZ PHE 44 -5.064 -9.413 3.226
316 H TYR 45 H TYR 45 -0.394 -3.426 4.238
317 HA TYR 45 HA TYR 45 0.730 -1.936 6.576
318 HB2 TYR 45 1HB TYR 45 1.508 -2.181 3.687
319 HB3 TYR 45 2HB TYR 45 1.900 -0.682 4.525
320 HD1 TYR 45 HD1 TYR 45 2.844 -1.129 7.035
321 HD2 TYR 45 HD2 TYR 45 3.174 -3.825 3.705
322 HE1 TYR 45 HE1 TYR 45 4.784 -2.216 8.114
323 HE2 TYR 45 HE2 TYR 45 5.123 -4.908 4.783
324 HH TYR 45 HH TYR 45 6.007 -5.184 7.125
325 H LYS 46 H LYS 46 0.275 0.203 6.858
326 HA LYS 46 HA LYS 46 -2.184 1.191 5.505
327 HB2 LYS 46 1HB LYS 46 -2.072 1.097 7.994
328 HB3 LYS 46 2HB LYS 46 -0.733 2.243 7.951
329 HG2 LYS 46 1HG LYS 46 -2.221 3.858 6.745
330 HG3 LYS 46 2HG LYS 46 -3.553 2.722 6.946
331 HD2 LYS 46 1HD LYS 46 -1.944 3.835 9.258
332 HD3 LYS 46 2HD LYS 46 -3.454 4.548 8.695
333 HE2 LYS 46 1HE LYS 46 -4.467 2.192 9.012
334 HE3 LYS 46 2HE LYS 46 -3.015 1.834 9.943
335 HZ1 LYS 46 3HZ LYS 46 -5.062 2.744 11.153
336 HZ2 LYS 46 1HZ LYS 46 -4.595 4.247 10.520
337 HZ3 LYS 46 2HZ LYS 46 -3.537 3.388 11.535
338 H ILE 47 H ILE 47 -1.978 2.707 3.961
339 HA ILE 47 HA ILE 47 0.419 4.502 3.986
340 HB ILE 47 HB ILE 47 0.325 4.386 1.466
341 HG12 ILE 47 1HG1 ILE 47 -1.368 1.925 2.016
342 HG13 ILE 47 2HG1 ILE 47 -2.019 3.448 1.409
343 HG21 ILE 47 1HG2 ILE 47 2.053 3.193 2.645
344 HG22 ILE 47 2HG2 ILE 47 1.419 2.106 1.410
345 HG23 ILE 47 3HG2 ILE 47 0.935 1.906 3.094
346 HD11 ILE 47 3HD1 ILE 47 -0.300 3.261 -0.482
347 HD12 ILE 47 1HD1 ILE 47 -1.634 2.107 -0.529
348 HD13 ILE 47 2HD1 ILE 47 -0.048 1.599 0.051
349 H GLU 48 H GLU 48 0.098 6.539 2.924
350 HA GLU 48 HA GLU 48 -2.646 7.558 3.329
351 HB2 GLU 48 1HB GLU 48 -0.695 8.836 4.169
352 HB3 GLU 48 2HB GLU 48 -0.115 9.015 2.512
353 HG2 GLU 48 1HG GLU 48 -2.148 10.235 1.901
354 HG3 GLU 48 2HG GLU 48 -2.803 9.993 3.518
355 H TYR 49 H TYR 49 -3.935 6.983 1.636
356 HA TYR 49 HA TYR 49 -2.989 7.587 -1.144
357 HB2 TYR 49 1HB TYR 49 -3.625 5.251 -0.816
358 HB3 TYR 49 2HB TYR 49 -5.189 5.747 -0.169
359 HD1 TYR 49 HD2 TYR 49 -3.013 6.072 -3.195
360 HD2 TYR 49 HD1 TYR 49 -7.012 6.088 -1.626
361 HE1 TYR 49 HE2 TYR 49 -3.919 6.200 -5.501
362 HE2 TYR 49 HE1 TYR 49 -7.916 6.213 -3.933
363 HH TYR 49 HH TYR 49 -7.427 6.147 -6.102
364 H LYS 50 H LYS 50 -3.759 9.423 -1.927
365 HA LYS 50 HA LYS 50 -5.118 11.304 -2.235
366 HB2 LYS 50 1HB LYS 50 -7.357 9.308 -1.800
367 HB3 LYS 50 2HB LYS 50 -7.440 10.819 -2.708
368 HG2 LYS 50 1HG LYS 50 -5.640 8.480 -3.416
369 HG3 LYS 50 2HG LYS 50 -7.184 8.825 -4.194
370 HD2 LYS 50 1HD LYS 50 -6.187 11.170 -4.681
371 HD3 LYS 50 2HD LYS 50 -4.633 10.442 -4.284
372 HE2 LYS 50 1HE LYS 50 -4.975 8.725 -6.006
373 HE3 LYS 50 2HE LYS 50 -6.542 9.428 -6.406
374 HZ1 LYS 50 3HZ LYS 50 -5.551 11.355 -7.222
375 HZ2 LYS 50 1HZ LYS 50 -4.561 10.113 -7.815
376 HZ3 LYS 50 2HZ LYS 50 -4.059 11.030 -6.476
377 H GLY 51 H GLY 51 -4.276 10.639 0.494
378 HA2 GLY 51 1HA GLY 51 -4.571 11.957 2.471
379 HA3 GLY 51 2HA GLY 51 -6.181 12.410 1.907
380 H SER 52 H SER 52 -6.687 9.482 1.286
381 HA SER 52 HA SER 52 -7.724 8.801 3.958
382 HB2 SER 52 1HB SER 52 -8.113 7.697 1.190
383 HB3 SER 52 2HB SER 52 -8.664 6.791 2.597
384 HG SER 52 HG SER 52 -10.352 8.053 2.258
385 H HIS 53 H HIS 53 -7.497 6.529 4.746
386 HA HIS 53 HA HIS 53 -4.653 5.693 4.567
387 HB2 HIS 53 1HB HIS 53 -6.893 4.875 6.435
388 HB3 HIS 53 2HB HIS 53 -5.233 4.295 6.548
389 HD1 HIS 53 HD1 HIS 53 -3.379 6.324 6.754
390 HD2 HIS 53 HD2 HIS 53 -7.304 7.246 7.812
391 HE1 HIS 53 HE1 HIS 53 -3.268 8.438 8.144
392 H GLY 54 H GLY 54 -4.418 4.451 2.767
393 HA2 GLY 54 1HA GLY 54 -6.413 2.390 2.071
394 HA3 GLY 54 2HA GLY 54 -4.982 2.811 1.132
395 H TYR 55 H TYR 55 -5.978 0.174 2.060
396 HA TYR 55 HA TYR 55 -3.605 -0.706 3.677
397 HB2 TYR 55 1HB TYR 55 -6.370 -1.918 3.434
398 HB3 TYR 55 2HB TYR 55 -5.027 -2.658 4.308
399 HD1 TYR 55 HD1 TYR 55 -7.335 0.239 4.207
400 HD2 TYR 55 HD2 TYR 55 -4.285 -1.808 6.434
401 HE1 TYR 55 HE1 TYR 55 -7.847 1.635 6.190
402 HE2 TYR 55 HE2 TYR 55 -4.797 -0.412 8.418
403 HH TYR 55 HH TYR 55 -6.223 1.075 9.299
404 H VAL 56 H VAL 56 -2.264 -2.160 2.753
405 HA VAL 56 HA VAL 56 -3.163 -3.622 0.302
406 HB VAL 56 HB VAL 56 -0.865 -3.159 -0.659
407 HG11 VAL 56 1HG1 VAL 56 -2.774 -0.856 -0.172
408 HG12 VAL 56 2HG1 VAL 56 -2.836 -2.009 -1.504
409 HG13 VAL 56 3HG1 VAL 56 -1.506 -0.855 -1.397
410 HG21 VAL 56 3HG2 VAL 56 0.203 -2.430 1.452
411 HG22 VAL 56 1HG2 VAL 56 -0.881 -1.040 1.518
412 HG23 VAL 56 2HG2 VAL 56 0.308 -1.170 0.222
413 H ALA 57 H ALA 57 -2.403 -5.678 0.155
414 HA ALA 57 HA ALA 57 -1.413 -6.998 2.482
415 HB1 ALA 57 3HB ALA 57 -1.035 -8.928 0.887
416 HB2 ALA 57 1HB ALA 57 -1.523 -7.848 -0.417
417 HB3 ALA 57 2HB ALA 57 -2.664 -8.254 0.862
418 H LYS 58 H LYS 58 0.608 -7.741 3.021
419 HA LYS 58 HA LYS 58 2.882 -6.191 2.257
420 HB2 LYS 58 1HB LYS 58 2.690 -8.880 3.640
421 HB3 LYS 58 2HB LYS 58 4.171 -7.932 3.520
422 HG2 LYS 58 1HG LYS 58 3.082 -6.072 4.713
423 HG3 LYS 58 2HG LYS 58 1.595 -7.008 4.828
424 HD2 LYS 58 1HD LYS 58 2.779 -8.738 6.133
425 HD3 LYS 58 2HD LYS 58 4.269 -7.800 6.023
426 HE2 LYS 58 1HE LYS 58 1.728 -6.662 7.206
427 HE3 LYS 58 2HE LYS 58 2.925 -7.513 8.181
428 HZ1 LYS 58 3HZ LYS 58 2.995 -4.864 7.115
429 HZ2 LYS 58 1HZ LYS 58 4.382 -5.747 6.698
430 HZ3 LYS 58 2HZ LYS 58 3.951 -5.565 8.332
431 H GLU 59 H GLU 59 1.724 -9.362 1.189
432 HA GLU 59 HA GLU 59 3.928 -10.372 -0.163
433 HB2 GLU 59 1HB GLU 59 1.027 -10.382 -1.028
434 HB3 GLU 59 2HB GLU 59 2.278 -11.355 -1.805
435 HG2 GLU 59 1HG GLU 59 2.764 -12.477 0.315
436 HG3 GLU 59 2HG GLU 59 1.584 -11.463 1.146
437 H TYR 60 H TYR 60 2.301 -7.440 -0.883
438 HA TYR 60 HA TYR 60 3.591 -7.309 -3.594
439 HB2 TYR 60 1HB TYR 60 1.462 -5.503 -2.422
440 HB3 TYR 60 2HB TYR 60 2.015 -5.533 -4.096
441 HD1 TYR 60 HD2 TYR 60 2.024 -8.135 -5.053
442 HD2 TYR 60 HD1 TYR 60 -0.624 -6.501 -2.088
443 HE1 TYR 60 HE2 TYR 60 0.367 -9.891 -5.569
444 HE2 TYR 60 HE1 TYR 60 -2.288 -8.267 -2.611
445 HH TYR 60 HH TYR 60 -2.173 -10.130 -5.362
446 H ILE 61 H ILE 61 3.374 -5.807 -0.434
447 HA ILE 61 HA ILE 61 5.220 -3.633 -1.259
448 HB ILE 61 HB ILE 61 3.658 -4.209 1.264
449 HG12 ILE 61 1HG1 ILE 61 2.600 -2.074 0.739
450 HG13 ILE 61 2HG1 ILE 61 3.724 -1.807 -0.589
451 HG21 ILE 61 1HG2 ILE 61 4.671 -1.925 1.994
452 HG22 ILE 61 2HG2 ILE 61 5.940 -2.288 0.821
453 HG23 ILE 61 3HG2 ILE 61 5.664 -3.372 2.181
454 HD11 ILE 61 3HD1 ILE 61 1.960 -4.252 -0.515
455 HD12 ILE 61 1HD1 ILE 61 2.767 -3.518 -1.902
456 HD13 ILE 61 2HD1 ILE 61 1.376 -2.723 -1.169
457 H LYS 62 H LYS 62 7.356 -3.877 -1.052
458 HA LYS 62 HA LYS 62 8.464 -5.418 1.216
459 HB2 LYS 62 1HB LYS 62 9.879 -6.815 -0.186
460 HB3 LYS 62 2HB LYS 62 8.193 -7.072 -0.629
461 HG2 LYS 62 1HG LYS 62 8.465 -5.484 -2.522
462 HG3 LYS 62 2HG LYS 62 10.166 -5.290 -2.100
463 HD2 LYS 62 1HD LYS 62 10.393 -7.811 -2.328
464 HD3 LYS 62 2HD LYS 62 8.780 -7.807 -3.041
465 HE2 LYS 62 1HE LYS 62 11.104 -6.156 -4.074
466 HE3 LYS 62 2HE LYS 62 10.611 -7.708 -4.750
467 HZ1 LYS 62 3HZ LYS 62 9.660 -5.791 -5.932
468 HZ2 LYS 62 1HZ LYS 62 8.844 -5.335 -4.517
469 HZ3 LYS 62 2HZ LYS 62 8.469 -6.808 -5.275
470 H ASP 63 H ASP 63 10.957 -5.299 1.056
471 HA ASP 63 HA ASP 63 12.845 -3.946 1.172
472 HB2 ASP 63 1HB ASP 63 11.627 -2.923 -1.409
473 HB3 ASP 63 2HB ASP 63 13.199 -2.396 -0.811
474 H ILE 64 H ILE 64 10.980 -3.165 2.923
475 HA ILE 64 HA ILE 64 10.145 -0.407 2.652
476 HB ILE 64 HB ILE 64 10.443 -2.144 5.117
477 HG12 ILE 64 1HG1 ILE 64 7.960 -1.388 3.551
478 HG13 ILE 64 2HG1 ILE 64 8.838 -2.895 3.298
479 HG21 ILE 64 1HG2 ILE 64 8.721 -0.438 5.999
480 HG22 ILE 64 2HG2 ILE 64 9.225 0.585 4.654
481 HG23 ILE 64 3HG2 ILE 64 10.393 0.107 5.886
482 HD11 ILE 64 3HD1 ILE 64 7.097 -3.435 4.827
483 HD12 ILE 64 1HD1 ILE 64 7.382 -1.983 5.786
484 HD13 ILE 64 2HD1 ILE 64 8.551 -3.305 5.817
485 H LYS 65 H LYS 65 11.236 1.422 3.144
486 HA LYS 65 HA LYS 65 13.985 1.142 4.310
487 HB2 LYS 65 1HB LYS 65 13.741 1.980 1.928
488 HB3 LYS 65 2HB LYS 65 12.954 3.409 2.601
489 HG2 LYS 65 1HG LYS 65 14.920 3.939 3.918
490 HG3 LYS 65 2HG LYS 65 15.708 2.443 3.420
491 HD2 LYS 65 1HD LYS 65 14.784 4.333 1.271
492 HD3 LYS 65 2HD LYS 65 16.239 4.745 2.178
493 HE2 LYS 65 1HE LYS 65 15.857 2.019 0.932
494 HE3 LYS 65 2HE LYS 65 16.579 3.362 0.043
495 HZ1 LYS 65 3HZ LYS 65 18.456 2.592 0.973
496 HZ2 LYS 65 1HZ LYS 65 17.651 1.806 2.242
497 HZ3 LYS 65 2HZ LYS 65 17.938 3.478 2.327
498 H ASP 66 H ASP 66 14.422 2.171 6.144
499 HA ASP 66 HA ASP 66 12.300 3.685 7.503
500 HB2 ASP 66 1HB ASP 66 15.036 2.699 8.322
501 HB3 ASP 66 2HB ASP 66 14.049 3.714 9.373
502 H GLU 67 H GLU 67 12.128 5.809 7.205
503 HA GLU 67 HA GLU 67 14.026 7.439 5.859
504 HB2 GLU 67 1HB GLU 67 11.787 8.195 7.754
505 HB3 GLU 67 2HB GLU 67 12.656 9.343 6.734
506 HG2 GLU 67 1HG GLU 67 11.150 6.921 5.697
507 HG3 GLU 67 2HG GLU 67 10.509 8.563 5.710
508 H VAL 68 H VAL 68 15.731 8.612 6.544
509 HA VAL 68 HA VAL 68 16.534 8.342 9.396
510 HB VAL 68 HB VAL 68 18.058 7.645 7.475
511 HG11 VAL 68 1HG1 VAL 68 18.593 10.603 7.187
512 HG12 VAL 68 2HG1 VAL 68 17.450 9.766 6.136
513 HG13 VAL 68 3HG1 VAL 68 19.145 9.281 6.158
514 HG21 VAL 68 3HG2 VAL 68 20.058 8.893 8.539
515 HG22 VAL 68 1HG2 VAL 68 19.068 7.882 9.594
516 HG23 VAL 68 2HG2 VAL 68 18.857 9.631 9.596
517 H LEU 69 H LEU 69 16.335 10.041 10.713
518 HA LEU 69 HA LEU 69 15.637 12.704 9.602
519 HB2 LEU 69 1HB LEU 69 15.709 11.688 12.463
520 HB3 LEU 69 2HB LEU 69 15.060 13.244 11.945
521 HG LEU 69 HG LEU 69 14.026 10.539 11.026
522 HD11 LEU 69 1HD1 LEU 69 13.576 11.021 13.432
523 HD12 LEU 69 2HD1 LEU 69 12.102 10.985 12.464
524 HD13 LEU 69 3HD1 LEU 69 12.794 12.529 12.956
525 HD21 LEU 69 3HD2 LEU 69 13.451 12.026 9.304
526 HD22 LEU 69 1HD2 LEU 69 13.298 13.399 10.401
527 HD23 LEU 69 2HD2 LEU 69 12.048 12.156 10.361
528 H GLU 70 H GLU 70 18.384 11.043 10.512
529 HA GLU 70 HA GLU 70 19.870 12.938 12.017
530 HB2 GLU 70 1HB GLU 70 20.781 10.875 9.996
531 HB3 GLU 70 2HB GLU 70 21.885 11.788 11.027
532 HG2 GLU 70 1HG GLU 70 20.798 10.903 13.033
533 HG3 GLU 70 2HG GLU 70 19.613 10.052 12.043
534 H HIS 71 H HIS 71 20.945 14.769 11.474
535 HA HIS 71 HA HIS 71 20.346 16.120 9.005
536 HB2 HIS 71 1HB HIS 71 20.863 17.303 11.136
537 HB3 HIS 71 2HB HIS 71 22.522 16.718 11.034
538 HD1 HIS 71 HD1 HIS 71 20.084 18.693 8.861
539 HD2 HIS 71 HD2 HIS 71 24.172 18.444 9.639
540 HE1 HIS 71 HE1 HIS 71 21.184 20.531 7.509
541 H HIS 72 H HIS 72 23.184 14.396 10.214
542 HA HIS 72 HA HIS 72 24.878 15.006 7.972
543 HB2 HIS 72 1HB HIS 72 24.980 12.723 9.960
544 HB3 HIS 72 2HB HIS 72 26.266 13.114 8.817
545 HD1 HIS 72 HD1 HIS 72 27.363 15.552 9.084
546 HD2 HIS 72 HD2 HIS 72 24.988 14.297 12.275
547 HE1 HIS 72 HE1 HIS 72 27.908 17.079 11.030
548 H HIS 73 H HIS 73 25.337 13.803 6.141
549 HA HIS 73 HA HIS 73 23.582 11.448 5.556
550 HB2 HIS 73 1HB HIS 73 22.669 13.502 4.480
551 HB3 HIS 73 2HB HIS 73 24.207 13.713 3.643
552 HD1 HIS 73 HD1 HIS 73 24.849 11.900 1.843
553 HD2 HIS 73 HD2 HIS 73 21.011 11.484 3.415
554 HE1 HIS 73 HE1 HIS 73 23.625 10.283 0.326
555 H HIS 74 H HIS 74 24.405 10.184 3.722
556 HA HIS 74 HA HIS 74 26.150 8.796 2.985
557 HB2 HIS 74 1HB HIS 74 27.730 9.951 1.536
558 HB3 HIS 74 2HB HIS 74 26.122 10.644 1.325
559 HD1 HIS 74 HD1 HIS 74 29.212 11.318 3.476
560 HD2 HIS 74 HD2 HIS 74 26.139 13.387 1.566
561 HE1 HIS 74 HE1 HIS 74 29.683 13.781 3.825
562 H HIS 75 H HIS 75 28.929 9.389 2.787
563 HA HIS 75 HA HIS 75 29.772 9.751 5.632
564 HB2 HIS 75 1HB HIS 75 30.510 7.418 3.845
565 HB3 HIS 75 2HB HIS 75 31.234 7.751 5.418
566 HD1 HIS 75 HD1 HIS 75 29.410 7.898 7.464
567 HD2 HIS 75 HD2 HIS 75 28.187 5.907 4.011
568 HE1 HIS 75 HE1 HIS 75 27.405 6.498 8.117
569 H HIS 76 H HIS 76 31.874 10.516 5.872
570 HA HIS 76 HA HIS 76 33.659 10.834 3.573
571 HB2 HIS 76 1HB HIS 76 32.108 12.723 3.228
572 HB3 HIS 76 2HB HIS 76 32.403 13.269 4.878
573 HD1 HIS 76 HD1 HIS 76 34.467 12.473 1.765
574 HD2 HIS 76 HD2 HIS 76 34.480 15.082 5.016
575 HE1 HIS 76 HE1 HIS 76 36.430 14.036 1.422
Start of MODEL 11
1 H1 ALA 1 1H ALA 1 8.285 7.757 13.431
2 H2 ALA 1 2H ALA 1 7.066 6.856 12.662
3 H3 ALA 1 3H ALA 1 7.455 8.412 12.104
4 HA ALA 1 HA ALA 1 9.633 7.676 11.416
5 HB1 ALA 1 3HB ALA 1 8.658 5.002 12.464
6 HB2 ALA 1 1HB ALA 1 9.977 5.966 13.130
7 HB3 ALA 1 2HB ALA 1 10.136 5.237 11.532
8 H GLU 2 H GLU 2 8.321 8.461 9.616
9 HA GLU 2 HA GLU 2 6.424 6.770 8.261
10 HB2 GLU 2 1HB GLU 2 7.978 9.212 7.370
11 HB3 GLU 2 2HB GLU 2 6.744 8.429 6.380
12 HG2 GLU 2 1HG GLU 2 5.062 8.803 8.110
13 HG3 GLU 2 2HG GLU 2 6.282 9.491 9.183
14 H LYS 3 H LYS 3 6.709 5.373 6.550
15 HA LYS 3 HA LYS 3 9.452 5.027 5.424
16 HB2 LYS 3 1HB LYS 3 7.687 2.845 6.561
17 HB3 LYS 3 2HB LYS 3 9.128 2.544 5.589
18 HG2 LYS 3 1HG LYS 3 10.467 3.851 7.241
19 HG3 LYS 3 2HG LYS 3 9.026 4.015 8.240
20 HD2 LYS 3 1HD LYS 3 10.127 1.328 7.381
21 HD3 LYS 3 2HD LYS 3 10.605 2.116 8.882
22 HE2 LYS 3 1HE LYS 3 8.101 2.250 9.434
23 HE3 LYS 3 2HE LYS 3 7.857 1.129 8.094
24 HZ1 LYS 3 3HZ LYS 3 8.965 0.652 10.708
25 HZ2 LYS 3 1HZ LYS 3 9.877 -0.018 9.445
26 HZ3 LYS 3 2HZ LYS 3 8.238 -0.431 9.620
27 H THR 4 H THR 4 9.457 4.068 3.315
28 HA THR 4 HA THR 4 6.796 4.184 1.922
29 HB THR 4 HB THR 4 8.003 4.892 -0.060
30 HG1 THR 4 HG1 THR 4 10.009 3.695 1.123
31 HG21 THR 4 3HG2 THR 4 7.438 6.610 1.660
32 HG22 THR 4 1HG2 THR 4 8.864 7.041 0.713
33 HG23 THR 4 2HG2 THR 4 9.049 6.406 2.349
34 H GLY 5 H GLY 5 6.098 2.258 1.202
35 HA2 GLY 5 1HA GLY 5 8.006 -0.016 1.005
36 HA3 GLY 5 2HA GLY 5 6.248 -0.143 1.040
37 H ILE 6 H ILE 6 8.638 -0.817 -0.943
38 HA ILE 6 HA ILE 6 7.731 0.543 -3.377
39 HB ILE 6 HB ILE 6 9.778 -1.601 -2.783
40 HG12 ILE 6 1HG1 ILE 6 11.344 0.088 -3.542
41 HG13 ILE 6 2HG1 ILE 6 10.031 1.124 -4.095
42 HG21 ILE 6 1HG2 ILE 6 10.356 -1.335 -5.285
43 HG22 ILE 6 2HG2 ILE 6 8.727 -0.682 -5.466
44 HG23 ILE 6 3HG2 ILE 6 8.956 -2.333 -4.891
45 HD11 ILE 6 3HD1 ILE 6 11.086 1.705 -1.824
46 HD12 ILE 6 1HD1 ILE 6 10.269 0.269 -1.208
47 HD13 ILE 6 2HD1 ILE 6 9.327 1.601 -1.878
48 H VAL 7 H VAL 7 6.099 -0.144 -4.640
49 HA VAL 7 HA VAL 7 4.685 -2.619 -3.987
50 HB VAL 7 HB VAL 7 4.240 -0.529 -6.137
51 HG11 VAL 7 1HG1 VAL 7 3.253 -2.510 -6.995
52 HG12 VAL 7 2HG1 VAL 7 1.925 -1.676 -6.190
53 HG13 VAL 7 3HG1 VAL 7 2.723 -3.037 -5.399
54 HG21 VAL 7 3HG2 VAL 7 2.667 -1.125 -3.614
55 HG22 VAL 7 1HG2 VAL 7 2.462 0.249 -4.700
56 HG23 VAL 7 2HG2 VAL 7 3.915 0.117 -3.710
57 H ASN 8 H ASN 8 4.871 -4.537 -5.053
58 HA ASN 8 HA ASN 8 6.359 -4.606 -7.657
59 HB2 ASN 8 1HB ASN 8 7.843 -5.321 -5.797
60 HB3 ASN 8 2HB ASN 8 6.668 -6.558 -5.354
61 HD21 ASN 8 2HD2 ASN 8 8.574 -5.471 -8.222
62 HD22 ASN 8 1HD2 ASN 8 8.795 -7.033 -8.848
63 H VAL 9 H VAL 9 4.656 -5.082 -8.994
64 HA VAL 9 HA VAL 9 3.177 -7.624 -8.443
65 HB VAL 9 HB VAL 9 1.120 -6.553 -9.378
66 HG11 VAL 9 1HG1 VAL 9 0.473 -5.528 -7.339
67 HG12 VAL 9 2HG1 VAL 9 2.112 -4.968 -7.004
68 HG13 VAL 9 3HG1 VAL 9 1.721 -6.682 -6.876
69 HG21 VAL 9 3HG2 VAL 9 1.954 -4.727 -10.653
70 HG22 VAL 9 1HG2 VAL 9 2.915 -4.117 -9.307
71 HG23 VAL 9 2HG2 VAL 9 1.161 -3.975 -9.270
72 H SER 10 H SER 10 2.395 -8.662 -10.386
73 HA SER 10 HA SER 10 4.207 -8.243 -12.662
74 HB2 SER 10 1HB SER 10 3.239 -10.298 -13.536
75 HB3 SER 10 2HB SER 10 3.591 -10.525 -11.825
76 HG SER 10 HG SER 10 1.555 -10.994 -11.654
77 H SER 11 H SER 11 1.173 -7.105 -11.705
78 HA SER 11 HA SER 11 0.630 -6.115 -14.473
79 HB2 SER 11 1HB SER 11 -1.730 -6.637 -14.265
80 HB3 SER 11 2HB SER 11 -0.825 -8.115 -13.955
81 HG SER 11 HG SER 11 -2.262 -7.950 -12.308
82 H SER 12 H SER 12 -1.087 -5.882 -11.357
83 HA SER 12 HA SER 12 -0.214 -3.115 -10.962
84 HB2 SER 12 1HB SER 12 -2.575 -2.233 -11.007
85 HB3 SER 12 2HB SER 12 -1.955 -2.696 -12.589
86 HG SER 12 HG SER 12 -2.966 -4.832 -11.998
87 H LEU 13 H LEU 13 -1.232 -2.218 -8.925
88 HA LEU 13 HA LEU 13 -1.904 -4.439 -7.020
89 HB2 LEU 13 1HB LEU 13 0.236 -3.359 -6.491
90 HB3 LEU 13 2HB LEU 13 -0.535 -1.775 -6.516
91 HG LEU 13 HG LEU 13 -1.930 -2.381 -4.596
92 HD11 LEU 13 1HD1 LEU 13 -0.704 -5.094 -5.059
93 HD12 LEU 13 2HD1 LEU 13 -2.389 -4.672 -4.756
94 HD13 LEU 13 3HD1 LEU 13 -1.224 -4.635 -3.436
95 HD21 LEU 13 3HD2 LEU 13 0.489 -1.568 -4.334
96 HD22 LEU 13 1HD2 LEU 13 0.896 -3.243 -3.958
97 HD23 LEU 13 2HD2 LEU 13 -0.228 -2.357 -2.930
98 H ASN 14 H ASN 14 -3.843 -4.308 -6.017
99 HA ASN 14 HA ASN 14 -5.585 -1.996 -6.620
100 HB2 ASN 14 1HB ASN 14 -6.075 -4.715 -5.391
101 HB3 ASN 14 2HB ASN 14 -7.321 -3.469 -5.485
102 HD21 ASN 14 2HD2 ASN 14 -7.539 -5.970 -6.919
103 HD22 ASN 14 1HD2 ASN 14 -7.468 -5.626 -8.580
104 H VAL 15 H VAL 15 -6.519 -0.693 -5.017
105 HA VAL 15 HA VAL 15 -5.094 -0.699 -2.395
106 HB VAL 15 HB VAL 15 -6.782 1.387 -3.810
107 HG11 VAL 15 1HG1 VAL 15 -7.225 1.710 -1.493
108 HG12 VAL 15 2HG1 VAL 15 -5.930 2.846 -1.870
109 HG13 VAL 15 3HG1 VAL 15 -5.561 1.332 -1.043
110 HG21 VAL 15 3HG2 VAL 15 -4.466 1.027 -4.661
111 HG22 VAL 15 1HG2 VAL 15 -3.846 1.335 -3.039
112 HG23 VAL 15 2HG2 VAL 15 -4.667 2.618 -3.928
113 H ARG 16 H ARG 16 -6.172 -1.318 -0.580
114 HA ARG 16 HA ARG 16 -9.131 -1.784 -0.783
115 HB2 ARG 16 1HB ARG 16 -7.009 -3.084 0.947
116 HB3 ARG 16 2HB ARG 16 -8.740 -3.389 1.097
117 HG2 ARG 16 1HG ARG 16 -8.821 -4.160 -1.240
118 HG3 ARG 16 2HG ARG 16 -7.095 -3.834 -1.412
119 HD2 ARG 16 1HD ARG 16 -6.625 -5.465 0.398
120 HD3 ARG 16 2HD ARG 16 -8.349 -5.819 0.506
121 HE ARG 16 HE ARG 16 -6.537 -6.806 -1.539
122 HH11 ARG 16 1HH2 ARG 16 -9.754 -5.815 -0.797
123 HH12 ARG 16 2HH2 ARG 16 -10.481 -6.808 -2.016
124 HH21 ARG 16 1HH1 ARG 16 -7.468 -8.107 -3.133
125 HH22 ARG 16 2HH1 ARG 16 -9.188 -8.107 -3.337
126 H GLU 17 H GLU 17 -10.459 -0.785 0.667
127 HA GLU 17 HA GLU 17 -9.323 1.318 2.359
128 HB2 GLU 17 1HB GLU 17 -12.148 0.373 1.809
129 HB3 GLU 17 2HB GLU 17 -11.785 1.655 2.965
130 HG2 GLU 17 1HG GLU 17 -10.879 1.704 0.074
131 HG3 GLU 17 2HG GLU 17 -12.352 2.484 0.649
132 H GLY 18 H GLY 18 -10.834 -1.845 2.810
133 HA2 GLY 18 1HA GLY 18 -10.638 -1.562 5.764
134 HA3 GLY 18 2HA GLY 18 -11.446 -2.871 4.901
135 H ALA 19 H ALA 19 -9.888 -3.768 6.825
136 HA ALA 19 HA ALA 19 -7.168 -4.320 5.745
137 HB1 ALA 19 3HB ALA 19 -7.441 -3.677 8.141
138 HB2 ALA 19 1HB ALA 19 -6.731 -5.280 7.958
139 HB3 ALA 19 2HB ALA 19 -8.433 -5.114 8.390
140 H SER 20 H SER 20 -10.248 -5.620 5.582
141 HA SER 20 HA SER 20 -9.443 -8.452 5.668
142 HB2 SER 20 1HB SER 20 -11.667 -7.869 6.474
143 HB3 SER 20 2HB SER 20 -12.058 -7.098 4.940
144 HG SER 20 HG SER 20 -12.079 -9.059 3.959
145 H THR 21 H THR 21 -9.573 -9.849 3.819
146 HA THR 21 HA THR 21 -8.447 -8.774 1.418
147 HB THR 21 HB THR 21 -9.933 -11.402 1.649
148 HG1 THR 21 HG1 THR 21 -7.366 -11.745 2.016
149 HG21 THR 21 3HG2 THR 21 -7.618 -10.421 -0.040
150 HG22 THR 21 1HG2 THR 21 -9.238 -10.832 -0.605
151 HG23 THR 21 2HG2 THR 21 -8.169 -12.094 0.010
152 H SER 22 H SER 22 -11.760 -9.836 2.198
153 HA SER 22 HA SER 22 -12.803 -9.182 -0.427
154 HB2 SER 22 1HB SER 22 -14.966 -9.660 0.517
155 HB3 SER 22 2HB SER 22 -13.835 -10.825 1.203
156 HG SER 22 HG SER 22 -13.828 -9.709 3.086
157 H SER 23 H SER 23 -11.372 -7.111 1.392
158 HA SER 23 HA SER 23 -13.284 -5.098 2.083
159 HB2 SER 23 1HB SER 23 -10.326 -5.048 1.504
160 HB3 SER 23 2HB SER 23 -11.209 -3.571 1.878
161 HG SER 23 HG SER 23 -12.013 -4.971 3.739
162 H LYS 24 H LYS 24 -13.903 -3.213 0.936
163 HA LYS 24 HA LYS 24 -14.236 -3.560 -1.909
164 HB2 LYS 24 1HB LYS 24 -15.272 -1.311 -1.820
165 HB3 LYS 24 2HB LYS 24 -15.904 -2.374 -0.564
166 HG2 LYS 24 1HG LYS 24 -14.302 -1.371 1.051
167 HG3 LYS 24 2HG LYS 24 -13.765 -0.257 -0.208
168 HD2 LYS 24 1HD LYS 24 -16.099 0.578 -0.428
169 HD3 LYS 24 2HD LYS 24 -16.582 -0.484 0.896
170 HE2 LYS 24 1HE LYS 24 -14.523 1.735 1.071
171 HE3 LYS 24 2HE LYS 24 -16.158 1.794 1.726
172 HZ1 LYS 24 3HZ LYS 24 -13.951 -0.008 2.546
173 HZ2 LYS 24 1HZ LYS 24 -15.558 -0.219 3.045
174 HZ3 LYS 24 2HZ LYS 24 -14.713 1.189 3.481
175 H VAL 25 H VAL 25 -13.217 -2.511 -3.609
176 HA VAL 25 HA VAL 25 -10.612 -1.202 -2.955
177 HB VAL 25 HB VAL 25 -11.658 -2.564 -5.451
178 HG11 VAL 25 1HG1 VAL 25 -9.256 -2.133 -6.267
179 HG12 VAL 25 2HG1 VAL 25 -9.167 -0.907 -5.001
180 HG13 VAL 25 3HG1 VAL 25 -10.359 -0.757 -6.292
181 HG21 VAL 25 3HG2 VAL 25 -9.632 -4.010 -5.002
182 HG22 VAL 25 1HG2 VAL 25 -10.892 -4.121 -3.774
183 HG23 VAL 25 2HG2 VAL 25 -9.445 -3.161 -3.468
184 H ILE 26 H ILE 26 -10.332 0.927 -3.401
185 HA ILE 26 HA ILE 26 -12.549 2.389 -4.759
186 HB ILE 26 HB ILE 26 -11.378 4.409 -3.813
187 HG12 ILE 26 1HG1 ILE 26 -9.726 2.352 -2.312
188 HG13 ILE 26 2HG1 ILE 26 -9.120 3.239 -3.709
189 HG21 ILE 26 1HG2 ILE 26 -11.920 3.790 -1.399
190 HG22 ILE 26 2HG2 ILE 26 -12.247 2.158 -1.983
191 HG23 ILE 26 3HG2 ILE 26 -13.217 3.513 -2.563
192 HD11 ILE 26 3HD1 ILE 26 -10.295 4.679 -1.329
193 HD12 ILE 26 1HD1 ILE 26 -9.240 5.319 -2.589
194 HD13 ILE 26 2HD1 ILE 26 -8.594 4.213 -1.378
195 H GLY 27 H GLY 27 -9.534 1.073 -5.490
196 HA2 GLY 27 1HA GLY 27 -9.401 1.959 -8.127
197 HA3 GLY 27 2HA GLY 27 -8.507 3.170 -7.207
198 H SER 28 H SER 28 -6.604 2.423 -8.437
199 HA SER 28 HA SER 28 -5.206 0.262 -6.998
200 HB2 SER 28 1HB SER 28 -5.591 0.175 -10.007
201 HB3 SER 28 2HB SER 28 -4.585 -0.925 -9.070
202 HG SER 28 HG SER 28 -7.398 -0.569 -8.932
203 H LEU 29 H LEU 29 -2.866 0.173 -7.739
204 HA LEU 29 HA LEU 29 -1.931 2.830 -8.774
205 HB2 LEU 29 1HB LEU 29 -0.744 1.204 -6.502
206 HB3 LEU 29 2HB LEU 29 -0.052 2.684 -7.165
207 HG LEU 29 HG LEU 29 -2.809 2.467 -5.915
208 HD11 LEU 29 1HD1 LEU 29 -1.858 3.632 -4.010
209 HD12 LEU 29 2HD1 LEU 29 -0.299 3.770 -4.822
210 HD13 LEU 29 3HD1 LEU 29 -0.893 2.188 -4.317
211 HD21 LEU 29 3HD2 LEU 29 -2.336 5.091 -5.908
212 HD22 LEU 29 1HD2 LEU 29 -2.989 4.307 -7.343
213 HD23 LEU 29 2HD2 LEU 29 -1.269 4.686 -7.251
214 H SER 30 H SER 30 0.085 2.770 -9.903
215 HA SER 30 HA SER 30 0.423 0.387 -11.507
216 HB2 SER 30 1HB SER 30 2.371 1.698 -12.465
217 HB3 SER 30 2HB SER 30 0.813 2.516 -12.545
218 HG SER 30 HG SER 30 1.773 4.042 -11.479
219 H GLY 31 H GLY 31 2.518 -0.732 -11.770
220 HA2 GLY 31 1HA GLY 31 3.522 -1.704 -9.256
221 HA3 GLY 31 2HA GLY 31 4.167 -2.114 -10.842
222 H ASN 32 H ASN 32 5.849 -1.707 -8.671
223 HA ASN 32 HA ASN 32 7.842 -0.617 -8.129
224 HB2 ASN 32 1HB ASN 32 7.980 -0.547 -10.715
225 HB3 ASN 32 2HB ASN 32 7.475 1.136 -10.564
226 HD21 ASN 32 2HD2 ASN 32 10.112 0.290 -11.515
227 HD22 ASN 32 1HD2 ASN 32 11.253 0.878 -10.405
228 H THR 33 H THR 33 4.897 1.051 -8.536
229 HA THR 33 HA THR 33 5.722 3.673 -7.694
230 HB THR 33 HB THR 33 3.022 2.347 -7.309
231 HG1 THR 33 HG1 THR 33 3.728 4.044 -9.432
232 HG21 THR 33 3HG2 THR 33 3.972 5.218 -7.362
233 HG22 THR 33 1HG2 THR 33 3.144 4.379 -6.050
234 HG23 THR 33 2HG2 THR 33 2.275 4.768 -7.535
235 H LYS 34 H LYS 34 6.125 4.432 -5.655
236 HA LYS 34 HA LYS 34 6.056 2.474 -3.422
237 HB2 LYS 34 1HB LYS 34 7.409 4.172 -2.228
238 HB3 LYS 34 2HB LYS 34 8.133 3.738 -3.777
239 HG2 LYS 34 1HG LYS 34 7.049 5.739 -4.801
240 HG3 LYS 34 2HG LYS 34 6.451 6.197 -3.205
241 HD2 LYS 34 1HD LYS 34 8.749 6.339 -2.359
242 HD3 LYS 34 2HD LYS 34 9.373 5.830 -3.928
243 HE2 LYS 34 1HE LYS 34 9.415 8.333 -3.523
244 HE3 LYS 34 2HE LYS 34 8.576 7.830 -4.989
245 HZ1 LYS 34 3HZ LYS 34 7.275 8.437 -2.389
246 HZ2 LYS 34 1HZ LYS 34 6.481 7.995 -3.821
247 HZ3 LYS 34 2HZ LYS 34 7.312 9.474 -3.734
248 H VAL 35 H VAL 35 4.899 2.858 -1.506
249 HA VAL 35 HA VAL 35 2.904 5.102 -1.585
250 HB VAL 35 HB VAL 35 1.383 3.540 -0.331
251 HG11 VAL 35 1HG1 VAL 35 0.797 2.195 -2.354
252 HG12 VAL 35 2HG1 VAL 35 2.316 2.702 -3.091
253 HG13 VAL 35 3HG1 VAL 35 1.075 3.898 -2.721
254 HG21 VAL 35 3HG2 VAL 35 3.575 1.571 -1.053
255 HG22 VAL 35 1HG2 VAL 35 1.942 1.078 -0.613
256 HG23 VAL 35 2HG2 VAL 35 2.948 1.936 0.553
257 H THR 36 H THR 36 2.903 6.383 0.177
258 HA THR 36 HA THR 36 4.910 6.119 2.205
259 HB THR 36 HB THR 36 2.391 7.802 2.296
260 HG1 THR 36 HG1 THR 36 4.948 8.299 1.176
261 HG21 THR 36 3HG2 THR 36 5.105 8.100 3.613
262 HG22 THR 36 1HG2 THR 36 3.603 7.661 4.427
263 HG23 THR 36 2HG2 THR 36 3.786 9.266 3.719
264 H ILE 37 H ILE 37 4.876 5.008 4.080
265 HA ILE 37 HA ILE 37 2.294 3.795 5.000
266 HB ILE 37 HB ILE 37 5.167 2.989 5.560
267 HG12 ILE 37 1HG1 ILE 37 3.036 1.492 4.019
268 HG13 ILE 37 2HG1 ILE 37 4.208 2.553 3.234
269 HG21 ILE 37 1HG2 ILE 37 2.504 1.864 6.462
270 HG22 ILE 37 2HG2 ILE 37 3.832 2.429 7.475
271 HG23 ILE 37 3HG2 ILE 37 4.007 0.946 6.537
272 HD11 ILE 37 3HD1 ILE 37 4.910 0.144 3.271
273 HD12 ILE 37 1HD1 ILE 37 4.949 0.228 5.032
274 HD13 ILE 37 2HD1 ILE 37 6.053 1.219 4.077
275 H VAL 38 H VAL 38 1.469 4.548 6.883
276 HA VAL 38 HA VAL 38 3.229 6.209 8.661
277 HB VAL 38 HB VAL 38 1.049 7.189 9.452
278 HG11 VAL 38 1HG1 VAL 38 0.689 8.522 7.365
279 HG12 VAL 38 2HG1 VAL 38 1.720 7.381 6.501
280 HG13 VAL 38 3HG1 VAL 38 2.392 8.369 7.799
281 HG21 VAL 38 3HG2 VAL 38 -0.285 5.160 8.611
282 HG22 VAL 38 1HG2 VAL 38 -0.127 5.858 7.000
283 HG23 VAL 38 2HG2 VAL 38 -0.977 6.743 8.266
284 H GLY 39 H GLY 39 1.906 3.178 8.436
285 HA2 GLY 39 1HA GLY 39 2.494 2.453 11.118
286 HA3 GLY 39 2HA GLY 39 0.758 2.741 11.007
287 H GLU 40 H GLU 40 1.035 0.273 11.610
288 HA GLU 40 HA GLU 40 0.712 -1.254 9.068
289 HB2 GLU 40 1HB GLU 40 3.032 -1.646 9.890
290 HB3 GLU 40 2HB GLU 40 2.370 -2.203 11.429
291 HG2 GLU 40 1HG GLU 40 1.194 -4.026 10.312
292 HG3 GLU 40 2HG GLU 40 1.728 -3.443 8.736
293 H GLU 41 H GLU 41 -0.638 -3.133 9.319
294 HA GLU 41 HA GLU 41 -1.892 -3.606 11.950
295 HB2 GLU 41 1HB GLU 41 -3.204 -1.740 10.880
296 HB3 GLU 41 2HB GLU 41 -3.583 -2.838 9.554
297 HG2 GLU 41 1HG GLU 41 -5.431 -2.928 11.094
298 HG3 GLU 41 2HG GLU 41 -4.538 -4.436 11.276
299 H GLY 42 H GLY 42 -1.668 -5.769 12.069
300 HA2 GLY 42 1HA GLY 42 -1.822 -8.036 11.517
301 HA3 GLY 42 2HA GLY 42 -3.069 -7.561 10.368
302 H ALA 43 H ALA 43 -2.421 -8.851 8.664
303 HA ALA 43 HA ALA 43 0.373 -8.860 7.746
304 HB1 ALA 43 3HB ALA 43 -0.669 -10.298 5.884
305 HB2 ALA 43 1HB ALA 43 -2.169 -10.196 6.805
306 HB3 ALA 43 2HB ALA 43 -0.746 -10.950 7.521
307 H PHE 44 H PHE 44 -1.608 -6.445 7.616
308 HA PHE 44 HA PHE 44 -1.055 -5.772 4.739
309 HB2 PHE 44 1HB PHE 44 -3.480 -5.044 6.414
310 HB3 PHE 44 2HB PHE 44 -3.157 -4.452 4.783
311 HD1 PHE 44 HD2 PHE 44 -3.980 -7.424 6.813
312 HD2 PHE 44 HD1 PHE 44 -3.389 -5.893 2.844
313 HE1 PHE 44 HE2 PHE 44 -4.964 -9.495 5.868
314 HE2 PHE 44 HE1 PHE 44 -4.368 -7.967 1.898
315 HZ PHE 44 HZ PHE 44 -5.159 -9.766 3.411
316 H TYR 45 H TYR 45 -0.412 -3.632 4.360
317 HA TYR 45 HA TYR 45 0.581 -2.191 6.773
318 HB2 TYR 45 1HB TYR 45 1.295 -2.108 3.838
319 HB3 TYR 45 2HB TYR 45 1.811 -0.833 4.942
320 HD1 TYR 45 HD1 TYR 45 2.833 -1.725 7.236
321 HD2 TYR 45 HD2 TYR 45 2.736 -3.941 3.557
322 HE1 TYR 45 HE1 TYR 45 4.703 -3.138 8.039
323 HE2 TYR 45 HE2 TYR 45 4.610 -5.352 4.362
324 HH TYR 45 HH TYR 45 6.532 -5.062 6.064
325 H LYS 46 H LYS 46 0.086 -0.027 7.130
326 HA LYS 46 HA LYS 46 -2.416 0.921 5.831
327 HB2 LYS 46 1HB LYS 46 -2.296 0.864 8.310
328 HB3 LYS 46 2HB LYS 46 -0.916 1.959 8.258
329 HG2 LYS 46 1HG LYS 46 -2.283 3.689 7.201
330 HG3 LYS 46 2HG LYS 46 -3.665 2.594 7.149
331 HD2 LYS 46 1HD LYS 46 -3.634 2.446 9.620
332 HD3 LYS 46 2HD LYS 46 -2.275 3.571 9.661
333 HE2 LYS 46 1HE LYS 46 -4.964 4.205 8.416
334 HE3 LYS 46 2HE LYS 46 -4.494 4.678 10.049
335 HZ1 LYS 46 3HZ LYS 46 -3.584 6.464 9.133
336 HZ2 LYS 46 1HZ LYS 46 -3.788 5.863 7.561
337 HZ3 LYS 46 2HZ LYS 46 -2.404 5.448 8.453
338 H ILE 47 H ILE 47 -2.304 2.498 4.309
339 HA ILE 47 HA ILE 47 0.113 4.266 4.243
340 HB ILE 47 HB ILE 47 -0.030 4.197 1.755
341 HG12 ILE 47 1HG1 ILE 47 -1.927 1.871 2.203
342 HG13 ILE 47 2HG1 ILE 47 -2.461 3.478 1.720
343 HG21 ILE 47 1HG2 ILE 47 1.623 2.801 2.720
344 HG22 ILE 47 2HG2 ILE 47 0.771 1.759 1.583
345 HG23 ILE 47 3HG2 ILE 47 0.429 1.647 3.310
346 HD11 ILE 47 3HD1 ILE 47 -0.958 3.331 -0.273
347 HD12 ILE 47 1HD1 ILE 47 -2.220 2.099 -0.271
348 HD13 ILE 47 2HD1 ILE 47 -0.571 1.673 0.186
349 H GLU 48 H GLU 48 -0.248 6.353 3.292
350 HA GLU 48 HA GLU 48 -3.000 7.330 3.808
351 HB2 GLU 48 1HB GLU 48 -0.412 8.778 3.160
352 HB3 GLU 48 2HB GLU 48 -1.947 9.579 3.495
353 HG2 GLU 48 1HG GLU 48 -0.567 7.671 5.404
354 HG3 GLU 48 2HG GLU 48 -0.463 9.428 5.507
355 H TYR 49 H TYR 49 -4.417 7.370 2.154
356 HA TYR 49 HA TYR 49 -3.377 7.621 -0.645
357 HB2 TYR 49 1HB TYR 49 -4.755 5.607 -0.043
358 HB3 TYR 49 2HB TYR 49 -6.105 6.690 0.296
359 HD1 TYR 49 HD1 TYR 49 -3.551 6.100 -2.399
360 HD2 TYR 49 HD2 TYR 49 -7.628 7.065 -1.442
361 HE1 TYR 49 HE1 TYR 49 -4.111 6.139 -4.811
362 HE2 TYR 49 HE2 TYR 49 -8.184 7.101 -3.858
363 HH TYR 49 HH TYR 49 -6.407 5.751 -6.173
364 H LYS 50 H LYS 50 -3.288 9.801 -1.012
365 HA LYS 50 HA LYS 50 -3.980 12.046 -1.137
366 HB2 LYS 50 1HB LYS 50 -6.440 10.509 -2.001
367 HB3 LYS 50 2HB LYS 50 -6.290 12.259 -2.159
368 HG2 LYS 50 1HG LYS 50 -4.170 11.883 -3.467
369 HG3 LYS 50 2HG LYS 50 -4.527 10.155 -3.440
370 HD2 LYS 50 1HD LYS 50 -6.375 12.290 -4.554
371 HD3 LYS 50 2HD LYS 50 -5.333 11.253 -5.528
372 HE2 LYS 50 1HE LYS 50 -7.243 9.960 -5.618
373 HE3 LYS 50 2HE LYS 50 -6.624 9.349 -4.087
374 HZ1 LYS 50 3HZ LYS 50 -9.037 10.564 -4.497
375 HZ2 LYS 50 1HZ LYS 50 -8.101 11.765 -3.751
376 HZ3 LYS 50 2HZ LYS 50 -8.307 10.257 -2.994
377 H GLY 51 H GLY 51 -7.233 10.986 -0.294
378 HA2 GLY 51 1HA GLY 51 -6.974 12.380 2.358
379 HA3 GLY 51 2HA GLY 51 -8.349 12.666 1.290
380 H SER 52 H SER 52 -6.730 9.587 2.024
381 HA SER 52 HA SER 52 -8.902 8.703 3.757
382 HB2 SER 52 1HB SER 52 -9.713 6.915 2.286
383 HB3 SER 52 2HB SER 52 -9.937 8.479 1.505
384 HG SER 52 HG SER 52 -7.559 7.766 0.820
385 H HIS 53 H HIS 53 -8.501 6.411 4.471
386 HA HIS 53 HA HIS 53 -5.573 5.923 4.597
387 HB2 HIS 53 1HB HIS 53 -7.897 4.721 6.136
388 HB3 HIS 53 2HB HIS 53 -6.195 4.352 6.423
389 HD1 HIS 53 HD1 HIS 53 -4.669 6.609 6.909
390 HD2 HIS 53 HD2 HIS 53 -8.771 6.913 7.586
391 HE1 HIS 53 HE1 HIS 53 -5.003 8.650 8.371
392 H GLY 54 H GLY 54 -4.819 4.656 2.983
393 HA2 GLY 54 1HA GLY 54 -6.539 2.512 1.849
394 HA3 GLY 54 2HA GLY 54 -5.033 3.107 1.150
395 H TYR 55 H TYR 55 -5.826 0.327 1.792
396 HA TYR 55 HA TYR 55 -3.541 -0.366 3.610
397 HB2 TYR 55 1HB TYR 55 -6.257 -1.709 3.436
398 HB3 TYR 55 2HB TYR 55 -4.892 -2.305 4.383
399 HD1 TYR 55 HD1 TYR 55 -7.394 0.390 4.046
400 HD2 TYR 55 HD2 TYR 55 -4.174 -1.185 6.412
401 HE1 TYR 55 HE1 TYR 55 -7.998 1.931 5.894
402 HE2 TYR 55 HE2 TYR 55 -4.778 0.353 8.260
403 HH TYR 55 HH TYR 55 -7.709 2.239 8.197
404 H VAL 56 H VAL 56 -2.208 -1.990 2.856
405 HA VAL 56 HA VAL 56 -3.044 -3.471 0.394
406 HB VAL 56 HB VAL 56 -0.759 -3.105 -0.534
407 HG11 VAL 56 1HG1 VAL 56 -2.585 -1.687 -1.300
408 HG12 VAL 56 2HG1 VAL 56 -1.130 -0.704 -1.138
409 HG13 VAL 56 3HG1 VAL 56 -2.390 -0.626 0.094
410 HG21 VAL 56 3HG2 VAL 56 -0.547 -1.295 1.889
411 HG22 VAL 56 1HG2 VAL 56 0.517 -1.150 0.490
412 HG23 VAL 56 2HG2 VAL 56 0.515 -2.631 1.447
413 H ALA 57 H ALA 57 -1.873 -5.459 0.078
414 HA ALA 57 HA ALA 57 -1.269 -6.824 2.571
415 HB1 ALA 57 3HB ALA 57 -1.042 -8.796 1.222
416 HB2 ALA 57 1HB ALA 57 -0.796 -7.840 -0.240
417 HB3 ALA 57 2HB ALA 57 -2.378 -7.866 0.541
418 H LYS 58 H LYS 58 0.727 -7.647 3.245
419 HA LYS 58 HA LYS 58 3.052 -6.076 2.585
420 HB2 LYS 58 1HB LYS 58 4.246 -7.635 4.082
421 HB3 LYS 58 2HB LYS 58 2.740 -7.082 4.813
422 HG2 LYS 58 1HG LYS 58 1.633 -9.173 4.003
423 HG3 LYS 58 2HG LYS 58 3.197 -9.731 3.406
424 HD2 LYS 58 1HD LYS 58 4.127 -9.619 5.676
425 HD3 LYS 58 2HD LYS 58 2.588 -9.017 6.290
426 HE2 LYS 58 1HE LYS 58 2.757 -11.426 6.702
427 HE3 LYS 58 2HE LYS 58 1.489 -11.109 5.519
428 HZ1 LYS 58 3HZ LYS 58 4.247 -12.053 4.983
429 HZ2 LYS 58 1HZ LYS 58 3.181 -11.540 3.769
430 HZ3 LYS 58 2HZ LYS 58 2.797 -12.897 4.717
431 H GLU 59 H GLU 59 1.597 -8.757 1.095
432 HA GLU 59 HA GLU 59 3.929 -10.126 0.120
433 HB2 GLU 59 1HB GLU 59 1.616 -11.081 0.128
434 HB3 GLU 59 2HB GLU 59 1.188 -9.961 -1.164
435 HG2 GLU 59 1HG GLU 59 2.913 -10.928 -2.612
436 HG3 GLU 59 2HG GLU 59 3.412 -12.018 -1.317
437 H TYR 60 H TYR 60 2.061 -7.372 -1.127
438 HA TYR 60 HA TYR 60 3.741 -7.308 -3.579
439 HB2 TYR 60 1HB TYR 60 1.588 -5.329 -2.819
440 HB3 TYR 60 2HB TYR 60 2.187 -5.731 -4.428
441 HD1 TYR 60 HD2 TYR 60 1.942 -8.254 -5.142
442 HD2 TYR 60 HD1 TYR 60 -0.365 -6.376 -2.042
443 HE1 TYR 60 HE2 TYR 60 0.216 -10.022 -5.355
444 HE2 TYR 60 HE1 TYR 60 -2.091 -8.146 -2.254
445 HH TYR 60 HH TYR 60 -2.829 -9.762 -4.211
446 H ILE 61 H ILE 61 3.950 -6.131 -0.452
447 HA ILE 61 HA ILE 61 5.455 -3.674 -1.297
448 HB ILE 61 HB ILE 61 3.989 -4.446 1.224
449 HG12 ILE 61 1HG1 ILE 61 2.999 -2.231 0.948
450 HG13 ILE 61 2HG1 ILE 61 4.107 -1.867 -0.371
451 HG21 ILE 61 1HG2 ILE 61 5.056 -2.292 2.198
452 HG22 ILE 61 2HG2 ILE 61 6.308 -2.527 0.976
453 HG23 ILE 61 3HG2 ILE 61 6.030 -3.762 2.204
454 HD11 ILE 61 3HD1 ILE 61 3.028 -3.303 -1.854
455 HD12 ILE 61 1HD1 ILE 61 1.671 -2.694 -0.909
456 HD13 ILE 61 2HD1 ILE 61 2.335 -4.290 -0.564
457 H LYS 62 H LYS 62 7.621 -3.666 -1.057
458 HA LYS 62 HA LYS 62 8.906 -5.576 0.833
459 HB2 LYS 62 1HB LYS 62 10.433 -6.400 -0.853
460 HB3 LYS 62 2HB LYS 62 8.795 -6.624 -1.464
461 HG2 LYS 62 1HG LYS 62 9.021 -4.475 -2.729
462 HG3 LYS 62 2HG LYS 62 10.703 -4.379 -2.205
463 HD2 LYS 62 1HD LYS 62 11.139 -6.578 -3.264
464 HD3 LYS 62 2HD LYS 62 9.475 -6.605 -3.848
465 HE2 LYS 62 1HE LYS 62 9.885 -4.488 -5.074
466 HE3 LYS 62 2HE LYS 62 11.558 -4.509 -4.522
467 HZ1 LYS 62 3HZ LYS 62 12.108 -6.025 -6.032
468 HZ2 LYS 62 1HZ LYS 62 10.631 -5.674 -6.789
469 HZ3 LYS 62 2HZ LYS 62 10.743 -6.984 -5.712
470 H ASP 63 H ASP 63 11.523 -5.059 0.229
471 HA ASP 63 HA ASP 63 13.224 -3.515 0.667
472 HB2 ASP 63 1HB ASP 63 11.324 -1.804 -0.959
473 HB3 ASP 63 2HB ASP 63 12.916 -1.253 -0.443
474 H ILE 64 H ILE 64 10.451 -1.281 0.822
475 HA ILE 64 HA ILE 64 9.744 0.130 2.544
476 HB ILE 64 HB ILE 64 10.752 -2.155 4.269
477 HG12 ILE 64 1HG1 ILE 64 7.936 -1.515 3.346
478 HG13 ILE 64 2HG1 ILE 64 8.983 -2.664 2.515
479 HG21 ILE 64 1HG2 ILE 64 8.971 -1.154 5.841
480 HG22 ILE 64 2HG2 ILE 64 9.074 0.292 4.836
481 HG23 ILE 64 3HG2 ILE 64 10.498 -0.283 5.704
482 HD11 ILE 64 3HD1 ILE 64 9.149 -4.039 4.511
483 HD12 ILE 64 1HD1 ILE 64 7.444 -3.753 4.162
484 HD13 ILE 64 2HD1 ILE 64 8.244 -2.850 5.448
485 H LYS 65 H LYS 65 11.443 1.618 1.918
486 HA LYS 65 HA LYS 65 13.452 1.986 4.096
487 HB2 LYS 65 1HB LYS 65 14.018 2.003 1.116
488 HB3 LYS 65 2HB LYS 65 15.113 2.677 2.323
489 HG2 LYS 65 1HG LYS 65 15.296 0.507 3.429
490 HG3 LYS 65 2HG LYS 65 14.112 -0.184 2.322
491 HD2 LYS 65 1HD LYS 65 16.221 -0.847 1.448
492 HD3 LYS 65 2HD LYS 65 15.702 0.494 0.429
493 HE2 LYS 65 1HE LYS 65 17.181 2.022 1.519
494 HE3 LYS 65 2HE LYS 65 17.498 0.893 2.836
495 HZ1 LYS 65 3HZ LYS 65 18.517 -0.605 1.203
496 HZ2 LYS 65 1HZ LYS 65 19.324 0.883 1.305
497 HZ3 LYS 65 2HZ LYS 65 18.290 0.568 -0.005
498 H ASP 66 H ASP 66 14.120 4.212 4.335
499 HA ASP 66 HA ASP 66 11.985 6.085 3.629
500 HB2 ASP 66 1HB ASP 66 14.579 6.383 5.164
501 HB3 ASP 66 2HB ASP 66 13.455 7.716 4.899
502 H GLU 67 H GLU 67 11.986 6.827 1.560
503 HA GLU 67 HA GLU 67 14.589 7.527 0.258
504 HB2 GLU 67 1HB GLU 67 11.804 7.129 -0.884
505 HB3 GLU 67 2HB GLU 67 13.218 7.591 -1.830
506 HG2 GLU 67 1HG GLU 67 13.034 5.067 -0.161
507 HG3 GLU 67 2HG GLU 67 12.752 5.132 -1.901
508 H VAL 68 H VAL 68 11.941 8.911 1.868
509 HA VAL 68 HA VAL 68 12.087 11.488 0.404
510 HB VAL 68 HB VAL 68 10.451 10.641 2.818
511 HG11 VAL 68 1HG1 VAL 68 10.441 13.142 1.106
512 HG12 VAL 68 2HG1 VAL 68 10.730 13.035 2.842
513 HG13 VAL 68 3HG1 VAL 68 9.124 12.704 2.194
514 HG21 VAL 68 3HG2 VAL 68 9.819 9.421 0.793
515 HG22 VAL 68 1HG2 VAL 68 9.748 10.927 -0.121
516 HG23 VAL 68 2HG2 VAL 68 8.583 10.622 1.166
517 H LEU 69 H LEU 69 13.361 9.952 3.228
518 HA LEU 69 HA LEU 69 14.119 12.506 4.512
519 HB2 LEU 69 1HB LEU 69 14.774 9.647 5.290
520 HB3 LEU 69 2HB LEU 69 15.052 11.080 6.277
521 HG LEU 69 HG LEU 69 12.341 10.120 5.313
522 HD11 LEU 69 1HD1 LEU 69 11.955 9.386 7.564
523 HD12 LEU 69 2HD1 LEU 69 13.443 10.143 8.133
524 HD13 LEU 69 3HD1 LEU 69 13.520 8.725 7.087
525 HD21 LEU 69 3HD2 LEU 69 11.688 11.851 7.204
526 HD22 LEU 69 1HD2 LEU 69 12.068 12.433 5.586
527 HD23 LEU 69 2HD2 LEU 69 13.280 12.531 6.864
528 H GLU 70 H GLU 70 16.137 13.371 4.460
529 HA GLU 70 HA GLU 70 18.186 13.852 3.375
530 HB2 GLU 70 1HB GLU 70 19.944 12.330 4.203
531 HB3 GLU 70 2HB GLU 70 18.783 12.712 5.468
532 HG2 GLU 70 1HG GLU 70 17.704 10.586 5.259
533 HG3 GLU 70 2HG GLU 70 18.568 10.207 3.771
534 H HIS 71 H HIS 71 20.097 11.772 2.541
535 HA HIS 71 HA HIS 71 20.753 10.779 0.536
536 HB2 HIS 71 1HB HIS 71 19.041 9.117 1.423
537 HB3 HIS 71 2HB HIS 71 17.870 9.879 0.345
538 HD1 HIS 71 HD1 HIS 71 21.441 8.555 -0.007
539 HD2 HIS 71 HD2 HIS 71 17.827 8.584 -2.086
540 HE1 HIS 71 HE1 HIS 71 21.831 7.244 -2.139
541 H HIS 72 H HIS 72 21.128 12.669 -0.652
542 HA HIS 72 HA HIS 72 19.040 14.178 -1.950
543 HB2 HIS 72 1HB HIS 72 21.292 15.094 -1.424
544 HB3 HIS 72 2HB HIS 72 21.991 14.013 -2.628
545 HD1 HIS 72 HD1 HIS 72 21.255 14.417 -5.149
546 HD2 HIS 72 HD2 HIS 72 20.104 17.406 -2.481
547 HE1 HIS 72 HE1 HIS 72 20.588 16.415 -6.556
548 H HIS 73 H HIS 73 17.770 13.116 -3.408
549 HA HIS 73 HA HIS 73 17.140 11.845 -5.272
550 HB2 HIS 73 1HB HIS 73 18.416 13.765 -6.309
551 HB3 HIS 73 2HB HIS 73 19.826 12.706 -6.371
552 HD1 HIS 73 HD1 HIS 73 19.343 10.318 -7.663
553 HD2 HIS 73 HD2 HIS 73 16.743 13.468 -8.493
554 HE1 HIS 73 HE1 HIS 73 18.153 9.713 -9.815
555 H HIS 74 H HIS 74 20.638 11.286 -5.648
556 HA HIS 74 HA HIS 74 20.299 8.475 -4.762
557 HB2 HIS 74 1HB HIS 74 21.238 7.596 -6.852
558 HB3 HIS 74 2HB HIS 74 19.754 8.489 -7.182
559 HD1 HIS 74 HD1 HIS 74 20.414 11.267 -7.558
560 HD2 HIS 74 HD2 HIS 74 23.168 8.340 -8.665
561 HE1 HIS 74 HE1 HIS 74 21.976 12.351 -9.229
562 H HIS 75 H HIS 75 22.489 7.352 -4.801
563 HA HIS 75 HA HIS 75 24.396 8.944 -3.375
564 HB2 HIS 75 1HB HIS 75 25.885 6.863 -3.807
565 HB3 HIS 75 2HB HIS 75 24.409 6.643 -2.870
566 HD1 HIS 75 HD1 HIS 75 25.940 5.879 -6.205
567 HD2 HIS 75 HD2 HIS 75 22.339 5.203 -4.216
568 HE1 HIS 75 HE1 HIS 75 24.677 4.161 -7.573
569 H HIS 76 H HIS 76 26.299 9.900 -4.036
570 HA HIS 76 HA HIS 76 27.772 10.969 -5.506
571 HB2 HIS 76 1HB HIS 76 27.346 8.426 -7.108
572 HB3 HIS 76 2HB HIS 76 28.676 9.565 -7.313
573 HD1 HIS 76 HD1 HIS 76 30.229 9.901 -5.097
574 HD2 HIS 76 HD2 HIS 76 27.809 6.507 -5.156
575 HE1 HIS 76 HE1 HIS 76 31.147 8.334 -3.330
Start of MODEL 12
1 H1 ALA 1 1H ALA 1 7.499 6.903 12.662
2 H2 ALA 1 2H ALA 1 8.974 7.384 13.356
3 H3 ALA 1 3H ALA 1 8.885 5.948 12.452
4 HA ALA 1 HA ALA 1 8.485 8.691 11.389
5 HB1 ALA 1 3HB ALA 1 10.618 8.061 10.120
6 HB2 ALA 1 1HB ALA 1 10.800 6.754 11.291
7 HB3 ALA 1 2HB ALA 1 10.802 8.432 11.835
8 H GLU 2 H GLU 2 8.018 8.762 9.174
9 HA GLU 2 HA GLU 2 6.426 6.573 8.167
10 HB2 GLU 2 1HB GLU 2 7.411 9.128 6.878
11 HB3 GLU 2 2HB GLU 2 6.302 8.003 6.093
12 HG2 GLU 2 1HG GLU 2 4.674 8.294 7.886
13 HG3 GLU 2 2HG GLU 2 5.793 9.330 8.770
14 H LYS 3 H LYS 3 6.815 5.366 6.214
15 HA LYS 3 HA LYS 3 9.677 5.232 5.333
16 HB2 LYS 3 1HB LYS 3 7.946 2.876 6.131
17 HB3 LYS 3 2HB LYS 3 9.528 2.748 5.362
18 HG2 LYS 3 1HG LYS 3 10.537 3.982 7.251
19 HG3 LYS 3 2HG LYS 3 8.954 4.075 8.023
20 HD2 LYS 3 1HD LYS 3 8.852 1.582 8.031
21 HD3 LYS 3 2HD LYS 3 10.488 1.542 7.375
22 HE2 LYS 3 1HE LYS 3 9.669 2.792 10.016
23 HE3 LYS 3 2HE LYS 3 10.535 1.269 9.820
24 HZ1 LYS 3 3HZ LYS 3 12.055 2.931 8.382
25 HZ2 LYS 3 1HZ LYS 3 12.333 2.569 10.016
26 HZ3 LYS 3 2HZ LYS 3 11.499 3.987 9.591
27 H THR 4 H THR 4 9.937 4.332 3.196
28 HA THR 4 HA THR 4 7.449 4.534 1.537
29 HB THR 4 HB THR 4 9.028 4.939 -0.356
30 HG1 THR 4 HG1 THR 4 11.088 5.472 1.401
31 HG21 THR 4 3HG2 THR 4 9.494 7.211 0.231
32 HG22 THR 4 1HG2 THR 4 9.553 6.823 1.951
33 HG23 THR 4 2HG2 THR 4 8.016 6.769 1.085
34 H GLY 5 H GLY 5 6.640 2.620 1.037
35 HA2 GLY 5 1HA GLY 5 8.410 0.235 0.844
36 HA3 GLY 5 2HA GLY 5 6.654 0.204 1.000
37 H ILE 6 H ILE 6 8.757 -0.813 -1.057
38 HA ILE 6 HA ILE 6 7.822 0.481 -3.534
39 HB ILE 6 HB ILE 6 9.719 -1.822 -2.992
40 HG12 ILE 6 1HG1 ILE 6 11.393 -0.155 -3.838
41 HG13 ILE 6 2HG1 ILE 6 10.109 1.048 -3.909
42 HG21 ILE 6 1HG2 ILE 6 8.766 -2.262 -5.140
43 HG22 ILE 6 2HG2 ILE 6 10.306 -1.462 -5.453
44 HG23 ILE 6 3HG2 ILE 6 8.799 -0.556 -5.583
45 HD11 ILE 6 3HD1 ILE 6 11.678 0.859 -1.773
46 HD12 ILE 6 1HD1 ILE 6 10.535 -0.406 -1.319
47 HD13 ILE 6 2HD1 ILE 6 9.967 1.240 -1.604
48 H VAL 7 H VAL 7 5.986 -0.151 -4.501
49 HA VAL 7 HA VAL 7 4.651 -2.640 -3.700
50 HB VAL 7 HB VAL 7 3.912 -0.505 -5.725
51 HG11 VAL 7 1HG1 VAL 7 2.773 -2.491 -6.389
52 HG12 VAL 7 2HG1 VAL 7 1.605 -1.590 -5.424
53 HG13 VAL 7 3HG1 VAL 7 2.464 -2.959 -4.718
54 HG21 VAL 7 3HG2 VAL 7 3.860 0.405 -3.504
55 HG22 VAL 7 1HG2 VAL 7 3.119 -1.057 -2.854
56 HG23 VAL 7 2HG2 VAL 7 2.190 0.007 -3.909
57 H ASN 8 H ASN 8 5.604 -4.434 -4.535
58 HA ASN 8 HA ASN 8 6.417 -4.450 -7.407
59 HB2 ASN 8 1HB ASN 8 8.089 -5.162 -5.728
60 HB3 ASN 8 2HB ASN 8 6.996 -6.439 -5.194
61 HD21 ASN 8 2HD2 ASN 8 8.796 -5.284 -8.075
62 HD22 ASN 8 1HD2 ASN 8 8.905 -6.810 -8.808
63 H VAL 9 H VAL 9 4.626 -4.926 -8.600
64 HA VAL 9 HA VAL 9 3.243 -7.506 -8.017
65 HB VAL 9 HB VAL 9 1.077 -6.491 -8.601
66 HG11 VAL 9 1HG1 VAL 9 2.085 -6.547 -6.213
67 HG12 VAL 9 2HG1 VAL 9 0.692 -5.510 -6.498
68 HG13 VAL 9 3HG1 VAL 9 2.306 -4.809 -6.420
69 HG21 VAL 9 3HG2 VAL 9 2.760 -3.984 -8.781
70 HG22 VAL 9 1HG2 VAL 9 1.011 -3.933 -8.559
71 HG23 VAL 9 2HG2 VAL 9 1.696 -4.664 -10.011
72 H SER 10 H SER 10 2.062 -8.313 -9.941
73 HA SER 10 HA SER 10 3.713 -8.313 -12.275
74 HB2 SER 10 1HB SER 10 1.848 -9.572 -13.310
75 HB3 SER 10 2HB SER 10 2.197 -10.170 -11.689
76 HG SER 10 HG SER 10 0.354 -9.361 -10.980
77 H SER 11 H SER 11 0.720 -6.570 -11.491
78 HA SER 11 HA SER 11 1.384 -4.485 -13.403
79 HB2 SER 11 1HB SER 11 -0.726 -4.774 -14.754
80 HB3 SER 11 2HB SER 11 0.486 -6.023 -15.025
81 HG SER 11 HG SER 11 -1.907 -6.134 -13.530
82 H SER 12 H SER 12 0.960 -2.839 -12.086
83 HA SER 12 HA SER 12 -0.141 -1.422 -10.600
84 HB2 SER 12 1HB SER 12 -2.746 -2.506 -11.643
85 HB3 SER 12 2HB SER 12 -2.330 -0.853 -11.196
86 HG SER 12 HG SER 12 -1.957 -0.647 -13.252
87 H LEU 13 H LEU 13 -1.750 -1.313 -8.791
88 HA LEU 13 HA LEU 13 -2.366 -3.968 -7.603
89 HB2 LEU 13 1HB LEU 13 -0.226 -3.367 -6.623
90 HB3 LEU 13 2HB LEU 13 -0.817 -1.754 -6.229
91 HG LEU 13 HG LEU 13 -2.450 -2.688 -4.666
92 HD11 LEU 13 1HD1 LEU 13 -2.132 -5.268 -4.207
93 HD12 LEU 13 2HD1 LEU 13 -1.520 -5.293 -5.860
94 HD13 LEU 13 3HD1 LEU 13 -3.160 -4.740 -5.538
95 HD21 LEU 13 3HD2 LEU 13 0.332 -3.838 -4.317
96 HD22 LEU 13 1HD2 LEU 13 -0.874 -3.729 -3.035
97 HD23 LEU 13 2HD2 LEU 13 -0.231 -2.260 -3.769
98 H ASN 14 H ASN 14 -4.327 -4.009 -6.707
99 HA ASN 14 HA ASN 14 -6.002 -1.618 -6.757
100 HB2 ASN 14 1HB ASN 14 -6.465 -4.492 -5.946
101 HB3 ASN 14 2HB ASN 14 -7.714 -3.257 -5.799
102 HD21 ASN 14 2HD2 ASN 14 -7.993 -5.502 -7.588
103 HD22 ASN 14 1HD2 ASN 14 -7.982 -4.906 -9.177
104 H VAL 15 H VAL 15 -6.761 -0.483 -4.996
105 HA VAL 15 HA VAL 15 -5.352 -0.945 -2.414
106 HB VAL 15 HB VAL 15 -6.887 1.417 -3.526
107 HG11 VAL 15 1HG1 VAL 15 -7.281 1.462 -1.174
108 HG12 VAL 15 2HG1 VAL 15 -5.925 2.558 -1.441
109 HG13 VAL 15 3HG1 VAL 15 -5.638 0.934 -0.814
110 HG21 VAL 15 3HG2 VAL 15 -4.589 0.935 -4.427
111 HG22 VAL 15 1HG2 VAL 15 -3.963 1.095 -2.786
112 HG23 VAL 15 2HG2 VAL 15 -4.704 2.481 -3.586
113 H ARG 16 H ARG 16 -6.434 -1.692 -0.666
114 HA ARG 16 HA ARG 16 -9.398 -2.035 -0.876
115 HB2 ARG 16 1HB ARG 16 -7.305 -3.384 0.849
116 HB3 ARG 16 2HB ARG 16 -9.038 -3.664 1.013
117 HG2 ARG 16 1HG ARG 16 -9.157 -4.447 -1.307
118 HG3 ARG 16 2HG ARG 16 -7.438 -4.115 -1.525
119 HD2 ARG 16 1HD ARG 16 -6.883 -5.756 0.217
120 HD3 ARG 16 2HD ARG 16 -8.598 -6.064 0.487
121 HE ARG 16 HE ARG 16 -8.669 -7.302 -1.546
122 HH11 ARG 16 1HH2 ARG 16 -5.650 -5.677 -1.080
123 HH12 ARG 16 2HH2 ARG 16 -4.852 -6.540 -2.352
124 HH21 ARG 16 1HH1 ARG 16 -7.634 -8.422 -3.191
125 HH22 ARG 16 2HH1 ARG 16 -5.972 -8.089 -3.545
126 H GLU 17 H GLU 17 -10.716 -0.983 0.503
127 HA GLU 17 HA GLU 17 -9.683 1.129 2.186
128 HB2 GLU 17 1HB GLU 17 -11.978 0.947 0.947
129 HB3 GLU 17 2HB GLU 17 -12.489 0.029 2.360
130 HG2 GLU 17 1HG GLU 17 -11.274 2.805 2.484
131 HG3 GLU 17 2HG GLU 17 -13.005 2.475 2.529
132 H GLY 18 H GLY 18 -11.015 -2.096 2.776
133 HA2 GLY 18 1HA GLY 18 -10.705 -1.773 5.700
134 HA3 GLY 18 2HA GLY 18 -11.408 -3.166 4.881
135 H ALA 19 H ALA 19 -9.687 -3.777 6.822
136 HA ALA 19 HA ALA 19 -6.965 -4.108 5.711
137 HB1 ALA 19 3HB ALA 19 -6.551 -5.200 7.961
138 HB2 ALA 19 1HB ALA 19 -8.228 -4.839 8.369
139 HB3 ALA 19 2HB ALA 19 -7.097 -3.525 8.057
140 H SER 20 H SER 20 -9.781 -5.641 5.180
141 HA SER 20 HA SER 20 -8.970 -8.416 5.588
142 HB2 SER 20 1HB SER 20 -11.090 -8.994 4.808
143 HB3 SER 20 2HB SER 20 -11.380 -7.378 5.449
144 HG SER 20 HG SER 20 -10.603 -6.918 3.058
145 H THR 21 H THR 21 -8.948 -9.954 3.711
146 HA THR 21 HA THR 21 -6.956 -9.146 1.785
147 HB THR 21 HB THR 21 -6.924 -11.437 2.423
148 HG1 THR 21 HG1 THR 21 -6.990 -10.831 0.028
149 HG21 THR 21 3HG2 THR 21 -9.888 -11.347 1.844
150 HG22 THR 21 1HG2 THR 21 -9.082 -11.776 3.353
151 HG23 THR 21 2HG2 THR 21 -9.012 -12.872 1.974
152 H SER 22 H SER 22 -10.403 -9.063 1.827
153 HA SER 22 HA SER 22 -10.403 -7.880 -0.876
154 HB2 SER 22 1HB SER 22 -10.746 -10.267 -1.342
155 HB3 SER 22 2HB SER 22 -12.062 -10.324 -0.175
156 HG SER 22 HG SER 22 -12.036 -8.519 -2.353
157 H SER 23 H SER 23 -10.790 -6.259 1.041
158 HA SER 23 HA SER 23 -13.457 -6.211 2.215
159 HB2 SER 23 1HB SER 23 -11.197 -4.222 2.031
160 HB3 SER 23 2HB SER 23 -12.747 -3.784 2.741
161 HG SER 23 HG SER 23 -10.808 -4.882 3.985
162 H LYS 24 H LYS 24 -12.057 -3.567 0.308
163 HA LYS 24 HA LYS 24 -14.102 -3.776 -1.768
164 HB2 LYS 24 1HB LYS 24 -15.345 -2.728 0.126
165 HB3 LYS 24 2HB LYS 24 -14.203 -1.384 0.083
166 HG2 LYS 24 1HG LYS 24 -14.806 -0.968 -2.293
167 HG3 LYS 24 2HG LYS 24 -15.981 -2.278 -2.210
168 HD2 LYS 24 1HD LYS 24 -16.049 0.102 -0.344
169 HD3 LYS 24 2HD LYS 24 -16.916 0.072 -1.878
170 HE2 LYS 24 1HE LYS 24 -17.975 -2.122 -1.052
171 HE3 LYS 24 2HE LYS 24 -17.335 -1.699 0.536
172 HZ1 LYS 24 3HZ LYS 24 -18.469 0.527 0.142
173 HZ2 LYS 24 1HZ LYS 24 -19.448 -0.802 0.526
174 HZ3 LYS 24 2HZ LYS 24 -19.339 -0.268 -1.083
175 H VAL 25 H VAL 25 -13.080 -3.163 -3.561
176 HA VAL 25 HA VAL 25 -10.588 -1.672 -3.475
177 HB VAL 25 HB VAL 25 -12.337 -2.616 -5.761
178 HG11 VAL 25 1HG1 VAL 25 -10.198 -2.193 -7.103
179 HG12 VAL 25 2HG1 VAL 25 -9.653 -1.220 -5.737
180 HG13 VAL 25 3HG1 VAL 25 -11.104 -0.758 -6.623
181 HG21 VAL 25 3HG2 VAL 25 -9.779 -3.623 -4.486
182 HG22 VAL 25 1HG2 VAL 25 -10.397 -4.226 -6.024
183 HG23 VAL 25 2HG2 VAL 25 -11.336 -4.445 -4.547
184 H ILE 26 H ILE 26 -10.351 0.471 -3.634
185 HA ILE 26 HA ILE 26 -12.678 2.144 -4.514
186 HB ILE 26 HB ILE 26 -11.765 3.874 -2.956
187 HG12 ILE 26 1HG1 ILE 26 -10.002 1.619 -1.941
188 HG13 ILE 26 2HG1 ILE 26 -9.412 2.927 -2.967
189 HG21 ILE 26 1HG2 ILE 26 -13.557 2.220 -2.311
190 HG22 ILE 26 2HG2 ILE 26 -12.625 2.838 -0.948
191 HG23 ILE 26 3HG2 ILE 26 -12.296 1.226 -1.580
192 HD11 ILE 26 3HD1 ILE 26 -9.055 3.332 -0.509
193 HD12 ILE 26 1HD1 ILE 26 -10.807 3.368 -0.314
194 HD13 ILE 26 2HD1 ILE 26 -10.006 4.585 -1.307
195 H GLY 27 H GLY 27 -9.492 1.190 -5.160
196 HA2 GLY 27 1HA GLY 27 -9.258 2.838 -7.469
197 HA3 GLY 27 2HA GLY 27 -8.348 3.600 -6.165
198 H SER 28 H SER 28 -6.558 3.106 -7.783
199 HA SER 28 HA SER 28 -5.212 0.629 -6.934
200 HB2 SER 28 1HB SER 28 -6.457 -0.165 -8.880
201 HB3 SER 28 2HB SER 28 -5.852 1.180 -9.844
202 HG SER 28 HG SER 28 -4.519 -0.524 -10.261
203 H LEU 29 H LEU 29 -2.947 0.669 -7.416
204 HA LEU 29 HA LEU 29 -1.880 3.350 -8.247
205 HB2 LEU 29 1HB LEU 29 -0.740 1.459 -6.170
206 HB3 LEU 29 2HB LEU 29 -0.067 3.023 -6.630
207 HG LEU 29 HG LEU 29 -2.805 2.582 -5.398
208 HD11 LEU 29 1HD1 LEU 29 -1.760 3.792 -3.456
209 HD12 LEU 29 2HD1 LEU 29 -0.203 3.655 -4.270
210 HD13 LEU 29 3HD1 LEU 29 -1.061 2.202 -3.757
211 HD21 LEU 29 3HD2 LEU 29 -3.045 4.544 -6.664
212 HD22 LEU 29 1HD2 LEU 29 -1.352 5.001 -6.469
213 HD23 LEU 29 2HD2 LEU 29 -2.481 5.189 -5.126
214 H SER 30 H SER 30 0.052 3.328 -9.414
215 HA SER 30 HA SER 30 0.393 1.095 -11.199
216 HB2 SER 30 1HB SER 30 1.919 3.645 -10.714
217 HB3 SER 30 2HB SER 30 2.491 2.448 -11.870
218 HG SER 30 HG SER 30 1.148 3.960 -12.884
219 H GLY 31 H GLY 31 2.181 -0.288 -11.397
220 HA2 GLY 31 1HA GLY 31 3.227 -1.322 -8.934
221 HA3 GLY 31 2HA GLY 31 3.729 -1.816 -10.547
222 H ASN 32 H ASN 32 5.576 -1.638 -8.538
223 HA ASN 32 HA ASN 32 7.656 -0.729 -8.007
224 HB2 ASN 32 1HB ASN 32 7.268 0.407 -10.793
225 HB3 ASN 32 2HB ASN 32 8.753 0.615 -9.870
226 HD21 ASN 32 2HD2 ASN 32 8.675 -0.870 -12.337
227 HD22 ASN 32 1HD2 ASN 32 9.012 -2.493 -11.980
228 H THR 33 H THR 33 4.943 0.939 -7.904
229 HA THR 33 HA THR 33 6.055 3.654 -7.597
230 HB THR 33 HB THR 33 3.247 2.668 -7.043
231 HG1 THR 33 HG1 THR 33 2.855 2.992 -9.115
232 HG21 THR 33 3HG2 THR 33 2.736 5.101 -7.461
233 HG22 THR 33 1HG2 THR 33 4.474 5.405 -7.462
234 HG23 THR 33 2HG2 THR 33 3.685 4.807 -6.003
235 H LYS 34 H LYS 34 6.556 4.583 -5.691
236 HA LYS 34 HA LYS 34 6.668 2.939 -3.287
237 HB2 LYS 34 1HB LYS 34 7.384 5.824 -3.856
238 HB3 LYS 34 2HB LYS 34 7.614 5.063 -2.281
239 HG2 LYS 34 1HG LYS 34 9.040 3.337 -3.332
240 HG3 LYS 34 2HG LYS 34 8.824 4.119 -4.897
241 HD2 LYS 34 1HD LYS 34 9.847 6.189 -3.984
242 HD3 LYS 34 2HD LYS 34 10.108 5.363 -2.447
243 HE2 LYS 34 1HE LYS 34 11.261 4.511 -5.120
244 HE3 LYS 34 2HE LYS 34 12.150 5.321 -3.830
245 HZ1 LYS 34 3HZ LYS 34 12.617 3.132 -3.410
246 HZ2 LYS 34 1HZ LYS 34 11.096 2.581 -3.919
247 HZ3 LYS 34 2HZ LYS 34 11.257 3.356 -2.417
248 H VAL 35 H VAL 35 5.511 3.265 -1.367
249 HA VAL 35 HA VAL 35 3.178 5.143 -1.511
250 HB VAL 35 HB VAL 35 1.946 3.394 -0.143
251 HG11 VAL 35 1HG1 VAL 35 2.805 2.665 -2.959
252 HG12 VAL 35 2HG1 VAL 35 1.521 3.799 -2.540
253 HG13 VAL 35 3HG1 VAL 35 1.349 2.089 -2.147
254 HG21 VAL 35 3HG2 VAL 35 4.178 1.621 -1.192
255 HG22 VAL 35 1HG2 VAL 35 2.750 1.085 -0.306
256 HG23 VAL 35 2HG2 VAL 35 3.963 2.079 0.498
257 H THR 36 H THR 36 2.949 6.433 0.195
258 HA THR 36 HA THR 36 4.977 6.622 2.201
259 HB THR 36 HB THR 36 2.191 7.803 2.264
260 HG1 THR 36 HG1 THR 36 2.967 8.652 0.480
261 HG21 THR 36 3HG2 THR 36 4.804 8.601 3.575
262 HG22 THR 36 1HG2 THR 36 3.372 7.978 4.393
263 HG23 THR 36 2HG2 THR 36 3.323 9.560 3.616
264 H ILE 37 H ILE 37 5.175 5.610 4.089
265 HA ILE 37 HA ILE 37 2.939 3.882 5.040
266 HB ILE 37 HB ILE 37 5.876 3.893 5.782
267 HG12 ILE 37 1HG1 ILE 37 5.099 3.178 3.367
268 HG13 ILE 37 2HG1 ILE 37 6.216 2.143 4.253
269 HG21 ILE 37 1HG2 ILE 37 5.176 1.540 6.639
270 HG22 ILE 37 2HG2 ILE 37 3.532 2.175 6.593
271 HG23 ILE 37 3HG2 ILE 37 4.745 2.940 7.621
272 HD11 ILE 37 3HD1 ILE 37 4.147 1.034 3.130
273 HD12 ILE 37 1HD1 ILE 37 3.243 1.712 4.481
274 HD13 ILE 37 2HD1 ILE 37 4.554 0.576 4.783
275 H VAL 38 H VAL 38 1.830 4.505 6.747
276 HA VAL 38 HA VAL 38 3.035 6.459 8.669
277 HB VAL 38 HB VAL 38 0.606 7.178 9.027
278 HG11 VAL 38 1HG1 VAL 38 1.738 7.637 6.254
279 HG12 VAL 38 2HG1 VAL 38 2.310 8.462 7.703
280 HG13 VAL 38 3HG1 VAL 38 0.655 8.706 7.144
281 HG21 VAL 38 3HG2 VAL 38 0.146 5.965 6.295
282 HG22 VAL 38 1HG2 VAL 38 -1.045 6.578 7.443
283 HG23 VAL 38 2HG2 VAL 38 -0.214 5.056 7.762
284 H GLY 39 H GLY 39 1.691 3.369 8.188
285 HA2 GLY 39 1HA GLY 39 2.058 2.590 10.902
286 HA3 GLY 39 2HA GLY 39 0.348 2.948 10.669
287 H GLU 40 H GLU 40 0.437 0.518 11.290
288 HA GLU 40 HA GLU 40 0.139 -1.032 8.784
289 HB2 GLU 40 1HB GLU 40 1.502 -2.894 9.612
290 HB3 GLU 40 2HB GLU 40 2.480 -1.431 9.508
291 HG2 GLU 40 1HG GLU 40 2.068 -1.039 11.948
292 HG3 GLU 40 2HG GLU 40 1.223 -2.587 12.018
293 H GLU 41 H GLU 41 -0.968 -3.120 9.205
294 HA GLU 41 HA GLU 41 -2.275 -3.458 11.810
295 HB2 GLU 41 1HB GLU 41 -3.699 -1.750 10.701
296 HB3 GLU 41 2HB GLU 41 -3.938 -2.854 9.346
297 HG2 GLU 41 1HG GLU 41 -4.979 -4.500 10.839
298 HG3 GLU 41 2HG GLU 41 -4.692 -3.446 12.223
299 H GLY 42 H GLY 42 -2.016 -5.585 12.085
300 HA2 GLY 42 1HA GLY 42 -2.045 -7.889 11.696
301 HA3 GLY 42 2HA GLY 42 -3.246 -7.563 10.451
302 H ALA 43 H ALA 43 -2.534 -8.759 8.760
303 HA ALA 43 HA ALA 43 0.338 -8.755 8.029
304 HB1 ALA 43 3HB ALA 43 -0.236 -10.544 6.516
305 HB2 ALA 43 1HB ALA 43 -1.956 -10.183 6.659
306 HB3 ALA 43 2HB ALA 43 -1.083 -10.861 8.032
307 H PHE 44 H PHE 44 -1.391 -6.355 7.788
308 HA PHE 44 HA PHE 44 -0.974 -5.857 4.867
309 HB2 PHE 44 1HB PHE 44 -3.354 -4.917 6.486
310 HB3 PHE 44 2HB PHE 44 -3.049 -4.576 4.782
311 HD1 PHE 44 HD2 PHE 44 -3.866 -7.229 7.230
312 HD2 PHE 44 HD1 PHE 44 -3.442 -6.227 3.077
313 HE1 PHE 44 HE2 PHE 44 -4.964 -9.363 6.604
314 HE2 PHE 44 HE1 PHE 44 -4.535 -8.362 2.448
315 HZ PHE 44 HZ PHE 44 -5.299 -9.929 4.213
316 H TYR 45 H TYR 45 -0.410 -3.711 4.369
317 HA TYR 45 HA TYR 45 0.563 -2.110 6.698
318 HB2 TYR 45 1HB TYR 45 1.523 -2.533 3.895
319 HB3 TYR 45 2HB TYR 45 1.818 -0.950 4.612
320 HD1 TYR 45 HD1 TYR 45 2.618 -1.108 7.180
321 HD2 TYR 45 HD2 TYR 45 3.209 -4.135 4.192
322 HE1 TYR 45 HE1 TYR 45 4.510 -2.021 8.486
323 HE2 TYR 45 HE2 TYR 45 5.111 -5.047 5.497
324 HH TYR 45 HH TYR 45 6.570 -3.372 8.027
325 H LYS 46 H LYS 46 -0.079 -0.050 6.977
326 HA LYS 46 HA LYS 46 -2.362 0.885 5.322
327 HB2 LYS 46 1HB LYS 46 -2.562 0.788 7.819
328 HB3 LYS 46 2HB LYS 46 -1.278 1.992 7.925
329 HG2 LYS 46 1HG LYS 46 -2.607 3.616 6.733
330 HG3 LYS 46 2HG LYS 46 -3.844 2.410 6.376
331 HD2 LYS 46 1HD LYS 46 -4.575 3.800 8.248
332 HD3 LYS 46 2HD LYS 46 -4.268 2.158 8.812
333 HE2 LYS 46 1HE LYS 46 -2.036 4.170 8.940
334 HE3 LYS 46 2HE LYS 46 -3.309 4.223 10.160
335 HZ1 LYS 46 3HZ LYS 46 -2.686 1.575 9.942
336 HZ2 LYS 46 1HZ LYS 46 -2.196 2.620 11.184
337 HZ3 LYS 46 2HZ LYS 46 -1.178 2.351 9.851
338 H ILE 47 H ILE 47 -2.106 2.509 3.909
339 HA ILE 47 HA ILE 47 0.296 4.279 4.138
340 HB ILE 47 HB ILE 47 0.446 4.253 1.661
341 HG12 ILE 47 1HG1 ILE 47 -1.532 1.952 1.824
342 HG13 ILE 47 2HG1 ILE 47 -1.973 3.580 1.308
343 HG21 ILE 47 1HG2 ILE 47 1.922 2.792 2.870
344 HG22 ILE 47 2HG2 ILE 47 1.289 1.868 1.508
345 HG23 ILE 47 3HG2 ILE 47 0.638 1.610 3.125
346 HD11 ILE 47 3HD1 ILE 47 -0.356 3.460 -0.531
347 HD12 ILE 47 1HD1 ILE 47 -1.485 2.108 -0.625
348 HD13 ILE 47 2HD1 ILE 47 0.146 1.853 -0.003
349 H GLU 48 H GLU 48 0.047 6.309 2.920
350 HA GLU 48 HA GLU 48 -2.556 7.497 3.503
351 HB2 GLU 48 1HB GLU 48 -0.037 8.590 2.231
352 HB3 GLU 48 2HB GLU 48 -1.472 9.568 2.545
353 HG2 GLU 48 1HG GLU 48 -1.334 9.051 4.936
354 HG3 GLU 48 2HG GLU 48 0.055 8.003 4.647
355 H TYR 49 H TYR 49 -4.126 6.740 2.133
356 HA TYR 49 HA TYR 49 -3.641 6.667 -0.783
357 HB2 TYR 49 1HB TYR 49 -4.874 4.805 0.193
358 HB3 TYR 49 2HB TYR 49 -6.059 5.914 0.881
359 HD1 TYR 49 HD1 TYR 49 -4.573 4.786 -2.353
360 HD2 TYR 49 HD2 TYR 49 -7.922 6.629 -0.393
361 HE1 TYR 49 HE1 TYR 49 -5.849 4.728 -4.479
362 HE2 TYR 49 HE2 TYR 49 -9.198 6.570 -2.519
363 HH TYR 49 HH TYR 49 -7.899 6.218 -5.433
364 H LYS 50 H LYS 50 -4.394 8.171 -2.168
365 HA LYS 50 HA LYS 50 -5.061 10.767 -1.370
366 HB2 LYS 50 1HB LYS 50 -5.736 9.277 -3.914
367 HB3 LYS 50 2HB LYS 50 -5.986 11.012 -3.706
368 HG2 LYS 50 1HG LYS 50 -3.610 11.348 -3.279
369 HG3 LYS 50 2HG LYS 50 -3.323 9.609 -3.328
370 HD2 LYS 50 1HD LYS 50 -2.678 10.384 -5.481
371 HD3 LYS 50 2HD LYS 50 -4.277 9.679 -5.713
372 HE2 LYS 50 1HE LYS 50 -5.322 11.837 -5.757
373 HE3 LYS 50 2HE LYS 50 -3.856 12.633 -5.185
374 HZ1 LYS 50 3HZ LYS 50 -4.437 11.484 -7.832
375 HZ2 LYS 50 1HZ LYS 50 -2.832 11.625 -7.303
376 HZ3 LYS 50 2HZ LYS 50 -3.804 13.011 -7.438
377 H GLY 51 H GLY 51 -6.675 10.934 0.151
378 HA2 GLY 51 1HA GLY 51 -9.102 11.624 0.126
379 HA3 GLY 51 2HA GLY 51 -9.435 10.083 -0.668
380 H SER 52 H SER 52 -7.561 8.544 0.953
381 HA SER 52 HA SER 52 -8.305 8.901 3.753
382 HB2 SER 52 1HB SER 52 -9.779 7.084 4.028
383 HB3 SER 52 2HB SER 52 -10.352 7.856 2.553
384 HG SER 52 HG SER 52 -8.554 5.656 2.704
385 H HIS 53 H HIS 53 -8.062 6.071 4.376
386 HA HIS 53 HA HIS 53 -5.131 5.738 3.872
387 HB2 HIS 53 1HB HIS 53 -6.920 4.682 6.075
388 HB3 HIS 53 2HB HIS 53 -5.209 4.289 5.909
389 HD1 HIS 53 HD1 HIS 53 -3.572 6.489 5.845
390 HD2 HIS 53 HD2 HIS 53 -7.370 7.040 7.472
391 HE1 HIS 53 HE1 HIS 53 -3.467 8.627 7.196
392 H GLY 54 H GLY 54 -4.628 4.245 2.413
393 HA2 GLY 54 1HA GLY 54 -6.566 2.122 1.699
394 HA3 GLY 54 2HA GLY 54 -5.109 2.543 0.801
395 H TYR 55 H TYR 55 -6.111 -0.069 1.886
396 HA TYR 55 HA TYR 55 -3.744 -0.797 3.583
397 HB2 TYR 55 1HB TYR 55 -6.494 -2.053 3.416
398 HB3 TYR 55 2HB TYR 55 -5.148 -2.711 4.349
399 HD1 TYR 55 HD1 TYR 55 -7.496 0.138 4.029
400 HD2 TYR 55 HD2 TYR 55 -4.418 -1.689 6.403
401 HE1 TYR 55 HE1 TYR 55 -8.028 1.674 5.902
402 HE2 TYR 55 HE2 TYR 55 -4.951 -0.154 8.276
403 HH TYR 55 HH TYR 55 -7.732 1.999 8.151
404 H VAL 56 H VAL 56 -2.415 -2.373 2.844
405 HA VAL 56 HA VAL 56 -3.258 -4.007 0.495
406 HB VAL 56 HB VAL 56 -1.033 -3.612 -0.547
407 HG11 VAL 56 1HG1 VAL 56 -2.660 -1.113 0.007
408 HG12 VAL 56 2HG1 VAL 56 -3.004 -2.307 -1.244
409 HG13 VAL 56 3HG1 VAL 56 -1.539 -1.329 -1.338
410 HG21 VAL 56 3HG2 VAL 56 0.343 -2.968 1.290
411 HG22 VAL 56 1HG2 VAL 56 -0.781 -1.706 1.792
412 HG23 VAL 56 2HG2 VAL 56 0.166 -1.507 0.320
413 H ALA 57 H ALA 57 -2.060 -5.968 0.280
414 HA ALA 57 HA ALA 57 -1.329 -7.161 2.811
415 HB1 ALA 57 3HB ALA 57 -1.231 -9.190 1.644
416 HB2 ALA 57 1HB ALA 57 -0.730 -8.414 0.142
417 HB3 ALA 57 2HB ALA 57 -2.393 -8.258 0.701
418 H LYS 58 H LYS 58 0.671 -7.949 3.457
419 HA LYS 58 HA LYS 58 2.956 -6.325 2.905
420 HB2 LYS 58 1HB LYS 58 2.654 -9.037 4.213
421 HB3 LYS 58 2HB LYS 58 4.184 -8.160 4.158
422 HG2 LYS 58 1HG LYS 58 3.115 -6.249 5.311
423 HG3 LYS 58 2HG LYS 58 1.602 -7.146 5.383
424 HD2 LYS 58 1HD LYS 58 2.571 -8.825 6.811
425 HD3 LYS 58 2HD LYS 58 4.190 -8.162 6.584
426 HE2 LYS 58 1HE LYS 58 3.172 -7.495 8.767
427 HE3 LYS 58 2HE LYS 58 3.562 -6.112 7.745
428 HZ1 LYS 58 3HZ LYS 58 1.170 -6.548 8.882
429 HZ2 LYS 58 1HZ LYS 58 0.924 -7.196 7.336
430 HZ3 LYS 58 2HZ LYS 58 1.421 -5.583 7.506
431 H GLU 59 H GLU 59 1.871 -9.417 1.605
432 HA GLU 59 HA GLU 59 4.213 -10.296 0.317
433 HB2 GLU 59 1HB GLU 59 1.325 -10.484 -0.572
434 HB3 GLU 59 2HB GLU 59 2.643 -11.363 -1.348
435 HG2 GLU 59 1HG GLU 59 3.175 -12.478 0.770
436 HG3 GLU 59 2HG GLU 59 1.909 -11.563 1.588
437 H TYR 60 H TYR 60 2.026 -7.701 -0.590
438 HA TYR 60 HA TYR 60 3.351 -7.366 -3.218
439 HB2 TYR 60 1HB TYR 60 1.253 -5.630 -1.887
440 HB3 TYR 60 2HB TYR 60 1.709 -5.608 -3.590
441 HD1 TYR 60 HD1 TYR 60 1.721 -8.189 -4.612
442 HD2 TYR 60 HD2 TYR 60 -0.785 -6.692 -1.457
443 HE1 TYR 60 HE1 TYR 60 0.072 -9.967 -5.081
444 HE2 TYR 60 HE2 TYR 60 -2.437 -8.478 -1.932
445 HH TYR 60 HH TYR 60 -1.753 -11.038 -4.265
446 H ILE 61 H ILE 61 4.044 -6.556 -0.083
447 HA ILE 61 HA ILE 61 5.339 -3.963 -0.839
448 HB ILE 61 HB ILE 61 4.805 -5.091 1.918
449 HG12 ILE 61 1HG1 ILE 61 2.696 -4.560 0.826
450 HG13 ILE 61 2HG1 ILE 61 3.050 -3.301 2.003
451 HG21 ILE 61 1HG2 ILE 61 6.686 -3.571 1.916
452 HG22 ILE 61 2HG2 ILE 61 5.297 -2.713 2.584
453 HG23 ILE 61 3HG2 ILE 61 5.805 -2.413 0.921
454 HD11 ILE 61 3HD1 ILE 61 4.179 -2.093 -0.058
455 HD12 ILE 61 1HD1 ILE 61 2.428 -2.040 0.137
456 HD13 ILE 61 2HD1 ILE 61 3.151 -3.175 -0.997
457 H LYS 62 H LYS 62 7.458 -3.909 -1.067
458 HA LYS 62 HA LYS 62 9.152 -5.902 0.357
459 HB2 LYS 62 1HB LYS 62 8.688 -6.791 -1.922
460 HB3 LYS 62 2HB LYS 62 9.371 -5.315 -2.609
461 HG2 LYS 62 1HG LYS 62 11.525 -5.780 -1.540
462 HG3 LYS 62 2HG LYS 62 10.855 -7.218 -0.771
463 HD2 LYS 62 1HD LYS 62 10.419 -8.198 -3.000
464 HD3 LYS 62 2HD LYS 62 11.113 -6.763 -3.758
465 HE2 LYS 62 1HE LYS 62 13.264 -7.203 -2.631
466 HE3 LYS 62 2HE LYS 62 12.573 -8.636 -1.871
467 HZ1 LYS 62 3HZ LYS 62 13.733 -9.357 -3.780
468 HZ2 LYS 62 1HZ LYS 62 13.031 -8.164 -4.760
469 HZ3 LYS 62 2HZ LYS 62 12.082 -9.444 -4.169
470 H ASP 63 H ASP 63 11.284 -5.218 0.683
471 HA ASP 63 HA ASP 63 12.941 -3.665 1.187
472 HB2 ASP 63 1HB ASP 63 13.037 -3.700 -1.342
473 HB3 ASP 63 2HB ASP 63 12.034 -2.251 -1.333
474 H ILE 64 H ILE 64 11.006 -3.189 2.827
475 HA ILE 64 HA ILE 64 9.760 -0.577 2.548
476 HB ILE 64 HB ILE 64 10.074 -2.397 4.951
477 HG12 ILE 64 1HG1 ILE 64 7.664 -1.862 3.189
478 HG13 ILE 64 2HG1 ILE 64 8.748 -3.234 2.963
479 HG21 ILE 64 1HG2 ILE 64 8.128 -0.993 5.806
480 HG22 ILE 64 2HG2 ILE 64 8.490 0.147 4.510
481 HG23 ILE 64 3HG2 ILE 64 9.687 -0.171 5.766
482 HD11 ILE 64 3HD1 ILE 64 8.255 -4.020 5.240
483 HD12 ILE 64 1HD1 ILE 64 6.767 -3.860 4.307
484 HD13 ILE 64 2HD1 ILE 64 7.197 -2.632 5.498
485 H LYS 65 H LYS 65 11.281 1.026 2.341
486 HA LYS 65 HA LYS 65 12.959 1.566 4.742
487 HB2 LYS 65 1HB LYS 65 13.960 1.468 1.886
488 HB3 LYS 65 2HB LYS 65 14.854 2.212 3.212
489 HG2 LYS 65 1HG LYS 65 14.808 0.057 4.436
490 HG3 LYS 65 2HG LYS 65 13.958 -0.683 3.080
491 HD2 LYS 65 1HD LYS 65 15.855 -0.169 1.595
492 HD3 LYS 65 2HD LYS 65 16.706 0.593 2.939
493 HE2 LYS 65 1HE LYS 65 16.689 -1.552 4.166
494 HE3 LYS 65 2HE LYS 65 15.853 -2.315 2.814
495 HZ1 LYS 65 3HZ LYS 65 17.778 -2.601 1.787
496 HZ2 LYS 65 1HZ LYS 65 18.587 -1.978 3.140
497 HZ3 LYS 65 2HZ LYS 65 18.130 -0.942 1.875
498 H ASP 66 H ASP 66 13.576 3.791 4.925
499 HA ASP 66 HA ASP 66 11.567 5.626 3.824
500 HB2 ASP 66 1HB ASP 66 12.412 5.656 6.222
501 HB3 ASP 66 2HB ASP 66 13.932 6.289 5.592
502 H GLU 67 H GLU 67 11.917 6.415 1.814
503 HA GLU 67 HA GLU 67 14.582 6.551 0.650
504 HB2 GLU 67 1HB GLU 67 12.489 6.081 -0.663
505 HB3 GLU 67 2HB GLU 67 12.000 7.750 -0.389
506 HG2 GLU 67 1HG GLU 67 13.061 7.653 -2.552
507 HG3 GLU 67 2HG GLU 67 14.172 8.475 -1.458
508 H VAL 68 H VAL 68 15.848 8.017 1.721
509 HA VAL 68 HA VAL 68 15.229 10.861 1.292
510 HB VAL 68 HB VAL 68 15.717 11.407 3.704
511 HG11 VAL 68 1HG1 VAL 68 13.483 11.002 4.447
512 HG12 VAL 68 2HG1 VAL 68 13.337 9.560 3.445
513 HG13 VAL 68 3HG1 VAL 68 13.379 11.153 2.692
514 HG21 VAL 68 3HG2 VAL 68 15.361 9.498 5.328
515 HG22 VAL 68 1HG2 VAL 68 16.860 9.390 4.405
516 HG23 VAL 68 2HG2 VAL 68 15.476 8.392 3.961
517 H LEU 69 H LEU 69 17.342 8.255 1.518
518 HA LEU 69 HA LEU 69 19.765 9.888 2.005
519 HB2 LEU 69 1HB LEU 69 20.841 7.531 1.450
520 HB3 LEU 69 2HB LEU 69 20.076 7.816 3.011
521 HG LEU 69 HG LEU 69 18.295 6.837 0.801
522 HD11 LEU 69 1HD1 LEU 69 20.374 5.130 2.190
523 HD12 LEU 69 2HD1 LEU 69 20.160 5.357 0.455
524 HD13 LEU 69 3HD1 LEU 69 18.954 4.464 1.382
525 HD21 LEU 69 3HD2 LEU 69 17.201 5.677 2.640
526 HD22 LEU 69 1HD2 LEU 69 17.512 7.337 3.150
527 HD23 LEU 69 2HD2 LEU 69 18.550 6.031 3.718
528 H GLU 70 H GLU 70 21.454 10.069 0.471
529 HA GLU 70 HA GLU 70 20.701 10.705 -2.179
530 HB2 GLU 70 1HB GLU 70 23.107 10.830 -2.644
531 HB3 GLU 70 2HB GLU 70 22.746 11.550 -1.078
532 HG2 GLU 70 1HG GLU 70 23.385 9.401 0.021
533 HG3 GLU 70 2HG GLU 70 23.836 8.757 -1.556
534 H HIS 71 H HIS 71 21.118 9.652 -4.179
535 HA HIS 71 HA HIS 71 21.862 6.786 -4.116
536 HB2 HIS 71 1HB HIS 71 19.843 6.138 -5.390
537 HB3 HIS 71 2HB HIS 71 19.430 6.756 -3.791
538 HD1 HIS 71 HD1 HIS 71 18.232 9.049 -3.660
539 HD2 HIS 71 HD2 HIS 71 19.080 7.839 -7.559
540 HE1 HIS 71 HE1 HIS 71 16.937 10.598 -5.190
541 H HIS 72 H HIS 72 22.064 5.913 -6.343
542 HA HIS 72 HA HIS 72 23.267 6.059 -8.347
543 HB2 HIS 72 1HB HIS 72 20.966 6.461 -9.093
544 HB3 HIS 72 2HB HIS 72 21.156 8.190 -8.806
545 HD1 HIS 72 HD1 HIS 72 22.679 5.411 -10.931
546 HD2 HIS 72 HD2 HIS 72 22.275 9.561 -10.945
547 HE1 HIS 72 HE1 HIS 72 23.592 6.213 -13.153
548 H HIS 73 H HIS 73 25.273 6.811 -7.699
549 HA HIS 73 HA HIS 73 25.834 9.602 -7.192
550 HB2 HIS 73 1HB HIS 73 28.179 8.904 -7.139
551 HB3 HIS 73 2HB HIS 73 27.190 7.747 -6.249
552 HD1 HIS 73 HD1 HIS 73 26.538 5.501 -7.605
553 HD2 HIS 73 HD2 HIS 73 29.609 7.788 -9.252
554 HE1 HIS 73 HE1 HIS 73 27.719 4.014 -9.281
555 H HIS 74 H HIS 74 26.252 11.177 -8.634
556 HA HIS 74 HA HIS 74 26.562 10.431 -11.508
557 HB2 HIS 74 1HB HIS 74 25.818 12.696 -12.005
558 HB3 HIS 74 2HB HIS 74 24.684 11.947 -10.885
559 HD1 HIS 74 HD1 HIS 74 25.012 12.631 -8.284
560 HD2 HIS 74 HD2 HIS 74 26.939 15.064 -11.069
561 HE1 HIS 74 HE1 HIS 74 25.607 14.776 -7.074
562 H HIS 75 H HIS 75 28.638 10.340 -12.127
563 HA HIS 75 HA HIS 75 30.445 12.599 -11.440
564 HB2 HIS 75 1HB HIS 75 31.035 9.677 -10.937
565 HB3 HIS 75 2HB HIS 75 32.294 10.906 -11.035
566 HD1 HIS 75 HD1 HIS 75 29.251 9.972 -8.973
567 HD2 HIS 75 HD2 HIS 75 32.560 12.498 -8.755
568 HE1 HIS 75 HE1 HIS 75 29.283 10.910 -6.621
569 H HIS 76 H HIS 76 32.057 12.949 -12.986
570 HA HIS 76 HA HIS 76 31.460 12.085 -15.682
571 HB2 HIS 76 1HB HIS 76 33.869 13.533 -14.540
572 HB3 HIS 76 2HB HIS 76 33.506 13.378 -16.259
573 HD1 HIS 76 HD1 HIS 76 31.097 14.419 -16.994
574 HD2 HIS 76 HD2 HIS 76 32.608 15.691 -13.323
575 HE1 HIS 76 HE1 HIS 76 29.831 16.528 -16.391
Start of MODEL 13
1 H1 ALA 1 1H ALA 1 7.092 5.306 13.527
2 H2 ALA 1 2H ALA 1 6.729 4.833 11.935
3 H3 ALA 1 3H ALA 1 6.476 6.440 12.426
4 HA ALA 1 HA ALA 1 8.822 6.804 12.674
5 HB1 ALA 1 3HB ALA 1 9.563 4.650 13.424
6 HB2 ALA 1 1HB ALA 1 10.341 4.918 11.865
7 HB3 ALA 1 2HB ALA 1 8.936 3.859 11.977
8 H GLU 2 H GLU 2 6.497 6.027 10.534
9 HA GLU 2 HA GLU 2 6.146 6.425 8.267
10 HB2 GLU 2 1HB GLU 2 8.477 8.291 8.782
11 HB3 GLU 2 2HB GLU 2 7.566 8.258 7.271
12 HG2 GLU 2 1HG GLU 2 5.495 8.748 8.467
13 HG3 GLU 2 2HG GLU 2 6.351 8.703 10.009
14 H LYS 3 H LYS 3 6.521 4.816 6.873
15 HA LYS 3 HA LYS 3 9.343 4.237 6.064
16 HB2 LYS 3 1HB LYS 3 7.174 2.235 6.720
17 HB3 LYS 3 2HB LYS 3 8.694 1.819 5.928
18 HG2 LYS 3 1HG LYS 3 9.922 2.801 7.871
19 HG3 LYS 3 2HG LYS 3 8.379 3.057 8.677
20 HD2 LYS 3 1HD LYS 3 9.290 0.344 7.689
21 HD3 LYS 3 2HD LYS 3 9.602 0.920 9.325
22 HE2 LYS 3 1HE LYS 3 7.065 1.326 9.489
23 HE3 LYS 3 2HE LYS 3 6.933 0.351 8.025
24 HZ1 LYS 3 3HZ LYS 3 7.128 -0.561 10.617
25 HZ2 LYS 3 1HZ LYS 3 8.630 -0.906 9.906
26 HZ3 LYS 3 2HZ LYS 3 7.201 -1.487 9.194
27 H THR 4 H THR 4 9.584 3.533 3.889
28 HA THR 4 HA THR 4 7.176 4.025 2.160
29 HB THR 4 HB THR 4 8.853 4.682 0.413
30 HG1 THR 4 HG1 THR 4 10.945 5.266 1.533
31 HG21 THR 4 3HG2 THR 4 9.222 6.881 1.317
32 HG22 THR 4 1HG2 THR 4 9.136 6.274 2.971
33 HG23 THR 4 2HG2 THR 4 7.688 6.304 1.967
34 H GLY 5 H GLY 5 6.441 2.196 1.277
35 HA2 GLY 5 1HA GLY 5 8.318 -0.094 0.853
36 HA3 GLY 5 2HA GLY 5 6.574 -0.228 1.029
37 H ILE 6 H ILE 6 8.785 -0.737 -1.197
38 HA ILE 6 HA ILE 6 7.625 0.759 -3.448
39 HB ILE 6 HB ILE 6 9.793 -1.349 -3.236
40 HG12 ILE 6 1HG1 ILE 6 11.224 0.570 -3.923
41 HG13 ILE 6 2HG1 ILE 6 9.806 1.613 -3.915
42 HG21 ILE 6 1HG2 ILE 6 10.216 -0.612 -5.685
43 HG22 ILE 6 2HG2 ILE 6 8.551 -0.029 -5.657
44 HG23 ILE 6 3HG2 ILE 6 8.890 -1.739 -5.393
45 HD11 ILE 6 3HD1 ILE 6 9.632 1.595 -1.597
46 HD12 ILE 6 1HD1 ILE 6 11.379 1.488 -1.794
47 HD13 ILE 6 2HD1 ILE 6 10.446 0.037 -1.440
48 H VAL 7 H VAL 7 5.927 0.027 -4.621
49 HA VAL 7 HA VAL 7 4.704 -2.531 -4.005
50 HB VAL 7 HB VAL 7 4.126 -0.441 -6.114
51 HG11 VAL 7 1HG1 VAL 7 3.213 -2.446 -7.000
52 HG12 VAL 7 2HG1 VAL 7 1.866 -1.676 -6.163
53 HG13 VAL 7 3HG1 VAL 7 2.720 -3.022 -5.407
54 HG21 VAL 7 3HG2 VAL 7 2.544 -1.152 -3.636
55 HG22 VAL 7 1HG2 VAL 7 2.409 0.296 -4.635
56 HG23 VAL 7 2HG2 VAL 7 3.826 0.060 -3.612
57 H ASN 8 H ASN 8 5.058 -4.440 -5.000
58 HA ASN 8 HA ASN 8 6.542 -4.458 -7.612
59 HB2 ASN 8 1HB ASN 8 7.887 -5.282 -5.690
60 HB3 ASN 8 2HB ASN 8 6.651 -6.502 -5.374
61 HD21 ASN 8 2HD2 ASN 8 9.147 -7.503 -5.942
62 HD22 ASN 8 1HD2 ASN 8 9.201 -8.138 -7.516
63 H VAL 9 H VAL 9 4.869 -4.799 -9.040
64 HA VAL 9 HA VAL 9 3.290 -7.310 -8.682
65 HB VAL 9 HB VAL 9 1.294 -6.105 -9.628
66 HG11 VAL 9 1HG1 VAL 9 0.608 -5.193 -7.526
67 HG12 VAL 9 2HG1 VAL 9 2.272 -4.832 -7.063
68 HG13 VAL 9 3HG1 VAL 9 1.722 -6.504 -7.148
69 HG21 VAL 9 3HG2 VAL 9 2.237 -4.193 -10.685
70 HG22 VAL 9 1HG2 VAL 9 3.142 -3.741 -9.241
71 HG23 VAL 9 2HG2 VAL 9 1.393 -3.554 -9.275
72 H SER 10 H SER 10 2.403 -8.105 -10.727
73 HA SER 10 HA SER 10 4.326 -7.739 -12.911
74 HB2 SER 10 1HB SER 10 3.059 -9.568 -13.977
75 HB3 SER 10 2HB SER 10 3.458 -9.981 -12.312
76 HG SER 10 HG SER 10 1.049 -8.653 -12.876
77 H SER 11 H SER 11 1.358 -6.351 -11.968
78 HA SER 11 HA SER 11 1.142 -4.963 -14.588
79 HB2 SER 11 1HB SER 11 -1.043 -6.594 -13.280
80 HB3 SER 11 2HB SER 11 -1.410 -5.289 -14.403
81 HG SER 11 HG SER 11 -0.798 -6.521 -15.990
82 H SER 12 H SER 12 -0.889 -5.208 -11.643
83 HA SER 12 HA SER 12 -0.067 -2.511 -10.812
84 HB2 SER 12 1HB SER 12 -2.915 -3.068 -11.684
85 HB3 SER 12 2HB SER 12 -2.359 -1.594 -10.896
86 HG SER 12 HG SER 12 -1.089 -1.155 -12.665
87 H LEU 13 H LEU 13 -1.330 -1.864 -8.784
88 HA LEU 13 HA LEU 13 -1.996 -4.318 -7.186
89 HB2 LEU 13 1HB LEU 13 0.090 -3.154 -6.482
90 HB3 LEU 13 2HB LEU 13 -0.851 -1.694 -6.194
91 HG LEU 13 HG LEU 13 -2.254 -2.968 -4.559
92 HD11 LEU 13 1HD1 LEU 13 -0.407 -5.182 -5.403
93 HD12 LEU 13 2HD1 LEU 13 -2.139 -5.231 -5.074
94 HD13 LEU 13 3HD1 LEU 13 -0.994 -5.152 -3.741
95 HD21 LEU 13 3HD2 LEU 13 0.737 -2.896 -4.073
96 HD22 LEU 13 1HD2 LEU 13 -0.465 -3.136 -2.804
97 HD23 LEU 13 2HD2 LEU 13 -0.429 -1.624 -3.710
98 H ASN 14 H ASN 14 -4.002 -4.393 -6.341
99 HA ASN 14 HA ASN 14 -5.794 -2.075 -6.707
100 HB2 ASN 14 1HB ASN 14 -7.583 -3.625 -6.197
101 HB3 ASN 14 2HB ASN 14 -6.481 -4.407 -7.330
102 HD21 ASN 14 2HD2 ASN 14 -5.540 -6.378 -6.679
103 HD22 ASN 14 1HD2 ASN 14 -5.687 -7.031 -5.118
104 H VAL 15 H VAL 15 -6.121 -0.647 -5.102
105 HA VAL 15 HA VAL 15 -5.053 -1.094 -2.436
106 HB VAL 15 HB VAL 15 -6.813 1.130 -3.508
107 HG11 VAL 15 1HG1 VAL 15 -6.932 1.119 -1.108
108 HG12 VAL 15 2HG1 VAL 15 -5.775 2.374 -1.551
109 HG13 VAL 15 3HG1 VAL 15 -5.200 0.814 -0.964
110 HG21 VAL 15 3HG2 VAL 15 -4.575 0.778 -4.636
111 HG22 VAL 15 1HG2 VAL 15 -3.814 1.076 -3.073
112 HG23 VAL 15 2HG2 VAL 15 -4.758 2.347 -3.850
113 H ARG 16 H ARG 16 -6.313 -1.137 -0.469
114 HA ARG 16 HA ARG 16 -9.190 -1.918 -0.827
115 HB2 ARG 16 1HB ARG 16 -7.052 -3.205 0.890
116 HB3 ARG 16 2HB ARG 16 -8.777 -3.498 1.115
117 HG2 ARG 16 1HG ARG 16 -8.979 -4.345 -1.160
118 HG3 ARG 16 2HG ARG 16 -7.295 -3.935 -1.493
119 HD2 ARG 16 1HD ARG 16 -8.125 -5.856 0.696
120 HD3 ARG 16 2HD ARG 16 -7.710 -6.377 -0.936
121 HE ARG 16 HE ARG 16 -5.603 -4.727 0.031
122 HH11 ARG 16 1HH2 ARG 16 -7.112 -7.778 0.597
123 HH12 ARG 16 2HH2 ARG 16 -5.667 -8.526 1.192
124 HH21 ARG 16 1HH1 ARG 16 -3.719 -5.689 0.797
125 HH22 ARG 16 2HH1 ARG 16 -3.746 -7.344 1.301
126 H GLU 17 H GLU 17 -10.577 -0.952 0.576
127 HA GLU 17 HA GLU 17 -9.665 1.255 2.201
128 HB2 GLU 17 1HB GLU 17 -11.955 0.936 1.055
129 HB3 GLU 17 2HB GLU 17 -12.355 -0.117 2.411
130 HG2 GLU 17 1HG GLU 17 -11.378 2.730 2.762
131 HG3 GLU 17 2HG GLU 17 -13.083 2.288 2.690
132 H GLY 18 H GLY 18 -10.711 -2.066 2.871
133 HA2 GLY 18 1HA GLY 18 -10.095 -1.677 5.772
134 HA3 GLY 18 2HA GLY 18 -11.074 -2.977 5.102
135 H ALA 19 H ALA 19 -9.311 -3.968 6.699
136 HA ALA 19 HA ALA 19 -6.782 -4.582 5.263
137 HB1 ALA 19 3HB ALA 19 -6.851 -4.008 7.736
138 HB2 ALA 19 1HB ALA 19 -6.061 -5.538 7.361
139 HB3 ALA 19 2HB ALA 19 -7.709 -5.527 7.990
140 H SER 20 H SER 20 -9.897 -5.698 5.295
141 HA SER 20 HA SER 20 -9.306 -8.574 5.325
142 HB2 SER 20 1HB SER 20 -11.798 -6.935 4.853
143 HB3 SER 20 2HB SER 20 -11.774 -8.673 4.566
144 HG SER 20 HG SER 20 -10.956 -7.428 6.983
145 H THR 21 H THR 21 -9.522 -9.948 3.485
146 HA THR 21 HA THR 21 -8.508 -8.859 1.011
147 HB THR 21 HB THR 21 -8.881 -11.171 0.158
148 HG1 THR 21 HG1 THR 21 -9.714 -11.946 2.699
149 HG21 THR 21 3HG2 THR 21 -7.638 -10.869 2.905
150 HG22 THR 21 1HG2 THR 21 -6.821 -10.764 1.345
151 HG23 THR 21 2HG2 THR 21 -7.454 -12.311 1.907
152 H SER 22 H SER 22 -11.715 -9.580 2.236
153 HA SER 22 HA SER 22 -12.981 -9.286 -0.407
154 HB2 SER 22 1HB SER 22 -15.061 -9.690 0.792
155 HB3 SER 22 2HB SER 22 -13.857 -10.847 1.351
156 HG SER 22 HG SER 22 -15.110 -8.802 2.685
157 H SER 23 H SER 23 -11.545 -7.123 1.498
158 HA SER 23 HA SER 23 -13.485 -5.101 2.001
159 HB2 SER 23 1HB SER 23 -11.377 -4.895 3.073
160 HB3 SER 23 2HB SER 23 -10.503 -5.014 1.550
161 HG SER 23 HG SER 23 -12.182 -2.905 2.448
162 H LYS 24 H LYS 24 -14.121 -3.293 0.806
163 HA LYS 24 HA LYS 24 -14.305 -3.635 -2.040
164 HB2 LYS 24 1HB LYS 24 -15.999 -2.459 -0.648
165 HB3 LYS 24 2HB LYS 24 -14.847 -1.145 -0.404
166 HG2 LYS 24 1HG LYS 24 -14.762 -0.733 -2.815
167 HG3 LYS 24 2HG LYS 24 -15.842 -2.096 -3.108
168 HD2 LYS 24 1HD LYS 24 -17.609 -0.974 -1.791
169 HD3 LYS 24 2HD LYS 24 -16.531 0.397 -1.520
170 HE2 LYS 24 1HE LYS 24 -16.397 0.773 -3.958
171 HE3 LYS 24 2HE LYS 24 -17.478 -0.594 -4.227
172 HZ1 LYS 24 3HZ LYS 24 -18.921 1.175 -4.235
173 HZ2 LYS 24 1HZ LYS 24 -18.068 2.035 -3.049
174 HZ3 LYS 24 2HZ LYS 24 -19.010 0.692 -2.609
175 H VAL 25 H VAL 25 -13.134 -2.750 -3.680
176 HA VAL 25 HA VAL 25 -10.541 -1.578 -3.032
177 HB VAL 25 HB VAL 25 -11.920 -2.184 -5.661
178 HG11 VAL 25 1HG1 VAL 25 -9.176 -1.078 -5.036
179 HG12 VAL 25 2HG1 VAL 25 -10.382 -0.432 -6.149
180 HG13 VAL 25 3HG1 VAL 25 -9.524 -1.921 -6.545
181 HG21 VAL 25 3HG2 VAL 25 -11.344 -4.190 -4.449
182 HG22 VAL 25 1HG2 VAL 25 -9.752 -3.548 -4.040
183 HG23 VAL 25 2HG2 VAL 25 -10.129 -3.975 -5.709
184 H ILE 26 H ILE 26 -10.043 0.562 -3.060
185 HA ILE 26 HA ILE 26 -12.167 2.495 -3.886
186 HB ILE 26 HB ILE 26 -10.763 4.128 -2.571
187 HG12 ILE 26 1HG1 ILE 26 -9.319 1.625 -1.646
188 HG13 ILE 26 2HG1 ILE 26 -8.642 2.760 -2.814
189 HG21 ILE 26 1HG2 ILE 26 -12.678 3.140 -1.500
190 HG22 ILE 26 2HG2 ILE 26 -11.351 3.067 -0.340
191 HG23 ILE 26 3HG2 ILE 26 -11.820 1.622 -1.236
192 HD11 ILE 26 3HD1 ILE 26 -7.804 3.352 -0.615
193 HD12 ILE 26 1HD1 ILE 26 -9.438 3.357 0.050
194 HD13 ILE 26 2HD1 ILE 26 -8.957 4.589 -1.116
195 H GLY 27 H GLY 27 -9.392 1.065 -5.094
196 HA2 GLY 27 1HA GLY 27 -9.234 2.455 -7.462
197 HA3 GLY 27 2HA GLY 27 -8.248 3.426 -6.371
198 H SER 28 H SER 28 -6.719 2.579 -8.258
199 HA SER 28 HA SER 28 -5.296 0.168 -7.190
200 HB2 SER 28 1HB SER 28 -5.911 0.832 -10.079
201 HB3 SER 28 2HB SER 28 -4.736 -0.383 -9.585
202 HG SER 28 HG SER 28 -6.316 -1.653 -8.921
203 H LEU 29 H LEU 29 -2.994 0.147 -7.743
204 HA LEU 29 HA LEU 29 -1.880 2.891 -8.239
205 HB2 LEU 29 1HB LEU 29 -0.835 0.673 -6.458
206 HB3 LEU 29 2HB LEU 29 -0.001 2.196 -6.766
207 HG LEU 29 HG LEU 29 -2.778 1.958 -5.568
208 HD11 LEU 29 1HD1 LEU 29 -0.183 2.690 -4.181
209 HD12 LEU 29 2HD1 LEU 29 -0.903 1.080 -4.125
210 HD13 LEU 29 3HD1 LEU 29 -1.764 2.455 -3.436
211 HD21 LEU 29 3HD2 LEU 29 -2.040 4.421 -4.898
212 HD22 LEU 29 1HD2 LEU 29 -2.733 4.108 -6.484
213 HD23 LEU 29 2HD2 LEU 29 -0.986 4.268 -6.298
214 H SER 30 H SER 30 -0.001 3.015 -9.487
215 HA SER 30 HA SER 30 0.245 0.989 -11.537
216 HB2 SER 30 1HB SER 30 1.895 3.450 -10.926
217 HB3 SER 30 2HB SER 30 2.094 2.452 -12.364
218 HG SER 30 HG SER 30 -0.463 3.372 -11.693
219 H GLY 31 H GLY 31 2.300 -0.047 -12.108
220 HA2 GLY 31 1HA GLY 31 3.406 -1.534 -9.951
221 HA3 GLY 31 2HA GLY 31 4.051 -1.497 -11.587
222 H ASN 32 H ASN 32 5.462 -1.491 -8.998
223 HA ASN 32 HA ASN 32 7.307 -0.465 -8.005
224 HB2 ASN 32 1HB ASN 32 7.508 1.032 -10.636
225 HB3 ASN 32 2HB ASN 32 8.806 0.751 -9.474
226 HD21 ASN 32 2HD2 ASN 32 8.375 -0.208 -12.393
227 HD22 ASN 32 1HD2 ASN 32 8.627 -1.885 -12.302
228 H THR 33 H THR 33 4.667 0.760 -7.650
229 HA THR 33 HA THR 33 5.226 3.667 -7.622
230 HB THR 33 HB THR 33 2.784 2.040 -6.868
231 HG1 THR 33 HG1 THR 33 2.870 4.018 -8.828
232 HG21 THR 33 3HG2 THR 33 1.721 4.390 -6.832
233 HG22 THR 33 1HG2 THR 33 3.367 4.996 -6.649
234 HG23 THR 33 2HG2 THR 33 2.681 3.921 -5.429
235 H LYS 34 H LYS 34 6.032 4.667 -5.858
236 HA LYS 34 HA LYS 34 6.541 3.150 -3.413
237 HB2 LYS 34 1HB LYS 34 8.135 4.814 -4.366
238 HB3 LYS 34 2HB LYS 34 6.978 6.089 -3.997
239 HG2 LYS 34 1HG LYS 34 7.061 5.486 -1.607
240 HG3 LYS 34 2HG LYS 34 8.222 4.212 -1.966
241 HD2 LYS 34 1HD LYS 34 8.729 7.104 -2.699
242 HD3 LYS 34 2HD LYS 34 9.182 6.446 -1.129
243 HE2 LYS 34 1HE LYS 34 10.458 4.630 -2.411
244 HE3 LYS 34 2HE LYS 34 10.212 5.614 -3.852
245 HZ1 LYS 34 3HZ LYS 34 11.905 6.866 -3.248
246 HZ2 LYS 34 1HZ LYS 34 12.138 5.929 -1.855
247 HZ3 LYS 34 2HZ LYS 34 11.112 7.282 -1.805
248 H VAL 35 H VAL 35 5.329 3.221 -1.557
249 HA VAL 35 HA VAL 35 3.157 5.289 -1.369
250 HB VAL 35 HB VAL 35 1.892 3.468 -0.099
251 HG11 VAL 35 1HG1 VAL 35 1.293 4.156 -2.373
252 HG12 VAL 35 2HG1 VAL 35 1.127 2.406 -2.218
253 HG13 VAL 35 3HG1 VAL 35 2.529 3.091 -3.041
254 HG21 VAL 35 3HG2 VAL 35 3.957 1.734 -1.498
255 HG22 VAL 35 1HG2 VAL 35 2.549 1.149 -0.613
256 HG23 VAL 35 2HG2 VAL 35 3.850 1.975 0.246
257 H THR 36 H THR 36 3.138 6.432 0.473
258 HA THR 36 HA THR 36 5.240 5.991 2.445
259 HB THR 36 HB THR 36 2.962 7.989 2.439
260 HG1 THR 36 HG1 THR 36 5.162 9.171 1.835
261 HG21 THR 36 3HG2 THR 36 3.983 7.741 4.640
262 HG22 THR 36 1HG2 THR 36 4.497 9.269 3.926
263 HG23 THR 36 2HG2 THR 36 5.595 7.889 3.937
264 H ILE 37 H ILE 37 5.028 4.878 4.308
265 HA ILE 37 HA ILE 37 2.338 3.862 5.068
266 HB ILE 37 HB ILE 37 5.141 3.100 5.934
267 HG12 ILE 37 1HG1 ILE 37 3.070 1.520 4.393
268 HG13 ILE 37 2HG1 ILE 37 4.336 2.468 3.614
269 HG21 ILE 37 1HG2 ILE 37 3.760 2.681 7.827
270 HG22 ILE 37 2HG2 ILE 37 3.876 1.134 6.989
271 HG23 ILE 37 3HG2 ILE 37 2.423 2.119 6.822
272 HD11 ILE 37 3HD1 ILE 37 6.062 1.118 4.565
273 HD12 ILE 37 1HD1 ILE 37 4.848 -0.011 3.965
274 HD13 ILE 37 2HD1 ILE 37 4.940 0.350 5.688
275 H VAL 38 H VAL 38 1.269 4.789 6.710
276 HA VAL 38 HA VAL 38 2.771 6.503 8.657
277 HB VAL 38 HB VAL 38 0.600 7.636 9.021
278 HG11 VAL 38 1HG1 VAL 38 0.564 8.842 6.955
279 HG12 VAL 38 2HG1 VAL 38 1.149 7.446 6.051
280 HG13 VAL 38 3HG1 VAL 38 2.226 8.292 7.162
281 HG21 VAL 38 3HG2 VAL 38 -1.222 7.078 7.297
282 HG22 VAL 38 1HG2 VAL 38 -0.994 5.905 8.595
283 HG23 VAL 38 2HG2 VAL 38 -0.330 5.588 6.993
284 H GLY 39 H GLY 39 1.451 3.472 8.343
285 HA2 GLY 39 1HA GLY 39 1.544 2.945 11.158
286 HA3 GLY 39 2HA GLY 39 -0.136 3.103 10.648
287 H GLU 40 H GLU 40 0.352 0.679 11.573
288 HA GLU 40 HA GLU 40 0.460 -1.024 9.133
289 HB2 GLU 40 1HB GLU 40 2.732 -1.078 10.152
290 HB3 GLU 40 2HB GLU 40 2.017 -1.617 11.673
291 HG2 GLU 40 1HG GLU 40 1.152 -3.634 10.590
292 HG3 GLU 40 2HG GLU 40 1.774 -3.089 9.032
293 H GLU 41 H GLU 41 -0.676 -3.041 9.407
294 HA GLU 41 HA GLU 41 -2.073 -3.516 11.960
295 HB2 GLU 41 1HB GLU 41 -3.460 -1.865 10.565
296 HB3 GLU 41 2HB GLU 41 -3.704 -3.191 9.432
297 HG2 GLU 41 1HG GLU 41 -4.358 -3.403 12.386
298 HG3 GLU 41 2HG GLU 41 -5.535 -2.923 11.165
299 H GLY 42 H GLY 42 -1.459 -5.598 12.195
300 HA2 GLY 42 1HA GLY 42 -1.183 -7.876 11.768
301 HA3 GLY 42 2HA GLY 42 -2.587 -7.708 10.719
302 H ALA 43 H ALA 43 -1.993 -8.862 8.946
303 HA ALA 43 HA ALA 43 0.715 -8.662 7.826
304 HB1 ALA 43 3HB ALA 43 -0.418 -10.159 6.023
305 HB2 ALA 43 1HB ALA 43 -1.784 -10.205 7.139
306 HB3 ALA 43 2HB ALA 43 -0.212 -10.828 7.640
307 H PHE 44 H PHE 44 -1.162 -6.291 7.906
308 HA PHE 44 HA PHE 44 -1.038 -5.633 4.982
309 HB2 PHE 44 1HB PHE 44 -3.262 -4.875 6.906
310 HB3 PHE 44 2HB PHE 44 -3.145 -4.391 5.213
311 HD1 PHE 44 HD1 PHE 44 -3.364 -6.067 3.401
312 HD2 PHE 44 HD2 PHE 44 -3.926 -7.105 7.530
313 HE1 PHE 44 HE1 PHE 44 -4.459 -8.186 2.719
314 HE2 PHE 44 HE2 PHE 44 -5.022 -9.223 6.849
315 HZ PHE 44 HZ PHE 44 -5.289 -9.763 4.442
316 H TYR 45 H TYR 45 -0.408 -3.527 4.527
317 HA TYR 45 HA TYR 45 0.619 -1.951 6.855
318 HB2 TYR 45 1HB TYR 45 1.474 -2.189 3.969
319 HB3 TYR 45 2HB TYR 45 1.956 -0.800 4.944
320 HD1 TYR 45 HD1 TYR 45 2.935 -1.360 7.314
321 HD2 TYR 45 HD2 TYR 45 2.809 -4.130 4.035
322 HE1 TYR 45 HE1 TYR 45 4.744 -2.685 8.367
323 HE2 TYR 45 HE2 TYR 45 4.623 -5.453 5.089
324 HH TYR 45 HH TYR 45 5.461 -5.276 8.191
325 H LYS 46 H LYS 46 -0.045 0.132 7.139
326 HA LYS 46 HA LYS 46 -2.359 1.027 5.516
327 HB2 LYS 46 1HB LYS 46 -2.511 1.074 7.989
328 HB3 LYS 46 2HB LYS 46 -1.139 2.182 8.041
329 HG2 LYS 46 1HG LYS 46 -2.399 3.847 6.754
330 HG3 LYS 46 2HG LYS 46 -3.762 2.736 6.621
331 HD2 LYS 46 1HD LYS 46 -3.988 2.728 9.083
332 HD3 LYS 46 2HD LYS 46 -2.635 3.856 9.206
333 HE2 LYS 46 1HE LYS 46 -3.889 5.509 7.871
334 HE3 LYS 46 2HE LYS 46 -5.238 4.383 7.747
335 HZ1 LYS 46 3HZ LYS 46 -4.358 5.978 10.010
336 HZ2 LYS 46 1HZ LYS 46 -4.892 4.409 10.369
337 HZ3 LYS 46 2HZ LYS 46 -5.924 5.494 9.563
338 H ILE 47 H ILE 47 -2.172 2.629 4.029
339 HA ILE 47 HA ILE 47 0.249 4.386 4.100
340 HB ILE 47 HB ILE 47 0.318 4.239 1.616
341 HG12 ILE 47 1HG1 ILE 47 -1.651 1.959 1.986
342 HG13 ILE 47 2HG1 ILE 47 -2.087 3.545 1.353
343 HG21 ILE 47 1HG2 ILE 47 0.544 1.625 3.132
344 HG22 ILE 47 2HG2 ILE 47 1.806 2.843 2.943
345 HG23 ILE 47 3HG2 ILE 47 1.251 1.927 1.546
346 HD11 ILE 47 3HD1 ILE 47 -0.033 1.675 0.142
347 HD12 ILE 47 1HD1 ILE 47 -0.470 3.263 -0.487
348 HD13 ILE 47 2HD1 ILE 47 -1.656 1.958 -0.485
349 H GLU 48 H GLU 48 -0.054 6.464 3.138
350 HA GLU 48 HA GLU 48 -2.864 7.394 3.324
351 HB2 GLU 48 1HB GLU 48 -1.068 8.653 4.475
352 HB3 GLU 48 2HB GLU 48 -0.289 8.944 2.919
353 HG2 GLU 48 1HG GLU 48 -2.245 10.172 2.125
354 HG3 GLU 48 2HG GLU 48 -3.106 9.815 3.624
355 H TYR 49 H TYR 49 -3.835 6.721 1.394
356 HA TYR 49 HA TYR 49 -2.564 7.603 -1.170
357 HB2 TYR 49 1HB TYR 49 -3.032 5.230 -1.109
358 HB3 TYR 49 2HB TYR 49 -4.691 5.526 -0.588
359 HD1 TYR 49 HD2 TYR 49 -2.304 6.360 -3.354
360 HD2 TYR 49 HD1 TYR 49 -6.390 5.724 -2.197
361 HE1 TYR 49 HE2 TYR 49 -3.007 6.568 -5.722
362 HE2 TYR 49 HE1 TYR 49 -7.093 5.936 -4.566
363 HH TYR 49 HH TYR 49 -6.376 6.737 -6.630
364 H LYS 50 H LYS 50 -3.403 9.346 -2.111
365 HA LYS 50 HA LYS 50 -4.827 11.129 -2.571
366 HB2 LYS 50 1HB LYS 50 -5.970 9.024 -3.612
367 HB3 LYS 50 2HB LYS 50 -7.132 9.197 -2.297
368 HG2 LYS 50 1HG LYS 50 -7.651 11.476 -3.002
369 HG3 LYS 50 2HG LYS 50 -6.404 11.405 -4.247
370 HD2 LYS 50 1HD LYS 50 -7.607 9.573 -5.367
371 HD3 LYS 50 2HD LYS 50 -8.858 9.628 -4.123
372 HE2 LYS 50 1HE LYS 50 -9.372 11.960 -4.737
373 HE3 LYS 50 2HE LYS 50 -8.121 11.911 -5.978
374 HZ1 LYS 50 3HZ LYS 50 -9.358 9.958 -6.918
375 HZ2 LYS 50 1HZ LYS 50 -10.144 11.454 -7.056
376 HZ3 LYS 50 2HZ LYS 50 -10.633 10.346 -5.865
377 H GLY 51 H GLY 51 -4.191 10.712 0.221
378 HA2 GLY 51 1HA GLY 51 -4.801 11.826 2.208
379 HA3 GLY 51 2HA GLY 51 -6.238 12.422 1.378
380 H SER 52 H SER 52 -6.545 9.342 0.685
381 HA SER 52 HA SER 52 -8.302 8.828 3.012
382 HB2 SER 52 1HB SER 52 -9.308 8.449 0.864
383 HB3 SER 52 2HB SER 52 -7.955 7.454 0.338
384 HG SER 52 HG SER 52 -9.879 6.907 2.351
385 H HIS 53 H HIS 53 -8.369 6.397 3.680
386 HA HIS 53 HA HIS 53 -5.590 5.618 4.396
387 HB2 HIS 53 1HB HIS 53 -8.304 4.797 5.458
388 HB3 HIS 53 2HB HIS 53 -6.781 4.114 6.024
389 HD1 HIS 53 HD1 HIS 53 -8.954 6.204 7.470
390 HD2 HIS 53 HD2 HIS 53 -5.049 6.953 6.211
391 HE1 HIS 53 HE1 HIS 53 -8.141 8.204 8.796
392 H GLY 54 H GLY 54 -4.784 4.430 2.704
393 HA2 GLY 54 1HA GLY 54 -6.458 2.287 1.497
394 HA3 GLY 54 2HA GLY 54 -4.927 2.882 0.860
395 H TYR 55 H TYR 55 -6.013 0.129 1.824
396 HA TYR 55 HA TYR 55 -3.668 -0.554 3.578
397 HB2 TYR 55 1HB TYR 55 -6.436 -1.781 3.463
398 HB3 TYR 55 2HB TYR 55 -5.091 -2.439 4.398
399 HD1 TYR 55 HD2 TYR 55 -7.357 0.472 4.009
400 HD2 TYR 55 HD1 TYR 55 -4.372 -1.421 6.447
401 HE1 TYR 55 HE2 TYR 55 -7.860 2.053 5.852
402 HE2 TYR 55 HE1 TYR 55 -4.869 0.163 8.289
403 HH TYR 55 HH TYR 55 -7.595 2.347 8.148
404 H VAL 56 H VAL 56 -2.349 -2.191 2.864
405 HA VAL 56 HA VAL 56 -3.276 -3.875 0.579
406 HB VAL 56 HB VAL 56 -1.024 -3.541 -0.502
407 HG11 VAL 56 1HG1 VAL 56 -3.134 -2.333 -1.179
408 HG12 VAL 56 2HG1 VAL 56 -1.649 -1.466 -1.566
409 HG13 VAL 56 3HG1 VAL 56 -2.613 -0.982 -0.171
410 HG21 VAL 56 3HG2 VAL 56 -0.868 -1.345 1.586
411 HG22 VAL 56 1HG2 VAL 56 0.181 -1.435 0.174
412 HG23 VAL 56 2HG2 VAL 56 0.237 -2.706 1.396
413 H ALA 57 H ALA 57 -2.095 -5.859 0.374
414 HA ALA 57 HA ALA 57 -1.269 -6.964 2.920
415 HB1 ALA 57 3HB ALA 57 -1.410 -8.010 0.099
416 HB2 ALA 57 1HB ALA 57 -2.368 -8.486 1.499
417 HB3 ALA 57 2HB ALA 57 -0.679 -8.972 1.383
418 H LYS 58 H LYS 58 0.790 -7.653 3.545
419 HA LYS 58 HA LYS 58 3.030 -6.081 2.671
420 HB2 LYS 58 1HB LYS 58 4.334 -7.574 4.167
421 HB3 LYS 58 2HB LYS 58 2.865 -6.986 4.948
422 HG2 LYS 58 1HG LYS 58 1.716 -9.101 4.363
423 HG3 LYS 58 2HG LYS 58 3.199 -9.694 3.614
424 HD2 LYS 58 1HD LYS 58 4.376 -9.503 5.773
425 HD3 LYS 58 2HD LYS 58 2.899 -8.904 6.528
426 HE2 LYS 58 1HE LYS 58 1.754 -11.014 6.000
427 HE3 LYS 58 2HE LYS 58 3.210 -11.619 5.209
428 HZ1 LYS 58 3HZ LYS 58 3.888 -10.699 7.771
429 HZ2 LYS 58 1HZ LYS 58 3.968 -12.282 7.165
430 HZ3 LYS 58 2HZ LYS 58 2.547 -11.732 7.918
431 H GLU 59 H GLU 59 1.571 -8.839 1.338
432 HA GLU 59 HA GLU 59 3.881 -10.198 0.291
433 HB2 GLU 59 1HB GLU 59 1.597 -11.197 0.415
434 HB3 GLU 59 2HB GLU 59 1.080 -10.086 -0.854
435 HG2 GLU 59 1HG GLU 59 2.728 -11.028 -2.399
436 HG3 GLU 59 2HG GLU 59 3.325 -12.105 -1.136
437 H TYR 60 H TYR 60 1.923 -7.500 -0.878
438 HA TYR 60 HA TYR 60 3.403 -7.422 -3.441
439 HB2 TYR 60 1HB TYR 60 1.281 -5.560 -2.329
440 HB3 TYR 60 2HB TYR 60 1.883 -5.577 -3.986
441 HD1 TYR 60 HD1 TYR 60 1.734 -7.869 -5.246
442 HD2 TYR 60 HD2 TYR 60 -0.588 -6.873 -1.774
443 HE1 TYR 60 HE1 TYR 60 0.100 -9.639 -5.833
444 HE2 TYR 60 HE2 TYR 60 -2.222 -8.645 -2.358
445 HH TYR 60 HH TYR 60 -2.931 -9.987 -4.108
446 H ILE 61 H ILE 61 4.125 -6.504 -0.378
447 HA ILE 61 HA ILE 61 5.378 -3.901 -1.161
448 HB ILE 61 HB ILE 61 5.076 -5.125 1.592
449 HG12 ILE 61 1HG1 ILE 61 2.868 -4.668 0.688
450 HG13 ILE 61 2HG1 ILE 61 3.260 -3.412 1.854
451 HG21 ILE 61 1HG2 ILE 61 5.479 -2.704 2.252
452 HG22 ILE 61 2HG2 ILE 61 5.934 -2.411 0.573
453 HG23 ILE 61 3HG2 ILE 61 6.871 -3.534 1.556
454 HD11 ILE 61 3HD1 ILE 61 4.153 -2.106 -0.245
455 HD12 ILE 61 1HD1 ILE 61 2.419 -2.170 0.055
456 HD13 ILE 61 2HD1 ILE 61 3.143 -3.234 -1.146
457 H LYS 62 H LYS 62 7.516 -3.778 -1.461
458 HA LYS 62 HA LYS 62 9.307 -5.765 -0.181
459 HB2 LYS 62 1HB LYS 62 8.726 -6.753 -2.368
460 HB3 LYS 62 2HB LYS 62 9.235 -5.269 -3.175
461 HG2 LYS 62 1HG LYS 62 11.521 -5.564 -2.384
462 HG3 LYS 62 2HG LYS 62 11.048 -6.981 -1.444
463 HD2 LYS 62 1HD LYS 62 10.402 -8.133 -3.538
464 HD3 LYS 62 2HD LYS 62 10.903 -6.715 -4.462
465 HE2 LYS 62 1HE LYS 62 13.199 -6.956 -3.608
466 HE3 LYS 62 2HE LYS 62 12.707 -8.359 -2.660
467 HZ1 LYS 62 3HZ LYS 62 13.749 -8.932 -4.807
468 HZ2 LYS 62 1HZ LYS 62 12.465 -8.169 -5.611
469 HZ3 LYS 62 2HZ LYS 62 12.170 -9.538 -4.649
470 H ASP 63 H ASP 63 11.515 -5.080 -0.150
471 HA ASP 63 HA ASP 63 13.224 -3.514 0.069
472 HB2 ASP 63 1HB ASP 63 12.789 -3.308 -2.428
473 HB3 ASP 63 2HB ASP 63 11.781 -1.909 -2.060
474 H ILE 64 H ILE 64 11.439 -3.346 2.034
475 HA ILE 64 HA ILE 64 10.251 -0.696 2.265
476 HB ILE 64 HB ILE 64 10.708 -2.878 4.321
477 HG12 ILE 64 1HG1 ILE 64 8.167 -2.027 2.906
478 HG13 ILE 64 2HG1 ILE 64 9.184 -3.356 2.351
479 HG21 ILE 64 1HG2 ILE 64 10.464 -0.841 5.536
480 HG22 ILE 64 2HG2 ILE 64 8.858 -1.566 5.524
481 HG23 ILE 64 3HG2 ILE 64 9.231 -0.239 4.425
482 HD11 ILE 64 3HD1 ILE 64 7.779 -3.146 5.028
483 HD12 ILE 64 1HD1 ILE 64 8.928 -4.417 4.611
484 HD13 ILE 64 2HD1 ILE 64 7.410 -4.275 3.726
485 H LYS 65 H LYS 65 11.344 1.102 2.845
486 HA LYS 65 HA LYS 65 13.664 0.844 4.697
487 HB2 LYS 65 1HB LYS 65 14.433 0.926 2.258
488 HB3 LYS 65 2HB LYS 65 13.785 2.562 2.209
489 HG2 LYS 65 1HG LYS 65 16.000 2.984 2.809
490 HG3 LYS 65 2HG LYS 65 15.236 2.903 4.393
491 HD2 LYS 65 1HD LYS 65 15.941 0.564 4.644
492 HD3 LYS 65 2HD LYS 65 16.630 0.579 3.022
493 HE2 LYS 65 1HE LYS 65 17.503 2.459 5.225
494 HE3 LYS 65 2HE LYS 65 18.313 0.934 4.865
495 HZ1 LYS 65 3HZ LYS 65 18.103 3.357 3.203
496 HZ2 LYS 65 1HZ LYS 65 18.374 1.848 2.481
497 HZ3 LYS 65 2HZ LYS 65 19.485 2.457 3.614
498 H ASP 66 H ASP 66 13.895 2.576 6.077
499 HA ASP 66 HA ASP 66 11.607 4.405 6.227
500 HB2 ASP 66 1HB ASP 66 14.050 4.288 8.007
501 HB3 ASP 66 2HB ASP 66 12.491 5.023 8.383
502 H GLU 67 H GLU 67 11.623 6.313 5.162
503 HA GLU 67 HA GLU 67 14.213 7.542 4.373
504 HB2 GLU 67 1HB GLU 67 11.331 8.123 3.632
505 HB3 GLU 67 2HB GLU 67 12.699 9.073 3.049
506 HG2 GLU 67 1HG GLU 67 13.669 7.075 2.006
507 HG3 GLU 67 2HG GLU 67 12.358 6.085 2.644
508 H VAL 68 H VAL 68 11.804 7.763 6.753
509 HA VAL 68 HA VAL 68 11.354 9.321 8.429
510 HB VAL 68 HB VAL 68 14.251 10.069 7.939
511 HG11 VAL 68 1HG1 VAL 68 12.292 10.569 10.183
512 HG12 VAL 68 2HG1 VAL 68 13.393 11.707 9.403
513 HG13 VAL 68 3HG1 VAL 68 14.023 10.493 10.510
514 HG21 VAL 68 3HG2 VAL 68 14.671 8.398 9.758
515 HG22 VAL 68 1HG2 VAL 68 14.020 7.666 8.292
516 HG23 VAL 68 2HG2 VAL 68 12.970 7.941 9.683
517 H LEU 69 H LEU 69 11.402 11.726 8.987
518 HA LEU 69 HA LEU 69 10.352 13.195 6.755
519 HB2 LEU 69 1HB LEU 69 9.843 13.441 9.287
520 HB3 LEU 69 2HB LEU 69 11.279 14.459 9.338
521 HG LEU 69 HG LEU 69 8.922 14.888 7.479
522 HD11 LEU 69 1HD1 LEU 69 8.418 15.239 9.920
523 HD12 LEU 69 2HD1 LEU 69 8.260 16.697 8.943
524 HD13 LEU 69 3HD1 LEU 69 9.686 16.463 9.954
525 HD21 LEU 69 3HD2 LEU 69 11.533 16.325 7.945
526 HD22 LEU 69 1HD2 LEU 69 10.119 17.240 7.426
527 HD23 LEU 69 2HD2 LEU 69 10.729 15.934 6.424
528 H GLU 70 H GLU 70 11.737 13.720 5.128
529 HA GLU 70 HA GLU 70 13.700 14.448 4.053
530 HB2 GLU 70 1HB GLU 70 13.051 16.602 6.070
531 HB3 GLU 70 2HB GLU 70 14.309 16.800 4.850
532 HG2 GLU 70 1HG GLU 70 12.707 16.442 3.061
533 HG3 GLU 70 2HG GLU 70 11.435 16.069 4.219
534 H HIS 71 H HIS 71 15.128 12.769 4.752
535 HA HIS 71 HA HIS 71 16.764 13.257 7.165
536 HB2 HIS 71 1HB HIS 71 17.740 11.063 6.669
537 HB3 HIS 71 2HB HIS 71 15.981 10.967 6.652
538 HD1 HIS 71 HD1 HIS 71 16.060 12.511 3.693
539 HD2 HIS 71 HD2 HIS 71 17.736 8.850 4.777
540 HE1 HIS 71 HE1 HIS 71 16.343 11.188 1.550
541 H HIS 72 H HIS 72 19.173 13.091 6.945
542 HA HIS 72 HA HIS 72 20.249 13.892 4.303
543 HB2 HIS 72 1HB HIS 72 21.539 15.767 5.529
544 HB3 HIS 72 2HB HIS 72 19.842 16.065 5.155
545 HD1 HIS 72 HD1 HIS 72 22.141 16.312 7.877
546 HD2 HIS 72 HD2 HIS 72 18.135 15.200 7.562
547 HE1 HIS 72 HE1 HIS 72 21.146 16.550 10.194
548 H HIS 73 H HIS 73 22.240 12.982 3.991
549 HA HIS 73 HA HIS 73 23.576 11.710 6.363
550 HB2 HIS 73 1HB HIS 73 23.629 10.945 3.429
551 HB3 HIS 73 2HB HIS 73 24.550 10.140 4.702
552 HD1 HIS 73 HD1 HIS 73 22.853 9.412 6.849
553 HD2 HIS 73 HD2 HIS 73 21.204 9.696 3.031
554 HE1 HIS 73 HE1 HIS 73 20.695 8.086 6.901
555 H HIS 74 H HIS 74 25.192 13.029 6.993
556 HA HIS 74 HA HIS 74 27.074 14.417 6.901
557 HB2 HIS 74 1HB HIS 74 28.002 12.302 5.928
558 HB3 HIS 74 2HB HIS 74 27.611 12.921 4.321
559 HD1 HIS 74 HD1 HIS 74 28.978 14.974 3.457
560 HD2 HIS 74 HD2 HIS 74 30.233 13.541 7.165
561 HE1 HIS 74 HE1 HIS 74 31.217 16.062 3.926
562 H HIS 75 H HIS 75 24.539 14.832 4.940
563 HA HIS 75 HA HIS 75 25.746 16.815 3.114
564 HB2 HIS 75 1HB HIS 75 23.978 15.390 2.230
565 HB3 HIS 75 2HB HIS 75 22.878 15.914 3.506
566 HD1 HIS 75 HD1 HIS 75 25.025 17.585 0.823
567 HD2 HIS 75 HD2 HIS 75 21.324 18.038 2.683
568 HE1 HIS 75 HE1 HIS 75 23.909 19.572 -0.280
569 H HIS 76 H HIS 76 25.644 18.997 3.428
570 HA HIS 76 HA HIS 76 25.189 20.103 5.995
571 HB2 HIS 76 1HB HIS 76 26.549 21.193 4.260
572 HB3 HIS 76 2HB HIS 76 25.105 21.459 3.286
573 HD1 HIS 76 HD1 HIS 76 26.390 22.320 6.770
574 HD2 HIS 76 HD2 HIS 76 23.861 23.864 3.839
575 HE1 HIS 76 HE1 HIS 76 25.625 24.584 7.606
Start of MODEL 14
1 H1 ALA 1 1H ALA 1 9.355 8.920 11.531
2 H2 ALA 1 2H ALA 1 10.505 7.773 12.031
3 H3 ALA 1 3H ALA 1 9.705 8.737 13.180
4 HA ALA 1 HA ALA 1 8.948 6.292 12.768
5 HB1 ALA 1 3HB ALA 1 7.870 7.880 14.317
6 HB2 ALA 1 1HB ALA 1 6.652 6.987 13.403
7 HB3 ALA 1 2HB ALA 1 7.044 8.650 12.962
8 H GLU 2 H GLU 2 9.083 8.372 10.194
9 HA GLU 2 HA GLU 2 6.774 7.453 8.692
10 HB2 GLU 2 1HB GLU 2 9.288 8.941 7.906
11 HB3 GLU 2 2HB GLU 2 8.000 8.553 6.764
12 HG2 GLU 2 1HG GLU 2 6.379 9.773 8.140
13 HG3 GLU 2 2HG GLU 2 7.630 10.122 9.333
14 H LYS 3 H LYS 3 6.642 5.773 7.267
15 HA LYS 3 HA LYS 3 9.116 4.186 6.681
16 HB2 LYS 3 1HB LYS 3 6.367 3.131 7.405
17 HB3 LYS 3 2HB LYS 3 7.749 2.141 6.937
18 HG2 LYS 3 1HG LYS 3 7.743 4.019 9.315
19 HG3 LYS 3 2HG LYS 3 7.392 2.296 9.428
20 HD2 LYS 3 1HD LYS 3 9.674 1.950 8.255
21 HD3 LYS 3 2HD LYS 3 9.991 3.634 8.670
22 HE2 LYS 3 1HE LYS 3 9.597 3.158 11.036
23 HE3 LYS 3 2HE LYS 3 9.241 1.474 10.648
24 HZ1 LYS 3 3HZ LYS 3 11.651 2.297 11.333
25 HZ2 LYS 3 1HZ LYS 3 11.759 2.554 9.660
26 HZ3 LYS 3 2HZ LYS 3 11.401 1.005 10.258
27 H THR 4 H THR 4 9.186 3.288 4.602
28 HA THR 4 HA THR 4 6.884 3.936 2.788
29 HB THR 4 HB THR 4 8.456 4.669 1.081
30 HG1 THR 4 HG1 THR 4 10.327 3.864 3.025
31 HG21 THR 4 3HG2 THR 4 8.897 5.963 3.783
32 HG22 THR 4 1HG2 THR 4 7.673 6.394 2.589
33 HG23 THR 4 2HG2 THR 4 9.378 6.689 2.249
34 H GLY 5 H GLY 5 6.311 2.283 1.487
35 HA2 GLY 5 1HA GLY 5 8.159 -0.082 1.276
36 HA3 GLY 5 2HA GLY 5 6.410 -0.237 1.454
37 H ILE 6 H ILE 6 8.619 -0.700 -0.806
38 HA ILE 6 HA ILE 6 7.404 0.845 -3.001
39 HB ILE 6 HB ILE 6 9.632 -1.195 -2.892
40 HG12 ILE 6 1HG1 ILE 6 10.988 0.816 -3.508
41 HG13 ILE 6 2HG1 ILE 6 9.533 1.800 -3.381
42 HG21 ILE 6 1HG2 ILE 6 8.378 0.252 -5.234
43 HG22 ILE 6 2HG2 ILE 6 8.678 -1.476 -5.061
44 HG23 ILE 6 3HG2 ILE 6 10.029 -0.366 -5.290
45 HD11 ILE 6 3HD1 ILE 6 9.449 1.625 -1.067
46 HD12 ILE 6 1HD1 ILE 6 11.190 1.572 -1.326
47 HD13 ILE 6 2HD1 ILE 6 10.298 0.079 -1.041
48 H VAL 7 H VAL 7 5.756 0.115 -4.246
49 HA VAL 7 HA VAL 7 4.568 -2.485 -3.716
50 HB VAL 7 HB VAL 7 3.973 -0.355 -5.790
51 HG11 VAL 7 1HG1 VAL 7 2.601 -2.965 -5.123
52 HG12 VAL 7 2HG1 VAL 7 3.127 -2.385 -6.701
53 HG13 VAL 7 3HG1 VAL 7 1.747 -1.632 -5.901
54 HG21 VAL 7 3HG2 VAL 7 2.228 0.324 -4.315
55 HG22 VAL 7 1HG2 VAL 7 3.639 0.096 -3.281
56 HG23 VAL 7 2HG2 VAL 7 2.380 -1.138 -3.340
57 H ASN 8 H ASN 8 4.914 -4.358 -4.804
58 HA ASN 8 HA ASN 8 6.418 -4.262 -7.404
59 HB2 ASN 8 1HB ASN 8 7.704 -5.118 -5.358
60 HB3 ASN 8 2HB ASN 8 6.598 -6.492 -5.366
61 HD21 ASN 8 2HD2 ASN 8 8.598 -4.676 -7.777
62 HD22 ASN 8 1HD2 ASN 8 9.133 -6.068 -8.588
63 H VAL 9 H VAL 9 4.880 -4.741 -8.900
64 HA VAL 9 HA VAL 9 3.488 -7.330 -8.693
65 HB VAL 9 HB VAL 9 1.272 -6.289 -9.227
66 HG11 VAL 9 1HG1 VAL 9 2.077 -6.887 -6.866
67 HG12 VAL 9 2HG1 VAL 9 0.731 -5.754 -6.973
68 HG13 VAL 9 3HG1 VAL 9 2.359 -5.162 -6.639
69 HG21 VAL 9 3HG2 VAL 9 2.812 -3.752 -8.611
70 HG22 VAL 9 1HG2 VAL 9 1.052 -3.837 -8.692
71 HG23 VAL 9 2HG2 VAL 9 2.017 -4.165 -10.131
72 H SER 10 H SER 10 4.704 -4.622 -10.434
73 HA SER 10 HA SER 10 5.271 -4.374 -12.690
74 HB2 SER 10 1HB SER 10 5.773 -6.927 -12.345
75 HB3 SER 10 2HB SER 10 4.291 -7.168 -13.266
76 HG SER 10 HG SER 10 5.434 -5.445 -14.677
77 H SER 11 H SER 11 2.293 -6.340 -12.375
78 HA SER 11 HA SER 11 1.057 -5.046 -14.668
79 HB2 SER 11 1HB SER 11 -0.046 -6.859 -12.506
80 HB3 SER 11 2HB SER 11 -0.958 -6.332 -13.917
81 HG SER 11 HG SER 11 1.321 -7.217 -14.834
82 H SER 12 H SER 12 -0.416 -5.337 -11.451
83 HA SER 12 HA SER 12 -0.464 -2.488 -10.951
84 HB2 SER 12 1HB SER 12 -2.119 -2.464 -12.730
85 HB3 SER 12 2HB SER 12 -2.981 -3.816 -11.999
86 HG SER 12 HG SER 12 -4.050 -2.251 -11.063
87 H LEU 13 H LEU 13 -1.558 -2.018 -8.906
88 HA LEU 13 HA LEU 13 -2.218 -4.472 -7.301
89 HB2 LEU 13 1HB LEU 13 -0.042 -3.573 -6.607
90 HB3 LEU 13 2HB LEU 13 -0.746 -1.972 -6.404
91 HG LEU 13 HG LEU 13 -2.202 -2.802 -4.615
92 HD11 LEU 13 1HD1 LEU 13 -1.061 -5.460 -5.456
93 HD12 LEU 13 2HD1 LEU 13 -2.734 -5.028 -5.099
94 HD13 LEU 13 3HD1 LEU 13 -1.578 -5.224 -3.785
95 HD21 LEU 13 3HD2 LEU 13 -0.502 -3.196 -2.939
96 HD22 LEU 13 1HD2 LEU 13 0.150 -2.062 -4.121
97 HD23 LEU 13 2HD2 LEU 13 0.635 -3.758 -4.161
98 H ASN 14 H ASN 14 -4.177 -4.412 -6.342
99 HA ASN 14 HA ASN 14 -5.852 -2.021 -6.677
100 HB2 ASN 14 1HB ASN 14 -7.632 -3.468 -5.712
101 HB3 ASN 14 2HB ASN 14 -6.835 -4.216 -7.095
102 HD21 ASN 14 2HD2 ASN 14 -6.947 -6.426 -6.537
103 HD22 ASN 14 1HD2 ASN 14 -6.306 -7.076 -5.107
104 H VAL 15 H VAL 15 -6.926 -0.964 -4.891
105 HA VAL 15 HA VAL 15 -5.326 -1.036 -2.358
106 HB VAL 15 HB VAL 15 -7.058 1.098 -3.638
107 HG11 VAL 15 1HG1 VAL 15 -7.504 1.322 -1.312
108 HG12 VAL 15 2HG1 VAL 15 -6.213 2.478 -1.637
109 HG13 VAL 15 3HG1 VAL 15 -5.841 0.931 -0.875
110 HG21 VAL 15 3HG2 VAL 15 -4.696 0.718 -4.453
111 HG22 VAL 15 1HG2 VAL 15 -4.138 1.117 -2.829
112 HG23 VAL 15 2HG2 VAL 15 -4.985 2.327 -3.792
113 H ARG 16 H ARG 16 -6.304 -1.750 -0.535
114 HA ARG 16 HA ARG 16 -9.242 -2.315 -0.619
115 HB2 ARG 16 1HB ARG 16 -6.941 -3.463 0.972
116 HB3 ARG 16 2HB ARG 16 -8.622 -3.752 1.423
117 HG2 ARG 16 1HG ARG 16 -9.093 -4.833 -0.659
118 HG3 ARG 16 2HG ARG 16 -7.562 -4.304 -1.356
119 HD2 ARG 16 1HD ARG 16 -7.698 -6.742 -0.529
120 HD3 ARG 16 2HD ARG 16 -6.303 -5.792 -0.010
121 HE ARG 16 HE ARG 16 -8.287 -5.452 1.966
122 HH11 ARG 16 1HH2 ARG 16 -6.431 -7.981 0.517
123 HH12 ARG 16 2HH2 ARG 16 -6.369 -8.936 1.960
124 HH21 ARG 16 1HH1 ARG 16 -8.190 -6.680 3.854
125 HH22 ARG 16 2HH1 ARG 16 -7.367 -8.204 3.845
126 H GLU 17 H GLU 17 -10.561 -1.109 0.625
127 HA GLU 17 HA GLU 17 -9.531 1.046 2.258
128 HB2 GLU 17 1HB GLU 17 -11.697 1.158 1.042
129 HB3 GLU 17 2HB GLU 17 -12.335 -0.103 2.095
130 HG2 GLU 17 1HG GLU 17 -12.008 1.330 4.055
131 HG3 GLU 17 2HG GLU 17 -11.297 2.586 3.039
132 H GLY 18 H GLY 18 -11.086 -2.080 2.950
133 HA2 GLY 18 1HA GLY 18 -10.574 -1.696 5.862
134 HA3 GLY 18 2HA GLY 18 -11.637 -2.910 5.153
135 H ALA 19 H ALA 19 -10.176 -4.106 6.843
136 HA ALA 19 HA ALA 19 -7.588 -4.969 5.651
137 HB1 ALA 19 3HB ALA 19 -8.892 -5.512 8.338
138 HB2 ALA 19 1HB ALA 19 -7.542 -4.422 8.027
139 HB3 ALA 19 2HB ALA 19 -7.330 -6.163 7.840
140 H SER 20 H SER 20 -10.001 -5.731 4.295
141 HA SER 20 HA SER 20 -9.920 -8.703 4.696
142 HB2 SER 20 1HB SER 20 -12.042 -7.755 5.606
143 HB3 SER 20 2HB SER 20 -12.384 -7.063 4.021
144 HG SER 20 HG SER 20 -13.085 -8.948 3.443
145 H THR 21 H THR 21 -10.132 -9.917 2.777
146 HA THR 21 HA THR 21 -9.024 -8.744 0.412
147 HB THR 21 HB THR 21 -9.603 -10.940 -0.628
148 HG1 THR 21 HG1 THR 21 -10.462 -12.055 1.686
149 HG21 THR 21 3HG2 THR 21 -8.218 -12.303 0.869
150 HG22 THR 21 1HG2 THR 21 -8.477 -11.154 2.181
151 HG23 THR 21 2HG2 THR 21 -7.556 -10.672 0.756
152 H SER 22 H SER 22 -12.323 -9.326 1.484
153 HA SER 22 HA SER 22 -13.461 -8.630 -1.145
154 HB2 SER 22 1HB SER 22 -15.610 -9.033 -0.075
155 HB3 SER 22 2HB SER 22 -14.510 -10.336 0.368
156 HG SER 22 HG SER 22 -14.056 -9.048 2.287
157 H SER 23 H SER 23 -11.881 -6.802 0.890
158 HA SER 23 HA SER 23 -13.655 -4.751 1.754
159 HB2 SER 23 1HB SER 23 -10.705 -4.787 1.122
160 HB3 SER 23 2HB SER 23 -11.515 -3.319 1.662
161 HG SER 23 HG SER 23 -12.369 -4.998 3.335
162 H LYS 24 H LYS 24 -14.119 -2.705 0.835
163 HA LYS 24 HA LYS 24 -14.702 -2.710 -1.962
164 HB2 LYS 24 1HB LYS 24 -15.946 -1.387 -0.272
165 HB3 LYS 24 2HB LYS 24 -14.536 -0.348 -0.073
166 HG2 LYS 24 1HG LYS 24 -14.649 0.347 -2.399
167 HG3 LYS 24 2HG LYS 24 -15.964 -0.784 -2.714
168 HD2 LYS 24 1HD LYS 24 -16.314 1.257 -0.523
169 HD3 LYS 24 2HD LYS 24 -16.472 1.781 -2.198
170 HE2 LYS 24 1HE LYS 24 -17.988 -0.580 -1.056
171 HE3 LYS 24 2HE LYS 24 -18.641 1.056 -1.120
172 HZ1 LYS 24 3HZ LYS 24 -18.673 -0.833 -3.132
173 HZ2 LYS 24 1HZ LYS 24 -17.536 0.327 -3.623
174 HZ3 LYS 24 2HZ LYS 24 -19.125 0.800 -3.251
175 H VAL 25 H VAL 25 -13.609 -1.916 -3.693
176 HA VAL 25 HA VAL 25 -10.796 -1.080 -3.289
177 HB VAL 25 HB VAL 25 -12.405 -1.696 -5.789
178 HG11 VAL 25 1HG1 VAL 25 -10.077 -1.801 -6.814
179 HG12 VAL 25 2HG1 VAL 25 -9.491 -0.999 -5.358
180 HG13 VAL 25 3HG1 VAL 25 -10.649 -0.184 -6.407
181 HG21 VAL 25 3HG2 VAL 25 -10.330 -3.250 -4.213
182 HG22 VAL 25 1HG2 VAL 25 -10.939 -3.733 -5.796
183 HG23 VAL 25 2HG2 VAL 25 -12.033 -3.668 -4.415
184 H ILE 26 H ILE 26 -10.415 1.054 -3.053
185 HA ILE 26 HA ILE 26 -12.295 3.027 -4.283
186 HB ILE 26 HB ILE 26 -11.247 4.634 -2.701
187 HG12 ILE 26 1HG1 ILE 26 -9.793 2.191 -1.636
188 HG13 ILE 26 2HG1 ILE 26 -9.026 3.460 -2.589
189 HG21 ILE 26 1HG2 ILE 26 -12.322 3.772 -0.729
190 HG22 ILE 26 2HG2 ILE 26 -12.120 2.108 -1.277
191 HG23 ILE 26 3HG2 ILE 26 -13.244 3.180 -2.111
192 HD11 ILE 26 3HD1 ILE 26 -9.838 5.118 -0.856
193 HD12 ILE 26 1HD1 ILE 26 -8.618 3.981 -0.281
194 HD13 ILE 26 2HD1 ILE 26 -10.314 3.738 0.134
195 H GLY 27 H GLY 27 -9.338 1.558 -4.916
196 HA2 GLY 27 1HA GLY 27 -8.763 3.294 -7.106
197 HA3 GLY 27 2HA GLY 27 -7.718 3.732 -5.757
198 H SER 28 H SER 28 -6.189 2.975 -7.638
199 HA SER 28 HA SER 28 -5.185 0.330 -6.873
200 HB2 SER 28 1HB SER 28 -5.237 -0.607 -9.133
201 HB3 SER 28 2HB SER 28 -6.877 -0.206 -8.629
202 HG SER 28 HG SER 28 -5.892 0.537 -10.808
203 H LEU 29 H LEU 29 -3.052 -0.086 -8.043
204 HA LEU 29 HA LEU 29 -1.729 2.505 -8.819
205 HB2 LEU 29 1HB LEU 29 -0.524 0.184 -7.284
206 HB3 LEU 29 2HB LEU 29 0.294 1.684 -7.713
207 HG LEU 29 HG LEU 29 -2.164 1.484 -5.948
208 HD11 LEU 29 1HD1 LEU 29 0.741 2.032 -5.263
209 HD12 LEU 29 2HD1 LEU 29 -0.157 0.566 -4.863
210 HD13 LEU 29 3HD1 LEU 29 -0.608 2.105 -4.129
211 HD21 LEU 29 3HD2 LEU 29 -1.325 3.923 -5.434
212 HD22 LEU 29 1HD2 LEU 29 -2.267 3.633 -6.894
213 HD23 LEU 29 2HD2 LEU 29 -0.512 3.786 -6.993
214 H SER 30 H SER 30 -0.033 2.329 -10.361
215 HA SER 30 HA SER 30 -0.483 0.236 -12.352
216 HB2 SER 30 1HB SER 30 1.458 2.562 -12.232
217 HB3 SER 30 2HB SER 30 1.265 1.500 -13.625
218 HG SER 30 HG SER 30 -0.928 2.825 -12.428
219 H GLY 31 H GLY 31 1.317 0.384 -9.555
220 HA2 GLY 31 1HA GLY 31 2.689 -1.432 -8.795
221 HA3 GLY 31 2HA GLY 31 3.027 -1.865 -10.468
222 H ASN 32 H ASN 32 5.072 -1.709 -8.620
223 HA ASN 32 HA ASN 32 7.176 -0.770 -8.255
224 HB2 ASN 32 1HB ASN 32 7.076 -0.986 -10.828
225 HB3 ASN 32 2HB ASN 32 6.775 0.751 -10.837
226 HD21 ASN 32 2HD2 ASN 32 9.161 -1.714 -9.808
227 HD22 ASN 32 1HD2 ASN 32 10.478 -0.645 -9.746
228 H THR 33 H THR 33 4.419 1.000 -8.099
229 HA THR 33 HA THR 33 5.654 3.659 -7.826
230 HB THR 33 HB THR 33 2.840 2.759 -7.136
231 HG1 THR 33 HG1 THR 33 3.444 4.237 -9.406
232 HG21 THR 33 3HG2 THR 33 4.046 5.490 -7.659
233 HG22 THR 33 1HG2 THR 33 3.526 4.880 -6.088
234 HG23 THR 33 2HG2 THR 33 2.338 5.167 -7.359
235 H LYS 34 H LYS 34 6.336 4.537 -5.923
236 HA LYS 34 HA LYS 34 6.416 2.835 -3.552
237 HB2 LYS 34 1HB LYS 34 8.314 4.308 -4.239
238 HB3 LYS 34 2HB LYS 34 7.307 5.711 -3.879
239 HG2 LYS 34 1HG LYS 34 7.120 5.035 -1.546
240 HG3 LYS 34 2HG LYS 34 7.993 3.540 -1.881
241 HD2 LYS 34 1HD LYS 34 9.575 5.092 -0.925
242 HD3 LYS 34 2HD LYS 34 9.952 4.931 -2.638
243 HE2 LYS 34 1HE LYS 34 8.086 7.126 -1.763
244 HE3 LYS 34 2HE LYS 34 9.824 7.327 -1.543
245 HZ1 LYS 34 3HZ LYS 34 10.145 7.578 -3.716
246 HZ2 LYS 34 1HZ LYS 34 8.471 7.835 -3.826
247 HZ3 LYS 34 2HZ LYS 34 9.114 6.291 -4.126
248 H VAL 35 H VAL 35 5.171 3.031 -1.730
249 HA VAL 35 HA VAL 35 3.141 5.247 -1.662
250 HB VAL 35 HB VAL 35 1.715 3.555 -0.422
251 HG11 VAL 35 1HG1 VAL 35 1.105 2.343 -2.553
252 HG12 VAL 35 2HG1 VAL 35 2.526 3.075 -3.298
253 HG13 VAL 35 3HG1 VAL 35 1.210 4.096 -2.717
254 HG21 VAL 35 3HG2 VAL 35 3.479 1.961 0.181
255 HG22 VAL 35 1HG2 VAL 35 3.830 1.672 -1.523
256 HG23 VAL 35 2HG2 VAL 35 2.286 1.163 -0.843
257 H THR 36 H THR 36 3.171 6.458 0.140
258 HA THR 36 HA THR 36 5.182 6.007 2.171
259 HB THR 36 HB THR 36 2.862 7.958 2.171
260 HG1 THR 36 HG1 THR 36 4.469 9.373 1.326
261 HG21 THR 36 3HG2 THR 36 5.495 7.892 3.670
262 HG22 THR 36 1HG2 THR 36 3.887 7.707 4.368
263 HG23 THR 36 2HG2 THR 36 4.373 9.253 3.672
264 H ILE 37 H ILE 37 4.962 5.021 4.117
265 HA ILE 37 HA ILE 37 2.245 4.015 4.894
266 HB ILE 37 HB ILE 37 5.030 2.988 5.495
267 HG12 ILE 37 1HG1 ILE 37 2.716 1.655 4.070
268 HG13 ILE 37 2HG1 ILE 37 3.974 2.558 3.227
269 HG21 ILE 37 1HG2 ILE 37 3.838 2.540 7.483
270 HG22 ILE 37 2HG2 ILE 37 3.643 1.062 6.541
271 HG23 ILE 37 3HG2 ILE 37 2.330 2.239 6.618
272 HD11 ILE 37 3HD1 ILE 37 5.677 1.049 3.947
273 HD12 ILE 37 1HD1 ILE 37 4.339 0.034 3.408
274 HD13 ILE 37 2HD1 ILE 37 4.608 0.296 5.131
275 H VAL 38 H VAL 38 1.376 4.844 6.694
276 HA VAL 38 HA VAL 38 3.122 6.395 8.580
277 HB VAL 38 HB VAL 38 1.020 7.587 9.189
278 HG11 VAL 38 1HG1 VAL 38 0.718 8.710 6.907
279 HG12 VAL 38 2HG1 VAL 38 1.867 7.526 6.285
280 HG13 VAL 38 3HG1 VAL 38 2.366 8.665 7.535
281 HG21 VAL 38 3HG2 VAL 38 -0.113 5.804 7.016
282 HG22 VAL 38 1HG2 VAL 38 -0.923 7.263 7.580
283 HG23 VAL 38 2HG2 VAL 38 -0.646 5.923 8.691
284 H GLY 39 H GLY 39 1.602 3.458 8.255
285 HA2 GLY 39 1HA GLY 39 1.868 2.848 11.057
286 HA3 GLY 39 2HA GLY 39 0.168 3.055 10.638
287 H GLU 40 H GLU 40 0.710 0.600 11.490
288 HA GLU 40 HA GLU 40 0.628 -1.048 9.004
289 HB2 GLU 40 1HB GLU 40 2.105 -2.727 9.999
290 HB3 GLU 40 2HB GLU 40 2.938 -1.176 9.924
291 HG2 GLU 40 1HG GLU 40 2.266 -0.766 12.308
292 HG3 GLU 40 2HG GLU 40 1.607 -2.402 12.358
293 H GLU 41 H GLU 41 -0.555 -3.037 9.269
294 HA GLU 41 HA GLU 41 -1.869 -3.528 11.866
295 HB2 GLU 41 1HB GLU 41 -3.262 -1.820 10.534
296 HB3 GLU 41 2HB GLU 41 -3.586 -3.133 9.403
297 HG2 GLU 41 1HG GLU 41 -4.126 -3.336 12.381
298 HG3 GLU 41 2HG GLU 41 -5.341 -2.835 11.206
299 H GLY 42 H GLY 42 -1.276 -5.637 12.038
300 HA2 GLY 42 1HA GLY 42 -1.132 -7.923 11.557
301 HA3 GLY 42 2HA GLY 42 -2.515 -7.663 10.498
302 H ALA 43 H ALA 43 -1.907 -8.812 8.712
303 HA ALA 43 HA ALA 43 0.811 -8.635 7.625
304 HB1 ALA 43 3HB ALA 43 -1.712 -10.102 6.861
305 HB2 ALA 43 1HB ALA 43 -0.155 -10.768 7.346
306 HB3 ALA 43 2HB ALA 43 -0.342 -10.038 5.751
307 H PHE 44 H PHE 44 -1.642 -6.523 7.628
308 HA PHE 44 HA PHE 44 -1.208 -5.621 4.795
309 HB2 PHE 44 1HB PHE 44 -3.525 -5.153 6.696
310 HB3 PHE 44 2HB PHE 44 -3.355 -4.368 5.126
311 HD1 PHE 44 HD2 PHE 44 -3.341 -5.735 3.037
312 HD2 PHE 44 HD1 PHE 44 -4.213 -7.447 6.877
313 HE1 PHE 44 HE2 PHE 44 -4.323 -7.720 1.926
314 HE2 PHE 44 HE1 PHE 44 -5.197 -9.434 5.767
315 HZ PHE 44 HZ PHE 44 -5.254 -9.571 3.290
316 H TYR 45 H TYR 45 -0.518 -3.531 4.462
317 HA TYR 45 HA TYR 45 0.289 -1.983 6.897
318 HB2 TYR 45 1HB TYR 45 1.402 -2.138 4.092
319 HB3 TYR 45 2HB TYR 45 1.799 -0.796 5.166
320 HD1 TYR 45 HD2 TYR 45 2.460 -1.544 7.641
321 HD2 TYR 45 HD1 TYR 45 2.828 -4.003 4.140
322 HE1 TYR 45 HE2 TYR 45 4.158 -2.928 8.795
323 HE2 TYR 45 HE1 TYR 45 4.532 -5.383 5.293
324 HH TYR 45 HH TYR 45 5.266 -4.919 8.710
325 H LYS 46 H LYS 46 -0.115 0.264 6.947
326 HA LYS 46 HA LYS 46 -2.485 1.087 5.369
327 HB2 LYS 46 1HB LYS 46 -1.037 2.188 7.786
328 HB3 LYS 46 2HB LYS 46 -2.268 3.130 6.941
329 HG2 LYS 46 1HG LYS 46 -3.925 1.407 7.321
330 HG3 LYS 46 2HG LYS 46 -2.710 0.331 8.013
331 HD2 LYS 46 1HD LYS 46 -3.990 1.405 9.805
332 HD3 LYS 46 2HD LYS 46 -2.321 1.973 9.832
333 HE2 LYS 46 1HE LYS 46 -4.354 3.522 8.247
334 HE3 LYS 46 2HE LYS 46 -4.302 3.709 10.000
335 HZ1 LYS 46 3HZ LYS 46 -2.613 5.084 9.717
336 HZ2 LYS 46 1HZ LYS 46 -2.550 4.768 8.054
337 HZ3 LYS 46 2HZ LYS 46 -1.680 3.790 9.135
338 H ILE 47 H ILE 47 -2.414 2.706 3.838
339 HA ILE 47 HA ILE 47 0.177 4.142 3.421
340 HB ILE 47 HB ILE 47 -0.107 3.813 0.981
341 HG12 ILE 47 1HG1 ILE 47 -2.266 1.833 1.777
342 HG13 ILE 47 2HG1 ILE 47 -2.589 3.413 1.065
343 HG21 ILE 47 1HG2 ILE 47 0.557 1.422 0.970
344 HG22 ILE 47 2HG2 ILE 47 -0.018 1.269 2.630
345 HG23 ILE 47 3HG2 ILE 47 1.354 2.314 2.265
346 HD11 ILE 47 3HD1 ILE 47 -0.972 1.187 -0.210
347 HD12 ILE 47 1HD1 ILE 47 -1.232 2.784 -0.913
348 HD13 ILE 47 2HD1 ILE 47 -2.596 1.691 -0.681
349 H GLU 48 H GLU 48 -0.037 6.214 2.492
350 HA GLU 48 HA GLU 48 -2.691 7.434 2.920
351 HB2 GLU 48 1HB GLU 48 -0.640 8.573 3.725
352 HB3 GLU 48 2HB GLU 48 -0.052 8.671 2.065
353 HG2 GLU 48 1HG GLU 48 -1.977 10.046 1.432
354 HG3 GLU 48 2HG GLU 48 -2.644 9.896 3.059
355 H TYR 49 H TYR 49 -3.961 6.704 1.173
356 HA TYR 49 HA TYR 49 -2.953 7.297 -1.587
357 HB2 TYR 49 1HB TYR 49 -3.740 4.989 -1.162
358 HB3 TYR 49 2HB TYR 49 -5.317 5.620 -0.684
359 HD1 TYR 49 HD1 TYR 49 -2.920 5.323 -3.506
360 HD2 TYR 49 HD2 TYR 49 -6.917 6.342 -2.309
361 HE1 TYR 49 HE1 TYR 49 -3.614 5.395 -5.886
362 HE2 TYR 49 HE2 TYR 49 -7.611 6.414 -4.688
363 HH TYR 49 HH TYR 49 -5.444 5.393 -7.265
364 H LYS 50 H LYS 50 -3.593 9.226 -2.334
365 HA LYS 50 HA LYS 50 -4.852 11.157 -2.666
366 HB2 LYS 50 1HB LYS 50 -6.292 9.202 -3.667
367 HB3 LYS 50 2HB LYS 50 -7.336 9.486 -2.276
368 HG2 LYS 50 1HG LYS 50 -7.648 11.812 -2.918
369 HG3 LYS 50 2HG LYS 50 -6.480 11.646 -4.230
370 HD2 LYS 50 1HD LYS 50 -7.942 9.931 -5.281
371 HD3 LYS 50 2HD LYS 50 -9.134 10.201 -4.008
372 HE2 LYS 50 1HE LYS 50 -8.088 12.380 -5.835
373 HE3 LYS 50 2HE LYS 50 -9.596 11.507 -6.108
374 HZ1 LYS 50 3HZ LYS 50 -9.997 12.217 -3.627
375 HZ2 LYS 50 1HZ LYS 50 -10.368 13.260 -4.911
376 HZ3 LYS 50 2HZ LYS 50 -8.922 13.465 -4.042
377 H GLY 51 H GLY 51 -4.101 10.496 0.084
378 HA2 GLY 51 1HA GLY 51 -4.441 11.771 2.071
379 HA3 GLY 51 2HA GLY 51 -6.004 12.298 1.443
380 H SER 52 H SER 52 -6.537 9.338 0.781
381 HA SER 52 HA SER 52 -7.819 8.745 3.352
382 HB2 SER 52 1HB SER 52 -8.901 6.937 2.161
383 HB3 SER 52 2HB SER 52 -8.938 8.370 1.140
384 HG SER 52 HG SER 52 -7.032 6.266 1.015
385 H HIS 53 H HIS 53 -7.638 6.483 4.255
386 HA HIS 53 HA HIS 53 -4.768 5.645 4.306
387 HB2 HIS 53 1HB HIS 53 -7.079 5.092 6.199
388 HB3 HIS 53 2HB HIS 53 -5.435 4.489 6.413
389 HD1 HIS 53 HD1 HIS 53 -6.351 6.287 8.614
390 HD2 HIS 53 HD2 HIS 53 -4.659 7.820 5.125
391 HE1 HIS 53 HE1 HIS 53 -5.493 8.600 9.186
392 H GLY 54 H GLY 54 -4.673 4.295 2.492
393 HA2 GLY 54 1HA GLY 54 -6.707 2.192 2.123
394 HA3 GLY 54 2HA GLY 54 -5.341 2.516 1.057
395 H TYR 55 H TYR 55 -6.002 -0.082 1.845
396 HA TYR 55 HA TYR 55 -3.703 -0.812 3.635
397 HB2 TYR 55 1HB TYR 55 -6.442 -2.069 3.335
398 HB3 TYR 55 2HB TYR 55 -5.092 -2.893 4.116
399 HD1 TYR 55 HD1 TYR 55 -7.312 0.077 4.278
400 HD2 TYR 55 HD2 TYR 55 -4.327 -2.263 6.294
401 HE1 TYR 55 HE1 TYR 55 -7.742 1.333 6.374
402 HE2 TYR 55 HE2 TYR 55 -4.756 -1.009 8.388
403 HH TYR 55 HH TYR 55 -7.457 1.111 8.739
404 H VAL 56 H VAL 56 -2.281 -2.328 2.800
405 HA VAL 56 HA VAL 56 -3.055 -3.745 0.281
406 HB VAL 56 HB VAL 56 -0.770 -3.240 -0.621
407 HG11 VAL 56 1HG1 VAL 56 -1.350 -0.996 -1.369
408 HG12 VAL 56 2HG1 VAL 56 -2.437 -0.783 0.004
409 HG13 VAL 56 3HG1 VAL 56 -2.828 -1.954 -1.256
410 HG21 VAL 56 3HG2 VAL 56 -0.718 -1.177 1.604
411 HG22 VAL 56 1HG2 VAL 56 0.529 -1.450 0.388
412 HG23 VAL 56 2HG2 VAL 56 0.220 -2.670 1.623
413 H ALA 57 H ALA 57 -1.866 -5.686 -0.079
414 HA ALA 57 HA ALA 57 -1.168 -7.079 2.355
415 HB1 ALA 57 3HB ALA 57 -0.962 -7.813 -0.573
416 HB2 ALA 57 1HB ALA 57 -2.197 -8.325 0.576
417 HB3 ALA 57 2HB ALA 57 -0.547 -8.922 0.733
418 H LYS 58 H LYS 58 0.858 -7.602 3.143
419 HA LYS 58 HA LYS 58 3.117 -5.990 2.351
420 HB2 LYS 58 1HB LYS 58 4.345 -7.319 4.028
421 HB3 LYS 58 2HB LYS 58 2.782 -6.805 4.664
422 HG2 LYS 58 1HG LYS 58 1.832 -9.020 4.064
423 HG3 LYS 58 2HG LYS 58 3.422 -9.535 3.502
424 HD2 LYS 58 1HD LYS 58 4.350 -9.151 5.756
425 HD3 LYS 58 2HD LYS 58 2.761 -8.639 6.323
426 HE2 LYS 58 1HE LYS 58 1.841 -10.859 5.776
427 HE3 LYS 58 2HE LYS 58 3.421 -11.375 5.189
428 HZ1 LYS 58 3HZ LYS 58 3.910 -11.950 7.256
429 HZ2 LYS 58 1HZ LYS 58 2.447 -11.320 7.839
430 HZ3 LYS 58 2HZ LYS 58 3.814 -10.319 7.720
431 H GLU 59 H GLU 59 1.804 -8.866 1.127
432 HA GLU 59 HA GLU 59 4.138 -10.295 0.333
433 HB2 GLU 59 1HB GLU 59 2.675 -11.516 -1.124
434 HB3 GLU 59 2HB GLU 59 1.724 -11.098 0.303
435 HG2 GLU 59 1HG GLU 59 0.997 -9.004 -1.016
436 HG3 GLU 59 2HG GLU 59 1.644 -9.826 -2.433
437 H TYR 60 H TYR 60 2.463 -7.549 -1.121
438 HA TYR 60 HA TYR 60 4.262 -7.660 -3.495
439 HB2 TYR 60 1HB TYR 60 1.914 -5.832 -2.900
440 HB3 TYR 60 2HB TYR 60 2.776 -5.961 -4.435
441 HD1 TYR 60 HD2 TYR 60 3.004 -8.470 -5.348
442 HD2 TYR 60 HD1 TYR 60 -0.051 -7.088 -2.662
443 HE1 TYR 60 HE2 TYR 60 1.558 -10.372 -6.012
444 HE2 TYR 60 HE1 TYR 60 -1.496 -8.991 -3.325
445 HH TYR 60 HH TYR 60 -1.317 -11.182 -4.297
446 H ILE 61 H ILE 61 4.527 -6.511 -0.460
447 HA ILE 61 HA ILE 61 5.757 -3.898 -1.263
448 HB ILE 61 HB ILE 61 5.072 -4.940 1.504
449 HG12 ILE 61 1HG1 ILE 61 3.027 -4.588 0.229
450 HG13 ILE 61 2HG1 ILE 61 3.214 -3.261 1.371
451 HG21 ILE 61 1HG2 ILE 61 6.841 -3.326 1.625
452 HG22 ILE 61 2HG2 ILE 61 5.354 -2.480 2.056
453 HG23 ILE 61 3HG2 ILE 61 6.048 -2.283 0.447
454 HD11 ILE 61 3HD1 ILE 61 4.420 -2.066 -0.651
455 HD12 ILE 61 1HD1 ILE 61 2.658 -2.122 -0.591
456 HD13 ILE 61 2HD1 ILE 61 3.541 -3.249 -1.617
457 H LYS 62 H LYS 62 7.915 -3.730 -1.304
458 HA LYS 62 HA LYS 62 9.560 -5.598 0.336
459 HB2 LYS 62 1HB LYS 62 10.943 -6.206 -1.549
460 HB3 LYS 62 2HB LYS 62 9.267 -6.551 -1.974
461 HG2 LYS 62 1HG LYS 62 9.157 -4.351 -3.159
462 HG3 LYS 62 2HG LYS 62 10.873 -4.116 -2.823
463 HD2 LYS 62 1HD LYS 62 11.408 -6.186 -4.043
464 HD3 LYS 62 2HD LYS 62 9.695 -6.431 -4.384
465 HE2 LYS 62 1HE LYS 62 10.506 -5.389 -6.341
466 HE3 LYS 62 2HE LYS 62 9.781 -4.058 -5.439
467 HZ1 LYS 62 3HZ LYS 62 12.219 -3.990 -4.442
468 HZ2 LYS 62 1HZ LYS 62 11.789 -3.142 -5.846
469 HZ3 LYS 62 2HZ LYS 62 12.588 -4.637 -5.970
470 H ASP 63 H ASP 63 11.852 -4.893 0.405
471 HA ASP 63 HA ASP 63 13.431 -3.257 0.911
472 HB2 ASP 63 1HB ASP 63 12.114 -2.054 -1.534
473 HB3 ASP 63 2HB ASP 63 13.504 -1.315 -0.742
474 H ILE 64 H ILE 64 11.404 -3.145 2.676
475 HA ILE 64 HA ILE 64 10.213 -0.473 2.769
476 HB ILE 64 HB ILE 64 10.359 -2.708 4.818
477 HG12 ILE 64 1HG1 ILE 64 8.012 -1.711 3.182
478 HG13 ILE 64 2HG1 ILE 64 9.034 -3.057 2.675
479 HG21 ILE 64 1HG2 ILE 64 8.452 -1.355 5.864
480 HG22 ILE 64 2HG2 ILE 64 8.982 -0.016 4.845
481 HG23 ILE 64 3HG2 ILE 64 10.074 -0.690 6.055
482 HD11 ILE 64 3HD1 ILE 64 7.653 -2.970 5.366
483 HD12 ILE 64 1HD1 ILE 64 8.433 -4.354 4.600
484 HD13 ILE 64 2HD1 ILE 64 6.928 -3.714 3.940
485 H LYS 65 H LYS 65 11.301 1.298 3.475
486 HA LYS 65 HA LYS 65 13.310 0.984 5.652
487 HB2 LYS 65 1HB LYS 65 14.978 2.293 4.456
488 HB3 LYS 65 2HB LYS 65 14.547 0.880 3.495
489 HG2 LYS 65 1HG LYS 65 12.932 2.314 2.212
490 HG3 LYS 65 2HG LYS 65 13.525 3.710 3.109
491 HD2 LYS 65 1HD LYS 65 14.876 3.824 1.214
492 HD3 LYS 65 2HD LYS 65 15.900 2.863 2.278
493 HE2 LYS 65 1HE LYS 65 15.767 1.856 0.028
494 HE3 LYS 65 2HE LYS 65 15.038 0.792 1.228
495 HZ1 LYS 65 3HZ LYS 65 13.852 1.944 -1.043
496 HZ2 LYS 65 1HZ LYS 65 13.059 2.534 0.335
497 HZ3 LYS 65 2HZ LYS 65 13.171 0.859 0.072
498 H ASP 66 H ASP 66 13.641 2.893 6.860
499 HA ASP 66 HA ASP 66 11.347 4.615 7.037
500 HB2 ASP 66 1HB ASP 66 12.778 3.987 8.967
501 HB3 ASP 66 2HB ASP 66 14.081 4.960 8.284
502 H GLU 67 H GLU 67 11.058 6.717 6.329
503 HA GLU 67 HA GLU 67 12.792 7.625 4.158
504 HB2 GLU 67 1HB GLU 67 10.266 7.860 4.212
505 HB3 GLU 67 2HB GLU 67 10.481 9.102 5.446
506 HG2 GLU 67 1HG GLU 67 10.337 10.246 3.349
507 HG3 GLU 67 2HG GLU 67 12.037 10.284 3.815
508 H VAL 68 H VAL 68 14.544 7.623 6.030
509 HA VAL 68 HA VAL 68 16.061 8.880 7.283
510 HB VAL 68 HB VAL 68 14.730 11.314 6.087
511 HG11 VAL 68 1HG1 VAL 68 16.887 12.314 6.350
512 HG12 VAL 68 2HG1 VAL 68 17.649 10.755 6.664
513 HG13 VAL 68 3HG1 VAL 68 16.571 11.467 7.865
514 HG21 VAL 68 3HG2 VAL 68 16.612 9.289 4.853
515 HG22 VAL 68 1HG2 VAL 68 16.472 10.937 4.241
516 HG23 VAL 68 2HG2 VAL 68 15.071 9.866 4.218
517 H LEU 69 H LEU 69 16.015 9.307 9.406
518 HA LEU 69 HA LEU 69 13.521 9.850 10.775
519 HB2 LEU 69 1HB LEU 69 16.371 9.969 11.818
520 HB3 LEU 69 2HB LEU 69 14.910 9.872 12.801
521 HG LEU 69 HG LEU 69 15.795 7.780 10.789
522 HD11 LEU 69 1HD1 LEU 69 16.382 6.419 12.710
523 HD12 LEU 69 2HD1 LEU 69 15.790 7.655 13.819
524 HD13 LEU 69 3HD1 LEU 69 17.227 7.961 12.845
525 HD21 LEU 69 3HD2 LEU 69 13.995 6.466 12.191
526 HD22 LEU 69 1HD2 LEU 69 13.459 7.557 10.916
527 HD23 LEU 69 2HD2 LEU 69 13.398 8.075 12.601
528 H GLU 70 H GLU 70 12.818 11.778 11.687
529 HA GLU 70 HA GLU 70 14.539 14.151 11.684
530 HB2 GLU 70 1HB GLU 70 13.714 14.096 9.344
531 HB3 GLU 70 2HB GLU 70 12.053 14.076 9.939
532 HG2 GLU 70 1HG GLU 70 12.390 16.246 11.027
533 HG3 GLU 70 2HG GLU 70 14.076 16.261 10.514
534 H HIS 71 H HIS 71 14.054 13.986 13.941
535 HA HIS 71 HA HIS 71 12.754 14.223 15.890
536 HB2 HIS 71 1HB HIS 71 11.692 16.452 14.131
537 HB3 HIS 71 2HB HIS 71 11.463 16.349 15.878
538 HD1 HIS 71 HD1 HIS 71 12.992 18.762 15.056
539 HD2 HIS 71 HD2 HIS 71 14.898 15.100 15.641
540 HE1 HIS 71 HE1 HIS 71 15.435 19.282 15.480
541 H HIS 72 H HIS 72 11.528 12.292 15.869
542 HA HIS 72 HA HIS 72 9.126 11.957 14.325
543 HB2 HIS 72 1HB HIS 72 8.731 10.002 15.719
544 HB3 HIS 72 2HB HIS 72 10.446 10.083 15.317
545 HD1 HIS 72 HD1 HIS 72 8.174 9.860 18.153
546 HD2 HIS 72 HD2 HIS 72 12.036 11.303 17.537
547 HE1 HIS 72 HE1 HIS 72 9.237 10.062 20.443
548 H HIS 73 H HIS 73 7.013 12.442 14.813
549 HA HIS 73 HA HIS 73 6.533 14.449 16.847
550 HB2 HIS 73 1HB HIS 73 4.254 14.454 16.019
551 HB3 HIS 73 2HB HIS 73 5.349 14.358 14.641
552 HD1 HIS 73 HD1 HIS 73 2.290 13.190 15.005
553 HD2 HIS 73 HD2 HIS 73 5.851 11.031 14.815
554 HE1 HIS 73 HE1 HIS 73 1.671 10.854 14.255
555 H HIS 74 H HIS 74 5.773 14.169 18.887
556 HA HIS 74 HA HIS 74 4.340 11.705 19.641
557 HB2 HIS 74 1HB HIS 74 6.784 11.179 19.926
558 HB3 HIS 74 2HB HIS 74 6.886 12.507 21.082
559 HD1 HIS 74 HD1 HIS 74 4.633 9.457 20.575
560 HD2 HIS 74 HD2 HIS 74 6.428 11.628 23.649
561 HE1 HIS 74 HE1 HIS 74 4.023 8.281 22.733
562 H HIS 75 H HIS 75 2.924 12.117 21.334
563 HA HIS 75 HA HIS 75 2.931 14.916 22.409
564 HB2 HIS 75 1HB HIS 75 0.714 12.864 22.150
565 HB3 HIS 75 2HB HIS 75 0.528 14.451 22.899
566 HD1 HIS 75 HD1 HIS 75 1.142 16.547 21.269
567 HD2 HIS 75 HD2 HIS 75 0.442 12.894 19.386
568 HE1 HIS 75 HE1 HIS 75 0.719 17.070 18.827
569 H HIS 76 H HIS 76 3.086 15.247 24.586
570 HA HIS 76 HA HIS 76 3.911 13.041 26.283
571 HB2 HIS 76 1HB HIS 76 3.324 15.963 26.807
572 HB3 HIS 76 2HB HIS 76 3.869 14.854 28.065
573 HD1 HIS 76 HD1 HIS 76 5.009 16.477 24.853
574 HD2 HIS 76 HD2 HIS 76 6.597 14.141 27.918
575 HE1 HIS 76 HE1 HIS 76 7.518 16.457 24.512
Start of MODEL 15
1 H1 ALA 1 1H ALA 1 9.181 9.193 13.391
2 H2 ALA 1 2H ALA 1 9.610 7.568 13.642
3 H3 ALA 1 3H ALA 1 8.129 7.955 12.905
4 HA ALA 1 HA ALA 1 10.025 9.208 11.364
5 HB1 ALA 1 3HB ALA 1 10.823 6.348 11.977
6 HB2 ALA 1 1HB ALA 1 11.708 7.778 12.507
7 HB3 ALA 1 2HB ALA 1 11.574 7.411 10.788
8 H GLU 2 H GLU 2 9.297 8.963 9.297
9 HA GLU 2 HA GLU 2 6.957 7.227 8.884
10 HB2 GLU 2 1HB GLU 2 7.013 8.382 6.573
11 HB3 GLU 2 2HB GLU 2 6.657 9.385 7.974
12 HG2 GLU 2 1HG GLU 2 9.504 9.057 7.026
13 HG3 GLU 2 2HG GLU 2 8.436 10.222 6.248
14 H LYS 3 H LYS 3 6.802 5.722 7.129
15 HA LYS 3 HA LYS 3 9.441 4.682 6.135
16 HB2 LYS 3 1HB LYS 3 6.978 3.172 7.036
17 HB3 LYS 3 2HB LYS 3 8.332 2.426 6.185
18 HG2 LYS 3 1HG LYS 3 9.865 3.174 7.974
19 HG3 LYS 3 2HG LYS 3 8.504 3.899 8.830
20 HD2 LYS 3 1HD LYS 3 7.437 1.714 9.062
21 HD3 LYS 3 2HD LYS 3 8.724 0.961 8.120
22 HE2 LYS 3 1HE LYS 3 9.146 0.611 10.503
23 HE3 LYS 3 2HE LYS 3 10.372 1.690 9.837
24 HZ1 LYS 3 3HZ LYS 3 7.915 2.788 11.036
25 HZ2 LYS 3 1HZ LYS 3 9.431 3.522 10.845
26 HZ3 LYS 3 2HZ LYS 3 9.213 2.321 12.027
27 H THR 4 H THR 4 9.332 3.639 4.040
28 HA THR 4 HA THR 4 6.919 4.343 2.410
29 HB THR 4 HB THR 4 8.349 5.095 0.602
30 HG1 THR 4 HG1 THR 4 10.097 3.611 1.347
31 HG21 THR 4 3HG2 THR 4 7.730 6.724 2.365
32 HG22 THR 4 1HG2 THR 4 9.290 7.105 1.638
33 HG23 THR 4 2HG2 THR 4 9.220 6.336 3.224
34 H GLY 5 H GLY 5 6.110 2.479 1.717
35 HA2 GLY 5 1HA GLY 5 7.838 0.108 1.371
36 HA3 GLY 5 2HA GLY 5 6.081 0.127 1.332
37 H ILE 6 H ILE 6 8.343 -0.791 -0.582
38 HA ILE 6 HA ILE 6 7.653 0.789 -2.998
39 HB ILE 6 HB ILE 6 9.635 -1.426 -2.441
40 HG12 ILE 6 1HG1 ILE 6 11.265 0.334 -2.999
41 HG13 ILE 6 2HG1 ILE 6 9.952 1.457 -3.340
42 HG21 ILE 6 1HG2 ILE 6 8.779 -0.184 -5.062
43 HG22 ILE 6 2HG2 ILE 6 8.938 -1.896 -4.664
44 HG23 ILE 6 3HG2 ILE 6 10.379 -0.898 -4.856
45 HD11 ILE 6 3HD1 ILE 6 9.356 1.656 -1.084
46 HD12 ILE 6 1HD1 ILE 6 11.111 1.528 -0.992
47 HD13 ILE 6 2HD1 ILE 6 10.110 0.122 -0.644
48 H VAL 7 H VAL 7 5.986 0.179 -4.250
49 HA VAL 7 HA VAL 7 4.632 -2.364 -3.807
50 HB VAL 7 HB VAL 7 4.198 -0.133 -5.807
51 HG11 VAL 7 1HG1 VAL 7 2.691 -2.706 -5.302
52 HG12 VAL 7 2HG1 VAL 7 3.297 -2.087 -6.837
53 HG13 VAL 7 3HG1 VAL 7 1.927 -1.304 -6.049
54 HG21 VAL 7 3HG2 VAL 7 3.802 0.251 -3.317
55 HG22 VAL 7 1HG2 VAL 7 2.536 -0.973 -3.420
56 HG23 VAL 7 2HG2 VAL 7 2.401 0.516 -4.356
57 H ASN 8 H ASN 8 4.870 -4.208 -4.967
58 HA ASN 8 HA ASN 8 6.285 -4.104 -7.596
59 HB2 ASN 8 1HB ASN 8 7.956 -4.679 -5.880
60 HB3 ASN 8 2HB ASN 8 6.934 -6.005 -5.324
61 HD21 ASN 8 2HD2 ASN 8 9.565 -6.500 -6.334
62 HD22 ASN 8 1HD2 ASN 8 9.427 -7.341 -7.801
63 H VAL 9 H VAL 9 4.743 -4.859 -8.945
64 HA VAL 9 HA VAL 9 3.520 -7.497 -8.348
65 HB VAL 9 HB VAL 9 1.281 -6.614 -9.117
66 HG11 VAL 9 1HG1 VAL 9 2.259 -5.175 -6.645
67 HG12 VAL 9 2HG1 VAL 9 2.028 -6.923 -6.682
68 HG13 VAL 9 3HG1 VAL 9 0.659 -5.850 -6.953
69 HG21 VAL 9 3HG2 VAL 9 1.048 -4.068 -8.738
70 HG22 VAL 9 1HG2 VAL 9 1.813 -4.586 -10.239
71 HG23 VAL 9 2HG2 VAL 9 2.797 -4.001 -8.898
72 H SER 10 H SER 10 2.902 -8.632 -10.216
73 HA SER 10 HA SER 10 4.454 -8.143 -12.567
74 HB2 SER 10 1HB SER 10 3.628 -10.380 -11.899
75 HB3 SER 10 2HB SER 10 1.978 -9.856 -12.221
76 HG SER 10 HG SER 10 2.510 -9.610 -14.377
77 H SER 11 H SER 11 1.008 -7.605 -11.858
78 HA SER 11 HA SER 11 0.753 -6.079 -14.427
79 HB2 SER 11 1HB SER 11 -0.796 -8.017 -14.054
80 HB3 SER 11 2HB SER 11 -1.428 -7.181 -12.640
81 HG SER 11 HG SER 11 -2.350 -5.707 -13.900
82 H SER 12 H SER 12 -1.104 -5.916 -11.396
83 HA SER 12 HA SER 12 -0.118 -3.204 -10.838
84 HB2 SER 12 1HB SER 12 -2.283 -2.117 -11.074
85 HB3 SER 12 2HB SER 12 -1.862 -2.878 -12.607
86 HG SER 12 HG SER 12 -4.009 -3.275 -11.123
87 H LEU 13 H LEU 13 -1.196 -2.329 -8.835
88 HA LEU 13 HA LEU 13 -2.012 -4.580 -7.029
89 HB2 LEU 13 1HB LEU 13 0.158 -3.632 -6.412
90 HB3 LEU 13 2HB LEU 13 -0.532 -2.011 -6.390
91 HG LEU 13 HG LEU 13 -2.002 -2.618 -4.531
92 HD11 LEU 13 1HD1 LEU 13 -2.584 -4.867 -4.792
93 HD12 LEU 13 2HD1 LEU 13 -1.441 -4.960 -3.455
94 HD13 LEU 13 3HD1 LEU 13 -0.920 -5.373 -5.090
95 HD21 LEU 13 3HD2 LEU 13 0.255 -1.835 -3.972
96 HD22 LEU 13 1HD2 LEU 13 0.869 -3.485 -4.073
97 HD23 LEU 13 2HD2 LEU 13 -0.273 -3.046 -2.806
98 H ASN 14 H ASN 14 -3.984 -4.447 -6.159
99 HA ASN 14 HA ASN 14 -5.657 -2.091 -6.674
100 HB2 ASN 14 1HB ASN 14 -6.168 -4.782 -5.395
101 HB3 ASN 14 2HB ASN 14 -7.403 -3.525 -5.503
102 HD21 ASN 14 2HD2 ASN 14 -7.698 -6.029 -6.878
103 HD22 ASN 14 1HD2 ASN 14 -7.619 -5.730 -8.547
104 H VAL 15 H VAL 15 -6.646 -0.824 -5.032
105 HA VAL 15 HA VAL 15 -5.132 -0.768 -2.463
106 HB VAL 15 HB VAL 15 -6.915 1.259 -3.837
107 HG11 VAL 15 1HG1 VAL 15 -7.280 1.589 -1.506
108 HG12 VAL 15 2HG1 VAL 15 -6.028 2.752 -1.941
109 HG13 VAL 15 3HG1 VAL 15 -5.592 1.253 -1.120
110 HG21 VAL 15 3HG2 VAL 15 -3.984 1.432 -3.103
111 HG22 VAL 15 1HG2 VAL 15 -4.888 2.479 -4.197
112 HG23 VAL 15 2HG2 VAL 15 -4.532 0.815 -4.662
113 H ARG 16 H ARG 16 -6.120 -1.356 -0.593
114 HA ARG 16 HA ARG 16 -9.023 -2.055 -0.697
115 HB2 ARG 16 1HB ARG 16 -6.777 -2.912 1.143
116 HB3 ARG 16 2HB ARG 16 -8.462 -3.363 1.383
117 HG2 ARG 16 1HG ARG 16 -8.513 -4.439 -0.823
118 HG3 ARG 16 2HG ARG 16 -6.843 -3.949 -1.112
119 HD2 ARG 16 1HD ARG 16 -6.124 -5.281 0.850
120 HD3 ARG 16 2HD ARG 16 -7.794 -5.791 1.101
121 HE ARG 16 HE ARG 16 -7.184 -6.465 -1.552
122 HH11 ARG 16 1HH2 ARG 16 -6.014 -7.157 1.620
123 HH12 ARG 16 2HH2 ARG 16 -5.481 -8.753 1.213
124 HH21 ARG 16 1HH1 ARG 16 -6.492 -8.537 -2.093
125 HH22 ARG 16 2HH1 ARG 16 -5.751 -9.535 -0.887
126 H GLU 17 H GLU 17 -10.459 -1.020 0.570
127 HA GLU 17 HA GLU 17 -9.733 1.437 1.908
128 HB2 GLU 17 1HB GLU 17 -11.959 0.925 0.811
129 HB3 GLU 17 2HB GLU 17 -12.299 -0.154 2.163
130 HG2 GLU 17 1HG GLU 17 -13.321 1.961 2.675
131 HG3 GLU 17 2HG GLU 17 -11.901 1.810 3.710
132 H GLY 18 H GLY 18 -10.762 -1.781 3.045
133 HA2 GLY 18 1HA GLY 18 -10.130 -0.983 5.845
134 HA3 GLY 18 2HA GLY 18 -11.033 -2.417 5.365
135 H ALA 19 H ALA 19 -9.094 -2.842 7.151
136 HA ALA 19 HA ALA 19 -6.605 -3.647 5.758
137 HB1 ALA 19 3HB ALA 19 -5.991 -4.380 8.143
138 HB2 ALA 19 1HB ALA 19 -7.504 -3.628 8.649
139 HB3 ALA 19 2HB ALA 19 -6.240 -2.650 7.905
140 H SER 20 H SER 20 -9.529 -4.901 5.763
141 HA SER 20 HA SER 20 -9.115 -7.590 6.761
142 HB2 SER 20 1HB SER 20 -11.206 -6.307 5.007
143 HB3 SER 20 2HB SER 20 -11.216 -8.037 5.329
144 HG SER 20 HG SER 20 -11.848 -7.652 7.301
145 H THR 21 H THR 21 -9.428 -9.491 5.194
146 HA THR 21 HA THR 21 -7.239 -9.585 3.361
147 HB THR 21 HB THR 21 -9.661 -11.397 3.345
148 HG1 THR 21 HG1 THR 21 -8.933 -11.287 5.439
149 HG21 THR 21 3HG2 THR 21 -8.012 -11.666 1.508
150 HG22 THR 21 1HG2 THR 21 -8.056 -13.070 2.574
151 HG23 THR 21 2HG2 THR 21 -6.742 -11.901 2.709
152 H SER 22 H SER 22 -10.746 -9.255 2.809
153 HA SER 22 HA SER 22 -10.121 -8.217 0.063
154 HB2 SER 22 1HB SER 22 -11.013 -10.589 0.061
155 HB3 SER 22 2HB SER 22 -12.503 -9.955 0.754
156 HG SER 22 HG SER 22 -11.443 -9.695 -1.798
157 H SER 23 H SER 23 -10.277 -6.212 1.481
158 HA SER 23 HA SER 23 -12.970 -5.453 2.358
159 HB2 SER 23 1HB SER 23 -10.687 -4.731 3.390
160 HB3 SER 23 2HB SER 23 -10.656 -3.544 2.096
161 HG SER 23 HG SER 23 -11.840 -2.451 3.458
162 H LYS 24 H LYS 24 -13.636 -3.112 1.638
163 HA LYS 24 HA LYS 24 -14.353 -3.228 -1.121
164 HB2 LYS 24 1HB LYS 24 -15.609 -2.008 0.660
165 HB3 LYS 24 2HB LYS 24 -14.326 -0.798 0.686
166 HG2 LYS 24 1HG LYS 24 -14.738 -0.252 -1.654
167 HG3 LYS 24 2HG LYS 24 -15.940 -1.538 -1.773
168 HD2 LYS 24 1HD LYS 24 -17.310 -0.404 -0.049
169 HD3 LYS 24 2HD LYS 24 -16.121 0.896 0.029
170 HE2 LYS 24 1HE LYS 24 -17.581 0.094 -2.501
171 HE3 LYS 24 2HE LYS 24 -18.085 1.417 -1.452
172 HZ1 LYS 24 3HZ LYS 24 -15.609 2.132 -1.759
173 HZ2 LYS 24 1HZ LYS 24 -16.771 2.523 -2.931
174 HZ3 LYS 24 2HZ LYS 24 -15.727 1.207 -3.180
175 H VAL 25 H VAL 25 -13.376 -2.459 -2.918
176 HA VAL 25 HA VAL 25 -10.714 -1.165 -2.617
177 HB VAL 25 HB VAL 25 -12.109 -2.486 -4.960
178 HG11 VAL 25 1HG1 VAL 25 -9.496 -0.978 -4.777
179 HG12 VAL 25 2HG1 VAL 25 -10.802 -0.761 -5.943
180 HG13 VAL 25 3HG1 VAL 25 -9.781 -2.196 -6.021
181 HG21 VAL 25 3HG2 VAL 25 -9.710 -3.212 -3.253
182 HG22 VAL 25 1HG2 VAL 25 -10.179 -4.076 -4.716
183 HG23 VAL 25 2HG2 VAL 25 -11.253 -4.061 -3.317
184 H ILE 26 H ILE 26 -10.468 0.953 -3.050
185 HA ILE 26 HA ILE 26 -12.735 2.446 -4.304
186 HB ILE 26 HB ILE 26 -11.691 4.437 -3.237
187 HG12 ILE 26 1HG1 ILE 26 -9.840 2.439 -1.895
188 HG13 ILE 26 2HG1 ILE 26 -9.343 3.454 -3.247
189 HG21 ILE 26 1HG2 ILE 26 -12.334 3.866 -0.963
190 HG22 ILE 26 2HG2 ILE 26 -12.111 2.148 -1.293
191 HG23 ILE 26 3HG2 ILE 26 -13.418 3.034 -2.078
192 HD11 ILE 26 3HD1 ILE 26 -9.659 5.456 -1.996
193 HD12 ILE 26 1HD1 ILE 26 -8.809 4.354 -0.914
194 HD13 ILE 26 2HD1 ILE 26 -10.543 4.612 -0.726
195 H GLY 27 H GLY 27 -9.746 1.143 -5.078
196 HA2 GLY 27 1HA GLY 27 -9.613 2.247 -7.655
197 HA3 GLY 27 2HA GLY 27 -8.635 3.300 -6.637
198 H SER 28 H SER 28 -6.768 2.614 -7.889
199 HA SER 28 HA SER 28 -5.478 0.242 -6.737
200 HB2 SER 28 1HB SER 28 -5.029 -0.852 -8.866
201 HB3 SER 28 2HB SER 28 -6.772 -0.661 -8.687
202 HG SER 28 HG SER 28 -5.004 1.032 -10.135
203 H LEU 29 H LEU 29 -3.164 0.113 -7.492
204 HA LEU 29 HA LEU 29 -2.119 2.778 -8.399
205 HB2 LEU 29 1HB LEU 29 -0.982 0.959 -6.258
206 HB3 LEU 29 2HB LEU 29 -0.212 2.431 -6.850
207 HG LEU 29 HG LEU 29 -2.956 2.305 -5.560
208 HD11 LEU 29 1HD1 LEU 29 -0.261 3.179 -4.477
209 HD12 LEU 29 2HD1 LEU 29 -1.240 1.825 -3.910
210 HD13 LEU 29 3HD1 LEU 29 -1.800 3.481 -3.670
211 HD21 LEU 29 3HD2 LEU 29 -3.039 4.235 -6.878
212 HD22 LEU 29 1HD2 LEU 29 -1.299 4.509 -6.777
213 HD23 LEU 29 2HD2 LEU 29 -2.336 4.885 -5.402
214 H SER 30 H SER 30 -0.281 2.734 -9.675
215 HA SER 30 HA SER 30 0.038 0.386 -11.331
216 HB2 SER 30 1HB SER 30 1.420 3.059 -11.184
217 HB3 SER 30 2HB SER 30 1.962 1.805 -12.297
218 HG SER 30 HG SER 30 -0.586 3.042 -12.136
219 H GLY 31 H GLY 31 2.020 -0.774 -11.658
220 HA2 GLY 31 1HA GLY 31 3.244 -1.712 -9.267
221 HA3 GLY 31 2HA GLY 31 3.820 -2.047 -10.897
222 H ASN 32 H ASN 32 5.453 -1.556 -8.601
223 HA ASN 32 HA ASN 32 7.353 -0.358 -7.982
224 HB2 ASN 32 1HB ASN 32 7.794 -0.758 -10.468
225 HB3 ASN 32 2HB ASN 32 7.231 0.893 -10.734
226 HD21 ASN 32 2HD2 ASN 32 9.396 1.625 -11.371
227 HD22 ASN 32 1HD2 ASN 32 10.638 1.793 -10.225
228 H THR 33 H THR 33 4.739 0.799 -7.438
229 HA THR 33 HA THR 33 5.211 3.722 -7.751
230 HB THR 33 HB THR 33 2.813 2.134 -6.807
231 HG1 THR 33 HG1 THR 33 3.715 3.051 -9.162
232 HG21 THR 33 3HG2 THR 33 3.349 5.109 -6.865
233 HG22 THR 33 1HG2 THR 33 2.766 4.135 -5.515
234 HG23 THR 33 2HG2 THR 33 1.714 4.452 -6.894
235 H LYS 34 H LYS 34 5.874 4.956 -6.076
236 HA LYS 34 HA LYS 34 6.631 3.660 -3.567
237 HB2 LYS 34 1HB LYS 34 8.047 5.394 -4.649
238 HB3 LYS 34 2HB LYS 34 6.770 6.579 -4.375
239 HG2 LYS 34 1HG LYS 34 6.939 6.250 -1.956
240 HG3 LYS 34 2HG LYS 34 8.158 4.998 -2.191
241 HD2 LYS 34 1HD LYS 34 9.649 6.658 -3.258
242 HD3 LYS 34 2HD LYS 34 8.433 7.910 -2.994
243 HE2 LYS 34 1HE LYS 34 8.574 7.553 -0.563
244 HE3 LYS 34 2HE LYS 34 9.767 6.278 -0.814
245 HZ1 LYS 34 3HZ LYS 34 10.321 8.860 -2.040
246 HZ2 LYS 34 1HZ LYS 34 11.380 7.751 -1.317
247 HZ3 LYS 34 2HZ LYS 34 10.439 8.780 -0.347
248 H VAL 35 H VAL 35 5.430 3.628 -1.735
249 HA VAL 35 HA VAL 35 3.197 5.615 -1.444
250 HB VAL 35 HB VAL 35 1.955 3.733 -0.265
251 HG11 VAL 35 1HG1 VAL 35 2.590 3.632 -3.220
252 HG12 VAL 35 2HG1 VAL 35 1.226 4.429 -2.437
253 HG13 VAL 35 3HG1 VAL 35 1.309 2.669 -2.486
254 HG21 VAL 35 3HG2 VAL 35 3.926 2.243 0.021
255 HG22 VAL 35 1HG2 VAL 35 4.020 2.059 -1.731
256 HG23 VAL 35 2HG2 VAL 35 2.619 1.443 -0.854
257 H THR 36 H THR 36 3.134 6.616 0.500
258 HA THR 36 HA THR 36 5.295 6.082 2.405
259 HB THR 36 HB THR 36 3.006 8.055 2.611
260 HG1 THR 36 HG1 THR 36 4.309 9.453 1.555
261 HG21 THR 36 3HG2 THR 36 4.180 7.656 4.724
262 HG22 THR 36 1HG2 THR 36 4.581 9.255 4.098
263 HG23 THR 36 2HG2 THR 36 5.731 7.928 3.928
264 H ILE 37 H ILE 37 5.108 4.765 4.099
265 HA ILE 37 HA ILE 37 2.430 3.751 4.890
266 HB ILE 37 HB ILE 37 5.235 2.773 5.492
267 HG12 ILE 37 1HG1 ILE 37 3.011 1.460 3.909
268 HG13 ILE 37 2HG1 ILE 37 4.259 2.457 3.161
269 HG21 ILE 37 1HG2 ILE 37 3.948 0.759 6.388
270 HG22 ILE 37 2HG2 ILE 37 2.517 1.788 6.388
271 HG23 ILE 37 3HG2 ILE 37 3.904 2.203 7.396
272 HD11 ILE 37 3HD1 ILE 37 4.978 0.138 4.957
273 HD12 ILE 37 1HD1 ILE 37 5.982 0.949 3.754
274 HD13 ILE 37 2HD1 ILE 37 4.659 -0.097 3.238
275 H VAL 38 H VAL 38 1.580 4.140 6.860
276 HA VAL 38 HA VAL 38 3.161 5.791 8.797
277 HB VAL 38 HB VAL 38 0.968 6.565 9.632
278 HG11 VAL 38 1HG1 VAL 38 0.995 6.829 6.621
279 HG12 VAL 38 2HG1 VAL 38 2.178 7.645 7.644
280 HG13 VAL 38 3HG1 VAL 38 0.462 8.015 7.813
281 HG21 VAL 38 3HG2 VAL 38 -0.120 4.811 7.405
282 HG22 VAL 38 1HG2 VAL 38 -1.077 5.975 8.320
283 HG23 VAL 38 2HG2 VAL 38 -0.373 4.579 9.135
284 H GLY 39 H GLY 39 1.961 2.710 8.193
285 HA2 GLY 39 1HA GLY 39 2.824 1.529 10.549
286 HA3 GLY 39 2HA GLY 39 1.164 2.006 10.897
287 H GLU 40 H GLU 40 1.218 -0.511 11.103
288 HA GLU 40 HA GLU 40 0.132 -1.606 8.561
289 HB2 GLU 40 1HB GLU 40 1.356 -3.733 8.923
290 HB3 GLU 40 2HB GLU 40 2.464 -2.388 8.666
291 HG2 GLU 40 1HG GLU 40 2.764 -2.164 11.109
292 HG3 GLU 40 2HG GLU 40 1.670 -3.525 11.364
293 H GLU 41 H GLU 41 -1.498 -3.173 8.887
294 HA GLU 41 HA GLU 41 -2.151 -3.907 11.695
295 HB2 GLU 41 1HB GLU 41 -4.044 -2.459 9.823
296 HB3 GLU 41 2HB GLU 41 -4.515 -3.194 11.353
297 HG2 GLU 41 1HG GLU 41 -4.142 -0.968 11.982
298 HG3 GLU 41 2HG GLU 41 -2.594 -1.716 12.367
299 H GLY 42 H GLY 42 -2.512 -6.031 11.691
300 HA2 GLY 42 1HA GLY 42 -3.338 -8.131 11.069
301 HA3 GLY 42 2HA GLY 42 -4.369 -7.317 9.894
302 H ALA 43 H ALA 43 -0.873 -6.962 9.947
303 HA ALA 43 HA ALA 43 0.782 -7.795 8.493
304 HB1 ALA 43 3HB ALA 43 0.487 -9.855 7.454
305 HB2 ALA 43 1HB ALA 43 -1.174 -9.506 6.979
306 HB3 ALA 43 2HB ALA 43 -0.807 -9.946 8.646
307 H PHE 44 H PHE 44 -1.603 -5.812 7.907
308 HA PHE 44 HA PHE 44 -1.042 -5.490 4.974
309 HB2 PHE 44 1HB PHE 44 -3.411 -4.538 6.612
310 HB3 PHE 44 2HB PHE 44 -3.168 -4.226 4.894
311 HD1 PHE 44 HD2 PHE 44 -3.237 -6.075 3.251
312 HD2 PHE 44 HD1 PHE 44 -4.090 -6.718 7.411
313 HE1 PHE 44 HE2 PHE 44 -4.247 -8.273 2.703
314 HE2 PHE 44 HE1 PHE 44 -5.105 -8.914 6.862
315 HZ PHE 44 HZ PHE 44 -5.183 -9.691 4.509
316 H TYR 45 H TYR 45 0.003 -3.678 4.374
317 HA TYR 45 HA TYR 45 0.918 -1.814 6.416
318 HB2 TYR 45 1HB TYR 45 1.342 -2.062 3.443
319 HB3 TYR 45 2HB TYR 45 1.951 -0.672 4.341
320 HD1 TYR 45 HD1 TYR 45 3.155 -1.397 6.672
321 HD2 TYR 45 HD2 TYR 45 2.847 -3.828 3.147
322 HE1 TYR 45 HE1 TYR 45 5.116 -2.708 7.410
323 HE2 TYR 45 HE2 TYR 45 4.821 -5.134 3.885
324 HH TYR 45 HH TYR 45 6.549 -5.191 5.343
325 H LYS 46 H LYS 46 0.234 0.279 6.736
326 HA LYS 46 HA LYS 46 -2.253 1.088 5.296
327 HB2 LYS 46 1HB LYS 46 -2.274 1.019 7.796
328 HB3 LYS 46 2HB LYS 46 -1.010 2.249 7.805
329 HG2 LYS 46 1HG LYS 46 -2.473 3.803 6.604
330 HG3 LYS 46 2HG LYS 46 -3.734 2.573 6.515
331 HD2 LYS 46 1HD LYS 46 -3.844 2.515 8.986
332 HD3 LYS 46 2HD LYS 46 -2.604 3.767 9.064
333 HE2 LYS 46 1HE LYS 46 -4.073 5.310 7.823
334 HE3 LYS 46 2HE LYS 46 -5.311 4.057 7.728
335 HZ1 LYS 46 3HZ LYS 46 -4.592 4.233 10.388
336 HZ2 LYS 46 1HZ LYS 46 -6.042 4.755 9.680
337 HZ3 LYS 46 2HZ LYS 46 -4.744 5.839 9.850
338 H ILE 47 H ILE 47 -1.988 2.500 3.678
339 HA ILE 47 HA ILE 47 0.279 4.449 3.812
340 HB ILE 47 HB ILE 47 0.360 4.297 1.327
341 HG12 ILE 47 1HG1 ILE 47 -1.403 1.857 1.709
342 HG13 ILE 47 2HG1 ILE 47 -2.002 3.404 1.115
343 HG21 ILE 47 1HG2 ILE 47 0.836 1.823 2.998
344 HG22 ILE 47 2HG2 ILE 47 2.005 3.057 2.528
345 HG23 ILE 47 3HG2 ILE 47 1.362 1.946 1.319
346 HD11 ILE 47 3HD1 ILE 47 -0.307 3.291 -0.727
347 HD12 ILE 47 1HD1 ILE 47 -1.499 1.992 -0.793
348 HD13 ILE 47 2HD1 ILE 47 0.122 1.672 -0.175
349 H GLU 48 H GLU 48 -0.068 6.408 2.579
350 HA GLU 48 HA GLU 48 -2.859 7.357 2.910
351 HB2 GLU 48 1HB GLU 48 -1.490 9.555 2.031
352 HB3 GLU 48 2HB GLU 48 -1.550 9.065 3.722
353 HG2 GLU 48 1HG GLU 48 0.773 9.499 2.945
354 HG3 GLU 48 2HG GLU 48 0.548 7.839 3.490
355 H TYR 49 H TYR 49 -4.243 7.448 1.229
356 HA TYR 49 HA TYR 49 -3.153 7.747 -1.542
357 HB2 TYR 49 1HB TYR 49 -3.706 5.398 -1.267
358 HB3 TYR 49 2HB TYR 49 -5.294 5.814 -0.620
359 HD1 TYR 49 HD2 TYR 49 -3.129 6.270 -3.639
360 HD2 TYR 49 HD1 TYR 49 -7.125 6.095 -2.074
361 HE1 TYR 49 HE2 TYR 49 -4.039 6.382 -5.944
362 HE2 TYR 49 HE1 TYR 49 -8.033 6.206 -4.378
363 HH TYR 49 HH TYR 49 -7.115 7.161 -6.672
364 H LYS 50 H LYS 50 -3.987 9.510 -2.428
365 HA LYS 50 HA LYS 50 -5.340 11.423 -2.640
366 HB2 LYS 50 1HB LYS 50 -6.344 9.474 -4.022
367 HB3 LYS 50 2HB LYS 50 -7.594 9.421 -2.780
368 HG2 LYS 50 1HG LYS 50 -8.177 11.750 -3.200
369 HG3 LYS 50 2HG LYS 50 -6.842 11.910 -4.342
370 HD2 LYS 50 1HD LYS 50 -7.875 10.184 -5.784
371 HD3 LYS 50 2HD LYS 50 -9.224 10.063 -4.654
372 HE2 LYS 50 1HE LYS 50 -9.772 12.430 -5.028
373 HE3 LYS 50 2HE LYS 50 -8.403 12.581 -6.130
374 HZ1 LYS 50 3HZ LYS 50 -9.700 11.865 -7.753
375 HZ2 LYS 50 1HZ LYS 50 -10.997 11.655 -6.680
376 HZ3 LYS 50 2HZ LYS 50 -9.903 10.383 -6.946
377 H GLY 51 H GLY 51 -4.850 11.119 0.024
378 HA2 GLY 51 1HA GLY 51 -5.721 12.203 1.957
379 HA3 GLY 51 2HA GLY 51 -7.313 12.228 1.197
380 H SER 52 H SER 52 -7.816 9.619 0.638
381 HA SER 52 HA SER 52 -8.393 8.542 3.268
382 HB2 SER 52 1HB SER 52 -8.856 7.583 0.451
383 HB3 SER 52 2HB SER 52 -9.241 6.564 1.835
384 HG SER 52 HG SER 52 -10.151 9.022 2.298
385 H HIS 53 H HIS 53 -7.533 6.715 4.257
386 HA HIS 53 HA HIS 53 -4.785 6.039 3.480
387 HB2 HIS 53 1HB HIS 53 -6.505 5.026 5.759
388 HB3 HIS 53 2HB HIS 53 -4.772 4.749 5.572
389 HD1 HIS 53 HD1 HIS 53 -3.276 7.028 5.463
390 HD2 HIS 53 HD2 HIS 53 -7.112 7.411 7.048
391 HE1 HIS 53 HE1 HIS 53 -3.311 9.219 6.734
392 H GLY 54 H GLY 54 -4.343 4.423 2.118
393 HA2 GLY 54 1HA GLY 54 -6.385 2.329 1.584
394 HA3 GLY 54 2HA GLY 54 -4.986 2.695 0.577
395 H TYR 55 H TYR 55 -5.883 0.117 1.769
396 HA TYR 55 HA TYR 55 -3.461 -0.526 3.420
397 HB2 TYR 55 1HB TYR 55 -6.189 -1.830 3.340
398 HB3 TYR 55 2HB TYR 55 -4.810 -2.461 4.241
399 HD1 TYR 55 HD2 TYR 55 -7.214 0.339 3.966
400 HD2 TYR 55 HD1 TYR 55 -4.020 -1.395 6.254
401 HE1 TYR 55 HE2 TYR 55 -7.716 1.885 5.840
402 HE2 TYR 55 HE1 TYR 55 -4.519 0.151 8.126
403 HH TYR 55 HH TYR 55 -7.338 2.271 8.053
404 H VAL 56 H VAL 56 -2.191 -2.249 2.787
405 HA VAL 56 HA VAL 56 -3.040 -3.851 0.424
406 HB VAL 56 HB VAL 56 -0.780 -3.525 -0.582
407 HG11 VAL 56 1HG1 VAL 56 -1.250 -1.295 -1.477
408 HG12 VAL 56 2HG1 VAL 56 -2.334 -0.962 -0.126
409 HG13 VAL 56 3HG1 VAL 56 -2.754 -2.200 -1.310
410 HG21 VAL 56 3HG2 VAL 56 0.522 -2.861 1.325
411 HG22 VAL 56 1HG2 VAL 56 -0.559 -1.512 1.672
412 HG23 VAL 56 2HG2 VAL 56 0.473 -1.469 0.244
413 H ALA 57 H ALA 57 -1.915 -5.865 0.259
414 HA ALA 57 HA ALA 57 -1.152 -6.983 2.828
415 HB1 ALA 57 3HB ALA 57 -0.791 -8.284 0.126
416 HB2 ALA 57 1HB ALA 57 -2.359 -8.187 0.924
417 HB3 ALA 57 2HB ALA 57 -1.037 -9.071 1.685
418 H LYS 58 H LYS 58 0.868 -7.502 3.567
419 HA LYS 58 HA LYS 58 3.142 -6.073 2.557
420 HB2 LYS 58 1HB LYS 58 4.398 -7.377 4.238
421 HB3 LYS 58 2HB LYS 58 2.898 -6.741 4.916
422 HG2 LYS 58 1HG LYS 58 1.884 -9.044 4.176
423 HG3 LYS 58 2HG LYS 58 3.566 -9.573 4.121
424 HD2 LYS 58 1HD LYS 58 2.085 -8.440 6.511
425 HD3 LYS 58 2HD LYS 58 2.701 -10.082 6.324
426 HE2 LYS 58 1HE LYS 58 4.260 -7.524 6.686
427 HE3 LYS 58 2HE LYS 58 4.318 -8.988 7.667
428 HZ1 LYS 58 3HZ LYS 58 5.679 -8.371 5.196
429 HZ2 LYS 58 1HZ LYS 58 4.970 -9.912 5.228
430 HZ3 LYS 58 2HZ LYS 58 6.095 -9.472 6.422
431 H GLU 59 H GLU 59 1.656 -8.883 1.460
432 HA GLU 59 HA GLU 59 3.968 -10.390 0.602
433 HB2 GLU 59 1HB GLU 59 1.086 -10.364 -0.315
434 HB3 GLU 59 2HB GLU 59 2.285 -11.509 -0.916
435 HG2 GLU 59 1HG GLU 59 2.669 -12.336 1.359
436 HG3 GLU 59 2HG GLU 59 1.533 -11.147 2.000
437 H TYR 60 H TYR 60 2.342 -7.595 -0.636
438 HA TYR 60 HA TYR 60 3.703 -7.875 -3.289
439 HB2 TYR 60 1HB TYR 60 1.517 -5.988 -2.364
440 HB3 TYR 60 2HB TYR 60 2.174 -6.067 -3.999
441 HD1 TYR 60 HD2 TYR 60 2.246 -8.546 -5.012
442 HD2 TYR 60 HD1 TYR 60 -0.431 -7.218 -1.927
443 HE1 TYR 60 HE2 TYR 60 0.699 -10.403 -5.557
444 HE2 TYR 60 HE1 TYR 60 -1.979 -9.082 -2.470
445 HH TYR 60 HH TYR 60 -1.213 -11.402 -5.073
446 H ILE 61 H ILE 61 3.683 -6.058 -0.326
447 HA ILE 61 HA ILE 61 5.439 -3.952 -1.486
448 HB ILE 61 HB ILE 61 4.015 -4.243 1.161
449 HG12 ILE 61 1HG1 ILE 61 2.943 -2.144 0.422
450 HG13 ILE 61 2HG1 ILE 61 3.917 -2.163 -1.046
451 HG21 ILE 61 1HG2 ILE 61 5.000 -1.896 1.575
452 HG22 ILE 61 2HG2 ILE 61 6.193 -2.313 0.343
453 HG23 ILE 61 3HG2 ILE 61 6.076 -3.269 1.820
454 HD11 ILE 61 3HD1 ILE 61 2.220 -4.556 -0.379
455 HD12 ILE 61 1HD1 ILE 61 2.759 -3.971 -1.954
456 HD13 ILE 61 2HD1 ILE 61 1.472 -3.130 -1.095
457 H LYS 62 H LYS 62 7.590 -3.964 -1.180
458 HA LYS 62 HA LYS 62 8.746 -5.657 0.998
459 HB2 LYS 62 1HB LYS 62 10.441 -6.527 -0.502
460 HB3 LYS 62 2HB LYS 62 8.856 -6.889 -1.182
461 HG2 LYS 62 1HG LYS 62 9.055 -4.876 -2.643
462 HG3 LYS 62 2HG LYS 62 10.682 -4.606 -2.014
463 HD2 LYS 62 1HD LYS 62 11.376 -6.825 -2.828
464 HD3 LYS 62 2HD LYS 62 9.753 -7.102 -3.461
465 HE2 LYS 62 1HE LYS 62 11.156 -6.342 -5.287
466 HE3 LYS 62 2HE LYS 62 10.028 -5.050 -4.884
467 HZ1 LYS 62 3HZ LYS 62 12.183 -4.635 -3.250
468 HZ2 LYS 62 1HZ LYS 62 11.799 -3.758 -4.650
469 HZ3 LYS 62 2HZ LYS 62 12.873 -5.072 -4.741
470 H ASP 63 H ASP 63 11.385 -5.184 0.467
471 HA ASP 63 HA ASP 63 13.085 -3.650 0.894
472 HB2 ASP 63 1HB ASP 63 11.214 -1.916 -0.740
473 HB3 ASP 63 2HB ASP 63 12.773 -1.346 -0.161
474 H ILE 64 H ILE 64 10.389 -1.352 1.026
475 HA ILE 64 HA ILE 64 9.669 0.049 2.746
476 HB ILE 64 HB ILE 64 10.491 -2.320 4.456
477 HG12 ILE 64 1HG1 ILE 64 7.749 -1.454 3.495
478 HG13 ILE 64 2HG1 ILE 64 8.722 -2.668 2.665
479 HG21 ILE 64 1HG2 ILE 64 8.794 -1.244 6.039
480 HG22 ILE 64 2HG2 ILE 64 8.927 0.203 5.040
481 HG23 ILE 64 3HG2 ILE 64 10.342 -0.414 5.893
482 HD11 ILE 64 3HD1 ILE 64 7.696 -2.799 5.513
483 HD12 ILE 64 1HD1 ILE 64 8.829 -3.960 4.820
484 HD13 ILE 64 2HD1 ILE 64 7.199 -3.816 4.161
485 H LYS 65 H LYS 65 11.325 1.606 2.379
486 HA LYS 65 HA LYS 65 13.333 1.708 4.584
487 HB2 LYS 65 1HB LYS 65 14.431 0.819 2.508
488 HB3 LYS 65 2HB LYS 65 14.005 2.326 1.696
489 HG2 LYS 65 1HG LYS 65 15.292 3.611 3.335
490 HG3 LYS 65 2HG LYS 65 15.666 2.135 4.226
491 HD2 LYS 65 1HD LYS 65 16.855 1.242 2.263
492 HD3 LYS 65 2HD LYS 65 16.480 2.711 1.362
493 HE2 LYS 65 1HE LYS 65 18.746 2.872 2.262
494 HE3 LYS 65 2HE LYS 65 17.708 4.037 3.081
495 HZ1 LYS 65 3HZ LYS 65 17.395 2.322 4.843
496 HZ2 LYS 65 1HZ LYS 65 18.974 2.931 4.727
497 HZ3 LYS 65 2HZ LYS 65 18.608 1.399 4.092
498 H ASP 66 H ASP 66 13.462 3.685 5.491
499 HA ASP 66 HA ASP 66 11.607 5.751 4.765
500 HB2 ASP 66 1HB ASP 66 12.812 7.085 6.500
501 HB3 ASP 66 2HB ASP 66 12.354 5.479 7.069
502 H GLU 67 H GLU 67 11.809 7.227 3.186
503 HA GLU 67 HA GLU 67 14.489 7.714 1.976
504 HB2 GLU 67 1HB GLU 67 12.381 7.074 0.620
505 HB3 GLU 67 2HB GLU 67 11.823 8.712 0.955
506 HG2 GLU 67 1HG GLU 67 12.947 8.776 -1.167
507 HG3 GLU 67 2HG GLU 67 14.018 9.547 0.004
508 H VAL 68 H VAL 68 12.226 9.117 4.121
509 HA VAL 68 HA VAL 68 13.040 11.898 3.537
510 HB VAL 68 HB VAL 68 11.349 10.906 5.843
511 HG11 VAL 68 1HG1 VAL 68 12.080 13.215 6.052
512 HG12 VAL 68 2HG1 VAL 68 10.376 13.208 5.599
513 HG13 VAL 68 3HG1 VAL 68 11.609 13.555 4.387
514 HG21 VAL 68 3HG2 VAL 68 10.314 10.042 3.847
515 HG22 VAL 68 1HG2 VAL 68 10.592 11.552 2.980
516 HG23 VAL 68 2HG2 VAL 68 9.420 11.494 4.297
517 H LEU 69 H LEU 69 15.177 12.126 4.123
518 HA LEU 69 HA LEU 69 16.041 11.226 6.831
519 HB2 LEU 69 1HB LEU 69 17.490 12.032 4.307
520 HB3 LEU 69 2HB LEU 69 18.334 11.986 5.856
521 HG LEU 69 HG LEU 69 17.598 9.617 6.145
522 HD11 LEU 69 1HD1 LEU 69 15.634 9.400 4.869
523 HD12 LEU 69 2HD1 LEU 69 16.821 8.527 3.906
524 HD13 LEU 69 3HD1 LEU 69 16.352 10.166 3.452
525 HD21 LEU 69 3HD2 LEU 69 19.044 10.117 3.522
526 HD22 LEU 69 1HD2 LEU 69 19.159 8.670 4.525
527 HD23 LEU 69 2HD2 LEU 69 19.799 10.204 5.114
528 H GLU 70 H GLU 70 14.452 13.760 5.775
529 HA GLU 70 HA GLU 70 14.254 15.997 6.425
530 HB2 GLU 70 1HB GLU 70 15.976 14.992 8.719
531 HB3 GLU 70 2HB GLU 70 15.170 16.556 8.688
532 HG2 GLU 70 1HG GLU 70 13.735 13.904 8.382
533 HG3 GLU 70 2HG GLU 70 13.864 14.787 9.903
534 H HIS 71 H HIS 71 15.346 16.937 4.702
535 HA HIS 71 HA HIS 71 18.206 17.097 4.492
536 HB2 HIS 71 1HB HIS 71 17.790 18.702 2.707
537 HB3 HIS 71 2HB HIS 71 16.644 17.369 2.573
538 HD1 HIS 71 HD1 HIS 71 16.839 20.959 3.802
539 HD2 HIS 71 HD2 HIS 71 13.958 18.117 2.793
540 HE1 HIS 71 HE1 HIS 71 14.609 22.165 3.801
541 H HIS 72 H HIS 72 19.625 18.669 5.152
542 HA HIS 72 HA HIS 72 18.688 21.216 6.221
543 HB2 HIS 72 1HB HIS 72 18.349 19.667 8.156
544 HB3 HIS 72 2HB HIS 72 20.064 19.260 8.086
545 HD1 HIS 72 HD1 HIS 72 20.675 20.347 10.339
546 HD2 HIS 72 HD2 HIS 72 18.881 23.005 7.675
547 HE1 HIS 72 HE1 HIS 72 20.968 22.661 11.324
548 H HIS 73 H HIS 73 21.267 18.945 5.499
549 HA HIS 73 HA HIS 73 23.014 21.221 4.788
550 HB2 HIS 73 1HB HIS 73 23.775 19.150 6.861
551 HB3 HIS 73 2HB HIS 73 24.929 20.235 6.085
552 HD1 HIS 73 HD1 HIS 73 24.243 22.896 6.312
553 HD2 HIS 73 HD2 HIS 73 22.578 20.275 9.094
554 HE1 HIS 73 HE1 HIS 73 23.434 24.321 8.242
555 H HIS 74 H HIS 74 24.901 20.521 3.514
556 HA HIS 74 HA HIS 74 24.889 17.729 2.547
557 HB2 HIS 74 1HB HIS 74 24.706 18.464 0.164
558 HB3 HIS 74 2HB HIS 74 23.228 18.741 1.084
559 HD1 HIS 74 HD1 HIS 74 22.615 21.203 1.659
560 HD2 HIS 74 HD2 HIS 74 26.065 20.829 -0.652
561 HE1 HIS 74 HE1 HIS 74 23.153 23.522 0.794
562 H HIS 75 H HIS 75 26.757 17.317 1.095
563 HA HIS 75 HA HIS 75 28.927 19.361 1.289
564 HB2 HIS 75 1HB HIS 75 30.516 17.501 1.878
565 HB3 HIS 75 2HB HIS 75 29.343 17.863 3.142
566 HD1 HIS 75 HD1 HIS 75 27.213 16.202 3.254
567 HD2 HIS 75 HD2 HIS 75 30.435 14.873 0.964
568 HE1 HIS 75 HE1 HIS 75 26.889 13.710 2.935
569 H HIS 76 H HIS 76 28.642 19.743 -0.943
570 HA HIS 76 HA HIS 76 28.888 19.350 -3.242
571 HB2 HIS 76 1HB HIS 76 31.240 19.177 -2.335
572 HB3 HIS 76 2HB HIS 76 31.034 17.425 -2.319
573 HD1 HIS 76 HD1 HIS 76 30.722 16.241 -4.652
574 HD2 HIS 76 HD2 HIS 76 31.648 20.299 -4.890
575 HE1 HIS 76 HE1 HIS 76 31.385 16.685 -7.056
Start of MODEL 16
1 H1 ALA 1 1H ALA 1 10.116 8.283 10.704
2 H2 ALA 1 2H ALA 1 9.917 8.610 12.359
3 H3 ALA 1 3H ALA 1 8.906 9.357 11.216
4 HA ALA 1 HA ALA 1 8.965 6.488 11.970
5 HB1 ALA 1 3HB ALA 1 7.685 7.965 13.465
6 HB2 ALA 1 1HB ALA 1 6.588 6.949 12.528
7 HB3 ALA 1 2HB ALA 1 6.824 8.639 12.082
8 H GLU 2 H GLU 2 8.395 8.823 9.489
9 HA GLU 2 HA GLU 2 6.454 7.375 7.956
10 HB2 GLU 2 1HB GLU 2 8.519 9.450 7.179
11 HB3 GLU 2 2HB GLU 2 7.306 8.819 6.062
12 HG2 GLU 2 1HG GLU 2 5.507 9.577 7.537
13 HG3 GLU 2 2HG GLU 2 6.689 10.143 8.718
14 H LYS 3 H LYS 3 6.696 5.768 6.451
15 HA LYS 3 HA LYS 3 9.455 4.935 5.652
16 HB2 LYS 3 1HB LYS 3 7.263 3.156 6.764
17 HB3 LYS 3 2HB LYS 3 8.711 2.549 5.955
18 HG2 LYS 3 1HG LYS 3 10.125 3.689 7.619
19 HG3 LYS 3 2HG LYS 3 8.684 4.303 8.428
20 HD2 LYS 3 1HD LYS 3 7.943 1.988 8.864
21 HD3 LYS 3 2HD LYS 3 9.396 1.378 8.069
22 HE2 LYS 3 1HE LYS 3 10.801 2.536 9.725
23 HE3 LYS 3 2HE LYS 3 9.357 3.164 10.517
24 HZ1 LYS 3 3HZ LYS 3 9.735 1.309 11.755
25 HZ2 LYS 3 1HZ LYS 3 10.415 0.435 10.470
26 HZ3 LYS 3 2HZ LYS 3 8.730 0.640 10.559
27 H THR 4 H THR 4 9.511 3.876 3.584
28 HA THR 4 HA THR 4 6.960 4.097 2.000
29 HB THR 4 HB THR 4 8.222 4.894 0.133
30 HG1 THR 4 HG1 THR 4 10.044 3.516 0.558
31 HG21 THR 4 3HG2 THR 4 9.036 6.983 0.963
32 HG22 THR 4 1HG2 THR 4 9.446 6.276 2.526
33 HG23 THR 4 2HG2 THR 4 7.756 6.488 2.070
34 H GLY 5 H GLY 5 6.346 2.244 1.050
35 HA2 GLY 5 1HA GLY 5 8.308 -0.018 0.905
36 HA3 GLY 5 2HA GLY 5 6.562 -0.205 1.032
37 H ILE 6 H ILE 6 8.903 -0.737 -1.088
38 HA ILE 6 HA ILE 6 7.801 0.599 -3.447
39 HB ILE 6 HB ILE 6 9.960 -1.475 -2.999
40 HG12 ILE 6 1HG1 ILE 6 11.396 0.347 -3.838
41 HG13 ILE 6 2HG1 ILE 6 9.976 1.358 -4.090
42 HG21 ILE 6 1HG2 ILE 6 10.440 -1.084 -5.493
43 HG22 ILE 6 2HG2 ILE 6 8.794 -0.458 -5.599
44 HG23 ILE 6 3HG2 ILE 6 9.073 -2.131 -5.112
45 HD11 ILE 6 3HD1 ILE 6 9.593 1.624 -1.789
46 HD12 ILE 6 1HD1 ILE 6 11.353 1.658 -1.891
47 HD13 ILE 6 2HD1 ILE 6 10.530 0.189 -1.367
48 H VAL 7 H VAL 7 6.130 -0.160 -4.640
49 HA VAL 7 HA VAL 7 4.893 -2.717 -3.938
50 HB VAL 7 HB VAL 7 4.206 -0.607 -5.999
51 HG11 VAL 7 1HG1 VAL 7 1.955 -1.859 -5.934
52 HG12 VAL 7 2HG1 VAL 7 2.857 -3.200 -5.228
53 HG13 VAL 7 3HG1 VAL 7 3.262 -2.617 -6.842
54 HG21 VAL 7 3HG2 VAL 7 2.852 -1.345 -3.391
55 HG22 VAL 7 1HG2 VAL 7 2.498 0.041 -4.421
56 HG23 VAL 7 2HG2 VAL 7 4.026 -0.038 -3.543
57 H ASN 8 H ASN 8 5.133 -4.610 -5.025
58 HA ASN 8 HA ASN 8 6.552 -4.571 -7.678
59 HB2 ASN 8 1HB ASN 8 6.702 -6.553 -5.388
60 HB3 ASN 8 2HB ASN 8 7.365 -6.862 -6.992
61 HD21 ASN 8 2HD2 ASN 8 7.966 -3.764 -7.063
62 HD22 ASN 8 1HD2 ASN 8 9.415 -3.646 -6.193
63 H VAL 9 H VAL 9 4.761 -4.749 -9.034
64 HA VAL 9 HA VAL 9 3.232 -7.298 -8.805
65 HB VAL 9 HB VAL 9 1.126 -6.067 -9.366
66 HG11 VAL 9 1HG1 VAL 9 0.651 -5.446 -7.123
67 HG12 VAL 9 2HG1 VAL 9 2.325 -4.982 -6.813
68 HG13 VAL 9 3HG1 VAL 9 1.901 -6.683 -6.995
69 HG21 VAL 9 3HG2 VAL 9 1.183 -3.572 -8.788
70 HG22 VAL 9 1HG2 VAL 9 1.931 -4.025 -10.318
71 HG23 VAL 9 2HG2 VAL 9 2.937 -3.682 -8.911
72 H SER 10 H SER 10 2.910 -8.258 -10.752
73 HA SER 10 HA SER 10 4.350 -7.385 -13.048
74 HB2 SER 10 1HB SER 10 3.852 -9.706 -12.870
75 HB3 SER 10 2HB SER 10 2.133 -9.399 -12.633
76 HG SER 10 HG SER 10 1.944 -8.839 -14.747
77 H SER 11 H SER 11 0.877 -7.216 -12.257
78 HA SER 11 HA SER 11 0.411 -5.526 -14.668
79 HB2 SER 11 1HB SER 11 -1.473 -6.863 -12.704
80 HB3 SER 11 2HB SER 11 -2.000 -5.829 -14.029
81 HG SER 11 HG SER 11 -2.020 -7.971 -14.701
82 H SER 12 H SER 12 -1.203 -5.399 -11.509
83 HA SER 12 HA SER 12 -0.034 -2.792 -10.872
84 HB2 SER 12 1HB SER 12 -2.972 -3.011 -11.595
85 HB3 SER 12 2HB SER 12 -2.194 -1.592 -10.899
86 HG SER 12 HG SER 12 -0.692 -2.113 -12.876
87 H LEU 13 H LEU 13 -1.218 -1.902 -8.836
88 HA LEU 13 HA LEU 13 -1.990 -4.227 -7.092
89 HB2 LEU 13 1HB LEU 13 0.163 -3.252 -6.447
90 HB3 LEU 13 2HB LEU 13 -0.559 -1.647 -6.372
91 HG LEU 13 HG LEU 13 -2.038 -2.378 -4.543
92 HD11 LEU 13 1HD1 LEU 13 -2.495 -4.648 -4.858
93 HD12 LEU 13 2HD1 LEU 13 -1.352 -4.706 -3.520
94 HD13 LEU 13 3HD1 LEU 13 -0.806 -5.056 -5.160
95 HD21 LEU 13 3HD2 LEU 13 0.227 -1.499 -4.027
96 HD22 LEU 13 1HD2 LEU 13 0.852 -3.146 -4.042
97 HD23 LEU 13 2HD2 LEU 13 -0.320 -2.661 -2.818
98 H ASN 14 H ASN 14 -3.950 -4.110 -6.136
99 HA ASN 14 HA ASN 14 -5.606 -1.703 -6.605
100 HB2 ASN 14 1HB ASN 14 -7.445 -3.142 -5.730
101 HB3 ASN 14 2HB ASN 14 -6.617 -3.857 -7.111
102 HD21 ASN 14 2HD2 ASN 14 -6.802 -6.077 -6.626
103 HD22 ASN 14 1HD2 ASN 14 -6.205 -6.787 -5.205
104 H VAL 15 H VAL 15 -6.726 -0.645 -4.856
105 HA VAL 15 HA VAL 15 -5.256 -0.799 -2.249
106 HB VAL 15 HB VAL 15 -6.899 1.383 -3.569
107 HG11 VAL 15 1HG1 VAL 15 -7.453 1.567 -1.263
108 HG12 VAL 15 2HG1 VAL 15 -6.134 2.714 -1.505
109 HG13 VAL 15 3HG1 VAL 15 -5.816 1.149 -0.756
110 HG21 VAL 15 3HG2 VAL 15 -4.567 1.087 -4.350
111 HG22 VAL 15 1HG2 VAL 15 -4.000 1.227 -2.686
112 HG23 VAL 15 2HG2 VAL 15 -4.765 2.606 -3.476
113 H ARG 16 H ARG 16 -6.350 -1.542 -0.488
114 HA ARG 16 HA ARG 16 -9.319 -1.944 -0.736
115 HB2 ARG 16 1HB ARG 16 -7.253 -3.416 0.930
116 HB3 ARG 16 2HB ARG 16 -8.988 -3.740 0.943
117 HG2 ARG 16 1HG ARG 16 -8.912 -4.255 -1.470
118 HG3 ARG 16 2HG ARG 16 -7.178 -3.943 -1.480
119 HD2 ARG 16 1HD ARG 16 -8.527 -6.049 0.232
120 HD3 ARG 16 2HD ARG 16 -7.733 -6.379 -1.307
121 HE ARG 16 HE ARG 16 -6.395 -5.757 1.237
122 HH11 ARG 16 1HH2 ARG 16 -6.237 -5.987 -2.206
123 HH12 ARG 16 2HH2 ARG 16 -4.512 -6.138 -2.245
124 HH21 ARG 16 1HH1 ARG 16 -4.148 -5.952 1.198
125 HH22 ARG 16 2HH1 ARG 16 -3.331 -6.116 -0.320
126 H GLU 17 H GLU 17 -10.624 -1.063 0.824
127 HA GLU 17 HA GLU 17 -9.390 0.835 2.714
128 HB2 GLU 17 1HB GLU 17 -12.263 0.153 2.020
129 HB3 GLU 17 2HB GLU 17 -11.817 1.352 3.233
130 HG2 GLU 17 1HG GLU 17 -10.893 1.439 0.346
131 HG3 GLU 17 2HG GLU 17 -12.276 2.339 0.970
132 H GLY 18 H GLY 18 -10.976 -2.296 2.726
133 HA2 GLY 18 1HA GLY 18 -11.040 -2.339 5.704
134 HA3 GLY 18 2HA GLY 18 -11.816 -3.508 4.637
135 H ALA 19 H ALA 19 -9.880 -3.926 6.878
136 HA ALA 19 HA ALA 19 -7.420 -4.851 5.576
137 HB1 ALA 19 3HB ALA 19 -7.207 -4.007 7.819
138 HB2 ALA 19 1HB ALA 19 -6.944 -5.749 7.902
139 HB3 ALA 19 2HB ALA 19 -8.491 -5.066 8.403
140 H SER 20 H SER 20 -8.763 -6.284 4.064
141 HA SER 20 HA SER 20 -8.729 -9.017 5.103
142 HB2 SER 20 1HB SER 20 -11.349 -8.095 3.925
143 HB3 SER 20 2HB SER 20 -11.009 -9.553 4.852
144 HG SER 20 HG SER 20 -10.713 -8.257 6.677
145 H THR 21 H THR 21 -10.027 -10.329 3.086
146 HA THR 21 HA THR 21 -8.231 -9.850 0.834
147 HB THR 21 HB THR 21 -9.331 -11.869 -0.114
148 HG1 THR 21 HG1 THR 21 -11.271 -11.137 1.465
149 HG21 THR 21 3HG2 THR 21 -8.626 -12.165 2.817
150 HG22 THR 21 1HG2 THR 21 -7.444 -12.017 1.518
151 HG23 THR 21 2HG2 THR 21 -8.516 -13.416 1.579
152 H SER 22 H SER 22 -8.806 -8.037 -0.293
153 HA SER 22 HA SER 22 -10.039 -6.627 -1.691
154 HB2 SER 22 1HB SER 22 -10.207 -8.383 -3.252
155 HB3 SER 22 2HB SER 22 -11.273 -9.330 -2.223
156 HG SER 22 HG SER 22 -12.530 -8.378 -3.779
157 H SER 23 H SER 23 -10.730 -6.213 0.869
158 HA SER 23 HA SER 23 -13.466 -6.643 1.562
159 HB2 SER 23 1HB SER 23 -13.112 -4.784 3.162
160 HB3 SER 23 2HB SER 23 -11.776 -5.928 3.200
161 HG SER 23 HG SER 23 -11.777 -3.307 2.565
162 H LYS 24 H LYS 24 -11.842 -3.956 -0.119
163 HA LYS 24 HA LYS 24 -14.194 -3.363 -1.664
164 HB2 LYS 24 1HB LYS 24 -14.754 -2.420 0.667
165 HB3 LYS 24 2HB LYS 24 -13.502 -1.219 0.349
166 HG2 LYS 24 1HG LYS 24 -14.669 -0.427 -1.619
167 HG3 LYS 24 2HG LYS 24 -15.841 -1.738 -1.508
168 HD2 LYS 24 1HD LYS 24 -16.869 0.259 -0.605
169 HD3 LYS 24 2HD LYS 24 -16.543 -0.844 0.732
170 HE2 LYS 24 1HE LYS 24 -14.686 0.424 1.474
171 HE3 LYS 24 2HE LYS 24 -14.570 1.305 -0.050
172 HZ1 LYS 24 3HZ LYS 24 -16.456 2.546 0.439
173 HZ2 LYS 24 1HZ LYS 24 -15.641 2.477 1.925
174 HZ3 LYS 24 2HZ LYS 24 -16.982 1.472 1.645
175 H VAL 25 H VAL 25 -13.225 -2.822 -3.540
176 HA VAL 25 HA VAL 25 -10.575 -1.505 -3.508
177 HB VAL 25 HB VAL 25 -12.291 -2.607 -5.752
178 HG11 VAL 25 1HG1 VAL 25 -9.606 -1.216 -5.756
179 HG12 VAL 25 2HG1 VAL 25 -11.020 -0.866 -6.750
180 HG13 VAL 25 3HG1 VAL 25 -10.078 -2.326 -7.043
181 HG21 VAL 25 3HG2 VAL 25 -10.477 -4.310 -5.846
182 HG22 VAL 25 1HG2 VAL 25 -11.318 -4.316 -4.295
183 HG23 VAL 25 2HG2 VAL 25 -9.730 -3.562 -4.434
184 H ILE 26 H ILE 26 -10.305 0.629 -3.881
185 HA ILE 26 HA ILE 26 -12.630 2.220 -4.927
186 HB ILE 26 HB ILE 26 -11.721 4.104 -3.599
187 HG12 ILE 26 1HG1 ILE 26 -9.810 2.037 -2.458
188 HG13 ILE 26 2HG1 ILE 26 -9.336 3.288 -3.605
189 HG21 ILE 26 1HG2 ILE 26 -12.142 1.573 -1.977
190 HG22 ILE 26 2HG2 ILE 26 -13.429 2.588 -2.629
191 HG23 ILE 26 3HG2 ILE 26 -12.347 3.222 -1.388
192 HD11 ILE 26 3HD1 ILE 26 -10.574 3.804 -0.887
193 HD12 ILE 26 1HD1 ILE 26 -10.038 5.033 -2.034
194 HD13 ILE 26 2HD1 ILE 26 -8.861 3.964 -1.271
195 H GLY 27 H GLY 27 -9.435 1.177 -5.494
196 HA2 GLY 27 1HA GLY 27 -9.236 2.454 -8.009
197 HA3 GLY 27 2HA GLY 27 -8.371 3.459 -6.848
198 H SER 28 H SER 28 -6.446 2.868 -8.190
199 HA SER 28 HA SER 28 -5.098 0.528 -7.022
200 HB2 SER 28 1HB SER 28 -6.195 -0.500 -8.949
201 HB3 SER 28 2HB SER 28 -5.578 0.765 -10.009
202 HG SER 28 HG SER 28 -4.416 -1.471 -9.497
203 H LEU 29 H LEU 29 -2.763 0.452 -7.825
204 HA LEU 29 HA LEU 29 -1.774 3.192 -8.554
205 HB2 LEU 29 1HB LEU 29 -0.587 1.260 -6.539
206 HB3 LEU 29 2HB LEU 29 0.128 2.797 -7.025
207 HG LEU 29 HG LEU 29 -2.600 2.483 -5.737
208 HD11 LEU 29 1HD1 LEU 29 -0.607 1.952 -4.276
209 HD12 LEU 29 2HD1 LEU 29 -1.583 3.309 -3.715
210 HD13 LEU 29 3HD1 LEU 29 -0.053 3.606 -4.541
211 HD21 LEU 29 3HD2 LEU 29 -1.019 4.833 -6.779
212 HD22 LEU 29 1HD2 LEU 29 -2.093 5.060 -5.396
213 HD23 LEU 29 2HD2 LEU 29 -2.744 4.496 -6.930
214 H SER 30 H SER 30 0.185 3.225 -9.753
215 HA SER 30 HA SER 30 0.459 1.044 -11.622
216 HB2 SER 30 1HB SER 30 2.391 3.327 -11.181
217 HB3 SER 30 2HB SER 30 2.167 2.380 -12.650
218 HG SER 30 HG SER 30 -0.167 3.204 -12.275
219 H GLY 31 H GLY 31 2.312 -0.306 -11.927
220 HA2 GLY 31 1HA GLY 31 3.353 -1.487 -9.564
221 HA3 GLY 31 2HA GLY 31 3.963 -1.785 -11.188
222 H ASN 32 H ASN 32 5.619 -1.654 -8.923
223 HA ASN 32 HA ASN 32 7.647 -0.735 -8.237
224 HB2 ASN 32 1HB ASN 32 7.940 -0.693 -10.794
225 HB3 ASN 32 2HB ASN 32 7.540 1.022 -10.693
226 HD21 ASN 32 2HD2 ASN 32 9.679 1.810 -11.190
227 HD22 ASN 32 1HD2 ASN 32 10.998 1.572 -10.148
228 H THR 33 H THR 33 4.827 0.877 -8.229
229 HA THR 33 HA THR 33 5.830 3.564 -7.605
230 HB THR 33 HB THR 33 3.059 2.386 -7.228
231 HG1 THR 33 HG1 THR 33 3.105 4.034 -9.222
232 HG21 THR 33 3HG2 THR 33 4.076 5.240 -7.320
233 HG22 THR 33 1HG2 THR 33 3.437 4.410 -5.902
234 HG23 THR 33 2HG2 THR 33 2.376 4.773 -7.262
235 H LYS 34 H LYS 34 6.378 4.284 -5.600
236 HA LYS 34 HA LYS 34 6.245 2.400 -3.333
237 HB2 LYS 34 1HB LYS 34 7.594 4.110 -2.163
238 HB3 LYS 34 2HB LYS 34 8.305 3.694 -3.721
239 HG2 LYS 34 1HG LYS 34 7.176 5.687 -4.722
240 HG3 LYS 34 2HG LYS 34 6.607 6.131 -3.111
241 HD2 LYS 34 1HD LYS 34 8.919 6.291 -2.311
242 HD3 LYS 34 2HD LYS 34 9.518 5.783 -3.889
243 HE2 LYS 34 1HE LYS 34 9.660 8.220 -3.687
244 HE3 LYS 34 2HE LYS 34 8.468 7.789 -4.911
245 HZ1 LYS 34 3HZ LYS 34 6.711 8.228 -3.429
246 HZ2 LYS 34 1HZ LYS 34 7.776 9.539 -3.273
247 HZ3 LYS 34 2HZ LYS 34 7.749 8.322 -2.087
248 H VAL 35 H VAL 35 5.094 2.820 -1.392
249 HA VAL 35 HA VAL 35 3.071 5.040 -1.528
250 HB VAL 35 HB VAL 35 1.562 3.489 -0.244
251 HG11 VAL 35 1HG1 VAL 35 0.897 2.222 -2.225
252 HG12 VAL 35 2HG1 VAL 35 2.495 2.457 -2.939
253 HG13 VAL 35 3HG1 VAL 35 1.418 3.835 -2.713
254 HG21 VAL 35 3HG2 VAL 35 3.742 1.502 -0.968
255 HG22 VAL 35 1HG2 VAL 35 2.132 1.045 -0.413
256 HG23 VAL 35 2HG2 VAL 35 3.211 1.941 0.655
257 H THR 36 H THR 36 3.005 6.338 0.212
258 HA THR 36 HA THR 36 5.021 6.127 2.256
259 HB THR 36 HB THR 36 2.540 7.865 2.227
260 HG1 THR 36 HG1 THR 36 4.678 7.800 0.623
261 HG21 THR 36 3HG2 THR 36 5.231 8.172 3.589
262 HG22 THR 36 1HG2 THR 36 3.711 7.775 4.391
263 HG23 THR 36 2HG2 THR 36 3.921 9.352 3.629
264 H ILE 37 H ILE 37 4.920 5.142 4.196
265 HA ILE 37 HA ILE 37 2.302 3.984 5.086
266 HB ILE 37 HB ILE 37 5.168 3.164 5.643
267 HG12 ILE 37 1HG1 ILE 37 2.939 1.626 4.293
268 HG13 ILE 37 2HG1 ILE 37 4.086 2.621 3.396
269 HG21 ILE 37 1HG2 ILE 37 3.977 2.709 7.652
270 HG22 ILE 37 2HG2 ILE 37 3.979 1.185 6.766
271 HG23 ILE 37 3HG2 ILE 37 2.536 2.199 6.775
272 HD11 ILE 37 3HD1 ILE 37 4.657 0.127 3.631
273 HD12 ILE 37 1HD1 ILE 37 4.999 0.481 5.323
274 HD13 ILE 37 2HD1 ILE 37 5.929 1.274 4.052
275 H VAL 38 H VAL 38 1.444 4.755 6.927
276 HA VAL 38 HA VAL 38 3.183 6.349 8.789
277 HB VAL 38 HB VAL 38 1.108 7.642 9.318
278 HG11 VAL 38 1HG1 VAL 38 2.797 8.384 7.604
279 HG12 VAL 38 2HG1 VAL 38 1.170 8.999 7.306
280 HG13 VAL 38 3HG1 VAL 38 1.787 7.643 6.363
281 HG21 VAL 38 3HG2 VAL 38 -0.014 6.164 6.915
282 HG22 VAL 38 1HG2 VAL 38 -0.830 7.430 7.831
283 HG23 VAL 38 2HG2 VAL 38 -0.496 5.872 8.585
284 H GLY 39 H GLY 39 1.737 3.442 8.484
285 HA2 GLY 39 1HA GLY 39 1.735 2.959 11.318
286 HA3 GLY 39 2HA GLY 39 0.082 3.098 10.725
287 H GLU 40 H GLU 40 0.549 0.726 11.732
288 HA GLU 40 HA GLU 40 1.029 -1.088 9.387
289 HB2 GLU 40 1HB GLU 40 1.803 -1.459 12.297
290 HB3 GLU 40 2HB GLU 40 1.834 -2.757 11.102
291 HG2 GLU 40 1HG GLU 40 3.429 -1.513 9.737
292 HG3 GLU 40 2HG GLU 40 3.347 -0.143 10.844
293 H GLU 41 H GLU 41 -0.325 -3.001 9.377
294 HA GLU 41 HA GLU 41 -2.463 -3.168 11.409
295 HB2 GLU 41 1HB GLU 41 -3.145 -1.526 9.522
296 HB3 GLU 41 2HB GLU 41 -3.260 -2.957 8.499
297 HG2 GLU 41 1HG GLU 41 -4.715 -2.642 11.145
298 HG3 GLU 41 2HG GLU 41 -5.439 -2.317 9.570
299 H GLY 42 H GLY 42 -1.689 -5.237 11.888
300 HA2 GLY 42 1HA GLY 42 -1.407 -7.548 11.642
301 HA3 GLY 42 2HA GLY 42 -2.796 -7.433 10.566
302 H ALA 43 H ALA 43 -2.265 -8.636 8.820
303 HA ALA 43 HA ALA 43 0.477 -8.652 7.757
304 HB1 ALA 43 3HB ALA 43 -2.067 -10.015 6.810
305 HB2 ALA 43 1HB ALA 43 -0.815 -10.742 7.814
306 HB3 ALA 43 2HB ALA 43 -0.457 -10.298 6.145
307 H PHE 44 H PHE 44 -1.287 -6.206 7.708
308 HA PHE 44 HA PHE 44 -0.959 -5.606 4.803
309 HB2 PHE 44 1HB PHE 44 -3.393 -4.895 6.476
310 HB3 PHE 44 2HB PHE 44 -3.106 -4.388 4.812
311 HD1 PHE 44 HD2 PHE 44 -3.877 -7.245 7.013
312 HD2 PHE 44 HD1 PHE 44 -3.318 -5.946 2.957
313 HE1 PHE 44 HE2 PHE 44 -4.873 -9.363 6.197
314 HE2 PHE 44 HE1 PHE 44 -4.313 -8.066 2.141
315 HZ PHE 44 HZ PHE 44 -5.092 -9.774 3.761
316 H TYR 45 H TYR 45 -0.000 -3.638 4.479
317 HA TYR 45 HA TYR 45 0.730 -2.087 6.887
318 HB2 TYR 45 1HB TYR 45 1.598 -2.020 3.992
319 HB3 TYR 45 2HB TYR 45 2.049 -0.740 5.119
320 HD1 TYR 45 HD1 TYR 45 2.992 -1.566 7.438
321 HD2 TYR 45 HD2 TYR 45 3.003 -3.907 3.837
322 HE1 TYR 45 HE1 TYR 45 4.814 -2.970 8.359
323 HE2 TYR 45 HE2 TYR 45 4.827 -5.312 4.758
324 HH TYR 45 HH TYR 45 6.678 -4.434 7.376
325 H LYS 46 H LYS 46 0.136 0.052 7.237
326 HA LYS 46 HA LYS 46 -2.317 0.922 5.827
327 HB2 LYS 46 1HB LYS 46 -2.196 0.973 8.310
328 HB3 LYS 46 2HB LYS 46 -0.861 2.121 8.206
329 HG2 LYS 46 1HG LYS 46 -2.293 3.742 7.076
330 HG3 LYS 46 2HG LYS 46 -3.628 2.588 7.057
331 HD2 LYS 46 1HD LYS 46 -3.620 2.545 9.528
332 HD3 LYS 46 2HD LYS 46 -2.299 3.715 9.540
333 HE2 LYS 46 1HE LYS 46 -3.721 5.352 8.382
334 HE3 LYS 46 2HE LYS 46 -5.039 4.182 8.328
335 HZ1 LYS 46 3HZ LYS 46 -3.803 4.857 10.908
336 HZ2 LYS 46 1HZ LYS 46 -5.377 4.320 10.579
337 HZ3 LYS 46 2HZ LYS 46 -4.937 5.922 10.224
338 H ILE 47 H ILE 47 -2.274 2.492 4.284
339 HA ILE 47 HA ILE 47 0.151 4.246 4.091
340 HB ILE 47 HB ILE 47 -0.078 4.099 1.620
341 HG12 ILE 47 1HG1 ILE 47 -2.016 1.839 2.213
342 HG13 ILE 47 2HG1 ILE 47 -2.517 3.437 1.661
343 HG21 ILE 47 1HG2 ILE 47 1.540 2.676 2.738
344 HG22 ILE 47 2HG2 ILE 47 0.777 1.750 1.447
345 HG23 ILE 47 3HG2 ILE 47 0.290 1.493 3.122
346 HD11 ILE 47 3HD1 ILE 47 -1.232 3.183 -0.392
347 HD12 ILE 47 1HD1 ILE 47 -2.305 1.796 -0.208
348 HD13 ILE 47 2HD1 ILE 47 -0.590 1.637 0.166
349 H GLU 48 H GLU 48 -0.229 6.323 3.174
350 HA GLU 48 HA GLU 48 -2.950 7.328 3.751
351 HB2 GLU 48 1HB GLU 48 -1.737 9.562 3.084
352 HB3 GLU 48 2HB GLU 48 -1.324 8.782 4.611
353 HG2 GLU 48 1HG GLU 48 0.654 7.792 3.666
354 HG3 GLU 48 2HG GLU 48 0.194 8.292 2.037
355 H TYR 49 H TYR 49 -4.209 6.552 2.010
356 HA TYR 49 HA TYR 49 -3.328 7.153 -0.757
357 HB2 TYR 49 1HB TYR 49 -4.291 4.953 -0.361
358 HB3 TYR 49 2HB TYR 49 -5.750 5.677 0.316
359 HD1 TYR 49 HD1 TYR 49 -3.682 5.480 -2.785
360 HD2 TYR 49 HD2 TYR 49 -7.521 6.384 -1.084
361 HE1 TYR 49 HE1 TYR 49 -4.645 5.680 -5.062
362 HE2 TYR 49 HE2 TYR 49 -8.484 6.582 -3.360
363 HH TYR 49 HH TYR 49 -8.117 6.302 -5.538
364 H LYS 50 H LYS 50 -4.630 8.423 -2.194
365 HA LYS 50 HA LYS 50 -5.589 10.853 -1.153
366 HB2 LYS 50 1HB LYS 50 -4.957 10.163 -3.591
367 HB3 LYS 50 2HB LYS 50 -6.653 9.708 -3.739
368 HG2 LYS 50 1HG LYS 50 -7.353 11.969 -3.149
369 HG3 LYS 50 2HG LYS 50 -5.682 12.445 -2.849
370 HD2 LYS 50 1HD LYS 50 -5.117 12.043 -5.199
371 HD3 LYS 50 2HD LYS 50 -6.765 11.499 -5.518
372 HE2 LYS 50 1HE LYS 50 -6.743 13.768 -6.215
373 HE3 LYS 50 2HE LYS 50 -7.510 13.800 -4.627
374 HZ1 LYS 50 3HZ LYS 50 -5.940 15.469 -4.491
375 HZ2 LYS 50 1HZ LYS 50 -4.775 14.608 -5.375
376 HZ3 LYS 50 2HZ LYS 50 -5.131 14.157 -3.777
377 H GLY 51 H GLY 51 -7.354 11.259 0.035
378 HA2 GLY 51 1HA GLY 51 -9.781 11.359 0.237
379 HA3 GLY 51 2HA GLY 51 -9.888 9.771 -0.524
380 H SER 52 H SER 52 -7.991 8.337 0.959
381 HA SER 52 HA SER 52 -8.423 8.756 3.806
382 HB2 SER 52 1HB SER 52 -9.742 6.745 4.222
383 HB3 SER 52 2HB SER 52 -10.614 7.799 3.113
384 HG SER 52 HG SER 52 -9.761 6.518 1.400
385 H HIS 53 H HIS 53 -7.658 6.585 4.988
386 HA HIS 53 HA HIS 53 -5.008 6.012 3.878
387 HB2 HIS 53 1HB HIS 53 -6.428 5.076 6.390
388 HB3 HIS 53 2HB HIS 53 -4.764 4.655 5.982
389 HD1 HIS 53 HD1 HIS 53 -6.898 7.496 7.145
390 HD2 HIS 53 HD2 HIS 53 -2.919 6.856 6.077
391 HE1 HIS 53 HE1 HIS 53 -5.615 9.545 7.899
392 H GLY 54 H GLY 54 -4.676 4.391 2.448
393 HA2 GLY 54 1HA GLY 54 -6.720 2.284 2.105
394 HA3 GLY 54 2HA GLY 54 -5.342 2.577 1.045
395 H TYR 55 H TYR 55 -5.949 -0.005 1.839
396 HA TYR 55 HA TYR 55 -3.704 -0.667 3.723
397 HB2 TYR 55 1HB TYR 55 -6.368 -2.067 3.339
398 HB3 TYR 55 2HB TYR 55 -5.035 -2.702 4.306
399 HD1 TYR 55 HD2 TYR 55 -4.239 -1.459 6.315
400 HD2 TYR 55 HD1 TYR 55 -7.749 -0.273 4.143
401 HE1 TYR 55 HE2 TYR 55 -4.952 -0.060 8.233
402 HE2 TYR 55 HE1 TYR 55 -8.462 1.129 6.061
403 HH TYR 55 HH TYR 55 -7.667 0.853 8.931
404 H VAL 56 H VAL 56 -2.249 -2.178 2.979
405 HA VAL 56 HA VAL 56 -2.895 -3.676 0.473
406 HB VAL 56 HB VAL 56 -0.558 -3.164 -0.326
407 HG11 VAL 56 1HG1 VAL 56 -1.161 -0.983 -1.224
408 HG12 VAL 56 2HG1 VAL 56 -2.344 -0.743 0.063
409 HG13 VAL 56 3HG1 VAL 56 -2.606 -1.991 -1.155
410 HG21 VAL 56 3HG2 VAL 56 0.433 -1.047 0.668
411 HG22 VAL 56 1HG2 VAL 56 0.500 -2.457 1.720
412 HG23 VAL 56 2HG2 VAL 56 -0.714 -1.210 1.991
413 H ALA 57 H ALA 57 -2.032 -5.722 0.417
414 HA ALA 57 HA ALA 57 -1.180 -6.900 2.893
415 HB1 ALA 57 3HB ALA 57 -1.261 -8.939 1.760
416 HB2 ALA 57 1HB ALA 57 -0.747 -8.228 0.230
417 HB3 ALA 57 2HB ALA 57 -2.385 -7.958 0.822
418 H LYS 58 H LYS 58 0.856 -7.815 3.435
419 HA LYS 58 HA LYS 58 3.160 -6.265 2.757
420 HB2 LYS 58 1HB LYS 58 3.107 -9.088 3.865
421 HB3 LYS 58 2HB LYS 58 4.413 -7.913 4.031
422 HG2 LYS 58 1HG LYS 58 2.690 -6.402 5.192
423 HG3 LYS 58 2HG LYS 58 1.662 -7.826 5.275
424 HD2 LYS 58 1HD LYS 58 4.486 -7.723 6.364
425 HD3 LYS 58 2HD LYS 58 3.042 -7.475 7.342
426 HE2 LYS 58 1HE LYS 58 2.240 -9.749 6.485
427 HE3 LYS 58 2HE LYS 58 3.878 -9.983 5.874
428 HZ1 LYS 58 3HZ LYS 58 4.173 -10.830 7.928
429 HZ2 LYS 58 1HZ LYS 58 2.910 -9.933 8.617
430 HZ3 LYS 58 2HZ LYS 58 4.417 -9.199 8.339
431 H GLU 59 H GLU 59 1.756 -9.165 1.377
432 HA GLU 59 HA GLU 59 3.980 -10.181 -0.048
433 HB2 GLU 59 1HB GLU 59 1.041 -10.168 -0.805
434 HB3 GLU 59 2HB GLU 59 2.272 -11.176 -1.566
435 HG2 GLU 59 1HG GLU 59 1.627 -11.217 1.397
436 HG3 GLU 59 2HG GLU 59 1.000 -12.375 0.223
437 H TYR 60 H TYR 60 1.773 -7.523 -0.851
438 HA TYR 60 HA TYR 60 3.015 -7.214 -3.517
439 HB2 TYR 60 1HB TYR 60 0.946 -5.497 -2.109
440 HB3 TYR 60 2HB TYR 60 1.385 -5.419 -3.815
441 HD1 TYR 60 HD2 TYR 60 1.330 -7.817 -5.042
442 HD2 TYR 60 HD1 TYR 60 -0.961 -6.749 -1.570
443 HE1 TYR 60 HE2 TYR 60 -0.288 -9.623 -5.554
444 HE2 TYR 60 HE1 TYR 60 -2.577 -8.558 -2.079
445 HH TYR 60 HH TYR 60 -2.052 -10.770 -4.817
446 H ILE 61 H ILE 61 3.837 -6.364 -0.411
447 HA ILE 61 HA ILE 61 5.178 -3.818 -1.275
448 HB ILE 61 HB ILE 61 4.524 -4.783 1.527
449 HG12 ILE 61 1HG1 ILE 61 2.473 -4.202 0.350
450 HG13 ILE 61 2HG1 ILE 61 2.860 -2.910 1.483
451 HG21 ILE 61 1HG2 ILE 61 5.810 -2.294 0.410
452 HG22 ILE 61 2HG2 ILE 61 6.428 -3.376 1.657
453 HG23 ILE 61 3HG2 ILE 61 5.064 -2.314 2.008
454 HD11 ILE 61 3HD1 ILE 61 3.037 -2.915 -1.518
455 HD12 ILE 61 1HD1 ILE 61 4.099 -1.849 -0.600
456 HD13 ILE 61 2HD1 ILE 61 2.353 -1.698 -0.446
457 H LYS 62 H LYS 62 7.338 -3.809 -1.375
458 HA LYS 62 HA LYS 62 8.877 -5.883 0.130
459 HB2 LYS 62 1HB LYS 62 8.599 -6.695 -2.179
460 HB3 LYS 62 2HB LYS 62 9.256 -5.179 -2.799
461 HG2 LYS 62 1HG LYS 62 11.393 -5.609 -1.702
462 HG3 LYS 62 2HG LYS 62 10.744 -7.067 -0.948
463 HD2 LYS 62 1HD LYS 62 10.374 -8.047 -3.190
464 HD3 LYS 62 2HD LYS 62 11.060 -6.599 -3.927
465 HE2 LYS 62 1HE LYS 62 12.513 -8.436 -2.000
466 HE3 LYS 62 2HE LYS 62 12.746 -8.405 -3.748
467 HZ1 LYS 62 3HZ LYS 62 13.206 -5.920 -3.369
468 HZ2 LYS 62 1HZ LYS 62 14.418 -7.037 -2.971
469 HZ3 LYS 62 2HZ LYS 62 13.455 -6.359 -1.747
470 H ASP 63 H ASP 63 10.828 -5.178 0.894
471 HA ASP 63 HA ASP 63 12.478 -3.683 1.563
472 HB2 ASP 63 1HB ASP 63 12.862 -3.644 -0.955
473 HB3 ASP 63 2HB ASP 63 11.904 -2.163 -0.994
474 H ILE 64 H ILE 64 10.901 -3.055 3.252
475 HA ILE 64 HA ILE 64 9.353 -0.601 2.841
476 HB ILE 64 HB ILE 64 9.955 -2.161 5.376
477 HG12 ILE 64 1HG1 ILE 64 7.434 -2.158 3.692
478 HG13 ILE 64 2HG1 ILE 64 8.705 -3.367 3.510
479 HG21 ILE 64 1HG2 ILE 64 7.779 -0.950 6.080
480 HG22 ILE 64 2HG2 ILE 64 8.095 0.133 4.725
481 HG23 ILE 64 3HG2 ILE 64 9.257 0.009 6.045
482 HD11 ILE 64 3HD1 ILE 64 8.469 -3.911 5.942
483 HD12 ILE 64 1HD1 ILE 64 7.006 -4.242 5.016
484 HD13 ILE 64 2HD1 ILE 64 7.104 -2.796 6.021
485 H LYS 65 H LYS 65 11.304 0.700 2.191
486 HA LYS 65 HA LYS 65 12.536 1.926 4.607
487 HB2 LYS 65 1HB LYS 65 14.078 0.858 2.227
488 HB3 LYS 65 2HB LYS 65 14.753 1.989 3.400
489 HG2 LYS 65 1HG LYS 65 14.277 0.378 5.216
490 HG3 LYS 65 2HG LYS 65 13.640 -0.761 4.028
491 HD2 LYS 65 1HD LYS 65 15.814 -0.857 2.909
492 HD3 LYS 65 2HD LYS 65 16.462 0.344 4.027
493 HE2 LYS 65 1HE LYS 65 17.130 -1.892 4.756
494 HE3 LYS 65 2HE LYS 65 15.995 -1.204 5.918
495 HZ1 LYS 65 3HZ LYS 65 14.541 -2.524 3.922
496 HZ2 LYS 65 1HZ LYS 65 14.649 -2.906 5.572
497 HZ3 LYS 65 2HZ LYS 65 15.754 -3.580 4.470
498 H ASP 66 H ASP 66 13.377 4.079 4.180
499 HA ASP 66 HA ASP 66 11.778 5.465 2.129
500 HB2 ASP 66 1HB ASP 66 12.085 6.313 4.491
501 HB3 ASP 66 2HB ASP 66 13.775 6.623 4.092
502 H GLU 67 H GLU 67 12.636 5.411 0.090
503 HA GLU 67 HA GLU 67 15.570 5.406 -0.295
504 HB2 GLU 67 1HB GLU 67 14.014 3.936 -1.630
505 HB3 GLU 67 2HB GLU 67 13.368 5.395 -2.382
506 HG2 GLU 67 1HG GLU 67 15.062 4.545 -3.858
507 HG3 GLU 67 2HG GLU 67 15.750 5.963 -3.065
508 H VAL 68 H VAL 68 13.095 7.172 -2.168
509 HA VAL 68 HA VAL 68 13.955 9.785 -1.334
510 HB VAL 68 HB VAL 68 15.993 9.089 -2.601
511 HG11 VAL 68 1HG1 VAL 68 14.609 7.657 -4.223
512 HG12 VAL 68 2HG1 VAL 68 15.907 8.618 -4.930
513 HG13 VAL 68 3HG1 VAL 68 14.235 9.165 -5.058
514 HG21 VAL 68 3HG2 VAL 68 15.119 11.475 -2.476
515 HG22 VAL 68 1HG2 VAL 68 14.428 11.220 -4.077
516 HG23 VAL 68 2HG2 VAL 68 16.174 11.136 -3.847
517 H LEU 69 H LEU 69 12.755 11.454 -2.415
518 HA LEU 69 HA LEU 69 10.165 10.638 -3.336
519 HB2 LEU 69 1HB LEU 69 11.509 13.343 -3.609
520 HB3 LEU 69 2HB LEU 69 9.776 13.025 -3.702
521 HG LEU 69 HG LEU 69 11.522 12.480 -1.281
522 HD11 LEU 69 1HD1 LEU 69 10.328 14.378 -0.268
523 HD12 LEU 69 2HD1 LEU 69 9.446 14.639 -1.774
524 HD13 LEU 69 3HD1 LEU 69 11.190 14.891 -1.718
525 HD21 LEU 69 3HD2 LEU 69 9.105 12.341 -0.248
526 HD22 LEU 69 1HD2 LEU 69 9.750 10.945 -1.107
527 HD23 LEU 69 2HD2 LEU 69 8.604 12.020 -1.908
528 H GLU 70 H GLU 70 9.265 10.647 -5.387
529 HA GLU 70 HA GLU 70 10.843 9.837 -7.567
530 HB2 GLU 70 1HB GLU 70 8.389 9.498 -7.379
531 HB3 GLU 70 2HB GLU 70 8.148 11.220 -7.679
532 HG2 GLU 70 1HG GLU 70 9.205 11.024 -9.872
533 HG3 GLU 70 2HG GLU 70 9.560 9.321 -9.574
534 H HIS 71 H HIS 71 11.903 10.898 -9.182
535 HA HIS 71 HA HIS 71 12.400 13.755 -8.843
536 HB2 HIS 71 1HB HIS 71 14.215 12.221 -9.479
537 HB3 HIS 71 2HB HIS 71 13.350 11.805 -10.960
538 HD1 HIS 71 HD1 HIS 71 14.041 15.198 -9.355
539 HD2 HIS 71 HD2 HIS 71 14.648 13.192 -12.956
540 HE1 HIS 71 HE1 HIS 71 15.094 16.872 -10.936
541 H HIS 72 H HIS 72 12.269 15.231 -10.759
542 HA HIS 72 HA HIS 72 9.608 15.322 -11.817
543 HB2 HIS 72 1HB HIS 72 12.154 16.800 -12.524
544 HB3 HIS 72 2HB HIS 72 10.594 17.165 -13.264
545 HD1 HIS 72 HD1 HIS 72 12.371 17.224 -9.929
546 HD2 HIS 72 HD2 HIS 72 8.811 18.592 -11.614
547 HE1 HIS 72 HE1 HIS 72 11.311 18.760 -8.216
548 H HIS 73 H HIS 73 12.733 14.316 -13.220
549 HA HIS 73 HA HIS 73 11.300 13.459 -15.706
550 HB2 HIS 73 1HB HIS 73 14.245 13.916 -15.138
551 HB3 HIS 73 2HB HIS 73 13.603 13.312 -16.666
552 HD1 HIS 73 HD1 HIS 73 13.559 16.385 -14.458
553 HD2 HIS 73 HD2 HIS 73 12.422 15.271 -18.312
554 HE1 HIS 73 HE1 HIS 73 12.941 18.522 -15.669
555 H HIS 74 H HIS 74 11.214 11.338 -16.258
556 HA HIS 74 HA HIS 74 11.332 9.273 -14.409
557 HB2 HIS 74 1HB HIS 74 11.797 9.170 -17.398
558 HB3 HIS 74 2HB HIS 74 11.487 7.752 -16.394
559 HD1 HIS 74 HD1 HIS 74 9.400 8.185 -18.454
560 HD2 HIS 74 HD2 HIS 74 9.227 10.163 -14.787
561 HE1 HIS 74 HE1 HIS 74 6.985 8.868 -18.116
562 H HIS 75 H HIS 75 12.802 7.285 -14.592
563 HA HIS 75 HA HIS 75 15.426 7.931 -13.727
564 HB2 HIS 75 1HB HIS 75 15.870 5.503 -13.972
565 HB3 HIS 75 2HB HIS 75 14.320 5.801 -13.186
566 HD1 HIS 75 HD1 HIS 75 12.164 5.692 -14.847
567 HD2 HIS 75 HD2 HIS 75 15.678 3.968 -16.284
568 HE1 HIS 75 HE1 HIS 75 11.490 4.196 -16.776
569 H HIS 76 H HIS 76 14.224 6.909 -16.922
570 HA HIS 76 HA HIS 76 16.525 8.195 -18.197
571 HB2 HIS 76 1HB HIS 76 17.370 5.909 -17.539
572 HB3 HIS 76 2HB HIS 76 16.131 5.213 -18.583
573 HD1 HIS 76 HD1 HIS 76 16.464 5.389 -21.125
574 HD2 HIS 76 HD2 HIS 76 19.465 7.293 -18.946
575 HE1 HIS 76 HE1 HIS 76 18.293 5.968 -22.778
Start of MODEL 17
1 H1 ALA 1 1H ALA 1 11.509 8.288 10.607
2 H2 ALA 1 2H ALA 1 11.536 7.196 11.908
3 H3 ALA 1 3H ALA 1 11.374 8.862 12.196
4 HA ALA 1 HA ALA 1 9.338 7.094 12.050
5 HB1 ALA 1 3HB ALA 1 9.512 9.505 12.953
6 HB2 ALA 1 1HB ALA 1 7.959 9.006 12.282
7 HB3 ALA 1 2HB ALA 1 9.049 10.013 11.329
8 H GLU 2 H GLU 2 7.423 7.180 10.607
9 HA GLU 2 HA GLU 2 6.435 6.741 8.548
10 HB2 GLU 2 1HB GLU 2 6.874 9.168 8.222
11 HB3 GLU 2 2HB GLU 2 8.436 8.763 7.508
12 HG2 GLU 2 1HG GLU 2 7.303 7.441 5.757
13 HG3 GLU 2 2HG GLU 2 5.739 7.832 6.473
14 H LYS 3 H LYS 3 6.695 5.414 6.756
15 HA LYS 3 HA LYS 3 9.464 4.477 6.129
16 HB2 LYS 3 1HB LYS 3 7.103 2.721 6.860
17 HB3 LYS 3 2HB LYS 3 8.590 2.124 6.121
18 HG2 LYS 3 1HG LYS 3 9.895 3.019 8.011
19 HG3 LYS 3 2HG LYS 3 8.412 3.615 8.756
20 HD2 LYS 3 1HD LYS 3 7.547 1.277 8.824
21 HD3 LYS 3 2HD LYS 3 9.091 0.716 8.178
22 HE2 LYS 3 1HE LYS 3 8.723 2.240 10.775
23 HE3 LYS 3 2HE LYS 3 9.036 0.510 10.639
24 HZ1 LYS 3 3HZ LYS 3 10.821 2.764 9.975
25 HZ2 LYS 3 1HZ LYS 3 11.072 1.226 9.305
26 HZ3 LYS 3 2HZ LYS 3 11.118 1.436 10.991
27 H THR 4 H THR 4 9.688 3.590 4.046
28 HA THR 4 HA THR 4 7.412 4.184 2.172
29 HB THR 4 HB THR 4 9.120 4.644 0.464
30 HG1 THR 4 HG1 THR 4 10.841 3.460 1.109
31 HG21 THR 4 3HG2 THR 4 9.717 6.226 2.971
32 HG22 THR 4 1HG2 THR 4 8.247 6.436 2.020
33 HG23 THR 4 2HG2 THR 4 9.819 6.781 1.299
34 H GLY 5 H GLY 5 6.529 2.386 1.515
35 HA2 GLY 5 1HA GLY 5 8.162 -0.090 1.154
36 HA3 GLY 5 2HA GLY 5 6.409 -0.039 1.342
37 H ILE 6 H ILE 6 8.556 -0.821 -0.840
38 HA ILE 6 HA ILE 6 7.520 0.664 -3.171
39 HB ILE 6 HB ILE 6 9.431 -1.691 -3.145
40 HG12 ILE 6 1HG1 ILE 6 10.377 -0.010 -1.678
41 HG13 ILE 6 2HG1 ILE 6 11.215 0.101 -3.224
42 HG21 ILE 6 1HG2 ILE 6 8.985 0.587 -5.099
43 HG22 ILE 6 2HG2 ILE 6 8.448 -1.076 -5.328
44 HG23 ILE 6 3HG2 ILE 6 10.171 -0.705 -5.283
45 HD11 ILE 6 3HD1 ILE 6 9.135 1.953 -2.073
46 HD12 ILE 6 1HD1 ILE 6 9.418 1.899 -3.812
47 HD13 ILE 6 2HD1 ILE 6 10.726 2.348 -2.721
48 H VAL 7 H VAL 7 5.880 -0.010 -4.385
49 HA VAL 7 HA VAL 7 4.397 -2.415 -3.743
50 HB VAL 7 HB VAL 7 4.156 -0.475 -6.070
51 HG11 VAL 7 1HG1 VAL 7 1.813 -1.505 -6.185
52 HG12 VAL 7 2HG1 VAL 7 2.449 -2.807 -5.179
53 HG13 VAL 7 3HG1 VAL 7 3.135 -2.511 -6.775
54 HG21 VAL 7 3HG2 VAL 7 2.365 -0.776 -3.649
55 HG22 VAL 7 1HG2 VAL 7 2.413 0.556 -4.805
56 HG23 VAL 7 2HG2 VAL 7 3.742 0.327 -3.666
57 H ASN 8 H ASN 8 4.600 -4.387 -4.592
58 HA ASN 8 HA ASN 8 6.277 -4.752 -7.060
59 HB2 ASN 8 1HB ASN 8 7.236 -5.500 -4.749
60 HB3 ASN 8 2HB ASN 8 6.075 -6.820 -4.865
61 HD21 ASN 8 2HD2 ASN 8 7.651 -8.495 -5.251
62 HD22 ASN 8 1HD2 ASN 8 8.582 -8.561 -6.670
63 H VAL 9 H VAL 9 4.692 -5.076 -8.558
64 HA VAL 9 HA VAL 9 3.087 -7.544 -8.293
65 HB VAL 9 HB VAL 9 1.014 -6.384 -9.044
66 HG11 VAL 9 1HG1 VAL 9 2.022 -5.163 -6.471
67 HG12 VAL 9 2HG1 VAL 9 1.646 -6.881 -6.604
68 HG13 VAL 9 3HG1 VAL 9 0.388 -5.684 -6.869
69 HG21 VAL 9 3HG2 VAL 9 1.868 -4.374 -10.040
70 HG22 VAL 9 1HG2 VAL 9 2.733 -3.939 -8.567
71 HG23 VAL 9 2HG2 VAL 9 0.973 -3.871 -8.606
72 H SER 10 H SER 10 2.215 -8.257 -10.332
73 HA SER 10 HA SER 10 3.994 -7.578 -12.586
74 HB2 SER 10 1HB SER 10 1.875 -9.707 -12.185
75 HB3 SER 10 2HB SER 10 2.767 -9.500 -13.691
76 HG SER 10 HG SER 10 3.529 -10.924 -11.717
77 H SER 11 H SER 11 0.825 -6.783 -11.495
78 HA SER 11 HA SER 11 0.376 -5.179 -13.919
79 HB2 SER 11 1HB SER 11 -1.485 -7.434 -13.141
80 HB3 SER 11 2HB SER 11 -1.916 -6.143 -14.262
81 HG SER 11 HG SER 11 -0.981 -8.174 -15.149
82 H SER 12 H SER 12 0.509 -3.477 -12.430
83 HA SER 12 HA SER 12 -0.242 -1.944 -10.837
84 HB2 SER 12 1HB SER 12 -3.035 -2.743 -11.627
85 HB3 SER 12 2HB SER 12 -2.387 -1.136 -11.310
86 HG SER 12 HG SER 12 -1.363 -1.167 -13.258
87 H LEU 13 H LEU 13 -2.085 -1.661 -9.063
88 HA LEU 13 HA LEU 13 -2.593 -4.212 -7.646
89 HB2 LEU 13 1HB LEU 13 -0.437 -3.515 -6.754
90 HB3 LEU 13 2HB LEU 13 -1.038 -1.885 -6.463
91 HG LEU 13 HG LEU 13 -2.636 -2.729 -4.808
92 HD11 LEU 13 1HD1 LEU 13 -3.323 -4.844 -5.535
93 HD12 LEU 13 2HD1 LEU 13 -2.273 -5.264 -4.186
94 HD13 LEU 13 3HD1 LEU 13 -1.677 -5.392 -5.839
95 HD21 LEU 13 3HD2 LEU 13 -0.361 -2.219 -4.028
96 HD22 LEU 13 1HD2 LEU 13 0.139 -3.873 -4.388
97 HD23 LEU 13 2HD2 LEU 13 -1.048 -3.567 -3.119
98 H ASN 14 H ASN 14 -4.540 -4.200 -6.742
99 HA ASN 14 HA ASN 14 -6.191 -1.778 -6.864
100 HB2 ASN 14 1HB ASN 14 -8.019 -3.258 -6.215
101 HB3 ASN 14 2HB ASN 14 -7.084 -4.007 -7.507
102 HD21 ASN 14 2HD2 ASN 14 -8.679 -5.571 -5.717
103 HD22 ASN 14 1HD2 ASN 14 -7.644 -6.527 -4.770
104 H VAL 15 H VAL 15 -6.681 -0.502 -5.206
105 HA VAL 15 HA VAL 15 -5.359 -0.904 -2.630
106 HB VAL 15 HB VAL 15 -7.202 1.287 -3.640
107 HG11 VAL 15 1HG1 VAL 15 -7.385 1.233 -1.242
108 HG12 VAL 15 2HG1 VAL 15 -6.250 2.525 -1.632
109 HG13 VAL 15 3HG1 VAL 15 -5.651 0.967 -1.060
110 HG21 VAL 15 3HG2 VAL 15 -5.021 2.575 -3.608
111 HG22 VAL 15 1HG2 VAL 15 -5.084 1.285 -4.810
112 HG23 VAL 15 2HG2 VAL 15 -4.197 1.046 -3.305
113 H ARG 16 H ARG 16 -6.252 -1.668 -0.837
114 HA ARG 16 HA ARG 16 -9.162 -2.378 -0.877
115 HB2 ARG 16 1HB ARG 16 -6.810 -3.513 0.659
116 HB3 ARG 16 2HB ARG 16 -8.484 -3.949 0.990
117 HG2 ARG 16 1HG ARG 16 -8.738 -4.678 -1.377
118 HG3 ARG 16 2HG ARG 16 -7.033 -4.318 -1.648
119 HD2 ARG 16 1HD ARG 16 -8.040 -6.261 0.448
120 HD3 ARG 16 2HD ARG 16 -7.488 -6.746 -1.155
121 HE ARG 16 HE ARG 16 -5.790 -5.852 1.068
122 HH11 ARG 16 1HH2 ARG 16 -6.123 -6.372 -2.350
123 HH12 ARG 16 2HH2 ARG 16 -4.416 -6.505 -2.611
124 HH21 ARG 16 1HH1 ARG 16 -3.584 -6.029 0.718
125 HH22 ARG 16 2HH1 ARG 16 -2.985 -6.307 -0.884
126 H GLU 17 H GLU 17 -10.492 -1.540 0.590
127 HA GLU 17 HA GLU 17 -9.399 0.427 2.548
128 HB2 GLU 17 1HB GLU 17 -11.155 1.191 0.955
129 HB3 GLU 17 2HB GLU 17 -12.259 -0.016 1.614
130 HG2 GLU 17 1HG GLU 17 -12.087 1.024 3.839
131 HG3 GLU 17 2HG GLU 17 -10.948 2.210 3.206
132 H GLY 18 H GLY 18 -8.674 -1.402 3.867
133 HA2 GLY 18 1HA GLY 18 -9.839 -1.831 6.226
134 HA3 GLY 18 2HA GLY 18 -10.784 -2.959 5.255
135 H ALA 19 H ALA 19 -9.383 -4.027 7.268
136 HA ALA 19 HA ALA 19 -6.733 -4.937 6.328
137 HB1 ALA 19 3HB ALA 19 -8.310 -5.675 8.819
138 HB2 ALA 19 1HB ALA 19 -7.099 -4.395 8.721
139 HB3 ALA 19 2HB ALA 19 -6.621 -6.078 8.502
140 H SER 20 H SER 20 -9.768 -5.730 5.503
141 HA SER 20 HA SER 20 -9.724 -8.630 5.727
142 HB2 SER 20 1HB SER 20 -11.424 -6.663 4.190
143 HB3 SER 20 2HB SER 20 -11.605 -8.401 3.966
144 HG SER 20 HG SER 20 -11.476 -7.865 6.574
145 H THR 21 H THR 21 -9.539 -10.088 3.951
146 HA THR 21 HA THR 21 -7.270 -9.607 2.262
147 HB THR 21 HB THR 21 -7.893 -11.807 1.245
148 HG1 THR 21 HG1 THR 21 -9.783 -12.630 2.784
149 HG21 THR 21 3HG2 THR 21 -7.741 -13.111 3.372
150 HG22 THR 21 1HG2 THR 21 -8.025 -11.615 4.266
151 HG23 THR 21 2HG2 THR 21 -6.570 -11.794 3.284
152 H SER 22 H SER 22 -10.728 -9.298 1.820
153 HA SER 22 HA SER 22 -10.245 -8.115 -0.887
154 HB2 SER 22 1HB SER 22 -11.062 -10.430 -1.196
155 HB3 SER 22 2HB SER 22 -12.461 -10.072 -0.187
156 HG SER 22 HG SER 22 -12.589 -9.843 -2.616
157 H SER 23 H SER 23 -10.396 -6.264 0.774
158 HA SER 23 HA SER 23 -13.088 -5.582 1.725
159 HB2 SER 23 1HB SER 23 -12.076 -3.830 2.875
160 HB3 SER 23 2HB SER 23 -10.724 -4.951 2.753
161 HG SER 23 HG SER 23 -10.396 -3.736 0.633
162 H LYS 24 H LYS 24 -13.723 -3.189 1.265
163 HA LYS 24 HA LYS 24 -14.572 -2.997 -1.423
164 HB2 LYS 24 1HB LYS 24 -15.626 -1.829 0.527
165 HB3 LYS 24 2HB LYS 24 -14.270 -0.699 0.527
166 HG2 LYS 24 1HG LYS 24 -14.792 -0.018 -1.764
167 HG3 LYS 24 2HG LYS 24 -16.097 -1.200 -1.839
168 HD2 LYS 24 1HD LYS 24 -17.261 -0.037 0.001
169 HD3 LYS 24 2HD LYS 24 -15.961 1.154 0.069
170 HE2 LYS 24 1HE LYS 24 -16.434 1.818 -2.256
171 HE3 LYS 24 2HE LYS 24 -17.719 0.614 -2.346
172 HZ1 LYS 24 3HZ LYS 24 -17.692 2.737 -0.284
173 HZ2 LYS 24 1HZ LYS 24 -18.993 1.763 -0.773
174 HZ3 LYS 24 2HZ LYS 24 -18.401 2.973 -1.810
175 H VAL 25 H VAL 25 -13.684 -2.260 -3.195
176 HA VAL 25 HA VAL 25 -10.915 -1.285 -3.180
177 HB VAL 25 HB VAL 25 -12.875 -1.855 -5.433
178 HG11 VAL 25 1HG1 VAL 25 -11.321 -0.238 -6.266
179 HG12 VAL 25 2HG1 VAL 25 -10.732 -1.806 -6.818
180 HG13 VAL 25 3HG1 VAL 25 -9.969 -1.013 -5.439
181 HG21 VAL 25 3HG2 VAL 25 -10.391 -3.376 -4.607
182 HG22 VAL 25 1HG2 VAL 25 -11.655 -3.898 -5.721
183 HG23 VAL 25 2HG2 VAL 25 -11.995 -3.775 -3.995
184 H ILE 26 H ILE 26 -10.363 0.799 -3.302
185 HA ILE 26 HA ILE 26 -12.479 2.828 -3.965
186 HB ILE 26 HB ILE 26 -11.217 4.373 -2.511
187 HG12 ILE 26 1HG1 ILE 26 -9.549 1.943 -1.781
188 HG13 ILE 26 2HG1 ILE 26 -8.978 3.260 -2.804
189 HG21 ILE 26 1HG2 ILE 26 -11.915 1.740 -1.181
190 HG22 ILE 26 2HG2 ILE 26 -13.058 3.023 -1.576
191 HG23 ILE 26 3HG2 ILE 26 -11.802 3.301 -0.369
192 HD11 ILE 26 3HD1 ILE 26 -9.399 4.861 -0.960
193 HD12 ILE 26 1HD1 ILE 26 -8.244 3.615 -0.491
194 HD13 ILE 26 2HD1 ILE 26 -9.914 3.524 0.068
195 H GLY 27 H GLY 27 -9.653 1.385 -5.049
196 HA2 GLY 27 1HA GLY 27 -9.375 2.915 -7.365
197 HA3 GLY 27 2HA GLY 27 -8.323 3.692 -6.185
198 H SER 28 H SER 28 -6.684 3.032 -7.806
199 HA SER 28 HA SER 28 -5.444 0.478 -7.007
200 HB2 SER 28 1HB SER 28 -6.824 -0.153 -8.952
201 HB3 SER 28 2HB SER 28 -6.070 1.122 -9.905
202 HG SER 28 HG SER 28 -4.943 -1.243 -8.852
203 H LEU 29 H LEU 29 -3.227 0.389 -7.524
204 HA LEU 29 HA LEU 29 -1.980 2.995 -8.348
205 HB2 LEU 29 1HB LEU 29 -0.963 1.016 -6.281
206 HB3 LEU 29 2HB LEU 29 -0.189 2.531 -6.745
207 HG LEU 29 HG LEU 29 -2.952 2.296 -5.513
208 HD11 LEU 29 1HD1 LEU 29 -1.202 1.742 -3.893
209 HD12 LEU 29 2HD1 LEU 29 -1.855 3.340 -3.533
210 HD13 LEU 29 3HD1 LEU 29 -0.297 3.187 -4.343
211 HD21 LEU 29 3HD2 LEU 29 -3.010 4.285 -6.756
212 HD22 LEU 29 1HD2 LEU 29 -1.286 4.594 -6.540
213 HD23 LEU 29 2HD2 LEU 29 -2.409 4.859 -5.206
214 H SER 30 H SER 30 -0.091 2.850 -9.539
215 HA SER 30 HA SER 30 0.106 0.546 -11.287
216 HB2 SER 30 1HB SER 30 2.066 1.838 -12.234
217 HB3 SER 30 2HB SER 30 0.541 2.718 -12.224
218 HG SER 30 HG SER 30 2.811 3.014 -10.584
219 H GLY 31 H GLY 31 2.099 -0.634 -11.648
220 HA2 GLY 31 1HA GLY 31 3.172 -1.746 -9.228
221 HA3 GLY 31 2HA GLY 31 3.725 -2.114 -10.860
222 H ASN 32 H ASN 32 5.381 -1.736 -8.557
223 HA ASN 32 HA ASN 32 7.362 -0.686 -7.921
224 HB2 ASN 32 1HB ASN 32 7.853 -1.146 -10.348
225 HB3 ASN 32 2HB ASN 32 7.313 0.494 -10.710
226 HD21 ASN 32 2HD2 ASN 32 9.849 -1.395 -9.092
227 HD22 ASN 32 1HD2 ASN 32 10.938 -0.105 -8.911
228 H THR 33 H THR 33 4.850 0.652 -7.373
229 HA THR 33 HA THR 33 5.593 3.540 -7.627
230 HB THR 33 HB THR 33 2.966 2.228 -6.859
231 HG1 THR 33 HG1 THR 33 2.355 3.229 -8.850
232 HG21 THR 33 3HG2 THR 33 2.150 4.640 -7.087
233 HG22 THR 33 1HG2 THR 33 3.845 5.118 -7.002
234 HG23 THR 33 2HG2 THR 33 3.096 4.282 -5.642
235 H LYS 34 H LYS 34 6.372 4.566 -5.964
236 HA LYS 34 HA LYS 34 6.784 3.264 -3.398
237 HB2 LYS 34 1HB LYS 34 8.443 4.791 -4.451
238 HB3 LYS 34 2HB LYS 34 7.306 6.122 -4.257
239 HG2 LYS 34 1HG LYS 34 7.353 5.862 -1.830
240 HG3 LYS 34 2HG LYS 34 8.381 4.440 -1.978
241 HD2 LYS 34 1HD LYS 34 9.883 6.215 -1.471
242 HD3 LYS 34 2HD LYS 34 10.050 5.960 -3.207
243 HE2 LYS 34 1HE LYS 34 8.695 7.872 -3.714
244 HE3 LYS 34 2HE LYS 34 8.156 8.020 -2.043
245 HZ1 LYS 34 3HZ LYS 34 9.972 9.152 -1.501
246 HZ2 LYS 34 1HZ LYS 34 10.248 9.332 -3.164
247 HZ3 LYS 34 2HZ LYS 34 11.009 8.075 -2.311
248 H VAL 35 H VAL 35 5.547 3.423 -1.643
249 HA VAL 35 HA VAL 35 3.492 5.603 -1.476
250 HB VAL 35 HB VAL 35 2.023 3.857 -0.349
251 HG11 VAL 35 1HG1 VAL 35 1.663 4.680 -2.662
252 HG12 VAL 35 2HG1 VAL 35 1.200 2.987 -2.488
253 HG13 VAL 35 3HG1 VAL 35 2.727 3.409 -3.265
254 HG21 VAL 35 3HG2 VAL 35 4.052 2.005 -1.648
255 HG22 VAL 35 1HG2 VAL 35 2.498 1.495 -0.989
256 HG23 VAL 35 2HG2 VAL 35 3.734 2.155 0.080
257 H THR 36 H THR 36 3.513 6.653 0.385
258 HA THR 36 HA THR 36 5.460 5.987 2.444
259 HB THR 36 HB THR 36 4.374 8.019 3.588
260 HG1 THR 36 HG1 THR 36 2.587 7.557 1.716
261 HG21 THR 36 3HG2 THR 36 5.637 8.129 0.849
262 HG22 THR 36 1HG2 THR 36 6.414 8.352 2.416
263 HG23 THR 36 2HG2 THR 36 5.314 9.583 1.795
264 H ILE 37 H ILE 37 5.107 4.997 4.330
265 HA ILE 37 HA ILE 37 2.333 4.061 4.945
266 HB ILE 37 HB ILE 37 5.047 2.972 5.756
267 HG12 ILE 37 1HG1 ILE 37 2.836 1.717 4.106
268 HG13 ILE 37 2HG1 ILE 37 4.207 2.570 3.395
269 HG21 ILE 37 1HG2 ILE 37 3.605 2.576 7.611
270 HG22 ILE 37 2HG2 ILE 37 3.575 1.080 6.677
271 HG23 ILE 37 3HG2 ILE 37 2.234 2.217 6.562
272 HD11 ILE 37 3HD1 ILE 37 4.521 0.073 3.542
273 HD12 ILE 37 1HD1 ILE 37 4.485 0.227 5.299
274 HD13 ILE 37 2HD1 ILE 37 5.771 1.000 4.371
275 H VAL 38 H VAL 38 1.351 4.865 6.665
276 HA VAL 38 HA VAL 38 2.954 6.403 8.688
277 HB VAL 38 HB VAL 38 0.835 7.617 9.136
278 HG11 VAL 38 1HG1 VAL 38 2.554 8.326 7.382
279 HG12 VAL 38 2HG1 VAL 38 0.937 9.008 7.201
280 HG13 VAL 38 3HG1 VAL 38 1.448 7.668 6.174
281 HG21 VAL 38 3HG2 VAL 38 -0.971 7.341 7.336
282 HG22 VAL 38 1HG2 VAL 38 -0.855 6.043 8.523
283 HG23 VAL 38 2HG2 VAL 38 -0.174 5.827 6.911
284 H GLY 39 H GLY 39 1.437 3.485 8.235
285 HA2 GLY 39 1HA GLY 39 1.476 2.833 11.038
286 HA3 GLY 39 2HA GLY 39 -0.184 3.075 10.504
287 H GLU 40 H GLU 40 0.403 0.644 11.414
288 HA GLU 40 HA GLU 40 0.390 -1.073 8.979
289 HB2 GLU 40 1HB GLU 40 2.628 -1.253 9.875
290 HB3 GLU 40 2HB GLU 40 2.015 -1.500 11.506
291 HG2 GLU 40 1HG GLU 40 1.190 -3.365 9.287
292 HG3 GLU 40 2HG GLU 40 2.745 -3.581 10.080
293 H GLU 41 H GLU 41 -0.924 -2.877 9.147
294 HA GLU 41 HA GLU 41 -2.348 -3.411 11.696
295 HB2 GLU 41 1HB GLU 41 -3.666 -2.602 9.093
296 HB3 GLU 41 2HB GLU 41 -4.530 -3.479 10.356
297 HG2 GLU 41 1HG GLU 41 -3.083 -0.858 10.810
298 HG3 GLU 41 2HG GLU 41 -4.810 -0.985 10.495
299 H GLY 42 H GLY 42 -1.850 -5.455 11.984
300 HA2 GLY 42 1HA GLY 42 -1.581 -7.747 11.630
301 HA3 GLY 42 2HA GLY 42 -2.907 -7.585 10.481
302 H ALA 43 H ALA 43 -2.236 -8.700 8.750
303 HA ALA 43 HA ALA 43 0.556 -8.502 7.796
304 HB1 ALA 43 3HB ALA 43 -1.770 -10.035 6.588
305 HB2 ALA 43 1HB ALA 43 -0.708 -10.687 7.837
306 HB3 ALA 43 2HB ALA 43 -0.053 -10.267 6.256
307 H PHE 44 H PHE 44 -1.246 -6.176 7.740
308 HA PHE 44 HA PHE 44 -1.086 -5.599 4.809
309 HB2 PHE 44 1HB PHE 44 -3.384 -4.919 6.668
310 HB3 PHE 44 2HB PHE 44 -3.194 -4.276 5.037
311 HD1 PHE 44 HD1 PHE 44 -3.312 -5.768 3.068
312 HD2 PHE 44 HD2 PHE 44 -4.059 -7.209 7.043
313 HE1 PHE 44 HE1 PHE 44 -4.363 -7.807 2.130
314 HE2 PHE 44 HE2 PHE 44 -5.112 -9.250 6.105
315 HZ PHE 44 HZ PHE 44 -5.265 -9.549 3.648
316 H TYR 45 H TYR 45 -0.422 -3.554 4.312
317 HA TYR 45 HA TYR 45 0.458 -1.829 6.600
318 HB2 TYR 45 1HB TYR 45 1.570 -2.308 3.838
319 HB3 TYR 45 2HB TYR 45 1.932 -0.802 4.685
320 HD1 TYR 45 HD1 TYR 45 2.563 -1.159 7.275
321 HD2 TYR 45 HD2 TYR 45 3.079 -4.073 4.162
322 HE1 TYR 45 HE1 TYR 45 4.288 -2.307 8.632
323 HE2 TYR 45 HE2 TYR 45 4.806 -5.215 5.519
324 HH TYR 45 HH TYR 45 5.167 -5.071 8.524
325 H LYS 46 H LYS 46 -0.147 0.245 6.681
326 HA LYS 46 HA LYS 46 -2.327 1.081 4.858
327 HB2 LYS 46 1HB LYS 46 -1.305 2.173 7.484
328 HB3 LYS 46 2HB LYS 46 -2.550 2.978 6.529
329 HG2 LYS 46 1HG LYS 46 -3.838 0.811 6.584
330 HG3 LYS 46 2HG LYS 46 -2.669 0.215 7.759
331 HD2 LYS 46 1HD LYS 46 -4.284 2.757 8.106
332 HD3 LYS 46 2HD LYS 46 -4.737 1.202 8.802
333 HE2 LYS 46 1HE LYS 46 -2.386 1.190 9.859
334 HE3 LYS 46 2HE LYS 46 -2.320 2.899 9.433
335 HZ1 LYS 46 3HZ LYS 46 -3.778 1.601 11.523
336 HZ2 LYS 46 1HZ LYS 46 -4.760 2.616 10.584
337 HZ3 LYS 46 2HZ LYS 46 -3.371 3.240 11.339
338 H ILE 47 H ILE 47 -2.229 2.885 3.608
339 HA ILE 47 HA ILE 47 0.356 4.381 3.483
340 HB ILE 47 HB ILE 47 0.190 4.342 1.012
341 HG12 ILE 47 1HG1 ILE 47 -1.992 2.277 1.454
342 HG13 ILE 47 2HG1 ILE 47 -2.294 3.933 0.933
343 HG21 ILE 47 1HG2 ILE 47 0.174 1.566 2.229
344 HG22 ILE 47 2HG2 ILE 47 1.551 2.668 2.273
345 HG23 ILE 47 3HG2 ILE 47 0.964 2.053 0.728
346 HD11 ILE 47 3HD1 ILE 47 -0.665 3.472 -0.988
347 HD12 ILE 47 1HD1 ILE 47 -2.225 2.654 -1.071
348 HD13 ILE 47 2HD1 ILE 47 -0.792 1.769 -0.545
349 H GLU 48 H GLU 48 0.187 6.498 2.695
350 HA GLU 48 HA GLU 48 -2.312 7.828 3.363
351 HB2 GLU 48 1HB GLU 48 -0.080 8.842 3.810
352 HB3 GLU 48 2HB GLU 48 0.188 8.969 2.070
353 HG2 GLU 48 1HG GLU 48 -1.777 10.416 1.842
354 HG3 GLU 48 2HG GLU 48 -2.129 10.241 3.560
355 H TYR 49 H TYR 49 -3.857 7.148 1.908
356 HA TYR 49 HA TYR 49 -3.402 7.821 -0.980
357 HB2 TYR 49 1HB TYR 49 -4.006 5.466 -0.534
358 HB3 TYR 49 2HB TYR 49 -5.487 6.002 0.266
359 HD1 TYR 49 HD2 TYR 49 -3.624 6.127 -2.963
360 HD2 TYR 49 HD1 TYR 49 -7.415 6.579 -0.996
361 HE1 TYR 49 HE2 TYR 49 -4.746 6.316 -5.167
362 HE2 TYR 49 HE1 TYR 49 -8.536 6.769 -3.200
363 HH TYR 49 HH TYR 49 -6.895 6.067 -6.162
364 H LYS 50 H LYS 50 -4.776 9.179 -1.992
365 HA LYS 50 HA LYS 50 -6.041 11.255 -0.580
366 HB2 LYS 50 1HB LYS 50 -7.167 11.755 -2.774
367 HB3 LYS 50 2HB LYS 50 -5.419 11.555 -2.893
368 HG2 LYS 50 1HG LYS 50 -5.885 9.105 -3.497
369 HG3 LYS 50 2HG LYS 50 -7.571 9.577 -3.684
370 HD2 LYS 50 1HD LYS 50 -5.281 10.928 -5.135
371 HD3 LYS 50 2HD LYS 50 -6.246 9.625 -5.825
372 HE2 LYS 50 1HE LYS 50 -8.300 11.063 -5.323
373 HE3 LYS 50 2HE LYS 50 -7.176 12.384 -5.005
374 HZ1 LYS 50 3HZ LYS 50 -8.135 12.033 -7.372
375 HZ2 LYS 50 1HZ LYS 50 -6.925 10.851 -7.495
376 HZ3 LYS 50 2HZ LYS 50 -6.503 12.465 -7.172
377 H GLY 51 H GLY 51 -7.780 11.219 0.628
378 HA2 GLY 51 1HA GLY 51 -10.232 10.977 0.748
379 HA3 GLY 51 2HA GLY 51 -10.082 9.438 -0.099
380 H SER 52 H SER 52 -8.022 8.228 1.264
381 HA SER 52 HA SER 52 -8.342 8.355 4.142
382 HB2 SER 52 1HB SER 52 -9.586 5.974 2.736
383 HB3 SER 52 2HB SER 52 -9.471 6.223 4.477
384 HG SER 52 HG SER 52 -10.690 8.201 4.081
385 H HIS 53 H HIS 53 -7.697 5.707 4.759
386 HA HIS 53 HA HIS 53 -4.922 5.552 3.674
387 HB2 HIS 53 1HB HIS 53 -6.190 4.323 6.144
388 HB3 HIS 53 2HB HIS 53 -4.514 4.082 5.652
389 HD1 HIS 53 HD1 HIS 53 -6.877 6.782 6.843
390 HD2 HIS 53 HD2 HIS 53 -2.794 6.234 6.208
391 HE1 HIS 53 HE1 HIS 53 -5.719 8.798 7.849
392 H GLY 54 H GLY 54 -4.530 4.125 2.179
393 HA2 GLY 54 1HA GLY 54 -6.402 1.964 1.546
394 HA3 GLY 54 2HA GLY 54 -4.942 2.377 0.652
395 H TYR 55 H TYR 55 -5.998 -0.205 1.706
396 HA TYR 55 HA TYR 55 -3.723 -1.013 3.482
397 HB2 TYR 55 1HB TYR 55 -6.446 -2.255 3.000
398 HB3 TYR 55 2HB TYR 55 -5.161 -3.039 3.919
399 HD1 TYR 55 HD2 TYR 55 -7.434 -0.107 3.809
400 HD2 TYR 55 HD1 TYR 55 -4.569 -2.311 6.132
401 HE1 TYR 55 HE2 TYR 55 -8.071 1.188 5.827
402 HE2 TYR 55 HE1 TYR 55 -5.201 -1.010 8.147
403 HH TYR 55 HH TYR 55 -6.552 0.528 8.988
404 H VAL 56 H VAL 56 -2.309 -2.504 2.792
405 HA VAL 56 HA VAL 56 -2.849 -4.016 0.285
406 HB VAL 56 HB VAL 56 -0.510 -3.465 -0.475
407 HG11 VAL 56 1HG1 VAL 56 -1.146 -1.222 -1.338
408 HG12 VAL 56 2HG1 VAL 56 -2.489 -1.184 -0.194
409 HG13 VAL 56 3HG1 VAL 56 -2.460 -2.389 -1.482
410 HG21 VAL 56 3HG2 VAL 56 0.397 -2.675 1.668
411 HG22 VAL 56 1HG2 VAL 56 -0.771 -1.352 1.695
412 HG23 VAL 56 2HG2 VAL 56 0.492 -1.388 0.466
413 H ALA 57 H ALA 57 -1.860 -5.976 0.188
414 HA ALA 57 HA ALA 57 -1.086 -7.246 2.640
415 HB1 ALA 57 3HB ALA 57 -0.417 -8.382 -0.073
416 HB2 ALA 57 1HB ALA 57 -2.097 -8.260 0.448
417 HB3 ALA 57 2HB ALA 57 -0.952 -9.221 1.381
418 H LYS 58 H LYS 58 0.910 -7.953 3.331
419 HA LYS 58 HA LYS 58 3.166 -6.274 2.826
420 HB2 LYS 58 1HB LYS 58 3.081 -9.058 4.041
421 HB3 LYS 58 2HB LYS 58 4.430 -7.930 4.165
422 HG2 LYS 58 1HG LYS 58 2.748 -6.279 5.182
423 HG3 LYS 58 2HG LYS 58 1.663 -7.656 5.340
424 HD2 LYS 58 1HD LYS 58 4.466 -7.538 6.484
425 HD3 LYS 58 2HD LYS 58 2.991 -7.260 7.409
426 HE2 LYS 58 1HE LYS 58 2.234 -9.574 6.578
427 HE3 LYS 58 2HE LYS 58 3.911 -9.815 6.091
428 HZ1 LYS 58 3HZ LYS 58 3.559 -10.664 8.301
429 HZ2 LYS 58 1HZ LYS 58 2.960 -9.167 8.825
430 HZ3 LYS 58 2HZ LYS 58 4.589 -9.314 8.368
431 H GLU 59 H GLU 59 2.168 -9.378 1.519
432 HA GLU 59 HA GLU 59 4.497 -10.294 0.284
433 HB2 GLU 59 1HB GLU 59 1.623 -10.394 -0.695
434 HB3 GLU 59 2HB GLU 59 2.938 -11.316 -1.427
435 HG2 GLU 59 1HG GLU 59 3.383 -12.432 0.713
436 HG3 GLU 59 2HG GLU 59 2.122 -11.477 1.491
437 H TYR 60 H TYR 60 2.329 -7.714 -0.756
438 HA TYR 60 HA TYR 60 3.787 -7.357 -3.303
439 HB2 TYR 60 1HB TYR 60 1.567 -5.677 -2.095
440 HB3 TYR 60 2HB TYR 60 2.122 -5.640 -3.768
441 HD1 TYR 60 HD1 TYR 60 2.281 -8.214 -4.795
442 HD2 TYR 60 HD2 TYR 60 -0.455 -6.811 -1.790
443 HE1 TYR 60 HE1 TYR 60 0.718 -10.042 -5.363
444 HE2 TYR 60 HE2 TYR 60 -2.019 -8.647 -2.363
445 HH TYR 60 HH TYR 60 -1.648 -10.561 -5.177
446 H ILE 61 H ILE 61 4.397 -6.525 -0.176
447 HA ILE 61 HA ILE 61 5.610 -3.882 -0.905
448 HB ILE 61 HB ILE 61 4.986 -5.035 1.833
449 HG12 ILE 61 1HG1 ILE 61 3.060 -4.270 0.195
450 HG13 ILE 61 2HG1 ILE 61 3.047 -3.707 1.861
451 HG21 ILE 61 1HG2 ILE 61 5.394 -2.550 2.440
452 HG22 ILE 61 2HG2 ILE 61 6.201 -2.439 0.877
453 HG23 ILE 61 3HG2 ILE 61 6.811 -3.546 2.107
454 HD11 ILE 61 3HD1 ILE 61 4.429 -2.088 -0.276
455 HD12 ILE 61 1HD1 ILE 61 3.805 -1.559 1.280
456 HD13 ILE 61 2HD1 ILE 61 2.696 -1.953 -0.030
457 H LYS 62 H LYS 62 7.716 -3.777 -1.124
458 HA LYS 62 HA LYS 62 9.488 -5.589 0.421
459 HB2 LYS 62 1HB LYS 62 10.675 -6.363 -1.525
460 HB3 LYS 62 2HB LYS 62 8.963 -6.683 -1.794
461 HG2 LYS 62 1HG LYS 62 8.815 -4.559 -3.112
462 HG3 LYS 62 2HG LYS 62 10.555 -4.350 -2.925
463 HD2 LYS 62 1HD LYS 62 10.924 -6.541 -4.027
464 HD3 LYS 62 2HD LYS 62 9.186 -6.687 -4.279
465 HE2 LYS 62 1HE LYS 62 9.205 -4.591 -5.600
466 HE3 LYS 62 2HE LYS 62 10.946 -4.467 -5.361
467 HZ1 LYS 62 3HZ LYS 62 10.163 -5.517 -7.506
468 HZ2 LYS 62 1HZ LYS 62 9.697 -6.856 -6.575
469 HZ3 LYS 62 2HZ LYS 62 11.327 -6.383 -6.620
470 H ASP 63 H ASP 63 11.747 -4.944 0.239
471 HA ASP 63 HA ASP 63 13.434 -3.372 0.489
472 HB2 ASP 63 1HB ASP 63 11.955 -2.203 -1.875
473 HB3 ASP 63 2HB ASP 63 13.457 -1.524 -1.253
474 H ILE 64 H ILE 64 11.715 -3.112 2.434
475 HA ILE 64 HA ILE 64 10.466 -0.489 2.593
476 HB ILE 64 HB ILE 64 11.049 -2.582 4.718
477 HG12 ILE 64 1HG1 ILE 64 8.432 -1.814 3.391
478 HG13 ILE 64 2HG1 ILE 64 9.441 -3.145 2.829
479 HG21 ILE 64 1HG2 ILE 64 10.834 -0.480 5.848
480 HG22 ILE 64 2HG2 ILE 64 9.263 -1.270 5.982
481 HG23 ILE 64 3HG2 ILE 64 9.504 0.019 4.804
482 HD11 ILE 64 3HD1 ILE 64 9.316 -4.106 5.167
483 HD12 ILE 64 1HD1 ILE 64 7.780 -4.084 4.301
484 HD13 ILE 64 2HD1 ILE 64 8.113 -2.871 5.538
485 H LYS 65 H LYS 65 11.425 1.351 3.108
486 HA LYS 65 HA LYS 65 14.028 1.302 4.608
487 HB2 LYS 65 1HB LYS 65 13.294 2.976 2.188
488 HB3 LYS 65 2HB LYS 65 14.721 3.245 3.192
489 HG2 LYS 65 1HG LYS 65 15.517 0.972 2.703
490 HG3 LYS 65 2HG LYS 65 14.084 0.670 1.722
491 HD2 LYS 65 1HD LYS 65 14.731 2.492 0.196
492 HD3 LYS 65 2HD LYS 65 16.158 2.817 1.180
493 HE2 LYS 65 1HE LYS 65 17.001 0.548 0.725
494 HE3 LYS 65 2HE LYS 65 15.567 0.204 -0.243
495 HZ1 LYS 65 3HZ LYS 65 17.647 0.958 -1.463
496 HZ2 LYS 65 1HZ LYS 65 17.327 2.503 -0.840
497 HZ3 LYS 65 2HZ LYS 65 16.193 1.745 -1.854
498 H ASP 66 H ASP 66 14.348 2.952 6.039
499 HA ASP 66 HA ASP 66 11.917 4.386 6.922
500 HB2 ASP 66 1HB ASP 66 14.695 4.114 8.123
501 HB3 ASP 66 2HB ASP 66 13.376 5.018 8.867
502 H GLU 67 H GLU 67 11.562 6.183 5.761
503 HA GLU 67 HA GLU 67 12.025 8.130 4.494
504 HB2 GLU 67 1HB GLU 67 11.651 8.838 6.848
505 HB3 GLU 67 2HB GLU 67 13.388 8.731 7.135
506 HG2 GLU 67 1HG GLU 67 12.861 11.041 6.659
507 HG3 GLU 67 2HG GLU 67 13.722 10.395 5.270
508 H VAL 68 H VAL 68 13.495 7.070 2.988
509 HA VAL 68 HA VAL 68 16.397 7.639 3.474
510 HB VAL 68 HB VAL 68 15.850 5.310 2.897
511 HG11 VAL 68 1HG1 VAL 68 13.794 6.142 1.458
512 HG12 VAL 68 2HG1 VAL 68 14.651 4.677 0.993
513 HG13 VAL 68 3HG1 VAL 68 14.974 6.186 0.148
514 HG21 VAL 68 3HG2 VAL 68 17.486 5.057 1.163
515 HG22 VAL 68 1HG2 VAL 68 17.951 6.501 2.064
516 HG23 VAL 68 2HG2 VAL 68 17.134 6.656 0.508
517 H LEU 69 H LEU 69 17.033 9.519 2.663
518 HA LEU 69 HA LEU 69 15.709 10.657 0.250
519 HB2 LEU 69 1HB LEU 69 17.467 11.799 2.432
520 HB3 LEU 69 2HB LEU 69 17.255 12.667 0.915
521 HG LEU 69 HG LEU 69 15.622 13.331 2.724
522 HD11 LEU 69 1HD1 LEU 69 13.960 13.737 1.172
523 HD12 LEU 69 2HD1 LEU 69 13.972 12.097 0.542
524 HD13 LEU 69 3HD1 LEU 69 15.223 13.237 0.055
525 HD21 LEU 69 3HD2 LEU 69 14.297 10.671 2.169
526 HD22 LEU 69 1HD2 LEU 69 13.932 11.827 3.447
527 HD23 LEU 69 2HD2 LEU 69 15.415 10.877 3.519
528 H GLU 70 H GLU 70 18.343 8.783 1.029
529 HA GLU 70 HA GLU 70 20.258 8.137 -0.132
530 HB2 GLU 70 1HB GLU 70 18.559 7.757 -1.914
531 HB3 GLU 70 2HB GLU 70 18.838 9.398 -2.495
532 HG2 GLU 70 1HG GLU 70 20.181 7.870 -3.824
533 HG3 GLU 70 2HG GLU 70 21.261 8.818 -2.806
534 H HIS 71 H HIS 71 21.373 9.741 1.150
535 HA HIS 71 HA HIS 71 21.984 12.349 -0.027
536 HB2 HIS 71 1HB HIS 71 23.051 10.884 2.405
537 HB3 HIS 71 2HB HIS 71 23.584 12.496 1.927
538 HD1 HIS 71 HD1 HIS 71 20.721 10.662 3.459
539 HD2 HIS 71 HD2 HIS 71 21.569 14.539 2.183
540 HE1 HIS 71 HE1 HIS 71 18.888 12.140 4.391
541 H HIS 72 H HIS 72 23.905 12.966 -0.909
542 HA HIS 72 HA HIS 72 25.657 12.651 -2.436
543 HB2 HIS 72 1HB HIS 72 26.581 11.205 0.056
544 HB3 HIS 72 2HB HIS 72 27.642 11.585 -1.302
545 HD1 HIS 72 HD1 HIS 72 25.559 13.261 1.374
546 HD2 HIS 72 HD2 HIS 72 28.427 14.289 -1.471
547 HE1 HIS 72 HE1 HIS 72 26.209 15.662 1.848
548 H HIS 73 H HIS 73 24.475 11.377 -3.941
549 HA HIS 73 HA HIS 73 24.645 8.440 -3.776
550 HB2 HIS 73 1HB HIS 73 23.319 8.460 -5.817
551 HB3 HIS 73 2HB HIS 73 22.623 9.624 -4.694
552 HD1 HIS 73 HD1 HIS 73 23.041 12.182 -5.212
553 HD2 HIS 73 HD2 HIS 73 24.358 9.576 -8.190
554 HE1 HIS 73 HE1 HIS 73 23.494 13.603 -7.259
555 H HIS 74 H HIS 74 26.475 11.049 -5.015
556 HA HIS 74 HA HIS 74 27.716 9.807 -7.290
557 HB2 HIS 74 1HB HIS 74 27.789 12.264 -6.787
558 HB3 HIS 74 2HB HIS 74 28.879 11.927 -5.442
559 HD1 HIS 74 HD1 HIS 74 31.212 10.738 -6.125
560 HD2 HIS 74 HD2 HIS 74 29.043 12.412 -9.267
561 HE1 HIS 74 HE1 HIS 74 32.813 10.933 -8.078
562 H HIS 75 H HIS 75 28.660 10.037 -3.867
563 HA HIS 75 HA HIS 75 31.054 8.413 -4.264
564 HB2 HIS 75 1HB HIS 75 29.643 9.393 -1.765
565 HB3 HIS 75 2HB HIS 75 31.159 8.491 -1.752
566 HD1 HIS 75 HD1 HIS 75 29.718 11.846 -2.570
567 HD2 HIS 75 HD2 HIS 75 33.414 9.929 -2.778
568 HE1 HIS 75 HE1 HIS 75 31.437 13.650 -3.028
569 H HIS 76 H HIS 76 31.337 6.299 -3.746
570 HA HIS 76 HA HIS 76 29.300 4.432 -4.100
571 HB2 HIS 76 1HB HIS 76 30.892 2.864 -2.773
572 HB3 HIS 76 2HB HIS 76 31.507 3.606 -4.248
573 HD1 HIS 76 HD1 HIS 76 32.107 3.382 -0.627
574 HD2 HIS 76 HD2 HIS 76 33.255 5.926 -3.724
575 HE1 HIS 76 HE1 HIS 76 34.064 4.732 0.244
Start of MODEL 18
1 H1 ALA 1 1H ALA 1 6.757 12.362 9.845
2 H2 ALA 1 2H ALA 1 6.676 12.722 8.187
3 H3 ALA 1 3H ALA 1 7.659 11.450 8.734
4 HA ALA 1 HA ALA 1 5.686 10.250 9.500
5 HB1 ALA 1 3HB ALA 1 3.488 11.054 8.766
6 HB2 ALA 1 1HB ALA 1 4.234 12.503 8.091
7 HB3 ALA 1 2HB ALA 1 4.256 12.228 9.834
8 H GLU 2 H GLU 2 7.428 9.542 7.890
9 HA GLU 2 HA GLU 2 5.997 8.556 5.547
10 HB2 GLU 2 1HB GLU 2 6.869 10.745 4.725
11 HB3 GLU 2 2HB GLU 2 8.497 10.194 5.104
12 HG2 GLU 2 1HG GLU 2 8.284 8.334 3.507
13 HG3 GLU 2 2HG GLU 2 6.617 8.795 3.155
14 H LYS 3 H LYS 3 6.350 6.600 6.040
15 HA LYS 3 HA LYS 3 9.167 5.575 6.184
16 HB2 LYS 3 1HB LYS 3 7.642 5.118 8.250
17 HB3 LYS 3 2HB LYS 3 6.699 4.084 7.169
18 HG2 LYS 3 1HG LYS 3 8.633 2.681 6.734
19 HG3 LYS 3 2HG LYS 3 9.691 3.802 7.588
20 HD2 LYS 3 1HD LYS 3 9.239 1.977 9.088
21 HD3 LYS 3 2HD LYS 3 8.330 3.372 9.667
22 HE2 LYS 3 1HE LYS 3 6.283 2.523 8.779
23 HE3 LYS 3 2HE LYS 3 7.125 1.287 7.843
24 HZ1 LYS 3 3HZ LYS 3 6.227 1.195 10.507
25 HZ2 LYS 3 1HZ LYS 3 7.911 0.990 10.473
26 HZ3 LYS 3 2HZ LYS 3 6.913 -0.045 9.568
27 H THR 4 H THR 4 9.302 3.585 4.540
28 HA THR 4 HA THR 4 6.884 3.806 2.736
29 HB THR 4 HB THR 4 9.636 4.029 1.535
30 HG1 THR 4 HG1 THR 4 9.745 5.614 3.056
31 HG21 THR 4 3HG2 THR 4 6.931 5.250 0.857
32 HG22 THR 4 1HG2 THR 4 7.637 3.818 0.092
33 HG23 THR 4 2HG2 THR 4 8.421 5.382 -0.048
34 H GLY 5 H GLY 5 6.235 2.291 1.692
35 HA2 GLY 5 1HA GLY 5 7.629 -0.356 1.588
36 HA3 GLY 5 2HA GLY 5 5.871 -0.120 1.478
37 H ILE 6 H ILE 6 8.134 -1.112 -0.469
38 HA ILE 6 HA ILE 6 7.577 0.709 -2.762
39 HB ILE 6 HB ILE 6 9.401 -1.695 -2.551
40 HG12 ILE 6 1HG1 ILE 6 10.111 -0.034 -0.929
41 HG13 ILE 6 2HG1 ILE 6 11.210 0.037 -2.304
42 HG21 ILE 6 1HG2 ILE 6 10.474 -0.715 -4.533
43 HG22 ILE 6 2HG2 ILE 6 9.289 0.593 -4.533
44 HG23 ILE 6 3HG2 ILE 6 8.775 -1.066 -4.843
45 HD11 ILE 6 3HD1 ILE 6 10.746 2.295 -1.907
46 HD12 ILE 6 1HD1 ILE 6 9.063 1.978 -1.490
47 HD13 ILE 6 2HD1 ILE 6 9.586 1.899 -3.173
48 H VAL 7 H VAL 7 5.909 0.174 -4.068
49 HA VAL 7 HA VAL 7 4.607 -2.435 -3.825
50 HB VAL 7 HB VAL 7 4.082 -0.054 -5.620
51 HG11 VAL 7 1HG1 VAL 7 1.838 -1.232 -5.921
52 HG12 VAL 7 2HG1 VAL 7 2.608 -2.668 -5.246
53 HG13 VAL 7 3HG1 VAL 7 3.206 -1.971 -6.751
54 HG21 VAL 7 3HG2 VAL 7 2.081 0.138 -4.068
55 HG22 VAL 7 1HG2 VAL 7 3.640 0.462 -3.310
56 HG23 VAL 7 2HG2 VAL 7 2.842 -1.091 -3.057
57 H ASN 8 H ASN 8 4.891 -4.156 -5.175
58 HA ASN 8 HA ASN 8 6.142 -3.743 -7.846
59 HB2 ASN 8 1HB ASN 8 8.015 -4.203 -6.291
60 HB3 ASN 8 2HB ASN 8 7.214 -5.686 -5.773
61 HD21 ASN 8 2HD2 ASN 8 9.839 -5.498 -7.146
62 HD22 ASN 8 1HD2 ASN 8 9.674 -6.356 -8.602
63 H VAL 9 H VAL 9 4.521 -4.622 -9.091
64 HA VAL 9 HA VAL 9 3.637 -7.409 -8.438
65 HB VAL 9 HB VAL 9 1.333 -6.784 -9.168
66 HG11 VAL 9 1HG1 VAL 9 2.204 -6.760 -6.730
67 HG12 VAL 9 2HG1 VAL 9 0.685 -5.937 -7.063
68 HG13 VAL 9 3HG1 VAL 9 2.170 -5.003 -6.876
69 HG21 VAL 9 3HG2 VAL 9 1.938 -4.794 -10.487
70 HG22 VAL 9 1HG2 VAL 9 2.467 -3.975 -9.018
71 HG23 VAL 9 2HG2 VAL 9 0.764 -4.375 -9.238
72 H SER 10 H SER 10 2.711 -8.521 -10.316
73 HA SER 10 HA SER 10 4.357 -8.294 -12.628
74 HB2 SER 10 1HB SER 10 3.334 -10.408 -12.169
75 HB3 SER 10 2HB SER 10 1.726 -9.690 -12.118
76 HG SER 10 HG SER 10 1.748 -9.463 -14.282
77 H SER 11 H SER 11 1.021 -7.195 -12.022
78 HA SER 11 HA SER 11 1.209 -5.509 -14.505
79 HB2 SER 11 1HB SER 11 -1.171 -6.961 -13.335
80 HB3 SER 11 2HB SER 11 -1.300 -5.746 -14.602
81 HG SER 11 HG SER 11 -0.622 -8.338 -14.788
82 H SER 12 H SER 12 -1.453 -5.448 -12.239
83 HA SER 12 HA SER 12 -0.516 -2.793 -11.186
84 HB2 SER 12 1HB SER 12 -3.232 -3.569 -12.261
85 HB3 SER 12 2HB SER 12 -2.979 -2.142 -11.263
86 HG SER 12 HG SER 12 -2.124 -2.711 -13.866
87 H LEU 13 H LEU 13 -1.431 -2.235 -9.096
88 HA LEU 13 HA LEU 13 -2.284 -4.628 -7.497
89 HB2 LEU 13 1HB LEU 13 -0.088 -3.750 -6.818
90 HB3 LEU 13 2HB LEU 13 -0.772 -2.139 -6.642
91 HG LEU 13 HG LEU 13 -2.219 -2.899 -4.828
92 HD11 LEU 13 1HD1 LEU 13 -1.657 -5.333 -3.970
93 HD12 LEU 13 2HD1 LEU 13 -1.165 -5.602 -5.643
94 HD13 LEU 13 3HD1 LEU 13 -2.819 -5.114 -5.277
95 HD21 LEU 13 3HD2 LEU 13 0.131 -2.211 -4.337
96 HD22 LEU 13 1HD2 LEU 13 0.614 -3.904 -4.422
97 HD23 LEU 13 2HD2 LEU 13 -0.499 -3.367 -3.164
98 H ASN 14 H ASN 14 -4.248 -4.491 -6.531
99 HA ASN 14 HA ASN 14 -5.827 -2.022 -6.879
100 HB2 ASN 14 1HB ASN 14 -6.480 -4.811 -5.929
101 HB3 ASN 14 2HB ASN 14 -7.654 -3.495 -5.860
102 HD21 ASN 14 2HD2 ASN 14 -8.107 -5.760 -7.547
103 HD22 ASN 14 1HD2 ASN 14 -8.004 -5.252 -9.164
104 H VAL 15 H VAL 15 -6.630 -0.784 -5.161
105 HA VAL 15 HA VAL 15 -5.163 -1.078 -2.598
106 HB VAL 15 HB VAL 15 -6.969 1.098 -3.691
107 HG11 VAL 15 1HG1 VAL 15 -6.030 2.393 -1.704
108 HG12 VAL 15 2HG1 VAL 15 -5.496 0.839 -1.061
109 HG13 VAL 15 3HG1 VAL 15 -7.215 1.147 -1.311
110 HG21 VAL 15 3HG2 VAL 15 -3.975 0.902 -3.246
111 HG22 VAL 15 1HG2 VAL 15 -4.816 2.375 -3.732
112 HG23 VAL 15 2HG2 VAL 15 -4.802 0.971 -4.801
113 H ARG 16 H ARG 16 -6.138 -1.851 -0.782
114 HA ARG 16 HA ARG 16 -9.077 -2.439 -0.903
115 HB2 ARG 16 1HB ARG 16 -6.818 -3.673 0.691
116 HB3 ARG 16 2HB ARG 16 -8.517 -4.089 0.915
117 HG2 ARG 16 1HG ARG 16 -8.675 -4.751 -1.452
118 HG3 ARG 16 2HG ARG 16 -6.978 -4.331 -1.688
119 HD2 ARG 16 1HD ARG 16 -7.957 -6.400 0.302
120 HD3 ARG 16 2HD ARG 16 -7.358 -6.781 -1.312
121 HE ARG 16 HE ARG 16 -5.719 -6.068 0.977
122 HH11 ARG 16 1HH2 ARG 16 -6.072 -5.937 -2.452
123 HH12 ARG 16 2HH2 ARG 16 -4.369 -5.856 -2.757
124 HH21 ARG 16 1HH1 ARG 16 -3.492 -5.965 0.596
125 HH22 ARG 16 2HH1 ARG 16 -2.909 -5.872 -1.032
126 H GLU 17 H GLU 17 -10.418 -1.539 0.623
127 HA GLU 17 HA GLU 17 -9.224 0.462 2.461
128 HB2 GLU 17 1HB GLU 17 -11.149 1.097 1.032
129 HB3 GLU 17 2HB GLU 17 -12.126 -0.144 1.818
130 HG2 GLU 17 1HG GLU 17 -11.876 0.970 3.974
131 HG3 GLU 17 2HG GLU 17 -10.800 2.171 3.256
132 H GLY 18 H GLY 18 -8.368 -0.949 4.095
133 HA2 GLY 18 1HA GLY 18 -9.284 -1.395 6.462
134 HA3 GLY 18 2HA GLY 18 -10.403 -2.500 5.667
135 H ALA 19 H ALA 19 -9.181 -3.901 7.339
136 HA ALA 19 HA ALA 19 -6.626 -4.970 6.204
137 HB1 ALA 19 3HB ALA 19 -6.251 -5.950 8.383
138 HB2 ALA 19 1HB ALA 19 -7.893 -5.551 8.894
139 HB3 ALA 19 2HB ALA 19 -6.714 -4.267 8.631
140 H SER 20 H SER 20 -9.330 -5.523 5.097
141 HA SER 20 HA SER 20 -9.296 -8.508 5.395
142 HB2 SER 20 1HB SER 20 -11.687 -6.664 5.463
143 HB3 SER 20 2HB SER 20 -11.830 -8.384 5.114
144 HG SER 20 HG SER 20 -10.697 -8.723 7.135
145 H THR 21 H THR 21 -9.833 -9.637 3.496
146 HA THR 21 HA THR 21 -9.163 -8.338 1.023
147 HB THR 21 HB THR 21 -9.862 -10.522 0.003
148 HG1 THR 21 HG1 THR 21 -10.142 -11.932 2.200
149 HG21 THR 21 3HG2 THR 21 -8.105 -10.617 2.468
150 HG22 THR 21 1HG2 THR 21 -7.591 -10.246 0.824
151 HG23 THR 21 2HG2 THR 21 -8.150 -11.870 1.227
152 H SER 22 H SER 22 -12.220 -9.070 2.602
153 HA SER 22 HA SER 22 -13.846 -8.540 0.246
154 HB2 SER 22 1HB SER 22 -14.650 -9.942 2.135
155 HB3 SER 22 2HB SER 22 -14.617 -8.525 3.181
156 HG SER 22 HG SER 22 -16.175 -8.929 0.841
157 H SER 23 H SER 23 -11.884 -6.514 1.804
158 HA SER 23 HA SER 23 -13.540 -4.273 2.484
159 HB2 SER 23 1HB SER 23 -10.632 -4.553 1.755
160 HB3 SER 23 2HB SER 23 -11.340 -2.975 2.081
161 HG SER 23 HG SER 23 -11.482 -5.228 3.809
162 H LYS 24 H LYS 24 -14.033 -2.403 1.281
163 HA LYS 24 HA LYS 24 -14.602 -2.837 -1.522
164 HB2 LYS 24 1HB LYS 24 -14.741 -0.374 0.229
165 HB3 LYS 24 2HB LYS 24 -15.310 -0.425 -1.440
166 HG2 LYS 24 1HG LYS 24 -16.893 -2.190 -0.893
167 HG3 LYS 24 2HG LYS 24 -16.265 -2.286 0.750
168 HD2 LYS 24 1HD LYS 24 -18.215 -0.957 0.952
169 HD3 LYS 24 2HD LYS 24 -16.891 0.206 0.954
170 HE2 LYS 24 1HE LYS 24 -17.285 0.783 -1.345
171 HE3 LYS 24 2HE LYS 24 -18.400 -0.567 -1.559
172 HZ1 LYS 24 3HZ LYS 24 -19.822 0.477 0.155
173 HZ2 LYS 24 1HZ LYS 24 -19.662 1.408 -1.253
174 HZ3 LYS 24 2HZ LYS 24 -18.792 1.829 0.143
175 H VAL 25 H VAL 25 -13.574 -1.986 -3.327
176 HA VAL 25 HA VAL 25 -10.775 -1.137 -2.956
177 HB VAL 25 HB VAL 25 -12.348 -1.434 -5.528
178 HG11 VAL 25 1HG1 VAL 25 -10.173 -1.667 -6.556
179 HG12 VAL 25 2HG1 VAL 25 -9.377 -1.678 -4.982
180 HG13 VAL 25 3HG1 VAL 25 -10.146 -0.205 -5.573
181 HG21 VAL 25 3HG2 VAL 25 -12.499 -3.527 -4.327
182 HG22 VAL 25 1HG2 VAL 25 -10.789 -3.462 -3.901
183 HG23 VAL 25 2HG2 VAL 25 -11.270 -3.720 -5.578
184 H ILE 26 H ILE 26 -10.146 0.971 -2.992
185 HA ILE 26 HA ILE 26 -12.143 3.032 -3.854
186 HB ILE 26 HB ILE 26 -10.719 4.580 -2.468
187 HG12 ILE 26 1HG1 ILE 26 -9.472 1.985 -1.513
188 HG13 ILE 26 2HG1 ILE 26 -8.673 3.111 -2.610
189 HG21 ILE 26 1HG2 ILE 26 -11.564 3.710 -0.317
190 HG22 ILE 26 2HG2 ILE 26 -11.852 2.139 -1.063
191 HG23 ILE 26 3HG2 ILE 26 -12.781 3.545 -1.581
192 HD11 ILE 26 3HD1 ILE 26 -8.762 4.879 -0.939
193 HD12 ILE 26 1HD1 ILE 26 -8.025 3.450 -0.215
194 HD13 ILE 26 2HD1 ILE 26 -9.703 3.853 0.143
195 H GLY 27 H GLY 27 -9.424 1.466 -4.982
196 HA2 GLY 27 1HA GLY 27 -9.089 2.981 -7.290
197 HA3 GLY 27 2HA GLY 27 -8.014 3.748 -6.122
198 H SER 28 H SER 28 -6.658 2.798 -8.131
199 HA SER 28 HA SER 28 -5.440 0.246 -7.152
200 HB2 SER 28 1HB SER 28 -6.139 0.973 -10.004
201 HB3 SER 28 2HB SER 28 -5.047 -0.341 -9.581
202 HG SER 28 HG SER 28 -6.798 -1.469 -9.345
203 H LEU 29 H LEU 29 -3.159 0.080 -7.607
204 HA LEU 29 HA LEU 29 -1.852 2.668 -8.410
205 HB2 LEU 29 1HB LEU 29 -0.945 0.702 -6.287
206 HB3 LEU 29 2HB LEU 29 -0.093 2.172 -6.757
207 HG LEU 29 HG LEU 29 -2.901 2.076 -5.608
208 HD11 LEU 29 1HD1 LEU 29 -1.963 2.835 -3.554
209 HD12 LEU 29 2HD1 LEU 29 -0.399 3.157 -4.301
210 HD13 LEU 29 3HD1 LEU 29 -0.939 1.494 -4.065
211 HD21 LEU 29 3HD2 LEU 29 -2.241 4.631 -5.326
212 HD22 LEU 29 1HD2 LEU 29 -2.871 4.049 -6.865
213 HD23 LEU 29 2HD2 LEU 29 -1.135 4.284 -6.655
214 H SER 30 H SER 30 0.003 2.491 -9.668
215 HA SER 30 HA SER 30 0.210 0.040 -11.239
216 HB2 SER 30 1HB SER 30 0.444 2.127 -12.403
217 HB3 SER 30 2HB SER 30 1.712 2.663 -11.305
218 HG SER 30 HG SER 30 1.776 0.601 -13.240
219 H GLY 31 H GLY 31 2.346 -1.007 -11.639
220 HA2 GLY 31 1HA GLY 31 3.560 -1.882 -9.188
221 HA3 GLY 31 2HA GLY 31 4.153 -2.247 -10.806
222 H ASN 32 H ASN 32 5.885 -1.687 -8.653
223 HA ASN 32 HA ASN 32 7.712 -0.346 -8.074
224 HB2 ASN 32 1HB ASN 32 7.304 0.460 -10.968
225 HB3 ASN 32 2HB ASN 32 8.658 1.035 -9.994
226 HD21 ASN 32 2HD2 ASN 32 9.095 -0.627 -12.292
227 HD22 ASN 32 1HD2 ASN 32 9.686 -2.126 -11.760
228 H THR 33 H THR 33 5.014 0.646 -7.526
229 HA THR 33 HA THR 33 5.340 3.600 -7.812
230 HB THR 33 HB THR 33 2.994 1.887 -6.941
231 HG1 THR 33 HG1 THR 33 3.285 3.638 -9.143
232 HG21 THR 33 3HG2 THR 33 1.776 4.134 -7.071
233 HG22 THR 33 1HG2 THR 33 3.373 4.882 -7.030
234 HG23 THR 33 2HG2 THR 33 2.828 3.897 -5.673
235 H LYS 34 H LYS 34 6.090 4.734 -6.097
236 HA LYS 34 HA LYS 34 6.650 3.373 -3.569
237 HB2 LYS 34 1HB LYS 34 8.168 5.078 -4.566
238 HB3 LYS 34 2HB LYS 34 6.927 6.302 -4.310
239 HG2 LYS 34 1HG LYS 34 6.988 5.849 -1.885
240 HG3 LYS 34 2HG LYS 34 8.234 4.631 -2.161
241 HD2 LYS 34 1HD LYS 34 8.581 7.496 -3.068
242 HD3 LYS 34 2HD LYS 34 9.039 7.000 -1.448
243 HE2 LYS 34 1HE LYS 34 10.441 5.161 -2.580
244 HE3 LYS 34 2HE LYS 34 10.181 6.054 -4.079
245 HZ1 LYS 34 3HZ LYS 34 11.333 7.204 -1.602
246 HZ2 LYS 34 1HZ LYS 34 11.147 7.997 -3.089
247 HZ3 LYS 34 2HZ LYS 34 12.233 6.697 -2.952
248 H VAL 35 H VAL 35 5.389 3.443 -1.743
249 HA VAL 35 HA VAL 35 3.149 5.451 -1.653
250 HB VAL 35 HB VAL 35 1.826 3.658 -0.457
251 HG11 VAL 35 1HG1 VAL 35 1.133 2.578 -2.530
252 HG12 VAL 35 2HG1 VAL 35 2.664 2.997 -3.297
253 HG13 VAL 35 3HG1 VAL 35 1.517 4.266 -2.867
254 HG21 VAL 35 3HG2 VAL 35 2.566 1.308 -0.909
255 HG22 VAL 35 1HG2 VAL 35 3.661 2.175 0.169
256 HG23 VAL 35 2HG2 VAL 35 4.092 1.940 -1.525
257 H THR 36 H THR 36 3.070 6.591 0.181
258 HA THR 36 HA THR 36 5.150 6.270 2.182
259 HB THR 36 HB THR 36 4.170 8.245 3.207
260 HG1 THR 36 HG1 THR 36 2.132 8.707 2.957
261 HG21 THR 36 3HG2 THR 36 5.431 8.461 1.029
262 HG22 THR 36 1HG2 THR 36 4.298 9.773 1.349
263 HG23 THR 36 2HG2 THR 36 3.873 8.501 0.205
264 H ILE 37 H ILE 37 5.004 5.284 4.136
265 HA ILE 37 HA ILE 37 2.367 4.086 4.923
266 HB ILE 37 HB ILE 37 5.209 3.203 5.492
267 HG12 ILE 37 1HG1 ILE 37 2.941 1.773 4.075
268 HG13 ILE 37 2HG1 ILE 37 4.175 2.712 3.233
269 HG21 ILE 37 1HG2 ILE 37 3.989 1.225 6.581
270 HG22 ILE 37 2HG2 ILE 37 2.555 2.253 6.589
271 HG23 ILE 37 3HG2 ILE 37 3.992 2.738 7.487
272 HD11 ILE 37 3HD1 ILE 37 4.602 0.192 3.428
273 HD12 ILE 37 1HD1 ILE 37 4.887 0.481 5.143
274 HD13 ILE 37 2HD1 ILE 37 5.918 1.250 3.937
275 H VAL 38 H VAL 38 1.483 4.808 6.767
276 HA VAL 38 HA VAL 38 3.170 6.438 8.638
277 HB VAL 38 HB VAL 38 1.049 7.542 9.281
278 HG11 VAL 38 1HG1 VAL 38 0.612 8.619 6.996
279 HG12 VAL 38 2HG1 VAL 38 1.800 7.486 6.350
280 HG13 VAL 38 3HG1 VAL 38 2.278 8.667 7.570
281 HG21 VAL 38 3HG2 VAL 38 -0.939 7.108 7.772
282 HG22 VAL 38 1HG2 VAL 38 -0.538 5.774 8.854
283 HG23 VAL 38 2HG2 VAL 38 -0.077 5.699 7.153
284 H GLY 39 H GLY 39 1.776 3.443 8.293
285 HA2 GLY 39 1HA GLY 39 2.185 2.697 11.019
286 HA3 GLY 39 2HA GLY 39 0.463 3.002 10.788
287 H GLU 40 H GLU 40 0.789 0.512 11.423
288 HA GLU 40 HA GLU 40 0.495 -1.002 8.872
289 HB2 GLU 40 1HB GLU 40 1.868 -2.856 9.785
290 HB3 GLU 40 2HB GLU 40 2.815 -1.386 9.561
291 HG2 GLU 40 1HG GLU 40 2.550 -0.846 11.958
292 HG3 GLU 40 2HG GLU 40 1.604 -2.318 12.186
293 H GLU 41 H GLU 41 -0.670 -3.062 9.207
294 HA GLU 41 HA GLU 41 -1.923 -3.500 11.837
295 HB2 GLU 41 1HB GLU 41 -3.372 -1.763 10.800
296 HB3 GLU 41 2HB GLU 41 -3.628 -2.828 9.418
297 HG2 GLU 41 1HG GLU 41 -4.643 -4.520 10.882
298 HG3 GLU 41 2HG GLU 41 -4.343 -3.500 12.289
299 H GLY 42 H GLY 42 -1.617 -5.655 12.030
300 HA2 GLY 42 1HA GLY 42 -1.655 -7.944 11.529
301 HA3 GLY 42 2HA GLY 42 -2.925 -7.559 10.370
302 H ALA 43 H ALA 43 -2.241 -8.813 8.668
303 HA ALA 43 HA ALA 43 0.560 -8.688 7.741
304 HB1 ALA 43 3HB ALA 43 -1.896 -10.209 6.850
305 HB2 ALA 43 1HB ALA 43 -0.411 -10.854 7.551
306 HB3 ALA 43 2HB ALA 43 -0.408 -10.221 5.905
307 H PHE 44 H PHE 44 -1.323 -6.326 7.651
308 HA PHE 44 HA PHE 44 -1.024 -5.715 4.727
309 HB2 PHE 44 1HB PHE 44 -3.316 -4.983 6.571
310 HB3 PHE 44 2HB PHE 44 -3.109 -4.345 4.940
311 HD1 PHE 44 HD1 PHE 44 -3.339 -5.800 2.976
312 HD2 PHE 44 HD2 PHE 44 -3.961 -7.296 6.953
313 HE1 PHE 44 HE1 PHE 44 -4.423 -7.826 2.044
314 HE2 PHE 44 HE2 PHE 44 -5.046 -9.322 6.023
315 HZ PHE 44 HZ PHE 44 -5.277 -9.588 3.568
316 H TYR 45 H TYR 45 -0.385 -3.575 4.283
317 HA TYR 45 HA TYR 45 0.681 -2.068 6.639
318 HB2 TYR 45 1HB TYR 45 1.413 -2.072 3.705
319 HB3 TYR 45 2HB TYR 45 2.001 -0.843 4.824
320 HD1 TYR 45 HD2 TYR 45 2.936 -1.845 7.132
321 HD2 TYR 45 HD1 TYR 45 2.767 -3.963 3.395
322 HE1 TYR 45 HE2 TYR 45 4.702 -3.387 7.928
323 HE2 TYR 45 HE1 TYR 45 4.540 -5.501 4.195
324 HH TYR 45 HH TYR 45 5.498 -6.288 6.256
325 H LYS 46 H LYS 46 0.116 0.056 6.967
326 HA LYS 46 HA LYS 46 -2.318 0.997 5.560
327 HB2 LYS 46 1HB LYS 46 -2.155 1.056 8.049
328 HB3 LYS 46 2HB LYS 46 -0.809 2.184 7.911
329 HG2 LYS 46 1HG LYS 46 -2.293 3.761 6.686
330 HG3 LYS 46 2HG LYS 46 -3.638 2.649 6.923
331 HD2 LYS 46 1HD LYS 46 -2.013 3.776 9.215
332 HD3 LYS 46 2HD LYS 46 -3.472 4.554 8.609
333 HE2 LYS 46 1HE LYS 46 -4.649 2.304 8.996
334 HE3 LYS 46 2HE LYS 46 -3.216 1.835 9.911
335 HZ1 LYS 46 3HZ LYS 46 -4.366 4.427 10.545
336 HZ2 LYS 46 1HZ LYS 46 -3.683 3.260 11.568
337 HZ3 LYS 46 2HZ LYS 46 -5.275 3.069 11.006
338 H ILE 47 H ILE 47 -2.173 2.532 3.963
339 HA ILE 47 HA ILE 47 0.285 4.248 3.850
340 HB ILE 47 HB ILE 47 0.053 4.085 1.323
341 HG12 ILE 47 1HG1 ILE 47 -1.577 1.623 2.011
342 HG13 ILE 47 2HG1 ILE 47 -2.299 3.136 1.461
343 HG21 ILE 47 1HG2 ILE 47 1.861 2.925 2.351
344 HG22 ILE 47 2HG2 ILE 47 1.085 1.739 1.303
345 HG23 ILE 47 3HG2 ILE 47 0.787 1.707 3.040
346 HD11 ILE 47 3HD1 ILE 47 -0.956 3.029 -0.608
347 HD12 ILE 47 1HD1 ILE 47 -1.956 1.586 -0.430
348 HD13 ILE 47 2HD1 ILE 47 -0.234 1.516 -0.058
349 H GLU 48 H GLU 48 -0.055 6.322 2.887
350 HA GLU 48 HA GLU 48 -2.755 7.362 3.392
351 HB2 GLU 48 1HB GLU 48 -0.659 8.596 4.026
352 HB3 GLU 48 2HB GLU 48 -0.310 8.793 2.310
353 HG2 GLU 48 1HG GLU 48 -1.399 10.807 3.055
354 HG3 GLU 48 2HG GLU 48 -2.561 9.919 2.073
355 H TYR 49 H TYR 49 -4.251 7.048 1.803
356 HA TYR 49 HA TYR 49 -3.377 7.242 -1.059
357 HB2 TYR 49 1HB TYR 49 -4.495 5.129 -0.379
358 HB3 TYR 49 2HB TYR 49 -5.909 6.057 0.120
359 HD1 TYR 49 HD2 TYR 49 -3.807 5.088 -2.778
360 HD2 TYR 49 HD1 TYR 49 -7.457 6.945 -1.482
361 HE1 TYR 49 HE2 TYR 49 -4.640 5.082 -5.113
362 HE2 TYR 49 HE1 TYR 49 -8.289 6.939 -3.817
363 HH TYR 49 HH TYR 49 -6.229 5.866 -6.496
364 H LYS 50 H LYS 50 -3.797 9.187 -1.962
365 HA LYS 50 HA LYS 50 -4.759 11.325 -2.257
366 HB2 LYS 50 1HB LYS 50 -7.291 9.689 -1.957
367 HB3 LYS 50 2HB LYS 50 -7.131 11.219 -2.811
368 HG2 LYS 50 1HG LYS 50 -5.598 8.718 -3.569
369 HG3 LYS 50 2HG LYS 50 -7.145 9.154 -4.285
370 HD2 LYS 50 1HD LYS 50 -6.133 11.345 -4.992
371 HD3 LYS 50 2HD LYS 50 -4.575 10.759 -4.410
372 HE2 LYS 50 1HE LYS 50 -4.652 8.881 -5.959
373 HE3 LYS 50 2HE LYS 50 -6.255 9.372 -6.510
374 HZ1 LYS 50 3HZ LYS 50 -5.311 11.469 -7.258
375 HZ2 LYS 50 1HZ LYS 50 -4.551 10.155 -8.017
376 HZ3 LYS 50 2HZ LYS 50 -3.767 10.972 -6.751
377 H GLY 51 H GLY 51 -7.474 10.223 -0.292
378 HA2 GLY 51 1HA GLY 51 -6.676 12.192 1.833
379 HA3 GLY 51 2HA GLY 51 -8.338 12.016 1.274
380 H SER 52 H SER 52 -8.228 9.120 1.039
381 HA SER 52 HA SER 52 -8.618 8.475 3.901
382 HB2 SER 52 1HB SER 52 -9.488 6.292 2.936
383 HB3 SER 52 2HB SER 52 -10.383 7.736 2.467
384 HG SER 52 HG SER 52 -9.972 7.088 0.510
385 H HIS 53 H HIS 53 -7.828 6.240 4.602
386 HA HIS 53 HA HIS 53 -4.951 5.993 3.870
387 HB2 HIS 53 1HB HIS 53 -6.595 4.891 6.168
388 HB3 HIS 53 2HB HIS 53 -4.887 4.518 5.923
389 HD1 HIS 53 HD1 HIS 53 -7.188 7.219 7.064
390 HD2 HIS 53 HD2 HIS 53 -3.126 6.786 6.233
391 HE1 HIS 53 HE1 HIS 53 -6.041 9.272 8.006
392 H GLY 54 H GLY 54 -4.506 4.532 2.300
393 HA2 GLY 54 1HA GLY 54 -6.394 2.350 1.700
394 HA3 GLY 54 2HA GLY 54 -4.947 2.749 0.780
395 H TYR 55 H TYR 55 -5.791 0.118 1.713
396 HA TYR 55 HA TYR 55 -3.489 -0.570 3.523
397 HB2 TYR 55 1HB TYR 55 -6.213 -1.875 3.263
398 HB3 TYR 55 2HB TYR 55 -4.885 -2.525 4.228
399 HD1 TYR 55 HD1 TYR 55 -7.183 0.362 3.826
400 HD2 TYR 55 HD2 TYR 55 -4.320 -1.596 6.356
401 HE1 TYR 55 HE1 TYR 55 -7.813 1.863 5.696
402 HE2 TYR 55 HE2 TYR 55 -4.945 -0.094 8.227
403 HH TYR 55 HH TYR 55 -6.902 1.276 8.904
404 H VAL 56 H VAL 56 -2.129 -2.183 2.776
405 HA VAL 56 HA VAL 56 -2.941 -3.699 0.326
406 HB VAL 56 HB VAL 56 -0.622 -3.331 -0.564
407 HG11 VAL 56 1HG1 VAL 56 -2.575 -2.023 -1.363
408 HG12 VAL 56 2HG1 VAL 56 -1.090 -1.072 -1.403
409 HG13 VAL 56 3HG1 VAL 56 -2.263 -0.820 -0.111
410 HG21 VAL 56 3HG2 VAL 56 0.572 -1.306 0.377
411 HG22 VAL 56 1HG2 VAL 56 0.547 -2.698 1.460
412 HG23 VAL 56 2HG2 VAL 56 -0.551 -1.347 1.733
413 H ALA 57 H ALA 57 -1.858 -5.709 0.094
414 HA ALA 57 HA ALA 57 -1.198 -6.983 2.617
415 HB1 ALA 57 3HB ALA 57 -1.069 -9.005 1.354
416 HB2 ALA 57 1HB ALA 57 -0.790 -8.125 -0.149
417 HB3 ALA 57 2HB ALA 57 -2.369 -8.057 0.632
418 H LYS 58 H LYS 58 0.809 -7.819 3.275
419 HA LYS 58 HA LYS 58 3.149 -6.331 2.441
420 HB2 LYS 58 1HB LYS 58 4.358 -7.813 4.011
421 HB3 LYS 58 2HB LYS 58 2.895 -7.163 4.751
422 HG2 LYS 58 1HG LYS 58 1.696 -9.254 4.176
423 HG3 LYS 58 2HG LYS 58 3.186 -9.912 3.498
424 HD2 LYS 58 1HD LYS 58 4.296 -9.687 5.686
425 HD3 LYS 58 2HD LYS 58 2.816 -9.016 6.371
426 HE2 LYS 58 1HE LYS 58 2.711 -11.295 6.969
427 HE3 LYS 58 2HE LYS 58 1.689 -11.204 5.535
428 HZ1 LYS 58 3HZ LYS 58 4.159 -11.612 4.507
429 HZ2 LYS 58 1HZ LYS 58 2.991 -12.818 4.751
430 HZ3 LYS 58 2HZ LYS 58 4.196 -12.555 5.919
431 H GLU 59 H GLU 59 1.587 -9.105 1.250
432 HA GLU 59 HA GLU 59 3.824 -10.612 0.281
433 HB2 GLU 59 1HB GLU 59 0.972 -10.397 -0.708
434 HB3 GLU 59 2HB GLU 59 2.136 -11.569 -1.325
435 HG2 GLU 59 1HG GLU 59 2.402 -12.530 0.899
436 HG3 GLU 59 2HG GLU 59 1.327 -11.309 1.583
437 H TYR 60 H TYR 60 1.965 -7.935 -1.136
438 HA TYR 60 HA TYR 60 3.655 -8.048 -3.586
439 HB2 TYR 60 1HB TYR 60 1.295 -6.285 -2.883
440 HB3 TYR 60 2HB TYR 60 2.087 -6.361 -4.454
441 HD1 TYR 60 HD2 TYR 60 2.284 -8.762 -5.521
442 HD2 TYR 60 HD1 TYR 60 -0.522 -7.702 -2.446
443 HE1 TYR 60 HE2 TYR 60 0.876 -10.710 -6.133
444 HE2 TYR 60 HE1 TYR 60 -1.926 -9.650 -3.056
445 HH TYR 60 HH TYR 60 -2.211 -11.062 -5.362
446 H ILE 61 H ILE 61 3.695 -6.533 -0.570
447 HA ILE 61 HA ILE 61 5.180 -4.143 -1.622
448 HB ILE 61 HB ILE 61 3.571 -4.666 0.869
449 HG12 ILE 61 1HG1 ILE 61 2.568 -2.525 0.290
450 HG13 ILE 61 2HG1 ILE 61 3.779 -2.263 -0.960
451 HG21 ILE 61 1HG2 ILE 61 5.504 -3.838 1.935
452 HG22 ILE 61 2HG2 ILE 61 4.545 -2.384 1.666
453 HG23 ILE 61 3HG2 ILE 61 5.891 -2.761 0.593
454 HD11 ILE 61 3HD1 ILE 61 1.432 -3.189 -1.643
455 HD12 ILE 61 1HD1 ILE 61 2.055 -4.728 -1.051
456 HD13 ILE 61 2HD1 ILE 61 2.872 -3.886 -2.371
457 H LYS 62 H LYS 62 7.353 -4.084 -1.297
458 HA LYS 62 HA LYS 62 8.551 -5.619 0.945
459 HB2 LYS 62 1HB LYS 62 10.150 -6.754 -0.485
460 HB3 LYS 62 2HB LYS 62 8.521 -7.141 -1.037
461 HG2 LYS 62 1HG LYS 62 8.714 -5.355 -2.767
462 HG3 LYS 62 2HG LYS 62 10.381 -5.074 -2.258
463 HD2 LYS 62 1HD LYS 62 10.823 -7.527 -2.695
464 HD3 LYS 62 2HD LYS 62 9.232 -7.601 -3.454
465 HE2 LYS 62 1HE LYS 62 11.425 -5.676 -4.274
466 HE3 LYS 62 2HE LYS 62 11.085 -7.202 -5.091
467 HZ1 LYS 62 3HZ LYS 62 8.878 -5.324 -4.654
468 HZ2 LYS 62 1HZ LYS 62 9.117 -6.436 -5.912
469 HZ3 LYS 62 2HZ LYS 62 9.996 -4.982 -5.887
470 H ASP 63 H ASP 63 11.113 -5.222 0.705
471 HA ASP 63 HA ASP 63 12.816 -3.634 0.886
472 HB2 ASP 63 1HB ASP 63 12.250 -3.419 -1.603
473 HB3 ASP 63 2HB ASP 63 11.295 -2.011 -1.165
474 H ILE 64 H ILE 64 10.865 -3.471 2.822
475 HA ILE 64 HA ILE 64 9.808 -0.765 3.065
476 HB ILE 64 HB ILE 64 10.107 -3.013 5.073
477 HG12 ILE 64 1HG1 ILE 64 7.644 -1.952 3.664
478 HG13 ILE 64 2HG1 ILE 64 8.576 -3.331 3.081
479 HG21 ILE 64 1HG2 ILE 64 10.006 -0.971 6.320
480 HG22 ILE 64 2HG2 ILE 64 8.375 -1.642 6.342
481 HG23 ILE 64 3HG2 ILE 64 8.766 -0.307 5.256
482 HD11 ILE 64 3HD1 ILE 64 8.214 -4.467 5.261
483 HD12 ILE 64 1HD1 ILE 64 6.696 -4.118 4.434
484 HD13 ILE 64 2HD1 ILE 64 7.218 -3.107 5.781
485 H LYS 65 H LYS 65 10.844 0.978 3.923
486 HA LYS 65 HA LYS 65 13.579 0.557 5.073
487 HB2 LYS 65 1HB LYS 65 12.288 2.962 3.763
488 HB3 LYS 65 2HB LYS 65 13.893 2.977 4.495
489 HG2 LYS 65 1HG LYS 65 14.646 1.229 2.959
490 HG3 LYS 65 2HG LYS 65 13.031 1.119 2.260
491 HD2 LYS 65 1HD LYS 65 14.429 2.498 0.815
492 HD3 LYS 65 2HD LYS 65 13.203 3.512 1.574
493 HE2 LYS 65 1HE LYS 65 15.858 3.219 2.952
494 HE3 LYS 65 2HE LYS 65 15.750 4.271 1.544
495 HZ1 LYS 65 3HZ LYS 65 14.880 5.805 2.852
496 HZ2 LYS 65 1HZ LYS 65 14.850 4.745 4.175
497 HZ3 LYS 65 2HZ LYS 65 13.529 4.807 3.108
498 H ASP 66 H ASP 66 14.134 1.529 7.021
499 HA ASP 66 HA ASP 66 11.980 1.980 8.911
500 HB2 ASP 66 1HB ASP 66 14.981 2.290 9.073
501 HB3 ASP 66 2HB ASP 66 13.914 2.609 10.440
502 H GLU 67 H GLU 67 11.446 3.941 9.959
503 HA GLU 67 HA GLU 67 11.388 6.276 8.334
504 HB2 GLU 67 1HB GLU 67 9.815 5.766 10.225
505 HB3 GLU 67 2HB GLU 67 11.114 6.148 11.350
506 HG2 GLU 67 1HG GLU 67 9.780 8.137 11.113
507 HG3 GLU 67 2HG GLU 67 11.280 8.421 10.231
508 H VAL 68 H VAL 68 12.877 6.396 11.551
509 HA VAL 68 HA VAL 68 14.880 8.290 10.537
510 HB VAL 68 HB VAL 68 15.550 8.472 12.902
511 HG11 VAL 68 1HG1 VAL 68 12.532 8.425 12.648
512 HG12 VAL 68 2HG1 VAL 68 13.543 9.689 11.948
513 HG13 VAL 68 3HG1 VAL 68 13.501 9.460 13.696
514 HG21 VAL 68 3HG2 VAL 68 14.111 7.182 14.566
515 HG22 VAL 68 1HG2 VAL 68 15.290 6.213 13.681
516 HG23 VAL 68 2HG2 VAL 68 13.590 6.180 13.213
517 H LEU 69 H LEU 69 16.957 7.824 10.072
518 HA LEU 69 HA LEU 69 17.840 5.009 10.200
519 HB2 LEU 69 1HB LEU 69 18.885 7.527 8.902
520 HB3 LEU 69 2HB LEU 69 19.912 6.098 9.032
521 HG LEU 69 HG LEU 69 18.287 4.763 7.805
522 HD11 LEU 69 1HD1 LEU 69 16.290 6.003 6.799
523 HD12 LEU 69 2HD1 LEU 69 16.623 7.287 7.960
524 HD13 LEU 69 3HD1 LEU 69 16.195 5.672 8.528
525 HD21 LEU 69 3HD2 LEU 69 19.871 5.992 6.433
526 HD22 LEU 69 1HD2 LEU 69 18.877 7.445 6.519
527 HD23 LEU 69 2HD2 LEU 69 18.299 6.034 5.634
528 H GLU 70 H GLU 70 17.898 7.591 12.282
529 HA GLU 70 HA GLU 70 20.630 7.340 13.268
530 HB2 GLU 70 1HB GLU 70 18.153 8.641 14.420
531 HB3 GLU 70 2HB GLU 70 19.742 8.715 15.187
532 HG2 GLU 70 1HG GLU 70 20.684 9.791 13.208
533 HG3 GLU 70 2HG GLU 70 19.141 9.650 12.365
534 H HIS 71 H HIS 71 21.372 6.010 14.843
535 HA HIS 71 HA HIS 71 19.445 4.075 16.070
536 HB2 HIS 71 1HB HIS 71 22.453 3.941 15.696
537 HB3 HIS 71 2HB HIS 71 21.488 2.705 16.503
538 HD1 HIS 71 HD1 HIS 71 19.380 1.806 14.913
539 HD2 HIS 71 HD2 HIS 71 22.671 3.488 12.983
540 HE1 HIS 71 HE1 HIS 71 19.263 1.044 12.501
541 H HIS 72 H HIS 72 20.472 6.946 16.849
542 HA HIS 72 HA HIS 72 20.952 8.086 18.834
543 HB2 HIS 72 1HB HIS 72 19.761 5.563 20.029
544 HB3 HIS 72 2HB HIS 72 20.048 7.064 20.909
545 HD1 HIS 72 HD1 HIS 72 18.732 9.221 19.974
546 HD2 HIS 72 HD2 HIS 72 17.382 5.532 18.578
547 HE1 HIS 72 HE1 HIS 72 16.443 9.629 18.972
548 H HIS 73 H HIS 73 22.680 5.535 17.833
549 HA HIS 73 HA HIS 73 24.718 5.939 19.967
550 HB2 HIS 73 1HB HIS 73 23.415 3.837 20.466
551 HB3 HIS 73 2HB HIS 73 23.965 3.195 18.919
552 HD1 HIS 73 HD1 HIS 73 26.523 2.699 18.669
553 HD2 HIS 73 HD2 HIS 73 25.390 3.908 22.494
554 HE1 HIS 73 HE1 HIS 73 28.484 2.193 20.188
555 H HIS 74 H HIS 74 26.476 6.647 18.878
556 HA HIS 74 HA HIS 74 27.611 5.113 16.695
557 HB2 HIS 74 1HB HIS 74 25.818 6.372 15.491
558 HB3 HIS 74 2HB HIS 74 26.561 7.879 16.025
559 HD1 HIS 74 HD1 HIS 74 27.635 4.707 14.180
560 HD2 HIS 74 HD2 HIS 74 28.465 8.792 14.242
561 HE1 HIS 74 HE1 HIS 74 29.325 5.122 12.340
562 H HIS 75 H HIS 75 29.337 5.209 18.247
563 HA HIS 75 HA HIS 75 30.472 7.654 19.224
564 HB2 HIS 75 1HB HIS 75 30.890 5.410 20.222
565 HB3 HIS 75 2HB HIS 75 31.820 4.975 18.788
566 HD1 HIS 75 HD1 HIS 75 34.065 6.323 18.379
567 HD2 HIS 75 HD2 HIS 75 32.260 7.013 22.072
568 HE1 HIS 75 HE1 HIS 75 35.810 7.447 19.828
569 H HIS 76 H HIS 76 31.264 5.606 16.432
570 HA HIS 76 HA HIS 76 33.573 6.967 15.536
571 HB2 HIS 76 1HB HIS 76 32.643 4.812 14.619
572 HB3 HIS 76 2HB HIS 76 31.422 5.764 13.777
573 HD1 HIS 76 HD1 HIS 76 32.282 7.406 11.897
574 HD2 HIS 76 HD2 HIS 76 35.199 4.861 13.445
575 HE1 HIS 76 HE1 HIS 76 34.230 7.481 10.279
Start of MODEL 19
1 H1 ALA 1 1H ALA 1 6.800 9.960 11.557
2 H2 ALA 1 2H ALA 1 6.807 9.203 13.079
3 H3 ALA 1 3H ALA 1 5.583 8.849 11.953
4 HA ALA 1 HA ALA 1 8.465 8.241 11.577
5 HB1 ALA 1 3HB ALA 1 7.416 6.871 13.356
6 HB2 ALA 1 1HB ALA 1 7.790 5.900 11.933
7 HB3 ALA 1 2HB ALA 1 6.131 6.415 12.236
8 H GLU 2 H GLU 2 8.525 8.911 9.417
9 HA GLU 2 HA GLU 2 6.393 8.057 7.564
10 HB2 GLU 2 1HB GLU 2 7.545 10.320 7.450
11 HB3 GLU 2 2HB GLU 2 8.990 9.470 6.905
12 HG2 GLU 2 1HG GLU 2 6.317 9.148 5.520
13 HG3 GLU 2 2HG GLU 2 7.465 10.406 5.070
14 H LYS 3 H LYS 3 6.541 6.320 6.230
15 HA LYS 3 HA LYS 3 9.208 5.051 5.789
16 HB2 LYS 3 1HB LYS 3 6.673 3.625 6.639
17 HB3 LYS 3 2HB LYS 3 8.152 2.824 6.119
18 HG2 LYS 3 1HG LYS 3 8.603 2.830 8.384
19 HG3 LYS 3 2HG LYS 3 9.205 4.445 8.031
20 HD2 LYS 3 1HD LYS 3 7.773 4.885 9.821
21 HD3 LYS 3 2HD LYS 3 6.693 5.165 8.455
22 HE2 LYS 3 1HE LYS 3 5.806 2.882 8.663
23 HE3 LYS 3 2HE LYS 3 6.919 2.559 9.990
24 HZ1 LYS 3 3HZ LYS 3 4.776 3.148 10.856
25 HZ2 LYS 3 1HZ LYS 3 4.757 4.588 9.959
26 HZ3 LYS 3 2HZ LYS 3 5.880 4.389 11.218
27 H THR 4 H THR 4 9.334 3.874 3.813
28 HA THR 4 HA THR 4 7.072 4.397 1.903
29 HB THR 4 HB THR 4 8.801 4.642 0.152
30 HG1 THR 4 HG1 THR 4 10.722 3.981 0.615
31 HG21 THR 4 3HG2 THR 4 9.479 6.857 0.767
32 HG22 THR 4 1HG2 THR 4 9.395 6.470 2.487
33 HG23 THR 4 2HG2 THR 4 7.915 6.581 1.536
34 H GLY 5 H GLY 5 6.413 2.706 0.691
35 HA2 GLY 5 1HA GLY 5 7.911 0.111 0.950
36 HA3 GLY 5 2HA GLY 5 6.150 0.215 0.918
37 H ILE 6 H ILE 6 8.518 -0.806 -0.955
38 HA ILE 6 HA ILE 6 7.778 0.550 -3.466
39 HB ILE 6 HB ILE 6 9.645 -1.771 -2.877
40 HG12 ILE 6 1HG1 ILE 6 10.145 0.692 -2.089
41 HG13 ILE 6 2HG1 ILE 6 11.407 -0.226 -2.901
42 HG21 ILE 6 1HG2 ILE 6 8.921 -0.349 -5.440
43 HG22 ILE 6 2HG2 ILE 6 9.000 -2.083 -5.126
44 HG23 ILE 6 3HG2 ILE 6 10.485 -1.140 -5.244
45 HD11 ILE 6 3HD1 ILE 6 9.543 1.543 -4.486
46 HD12 ILE 6 1HD1 ILE 6 11.144 0.957 -4.922
47 HD13 ILE 6 2HD1 ILE 6 10.968 2.207 -3.695
48 H VAL 7 H VAL 7 6.098 -0.101 -4.664
49 HA VAL 7 HA VAL 7 4.676 -2.565 -4.022
50 HB VAL 7 HB VAL 7 4.273 -0.483 -6.186
51 HG11 VAL 7 1HG1 VAL 7 3.283 -2.511 -6.990
52 HG12 VAL 7 2HG1 VAL 7 1.966 -1.566 -6.296
53 HG13 VAL 7 3HG1 VAL 7 2.655 -2.916 -5.393
54 HG21 VAL 7 3HG2 VAL 7 3.966 0.115 -3.710
55 HG22 VAL 7 1HG2 VAL 7 2.619 -1.024 -3.712
56 HG23 VAL 7 2HG2 VAL 7 2.576 0.395 -4.758
57 H ASN 8 H ASN 8 4.876 -4.496 -5.037
58 HA ASN 8 HA ASN 8 6.467 -4.624 -7.584
59 HB2 ASN 8 1HB ASN 8 6.433 -6.468 -5.183
60 HB3 ASN 8 2HB ASN 8 7.083 -6.956 -6.750
61 HD21 ASN 8 2HD2 ASN 8 8.810 -6.773 -4.498
62 HD22 ASN 8 1HD2 ASN 8 9.868 -5.466 -4.722
63 H VAL 9 H VAL 9 4.815 -4.810 -9.061
64 HA VAL 9 HA VAL 9 3.087 -7.229 -8.821
65 HB VAL 9 HB VAL 9 1.151 -5.896 -9.665
66 HG11 VAL 9 1HG1 VAL 9 2.198 -4.691 -7.099
67 HG12 VAL 9 2HG1 VAL 9 1.661 -6.369 -7.187
68 HG13 VAL 9 3HG1 VAL 9 0.530 -5.062 -7.532
69 HG21 VAL 9 3HG2 VAL 9 3.138 -3.647 -9.293
70 HG22 VAL 9 1HG2 VAL 9 1.401 -3.352 -9.231
71 HG23 VAL 9 2HG2 VAL 9 2.135 -4.001 -10.696
72 H SER 10 H SER 10 2.164 -7.871 -10.899
73 HA SER 10 HA SER 10 4.103 -7.517 -13.064
74 HB2 SER 10 1HB SER 10 2.696 -9.181 -14.234
75 HB3 SER 10 2HB SER 10 3.092 -9.723 -12.606
76 HG SER 10 HG SER 10 0.997 -8.574 -12.083
77 H SER 11 H SER 11 1.278 -5.944 -12.030
78 HA SER 11 HA SER 11 1.172 -4.390 -14.550
79 HB2 SER 11 1HB SER 11 -1.398 -4.587 -14.455
80 HB3 SER 11 2HB SER 11 -0.515 -5.979 -15.077
81 HG SER 11 HG SER 11 -0.555 -6.661 -12.750
82 H SER 12 H SER 12 -0.959 -4.732 -11.690
83 HA SER 12 HA SER 12 -0.022 -2.138 -10.649
84 HB2 SER 12 1HB SER 12 -2.223 -1.094 -10.704
85 HB3 SER 12 2HB SER 12 -1.745 -1.527 -12.343
86 HG SER 12 HG SER 12 -3.926 -2.229 -11.091
87 H LEU 13 H LEU 13 -1.253 -1.593 -8.594
88 HA LEU 13 HA LEU 13 -1.960 -4.112 -7.127
89 HB2 LEU 13 1HB LEU 13 0.121 -3.115 -6.308
90 HB3 LEU 13 2HB LEU 13 -0.672 -1.553 -6.120
91 HG LEU 13 HG LEU 13 -2.158 -2.473 -4.403
92 HD11 LEU 13 1HD1 LEU 13 -0.854 -5.067 -5.221
93 HD12 LEU 13 2HD1 LEU 13 -2.565 -4.713 -4.970
94 HD13 LEU 13 3HD1 LEU 13 -1.489 -4.876 -3.585
95 HD21 LEU 13 3HD2 LEU 13 -0.470 -2.940 -2.673
96 HD22 LEU 13 1HD2 LEU 13 0.058 -1.621 -3.718
97 HD23 LEU 13 2HD2 LEU 13 0.738 -3.236 -3.923
98 H ASN 14 H ASN 14 -3.952 -4.188 -6.241
99 HA ASN 14 HA ASN 14 -5.767 -1.912 -6.611
100 HB2 ASN 14 1HB ASN 14 -6.117 -4.728 -5.561
101 HB3 ASN 14 2HB ASN 14 -7.431 -3.550 -5.592
102 HD21 ASN 14 2HD2 ASN 14 -7.506 -5.955 -7.178
103 HD22 ASN 14 1HD2 ASN 14 -7.431 -5.509 -8.813
104 H VAL 15 H VAL 15 -6.472 -0.555 -5.025
105 HA VAL 15 HA VAL 15 -5.211 -0.767 -2.357
106 HB VAL 15 HB VAL 15 -6.954 1.381 -3.608
107 HG11 VAL 15 1HG1 VAL 15 -7.185 1.494 -1.214
108 HG12 VAL 15 2HG1 VAL 15 -6.036 2.748 -1.682
109 HG13 VAL 15 3HG1 VAL 15 -5.455 1.239 -0.979
110 HG21 VAL 15 3HG2 VAL 15 -4.619 0.935 -4.565
111 HG22 VAL 15 1HG2 VAL 15 -3.991 1.452 -2.999
112 HG23 VAL 15 2HG2 VAL 15 -4.920 2.575 -3.990
113 H ARG 16 H ARG 16 -6.314 -1.437 -0.564
114 HA ARG 16 HA ARG 16 -9.231 -2.040 -0.869
115 HB2 ARG 16 1HB ARG 16 -7.066 -3.161 0.916
116 HB3 ARG 16 2HB ARG 16 -8.776 -3.496 1.177
117 HG2 ARG 16 1HG ARG 16 -8.965 -4.426 -1.086
118 HG3 ARG 16 2HG ARG 16 -7.273 -4.042 -1.399
119 HD2 ARG 16 1HD ARG 16 -8.169 -5.855 0.857
120 HD3 ARG 16 2HD ARG 16 -7.710 -6.452 -0.739
121 HE ARG 16 HE ARG 16 -5.624 -4.765 0.217
122 HH11 ARG 16 1HH2 ARG 16 -7.169 -7.792 0.853
123 HH12 ARG 16 2HH2 ARG 16 -5.749 -8.517 1.529
124 HH21 ARG 16 1HH1 ARG 16 -3.773 -5.704 1.091
125 HH22 ARG 16 2HH1 ARG 16 -3.827 -7.338 1.662
126 H GLU 17 H GLU 17 -10.691 -1.016 0.386
127 HA GLU 17 HA GLU 17 -9.955 1.299 1.920
128 HB2 GLU 17 1HB GLU 17 -12.150 1.033 0.791
129 HB3 GLU 17 2HB GLU 17 -12.554 -0.270 1.908
130 HG2 GLU 17 1HG GLU 17 -12.406 1.266 3.807
131 HG3 GLU 17 2HG GLU 17 -11.908 2.576 2.735
132 H GLY 18 H GLY 18 -11.107 -1.948 2.865
133 HA2 GLY 18 1HA GLY 18 -10.463 -1.327 5.708
134 HA3 GLY 18 2HA GLY 18 -11.428 -2.690 5.142
135 H ALA 19 H ALA 19 -9.634 -3.457 6.866
136 HA ALA 19 HA ALA 19 -7.099 -4.189 5.506
137 HB1 ALA 19 3HB ALA 19 -8.130 -4.554 8.337
138 HB2 ALA 19 1HB ALA 19 -6.874 -3.442 7.795
139 HB3 ALA 19 2HB ALA 19 -6.579 -5.181 7.782
140 H SER 20 H SER 20 -9.912 -5.280 4.918
141 HA SER 20 HA SER 20 -9.796 -8.075 5.740
142 HB2 SER 20 1HB SER 20 -11.528 -6.862 3.578
143 HB3 SER 20 2HB SER 20 -11.823 -8.342 4.484
144 HG SER 20 HG SER 20 -11.418 -6.211 6.112
145 H THR 21 H THR 21 -9.853 -9.832 4.074
146 HA THR 21 HA THR 21 -7.516 -9.788 2.436
147 HB THR 21 HB THR 21 -9.893 -11.639 2.127
148 HG1 THR 21 HG1 THR 21 -7.682 -11.897 3.879
149 HG21 THR 21 3HG2 THR 21 -6.923 -11.942 1.618
150 HG22 THR 21 1HG2 THR 21 -8.199 -11.889 0.402
151 HG23 THR 21 2HG2 THR 21 -8.094 -13.256 1.512
152 H SER 22 H SER 22 -10.977 -9.545 1.590
153 HA SER 22 HA SER 22 -10.167 -8.343 -1.038
154 HB2 SER 22 1HB SER 22 -12.552 -10.163 -0.612
155 HB3 SER 22 2HB SER 22 -11.933 -9.547 -2.142
156 HG SER 22 HG SER 22 -11.161 -11.623 -1.856
157 H SER 23 H SER 23 -10.472 -6.409 0.460
158 HA SER 23 HA SER 23 -13.236 -5.748 1.178
159 HB2 SER 23 1HB SER 23 -10.924 -5.012 2.294
160 HB3 SER 23 2HB SER 23 -11.074 -3.674 1.163
161 HG SER 23 HG SER 23 -12.508 -4.252 3.423
162 H LYS 24 H LYS 24 -13.822 -3.308 0.512
163 HA LYS 24 HA LYS 24 -14.379 -3.382 -2.301
164 HB2 LYS 24 1HB LYS 24 -15.790 -2.226 -0.589
165 HB3 LYS 24 2HB LYS 24 -14.530 -1.002 -0.429
166 HG2 LYS 24 1HG LYS 24 -14.755 -0.421 -2.800
167 HG3 LYS 24 2HG LYS 24 -15.965 -1.687 -3.012
168 HD2 LYS 24 1HD LYS 24 -17.432 -0.555 -1.373
169 HD3 LYS 24 2HD LYS 24 -16.227 0.719 -1.183
170 HE2 LYS 24 1HE LYS 24 -16.434 1.287 -3.570
171 HE3 LYS 24 2HE LYS 24 -17.621 -0.000 -3.780
172 HZ1 LYS 24 3HZ LYS 24 -19.204 1.345 -3.062
173 HZ2 LYS 24 1HZ LYS 24 -18.083 2.614 -2.973
174 HZ3 LYS 24 2HZ LYS 24 -18.369 1.638 -1.612
175 H VAL 25 H VAL 25 -13.273 -2.552 -3.999
176 HA VAL 25 HA VAL 25 -10.595 -1.459 -3.553
177 HB VAL 25 HB VAL 25 -12.206 -2.002 -6.065
178 HG11 VAL 25 1HG1 VAL 25 -9.388 -0.971 -5.670
179 HG12 VAL 25 2HG1 VAL 25 -10.678 -0.256 -6.638
180 HG13 VAL 25 3HG1 VAL 25 -9.910 -1.753 -7.162
181 HG21 VAL 25 3HG2 VAL 25 -9.938 -3.429 -4.653
182 HG22 VAL 25 1HG2 VAL 25 -10.454 -3.817 -6.295
183 HG23 VAL 25 2HG2 VAL 25 -11.568 -4.036 -4.945
184 H ILE 26 H ILE 26 -10.100 0.668 -3.508
185 HA ILE 26 HA ILE 26 -12.203 2.648 -4.309
186 HB ILE 26 HB ILE 26 -11.043 4.190 -2.759
187 HG12 ILE 26 1HG1 ILE 26 -9.371 1.763 -2.025
188 HG13 ILE 26 2HG1 ILE 26 -8.774 3.118 -2.981
189 HG21 ILE 26 1HG2 ILE 26 -11.739 3.071 -0.690
190 HG22 ILE 26 2HG2 ILE 26 -11.724 1.510 -1.511
191 HG23 ILE 26 3HG2 ILE 26 -12.901 2.739 -1.974
192 HD11 ILE 26 3HD1 ILE 26 -9.641 3.112 -0.093
193 HD12 ILE 26 1HD1 ILE 26 -9.536 4.609 -1.020
194 HD13 ILE 26 2HD1 ILE 26 -8.097 3.622 -0.772
195 H GLY 27 H GLY 27 -9.304 1.307 -5.340
196 HA2 GLY 27 1HA GLY 27 -8.982 2.903 -7.587
197 HA3 GLY 27 2HA GLY 27 -8.036 3.716 -6.342
198 H SER 28 H SER 28 -6.534 2.931 -8.336
199 HA SER 28 HA SER 28 -5.147 0.462 -7.358
200 HB2 SER 28 1HB SER 28 -5.743 1.259 -10.219
201 HB3 SER 28 2HB SER 28 -4.573 0.018 -9.778
202 HG SER 28 HG SER 28 -6.159 -1.266 -9.131
203 H LEU 29 H LEU 29 -2.847 0.473 -7.761
204 HA LEU 29 HA LEU 29 -1.704 3.198 -8.307
205 HB2 LEU 29 1HB LEU 29 -0.708 1.114 -6.342
206 HB3 LEU 29 2HB LEU 29 0.026 2.689 -6.645
207 HG LEU 29 HG LEU 29 -2.784 2.240 -5.594
208 HD11 LEU 29 1HD1 LEU 29 -0.325 3.313 -4.188
209 HD12 LEU 29 2HD1 LEU 29 -0.940 1.672 -3.999
210 HD13 LEU 29 3HD1 LEU 29 -1.912 3.045 -3.470
211 HD21 LEU 29 3HD2 LEU 29 -1.208 4.689 -6.382
212 HD22 LEU 29 1HD2 LEU 29 -2.391 4.804 -5.076
213 HD23 LEU 29 2HD2 LEU 29 -2.903 4.311 -6.685
214 H SER 30 H SER 30 0.281 3.247 -9.396
215 HA SER 30 HA SER 30 0.673 1.129 -11.317
216 HB2 SER 30 1HB SER 30 2.186 3.651 -10.645
217 HB3 SER 30 2HB SER 30 2.757 2.527 -11.876
218 HG SER 30 HG SER 30 0.239 2.833 -12.384
219 H GLY 31 H GLY 31 2.531 -0.206 -11.546
220 HA2 GLY 31 1HA GLY 31 3.479 -1.359 -9.097
221 HA3 GLY 31 2HA GLY 31 4.062 -1.765 -10.708
222 H ASN 32 H ASN 32 5.775 -1.608 -8.528
223 HA ASN 32 HA ASN 32 7.800 -0.683 -7.836
224 HB2 ASN 32 1HB ASN 32 7.647 0.548 -10.606
225 HB3 ASN 32 2HB ASN 32 9.083 0.542 -9.586
226 HD21 ASN 32 2HD2 ASN 32 8.324 -2.241 -8.551
227 HD22 ASN 32 1HD2 ASN 32 8.767 -3.291 -9.807
228 H THR 33 H THR 33 5.067 1.044 -8.047
229 HA THR 33 HA THR 33 6.164 3.736 -7.695
230 HB THR 33 HB THR 33 3.353 2.743 -7.149
231 HG1 THR 33 HG1 THR 33 4.235 4.082 -9.460
232 HG21 THR 33 3HG2 THR 33 3.877 4.922 -6.148
233 HG22 THR 33 1HG2 THR 33 2.788 5.129 -7.520
234 HG23 THR 33 2HG2 THR 33 4.505 5.494 -7.694
235 H LYS 34 H LYS 34 6.553 4.762 -5.782
236 HA LYS 34 HA LYS 34 6.608 3.126 -3.340
237 HB2 LYS 34 1HB LYS 34 7.509 5.941 -3.987
238 HB3 LYS 34 2HB LYS 34 7.633 5.234 -2.376
239 HG2 LYS 34 1HG LYS 34 9.025 3.429 -3.229
240 HG3 LYS 34 2HG LYS 34 8.827 4.014 -4.878
241 HD2 LYS 34 1HD LYS 34 10.936 4.859 -4.216
242 HD3 LYS 34 2HD LYS 34 9.841 6.228 -4.029
243 HE2 LYS 34 1HE LYS 34 9.718 5.913 -1.649
244 HE3 LYS 34 2HE LYS 34 10.535 4.354 -1.749
245 HZ1 LYS 34 3HZ LYS 34 12.125 5.940 -1.063
246 HZ2 LYS 34 1HZ LYS 34 11.682 7.032 -2.282
247 HZ3 LYS 34 2HZ LYS 34 12.472 5.584 -2.689
248 H VAL 35 H VAL 35 5.295 3.406 -1.563
249 HA VAL 35 HA VAL 35 3.211 5.565 -1.697
250 HB VAL 35 HB VAL 35 1.649 3.923 -0.629
251 HG11 VAL 35 1HG1 VAL 35 1.401 4.307 -2.973
252 HG12 VAL 35 2HG1 VAL 35 1.368 2.556 -2.767
253 HG13 VAL 35 3HG1 VAL 35 2.830 3.349 -3.353
254 HG21 VAL 35 3HG2 VAL 35 3.224 2.339 0.308
255 HG22 VAL 35 1HG2 VAL 35 3.922 2.019 -1.279
256 HG23 VAL 35 2HG2 VAL 35 2.279 1.493 -0.916
257 H THR 36 H THR 36 3.049 6.753 0.113
258 HA THR 36 HA THR 36 4.950 6.476 2.236
259 HB THR 36 HB THR 36 2.356 8.042 2.238
260 HG1 THR 36 HG1 THR 36 3.938 9.730 1.608
261 HG21 THR 36 3HG2 THR 36 4.896 8.166 3.868
262 HG22 THR 36 1HG2 THR 36 3.238 8.005 4.446
263 HG23 THR 36 2HG2 THR 36 3.787 9.533 3.755
264 H ILE 37 H ILE 37 4.865 5.256 4.027
265 HA ILE 37 HA ILE 37 2.250 4.017 4.815
266 HB ILE 37 HB ILE 37 5.082 2.982 5.076
267 HG12 ILE 37 1HG1 ILE 37 2.684 1.797 3.665
268 HG13 ILE 37 2HG1 ILE 37 3.878 2.808 2.851
269 HG21 ILE 37 1HG2 ILE 37 4.000 2.301 7.078
270 HG22 ILE 37 2HG2 ILE 37 3.829 0.925 5.987
271 HG23 ILE 37 3HG2 ILE 37 2.470 2.017 6.248
272 HD11 ILE 37 3HD1 ILE 37 4.674 0.359 4.432
273 HD12 ILE 37 1HD1 ILE 37 5.622 1.240 3.233
274 HD13 ILE 37 2HD1 ILE 37 4.241 0.267 2.725
275 H VAL 38 H VAL 38 1.488 4.657 6.718
276 HA VAL 38 HA VAL 38 3.354 5.905 8.709
277 HB VAL 38 HB VAL 38 1.360 7.105 9.544
278 HG11 VAL 38 1HG1 VAL 38 1.743 7.367 6.545
279 HG12 VAL 38 2HG1 VAL 38 2.754 8.128 7.773
280 HG13 VAL 38 3HG1 VAL 38 1.063 8.599 7.608
281 HG21 VAL 38 3HG2 VAL 38 0.006 5.498 7.369
282 HG22 VAL 38 1HG2 VAL 38 -0.683 7.016 7.944
283 HG23 VAL 38 2HG2 VAL 38 -0.466 5.671 9.060
284 H GLY 39 H GLY 39 0.403 3.909 8.397
285 HA2 GLY 39 1HA GLY 39 0.799 2.898 11.160
286 HA3 GLY 39 2HA GLY 39 -0.621 2.626 10.155
287 H GLU 40 H GLU 40 0.644 0.536 11.519
288 HA GLU 40 HA GLU 40 1.483 -1.157 9.221
289 HB2 GLU 40 1HB GLU 40 3.007 -0.820 11.820
290 HB3 GLU 40 2HB GLU 40 3.258 -2.178 10.720
291 HG2 GLU 40 1HG GLU 40 3.837 -0.632 8.908
292 HG3 GLU 40 2HG GLU 40 3.535 0.745 9.964
293 H GLU 41 H GLU 41 0.294 -2.978 9.237
294 HA GLU 41 HA GLU 41 -0.946 -3.865 11.827
295 HB2 GLU 41 1HB GLU 41 -2.534 -3.076 10.035
296 HB3 GLU 41 2HB GLU 41 -1.962 -4.402 9.024
297 HG2 GLU 41 1HG GLU 41 -2.638 -6.026 10.736
298 HG3 GLU 41 2HG GLU 41 -3.195 -4.710 11.769
299 H GLY 42 H GLY 42 -0.755 -6.023 12.375
300 HA2 GLY 42 1HA GLY 42 1.487 -7.483 11.355
301 HA3 GLY 42 2HA GLY 42 0.271 -8.123 12.460
302 H ALA 43 H ALA 43 0.356 -7.093 9.029
303 HA ALA 43 HA ALA 43 0.049 -9.466 7.707
304 HB1 ALA 43 3HB ALA 43 -2.633 -9.374 7.498
305 HB2 ALA 43 1HB ALA 43 -2.483 -8.717 9.126
306 HB3 ALA 43 2HB ALA 43 -1.846 -10.318 8.756
307 H PHE 44 H PHE 44 -1.217 -6.204 8.094
308 HA PHE 44 HA PHE 44 -0.997 -5.822 5.126
309 HB2 PHE 44 1HB PHE 44 -3.209 -4.756 6.913
310 HB3 PHE 44 2HB PHE 44 -3.019 -4.424 5.192
311 HD1 PHE 44 HD2 PHE 44 -3.891 -6.970 7.704
312 HD2 PHE 44 HD1 PHE 44 -3.466 -6.139 3.513
313 HE1 PHE 44 HE2 PHE 44 -5.117 -9.058 7.166
314 HE2 PHE 44 HE1 PHE 44 -4.683 -8.232 2.973
315 HZ PHE 44 HZ PHE 44 -5.511 -9.690 4.800
316 H TYR 45 H TYR 45 -0.697 -3.555 4.521
317 HA TYR 45 HA TYR 45 0.669 -1.968 6.674
318 HB2 TYR 45 1HB TYR 45 1.226 -2.258 3.717
319 HB3 TYR 45 2HB TYR 45 1.863 -0.910 4.660
320 HD1 TYR 45 HD1 TYR 45 3.086 -1.514 6.876
321 HD2 TYR 45 HD2 TYR 45 2.402 -4.298 3.688
322 HE1 TYR 45 HE1 TYR 45 4.912 -2.948 7.743
323 HE2 TYR 45 HE2 TYR 45 4.233 -5.736 4.547
324 HH TYR 45 HH TYR 45 5.966 -4.898 7.544
325 H LYS 46 H LYS 46 0.091 0.141 6.943
326 HA LYS 46 HA LYS 46 -2.392 1.019 5.595
327 HB2 LYS 46 1HB LYS 46 -2.114 1.197 8.077
328 HB3 LYS 46 2HB LYS 46 -0.794 2.337 7.813
329 HG2 LYS 46 1HG LYS 46 -2.302 3.877 6.669
330 HG3 LYS 46 2HG LYS 46 -3.629 2.724 6.810
331 HD2 LYS 46 1HD LYS 46 -3.466 2.851 9.278
332 HD3 LYS 46 2HD LYS 46 -2.166 4.032 9.123
333 HE2 LYS 46 1HE LYS 46 -3.685 5.558 7.925
334 HE3 LYS 46 2HE LYS 46 -4.988 4.379 8.077
335 HZ1 LYS 46 3HZ LYS 46 -3.747 6.054 10.136
336 HZ2 LYS 46 1HZ LYS 46 -4.347 4.533 10.589
337 HZ3 LYS 46 2HZ LYS 46 -5.386 5.679 9.886
338 H ILE 47 H ILE 47 -2.382 2.510 3.974
339 HA ILE 47 HA ILE 47 0.095 4.153 3.561
340 HB ILE 47 HB ILE 47 -0.410 3.936 1.090
341 HG12 ILE 47 1HG1 ILE 47 -2.086 1.576 1.998
342 HG13 ILE 47 2HG1 ILE 47 -2.782 3.116 1.489
343 HG21 ILE 47 1HG2 ILE 47 0.403 1.584 2.803
344 HG22 ILE 47 2HG2 ILE 47 1.434 2.699 1.908
345 HG23 ILE 47 3HG2 ILE 47 0.469 1.508 1.042
346 HD11 ILE 47 3HD1 ILE 47 -1.073 1.244 -0.172
347 HD12 ILE 47 1HD1 ILE 47 -1.516 2.872 -0.684
348 HD13 ILE 47 2HD1 ILE 47 -2.768 1.654 -0.435
349 H GLU 48 H GLU 48 -0.259 6.177 2.477
350 HA GLU 48 HA GLU 48 -2.835 7.390 3.240
351 HB2 GLU 48 1HB GLU 48 -0.254 8.517 2.123
352 HB3 GLU 48 2HB GLU 48 -1.674 9.505 2.477
353 HG2 GLU 48 1HG GLU 48 -1.624 8.792 4.819
354 HG3 GLU 48 2HG GLU 48 -0.262 7.723 4.486
355 H TYR 49 H TYR 49 -4.332 6.591 1.736
356 HA TYR 49 HA TYR 49 -3.791 6.855 -1.151
357 HB2 TYR 49 1HB TYR 49 -5.028 4.893 -0.364
358 HB3 TYR 49 2HB TYR 49 -6.257 5.931 0.357
359 HD1 TYR 49 HD1 TYR 49 -4.609 5.108 -2.896
360 HD2 TYR 49 HD2 TYR 49 -8.082 6.703 -0.934
361 HE1 TYR 49 HE1 TYR 49 -5.793 5.209 -5.073
362 HE2 TYR 49 HE2 TYR 49 -9.266 6.804 -3.110
363 HH TYR 49 HH TYR 49 -8.063 6.916 -5.850
364 H LYS 50 H LYS 50 -4.699 8.414 -2.470
365 HA LYS 50 HA LYS 50 -5.364 10.939 -1.422
366 HB2 LYS 50 1HB LYS 50 -4.686 10.516 -3.773
367 HB3 LYS 50 2HB LYS 50 -6.259 9.779 -4.075
368 HG2 LYS 50 1HG LYS 50 -7.387 11.876 -3.530
369 HG3 LYS 50 2HG LYS 50 -5.845 12.625 -3.114
370 HD2 LYS 50 1HD LYS 50 -5.061 12.279 -5.437
371 HD3 LYS 50 2HD LYS 50 -6.622 11.569 -5.849
372 HE2 LYS 50 1HE LYS 50 -6.282 14.370 -4.740
373 HE3 LYS 50 2HE LYS 50 -6.424 14.004 -6.460
374 HZ1 LYS 50 3HZ LYS 50 -8.591 14.409 -5.899
375 HZ2 LYS 50 1HZ LYS 50 -8.437 13.767 -4.336
376 HZ3 LYS 50 2HZ LYS 50 -8.529 12.725 -5.674
377 H GLY 51 H GLY 51 -6.965 11.021 0.109
378 HA2 GLY 51 1HA GLY 51 -9.433 11.621 0.110
379 HA3 GLY 51 2HA GLY 51 -9.704 10.059 -0.664
380 H SER 52 H SER 52 -7.666 8.674 0.941
381 HA SER 52 HA SER 52 -8.267 9.002 3.740
382 HB2 SER 52 1HB SER 52 -10.453 8.088 2.886
383 HB3 SER 52 2HB SER 52 -9.591 6.631 2.398
384 HG SER 52 HG SER 52 -10.626 6.780 4.607
385 H HIS 53 H HIS 53 -7.860 6.471 4.702
386 HA HIS 53 HA HIS 53 -5.112 5.867 3.704
387 HB2 HIS 53 1HB HIS 53 -6.382 4.826 6.242
388 HB3 HIS 53 2HB HIS 53 -4.667 4.961 5.845
389 HD1 HIS 53 HD1 HIS 53 -6.131 6.366 8.331
390 HD2 HIS 53 HD2 HIS 53 -5.067 8.204 4.743
391 HE1 HIS 53 HE1 HIS 53 -5.939 8.843 8.823
392 H GLY 54 H GLY 54 -4.904 4.144 2.402
393 HA2 GLY 54 1HA GLY 54 -7.020 2.050 2.381
394 HA3 GLY 54 2HA GLY 54 -5.816 2.311 1.119
395 H TYR 55 H TYR 55 -6.311 -0.220 2.248
396 HA TYR 55 HA TYR 55 -3.787 -0.737 3.791
397 HB2 TYR 55 1HB TYR 55 -6.496 -2.081 3.878
398 HB3 TYR 55 2HB TYR 55 -5.043 -2.850 4.518
399 HD1 TYR 55 HD2 TYR 55 -7.165 0.207 4.772
400 HD2 TYR 55 HD1 TYR 55 -4.147 -2.225 6.621
401 HE1 TYR 55 HE2 TYR 55 -7.364 1.542 6.852
402 HE2 TYR 55 HE1 TYR 55 -4.342 -0.893 8.702
403 HH TYR 55 HH TYR 55 -6.444 1.966 8.857
404 H VAL 56 H VAL 56 -2.513 -2.474 3.118
405 HA VAL 56 HA VAL 56 -3.343 -3.928 0.646
406 HB VAL 56 HB VAL 56 -1.063 -3.535 -0.295
407 HG11 VAL 56 1HG1 VAL 56 -2.535 -0.959 0.325
408 HG12 VAL 56 2HG1 VAL 56 -3.078 -2.131 -0.876
409 HG13 VAL 56 3HG1 VAL 56 -1.537 -1.299 -1.088
410 HG21 VAL 56 3HG2 VAL 56 0.147 -1.512 0.727
411 HG22 VAL 56 1HG2 VAL 56 0.244 -3.017 1.637
412 HG23 VAL 56 2HG2 VAL 56 -0.869 -1.748 2.145
413 H ALA 57 H ALA 57 -2.237 -5.934 0.360
414 HA ALA 57 HA ALA 57 -1.554 -7.263 2.842
415 HB1 ALA 57 3HB ALA 57 -1.676 -8.063 -0.051
416 HB2 ALA 57 1HB ALA 57 -2.627 -8.664 1.305
417 HB3 ALA 57 2HB ALA 57 -0.942 -9.149 1.127
418 H LYS 58 H LYS 58 0.434 -7.903 3.592
419 HA LYS 58 HA LYS 58 2.763 -6.413 2.836
420 HB2 LYS 58 1HB LYS 58 3.955 -8.057 4.333
421 HB3 LYS 58 2HB LYS 58 2.562 -7.279 5.086
422 HG2 LYS 58 1HG LYS 58 1.168 -9.254 4.504
423 HG3 LYS 58 2HG LYS 58 2.594 -10.039 3.827
424 HD2 LYS 58 1HD LYS 58 3.706 -9.953 6.014
425 HD3 LYS 58 2HD LYS 58 2.318 -9.111 6.701
426 HE2 LYS 58 1HE LYS 58 1.976 -11.370 7.311
427 HE3 LYS 58 2HE LYS 58 0.931 -11.147 5.907
428 HZ1 LYS 58 3HZ LYS 58 3.676 -11.989 5.399
429 HZ2 LYS 58 1HZ LYS 58 2.242 -12.432 4.611
430 HZ3 LYS 58 2HZ LYS 58 2.642 -13.139 6.103
431 H GLU 59 H GLU 59 1.319 -9.141 1.416
432 HA GLU 59 HA GLU 59 3.669 -10.513 0.490
433 HB2 GLU 59 1HB GLU 59 1.322 -11.445 0.555
434 HB3 GLU 59 2HB GLU 59 0.951 -10.435 -0.842
435 HG2 GLU 59 1HG GLU 59 1.553 -12.611 -1.680
436 HG3 GLU 59 2HG GLU 59 2.903 -11.532 -2.030
437 H TYR 60 H TYR 60 1.742 -7.851 -0.858
438 HA TYR 60 HA TYR 60 3.411 -7.845 -3.310
439 HB2 TYR 60 1HB TYR 60 1.040 -6.147 -2.476
440 HB3 TYR 60 2HB TYR 60 1.861 -6.038 -4.034
441 HD1 TYR 60 HD1 TYR 60 2.024 -8.166 -5.464
442 HD2 TYR 60 HD2 TYR 60 -0.642 -7.776 -2.121
443 HE1 TYR 60 HE1 TYR 60 0.675 -10.064 -6.317
444 HE2 TYR 60 HE2 TYR 60 -1.993 -9.673 -2.972
445 HH TYR 60 HH TYR 60 -2.357 -11.015 -4.753
446 H ILE 61 H ILE 61 3.808 -6.695 -0.259
447 HA ILE 61 HA ILE 61 5.067 -4.120 -1.137
448 HB ILE 61 HB ILE 61 4.440 -5.100 1.665
449 HG12 ILE 61 1HG1 ILE 61 2.369 -4.729 0.442
450 HG13 ILE 61 2HG1 ILE 61 2.612 -3.391 1.558
451 HG21 ILE 61 1HG2 ILE 61 4.759 -2.606 2.136
452 HG22 ILE 61 2HG2 ILE 61 5.477 -2.496 0.529
453 HG23 ILE 61 3HG2 ILE 61 6.222 -3.517 1.760
454 HD11 ILE 61 3HD1 ILE 61 2.032 -2.266 -0.401
455 HD12 ILE 61 1HD1 ILE 61 2.855 -3.426 -1.435
456 HD13 ILE 61 2HD1 ILE 61 3.788 -2.249 -0.512
457 H LYS 62 H LYS 62 7.225 -3.992 -1.224
458 HA LYS 62 HA LYS 62 8.876 -5.833 0.431
459 HB2 LYS 62 1HB LYS 62 8.553 -6.940 -1.773
460 HB3 LYS 62 2HB LYS 62 9.223 -5.514 -2.567
461 HG2 LYS 62 1HG LYS 62 11.348 -5.814 -1.426
462 HG3 LYS 62 2HG LYS 62 10.695 -7.157 -0.485
463 HD2 LYS 62 1HD LYS 62 10.337 -8.425 -2.585
464 HD3 LYS 62 2HD LYS 62 11.026 -7.082 -3.499
465 HE2 LYS 62 1HE LYS 62 13.152 -7.328 -2.278
466 HE3 LYS 62 2HE LYS 62 12.467 -8.658 -1.345
467 HZ1 LYS 62 3HZ LYS 62 12.210 -9.939 -3.328
468 HZ2 LYS 62 1HZ LYS 62 13.813 -9.389 -3.260
469 HZ3 LYS 62 2HZ LYS 62 12.703 -8.637 -4.304
470 H ASP 63 H ASP 63 11.084 -5.126 0.620
471 HA ASP 63 HA ASP 63 12.754 -3.534 0.918
472 HB2 ASP 63 1HB ASP 63 12.458 -3.390 -1.620
473 HB3 ASP 63 2HB ASP 63 11.468 -1.962 -1.325
474 H ILE 64 H ILE 64 10.605 -3.385 2.613
475 HA ILE 64 HA ILE 64 9.398 -0.782 2.773
476 HB ILE 64 HB ILE 64 9.854 -2.903 4.892
477 HG12 ILE 64 1HG1 ILE 64 7.356 -2.161 3.340
478 HG13 ILE 64 2HG1 ILE 64 8.436 -3.475 2.875
479 HG21 ILE 64 1HG2 ILE 64 9.497 -0.814 6.028
480 HG22 ILE 64 2HG2 ILE 64 7.950 -1.660 6.037
481 HG23 ILE 64 3HG2 ILE 64 8.230 -0.346 4.896
482 HD11 ILE 64 3HD1 ILE 64 6.435 -4.172 4.273
483 HD12 ILE 64 1HD1 ILE 64 7.161 -3.285 5.614
484 HD13 ILE 64 2HD1 ILE 64 8.002 -4.667 4.913
485 H LYS 65 H LYS 65 9.970 0.997 4.072
486 HA LYS 65 HA LYS 65 12.842 1.312 4.498
487 HB2 LYS 65 1HB LYS 65 11.376 3.135 3.617
488 HB3 LYS 65 2HB LYS 65 10.584 3.212 5.192
489 HG2 LYS 65 1HG LYS 65 12.683 3.797 6.274
490 HG3 LYS 65 2HG LYS 65 13.560 3.589 4.757
491 HD2 LYS 65 1HD LYS 65 12.229 5.420 3.748
492 HD3 LYS 65 2HD LYS 65 11.393 5.643 5.283
493 HE2 LYS 65 1HE LYS 65 14.393 5.866 4.942
494 HE3 LYS 65 2HE LYS 65 13.292 7.244 4.951
495 HZ1 LYS 65 3HZ LYS 65 13.560 7.223 7.145
496 HZ2 LYS 65 1HZ LYS 65 14.279 5.686 7.141
497 HZ3 LYS 65 2HZ LYS 65 12.586 5.831 7.164
498 H ASP 66 H ASP 66 13.914 1.411 6.432
499 HA ASP 66 HA ASP 66 12.876 0.039 8.700
500 HB2 ASP 66 1HB ASP 66 15.256 1.876 8.366
501 HB3 ASP 66 2HB ASP 66 14.915 1.003 9.861
502 H GLU 67 H GLU 67 12.118 0.770 10.676
503 HA GLU 67 HA GLU 67 11.578 3.700 10.982
504 HB2 GLU 67 1HB GLU 67 9.406 2.425 12.236
505 HB3 GLU 67 2HB GLU 67 9.358 3.229 10.670
506 HG2 GLU 67 1HG GLU 67 8.469 0.915 10.555
507 HG3 GLU 67 2HG GLU 67 9.885 1.130 9.528
508 H VAL 68 H VAL 68 10.580 1.001 13.042
509 HA VAL 68 HA VAL 68 12.795 1.238 14.878
510 HB VAL 68 HB VAL 68 11.535 3.379 15.291
511 HG11 VAL 68 1HG1 VAL 68 9.274 2.237 14.878
512 HG12 VAL 68 2HG1 VAL 68 9.358 3.337 16.253
513 HG13 VAL 68 3HG1 VAL 68 9.422 1.593 16.512
514 HG21 VAL 68 3HG2 VAL 68 12.934 2.427 17.038
515 HG22 VAL 68 1HG2 VAL 68 11.651 1.312 17.506
516 HG23 VAL 68 2HG2 VAL 68 11.456 3.044 17.774
517 H LEU 69 H LEU 69 12.892 -0.627 16.029
518 HA LEU 69 HA LEU 69 10.777 -2.610 15.692
519 HB2 LEU 69 1HB LEU 69 13.491 -2.578 17.011
520 HB3 LEU 69 2HB LEU 69 12.396 -3.941 17.248
521 HG LEU 69 HG LEU 69 12.263 -4.301 14.833
522 HD11 LEU 69 1HD1 LEU 69 13.946 -1.792 14.759
523 HD12 LEU 69 2HD1 LEU 69 12.431 -2.118 13.917
524 HD13 LEU 69 3HD1 LEU 69 13.914 -2.924 13.406
525 HD21 LEU 69 3HD2 LEU 69 15.076 -4.003 15.924
526 HD22 LEU 69 1HD2 LEU 69 14.701 -4.833 14.414
527 HD23 LEU 69 2HD2 LEU 69 14.075 -5.454 15.942
528 H GLU 70 H GLU 70 9.384 -3.379 17.239
529 HA GLU 70 HA GLU 70 8.010 -3.297 19.117
530 HB2 GLU 70 1HB GLU 70 10.697 -2.711 20.385
531 HB3 GLU 70 2HB GLU 70 9.225 -3.026 21.307
532 HG2 GLU 70 1HG GLU 70 8.989 -5.217 20.237
533 HG3 GLU 70 2HG GLU 70 10.418 -4.909 19.251
534 H HIS 71 H HIS 71 6.611 -1.638 18.885
535 HA HIS 71 HA HIS 71 7.406 1.150 19.083
536 HB2 HIS 71 1HB HIS 71 4.921 1.549 19.011
537 HB3 HIS 71 2HB HIS 71 5.518 0.565 17.675
538 HD1 HIS 71 HD1 HIS 71 4.893 -1.961 17.667
539 HD2 HIS 71 HD2 HIS 71 3.284 0.153 20.880
540 HE1 HIS 71 HE1 HIS 71 3.153 -3.472 18.721
541 H HIS 72 H HIS 72 6.768 -1.295 21.321
542 HA HIS 72 HA HIS 72 6.545 -1.302 23.639
543 HB2 HIS 72 1HB HIS 72 7.317 1.625 23.515
544 HB3 HIS 72 2HB HIS 72 7.542 0.504 24.856
545 HD1 HIS 72 HD1 HIS 72 9.183 -1.618 24.277
546 HD2 HIS 72 HD2 HIS 72 9.480 1.706 21.776
547 HE1 HIS 72 HE1 HIS 72 11.382 -1.845 23.040
548 H HIS 73 H HIS 73 4.370 -1.604 23.916
549 HA HIS 73 HA HIS 73 2.459 0.590 23.591
550 HB2 HIS 73 1HB HIS 73 0.857 -1.163 24.553
551 HB3 HIS 73 2HB HIS 73 1.630 -1.577 23.024
552 HD1 HIS 73 HD1 HIS 73 1.482 -2.546 26.622
553 HD2 HIS 73 HD2 HIS 73 3.693 -3.583 23.243
554 HE1 HIS 73 HE1 HIS 73 2.708 -4.687 27.197
555 H HIS 74 H HIS 74 4.686 -0.069 25.916
556 HA HIS 74 HA HIS 74 3.143 1.444 27.940
557 HB2 HIS 74 1HB HIS 74 3.747 -0.163 29.732
558 HB3 HIS 74 2HB HIS 74 2.672 -0.884 28.535
559 HD1 HIS 74 HD1 HIS 74 3.939 -2.352 26.622
560 HD2 HIS 74 HD2 HIS 74 6.131 -1.542 30.073
561 HE1 HIS 74 HE1 HIS 74 5.861 -4.002 26.654
562 H HIS 75 H HIS 75 4.552 2.173 29.722
563 HA HIS 75 HA HIS 75 7.390 2.534 28.816
564 HB2 HIS 75 1HB HIS 75 5.593 4.331 30.472
565 HB3 HIS 75 2HB HIS 75 7.305 4.631 30.181
566 HD1 HIS 75 HD1 HIS 75 7.971 4.793 27.526
567 HD2 HIS 75 HD2 HIS 75 3.945 5.317 28.471
568 HE1 HIS 75 HE1 HIS 75 6.909 5.933 25.529
569 H HIS 76 H HIS 76 8.998 2.021 30.269
570 HA HIS 76 HA HIS 76 8.406 1.604 33.110
571 HB2 HIS 76 1HB HIS 76 7.681 -0.548 32.190
572 HB3 HIS 76 2HB HIS 76 9.207 -0.714 31.322
573 HD1 HIS 76 HD1 HIS 76 7.890 -0.489 34.882
574 HD2 HIS 76 HD2 HIS 76 11.268 -1.820 32.834
575 HE1 HIS 76 HE1 HIS 76 9.348 -1.660 36.590
Start of MODEL 20
1 H1 ALA 1 1H ALA 1 8.543 7.736 13.691
2 H2 ALA 1 2H ALA 1 7.098 7.235 12.952
3 H3 ALA 1 3H ALA 1 8.114 8.347 12.168
4 HA ALA 1 HA ALA 1 9.862 6.624 12.064
5 HB1 ALA 1 3HB ALA 1 9.333 4.363 12.626
6 HB2 ALA 1 1HB ALA 1 7.617 4.732 12.808
7 HB3 ALA 1 2HB ALA 1 8.779 5.329 13.994
8 H GLU 2 H GLU 2 8.845 8.016 10.190
9 HA GLU 2 HA GLU 2 6.818 6.838 8.533
10 HB2 GLU 2 1HB GLU 2 7.465 9.228 8.423
11 HB3 GLU 2 2HB GLU 2 9.027 8.759 7.754
12 HG2 GLU 2 1HG GLU 2 7.921 7.739 5.818
13 HG3 GLU 2 2HG GLU 2 6.341 8.121 6.498
14 H LYS 3 H LYS 3 6.957 5.394 6.885
15 HA LYS 3 HA LYS 3 9.653 4.470 5.988
16 HB2 LYS 3 1HB LYS 3 7.362 2.730 6.915
17 HB3 LYS 3 2HB LYS 3 8.777 2.121 6.056
18 HG2 LYS 3 1HG LYS 3 10.216 3.123 7.855
19 HG3 LYS 3 2HG LYS 3 8.745 3.518 8.744
20 HD2 LYS 3 1HD LYS 3 9.435 0.715 7.827
21 HD3 LYS 3 2HD LYS 3 9.839 1.335 9.426
22 HE2 LYS 3 1HE LYS 3 7.328 1.909 9.637
23 HE3 LYS 3 2HE LYS 3 7.102 0.859 8.239
24 HZ1 LYS 3 3HZ LYS 3 8.657 -0.089 10.545
25 HZ2 LYS 3 1HZ LYS 3 7.793 -0.982 9.391
26 HZ3 LYS 3 2HZ LYS 3 6.960 -0.126 10.599
27 H THR 4 H THR 4 9.612 3.550 3.853
28 HA THR 4 HA THR 4 7.077 4.050 2.324
29 HB THR 4 HB THR 4 8.523 4.666 0.395
30 HG1 THR 4 HG1 THR 4 10.466 4.030 2.279
31 HG21 THR 4 3HG2 THR 4 8.916 6.255 2.944
32 HG22 THR 4 1HG2 THR 4 7.580 6.414 1.804
33 HG23 THR 4 2HG2 THR 4 9.212 6.875 1.319
34 H GLY 5 H GLY 5 6.305 2.286 1.406
35 HA2 GLY 5 1HA GLY 5 8.042 -0.121 1.130
36 HA3 GLY 5 2HA GLY 5 6.282 -0.131 1.197
37 H ILE 6 H ILE 6 8.532 -0.932 -0.835
38 HA ILE 6 HA ILE 6 7.719 0.568 -3.225
39 HB ILE 6 HB ILE 6 9.450 -1.907 -3.005
40 HG12 ILE 6 1HG1 ILE 6 10.403 -0.180 -1.595
41 HG13 ILE 6 2HG1 ILE 6 11.347 -0.252 -3.080
42 HG21 ILE 6 1HG2 ILE 6 9.271 0.253 -5.124
43 HG22 ILE 6 2HG2 ILE 6 8.611 -1.374 -5.271
44 HG23 ILE 6 3HG2 ILE 6 10.355 -1.137 -5.155
45 HD11 ILE 6 3HD1 ILE 6 9.375 1.841 -2.192
46 HD12 ILE 6 1HD1 ILE 6 9.698 1.618 -3.910
47 HD13 ILE 6 2HD1 ILE 6 11.009 2.054 -2.815
48 H VAL 7 H VAL 7 6.063 0.009 -4.517
49 HA VAL 7 HA VAL 7 4.565 -2.456 -3.965
50 HB VAL 7 HB VAL 7 4.159 -0.211 -5.959
51 HG11 VAL 7 1HG1 VAL 7 3.087 -2.092 -6.933
52 HG12 VAL 7 2HG1 VAL 7 1.806 -1.262 -6.052
53 HG13 VAL 7 3HG1 VAL 7 2.556 -2.704 -5.367
54 HG21 VAL 7 3HG2 VAL 7 2.571 -0.928 -3.480
55 HG22 VAL 7 1HG2 VAL 7 2.467 0.553 -4.433
56 HG23 VAL 7 2HG2 VAL 7 3.901 0.228 -3.460
57 H ASN 8 H ASN 8 5.751 -4.200 -4.688
58 HA ASN 8 HA ASN 8 6.771 -4.169 -7.489
59 HB2 ASN 8 1HB ASN 8 8.200 -4.870 -5.456
60 HB3 ASN 8 2HB ASN 8 7.234 -6.345 -5.450
61 HD21 ASN 8 2HD2 ASN 8 9.068 -7.676 -6.138
62 HD22 ASN 8 1HD2 ASN 8 9.680 -7.580 -7.717
63 H VAL 9 H VAL 9 5.181 -4.779 -8.873
64 HA VAL 9 HA VAL 9 3.851 -7.398 -8.383
65 HB VAL 9 HB VAL 9 1.689 -6.434 -9.212
66 HG11 VAL 9 1HG1 VAL 9 1.018 -5.651 -7.088
67 HG12 VAL 9 2HG1 VAL 9 2.598 -4.946 -6.746
68 HG13 VAL 9 3HG1 VAL 9 2.391 -6.696 -6.732
69 HG21 VAL 9 3HG2 VAL 9 1.413 -3.994 -9.182
70 HG22 VAL 9 1HG2 VAL 9 2.681 -4.440 -10.323
71 HG23 VAL 9 2HG2 VAL 9 3.107 -3.790 -8.740
72 H SER 10 H SER 10 3.450 -8.547 -10.245
73 HA SER 10 HA SER 10 5.017 -7.916 -12.572
74 HB2 SER 10 1HB SER 10 4.393 -10.233 -11.843
75 HB3 SER 10 2HB SER 10 2.732 -9.889 -12.308
76 HG SER 10 HG SER 10 5.040 -9.951 -13.955
77 H SER 11 H SER 11 1.936 -6.886 -11.539
78 HA SER 11 HA SER 11 1.428 -5.677 -14.219
79 HB2 SER 11 1HB SER 11 -0.941 -6.279 -14.110
80 HB3 SER 11 2HB SER 11 0.047 -7.739 -14.075
81 HG SER 11 HG SER 11 -0.121 -7.530 -11.712
82 H SER 12 H SER 12 -1.127 -5.576 -11.955
83 HA SER 12 HA SER 12 -0.264 -2.859 -11.011
84 HB2 SER 12 1HB SER 12 -2.965 -3.763 -12.018
85 HB3 SER 12 2HB SER 12 -2.704 -2.245 -11.163
86 HG SER 12 HG SER 12 -1.342 -3.063 -13.520
87 H LEU 13 H LEU 13 -1.208 -2.195 -8.998
88 HA LEU 13 HA LEU 13 -1.989 -4.499 -7.254
89 HB2 LEU 13 1HB LEU 13 0.152 -3.547 -6.596
90 HB3 LEU 13 2HB LEU 13 -0.535 -1.924 -6.585
91 HG LEU 13 HG LEU 13 -2.015 -2.512 -4.733
92 HD11 LEU 13 1HD1 LEU 13 -2.620 -4.755 -5.017
93 HD12 LEU 13 2HD1 LEU 13 -1.499 -4.867 -3.661
94 HD13 LEU 13 3HD1 LEU 13 -0.960 -5.281 -5.289
95 HD21 LEU 13 3HD2 LEU 13 -0.364 -2.779 -2.998
96 HD22 LEU 13 1HD2 LEU 13 0.374 -1.828 -4.287
97 HD23 LEU 13 2HD2 LEU 13 0.769 -3.538 -4.115
98 H ASN 14 H ASN 14 -3.954 -4.419 -6.357
99 HA ASN 14 HA ASN 14 -5.675 -2.083 -6.814
100 HB2 ASN 14 1HB ASN 14 -6.138 -4.817 -5.623
101 HB3 ASN 14 2HB ASN 14 -7.391 -3.575 -5.670
102 HD21 ASN 14 2HD2 ASN 14 -7.668 -6.028 -7.137
103 HD22 ASN 14 1HD2 ASN 14 -7.612 -5.663 -8.794
104 H VAL 15 H VAL 15 -6.703 -0.900 -5.132
105 HA VAL 15 HA VAL 15 -5.214 -0.926 -2.539
106 HB VAL 15 HB VAL 15 -6.881 1.195 -3.912
107 HG11 VAL 15 1HG1 VAL 15 -6.000 2.605 -1.929
108 HG12 VAL 15 2HG1 VAL 15 -5.704 1.060 -1.131
109 HG13 VAL 15 3HG1 VAL 15 -7.341 1.508 -1.607
110 HG21 VAL 15 3HG2 VAL 15 -4.815 2.352 -4.193
111 HG22 VAL 15 1HG2 VAL 15 -4.465 0.682 -4.636
112 HG23 VAL 15 2HG2 VAL 15 -3.981 1.295 -3.055
113 H ARG 16 H ARG 16 -6.258 -1.563 -0.739
114 HA ARG 16 HA ARG 16 -9.201 -2.067 -0.892
115 HB2 ARG 16 1HB ARG 16 -7.013 -3.209 0.855
116 HB3 ARG 16 2HB ARG 16 -8.727 -3.526 1.123
117 HG2 ARG 16 1HG ARG 16 -8.921 -4.454 -1.152
118 HG3 ARG 16 2HG ARG 16 -7.214 -4.121 -1.442
119 HD2 ARG 16 1HD ARG 16 -6.601 -5.647 0.399
120 HD3 ARG 16 2HD ARG 16 -8.308 -5.969 0.700
121 HE ARG 16 HE ARG 16 -8.376 -7.309 -1.271
122 HH11 ARG 16 1HH2 ARG 16 -5.390 -5.608 -0.916
123 HH12 ARG 16 2HH2 ARG 16 -4.575 -6.533 -2.131
124 HH21 ARG 16 1HH1 ARG 16 -7.324 -8.514 -2.848
125 HH22 ARG 16 2HH1 ARG 16 -5.666 -8.177 -3.223
126 H GLU 17 H GLU 17 -10.550 -0.932 0.389
127 HA GLU 17 HA GLU 17 -9.579 1.331 1.917
128 HB2 GLU 17 1HB GLU 17 -11.942 1.688 2.454
129 HB3 GLU 17 2HB GLU 17 -11.791 1.270 0.748
130 HG2 GLU 17 1HG GLU 17 -12.277 -1.127 1.366
131 HG3 GLU 17 2HG GLU 17 -12.620 -0.578 3.006
132 H GLY 18 H GLY 18 -10.758 -1.895 2.714
133 HA2 GLY 18 1HA GLY 18 -10.334 -1.365 5.619
134 HA3 GLY 18 2HA GLY 18 -11.213 -2.735 4.946
135 H ALA 19 H ALA 19 -9.505 -3.536 6.732
136 HA ALA 19 HA ALA 19 -6.876 -4.132 5.479
137 HB1 ALA 19 3HB ALA 19 -7.921 -4.925 8.210
138 HB2 ALA 19 1HB ALA 19 -7.096 -3.400 7.897
139 HB3 ALA 19 2HB ALA 19 -6.239 -4.928 7.677
140 H SER 20 H SER 20 -9.933 -5.392 5.428
141 HA SER 20 HA SER 20 -9.232 -8.232 5.676
142 HB2 SER 20 1HB SER 20 -11.738 -6.722 4.969
143 HB3 SER 20 2HB SER 20 -11.648 -8.466 4.747
144 HG SER 20 HG SER 20 -12.435 -7.704 6.842
145 H THR 21 H THR 21 -9.216 -9.727 3.946
146 HA THR 21 HA THR 21 -8.064 -8.810 1.482
147 HB THR 21 HB THR 21 -9.360 -11.461 2.160
148 HG1 THR 21 HG1 THR 21 -7.596 -10.961 3.473
149 HG21 THR 21 3HG2 THR 21 -9.213 -11.358 -0.206
150 HG22 THR 21 1HG2 THR 21 -7.773 -12.239 0.301
151 HG23 THR 21 2HG2 THR 21 -7.653 -10.540 -0.152
152 H SER 22 H SER 22 -11.338 -9.946 2.292
153 HA SER 22 HA SER 22 -12.313 -9.529 -0.430
154 HB2 SER 22 1HB SER 22 -14.529 -10.061 0.571
155 HB3 SER 22 2HB SER 22 -13.309 -11.256 1.001
156 HG SER 22 HG SER 22 -14.176 -9.053 2.578
157 H SER 23 H SER 23 -11.188 -7.290 1.417
158 HA SER 23 HA SER 23 -13.313 -5.454 1.960
159 HB2 SER 23 1HB SER 23 -10.357 -5.124 1.504
160 HB3 SER 23 2HB SER 23 -11.397 -3.733 1.812
161 HG SER 23 HG SER 23 -10.799 -4.365 3.795
162 H LYS 24 H LYS 24 -14.040 -3.658 0.774
163 HA LYS 24 HA LYS 24 -14.238 -4.063 -2.075
164 HB2 LYS 24 1HB LYS 24 -16.030 -3.020 -0.721
165 HB3 LYS 24 2HB LYS 24 -14.983 -1.629 -0.436
166 HG2 LYS 24 1HG LYS 24 -14.887 -1.176 -2.845
167 HG3 LYS 24 2HG LYS 24 -15.866 -2.606 -3.169
168 HD2 LYS 24 1HD LYS 24 -17.724 -1.626 -1.867
169 HD3 LYS 24 2HD LYS 24 -16.745 -0.189 -1.563
170 HE2 LYS 24 1HE LYS 24 -16.607 0.245 -3.982
171 HE3 LYS 24 2HE LYS 24 -17.563 -1.203 -4.302
172 HZ1 LYS 24 3HZ LYS 24 -18.406 1.396 -3.370
173 HZ2 LYS 24 1HZ LYS 24 -19.092 0.098 -2.521
174 HZ3 LYS 24 2HZ LYS 24 -19.280 0.204 -4.206
175 H VAL 25 H VAL 25 -13.163 -3.088 -3.723
176 HA VAL 25 HA VAL 25 -10.691 -1.639 -3.050
177 HB VAL 25 HB VAL 25 -11.834 -2.643 -5.668
178 HG11 VAL 25 1HG1 VAL 25 -9.453 -2.137 -6.474
179 HG12 VAL 25 2HG1 VAL 25 -9.285 -1.143 -5.025
180 HG13 VAL 25 3HG1 VAL 25 -10.505 -0.741 -6.234
181 HG21 VAL 25 3HG2 VAL 25 -11.041 -4.384 -4.111
182 HG22 VAL 25 1HG2 VAL 25 -9.502 -3.541 -3.945
183 HG23 VAL 25 2HG2 VAL 25 -9.954 -4.251 -5.494
184 H ILE 26 H ILE 26 -10.469 0.513 -3.205
185 HA ILE 26 HA ILE 26 -12.699 2.120 -4.371
186 HB ILE 26 HB ILE 26 -11.704 3.985 -3.040
187 HG12 ILE 26 1HG1 ILE 26 -9.908 1.821 -1.886
188 HG13 ILE 26 2HG1 ILE 26 -9.362 3.032 -3.047
189 HG21 ILE 26 1HG2 ILE 26 -13.498 2.648 -2.067
190 HG22 ILE 26 2HG2 ILE 26 -12.326 3.051 -0.812
191 HG23 ILE 26 3HG2 ILE 26 -12.338 1.438 -1.521
192 HD11 ILE 26 3HD1 ILE 26 -10.493 3.563 -0.285
193 HD12 ILE 26 1HD1 ILE 26 -10.105 4.818 -1.462
194 HD13 ILE 26 2HD1 ILE 26 -8.824 3.802 -0.803
195 H GLY 27 H GLY 27 -9.673 0.931 -5.155
196 HA2 GLY 27 1HA GLY 27 -9.435 2.329 -7.585
197 HA3 GLY 27 2HA GLY 27 -8.493 3.244 -6.408
198 H SER 28 H SER 28 -6.675 2.614 -7.872
199 HA SER 28 HA SER 28 -5.343 0.217 -6.826
200 HB2 SER 28 1HB SER 28 -4.933 -0.793 -9.020
201 HB3 SER 28 2HB SER 28 -6.668 -0.679 -8.735
202 HG SER 28 HG SER 28 -5.637 0.126 -10.830
203 H LEU 29 H LEU 29 -3.062 0.118 -7.589
204 HA LEU 29 HA LEU 29 -2.023 2.803 -8.447
205 HB2 LEU 29 1HB LEU 29 -0.806 0.889 -6.438
206 HB3 LEU 29 2HB LEU 29 -0.112 2.432 -6.941
207 HG LEU 29 HG LEU 29 -2.809 2.090 -5.594
208 HD11 LEU 29 1HD1 LEU 29 -1.685 3.174 -3.658
209 HD12 LEU 29 2HD1 LEU 29 -0.154 3.099 -4.530
210 HD13 LEU 29 3HD1 LEU 29 -0.970 1.610 -4.051
211 HD21 LEU 29 3HD2 LEU 29 -3.031 4.078 -6.808
212 HD22 LEU 29 1HD2 LEU 29 -1.308 4.446 -6.725
213 HD23 LEU 29 2HD2 LEU 29 -2.336 4.687 -5.310
214 H SER 30 H SER 30 -0.157 2.780 -9.723
215 HA SER 30 HA SER 30 0.082 0.485 -11.485
216 HB2 SER 30 1HB SER 30 1.422 1.865 -12.816
217 HB3 SER 30 2HB SER 30 0.365 3.019 -12.007
218 HG SER 30 HG SER 30 2.144 3.028 -10.355
219 H GLY 31 H GLY 31 2.206 -0.470 -12.014
220 HA2 GLY 31 1HA GLY 31 3.417 -1.689 -9.750
221 HA3 GLY 31 2HA GLY 31 4.050 -1.749 -11.389
222 H ASN 32 H ASN 32 5.517 -1.506 -8.911
223 HA ASN 32 HA ASN 32 7.328 -0.347 -8.021
224 HB2 ASN 32 1HB ASN 32 7.996 -0.489 -10.468
225 HB3 ASN 32 2HB ASN 32 7.386 1.156 -10.651
226 HD21 ASN 32 2HD2 ASN 32 9.451 2.184 -10.960
227 HD22 ASN 32 1HD2 ASN 32 10.640 2.230 -9.749
228 H THR 33 H THR 33 4.639 0.720 -7.604
229 HA THR 33 HA THR 33 5.016 3.659 -7.604
230 HB THR 33 HB THR 33 2.715 1.889 -6.748
231 HG1 THR 33 HG1 THR 33 3.077 2.173 -8.990
232 HG21 THR 33 3HG2 THR 33 1.516 4.191 -6.696
233 HG22 THR 33 1HG2 THR 33 3.137 4.867 -6.520
234 HG23 THR 33 2HG2 THR 33 2.511 3.746 -5.310
235 H LYS 34 H LYS 34 5.817 4.716 -5.886
236 HA LYS 34 HA LYS 34 6.488 3.239 -3.445
237 HB2 LYS 34 1HB LYS 34 8.017 4.922 -4.485
238 HB3 LYS 34 2HB LYS 34 6.845 6.177 -4.083
239 HG2 LYS 34 1HG LYS 34 7.072 5.729 -1.720
240 HG3 LYS 34 2HG LYS 34 8.066 4.308 -2.035
241 HD2 LYS 34 1HD LYS 34 9.617 6.008 -1.454
242 HD3 LYS 34 2HD LYS 34 9.698 5.912 -3.212
243 HE2 LYS 34 1HE LYS 34 8.314 7.868 -3.459
244 HE3 LYS 34 2HE LYS 34 7.935 7.888 -1.737
245 HZ1 LYS 34 3HZ LYS 34 10.697 7.880 -1.956
246 HZ2 LYS 34 1HZ LYS 34 9.704 9.156 -1.439
247 HZ3 LYS 34 2HZ LYS 34 10.136 9.027 -3.078
248 H VAL 35 H VAL 35 5.365 3.320 -1.552
249 HA VAL 35 HA VAL 35 3.146 5.332 -1.313
250 HB VAL 35 HB VAL 35 1.928 3.506 -0.026
251 HG11 VAL 35 1HG1 VAL 35 1.293 4.164 -2.293
252 HG12 VAL 35 2HG1 VAL 35 1.158 2.414 -2.126
253 HG13 VAL 35 3HG1 VAL 35 2.537 3.114 -2.971
254 HG21 VAL 35 3HG2 VAL 35 2.599 1.197 -0.485
255 HG22 VAL 35 1HG2 VAL 35 3.932 2.045 0.296
256 HG23 VAL 35 2HG2 VAL 35 3.969 1.757 -1.445
257 H THR 36 H THR 36 3.091 6.436 0.535
258 HA THR 36 HA THR 36 5.251 6.081 2.468
259 HB THR 36 HB THR 36 2.894 7.983 2.488
260 HG1 THR 36 HG1 THR 36 4.885 7.852 0.840
261 HG21 THR 36 3HG2 THR 36 3.814 7.894 4.682
262 HG22 THR 36 1HG2 THR 36 4.535 9.315 3.927
263 HG23 THR 36 2HG2 THR 36 5.465 7.823 4.065
264 H ILE 37 H ILE 37 5.112 4.935 4.301
265 HA ILE 37 HA ILE 37 2.440 3.930 5.182
266 HB ILE 37 HB ILE 37 5.238 2.935 5.791
267 HG12 ILE 37 1HG1 ILE 37 3.045 1.647 4.140
268 HG13 ILE 37 2HG1 ILE 37 4.342 2.613 3.434
269 HG21 ILE 37 1HG2 ILE 37 3.840 2.405 7.654
270 HG22 ILE 37 2HG2 ILE 37 3.906 0.943 6.670
271 HG23 ILE 37 3HG2 ILE 37 2.484 1.987 6.606
272 HD11 ILE 37 3HD1 ILE 37 4.753 0.104 3.471
273 HD12 ILE 37 1HD1 ILE 37 4.856 0.230 5.227
274 HD13 ILE 37 2HD1 ILE 37 6.019 1.084 4.213
275 H VAL 38 H VAL 38 1.613 4.742 7.012
276 HA VAL 38 HA VAL 38 3.411 6.210 8.908
277 HB VAL 38 HB VAL 38 1.295 7.391 9.602
278 HG11 VAL 38 1HG1 VAL 38 2.901 8.341 7.942
279 HG12 VAL 38 2HG1 VAL 38 1.241 8.865 7.661
280 HG13 VAL 38 3HG1 VAL 38 1.951 7.607 6.649
281 HG21 VAL 38 3HG2 VAL 38 -0.278 5.635 8.793
282 HG22 VAL 38 1HG2 VAL 38 0.167 6.029 7.131
283 HG23 VAL 38 2HG2 VAL 38 -0.662 7.224 8.130
284 H GLY 39 H GLY 39 1.799 3.338 8.484
285 HA2 GLY 39 1HA GLY 39 2.108 2.573 11.242
286 HA3 GLY 39 2HA GLY 39 0.408 2.879 10.894
287 H GLU 40 H GLU 40 0.799 0.383 11.596
288 HA GLU 40 HA GLU 40 0.589 -1.147 9.054
289 HB2 GLU 40 1HB GLU 40 1.997 -2.957 9.921
290 HB3 GLU 40 2HB GLU 40 2.916 -1.454 9.871
291 HG2 GLU 40 1HG GLU 40 2.419 -1.106 12.293
292 HG3 GLU 40 2HG GLU 40 1.592 -2.663 12.323
293 H GLU 41 H GLU 41 -0.505 -3.219 9.352
294 HA GLU 41 HA GLU 41 -1.849 -3.695 11.920
295 HB2 GLU 41 1HB GLU 41 -3.231 -1.962 10.586
296 HB3 GLU 41 2HB GLU 41 -3.594 -3.291 9.486
297 HG2 GLU 41 1HG GLU 41 -4.082 -3.415 12.478
298 HG3 GLU 41 2HG GLU 41 -5.316 -2.960 11.303
299 H GLY 42 H GLY 42 -1.362 -5.797 12.095
300 HA2 GLY 42 1HA GLY 42 -1.171 -8.071 11.591
301 HA3 GLY 42 2HA GLY 42 -2.567 -7.820 10.551
302 H ALA 43 H ALA 43 -2.004 -8.928 8.746
303 HA ALA 43 HA ALA 43 0.707 -8.751 7.622
304 HB1 ALA 43 3HB ALA 43 -0.238 -10.896 7.362
305 HB2 ALA 43 1HB ALA 43 -0.487 -10.165 5.774
306 HB3 ALA 43 2HB ALA 43 -1.816 -10.241 6.930
307 H PHE 44 H PHE 44 -1.209 -6.389 7.795
308 HA PHE 44 HA PHE 44 -1.042 -5.607 4.907
309 HB2 PHE 44 1HB PHE 44 -3.305 -5.076 6.841
310 HB3 PHE 44 2HB PHE 44 -3.134 -4.270 5.284
311 HD1 PHE 44 HD1 PHE 44 -3.804 -7.481 6.969
312 HD2 PHE 44 HD2 PHE 44 -3.452 -5.465 3.194
313 HE1 PHE 44 HE1 PHE 44 -4.864 -9.416 5.837
314 HE2 PHE 44 HE2 PHE 44 -4.514 -7.397 2.062
315 HZ PHE 44 HZ PHE 44 -5.218 -9.375 3.383
316 H TYR 45 H TYR 45 -0.426 -3.506 4.517
317 HA TYR 45 HA TYR 45 0.594 -1.985 6.881
318 HB2 TYR 45 1HB TYR 45 1.484 -2.149 4.004
319 HB3 TYR 45 2HB TYR 45 1.988 -0.817 5.043
320 HD1 TYR 45 HD2 TYR 45 2.820 -1.607 7.472
321 HD2 TYR 45 HD1 TYR 45 2.886 -4.029 3.924
322 HE1 TYR 45 HE2 TYR 45 4.583 -3.027 8.477
323 HE2 TYR 45 HE1 TYR 45 4.656 -5.443 4.932
324 HH TYR 45 HH TYR 45 5.781 -4.901 8.257
325 H LYS 46 H LYS 46 -0.050 0.109 7.183
326 HA LYS 46 HA LYS 46 -2.356 1.032 5.576
327 HB2 LYS 46 1HB LYS 46 -2.433 1.120 8.062
328 HB3 LYS 46 2HB LYS 46 -1.073 2.242 8.043
329 HG2 LYS 46 1HG LYS 46 -2.393 3.853 6.737
330 HG3 LYS 46 2HG LYS 46 -3.748 2.725 6.696
331 HD2 LYS 46 1HD LYS 46 -3.882 2.803 9.164
332 HD3 LYS 46 2HD LYS 46 -2.542 3.950 9.195
333 HE2 LYS 46 1HE LYS 46 -3.866 5.548 7.865
334 HE3 LYS 46 2HE LYS 46 -5.204 4.400 7.813
335 HZ1 LYS 46 3HZ LYS 46 -4.505 6.224 9.860
336 HZ2 LYS 46 1HZ LYS 46 -4.497 4.640 10.469
337 HZ3 LYS 46 2HZ LYS 46 -5.892 5.253 9.717
338 H ILE 47 H ILE 47 -2.177 2.588 4.057
339 HA ILE 47 HA ILE 47 0.276 4.303 4.026
340 HB ILE 47 HB ILE 47 0.138 4.173 1.510
341 HG12 ILE 47 1HG1 ILE 47 -1.605 1.753 2.058
342 HG13 ILE 47 2HG1 ILE 47 -2.261 3.309 1.548
343 HG21 ILE 47 1HG2 ILE 47 1.849 2.911 2.576
344 HG22 ILE 47 2HG2 ILE 47 1.064 1.785 1.470
345 HG23 ILE 47 3HG2 ILE 47 0.698 1.726 3.194
346 HD11 ILE 47 3HD1 ILE 47 -0.247 1.622 0.030
347 HD12 ILE 47 1HD1 ILE 47 -0.775 3.231 -0.461
348 HD13 ILE 47 2HD1 ILE 47 -1.930 1.899 -0.420
349 H GLU 48 H GLU 48 -0.011 6.378 3.102
350 HA GLU 48 HA GLU 48 -2.697 7.461 3.544
351 HB2 GLU 48 1HB GLU 48 -0.673 8.693 4.257
352 HB3 GLU 48 2HB GLU 48 -0.176 8.831 2.569
353 HG2 GLU 48 1HG GLU 48 -2.186 10.104 2.040
354 HG3 GLU 48 2HG GLU 48 -2.790 9.888 3.682
355 H TYR 49 H TYR 49 -4.073 6.825 1.932
356 HA TYR 49 HA TYR 49 -3.282 6.880 -0.882
357 HB2 TYR 49 1HB TYR 49 -4.848 5.179 -0.036
358 HB3 TYR 49 2HB TYR 49 -5.990 6.448 0.407
359 HD1 TYR 49 HD1 TYR 49 -4.110 5.033 -2.494
360 HD2 TYR 49 HD2 TYR 49 -7.527 7.281 -1.187
361 HE1 TYR 49 HE1 TYR 49 -5.003 5.018 -4.806
362 HE2 TYR 49 HE2 TYR 49 -8.420 7.271 -3.498
363 HH TYR 49 HH TYR 49 -7.438 5.225 -5.835
364 H LYS 50 H LYS 50 -3.950 8.366 -2.423
365 HA LYS 50 HA LYS 50 -4.158 11.070 -1.818
366 HB2 LYS 50 1HB LYS 50 -5.399 9.540 -4.117
367 HB3 LYS 50 2HB LYS 50 -5.278 11.298 -4.070
368 HG2 LYS 50 1HG LYS 50 -2.786 11.031 -3.772
369 HG3 LYS 50 2HG LYS 50 -2.995 9.303 -4.050
370 HD2 LYS 50 1HD LYS 50 -3.899 11.441 -6.003
371 HD3 LYS 50 2HD LYS 50 -2.348 10.612 -6.114
372 HE2 LYS 50 1HE LYS 50 -3.724 8.425 -6.084
373 HE3 LYS 50 2HE LYS 50 -5.119 9.450 -6.421
374 HZ1 LYS 50 3HZ LYS 50 -2.827 9.991 -8.083
375 HZ2 LYS 50 1HZ LYS 50 -4.458 9.798 -8.509
376 HZ3 LYS 50 2HZ LYS 50 -3.471 8.432 -8.288
377 H GLY 51 H GLY 51 -6.886 8.823 -2.332
378 HA2 GLY 51 1HA GLY 51 -8.919 10.806 -1.781
379 HA3 GLY 51 2HA GLY 51 -9.163 9.058 -1.793
380 H SER 52 H SER 52 -7.263 8.376 0.210
381 HA SER 52 HA SER 52 -7.661 9.895 2.631
382 HB2 SER 52 1HB SER 52 -9.475 7.534 2.115
383 HB3 SER 52 2HB SER 52 -9.087 8.067 3.747
384 HG SER 52 HG SER 52 -10.548 9.336 1.723
385 H HIS 53 H HIS 53 -8.031 6.608 3.302
386 HA HIS 53 HA HIS 53 -5.065 6.165 3.407
387 HB2 HIS 53 1HB HIS 53 -7.147 5.512 5.509
388 HB3 HIS 53 2HB HIS 53 -5.469 4.972 5.567
389 HD1 HIS 53 HD1 HIS 53 -7.630 7.953 6.117
390 HD2 HIS 53 HD2 HIS 53 -3.552 7.112 5.921
391 HE1 HIS 53 HE1 HIS 53 -6.434 9.980 7.055
392 H GLY 54 H GLY 54 -4.672 4.574 2.004
393 HA2 GLY 54 1HA GLY 54 -6.693 2.425 1.573
394 HA3 GLY 54 2HA GLY 54 -5.325 2.779 0.518
395 H TYR 55 H TYR 55 -6.030 0.200 1.656
396 HA TYR 55 HA TYR 55 -3.591 -0.308 3.332
397 HB2 TYR 55 1HB TYR 55 -6.262 -1.735 3.364
398 HB3 TYR 55 2HB TYR 55 -4.840 -2.234 4.281
399 HD1 TYR 55 HD1 TYR 55 -7.366 0.449 3.857
400 HD2 TYR 55 HD2 TYR 55 -4.132 -1.056 6.247
401 HE1 TYR 55 HE1 TYR 55 -7.937 2.068 5.649
402 HE2 TYR 55 HE2 TYR 55 -4.703 0.558 8.039
403 HH TYR 55 HH TYR 55 -6.639 3.200 7.582
404 H VAL 56 H VAL 56 -2.256 -1.932 2.675
405 HA VAL 56 HA VAL 56 -3.106 -3.638 0.370
406 HB VAL 56 HB VAL 56 -0.817 -3.308 -0.611
407 HG11 VAL 56 1HG1 VAL 56 -2.744 -2.095 -1.509
408 HG12 VAL 56 2HG1 VAL 56 -1.321 -1.052 -1.526
409 HG13 VAL 56 3HG1 VAL 56 -2.553 -0.843 -0.281
410 HG21 VAL 56 3HG2 VAL 56 -0.714 -1.158 1.530
411 HG22 VAL 56 1HG2 VAL 56 0.383 -1.224 0.152
412 HG23 VAL 56 2HG2 VAL 56 0.386 -2.525 1.343
413 H ALA 57 H ALA 57 -1.992 -5.650 0.272
414 HA ALA 57 HA ALA 57 -1.223 -6.687 2.870
415 HB1 ALA 57 3HB ALA 57 -0.721 -8.783 1.421
416 HB2 ALA 57 1HB ALA 57 -1.446 -7.849 0.111
417 HB3 ALA 57 2HB ALA 57 -2.389 -8.226 1.547
418 H LYS 58 H LYS 58 0.788 -7.520 3.479
419 HA LYS 58 HA LYS 58 3.096 -6.045 2.639
420 HB2 LYS 58 1HB LYS 58 4.329 -7.588 4.122
421 HB3 LYS 58 2HB LYS 58 2.857 -7.009 4.900
422 HG2 LYS 58 1HG LYS 58 1.694 -9.097 4.222
423 HG3 LYS 58 2HG LYS 58 3.191 -9.681 3.495
424 HD2 LYS 58 1HD LYS 58 4.315 -9.558 5.688
425 HD3 LYS 58 2HD LYS 58 2.822 -8.973 6.422
426 HE2 LYS 58 1HE LYS 58 1.680 -11.058 5.804
427 HE3 LYS 58 2HE LYS 58 3.148 -11.645 5.023
428 HZ1 LYS 58 3HZ LYS 58 3.249 -10.791 7.834
429 HZ2 LYS 58 1HZ LYS 58 4.208 -11.930 7.021
430 HZ3 LYS 58 2HZ LYS 58 2.612 -12.320 7.455
431 H GLU 59 H GLU 59 1.564 -8.804 1.343
432 HA GLU 59 HA GLU 59 3.844 -10.167 0.237
433 HB2 GLU 59 1HB GLU 59 2.247 -11.386 -1.084
434 HB3 GLU 59 2HB GLU 59 1.484 -11.084 0.476
435 HG2 GLU 59 1HG GLU 59 0.457 -8.994 -0.578
436 HG3 GLU 59 2HG GLU 59 0.997 -9.626 -2.131
437 H TYR 60 H TYR 60 1.817 -7.520 -0.932
438 HA TYR 60 HA TYR 60 3.249 -7.468 -3.522
439 HB2 TYR 60 1HB TYR 60 1.123 -5.596 -2.440
440 HB3 TYR 60 2HB TYR 60 1.669 -5.703 -4.114
441 HD1 TYR 60 HD1 TYR 60 1.614 -8.194 -5.106
442 HD2 TYR 60 HD2 TYR 60 -0.829 -6.767 -1.873
443 HE1 TYR 60 HE1 TYR 60 -0.016 -10.010 -5.538
444 HE2 TYR 60 HE2 TYR 60 -2.459 -8.587 -2.306
445 HH TYR 60 HH TYR 60 -2.798 -10.526 -3.408
446 H ILE 61 H ILE 61 3.857 -6.388 -0.456
447 HA ILE 61 HA ILE 61 5.290 -3.930 -1.409
448 HB ILE 61 HB ILE 61 4.529 -4.671 1.424
449 HG12 ILE 61 1HG1 ILE 61 2.507 -4.224 0.149
450 HG13 ILE 61 2HG1 ILE 61 2.847 -2.822 1.161
451 HG21 ILE 61 1HG2 ILE 61 6.504 -3.208 1.236
452 HG22 ILE 61 2HG2 ILE 61 5.129 -2.322 1.893
453 HG23 ILE 61 3HG2 ILE 61 5.590 -2.112 0.203
454 HD11 ILE 61 3HD1 ILE 61 2.383 -1.820 -0.904
455 HD12 ILE 61 1HD1 ILE 61 3.141 -3.122 -1.819
456 HD13 ILE 61 2HD1 ILE 61 4.139 -1.945 -0.967
457 H LYS 62 H LYS 62 7.433 -3.912 -1.353
458 HA LYS 62 HA LYS 62 8.873 -6.027 0.210
459 HB2 LYS 62 1HB LYS 62 8.796 -6.615 -2.207
460 HB3 LYS 62 2HB LYS 62 9.546 -5.065 -2.584
461 HG2 LYS 62 1HG LYS 62 11.537 -5.659 -1.330
462 HG3 LYS 62 2HG LYS 62 10.790 -7.157 -0.775
463 HD2 LYS 62 1HD LYS 62 10.653 -7.937 -3.120
464 HD3 LYS 62 2HD LYS 62 11.427 -6.443 -3.651
465 HE2 LYS 62 1HE LYS 62 13.096 -8.235 -3.467
466 HE3 LYS 62 2HE LYS 62 13.407 -6.989 -2.258
467 HZ1 LYS 62 3HZ LYS 62 13.460 -9.381 -1.480
468 HZ2 LYS 62 1HZ LYS 62 11.774 -9.382 -1.661
469 HZ3 LYS 62 2HZ LYS 62 12.509 -8.308 -0.569
470 H ASP 63 H ASP 63 11.054 -5.433 0.765
471 HA ASP 63 HA ASP 63 12.797 -3.954 1.307
472 HB2 ASP 63 1HB ASP 63 11.983 -2.807 -0.963
473 HB3 ASP 63 2HB ASP 63 11.345 -1.588 0.138
474 H ILE 64 H ILE 64 9.698 -2.197 1.434
475 HA ILE 64 HA ILE 64 8.798 -0.887 3.167
476 HB ILE 64 HB ILE 64 9.721 -3.313 4.748
477 HG12 ILE 64 1HG1 ILE 64 7.030 -2.749 3.464
478 HG13 ILE 64 2HG1 ILE 64 8.280 -3.722 2.689
479 HG21 ILE 64 1HG2 ILE 64 7.522 -2.563 6.038
480 HG22 ILE 64 2HG2 ILE 64 7.897 -0.985 5.345
481 HG23 ILE 64 3HG2 ILE 64 9.061 -1.785 6.399
482 HD11 ILE 64 3HD1 ILE 64 6.917 -4.291 5.334
483 HD12 ILE 64 1HD1 ILE 64 8.298 -5.200 4.722
484 HD13 ILE 64 2HD1 ILE 64 6.767 -5.223 3.845
485 H LYS 65 H LYS 65 10.860 0.485 2.717
486 HA LYS 65 HA LYS 65 12.197 0.919 5.341
487 HB2 LYS 65 1HB LYS 65 13.686 -0.483 3.909
488 HB3 LYS 65 2HB LYS 65 13.706 0.822 2.722
489 HG2 LYS 65 1HG LYS 65 14.601 2.363 4.451
490 HG3 LYS 65 2HG LYS 65 14.618 1.036 5.609
491 HD2 LYS 65 1HD LYS 65 16.075 0.844 2.973
492 HD3 LYS 65 2HD LYS 65 16.829 1.574 4.388
493 HE2 LYS 65 1HE LYS 65 16.296 -0.565 5.651
494 HE3 LYS 65 2HE LYS 65 15.821 -1.272 4.106
495 HZ1 LYS 65 3HZ LYS 65 18.072 -0.563 3.286
496 HZ2 LYS 65 1HZ LYS 65 18.054 -1.835 4.408
497 HZ3 LYS 65 2HZ LYS 65 18.482 -0.269 4.908
498 H ASP 66 H ASP 66 12.697 3.052 5.750
499 HA ASP 66 HA ASP 66 11.215 5.081 4.392
500 HB2 ASP 66 1HB ASP 66 11.932 5.214 6.761
501 HB3 ASP 66 2HB ASP 66 13.604 5.387 6.227
502 H GLU 67 H GLU 67 11.752 6.475 2.788
503 HA GLU 67 HA GLU 67 13.676 5.869 0.856
504 HB2 GLU 67 1HB GLU 67 13.363 8.199 0.048
505 HB3 GLU 67 2HB GLU 67 11.834 7.413 0.434
506 HG2 GLU 67 1HG GLU 67 11.783 8.526 2.621
507 HG3 GLU 67 2HG GLU 67 13.334 9.295 2.281
508 H VAL 68 H VAL 68 15.788 6.499 0.447
509 HA VAL 68 HA VAL 68 17.261 7.677 2.763
510 HB VAL 68 HB VAL 68 19.284 6.749 1.524
511 HG11 VAL 68 1HG1 VAL 68 17.072 4.955 2.548
512 HG12 VAL 68 2HG1 VAL 68 18.437 5.606 3.457
513 HG13 VAL 68 3HG1 VAL 68 18.707 4.381 2.217
514 HG21 VAL 68 3HG2 VAL 68 18.825 4.981 -0.127
515 HG22 VAL 68 1HG2 VAL 68 18.183 6.523 -0.692
516 HG23 VAL 68 2HG2 VAL 68 17.096 5.308 -0.017
517 H LEU 69 H LEU 69 18.184 9.615 2.600
518 HA LEU 69 HA LEU 69 17.767 11.250 0.231
519 HB2 LEU 69 1HB LEU 69 19.059 11.689 2.917
520 HB3 LEU 69 2HB LEU 69 19.174 12.910 1.649
521 HG LEU 69 HG LEU 69 16.727 13.002 1.489
522 HD11 LEU 69 1HD1 LEU 69 16.910 10.775 3.521
523 HD12 LEU 69 2HD1 LEU 69 16.010 10.808 2.005
524 HD13 LEU 69 3HD1 LEU 69 15.459 11.767 3.377
525 HD21 LEU 69 3HD2 LEU 69 18.058 14.329 3.245
526 HD22 LEU 69 1HD2 LEU 69 17.458 13.157 4.419
527 HD23 LEU 69 2HD2 LEU 69 16.324 14.168 3.525
528 H GLU 70 H GLU 70 19.359 12.139 -1.101
529 HA GLU 70 HA GLU 70 21.363 10.525 -2.099
530 HB2 GLU 70 1HB GLU 70 20.572 12.621 -3.151
531 HB3 GLU 70 2HB GLU 70 21.478 13.547 -1.954
532 HG2 GLU 70 1HG GLU 70 23.574 12.536 -2.720
533 HG3 GLU 70 2HG GLU 70 22.689 11.531 -3.868
534 H HIS 71 H HIS 71 23.568 10.251 -1.777
535 HA HIS 71 HA HIS 71 24.499 10.497 0.947
536 HB2 HIS 71 1HB HIS 71 25.864 9.653 -1.614
537 HB3 HIS 71 2HB HIS 71 26.650 9.597 -0.037
538 HD1 HIS 71 HD1 HIS 71 23.947 7.942 -2.067
539 HD2 HIS 71 HD2 HIS 71 25.666 7.572 1.715
540 HE1 HIS 71 HE1 HIS 71 23.110 5.749 -1.107
541 H HIS 72 H HIS 72 25.563 12.154 1.860
542 HA HIS 72 HA HIS 72 27.394 13.850 0.341
543 HB2 HIS 72 1HB HIS 72 25.163 14.858 -0.175
544 HB3 HIS 72 2HB HIS 72 24.921 15.116 1.551
545 HD1 HIS 72 HD1 HIS 72 27.726 15.860 -0.943
546 HD2 HIS 72 HD2 HIS 72 25.740 17.651 2.256
547 HE1 HIS 72 HE1 HIS 72 28.748 18.160 -0.662
548 H HIS 73 H HIS 73 28.213 15.659 1.881
549 HA HIS 73 HA HIS 73 29.213 14.471 4.277
550 HB2 HIS 73 1HB HIS 73 28.997 17.376 3.446
551 HB3 HIS 73 2HB HIS 73 29.928 16.813 4.835
552 HD1 HIS 73 HD1 HIS 73 31.686 14.740 4.097
553 HD2 HIS 73 HD2 HIS 73 30.557 17.489 1.173
554 HE1 HIS 73 HE1 HIS 73 33.408 14.567 2.249
555 H HIS 74 H HIS 74 26.454 16.591 3.672
556 HA HIS 74 HA HIS 74 25.789 17.103 6.418
557 HB2 HIS 74 1HB HIS 74 24.855 18.377 4.483
558 HB3 HIS 74 2HB HIS 74 23.937 16.943 4.024
559 HD1 HIS 74 HD1 HIS 74 22.092 16.117 5.767
560 HD2 HIS 74 HD2 HIS 74 23.710 19.878 6.549
561 HE1 HIS 74 HE1 HIS 74 20.550 17.226 7.443
562 H HIS 75 H HIS 75 24.867 14.539 4.154
563 HA HIS 75 HA HIS 75 22.968 13.284 5.923
564 HB2 HIS 75 1HB HIS 75 22.803 12.806 3.585
565 HB3 HIS 75 2HB HIS 75 24.487 12.293 3.505
566 HD1 HIS 75 HD1 HIS 75 25.058 9.920 4.351
567 HD2 HIS 75 HD2 HIS 75 21.022 10.883 4.747
568 HE1 HIS 75 HE1 HIS 75 23.858 7.759 4.904
569 H HIS 76 H HIS 76 23.313 11.961 7.594
570 HA HIS 76 HA HIS 76 25.894 11.537 8.722
571 HB2 HIS 76 1HB HIS 76 23.330 9.984 9.182
572 HB3 HIS 76 2HB HIS 76 24.722 10.013 10.264
573 HD1 HIS 76 HD1 HIS 76 25.363 12.533 11.172
574 HD2 HIS 76 HD2 HIS 76 21.500 12.010 9.691
575 HE1 HIS 76 HE1 HIS 76 23.988 14.471 12.050
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