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 |
|
|
14799 |
1x4y   |
11128 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 22.782 17.573 -7.338
2 HA2 GLY 1 1HA GLY 1 24.740 16.120 -7.250
3 HA3 GLY 1 2HA GLY 1 23.311 15.162 -6.891
4 H SER 2 H SER 2 22.569 13.665 -8.377
5 HA SER 2 HA SER 2 24.497 12.993 -10.481
6 HB2 SER 2 1HB SER 2 23.643 10.753 -10.388
7 HB3 SER 2 2HB SER 2 23.886 11.286 -8.724
8 HG SER 2 HG SER 2 21.545 10.710 -10.083
9 H SER 3 H SER 3 23.476 11.891 -12.444
10 HA SER 3 HA SER 3 21.063 13.375 -13.259
11 HB2 SER 3 1HB SER 3 23.250 14.157 -14.307
12 HB3 SER 3 2HB SER 3 23.301 12.600 -15.133
13 HG SER 3 HG SER 3 21.382 14.662 -15.386
14 H GLY 4 H GLY 4 19.416 12.044 -13.587
15 HA2 GLY 4 1HA GLY 4 19.302 9.987 -15.407
16 HA3 GLY 4 2HA GLY 4 19.769 9.221 -13.896
17 H SER 5 H SER 5 18.345 9.684 -12.003
18 HA SER 5 HA SER 5 15.548 10.076 -12.838
19 HB2 SER 5 1HB SER 5 16.496 8.042 -10.807
20 HB3 SER 5 2HB SER 5 14.841 8.281 -11.367
21 HG SER 5 HG SER 5 16.816 6.814 -12.469
22 H SER 6 H SER 6 14.864 11.886 -11.913
23 HA SER 6 HA SER 6 15.941 12.711 -9.332
24 HB2 SER 6 1HB SER 6 15.804 14.363 -11.173
25 HB3 SER 6 2HB SER 6 14.051 14.172 -11.193
26 HG SER 6 HG SER 6 15.502 15.774 -9.662
27 H GLY 7 H GLY 7 14.423 13.596 -7.693
28 HA2 GLY 7 1HA GLY 7 12.220 13.645 -6.736
29 HA3 GLY 7 2HA GLY 7 11.804 12.251 -7.722
30 HA PRO 8 HA PRO 8 12.894 10.936 -3.349
31 HB2 PRO 8 1HB PRO 8 10.508 9.763 -2.797
32 HB3 PRO 8 2HB PRO 8 10.834 11.473 -2.485
33 HG2 PRO 8 1HG PRO 8 9.393 10.207 -4.784
34 HG3 PRO 8 2HG PRO 8 8.968 11.659 -3.860
35 HD2 PRO 8 1HD PRO 8 10.162 11.776 -6.287
36 HD3 PRO 8 2HD PRO 8 10.451 12.987 -5.022
37 H VAL 9 H VAL 9 14.287 9.328 -3.926
38 HA VAL 9 HA VAL 9 13.306 7.002 -5.381
39 HB VAL 9 HB VAL 9 15.648 6.259 -5.395
40 HG11 VAL 9 1HG1 VAL 9 15.948 9.073 -6.214
41 HG12 VAL 9 2HG1 VAL 9 16.178 7.588 -7.140
42 HG13 VAL 9 3HG1 VAL 9 14.553 8.225 -6.881
43 HG21 VAL 9 1HG2 VAL 9 16.485 7.047 -3.326
44 HG22 VAL 9 2HG2 VAL 9 17.378 7.912 -4.577
45 HG23 VAL 9 3HG2 VAL 9 16.070 8.717 -3.711
46 H ALA 10 H ALA 10 14.807 7.764 -2.254
47 HA ALA 10 HA ALA 10 15.184 5.410 -1.054
48 HB1 ALA 10 1HB ALA 10 14.071 7.968 -0.052
49 HB2 ALA 10 2HB ALA 10 13.972 6.563 1.011
50 HB3 ALA 10 3HB ALA 10 15.540 7.109 0.414
51 H GLY 11 H GLY 11 12.006 6.819 -1.697
52 HA2 GLY 11 1HA GLY 11 9.909 5.887 -1.708
53 HA3 GLY 11 2HA GLY 11 10.714 4.342 -1.934
54 HA PRO 12 HA PRO 12 8.877 4.998 2.466
55 HB2 PRO 12 1HB PRO 12 6.367 4.020 2.126
56 HB3 PRO 12 2HB PRO 12 6.761 5.734 1.953
57 HG2 PRO 12 1HG PRO 12 6.407 3.648 -0.165
58 HG3 PRO 12 2HG PRO 12 5.820 5.321 -0.133
59 HD2 PRO 12 1HD PRO 12 8.023 4.576 -1.521
60 HD3 PRO 12 2HD PRO 12 7.859 6.181 -0.780
61 H TYR 13 H TYR 13 8.296 3.248 3.922
62 HA TYR 13 HA TYR 13 8.623 0.558 2.786
63 HB2 TYR 13 1HB TYR 13 10.785 0.890 3.589
64 HB3 TYR 13 2HB TYR 13 10.237 1.850 4.959
65 HD1 TYR 13 1HD TYR 13 9.619 -1.609 3.663
66 HD2 TYR 13 2HD TYR 13 10.573 0.850 7.001
67 HE1 TYR 13 1HE TYR 13 9.726 -3.606 5.095
68 HE2 TYR 13 2HE TYR 13 10.685 -1.139 8.442
69 HH TYR 13 HH TYR 13 10.058 -3.362 8.563
70 H ILE 14 H ILE 14 6.983 -0.688 3.362
71 HA ILE 14 HA ILE 14 5.098 0.090 5.347
72 HB ILE 14 HB ILE 14 5.377 -2.581 3.963
73 HG12 ILE 14 1HG1 ILE 14 3.450 -0.391 3.225
74 HG13 ILE 14 2HG1 ILE 14 5.073 -0.439 2.544
75 HG21 ILE 14 1HG2 ILE 14 3.069 -1.336 5.449
76 HG22 ILE 14 2HG2 ILE 14 2.983 -2.828 4.513
77 HG23 ILE 14 3HG2 ILE 14 4.008 -2.743 5.946
78 HD11 ILE 14 1HD1 ILE 14 4.017 -3.015 2.226
79 HD12 ILE 14 2HD1 ILE 14 2.740 -1.888 1.765
80 HD13 ILE 14 3HD1 ILE 14 4.318 -1.802 0.982
81 H THR 15 H THR 15 5.161 -0.252 7.460
82 HA THR 15 HA THR 15 6.814 -2.470 8.482
83 HB THR 15 HB THR 15 7.586 -1.188 10.285
84 HG1 THR 15 1HG THR 15 6.672 1.007 10.600
85 HG21 THR 15 1HG2 THR 15 9.006 -0.024 9.025
86 HG22 THR 15 2HG2 THR 15 7.771 1.201 8.730
87 HG23 THR 15 3HG2 THR 15 7.909 -0.191 7.655
88 H PHE 16 H PHE 16 3.776 -1.750 7.969
89 HA PHE 16 HA PHE 16 2.841 -3.259 10.260
90 HB2 PHE 16 1HB PHE 16 2.760 -0.825 10.929
91 HB3 PHE 16 2HB PHE 16 1.577 -0.585 9.647
92 HD1 PHE 16 1HD PHE 16 2.215 -2.476 12.770
93 HD2 PHE 16 2HD PHE 16 -0.685 -1.031 10.009
94 HE1 PHE 16 1HE PHE 16 0.418 -3.147 14.311
95 HE2 PHE 16 2HE PHE 16 -2.486 -1.698 11.547
96 HZ PHE 16 HZ PHE 16 -1.936 -2.757 13.701
97 H THR 17 H THR 17 1.441 -4.726 9.566
98 HA THR 17 HA THR 17 -0.411 -4.076 7.406
99 HB THR 17 HB THR 17 0.164 -6.489 6.502
100 HG1 THR 17 1HG THR 17 1.795 -7.105 7.832
101 HG21 THR 17 1HG2 THR 17 0.949 -5.395 4.702
102 HG22 THR 17 2HG2 THR 17 2.256 -4.643 5.616
103 HG23 THR 17 3HG2 THR 17 0.642 -3.934 5.640
104 H ASP 18 H ASP 18 -2.314 -4.456 8.337
105 HA ASP 18 HA ASP 18 -2.773 -7.085 9.538
106 HB2 ASP 18 1HB ASP 18 -2.302 -5.181 11.267
107 HB3 ASP 18 2HB ASP 18 -3.941 -4.668 10.875
108 H ALA 19 H ALA 19 -5.067 -7.632 9.705
109 HA ALA 19 HA ALA 19 -6.581 -6.406 7.510
110 HB1 ALA 19 1HB ALA 19 -6.219 -8.775 7.257
111 HB2 ALA 19 2HB ALA 19 -6.894 -9.085 8.857
112 HB3 ALA 19 3HB ALA 19 -7.930 -8.478 7.566
113 H VAL 20 H VAL 20 -7.971 -4.890 8.132
114 HA VAL 20 HA VAL 20 -8.975 -4.655 10.780
115 HB VAL 20 HB VAL 20 -10.084 -3.316 8.313
116 HG11 VAL 20 1HG1 VAL 20 -11.564 -2.809 9.996
117 HG12 VAL 20 2HG1 VAL 20 -10.327 -2.874 11.253
118 HG13 VAL 20 3HG1 VAL 20 -10.406 -1.490 10.162
119 HG21 VAL 20 1HG2 VAL 20 -7.992 -2.111 10.085
120 HG22 VAL 20 2HG2 VAL 20 -7.539 -3.137 8.723
121 HG23 VAL 20 3HG2 VAL 20 -8.459 -1.658 8.446
122 H ASN 21 H ASN 21 -10.144 -6.169 7.867
123 HA ASN 21 HA ASN 21 -12.206 -7.528 9.335
124 HB2 ASN 21 1HB ASN 21 -12.859 -5.283 7.486
125 HB3 ASN 21 2HB ASN 21 -13.898 -6.705 7.448
126 HD21 ASN 21 1HD2 ASN 21 -14.922 -4.305 8.180
127 HD22 ASN 21 2HD2 ASN 21 -15.289 -4.305 9.869
128 H GLU 22 H GLU 22 -13.691 -8.669 7.473
129 HA GLU 22 HA GLU 22 -11.917 -10.472 6.194
130 HB2 GLU 22 1HB GLU 22 -14.009 -11.385 5.153
131 HB3 GLU 22 2HB GLU 22 -14.045 -11.289 6.908
132 HG2 GLU 22 1HG GLU 22 -15.138 -9.006 5.360
133 HG3 GLU 22 2HG GLU 22 -16.074 -10.498 5.426
134 H THR 23 H THR 23 -13.294 -7.480 5.249
135 HA THR 23 HA THR 23 -12.243 -7.867 2.527
136 HB THR 23 HB THR 23 -14.056 -6.404 1.666
137 HG1 THR 23 1HG THR 23 -15.946 -6.394 3.251
138 HG21 THR 23 1HG2 THR 23 -15.840 -8.349 2.677
139 HG22 THR 23 2HG2 THR 23 -14.264 -9.124 2.521
140 HG23 THR 23 3HG2 THR 23 -15.006 -8.344 1.125
141 H THR 24 H THR 24 -11.474 -6.467 5.201
142 HA THR 24 HA THR 24 -10.626 -3.961 3.915
143 HB THR 24 HB THR 24 -11.267 -4.012 6.846
144 HG1 THR 24 1HG THR 24 -13.369 -3.422 6.391
145 HG21 THR 24 1HG2 THR 24 -11.549 -1.617 6.514
146 HG22 THR 24 2HG2 THR 24 -11.297 -1.809 4.779
147 HG23 THR 24 3HG2 THR 24 -9.978 -2.134 5.904
148 H ILE 25 H ILE 25 -8.604 -3.173 4.527
149 HA ILE 25 HA ILE 25 -7.035 -4.749 6.424
150 HB ILE 25 HB ILE 25 -6.325 -4.362 3.525
151 HG12 ILE 25 1HG1 ILE 25 -6.283 -6.800 5.316
152 HG13 ILE 25 2HG1 ILE 25 -7.580 -6.398 4.196
153 HG21 ILE 25 1HG2 ILE 25 -4.212 -3.992 4.110
154 HG22 ILE 25 2HG2 ILE 25 -4.564 -4.287 5.812
155 HG23 ILE 25 3HG2 ILE 25 -4.179 -5.637 4.745
156 HD11 ILE 25 1HD1 ILE 25 -4.745 -7.132 3.528
157 HD12 ILE 25 2HD1 ILE 25 -6.214 -8.039 3.167
158 HD13 ILE 25 3HD1 ILE 25 -5.900 -6.507 2.351
159 H MET 26 H MET 26 -5.605 -3.564 7.569
160 HA MET 26 HA MET 26 -5.303 -0.735 6.805
161 HB2 MET 26 1HB MET 26 -6.501 -0.886 8.867
162 HB3 MET 26 2HB MET 26 -5.357 -2.051 9.519
163 HG2 MET 26 1HG MET 26 -4.611 -0.204 10.583
164 HG3 MET 26 2HG MET 26 -3.665 -0.059 9.104
165 HE1 MET 26 1HE MET 26 -4.277 1.195 7.141
166 HE2 MET 26 2HE MET 26 -5.130 2.738 7.150
167 HE3 MET 26 3HE MET 26 -3.598 2.571 8.010
168 H LEU 27 H LEU 27 -3.344 -0.141 6.174
169 HA LEU 27 HA LEU 27 -1.006 -1.506 7.317
170 HB2 LEU 27 1HB LEU 27 0.000 -1.859 5.269
171 HB3 LEU 27 2HB LEU 27 -1.690 -2.241 4.942
172 HG LEU 27 HG LEU 27 -0.568 0.474 4.332
173 HD11 LEU 27 1HD1 LEU 27 0.235 -1.984 3.121
174 HD12 LEU 27 2HD1 LEU 27 0.723 -0.337 2.726
175 HD13 LEU 27 3HD1 LEU 27 -0.703 -1.040 1.963
176 HD21 LEU 27 1HD2 LEU 27 -2.588 -0.785 2.622
177 HD22 LEU 27 2HD2 LEU 27 -2.524 0.843 3.298
178 HD23 LEU 27 3HD2 LEU 27 -3.108 -0.500 4.283
179 H LYS 28 H LYS 28 0.679 -0.213 7.842
180 HA LYS 28 HA LYS 28 0.438 2.644 7.156
181 HB2 LYS 28 1HB LYS 28 1.548 1.420 9.689
182 HB3 LYS 28 2HB LYS 28 1.521 3.139 9.317
183 HG2 LYS 28 1HG LYS 28 -0.850 3.210 9.423
184 HG3 LYS 28 2HG LYS 28 -0.960 1.450 9.496
185 HD2 LYS 28 1HD LYS 28 0.005 1.408 11.680
186 HD3 LYS 28 2HD LYS 28 0.412 3.124 11.594
187 HE2 LYS 28 1HE LYS 28 -2.035 3.609 11.429
188 HE3 LYS 28 2HE LYS 28 -2.340 1.899 11.732
189 HZ1 LYS 28 1HZ LYS 28 -0.966 2.236 13.819
190 HZ2 LYS 28 2HZ LYS 28 -2.510 2.925 13.805
191 HZ3 LYS 28 3HZ LYS 28 -1.148 3.897 13.556
192 H TRP 29 H TRP 29 2.204 3.678 6.377
193 HA TRP 29 HA TRP 29 4.647 2.062 6.057
194 HB2 TRP 29 1HB TRP 29 5.084 3.479 4.038
195 HB3 TRP 29 2HB TRP 29 3.644 2.473 3.910
196 HD1 TRP 29 HD TRP 29 4.726 6.129 4.222
197 HE1 TRP 29 1HE TRP 29 2.728 7.633 3.613
198 HE3 TRP 29 3HE TRP 29 1.094 2.548 3.865
199 HZ2 TRP 29 2HZ TRP 29 -0.024 7.340 3.055
200 HZ3 TRP 29 3HZ TRP 29 -1.195 3.244 3.290
201 HH2 TRP 29 HH TRP 29 -1.741 5.591 2.894
202 H MET 30 H MET 30 6.682 3.285 5.958
203 HA MET 30 HA MET 30 6.578 5.697 7.648
204 HB2 MET 30 1HB MET 30 8.461 5.009 8.834
205 HB3 MET 30 2HB MET 30 7.565 3.511 8.622
206 HG2 MET 30 1HG MET 30 9.014 2.795 6.881
207 HG3 MET 30 2HG MET 30 9.796 4.373 6.805
208 HE1 MET 30 1HE MET 30 12.545 4.404 8.798
209 HE2 MET 30 2HE MET 30 11.183 5.344 8.188
210 HE3 MET 30 3HE MET 30 11.305 4.984 9.911
211 H TYR 31 H TYR 31 8.391 7.199 7.359
212 HA TYR 31 HA TYR 31 9.426 7.150 4.599
213 HB2 TYR 31 1HB TYR 31 7.639 8.869 5.028
214 HB3 TYR 31 2HB TYR 31 8.729 9.629 6.182
215 HD1 TYR 31 1HD TYR 31 8.323 8.742 2.607
216 HD2 TYR 31 2HD TYR 31 10.437 11.090 5.456
217 HE1 TYR 31 1HE TYR 31 9.349 10.027 0.778
218 HE2 TYR 31 2HE TYR 31 11.468 12.383 3.635
219 HH TYR 31 HH TYR 31 11.065 11.470 0.278
220 H ILE 32 H ILE 32 11.563 7.276 4.379
221 HA ILE 32 HA ILE 32 13.165 7.881 6.766
222 HB ILE 32 HB ILE 32 14.023 6.470 4.237
223 HG12 ILE 32 1HG1 ILE 32 14.141 4.526 6.017
224 HG13 ILE 32 2HG1 ILE 32 12.928 5.496 6.846
225 HG21 ILE 32 1HG2 ILE 32 15.625 5.977 6.578
226 HG22 ILE 32 2HG2 ILE 32 16.109 6.574 4.992
227 HG23 ILE 32 3HG2 ILE 32 15.546 7.702 6.224
228 HD11 ILE 32 1HD1 ILE 32 12.058 3.679 5.349
229 HD12 ILE 32 2HD1 ILE 32 11.410 5.293 5.050
230 HD13 ILE 32 3HD1 ILE 32 12.650 4.629 3.986
231 HA PRO 33 HA PRO 33 13.897 11.693 4.394
232 HB2 PRO 33 1HB PRO 33 14.647 13.140 6.566
233 HB3 PRO 33 2HB PRO 33 12.955 12.872 6.128
234 HG2 PRO 33 1HG PRO 33 14.630 11.461 8.169
235 HG3 PRO 33 2HG PRO 33 12.953 12.024 8.293
236 HD2 PRO 33 1HD PRO 33 13.589 9.438 7.803
237 HD3 PRO 33 2HD PRO 33 12.124 10.201 7.152
238 H ALA 34 H ALA 34 15.947 10.165 6.838
239 HA ALA 34 HA ALA 34 18.325 11.381 6.670
240 HB1 ALA 34 1HB ALA 34 19.399 9.096 6.779
241 HB2 ALA 34 2HB ALA 34 18.159 9.427 7.989
242 HB3 ALA 34 3HB ALA 34 17.779 8.424 6.589
243 H SER 35 H SER 35 17.575 8.718 4.413
244 HA SER 35 HA SER 35 19.549 9.779 2.549
245 HB2 SER 35 1HB SER 35 19.623 7.384 3.000
246 HB3 SER 35 2HB SER 35 17.941 7.214 2.498
247 HG SER 35 HG SER 35 18.902 6.767 0.656
248 H ASN 36 H ASN 36 17.313 11.407 2.837
249 HA ASN 36 HA ASN 36 15.936 11.022 0.260
250 HB2 ASN 36 1HB ASN 36 14.390 10.820 2.153
251 HB3 ASN 36 2HB ASN 36 14.897 12.399 2.747
252 HD21 ASN 36 1HD2 ASN 36 14.079 11.201 -0.488
253 HD22 ASN 36 2HD2 ASN 36 12.843 12.368 -0.793
254 H ASN 37 H ASN 37 15.292 13.025 -0.840
255 HA ASN 37 HA ASN 37 17.395 15.041 -0.577
256 HB2 ASN 37 1HB ASN 37 15.614 14.137 -2.797
257 HB3 ASN 37 2HB ASN 37 16.215 15.793 -2.830
258 HD21 ASN 37 1HD2 ASN 37 18.025 16.065 -3.896
259 HD22 ASN 37 2HD2 ASN 37 19.258 14.879 -4.138
260 H ASN 38 H ASN 38 15.187 14.953 1.297
261 HA ASN 38 HA ASN 38 13.448 16.220 2.126
262 HB2 ASN 38 1HB ASN 38 15.591 17.427 2.674
263 HB3 ASN 38 2HB ASN 38 15.292 18.461 1.280
264 HD21 ASN 38 1HD2 ASN 38 15.255 20.239 2.725
265 HD22 ASN 38 2HD2 ASN 38 13.848 20.580 3.668
266 H THR 39 H THR 39 12.766 15.478 -0.423
267 HA THR 39 HA THR 39 11.770 17.910 -1.726
268 HB THR 39 HB THR 39 12.997 16.171 -3.083
269 HG1 THR 39 1HG THR 39 11.637 16.506 -4.809
270 HG21 THR 39 1HG2 THR 39 11.886 14.138 -3.689
271 HG22 THR 39 2HG2 THR 39 10.439 14.598 -2.790
272 HG23 THR 39 3HG2 THR 39 11.930 14.218 -1.928
273 HA PRO 40 HA PRO 40 7.699 17.244 -0.168
274 HB2 PRO 40 1HB PRO 40 6.323 18.703 -1.998
275 HB3 PRO 40 2HB PRO 40 7.298 19.438 -0.720
276 HG2 PRO 40 1HG PRO 40 7.984 18.977 -3.597
277 HG3 PRO 40 2HG PRO 40 8.286 20.405 -2.590
278 HD2 PRO 40 1HD PRO 40 10.204 18.570 -3.129
279 HD3 PRO 40 2HD PRO 40 10.145 19.468 -1.599
280 H ILE 41 H ILE 41 6.174 15.718 -0.426
281 HA ILE 41 HA ILE 41 6.112 14.268 -2.975
282 HB ILE 41 HB ILE 41 4.852 13.352 -0.400
283 HG12 ILE 41 1HG1 ILE 41 7.652 12.739 -1.367
284 HG13 ILE 41 2HG1 ILE 41 7.268 13.836 -0.045
285 HG21 ILE 41 1HG2 ILE 41 4.254 12.293 -2.607
286 HG22 ILE 41 2HG2 ILE 41 5.923 11.735 -2.699
287 HG23 ILE 41 3HG2 ILE 41 4.885 11.194 -1.381
288 HD11 ILE 41 1HD1 ILE 41 7.058 12.164 1.399
289 HD12 ILE 41 2HD1 ILE 41 6.055 11.225 0.294
290 HD13 ILE 41 3HD1 ILE 41 7.812 11.152 0.168
291 H HIS 42 H HIS 42 4.253 13.968 -4.131
292 HA HIS 42 HA HIS 42 2.168 15.882 -3.774
293 HB2 HIS 42 1HB HIS 42 2.731 13.686 -5.725
294 HB3 HIS 42 2HB HIS 42 1.113 14.379 -5.666
295 HD1 HIS 42 1HD HIS 42 1.567 15.272 -8.106
296 HD2 HIS 42 2HD HIS 42 3.978 16.908 -5.144
297 HE1 HIS 42 1HE HIS 42 2.609 17.315 -9.139
298 HE2 HIS 42 2HE HIS 42 4.129 18.240 -7.356
299 H GLY 43 H GLY 43 2.434 12.384 -3.298
300 HA2 GLY 43 1HA GLY 43 0.446 12.376 -1.269
301 HA3 GLY 43 2HA GLY 43 -0.221 11.772 -2.778
302 H PHE 44 H PHE 44 -0.509 9.667 -2.169
303 HA PHE 44 HA PHE 44 1.892 8.046 -2.072
304 HB2 PHE 44 1HB PHE 44 -0.008 8.303 0.237
305 HB3 PHE 44 2HB PHE 44 0.833 6.783 -0.047
306 HD1 PHE 44 2HD PHE 44 3.476 7.333 -0.697
307 HD2 PHE 44 1HD PHE 44 0.935 9.553 1.898
308 HE1 PHE 44 2HE PHE 44 5.450 8.205 0.485
309 HE2 PHE 44 1HE PHE 44 2.905 10.429 3.083
310 HZ PHE 44 HZ PHE 44 5.166 9.754 2.378
311 H TYR 45 H TYR 45 1.572 6.450 -3.460
312 HA TYR 45 HA TYR 45 -1.162 5.640 -4.108
313 HB2 TYR 45 1HB TYR 45 1.483 5.362 -5.501
314 HB3 TYR 45 2HB TYR 45 0.125 4.341 -5.959
315 HD1 TYR 45 2HD TYR 45 -2.170 6.036 -5.923
316 HD2 TYR 45 1HD TYR 45 1.805 6.998 -7.094
317 HE1 TYR 45 2HE TYR 45 -3.036 7.828 -7.368
318 HE2 TYR 45 1HE TYR 45 0.951 8.794 -8.541
319 HH TYR 45 HH TYR 45 -0.923 10.124 -8.913
320 H ILE 46 H ILE 46 -1.899 3.551 -3.934
321 HA ILE 46 HA ILE 46 -0.107 1.600 -2.656
322 HB ILE 46 HB ILE 46 -2.981 2.083 -1.865
323 HG12 ILE 46 1HG1 ILE 46 -0.675 2.416 0.003
324 HG13 ILE 46 2HG1 ILE 46 -1.006 3.703 -1.152
325 HG21 ILE 46 1HG2 ILE 46 -2.426 -0.245 -1.674
326 HG22 ILE 46 2HG2 ILE 46 -0.919 0.138 -0.845
327 HG23 ILE 46 3HG2 ILE 46 -2.464 0.459 -0.058
328 HD11 ILE 46 1HD1 ILE 46 -2.974 2.606 0.842
329 HD12 ILE 46 2HD1 ILE 46 -2.058 4.104 1.015
330 HD13 ILE 46 3HD1 ILE 46 -3.249 3.943 -0.275
331 H TYR 47 H TYR 47 -0.023 -0.248 -3.737
332 HA TYR 47 HA TYR 47 -2.183 -0.869 -5.630
333 HB2 TYR 47 1HB TYR 47 0.695 -1.790 -5.540
334 HB3 TYR 47 2HB TYR 47 -0.495 -2.379 -6.696
335 HD1 TYR 47 2HD TYR 47 0.564 0.981 -5.425
336 HD2 TYR 47 1HD TYR 47 -0.242 -1.484 -8.798
337 HE1 TYR 47 2HE TYR 47 1.093 2.862 -6.918
338 HE2 TYR 47 1HE TYR 47 0.286 0.390 -10.301
339 HH TYR 47 HH TYR 47 1.729 2.535 -10.131
340 H TYR 48 H TYR 48 -3.090 -2.929 -5.718
341 HA TYR 48 HA TYR 48 -2.285 -4.985 -3.870
342 HB2 TYR 48 1HB TYR 48 -4.595 -5.059 -2.802
343 HB3 TYR 48 2HB TYR 48 -3.535 -3.756 -2.277
344 HD1 TYR 48 2HD TYR 48 -3.962 -1.442 -3.002
345 HD2 TYR 48 1HD TYR 48 -6.621 -4.607 -4.009
346 HE1 TYR 48 2HE TYR 48 -5.695 0.206 -3.578
347 HE2 TYR 48 1HE TYR 48 -8.361 -2.968 -4.590
348 HH TYR 48 HH TYR 48 -8.373 -0.490 -5.356
349 H ARG 49 H ARG 49 -3.377 -6.984 -4.218
350 HA ARG 49 HA ARG 49 -5.483 -7.335 -6.053
351 HB2 ARG 49 1HB ARG 49 -4.353 -8.175 -7.991
352 HB3 ARG 49 2HB ARG 49 -3.692 -6.585 -7.634
353 HG2 ARG 49 1HG ARG 49 -1.759 -7.703 -8.024
354 HG3 ARG 49 2HG ARG 49 -1.920 -8.027 -6.297
355 HD2 ARG 49 1HD ARG 49 -2.959 -10.179 -6.792
356 HD3 ARG 49 2HD ARG 49 -2.832 -9.851 -8.520
357 HE ARG 49 HE ARG 49 -0.742 -10.754 -6.769
358 HH11 ARG 49 1HH1 ARG 49 -1.461 -9.067 -9.729
359 HH12 ARG 49 2HH1 ARG 49 0.083 -9.396 -10.444
360 HH21 ARG 49 1HH2 ARG 49 1.293 -11.193 -7.700
361 HH22 ARG 49 2HH2 ARG 49 1.648 -10.606 -9.289
362 HA PRO 50 HA PRO 50 -5.401 -11.227 -3.996
363 HB2 PRO 50 1HB PRO 50 -7.080 -12.606 -5.623
364 HB3 PRO 50 2HB PRO 50 -7.640 -11.366 -4.495
365 HG2 PRO 50 1HG PRO 50 -7.131 -11.158 -7.437
366 HG3 PRO 50 2HG PRO 50 -8.480 -10.510 -6.487
367 HD2 PRO 50 1HD PRO 50 -6.390 -8.982 -7.279
368 HD3 PRO 50 2HD PRO 50 -7.260 -8.695 -5.758
369 H THR 51 H THR 51 -4.323 -13.149 -4.080
370 HA THR 51 HA THR 51 -2.294 -13.526 -5.961
371 HB THR 51 HB THR 51 -2.631 -14.554 -3.566
372 HG1 THR 51 1HG THR 51 -0.937 -15.878 -4.058
373 HG21 THR 51 1HG2 THR 51 -3.693 -16.551 -3.370
374 HG22 THR 51 2HG2 THR 51 -3.279 -17.054 -5.010
375 HG23 THR 51 3HG2 THR 51 -4.613 -15.932 -4.741
376 H ASP 52 H ASP 52 -5.618 -14.364 -6.082
377 HA ASP 52 HA ASP 52 -5.409 -16.522 -7.940
378 HB2 ASP 52 1HB ASP 52 -7.384 -15.871 -6.367
379 HB3 ASP 52 2HB ASP 52 -7.852 -14.797 -7.683
380 H SER 53 H SER 53 -5.181 -13.130 -8.204
381 HA SER 53 HA SER 53 -6.216 -12.574 -10.705
382 HB2 SER 53 1HB SER 53 -4.004 -11.425 -9.067
383 HB3 SER 53 2HB SER 53 -4.120 -10.930 -10.756
384 HG SER 53 HG SER 53 -5.380 -9.787 -8.933
385 H ASP 54 H ASP 54 -4.700 -11.924 -12.626
386 HA ASP 54 HA ASP 54 -3.234 -14.355 -13.349
387 HB2 ASP 54 1HB ASP 54 -5.151 -13.241 -14.754
388 HB3 ASP 54 2HB ASP 54 -3.863 -12.167 -15.295
389 H ASN 55 H ASN 55 -2.904 -10.822 -13.710
390 HA ASN 55 HA ASN 55 -0.076 -11.014 -13.105
391 HB2 ASN 55 1HB ASN 55 0.384 -9.575 -15.228
392 HB3 ASN 55 2HB ASN 55 0.244 -11.323 -15.390
393 HD21 ASN 55 1HD2 ASN 55 -0.991 -8.292 -16.300
394 HD22 ASN 55 2HD2 ASN 55 -2.298 -8.854 -17.280
395 H ASP 56 H ASP 56 0.913 -8.691 -13.335
396 HA ASP 56 HA ASP 56 -0.125 -7.036 -11.458
397 HB2 ASP 56 1HB ASP 56 2.088 -6.697 -12.438
398 HB3 ASP 56 2HB ASP 56 1.356 -6.182 -13.955
399 H SER 57 H SER 57 -1.145 -7.303 -14.785
400 HA SER 57 HA SER 57 -2.482 -5.030 -15.341
401 HB2 SER 57 1HB SER 57 -2.499 -6.946 -16.851
402 HB3 SER 57 2HB SER 57 -3.542 -7.838 -15.744
403 HG SER 57 HG SER 57 -4.320 -6.316 -17.687
404 H ASP 58 H ASP 58 -3.252 -7.269 -12.820
405 HA ASP 58 HA ASP 58 -5.896 -6.182 -12.357
406 HB2 ASP 58 1HB ASP 58 -4.222 -8.289 -11.012
407 HB3 ASP 58 2HB ASP 58 -5.693 -7.682 -10.256
408 H TYR 59 H TYR 59 -2.715 -6.086 -10.806
409 HA TYR 59 HA TYR 59 -3.084 -4.869 -8.461
410 HB2 TYR 59 1HB TYR 59 -1.044 -4.464 -10.587
411 HB3 TYR 59 2HB TYR 59 -1.067 -3.306 -9.262
412 HD1 TYR 59 1HD TYR 59 -1.761 -4.992 -6.967
413 HD2 TYR 59 2HD TYR 59 0.840 -5.780 -10.241
414 HE1 TYR 59 1HE TYR 59 -0.487 -6.563 -5.569
415 HE2 TYR 59 2HE TYR 59 2.121 -7.355 -8.851
416 HH TYR 59 HH TYR 59 2.498 -8.024 -6.699
417 H LYS 60 H LYS 60 -4.142 -3.170 -7.697
418 HA LYS 60 HA LYS 60 -5.103 -1.140 -9.570
419 HB2 LYS 60 1HB LYS 60 -5.940 -2.031 -6.832
420 HB3 LYS 60 2HB LYS 60 -6.415 -0.442 -7.419
421 HG2 LYS 60 1HG LYS 60 -7.593 -1.409 -9.266
422 HG3 LYS 60 2HG LYS 60 -6.988 -3.018 -8.867
423 HD2 LYS 60 1HD LYS 60 -8.137 -2.613 -6.580
424 HD3 LYS 60 2HD LYS 60 -9.027 -1.352 -7.437
425 HE2 LYS 60 1HE LYS 60 -9.678 -3.079 -9.125
426 HE3 LYS 60 2HE LYS 60 -8.943 -4.296 -8.082
427 HZ1 LYS 60 1HZ LYS 60 -10.487 -3.381 -6.299
428 HZ2 LYS 60 2HZ LYS 60 -11.187 -4.318 -7.521
429 HZ3 LYS 60 3HZ LYS 60 -11.329 -2.632 -7.562
430 H LYS 61 H LYS 61 -5.453 1.061 -8.134
431 HA LYS 61 HA LYS 61 -2.979 1.720 -6.738
432 HB2 LYS 61 1HB LYS 61 -2.544 2.184 -9.133
433 HB3 LYS 61 2HB LYS 61 -3.925 3.274 -9.154
434 HG2 LYS 61 1HG LYS 61 -2.858 4.837 -7.779
435 HG3 LYS 61 2HG LYS 61 -1.633 3.676 -7.264
436 HD2 LYS 61 1HD LYS 61 -0.440 4.915 -8.789
437 HD3 LYS 61 2HD LYS 61 -1.055 3.623 -9.823
438 HE2 LYS 61 1HE LYS 61 -2.800 5.024 -10.655
439 HE3 LYS 61 2HE LYS 61 -2.440 6.275 -9.466
440 HZ1 LYS 61 1HZ LYS 61 -1.531 6.308 -11.965
441 HZ2 LYS 61 2HZ LYS 61 -0.242 5.520 -11.204
442 HZ3 LYS 61 3HZ LYS 61 -0.729 7.052 -10.674
443 H ASP 62 H ASP 62 -3.477 2.825 -4.972
444 HA ASP 62 HA ASP 62 -5.906 4.495 -4.997
445 HB2 ASP 62 1HB ASP 62 -4.865 2.574 -2.959
446 HB3 ASP 62 2HB ASP 62 -5.745 3.996 -2.405
447 H MET 63 H MET 63 -5.344 6.566 -5.010
448 HA MET 63 HA MET 63 -2.798 7.478 -4.071
449 HB2 MET 63 1HB MET 63 -4.388 8.426 -5.954
450 HB3 MET 63 2HB MET 63 -5.052 9.360 -4.621
451 HG2 MET 63 1HG MET 63 -2.582 9.987 -4.160
452 HG3 MET 63 2HG MET 63 -2.322 9.458 -5.820
453 HE1 MET 63 1HE MET 63 -4.835 11.527 -3.676
454 HE2 MET 63 2HE MET 63 -3.319 12.421 -3.571
455 HE3 MET 63 3HE MET 63 -4.699 13.122 -4.416
456 H VAL 64 H VAL 64 -2.325 8.721 -2.277
457 HA VAL 64 HA VAL 64 -4.461 9.275 -0.360
458 HB VAL 64 HB VAL 64 -1.945 7.854 0.506
459 HG11 VAL 64 1HG1 VAL 64 -3.187 9.335 2.124
460 HG12 VAL 64 2HG1 VAL 64 -4.540 8.209 1.989
461 HG13 VAL 64 3HG1 VAL 64 -2.991 7.655 2.624
462 HG21 VAL 64 1HG2 VAL 64 -3.201 5.824 0.687
463 HG22 VAL 64 2HG2 VAL 64 -4.688 6.639 0.206
464 HG23 VAL 64 3HG2 VAL 64 -3.381 6.430 -0.959
465 H GLU 65 H GLU 65 -4.089 11.033 0.937
466 HA GLU 65 HA GLU 65 -2.608 13.135 0.139
467 HB2 GLU 65 1HB GLU 65 -2.719 12.663 3.087
468 HB3 GLU 65 2HB GLU 65 -3.027 14.137 2.179
469 HG2 GLU 65 1HG GLU 65 -5.076 12.759 1.277
470 HG3 GLU 65 2HG GLU 65 -4.838 11.858 2.773
471 H GLY 66 H GLY 66 -0.558 13.953 0.388
472 HA2 GLY 66 1HA GLY 66 1.557 12.079 0.659
473 HA3 GLY 66 2HA GLY 66 1.734 13.821 0.512
474 H ASP 67 H ASP 67 -0.139 13.982 2.952
475 HA ASP 67 HA ASP 67 2.024 13.800 4.910
476 HB2 ASP 67 1HB ASP 67 -0.639 15.224 4.938
477 HB3 ASP 67 2HB ASP 67 0.418 15.138 6.344
478 H ARG 68 H ARG 68 -0.347 11.838 3.833
479 HA ARG 68 HA ARG 68 -1.130 10.815 6.458
480 HB2 ARG 68 1HB ARG 68 -2.722 11.177 4.426
481 HB3 ARG 68 2HB ARG 68 -2.046 9.661 3.844
482 HG2 ARG 68 1HG ARG 68 -3.825 8.832 4.967
483 HG3 ARG 68 2HG ARG 68 -2.676 8.886 6.306
484 HD2 ARG 68 1HD ARG 68 -4.424 11.240 5.706
485 HD3 ARG 68 2HD ARG 68 -5.054 9.873 6.623
486 HE ARG 68 HE ARG 68 -2.578 10.797 7.681
487 HH11 ARG 68 1HH1 ARG 68 -5.989 11.480 7.564
488 HH12 ARG 68 2HH1 ARG 68 -6.007 12.315 9.082
489 HH21 ARG 68 1HH2 ARG 68 -2.588 11.895 9.680
490 HH22 ARG 68 2HH2 ARG 68 -4.071 12.551 10.285
491 H TYR 69 H TYR 69 -0.361 8.972 7.305
492 HA TYR 69 HA TYR 69 1.465 7.368 5.637
493 HB2 TYR 69 1HB TYR 69 1.615 8.222 8.505
494 HB3 TYR 69 2HB TYR 69 2.396 6.726 8.003
495 HD1 TYR 69 2HD TYR 69 2.094 10.055 6.334
496 HD2 TYR 69 1HD TYR 69 4.679 7.086 7.947
497 HE1 TYR 69 2HE TYR 69 4.044 11.339 5.557
498 HE2 TYR 69 1HE TYR 69 6.636 8.362 7.176
499 HH TYR 69 HH TYR 69 6.976 11.062 6.640
500 H TRP 70 H TRP 70 -1.525 7.198 6.383
501 HA TRP 70 HA TRP 70 -1.468 4.322 6.922
502 HB2 TRP 70 1HB TRP 70 -3.132 4.417 8.621
503 HB3 TRP 70 2HB TRP 70 -1.909 5.605 9.063
504 HD1 TRP 70 HD TRP 70 -2.581 8.247 8.335
505 HE1 TRP 70 1HE TRP 70 -4.880 9.390 8.506
506 HE3 TRP 70 3HE TRP 70 -5.542 4.085 8.567
507 HZ2 TRP 70 2HZ TRP 70 -7.590 8.629 8.712
508 HZ3 TRP 70 3HZ TRP 70 -7.978 4.380 8.751
509 HH2 TRP 70 HH TRP 70 -8.979 6.606 8.822
510 H HIS 71 H HIS 71 -3.229 3.167 6.079
511 HA HIS 71 HA HIS 71 -5.369 4.533 4.720
512 HB2 HIS 71 1HB HIS 71 -3.519 4.715 3.080
513 HB3 HIS 71 2HB HIS 71 -3.370 2.960 3.080
514 HD1 HIS 71 1HD HIS 71 -6.063 5.550 2.350
515 HD2 HIS 71 2HD HIS 71 -4.818 1.779 1.128
516 HE1 HIS 71 1HE HIS 71 -7.572 4.931 0.435
517 HE2 HIS 71 2HE HIS 71 -6.855 2.610 -0.232
518 H SER 72 H SER 72 -7.140 3.294 4.715
519 HA SER 72 HA SER 72 -6.814 0.453 5.401
520 HB2 SER 72 1HB SER 72 -8.988 0.536 6.407
521 HB3 SER 72 2HB SER 72 -8.104 1.952 6.973
522 HG SER 72 HG SER 72 -9.810 2.971 6.276
523 H ILE 73 H ILE 73 -6.809 -0.717 3.580
524 HA ILE 73 HA ILE 73 -8.294 0.013 1.247
525 HB ILE 73 HB ILE 73 -7.011 -2.653 1.841
526 HG12 ILE 73 1HG1 ILE 73 -5.740 -0.387 0.316
527 HG13 ILE 73 2HG1 ILE 73 -5.522 -0.567 2.053
528 HG21 ILE 73 1HG2 ILE 73 -7.637 -1.308 -0.784
529 HG22 ILE 73 2HG2 ILE 73 -6.927 -2.907 -0.564
530 HG23 ILE 73 3HG2 ILE 73 -8.587 -2.602 -0.053
531 HD11 ILE 73 1HD1 ILE 73 -4.673 -2.890 1.580
532 HD12 ILE 73 2HD1 ILE 73 -4.652 -2.437 -0.125
533 HD13 ILE 73 3HD1 ILE 73 -3.650 -1.562 1.032
534 H SER 74 H SER 74 -10.030 -1.122 0.293
535 HA SER 74 HA SER 74 -11.493 -2.986 2.015
536 HB2 SER 74 1HB SER 74 -12.784 -0.579 0.710
537 HB3 SER 74 2HB SER 74 -13.592 -1.793 1.701
538 HG SER 74 HG SER 74 -11.424 -0.615 2.909
539 H HIS 75 H HIS 75 -13.664 -3.538 0.630
540 HA HIS 75 HA HIS 75 -14.456 -4.764 -1.115
541 HB2 HIS 75 1HB HIS 75 -12.769 -2.729 -2.561
542 HB3 HIS 75 2HB HIS 75 -13.695 -3.950 -3.428
543 HD1 HIS 75 1HD HIS 75 -15.873 -3.094 -4.189
544 HD2 HIS 75 2HD HIS 75 -14.676 -1.293 -0.642
545 HE1 HIS 75 1HE HIS 75 -17.691 -1.452 -3.621
546 HE2 HIS 75 2HE HIS 75 -16.904 -0.314 -1.517
547 H LEU 76 H LEU 76 -12.500 -6.051 0.234
548 HA LEU 76 HA LEU 76 -10.851 -7.284 -1.873
549 HB2 LEU 76 1HB LEU 76 -10.308 -7.458 1.075
550 HB3 LEU 76 2HB LEU 76 -9.218 -7.822 -0.261
551 HG LEU 76 HG LEU 76 -10.207 -5.027 0.140
552 HD11 LEU 76 1HD1 LEU 76 -7.629 -5.443 1.335
553 HD12 LEU 76 2HD1 LEU 76 -8.844 -6.441 2.132
554 HD13 LEU 76 3HD1 LEU 76 -9.074 -4.696 2.017
555 HD21 LEU 76 1HD2 LEU 76 -7.440 -5.597 -0.642
556 HD22 LEU 76 2HD2 LEU 76 -8.613 -4.480 -1.341
557 HD23 LEU 76 3HD2 LEU 76 -8.660 -6.191 -1.770
558 H GLN 77 H GLN 77 -10.194 -9.632 -1.082
559 HA GLN 77 HA GLN 77 -12.723 -11.043 -0.726
560 HB2 GLN 77 1HB GLN 77 -9.985 -12.009 -1.558
561 HB3 GLN 77 2HB GLN 77 -11.390 -13.052 -1.388
562 HG2 GLN 77 1HG GLN 77 -12.417 -12.211 -3.255
563 HG3 GLN 77 2HG GLN 77 -11.571 -10.667 -3.158
564 HE21 GLN 77 1HE2 GLN 77 -10.981 -10.786 -5.329
565 HE22 GLN 77 2HE2 GLN 77 -9.738 -11.851 -5.882
566 HA PRO 78 HA PRO 78 -11.922 -12.103 3.469
567 HB2 PRO 78 1HB PRO 78 -13.467 -14.328 3.652
568 HB3 PRO 78 2HB PRO 78 -14.139 -12.695 3.585
569 HG2 PRO 78 1HG PRO 78 -13.850 -14.715 1.395
570 HG3 PRO 78 2HG PRO 78 -15.221 -13.653 1.764
571 HD2 PRO 78 1HD PRO 78 -13.442 -13.105 -0.202
572 HD3 PRO 78 2HD PRO 78 -14.251 -11.833 0.736
573 H GLU 79 H GLU 79 -10.693 -13.500 4.716
574 HA GLU 79 HA GLU 79 -8.776 -14.777 4.940
575 HB2 GLU 79 1HB GLU 79 -9.402 -17.249 4.437
576 HB3 GLU 79 2HB GLU 79 -10.268 -16.384 5.699
577 HG2 GLU 79 1HG GLU 79 -12.150 -16.041 4.281
578 HG3 GLU 79 2HG GLU 79 -11.273 -16.654 2.880
579 H THR 80 H THR 80 -8.552 -13.387 2.570
580 HA THR 80 HA THR 80 -7.479 -15.390 0.693
581 HB THR 80 HB THR 80 -8.197 -12.524 0.056
582 HG1 THR 80 1HG THR 80 -10.119 -13.551 0.456
583 HG21 THR 80 1HG2 THR 80 -7.658 -12.968 -2.124
584 HG22 THR 80 2HG2 THR 80 -8.013 -14.689 -1.975
585 HG23 THR 80 3HG2 THR 80 -6.510 -14.039 -1.322
586 H SER 81 H SER 81 -5.381 -15.647 1.202
587 HA SER 81 HA SER 81 -3.744 -13.474 2.126
588 HB2 SER 81 1HB SER 81 -3.584 -16.080 2.594
589 HB3 SER 81 2HB SER 81 -2.548 -16.039 1.168
590 HG SER 81 HG SER 81 -2.174 -14.855 3.682
591 H TYR 82 H TYR 82 -3.288 -11.918 0.689
592 HA TYR 82 HA TYR 82 -2.033 -12.738 -1.841
593 HB2 TYR 82 1HB TYR 82 -3.096 -10.627 -2.826
594 HB3 TYR 82 2HB TYR 82 -4.157 -12.006 -2.555
595 HD1 TYR 82 1HD TYR 82 -2.995 -8.887 -0.861
596 HD2 TYR 82 2HD TYR 82 -6.157 -11.675 -1.436
597 HE1 TYR 82 1HE TYR 82 -4.484 -7.467 0.487
598 HE2 TYR 82 2HE TYR 82 -7.655 -10.262 -0.090
599 HH TYR 82 HH TYR 82 -7.289 -7.241 0.507
600 H ASP 83 H ASP 83 -0.556 -11.170 -2.743
601 HA ASP 83 HA ASP 83 1.055 -9.936 -0.721
602 HB2 ASP 83 1HB ASP 83 1.260 -10.054 -3.729
603 HB3 ASP 83 2HB ASP 83 2.421 -9.182 -2.732
604 H ILE 84 H ILE 84 1.597 -7.728 -0.541
605 HA ILE 84 HA ILE 84 -0.128 -5.823 -1.944
606 HB ILE 84 HB ILE 84 0.191 -5.870 1.059
607 HG12 ILE 84 1HG1 ILE 84 -2.421 -6.069 -0.396
608 HG13 ILE 84 2HG1 ILE 84 -1.430 -7.510 -0.193
609 HG21 ILE 84 1HG2 ILE 84 -0.821 -3.844 -0.851
610 HG22 ILE 84 2HG2 ILE 84 -1.709 -4.054 0.657
611 HG23 ILE 84 3HG2 ILE 84 0.003 -3.634 0.694
612 HD11 ILE 84 1HD1 ILE 84 -1.417 -6.725 2.319
613 HD12 ILE 84 2HD1 ILE 84 -2.907 -5.921 1.825
614 HD13 ILE 84 3HD1 ILE 84 -2.747 -7.668 1.649
615 H LYS 85 H LYS 85 0.726 -3.758 -2.160
616 HA LYS 85 HA LYS 85 3.203 -3.037 -0.871
617 HB2 LYS 85 1HB LYS 85 4.636 -3.056 -2.696
618 HB3 LYS 85 2HB LYS 85 3.718 -4.538 -2.933
619 HG2 LYS 85 1HG LYS 85 2.321 -3.458 -4.578
620 HG3 LYS 85 2HG LYS 85 3.126 -1.914 -4.287
621 HD2 LYS 85 1HD LYS 85 4.237 -2.643 -6.165
622 HD3 LYS 85 2HD LYS 85 5.283 -3.275 -4.891
623 HE2 LYS 85 1HE LYS 85 3.051 -4.985 -5.857
624 HE3 LYS 85 2HE LYS 85 4.457 -4.786 -6.902
625 HZ1 LYS 85 1HZ LYS 85 4.965 -6.636 -5.627
626 HZ2 LYS 85 2HZ LYS 85 4.318 -5.982 -4.208
627 HZ3 LYS 85 3HZ LYS 85 5.782 -5.395 -4.818
628 H MET 86 H MET 86 3.997 -0.865 -1.763
629 HA MET 86 HA MET 86 1.943 0.763 -3.000
630 HB2 MET 86 1HB MET 86 1.590 2.260 -1.230
631 HB3 MET 86 2HB MET 86 1.515 0.675 -0.471
632 HG2 MET 86 1HG MET 86 2.850 1.732 1.021
633 HG3 MET 86 2HG MET 86 4.084 1.131 -0.083
634 HE1 MET 86 1HE MET 86 2.105 5.022 -0.878
635 HE2 MET 86 2HE MET 86 1.481 3.717 0.132
636 HE3 MET 86 3HE MET 86 2.396 5.037 0.862
637 H GLN 87 H GLN 87 2.763 3.141 -3.072
638 HA GLN 87 HA GLN 87 5.584 3.557 -2.960
639 HB2 GLN 87 1HB GLN 87 5.653 2.254 -4.962
640 HB3 GLN 87 2HB GLN 87 4.281 3.116 -5.645
641 HG2 GLN 87 1HG GLN 87 5.855 5.191 -5.411
642 HG3 GLN 87 2HG GLN 87 7.122 3.966 -5.394
643 HE21 GLN 87 1HE2 GLN 87 7.189 2.473 -7.204
644 HE22 GLN 87 2HE2 GLN 87 6.683 3.017 -8.763
645 H CYS 88 H CYS 88 6.141 5.714 -3.178
646 HA CYS 88 HA CYS 88 3.866 7.557 -3.240
647 HB2 CYS 88 1HB CYS 88 5.084 8.997 -1.901
648 HB3 CYS 88 2HB CYS 88 5.695 7.436 -1.365
649 HG CYS 88 HG CYS 88 8.160 7.698 -2.186
650 H PHE 89 H PHE 89 4.364 9.767 -4.193
651 HA PHE 89 HA PHE 89 6.239 9.798 -6.392
652 HB2 PHE 89 1HB PHE 89 4.621 10.113 -8.149
653 HB3 PHE 89 2HB PHE 89 4.235 8.615 -7.308
654 HD1 PHE 89 1HD PHE 89 2.514 8.905 -5.318
655 HD2 PHE 89 2HD PHE 89 2.910 11.564 -8.619
656 HE1 PHE 89 1HE PHE 89 0.218 9.706 -4.944
657 HE2 PHE 89 2HE PHE 89 0.615 12.369 -8.250
658 HZ PHE 89 HZ PHE 89 -0.734 11.441 -6.410
659 H ASN 90 H ASN 90 6.330 11.903 -7.462
660 HA ASN 90 HA ASN 90 4.890 14.117 -6.336
661 HB2 ASN 90 1HB ASN 90 6.562 15.166 -5.112
662 HB3 ASN 90 2HB ASN 90 6.836 13.474 -4.709
663 HD21 ASN 90 1HD2 ASN 90 8.759 15.507 -4.489
664 HD22 ASN 90 2HD2 ASN 90 10.037 15.161 -5.598
665 H GLU 91 H GLU 91 5.618 16.209 -7.290
666 HA GLU 91 HA GLU 91 5.552 16.339 -9.953
667 HB2 GLU 91 1HB GLU 91 5.556 18.363 -8.675
668 HB3 GLU 91 2HB GLU 91 7.196 18.073 -8.110
669 HG2 GLU 91 1HG GLU 91 7.967 18.293 -10.472
670 HG3 GLU 91 2HG GLU 91 6.328 18.782 -10.900
671 H GLY 92 H GLY 92 8.482 15.717 -8.077
672 HA2 GLY 92 1HA GLY 92 10.319 15.804 -10.207
673 HA3 GLY 92 2HA GLY 92 10.550 14.938 -8.695
674 H GLY 93 H GLY 93 8.848 12.940 -8.658
675 HA2 GLY 93 1HA GLY 93 8.162 11.552 -10.928
676 HA3 GLY 93 2HA GLY 93 9.857 11.171 -10.668
677 H GLU 94 H GLU 94 7.909 9.207 -10.625
678 HA GLU 94 HA GLU 94 6.922 8.618 -8.048
679 HB2 GLU 94 1HB GLU 94 7.328 7.065 -10.566
680 HB3 GLU 94 2HB GLU 94 6.992 6.185 -9.082
681 HG2 GLU 94 1HG GLU 94 4.885 7.179 -8.836
682 HG3 GLU 94 2HG GLU 94 5.252 8.442 -10.009
683 H SER 95 H SER 95 7.682 7.264 -6.435
684 HA SER 95 HA SER 95 10.570 7.057 -6.288
685 HB2 SER 95 1HB SER 95 10.296 6.685 -3.979
686 HB3 SER 95 2HB SER 95 9.000 7.810 -4.384
687 HG SER 95 HG SER 95 7.660 5.865 -4.618
688 H GLU 96 H GLU 96 11.257 4.923 -4.985
689 HA GLU 96 HA GLU 96 11.043 2.812 -6.853
690 HB2 GLU 96 1HB GLU 96 12.032 2.720 -3.997
691 HB3 GLU 96 2HB GLU 96 12.326 1.500 -5.228
692 HG2 GLU 96 1HG GLU 96 13.180 4.330 -5.662
693 HG3 GLU 96 2HG GLU 96 14.163 3.228 -4.700
694 H PHE 97 H PHE 97 10.420 0.543 -6.164
695 HA PHE 97 HA PHE 97 7.692 0.637 -5.177
696 HB2 PHE 97 1HB PHE 97 9.360 -1.461 -6.540
697 HB3 PHE 97 2HB PHE 97 7.822 -1.875 -5.790
698 HD1 PHE 97 1HD PHE 97 9.126 0.833 -8.009
699 HD2 PHE 97 2HD PHE 97 6.060 -2.016 -7.236
700 HE1 PHE 97 1HE PHE 97 7.946 1.557 -10.043
701 HE2 PHE 97 2HE PHE 97 4.875 -1.297 -9.270
702 HZ PHE 97 HZ PHE 97 5.819 0.490 -10.676
703 H SER 98 H SER 98 7.256 0.385 -3.098
704 HA SER 98 HA SER 98 9.039 -0.274 -1.101
705 HB2 SER 98 1HB SER 98 7.043 -0.703 0.320
706 HB3 SER 98 2HB SER 98 6.906 0.787 -0.612
707 HG SER 98 HG SER 98 5.795 -1.703 -1.399
708 H ASN 99 H ASN 99 8.350 -2.235 0.492
709 HA ASN 99 HA ASN 99 9.152 -4.600 -0.952
710 HB2 ASN 99 1HB ASN 99 9.725 -5.494 1.093
711 HB3 ASN 99 2HB ASN 99 9.834 -3.776 1.466
712 HD21 ASN 99 1HD2 ASN 99 7.461 -2.908 1.995
713 HD22 ASN 99 2HD2 ASN 99 6.677 -3.804 3.247
714 H VAL 100 H VAL 100 8.048 -6.684 -0.644
715 HA VAL 100 HA VAL 100 5.191 -6.366 -1.058
716 HB VAL 100 HB VAL 100 6.899 -8.854 -1.219
717 HG11 VAL 100 1HG1 VAL 100 4.913 -9.646 -2.609
718 HG12 VAL 100 2HG1 VAL 100 4.695 -9.576 -0.859
719 HG13 VAL 100 3HG1 VAL 100 4.022 -8.308 -1.884
720 HG21 VAL 100 1HG2 VAL 100 6.096 -6.795 -3.236
721 HG22 VAL 100 2HG2 VAL 100 7.678 -7.521 -2.951
722 HG23 VAL 100 3HG2 VAL 100 6.404 -8.459 -3.732
723 H MET 101 H MET 101 3.912 -6.328 0.670
724 HA MET 101 HA MET 101 4.599 -8.005 2.983
725 HB2 MET 101 1HB MET 101 2.747 -5.624 2.780
726 HB3 MET 101 2HB MET 101 3.032 -6.556 4.244
727 HG2 MET 101 1HG MET 101 5.195 -5.110 2.739
728 HG3 MET 101 2HG MET 101 4.295 -4.410 4.082
729 HE1 MET 101 1HE MET 101 5.162 -4.568 6.518
730 HE2 MET 101 2HE MET 101 4.011 -5.896 6.371
731 HE3 MET 101 3HE MET 101 5.556 -6.154 7.182
732 H ILE 102 H ILE 102 3.431 -9.760 3.398
733 HA ILE 102 HA ILE 102 1.004 -10.235 1.848
734 HB ILE 102 HB ILE 102 2.571 -12.111 3.623
735 HG12 ILE 102 1HG1 ILE 102 2.379 -12.182 0.617
736 HG13 ILE 102 2HG1 ILE 102 3.624 -11.249 1.441
737 HG21 ILE 102 1HG2 ILE 102 -0.030 -12.384 3.029
738 HG22 ILE 102 2HG2 ILE 102 0.680 -13.139 1.603
739 HG23 ILE 102 3HG2 ILE 102 1.070 -13.750 3.211
740 HD11 ILE 102 1HD1 ILE 102 4.862 -13.058 1.721
741 HD12 ILE 102 2HD1 ILE 102 3.526 -13.917 2.488
742 HD13 ILE 102 3HD1 ILE 102 3.701 -13.944 0.733
743 H CYS 103 H CYS 103 -0.706 -9.264 2.792
744 HA CYS 103 HA CYS 103 -1.130 -9.711 5.669
745 HB2 CYS 103 1HB CYS 103 -1.030 -7.334 4.791
746 HB3 CYS 103 2HB CYS 103 -2.531 -7.672 3.937
747 HG CYS 103 HG CYS 103 -3.625 -8.513 6.614
748 H GLU 104 H GLU 104 -2.334 -11.477 5.963
749 HA GLU 104 HA GLU 104 -4.320 -12.303 4.044
750 HB2 GLU 104 1HB GLU 104 -2.807 -13.797 5.535
751 HB3 GLU 104 2HB GLU 104 -4.005 -13.489 6.785
752 HG2 GLU 104 1HG GLU 104 -5.660 -14.250 4.864
753 HG3 GLU 104 2HG GLU 104 -4.216 -15.091 4.302
754 H THR 105 H THR 105 -6.385 -11.731 4.028
755 HA THR 105 HA THR 105 -7.467 -9.925 5.921
756 HB THR 105 HB THR 105 -9.665 -10.442 4.735
757 HG1 THR 105 1HG THR 105 -8.922 -11.507 2.559
758 HG21 THR 105 1HG2 THR 105 -7.963 -8.623 4.148
759 HG22 THR 105 2HG2 THR 105 -9.119 -9.080 2.898
760 HG23 THR 105 3HG2 THR 105 -7.464 -9.685 2.832
761 H LYS 106 H LYS 106 -9.910 -10.562 6.637
762 HA LYS 106 HA LYS 106 -9.522 -12.763 8.512
763 HB2 LYS 106 1HB LYS 106 -11.563 -10.548 8.341
764 HB3 LYS 106 2HB LYS 106 -11.673 -11.857 9.510
765 HG2 LYS 106 1HG LYS 106 -9.200 -11.088 10.053
766 HG3 LYS 106 2HG LYS 106 -9.799 -9.564 9.394
767 HD2 LYS 106 1HD LYS 106 -11.813 -9.980 10.994
768 HD3 LYS 106 2HD LYS 106 -10.694 -11.066 11.822
769 HE2 LYS 106 1HE LYS 106 -9.085 -8.990 11.657
770 HE3 LYS 106 2HE LYS 106 -10.601 -8.102 11.515
771 HZ1 LYS 106 1HZ LYS 106 -10.115 -10.036 13.701
772 HZ2 LYS 106 2HZ LYS 106 -11.296 -8.828 13.614
773 HZ3 LYS 106 3HZ LYS 106 -9.671 -8.409 13.830
774 H ALA 107 H ALA 107 -11.115 -14.396 8.832
775 HA ALA 107 HA ALA 107 -12.136 -15.481 6.418
776 HB1 ALA 107 1HB ALA 107 -13.284 -16.567 8.875
777 HB2 ALA 107 2HB ALA 107 -12.358 -17.366 7.603
778 HB3 ALA 107 3HB ALA 107 -11.522 -16.491 8.886
779 H ARG 108 H ARG 108 -14.140 -15.455 5.548
780 HA ARG 108 HA ARG 108 -15.976 -13.448 6.435
781 HB2 ARG 108 1HB ARG 108 -17.395 -14.355 4.541
782 HB3 ARG 108 2HB ARG 108 -15.809 -13.744 4.090
783 HG2 ARG 108 1HG ARG 108 -15.010 -15.810 3.550
784 HG3 ARG 108 2HG ARG 108 -16.074 -16.640 4.686
785 HD2 ARG 108 1HD ARG 108 -17.987 -16.136 3.210
786 HD3 ARG 108 2HD ARG 108 -16.877 -15.390 2.062
787 HE ARG 108 HE ARG 108 -16.124 -18.068 2.686
788 HH11 ARG 108 1HH1 ARG 108 -18.309 -16.147 0.774
789 HH12 ARG 108 2HH1 ARG 108 -18.507 -17.356 -0.451
790 HH21 ARG 108 1HH2 ARG 108 -16.377 -19.668 1.080
791 HH22 ARG 108 2HH2 ARG 108 -17.408 -19.359 -0.275
792 H SER 109 H SER 109 -16.458 -14.248 8.564
793 HA SER 109 HA SER 109 -17.676 -16.765 9.013
794 HB2 SER 109 1HB SER 109 -18.039 -16.033 11.232
795 HB3 SER 109 2HB SER 109 -16.559 -15.216 10.729
796 HG SER 109 HG SER 109 -17.539 -13.364 10.902
797 H GLY 110 H GLY 110 -19.925 -16.975 9.934
798 HA2 GLY 110 1HA GLY 110 -21.777 -15.565 8.139
799 HA3 GLY 110 2HA GLY 110 -22.088 -17.104 8.929
800 HA PRO 111 HA PRO 111 -24.298 -13.730 11.250
801 HB2 PRO 111 1HB PRO 111 -26.699 -14.995 11.299
802 HB3 PRO 111 2HB PRO 111 -26.193 -13.947 9.969
803 HG2 PRO 111 1HG PRO 111 -26.134 -16.935 10.155
804 HG3 PRO 111 2HG PRO 111 -26.630 -15.908 8.797
805 HD2 PRO 111 1HD PRO 111 -24.199 -17.096 8.914
806 HD3 PRO 111 2HD PRO 111 -24.457 -15.523 8.131
807 H SER 112 H SER 112 -24.270 -17.243 11.554
808 HA SER 112 HA SER 112 -24.837 -17.067 14.412
809 HB2 SER 112 1HB SER 112 -25.137 -19.433 14.369
810 HB3 SER 112 2HB SER 112 -25.905 -18.814 12.907
811 HG SER 112 HG SER 112 -24.122 -20.681 13.013
812 H SER 113 H SER 113 -23.286 -17.020 15.889
813 HA SER 113 HA SER 113 -20.527 -17.449 15.077
814 HB2 SER 113 1HB SER 113 -21.815 -16.316 17.557
815 HB3 SER 113 2HB SER 113 -20.087 -16.659 17.480
816 HG SER 113 HG SER 113 -20.155 -15.308 15.500
817 H GLY 114 H GLY 114 -19.078 -18.835 16.208
818 HA2 GLY 114 1HA GLY 114 -20.410 -21.008 17.702
819 HA3 GLY 114 2HA GLY 114 -19.233 -21.346 16.441
Start of MODEL 2
1 H1 GLY 1 H GLY 1 26.342 1.034 -14.109
2 HA2 GLY 1 1HA GLY 1 26.069 2.947 -15.371
3 HA3 GLY 1 2HA GLY 1 24.330 2.739 -15.222
4 H SER 2 H SER 2 26.320 5.055 -14.874
5 HA SER 2 HA SER 2 25.399 5.905 -12.207
6 HB2 SER 2 1HB SER 2 27.825 6.831 -13.765
7 HB3 SER 2 2HB SER 2 27.331 7.447 -12.189
8 HG SER 2 HG SER 2 27.638 4.692 -12.444
9 H SER 3 H SER 3 23.597 7.065 -12.503
10 HA SER 3 HA SER 3 23.768 9.500 -14.067
11 HB2 SER 3 1HB SER 3 21.977 7.211 -14.784
12 HB3 SER 3 2HB SER 3 21.401 8.859 -15.035
13 HG SER 3 HG SER 3 22.532 8.816 -16.795
14 H GLY 4 H GLY 4 22.581 11.129 -13.208
15 HA2 GLY 4 1HA GLY 4 21.468 10.765 -10.611
16 HA3 GLY 4 2HA GLY 4 21.436 12.248 -11.554
17 H SER 5 H SER 5 19.292 11.499 -9.983
18 HA SER 5 HA SER 5 17.243 11.116 -12.036
19 HB2 SER 5 1HB SER 5 17.869 8.961 -10.622
20 HB3 SER 5 2HB SER 5 16.826 9.726 -9.424
21 HG SER 5 HG SER 5 15.400 9.937 -11.479
22 H SER 6 H SER 6 15.302 12.151 -11.624
23 HA SER 6 HA SER 6 15.414 14.132 -9.467
24 HB2 SER 6 1HB SER 6 13.614 14.018 -11.900
25 HB3 SER 6 2HB SER 6 13.693 15.340 -10.736
26 HG SER 6 HG SER 6 15.428 16.052 -11.684
27 H GLY 7 H GLY 7 13.736 14.425 -8.005
28 HA2 GLY 7 1HA GLY 7 11.673 13.956 -6.985
29 HA3 GLY 7 2HA GLY 7 11.450 12.618 -8.101
30 HA PRO 8 HA PRO 8 12.810 11.134 -3.830
31 HB2 PRO 8 1HB PRO 8 10.527 9.807 -3.202
32 HB3 PRO 8 2HB PRO 8 10.790 11.509 -2.801
33 HG2 PRO 8 1HG PRO 8 9.260 10.314 -5.080
34 HG3 PRO 8 2HG PRO 8 8.829 11.682 -4.038
35 HD2 PRO 8 1HD PRO 8 9.849 12.010 -6.524
36 HD3 PRO 8 2HD PRO 8 10.165 13.155 -5.204
37 H VAL 9 H VAL 9 13.720 9.157 -3.574
38 HA VAL 9 HA VAL 9 12.916 7.019 -5.436
39 HB VAL 9 HB VAL 9 15.409 6.338 -5.311
40 HG11 VAL 9 1HG1 VAL 9 15.920 7.656 -7.278
41 HG12 VAL 9 2HG1 VAL 9 14.238 7.127 -7.332
42 HG13 VAL 9 3HG1 VAL 9 14.627 8.789 -6.886
43 HG21 VAL 9 1HG2 VAL 9 17.001 7.916 -4.751
44 HG22 VAL 9 2HG2 VAL 9 15.886 9.267 -4.951
45 HG23 VAL 9 3HG2 VAL 9 15.754 8.217 -3.541
46 H ALA 10 H ALA 10 14.109 7.938 -2.287
47 HA ALA 10 HA ALA 10 14.785 5.524 -1.156
48 HB1 ALA 10 1HB ALA 10 13.707 6.612 0.977
49 HB2 ALA 10 2HB ALA 10 15.166 7.290 0.253
50 HB3 ALA 10 3HB ALA 10 13.597 8.029 -0.068
51 H GLY 11 H GLY 11 11.576 6.822 -1.792
52 HA2 GLY 11 1HA GLY 11 9.500 5.845 -1.733
53 HA3 GLY 11 2HA GLY 11 10.341 4.310 -1.895
54 HA PRO 12 HA PRO 12 8.541 5.143 2.495
55 HB2 PRO 12 1HB PRO 12 6.030 4.144 2.232
56 HB3 PRO 12 2HB PRO 12 6.416 5.851 1.983
57 HG2 PRO 12 1HG PRO 12 6.039 3.679 -0.042
58 HG3 PRO 12 2HG PRO 12 5.448 5.350 -0.071
59 HD2 PRO 12 1HD PRO 12 7.633 4.555 -1.458
60 HD3 PRO 12 2HD PRO 12 7.474 6.189 -0.782
61 H TYR 13 H TYR 13 8.203 3.486 4.045
62 HA TYR 13 HA TYR 13 8.581 0.755 3.003
63 HB2 TYR 13 1HB TYR 13 10.633 1.220 4.004
64 HB3 TYR 13 2HB TYR 13 9.904 2.182 5.286
65 HD1 TYR 13 1HD TYR 13 9.305 -1.308 4.082
66 HD2 TYR 13 2HD TYR 13 10.372 1.223 7.331
67 HE1 TYR 13 1HE TYR 13 9.368 -3.261 5.575
68 HE2 TYR 13 2HE TYR 13 10.440 -0.724 8.833
69 HH TYR 13 HH TYR 13 9.701 -2.930 9.021
70 H ILE 14 H ILE 14 7.144 -0.723 3.629
71 HA ILE 14 HA ILE 14 4.996 0.060 5.397
72 HB ILE 14 HB ILE 14 5.425 -2.601 4.037
73 HG12 ILE 14 1HG1 ILE 14 3.661 -0.343 3.089
74 HG13 ILE 14 2HG1 ILE 14 5.311 -0.560 2.515
75 HG21 ILE 14 1HG2 ILE 14 2.835 -2.535 4.267
76 HG22 ILE 14 2HG2 ILE 14 3.825 -2.994 5.651
77 HG23 ILE 14 3HG2 ILE 14 3.162 -1.363 5.543
78 HD11 ILE 14 1HD1 ILE 14 2.913 -1.827 1.638
79 HD12 ILE 14 2HD1 ILE 14 4.543 -1.937 0.970
80 HD13 ILE 14 3HD1 ILE 14 4.034 -3.047 2.243
81 H THR 15 H THR 15 5.234 -0.101 7.522
82 HA THR 15 HA THR 15 6.725 -2.404 8.602
83 HB THR 15 HB THR 15 7.612 -1.131 10.294
84 HG1 THR 15 1HG THR 15 6.485 0.350 11.350
85 HG21 THR 15 1HG2 THR 15 8.780 0.448 9.198
86 HG22 THR 15 2HG2 THR 15 7.327 1.333 8.734
87 HG23 THR 15 3HG2 THR 15 7.852 -0.060 7.788
88 H PHE 16 H PHE 16 3.712 -1.574 8.021
89 HA PHE 16 HA PHE 16 2.699 -2.994 10.356
90 HB2 PHE 16 1HB PHE 16 2.586 -0.392 10.615
91 HB3 PHE 16 2HB PHE 16 1.235 -0.523 9.494
92 HD1 PHE 16 2HD PHE 16 -0.194 -2.856 10.279
93 HD2 PHE 16 1HD PHE 16 1.801 -0.007 12.733
94 HE1 PHE 16 2HE PHE 16 -1.690 -3.423 12.148
95 HE2 PHE 16 1HE PHE 16 0.308 -0.570 14.606
96 HZ PHE 16 HZ PHE 16 -1.441 -2.279 14.315
97 H THR 17 H THR 17 1.419 -4.569 9.677
98 HA THR 17 HA THR 17 -0.377 -4.117 7.418
99 HB THR 17 HB THR 17 0.298 -6.535 6.658
100 HG1 THR 17 1HG THR 17 1.824 -6.912 8.303
101 HG21 THR 17 1HG2 THR 17 1.103 -5.472 4.863
102 HG22 THR 17 2HG2 THR 17 2.450 -4.797 5.779
103 HG23 THR 17 3HG2 THR 17 0.890 -3.976 5.770
104 H ASP 18 H ASP 18 -2.307 -4.526 8.273
105 HA ASP 18 HA ASP 18 -2.753 -7.099 9.570
106 HB2 ASP 18 1HB ASP 18 -3.702 -6.257 11.537
107 HB3 ASP 18 2HB ASP 18 -2.282 -5.241 11.303
108 H ALA 19 H ALA 19 -4.969 -7.753 9.591
109 HA ALA 19 HA ALA 19 -6.504 -6.512 7.430
110 HB1 ALA 19 1HB ALA 19 -7.821 -8.600 7.460
111 HB2 ALA 19 2HB ALA 19 -6.100 -8.879 7.188
112 HB3 ALA 19 3HB ALA 19 -6.804 -9.194 8.774
113 H VAL 20 H VAL 20 -7.826 -4.947 8.114
114 HA VAL 20 HA VAL 20 -8.893 -4.761 10.725
115 HB VAL 20 HB VAL 20 -9.962 -3.410 8.245
116 HG11 VAL 20 1HG1 VAL 20 -10.394 -1.609 10.077
117 HG12 VAL 20 2HG1 VAL 20 -11.503 -2.971 9.908
118 HG13 VAL 20 3HG1 VAL 20 -10.284 -2.977 11.184
119 HG21 VAL 20 1HG2 VAL 20 -8.352 -1.760 8.415
120 HG22 VAL 20 2HG2 VAL 20 -7.970 -2.157 10.091
121 HG23 VAL 20 3HG2 VAL 20 -7.424 -3.213 8.788
122 H ASN 21 H ASN 21 -10.004 -6.297 7.809
123 HA ASN 21 HA ASN 21 -12.067 -7.680 9.236
124 HB2 ASN 21 1HB ASN 21 -12.744 -5.392 7.455
125 HB3 ASN 21 2HB ASN 21 -13.763 -6.825 7.356
126 HD21 ASN 21 1HD2 ASN 21 -14.634 -4.306 8.225
127 HD22 ASN 21 2HD2 ASN 21 -15.088 -4.435 9.887
128 H GLU 22 H GLU 22 -13.546 -8.792 7.350
129 HA GLU 22 HA GLU 22 -11.744 -10.534 6.014
130 HB2 GLU 22 1HB GLU 22 -13.718 -11.631 5.145
131 HB3 GLU 22 2HB GLU 22 -13.967 -11.238 6.841
132 HG2 GLU 22 1HG GLU 22 -14.910 -9.304 4.794
133 HG3 GLU 22 2HG GLU 22 -15.821 -10.794 5.029
134 H THR 23 H THR 23 -13.168 -7.546 5.171
135 HA THR 23 HA THR 23 -12.186 -7.858 2.415
136 HB THR 23 HB THR 23 -14.038 -6.381 1.643
137 HG1 THR 23 1HG THR 23 -15.471 -5.637 3.032
138 HG21 THR 23 1HG2 THR 23 -14.735 -8.429 1.035
139 HG22 THR 23 2HG2 THR 23 -15.846 -8.298 2.398
140 HG23 THR 23 3HG2 THR 23 -14.307 -9.136 2.593
141 H THR 24 H THR 24 -11.291 -6.546 5.058
142 HA THR 24 HA THR 24 -10.481 -4.017 3.815
143 HB THR 24 HB THR 24 -11.309 -4.131 6.712
144 HG1 THR 24 1HG THR 24 -13.251 -4.322 5.800
145 HG21 THR 24 1HG2 THR 24 -11.245 -1.685 4.998
146 HG22 THR 24 2HG2 THR 24 -9.734 -2.333 5.636
147 HG23 THR 24 3HG2 THR 24 -11.018 -1.842 6.740
148 H ILE 25 H ILE 25 -8.477 -3.217 4.490
149 HA ILE 25 HA ILE 25 -6.956 -4.787 6.428
150 HB ILE 25 HB ILE 25 -6.190 -4.443 3.540
151 HG12 ILE 25 1HG1 ILE 25 -6.061 -6.866 5.342
152 HG13 ILE 25 2HG1 ILE 25 -7.452 -6.477 4.336
153 HG21 ILE 25 1HG2 ILE 25 -4.102 -4.003 4.183
154 HG22 ILE 25 2HG2 ILE 25 -4.464 -4.357 5.871
155 HG23 ILE 25 3HG2 ILE 25 -4.041 -5.665 4.767
156 HD11 ILE 25 1HD1 ILE 25 -6.136 -8.104 3.204
157 HD12 ILE 25 2HD1 ILE 25 -5.949 -6.570 2.355
158 HD13 ILE 25 3HD1 ILE 25 -4.669 -7.149 3.421
159 H MET 26 H MET 26 -5.571 -3.588 7.607
160 HA MET 26 HA MET 26 -5.273 -0.761 6.848
161 HB2 MET 26 1HB MET 26 -6.434 -0.951 8.928
162 HB3 MET 26 2HB MET 26 -5.267 -2.112 9.546
163 HG2 MET 26 1HG MET 26 -4.516 -0.275 10.620
164 HG3 MET 26 2HG MET 26 -3.607 -0.090 9.122
165 HE1 MET 26 1HE MET 26 -4.364 1.177 7.161
166 HE2 MET 26 2HE MET 26 -5.165 2.744 7.269
167 HE3 MET 26 3HE MET 26 -3.596 2.501 8.038
168 H LEU 27 H LEU 27 -3.329 -0.109 6.224
169 HA LEU 27 HA LEU 27 -0.955 -1.451 7.312
170 HB2 LEU 27 1HB LEU 27 -0.001 -1.855 5.268
171 HB3 LEU 27 2HB LEU 27 -1.701 -2.170 4.926
172 HG LEU 27 HG LEU 27 -0.484 0.510 4.350
173 HD11 LEU 27 1HD1 LEU 27 -0.029 -2.038 2.941
174 HD12 LEU 27 2HD1 LEU 27 0.941 -0.566 2.976
175 HD13 LEU 27 3HD1 LEU 27 -0.477 -0.663 1.932
176 HD21 LEU 27 1HD2 LEU 27 -2.627 -0.867 2.793
177 HD22 LEU 27 2HD2 LEU 27 -2.337 0.857 3.025
178 HD23 LEU 27 3HD2 LEU 27 -3.017 -0.107 4.336
179 H LYS 28 H LYS 28 0.784 -0.144 7.696
180 HA LYS 28 HA LYS 28 0.457 2.711 7.044
181 HB2 LYS 28 1HB LYS 28 1.536 1.445 9.564
182 HB3 LYS 28 2HB LYS 28 1.726 3.151 9.179
183 HG2 LYS 28 1HG LYS 28 -0.115 3.055 10.612
184 HG3 LYS 28 2HG LYS 28 -0.809 3.232 8.999
185 HD2 LYS 28 1HD LYS 28 -1.616 1.083 8.962
186 HD3 LYS 28 2HD LYS 28 -0.383 0.487 10.075
187 HE2 LYS 28 1HE LYS 28 -2.779 0.656 10.947
188 HE3 LYS 28 2HE LYS 28 -1.499 1.340 11.947
189 HZ1 LYS 28 1HZ LYS 28 -3.273 2.890 11.883
190 HZ2 LYS 28 2HZ LYS 28 -3.389 2.808 10.197
191 HZ3 LYS 28 3HZ LYS 28 -2.038 3.527 10.918
192 H TRP 29 H TRP 29 2.261 3.844 6.391
193 HA TRP 29 HA TRP 29 4.689 2.237 5.935
194 HB2 TRP 29 1HB TRP 29 5.052 3.712 3.921
195 HB3 TRP 29 2HB TRP 29 3.673 2.622 3.806
196 HD1 TRP 29 HD TRP 29 4.516 6.342 4.219
197 HE1 TRP 29 1HE TRP 29 2.430 7.723 3.611
198 HE3 TRP 29 3HE TRP 29 1.152 2.532 3.667
199 HZ2 TRP 29 2HZ TRP 29 -0.281 7.259 2.980
200 HZ3 TRP 29 3HZ TRP 29 -1.168 3.085 3.060
201 HH2 TRP 29 HH TRP 29 -1.868 5.400 2.725
202 H MET 30 H MET 30 6.708 3.405 5.922
203 HA MET 30 HA MET 30 6.601 5.876 7.524
204 HB2 MET 30 1HB MET 30 8.335 5.167 8.850
205 HB3 MET 30 2HB MET 30 7.572 3.622 8.497
206 HG2 MET 30 1HG MET 30 9.721 3.069 8.059
207 HG3 MET 30 2HG MET 30 9.258 3.663 6.465
208 HE1 MET 30 1HE MET 30 11.693 6.005 9.583
209 HE2 MET 30 2HE MET 30 10.249 5.041 9.897
210 HE3 MET 30 3HE MET 30 11.774 4.244 9.506
211 H TYR 31 H TYR 31 8.477 7.321 7.248
212 HA TYR 31 HA TYR 31 9.517 7.206 4.492
213 HB2 TYR 31 1HB TYR 31 7.826 9.018 4.946
214 HB3 TYR 31 2HB TYR 31 8.975 9.719 6.081
215 HD1 TYR 31 1HD TYR 31 8.454 8.861 2.515
216 HD2 TYR 31 2HD TYR 31 10.761 11.070 5.326
217 HE1 TYR 31 1HE TYR 31 9.521 10.085 0.668
218 HE2 TYR 31 2HE TYR 31 11.834 12.301 3.487
219 HH TYR 31 HH TYR 31 12.245 11.644 0.827
220 H ILE 32 H ILE 32 11.659 7.570 4.161
221 HA ILE 32 HA ILE 32 13.325 7.758 6.571
222 HB ILE 32 HB ILE 32 14.077 6.846 3.792
223 HG12 ILE 32 1HG1 ILE 32 12.530 5.341 5.093
224 HG13 ILE 32 2HG1 ILE 32 14.074 4.614 4.661
225 HG21 ILE 32 1HG2 ILE 32 15.653 7.574 6.119
226 HG22 ILE 32 2HG2 ILE 32 15.979 5.931 5.569
227 HG23 ILE 32 3HG2 ILE 32 16.160 7.286 4.455
228 HD11 ILE 32 1HD1 ILE 32 14.869 4.736 6.853
229 HD12 ILE 32 2HD1 ILE 32 13.623 5.888 7.334
230 HD13 ILE 32 3HD1 ILE 32 13.193 4.209 7.009
231 HA PRO 33 HA PRO 33 13.923 11.972 4.971
232 HB2 PRO 33 1HB PRO 33 14.736 12.980 7.358
233 HB3 PRO 33 2HB PRO 33 13.033 12.769 6.934
234 HG2 PRO 33 1HG PRO 33 14.801 11.019 8.599
235 HG3 PRO 33 2HG PRO 33 13.123 11.513 8.889
236 HD2 PRO 33 1HD PRO 33 13.774 9.087 7.878
237 HD3 PRO 33 2HD PRO 33 12.276 9.932 7.441
238 H ALA 34 H ALA 34 16.053 9.804 6.680
239 HA ALA 34 HA ALA 34 18.435 11.200 6.710
240 HB1 ALA 34 1HB ALA 34 18.412 9.125 7.795
241 HB2 ALA 34 2HB ALA 34 17.852 8.277 6.353
242 HB3 ALA 34 3HB ALA 34 19.501 8.898 6.426
243 H SER 35 H SER 35 17.751 8.724 4.242
244 HA SER 35 HA SER 35 19.555 10.052 2.404
245 HB2 SER 35 1HB SER 35 18.183 7.406 2.512
246 HB3 SER 35 2HB SER 35 18.661 8.022 0.930
247 HG SER 35 HG SER 35 20.294 6.743 1.956
248 H ASN 36 H ASN 36 17.258 11.561 3.031
249 HA ASN 36 HA ASN 36 15.615 11.384 0.605
250 HB2 ASN 36 1HB ASN 36 14.324 11.435 2.649
251 HB3 ASN 36 2HB ASN 36 15.181 12.870 3.203
252 HD21 ASN 36 1HD2 ASN 36 13.182 13.934 3.424
253 HD22 ASN 36 2HD2 ASN 36 12.346 14.560 2.048
254 H ASN 37 H ASN 37 15.137 13.313 -0.596
255 HA ASN 37 HA ASN 37 17.409 15.163 -0.631
256 HB2 ASN 37 1HB ASN 37 16.553 13.819 -2.694
257 HB3 ASN 37 2HB ASN 37 15.291 15.045 -2.757
258 HD21 ASN 37 1HD2 ASN 37 15.998 15.856 -4.711
259 HD22 ASN 37 2HD2 ASN 37 17.450 16.780 -4.863
260 H ASN 38 H ASN 38 15.214 15.351 1.308
261 HA ASN 38 HA ASN 38 13.679 16.837 2.141
262 HB2 ASN 38 1HB ASN 38 15.849 18.594 1.000
263 HB3 ASN 38 2HB ASN 38 14.512 19.248 1.942
264 HD21 ASN 38 1HD2 ASN 38 14.477 18.979 4.123
265 HD22 ASN 38 2HD2 ASN 38 15.775 18.275 5.020
266 H THR 39 H THR 39 12.799 15.858 -0.286
267 HA THR 39 HA THR 39 11.674 18.224 -1.630
268 HB THR 39 HB THR 39 13.027 16.425 -2.937
269 HG1 THR 39 1HG THR 39 10.471 16.991 -4.013
270 HG21 THR 39 1HG2 THR 39 11.753 14.512 -1.980
271 HG22 THR 39 2HG2 THR 39 11.746 14.549 -3.744
272 HG23 THR 39 3HG2 THR 39 10.326 15.082 -2.845
273 HA PRO 40 HA PRO 40 7.739 17.190 0.087
274 HB2 PRO 40 1HB PRO 40 6.197 18.668 -1.589
275 HB3 PRO 40 2HB PRO 40 7.173 19.383 -0.300
276 HG2 PRO 40 1HG PRO 40 7.770 19.158 -3.225
277 HG3 PRO 40 2HG PRO 40 8.019 20.534 -2.134
278 HD2 PRO 40 1HD PRO 40 10.028 18.873 -2.866
279 HD3 PRO 40 2HD PRO 40 9.973 19.663 -1.278
280 H ILE 41 H ILE 41 6.071 15.779 -0.284
281 HA ILE 41 HA ILE 41 6.106 14.397 -2.881
282 HB ILE 41 HB ILE 41 4.903 13.330 -0.334
283 HG12 ILE 41 1HG1 ILE 41 7.683 12.791 -1.400
284 HG13 ILE 41 2HG1 ILE 41 7.328 13.840 -0.031
285 HG21 ILE 41 1HG2 ILE 41 4.295 12.388 -2.613
286 HG22 ILE 41 2HG2 ILE 41 5.957 11.808 -2.700
287 HG23 ILE 41 3HG2 ILE 41 4.891 11.239 -1.415
288 HD11 ILE 41 1HD1 ILE 41 6.458 10.978 -0.062
289 HD12 ILE 41 2HD1 ILE 41 8.081 11.449 0.443
290 HD13 ILE 41 3HD1 ILE 41 6.674 12.059 1.314
291 H HIS 42 H HIS 42 4.213 13.992 -3.993
292 HA HIS 42 HA HIS 42 2.089 15.865 -3.571
293 HB2 HIS 42 1HB HIS 42 2.683 13.739 -5.593
294 HB3 HIS 42 2HB HIS 42 1.055 14.405 -5.502
295 HD1 HIS 42 1HD HIS 42 2.997 14.795 -7.946
296 HD2 HIS 42 2HD HIS 42 2.358 17.545 -4.898
297 HE1 HIS 42 1HE HIS 42 3.613 17.031 -8.918
298 HE2 HIS 42 2HE HIS 42 3.299 18.668 -7.030
299 H GLY 43 H GLY 43 2.414 12.341 -3.294
300 HA2 GLY 43 1HA GLY 43 0.491 12.200 -1.203
301 HA3 GLY 43 2HA GLY 43 -0.213 11.671 -2.724
302 H PHE 44 H PHE 44 -0.491 9.572 -1.848
303 HA PHE 44 HA PHE 44 1.948 7.963 -2.009
304 HB2 PHE 44 1HB PHE 44 0.031 8.042 0.307
305 HB3 PHE 44 2HB PHE 44 0.978 6.598 -0.037
306 HD1 PHE 44 2HD PHE 44 3.577 7.216 -0.527
307 HD2 PHE 44 1HD PHE 44 0.878 9.425 1.913
308 HE1 PHE 44 2HE PHE 44 5.480 8.171 0.707
309 HE2 PHE 44 1HE PHE 44 2.777 10.384 3.151
310 HZ PHE 44 HZ PHE 44 5.081 9.756 2.549
311 H TYR 45 H TYR 45 1.652 6.386 -3.426
312 HA TYR 45 HA TYR 45 -1.071 5.603 -4.142
313 HB2 TYR 45 1HB TYR 45 1.596 5.401 -5.486
314 HB3 TYR 45 2HB TYR 45 0.307 4.303 -5.966
315 HD1 TYR 45 2HD TYR 45 -2.067 6.003 -5.830
316 HD2 TYR 45 1HD TYR 45 1.846 6.908 -7.234
317 HE1 TYR 45 2HE TYR 45 -3.002 7.739 -7.301
318 HE2 TYR 45 1HE TYR 45 0.922 8.647 -8.708
319 HH TYR 45 HH TYR 45 -2.515 9.036 -9.160
320 H ILE 46 H ILE 46 -1.879 3.582 -3.877
321 HA ILE 46 HA ILE 46 -0.114 1.562 -2.660
322 HB ILE 46 HB ILE 46 -2.954 2.205 -1.864
323 HG12 ILE 46 1HG1 ILE 46 -0.639 2.105 0.022
324 HG13 ILE 46 2HG1 ILE 46 -0.813 3.515 -1.018
325 HG21 ILE 46 1HG2 ILE 46 -2.897 0.353 -0.378
326 HG22 ILE 46 2HG2 ILE 46 -2.411 -0.245 -1.963
327 HG23 ILE 46 3HG2 ILE 46 -1.194 0.048 -0.721
328 HD11 ILE 46 1HD1 ILE 46 -1.828 3.892 1.149
329 HD12 ILE 46 2HD1 ILE 46 -3.052 3.892 -0.121
330 HD13 ILE 46 3HD1 ILE 46 -2.866 2.485 0.925
331 H TYR 47 H TYR 47 -0.061 -0.285 -3.746
332 HA TYR 47 HA TYR 47 -2.243 -0.863 -5.635
333 HB2 TYR 47 1HB TYR 47 0.629 -1.814 -5.659
334 HB3 TYR 47 2HB TYR 47 -0.597 -2.259 -6.841
335 HD1 TYR 47 2HD TYR 47 0.921 0.816 -5.349
336 HD2 TYR 47 1HD TYR 47 -0.658 -1.073 -8.819
337 HE1 TYR 47 2HE TYR 47 1.500 2.798 -6.685
338 HE2 TYR 47 1HE TYR 47 -0.083 0.903 -10.164
339 HH TYR 47 HH TYR 47 2.018 3.109 -9.385
340 H TYR 48 H TYR 48 -3.143 -2.917 -5.730
341 HA TYR 48 HA TYR 48 -2.240 -5.013 -3.967
342 HB2 TYR 48 1HB TYR 48 -4.557 -5.145 -2.873
343 HB3 TYR 48 2HB TYR 48 -3.463 -3.894 -2.296
344 HD1 TYR 48 2HD TYR 48 -3.779 -1.530 -3.148
345 HD2 TYR 48 1HD TYR 48 -6.669 -4.593 -3.754
346 HE1 TYR 48 2HE TYR 48 -5.487 0.180 -3.603
347 HE2 TYR 48 1HE TYR 48 -8.385 -2.891 -4.212
348 HH TYR 48 HH TYR 48 -8.549 -0.182 -3.414
349 H ARG 49 H ARG 49 -3.357 -7.018 -4.307
350 HA ARG 49 HA ARG 49 -5.482 -7.348 -6.120
351 HB2 ARG 49 1HB ARG 49 -4.405 -8.110 -8.097
352 HB3 ARG 49 2HB ARG 49 -3.665 -6.568 -7.691
353 HG2 ARG 49 1HG ARG 49 -1.789 -7.752 -8.147
354 HG3 ARG 49 2HG ARG 49 -1.949 -8.149 -6.435
355 HD2 ARG 49 1HD ARG 49 -3.287 -10.173 -7.184
356 HD3 ARG 49 2HD ARG 49 -2.720 -9.817 -8.815
357 HE ARG 49 HE ARG 49 -1.245 -11.077 -6.746
358 HH11 ARG 49 1HH1 ARG 49 -0.920 -8.870 -9.419
359 HH12 ARG 49 2HH1 ARG 49 0.747 -9.249 -9.698
360 HH21 ARG 49 1HH2 ARG 49 0.950 -11.584 -7.104
361 HH22 ARG 49 2HH2 ARG 49 1.810 -10.793 -8.381
362 HA PRO 50 HA PRO 50 -5.363 -11.265 -4.114
363 HB2 PRO 50 1HB PRO 50 -7.075 -12.620 -5.727
364 HB3 PRO 50 2HB PRO 50 -7.611 -11.396 -4.570
365 HG2 PRO 50 1HG PRO 50 -7.161 -11.146 -7.519
366 HG3 PRO 50 2HG PRO 50 -8.490 -10.511 -6.532
367 HD2 PRO 50 1HD PRO 50 -6.415 -8.973 -7.344
368 HD3 PRO 50 2HD PRO 50 -7.254 -8.708 -5.803
369 H THR 51 H THR 51 -4.169 -13.091 -4.217
370 HA THR 51 HA THR 51 -2.239 -13.465 -6.186
371 HB THR 51 HB THR 51 -2.440 -14.472 -3.772
372 HG1 THR 51 1HG THR 51 -0.740 -14.750 -5.519
373 HG21 THR 51 1HG2 THR 51 -4.451 -15.909 -4.882
374 HG22 THR 51 2HG2 THR 51 -3.512 -16.440 -3.486
375 HG23 THR 51 3HG2 THR 51 -3.099 -17.018 -5.100
376 H ASP 52 H ASP 52 -5.539 -14.492 -6.078
377 HA ASP 52 HA ASP 52 -5.355 -16.618 -7.955
378 HB2 ASP 52 1HB ASP 52 -7.553 -15.025 -6.732
379 HB3 ASP 52 2HB ASP 52 -7.913 -15.896 -8.220
380 H SER 53 H SER 53 -5.170 -13.246 -8.269
381 HA SER 53 HA SER 53 -6.373 -12.742 -10.721
382 HB2 SER 53 1HB SER 53 -4.069 -11.510 -9.254
383 HB3 SER 53 2HB SER 53 -4.418 -10.993 -10.904
384 HG SER 53 HG SER 53 -5.605 -10.210 -8.687
385 H ASP 54 H ASP 54 -4.701 -11.900 -12.593
386 HA ASP 54 HA ASP 54 -3.350 -14.361 -13.451
387 HB2 ASP 54 1HB ASP 54 -5.223 -13.169 -14.817
388 HB3 ASP 54 2HB ASP 54 -3.944 -12.046 -15.268
389 H ASN 55 H ASN 55 -2.914 -10.827 -13.675
390 HA ASN 55 HA ASN 55 -0.102 -11.119 -13.040
391 HB2 ASN 55 1HB ASN 55 -0.680 -9.571 -15.532
392 HB3 ASN 55 2HB ASN 55 0.807 -10.370 -15.031
393 HD21 ASN 55 1HD2 ASN 55 -2.314 -10.773 -16.498
394 HD22 ASN 55 2HD2 ASN 55 -2.028 -12.345 -17.154
395 H ASP 56 H ASP 56 0.894 -8.712 -13.460
396 HA ASP 56 HA ASP 56 -0.156 -7.103 -11.464
397 HB2 ASP 56 1HB ASP 56 1.347 -5.390 -12.211
398 HB3 ASP 56 2HB ASP 56 2.145 -6.941 -12.459
399 H SER 57 H SER 57 -1.327 -7.595 -14.607
400 HA SER 57 HA SER 57 -2.433 -5.132 -15.280
401 HB2 SER 57 1HB SER 57 -2.347 -7.245 -16.697
402 HB3 SER 57 2HB SER 57 -3.775 -7.785 -15.814
403 HG SER 57 HG SER 57 -4.739 -5.737 -16.510
404 H ASP 58 H ASP 58 -3.158 -7.130 -12.661
405 HA ASP 58 HA ASP 58 -5.882 -6.098 -12.374
406 HB2 ASP 58 1HB ASP 58 -4.344 -8.221 -10.872
407 HB3 ASP 58 2HB ASP 58 -5.945 -7.665 -10.390
408 H TYR 59 H TYR 59 -2.697 -5.910 -10.931
409 HA TYR 59 HA TYR 59 -3.099 -4.824 -8.485
410 HB2 TYR 59 1HB TYR 59 -1.052 -4.363 -10.592
411 HB3 TYR 59 2HB TYR 59 -1.084 -3.235 -9.241
412 HD1 TYR 59 1HD TYR 59 -1.737 -4.918 -6.965
413 HD2 TYR 59 2HD TYR 59 0.791 -5.736 -10.289
414 HE1 TYR 59 1HE TYR 59 -0.464 -6.516 -5.596
415 HE2 TYR 59 2HE TYR 59 2.070 -7.337 -8.929
416 HH TYR 59 HH TYR 59 2.377 -8.197 -6.900
417 H LYS 60 H LYS 60 -4.228 -3.182 -7.707
418 HA LYS 60 HA LYS 60 -5.196 -1.115 -9.521
419 HB2 LYS 60 1HB LYS 60 -5.959 -2.027 -6.768
420 HB3 LYS 60 2HB LYS 60 -6.465 -0.443 -7.341
421 HG2 LYS 60 1HG LYS 60 -7.676 -1.420 -9.162
422 HG3 LYS 60 2HG LYS 60 -7.044 -3.023 -8.779
423 HD2 LYS 60 1HD LYS 60 -9.120 -3.127 -7.797
424 HD3 LYS 60 2HD LYS 60 -8.141 -2.558 -6.443
425 HE2 LYS 60 1HE LYS 60 -9.834 -1.043 -6.319
426 HE3 LYS 60 2HE LYS 60 -8.793 -0.196 -7.463
427 HZ1 LYS 60 1HZ LYS 60 -10.174 -1.517 -9.199
428 HZ2 LYS 60 2HZ LYS 60 -10.810 -0.107 -8.515
429 HZ3 LYS 60 3HZ LYS 60 -11.314 -1.622 -7.954
430 H LYS 61 H LYS 61 -5.523 1.073 -8.065
431 HA LYS 61 HA LYS 61 -3.005 1.735 -6.743
432 HB2 LYS 61 1HB LYS 61 -2.764 2.244 -9.191
433 HB3 LYS 61 2HB LYS 61 -4.080 3.399 -9.025
434 HG2 LYS 61 1HG LYS 61 -2.813 4.870 -7.781
435 HG3 LYS 61 2HG LYS 61 -1.687 3.617 -7.255
436 HD2 LYS 61 1HD LYS 61 -0.410 4.741 -8.806
437 HD3 LYS 61 2HD LYS 61 -1.122 3.473 -9.808
438 HE2 LYS 61 1HE LYS 61 -2.901 5.069 -10.471
439 HE3 LYS 61 2HE LYS 61 -2.069 6.326 -9.556
440 HZ1 LYS 61 1HZ LYS 61 -1.630 5.621 -12.182
441 HZ2 LYS 61 2HZ LYS 61 -0.286 5.029 -11.342
442 HZ3 LYS 61 3HZ LYS 61 -0.692 6.668 -11.241
443 H ASP 62 H ASP 62 -3.348 2.947 -4.998
444 HA ASP 62 HA ASP 62 -5.836 4.517 -4.849
445 HB2 ASP 62 1HB ASP 62 -4.674 2.567 -2.916
446 HB3 ASP 62 2HB ASP 62 -5.485 3.989 -2.264
447 H MET 63 H MET 63 -5.325 6.600 -4.852
448 HA MET 63 HA MET 63 -2.742 7.522 -3.964
449 HB2 MET 63 1HB MET 63 -4.295 8.415 -5.904
450 HB3 MET 63 2HB MET 63 -4.978 9.395 -4.614
451 HG2 MET 63 1HG MET 63 -2.466 9.970 -4.146
452 HG3 MET 63 2HG MET 63 -2.263 9.474 -5.824
453 HE1 MET 63 1HE MET 63 -2.810 12.384 -3.565
454 HE2 MET 63 2HE MET 63 -4.162 13.293 -4.238
455 HE3 MET 63 3HE MET 63 -4.447 11.736 -3.460
456 H VAL 64 H VAL 64 -2.264 8.676 -2.147
457 HA VAL 64 HA VAL 64 -4.438 9.366 -0.309
458 HB VAL 64 HB VAL 64 -1.973 7.936 0.671
459 HG11 VAL 64 1HG1 VAL 64 -3.282 9.431 2.213
460 HG12 VAL 64 2HG1 VAL 64 -4.639 8.319 2.017
461 HG13 VAL 64 3HG1 VAL 64 -3.131 7.754 2.737
462 HG21 VAL 64 1HG2 VAL 64 -3.066 6.321 -0.673
463 HG22 VAL 64 2HG2 VAL 64 -3.535 5.977 0.992
464 HG23 VAL 64 3HG2 VAL 64 -4.657 6.806 -0.087
465 H GLU 65 H GLU 65 -4.051 11.137 0.970
466 HA GLU 65 HA GLU 65 -2.513 13.193 0.157
467 HB2 GLU 65 1HB GLU 65 -2.876 12.613 3.095
468 HB3 GLU 65 2HB GLU 65 -2.745 14.183 2.315
469 HG2 GLU 65 1HG GLU 65 -4.902 13.405 1.060
470 HG3 GLU 65 2HG GLU 65 -5.056 12.314 2.435
471 H GLY 66 H GLY 66 -0.472 14.058 0.601
472 HA2 GLY 66 1HA GLY 66 1.625 12.148 0.824
473 HA3 GLY 66 2HA GLY 66 1.817 13.894 0.769
474 H ASP 67 H ASP 67 -0.065 14.080 3.139
475 HA ASP 67 HA ASP 67 2.013 13.795 5.151
476 HB2 ASP 67 1HB ASP 67 0.831 15.897 5.130
477 HB3 ASP 67 2HB ASP 67 -0.724 15.075 5.229
478 H ARG 68 H ARG 68 -0.639 12.037 4.016
479 HA ARG 68 HA ARG 68 -1.313 10.784 6.529
480 HB2 ARG 68 1HB ARG 68 -2.866 11.188 4.495
481 HB3 ARG 68 2HB ARG 68 -2.110 9.749 3.823
482 HG2 ARG 68 1HG ARG 68 -3.899 8.787 4.833
483 HG3 ARG 68 2HG ARG 68 -2.763 8.749 6.183
484 HD2 ARG 68 1HD ARG 68 -3.821 10.460 7.298
485 HD3 ARG 68 2HD ARG 68 -4.497 11.145 5.821
486 HE ARG 68 HE ARG 68 -5.739 9.261 7.527
487 HH11 ARG 68 1HH1 ARG 68 -5.354 10.080 4.165
488 HH12 ARG 68 2HH1 ARG 68 -6.868 9.384 3.687
489 HH21 ARG 68 1HH2 ARG 68 -7.734 8.342 6.911
490 HH22 ARG 68 2HH2 ARG 68 -8.221 8.397 5.250
491 H TYR 69 H TYR 69 -0.439 8.995 7.361
492 HA TYR 69 HA TYR 69 1.412 7.450 5.666
493 HB2 TYR 69 1HB TYR 69 1.575 8.331 8.517
494 HB3 TYR 69 2HB TYR 69 2.342 6.816 8.057
495 HD1 TYR 69 2HD TYR 69 2.066 10.016 6.165
496 HD2 TYR 69 1HD TYR 69 4.629 7.238 8.120
497 HE1 TYR 69 2HE TYR 69 4.026 11.260 5.352
498 HE2 TYR 69 1HE TYR 69 6.595 8.476 7.313
499 HH TYR 69 HH TYR 69 6.984 11.035 6.576
500 H TRP 70 H TRP 70 -1.567 7.196 6.437
501 HA TRP 70 HA TRP 70 -1.444 4.315 6.885
502 HB2 TRP 70 1HB TRP 70 -3.044 4.316 8.668
503 HB3 TRP 70 2HB TRP 70 -1.764 5.441 9.113
504 HD1 TRP 70 HD TRP 70 -2.401 8.142 8.588
505 HE1 TRP 70 1HE TRP 70 -4.653 9.328 8.971
506 HE3 TRP 70 3HE TRP 70 -5.459 4.048 8.747
507 HZ2 TRP 70 2HZ TRP 70 -7.366 8.622 9.297
508 HZ3 TRP 70 3HZ TRP 70 -7.870 4.390 9.098
509 HH2 TRP 70 HH TRP 70 -8.802 6.630 9.368
510 H HIS 71 H HIS 71 -3.249 3.173 6.107
511 HA HIS 71 HA HIS 71 -5.477 4.572 4.937
512 HB2 HIS 71 1HB HIS 71 -3.729 4.841 3.199
513 HB3 HIS 71 2HB HIS 71 -3.570 3.089 3.115
514 HD1 HIS 71 1HD HIS 71 -6.405 5.614 2.757
515 HD2 HIS 71 2HD HIS 71 -5.039 2.054 1.107
516 HE1 HIS 71 1HE HIS 71 -8.000 5.084 0.887
517 HE2 HIS 71 2HE HIS 71 -7.204 2.882 -0.041
518 H SER 72 H SER 72 -7.231 3.322 5.041
519 HA SER 72 HA SER 72 -6.850 0.471 5.619
520 HB2 SER 72 1HB SER 72 -8.901 0.503 6.768
521 HB3 SER 72 2HB SER 72 -8.174 2.059 7.168
522 HG SER 72 HG SER 72 -9.470 2.639 5.079
523 H ILE 73 H ILE 73 -6.790 -0.602 3.724
524 HA ILE 73 HA ILE 73 -8.312 0.104 1.435
525 HB ILE 73 HB ILE 73 -7.063 -2.579 2.029
526 HG12 ILE 73 1HG1 ILE 73 -5.771 -0.348 0.473
527 HG13 ILE 73 2HG1 ILE 73 -5.557 -0.493 2.214
528 HG21 ILE 73 1HG2 ILE 73 -6.881 -2.632 -0.483
529 HG22 ILE 73 2HG2 ILE 73 -8.516 -2.749 0.165
530 HG23 ILE 73 3HG2 ILE 73 -7.941 -1.224 -0.509
531 HD11 ILE 73 1HD1 ILE 73 -4.727 -2.449 0.093
532 HD12 ILE 73 2HD1 ILE 73 -3.694 -1.520 1.181
533 HD13 ILE 73 3HD1 ILE 73 -4.709 -2.814 1.818
534 H SER 74 H SER 74 -10.001 -1.134 0.431
535 HA SER 74 HA SER 74 -11.505 -2.948 2.152
536 HB2 SER 74 1HB SER 74 -12.963 -0.675 0.824
537 HB3 SER 74 2HB SER 74 -13.514 -1.728 2.127
538 HG SER 74 HG SER 74 -12.681 -0.382 3.497
539 H HIS 75 H HIS 75 -13.658 -3.516 0.798
540 HA HIS 75 HA HIS 75 -14.457 -4.726 -0.956
541 HB2 HIS 75 1HB HIS 75 -12.884 -2.601 -2.406
542 HB3 HIS 75 2HB HIS 75 -13.839 -3.810 -3.260
543 HD1 HIS 75 1HD HIS 75 -15.334 -1.858 -4.172
544 HD2 HIS 75 2HD HIS 75 -15.439 -2.364 -0.050
545 HE1 HIS 75 1HE HIS 75 -17.327 -0.543 -3.384
546 HE2 HIS 75 2HE HIS 75 -17.321 -0.794 -0.878
547 H LEU 76 H LEU 76 -12.484 -6.045 0.261
548 HA LEU 76 HA LEU 76 -10.802 -7.092 -1.920
549 HB2 LEU 76 1HB LEU 76 -10.278 -7.374 1.029
550 HB3 LEU 76 2HB LEU 76 -9.184 -7.751 -0.300
551 HG LEU 76 HG LEU 76 -10.116 -4.939 0.085
552 HD11 LEU 76 1HD1 LEU 76 -9.096 -4.675 2.033
553 HD12 LEU 76 2HD1 LEU 76 -7.600 -5.323 1.361
554 HD13 LEU 76 3HD1 LEU 76 -8.780 -6.409 2.094
555 HD21 LEU 76 1HD2 LEU 76 -7.456 -6.032 -0.804
556 HD22 LEU 76 2HD2 LEU 76 -8.080 -4.394 -1.002
557 HD23 LEU 76 3HD2 LEU 76 -8.796 -5.727 -1.910
558 H GLN 77 H GLN 77 -10.029 -9.469 -1.056
559 HA GLN 77 HA GLN 77 -12.531 -10.979 -0.939
560 HB2 GLN 77 1HB GLN 77 -9.759 -12.052 -1.459
561 HB3 GLN 77 2HB GLN 77 -11.294 -12.849 -1.781
562 HG2 GLN 77 1HG GLN 77 -10.543 -12.128 -3.867
563 HG3 GLN 77 2HG GLN 77 -11.766 -10.949 -3.397
564 HE21 GLN 77 1HE2 GLN 77 -10.667 -9.647 -5.038
565 HE22 GLN 77 2HE2 GLN 77 -9.285 -8.721 -4.572
566 HA PRO 78 HA PRO 78 -11.924 -12.101 3.278
567 HB2 PRO 78 1HB PRO 78 -13.493 -14.316 3.339
568 HB3 PRO 78 2HB PRO 78 -14.148 -12.675 3.283
569 HG2 PRO 78 1HG PRO 78 -13.780 -14.645 1.059
570 HG3 PRO 78 2HG PRO 78 -15.158 -13.580 1.393
571 HD2 PRO 78 1HD PRO 78 -13.290 -13.001 -0.480
572 HD3 PRO 78 2HD PRO 78 -14.129 -11.745 0.453
573 H GLU 79 H GLU 79 -10.749 -13.527 4.538
574 HA GLU 79 HA GLU 79 -8.843 -14.818 4.797
575 HB2 GLU 79 1HB GLU 79 -9.546 -17.290 4.136
576 HB3 GLU 79 2HB GLU 79 -10.243 -16.471 5.527
577 HG2 GLU 79 1HG GLU 79 -12.220 -15.926 4.301
578 HG3 GLU 79 2HG GLU 79 -11.512 -16.525 2.802
579 H THR 80 H THR 80 -8.650 -13.424 2.374
580 HA THR 80 HA THR 80 -7.510 -15.427 0.542
581 HB THR 80 HB THR 80 -8.278 -12.567 -0.074
582 HG1 THR 80 1HG THR 80 -10.193 -13.560 0.043
583 HG21 THR 80 1HG2 THR 80 -7.801 -13.042 -2.336
584 HG22 THR 80 2HG2 THR 80 -7.668 -14.774 -2.027
585 HG23 THR 80 3HG2 THR 80 -6.426 -13.673 -1.431
586 H SER 81 H SER 81 -5.417 -15.687 1.050
587 HA SER 81 HA SER 81 -3.790 -13.537 2.037
588 HB2 SER 81 1HB SER 81 -3.628 -16.147 2.451
589 HB3 SER 81 2HB SER 81 -2.592 -16.082 1.025
590 HG SER 81 HG SER 81 -1.419 -15.816 2.984
591 H TYR 82 H TYR 82 -3.397 -11.940 0.612
592 HA TYR 82 HA TYR 82 -2.090 -12.695 -1.916
593 HB2 TYR 82 1HB TYR 82 -3.159 -10.560 -2.852
594 HB3 TYR 82 2HB TYR 82 -4.207 -11.958 -2.636
595 HD1 TYR 82 1HD TYR 82 -3.070 -8.943 -0.737
596 HD2 TYR 82 2HD TYR 82 -6.255 -11.620 -1.629
597 HE1 TYR 82 1HE TYR 82 -4.591 -7.582 0.636
598 HE2 TYR 82 2HE TYR 82 -7.784 -10.266 -0.259
599 HH TYR 82 HH TYR 82 -7.049 -7.159 0.793
600 H ASP 83 H ASP 83 -0.544 -11.193 -2.723
601 HA ASP 83 HA ASP 83 1.017 -9.968 -0.675
602 HB2 ASP 83 1HB ASP 83 1.244 -10.111 -3.672
603 HB3 ASP 83 2HB ASP 83 2.348 -9.122 -2.721
604 H ILE 84 H ILE 84 1.606 -7.749 -0.506
605 HA ILE 84 HA ILE 84 -0.164 -5.830 -1.832
606 HB ILE 84 HB ILE 84 0.267 -5.915 1.156
607 HG12 ILE 84 1HG1 ILE 84 -2.407 -6.037 -0.181
608 HG13 ILE 84 2HG1 ILE 84 -1.432 -7.499 -0.093
609 HG21 ILE 84 1HG2 ILE 84 -1.623 -4.045 -0.185
610 HG22 ILE 84 2HG2 ILE 84 -0.774 -3.882 1.351
611 HG23 ILE 84 3HG2 ILE 84 0.096 -3.653 -0.166
612 HD11 ILE 84 1HD1 ILE 84 -1.347 -6.496 2.476
613 HD12 ILE 84 2HD1 ILE 84 -3.003 -6.193 1.950
614 HD13 ILE 84 3HD1 ILE 84 -2.346 -7.829 1.898
615 H LYS 85 H LYS 85 0.801 -3.946 -2.359
616 HA LYS 85 HA LYS 85 3.276 -3.146 -1.058
617 HB2 LYS 85 1HB LYS 85 4.610 -3.099 -3.018
618 HB3 LYS 85 2HB LYS 85 3.863 -4.691 -2.979
619 HG2 LYS 85 1HG LYS 85 2.474 -4.234 -4.758
620 HG3 LYS 85 2HG LYS 85 2.561 -2.488 -4.512
621 HD2 LYS 85 1HD LYS 85 4.577 -2.299 -5.596
622 HD3 LYS 85 2HD LYS 85 5.055 -3.957 -5.221
623 HE2 LYS 85 1HE LYS 85 2.711 -3.532 -7.003
624 HE3 LYS 85 2HE LYS 85 4.320 -3.231 -7.658
625 HZ1 LYS 85 1HZ LYS 85 3.825 -5.469 -8.116
626 HZ2 LYS 85 2HZ LYS 85 3.254 -5.763 -6.552
627 HZ3 LYS 85 3HZ LYS 85 4.906 -5.512 -6.815
628 H MET 86 H MET 86 4.019 -0.986 -1.852
629 HA MET 86 HA MET 86 2.005 0.623 -3.188
630 HB2 MET 86 1HB MET 86 1.951 2.297 -1.360
631 HB3 MET 86 2HB MET 86 1.246 0.754 -0.897
632 HG2 MET 86 1HG MET 86 3.067 0.197 0.458
633 HG3 MET 86 2HG MET 86 4.096 1.427 -0.272
634 HE1 MET 86 1HE MET 86 2.548 4.720 1.074
635 HE2 MET 86 2HE MET 86 3.245 3.918 -0.334
636 HE3 MET 86 3HE MET 86 1.500 3.893 -0.079
637 H GLN 87 H GLN 87 2.819 3.003 -3.253
638 HA GLN 87 HA GLN 87 5.661 3.372 -3.109
639 HB2 GLN 87 1HB GLN 87 5.688 2.173 -5.168
640 HB3 GLN 87 2HB GLN 87 4.306 3.068 -5.785
641 HG2 GLN 87 1HG GLN 87 5.861 5.130 -5.535
642 HG3 GLN 87 2HG GLN 87 7.149 3.927 -5.521
643 HE21 GLN 87 1HE2 GLN 87 4.699 5.485 -7.401
644 HE22 GLN 87 2HE2 GLN 87 5.190 4.868 -8.938
645 H CYS 88 H CYS 88 6.273 5.530 -3.287
646 HA CYS 88 HA CYS 88 4.049 7.419 -3.125
647 HB2 CYS 88 1HB CYS 88 5.509 8.881 -1.984
648 HB3 CYS 88 2HB CYS 88 5.905 7.279 -1.373
649 HG CYS 88 HG CYS 88 8.400 7.958 -1.601
650 H PHE 89 H PHE 89 4.345 9.580 -4.128
651 HA PHE 89 HA PHE 89 6.062 9.680 -6.466
652 HB2 PHE 89 1HB PHE 89 4.340 9.943 -8.081
653 HB3 PHE 89 2HB PHE 89 3.907 8.517 -7.144
654 HD1 PHE 89 1HD PHE 89 2.286 8.918 -5.152
655 HD2 PHE 89 2HD PHE 89 2.777 11.602 -8.419
656 HE1 PHE 89 1HE PHE 89 0.084 9.903 -4.668
657 HE2 PHE 89 2HE PHE 89 0.576 12.593 -7.939
658 HZ PHE 89 HZ PHE 89 -0.773 11.744 -6.062
659 H ASN 90 H ASN 90 6.086 11.804 -7.480
660 HA ASN 90 HA ASN 90 4.742 14.000 -6.218
661 HB2 ASN 90 1HB ASN 90 6.454 14.984 -5.028
662 HB3 ASN 90 2HB ASN 90 6.819 13.282 -4.754
663 HD21 ASN 90 1HD2 ASN 90 8.644 15.457 -4.597
664 HD22 ASN 90 2HD2 ASN 90 9.860 15.200 -5.797
665 H GLU 91 H GLU 91 5.594 16.135 -7.115
666 HA GLU 91 HA GLU 91 5.308 16.344 -9.777
667 HB2 GLU 91 1HB GLU 91 5.507 18.295 -8.337
668 HB3 GLU 91 2HB GLU 91 7.216 17.968 -8.086
669 HG2 GLU 91 1HG GLU 91 7.741 18.505 -10.332
670 HG3 GLU 91 2HG GLU 91 6.039 18.539 -10.790
671 H GLY 92 H GLY 92 8.319 15.533 -8.122
672 HA2 GLY 92 1HA GLY 92 10.020 15.633 -10.366
673 HA3 GLY 92 2HA GLY 92 10.314 14.708 -8.902
674 H GLY 93 H GLY 93 8.246 12.902 -8.929
675 HA2 GLY 93 1HA GLY 93 7.378 11.557 -11.045
676 HA3 GLY 93 2HA GLY 93 9.094 11.183 -11.130
677 H GLU 94 H GLU 94 7.074 9.248 -10.811
678 HA GLU 94 HA GLU 94 6.491 8.441 -8.236
679 HB2 GLU 94 1HB GLU 94 6.947 6.925 -10.784
680 HB3 GLU 94 2HB GLU 94 6.645 6.060 -9.284
681 HG2 GLU 94 1HG GLU 94 4.481 6.821 -9.119
682 HG3 GLU 94 2HG GLU 94 4.791 8.238 -10.120
683 H SER 95 H SER 95 7.473 7.087 -6.731
684 HA SER 95 HA SER 95 10.391 7.088 -6.852
685 HB2 SER 95 1HB SER 95 9.251 7.985 -4.833
686 HB3 SER 95 2HB SER 95 8.568 6.386 -4.538
687 HG SER 95 HG SER 95 10.427 5.734 -3.786
688 H GLU 96 H GLU 96 11.234 5.053 -5.421
689 HA GLU 96 HA GLU 96 10.996 2.830 -7.138
690 HB2 GLU 96 1HB GLU 96 12.100 2.996 -4.329
691 HB3 GLU 96 2HB GLU 96 12.313 1.628 -5.413
692 HG2 GLU 96 1HG GLU 96 13.194 4.382 -6.189
693 HG3 GLU 96 2HG GLU 96 14.213 3.327 -5.211
694 H PHE 97 H PHE 97 10.332 0.634 -6.470
695 HA PHE 97 HA PHE 97 7.669 0.713 -5.374
696 HB2 PHE 97 1HB PHE 97 9.369 -1.406 -6.650
697 HB3 PHE 97 2HB PHE 97 7.889 -1.848 -5.805
698 HD1 PHE 97 1HD PHE 97 8.951 0.779 -8.240
699 HD2 PHE 97 2HD PHE 97 6.076 -2.167 -7.158
700 HE1 PHE 97 1HE PHE 97 7.647 1.315 -10.257
701 HE2 PHE 97 2HE PHE 97 4.768 -1.637 -9.173
702 HZ PHE 97 HZ PHE 97 5.554 0.105 -10.726
703 H SER 98 H SER 98 7.161 0.430 -3.313
704 HA SER 98 HA SER 98 9.043 -0.051 -1.296
705 HB2 SER 98 1HB SER 98 7.271 0.112 0.211
706 HB3 SER 98 2HB SER 98 6.652 0.999 -1.182
707 HG SER 98 HG SER 98 5.892 -1.355 -1.707
708 H ASN 99 H ASN 99 8.493 -1.872 0.421
709 HA ASN 99 HA ASN 99 9.249 -4.324 -0.791
710 HB2 ASN 99 1HB ASN 99 8.823 -5.220 1.587
711 HB3 ASN 99 2HB ASN 99 10.077 -4.000 1.384
712 HD21 ASN 99 1HD2 ASN 99 7.699 -4.910 3.351
713 HD22 ASN 99 2HD2 ASN 99 7.226 -3.385 4.010
714 H VAL 100 H VAL 100 8.039 -6.410 -0.073
715 HA VAL 100 HA VAL 100 5.214 -6.066 -0.826
716 HB VAL 100 HB VAL 100 6.963 -8.513 -1.118
717 HG11 VAL 100 1HG1 VAL 100 4.256 -8.476 -0.846
718 HG12 VAL 100 2HG1 VAL 100 4.437 -8.352 -2.597
719 HG13 VAL 100 3HG1 VAL 100 5.162 -9.705 -1.728
720 HG21 VAL 100 1HG2 VAL 100 7.470 -7.875 -3.208
721 HG22 VAL 100 2HG2 VAL 100 5.850 -7.250 -3.514
722 HG23 VAL 100 3HG2 VAL 100 7.029 -6.259 -2.655
723 H MET 101 H MET 101 3.850 -6.232 0.820
724 HA MET 101 HA MET 101 4.519 -8.062 3.028
725 HB2 MET 101 1HB MET 101 2.633 -5.701 3.099
726 HB3 MET 101 2HB MET 101 3.141 -6.682 4.467
727 HG2 MET 101 1HG MET 101 5.091 -5.117 2.812
728 HG3 MET 101 2HG MET 101 4.240 -4.416 4.186
729 HE1 MET 101 1HE MET 101 5.293 -4.597 6.692
730 HE2 MET 101 2HE MET 101 4.063 -5.834 6.433
731 HE3 MET 101 3HE MET 101 5.582 -6.253 7.228
732 H ILE 102 H ILE 102 3.312 -9.823 3.244
733 HA ILE 102 HA ILE 102 0.835 -10.036 1.706
734 HB ILE 102 HB ILE 102 2.446 -12.158 3.127
735 HG12 ILE 102 1HG1 ILE 102 2.031 -11.821 0.159
736 HG13 ILE 102 2HG1 ILE 102 3.374 -11.060 1.007
737 HG21 ILE 102 1HG2 ILE 102 0.617 -13.415 3.040
738 HG22 ILE 102 2HG2 ILE 102 -0.264 -12.165 2.164
739 HG23 ILE 102 3HG2 ILE 102 0.713 -13.339 1.281
740 HD11 ILE 102 1HD1 ILE 102 3.915 -13.425 1.839
741 HD12 ILE 102 2HD1 ILE 102 2.846 -13.964 0.543
742 HD13 ILE 102 3HD1 ILE 102 4.283 -13.016 0.164
743 H CYS 103 H CYS 103 -0.787 -9.122 2.859
744 HA CYS 103 HA CYS 103 -1.118 -9.930 5.664
745 HB2 CYS 103 1HB CYS 103 -1.075 -7.454 4.921
746 HB3 CYS 103 2HB CYS 103 -2.692 -7.761 4.300
747 HG CYS 103 HG CYS 103 -2.252 -6.548 7.056
748 H GLU 104 H GLU 104 -2.385 -11.644 5.920
749 HA GLU 104 HA GLU 104 -4.345 -12.403 3.964
750 HB2 GLU 104 1HB GLU 104 -2.907 -13.922 5.510
751 HB3 GLU 104 2HB GLU 104 -4.154 -13.603 6.708
752 HG2 GLU 104 1HG GLU 104 -5.736 -14.335 4.718
753 HG3 GLU 104 2HG GLU 104 -4.281 -15.189 4.208
754 H THR 105 H THR 105 -6.394 -11.782 3.878
755 HA THR 105 HA THR 105 -7.508 -9.958 5.726
756 HB THR 105 HB THR 105 -9.700 -10.573 4.479
757 HG1 THR 105 1HG THR 105 -8.003 -11.578 2.487
758 HG21 THR 105 1HG2 THR 105 -8.082 -8.613 4.082
759 HG22 THR 105 2HG2 THR 105 -9.188 -9.046 2.778
760 HG23 THR 105 3HG2 THR 105 -7.500 -9.552 2.708
761 H LYS 106 H LYS 106 -9.856 -10.439 6.565
762 HA LYS 106 HA LYS 106 -9.581 -12.616 8.446
763 HB2 LYS 106 1HB LYS 106 -11.799 -10.591 8.089
764 HB3 LYS 106 2HB LYS 106 -11.658 -11.720 9.431
765 HG2 LYS 106 1HG LYS 106 -9.371 -9.906 8.890
766 HG3 LYS 106 2HG LYS 106 -10.829 -9.223 9.614
767 HD2 LYS 106 1HD LYS 106 -10.589 -10.419 11.554
768 HD3 LYS 106 2HD LYS 106 -9.726 -11.739 10.761
769 HE2 LYS 106 1HE LYS 106 -7.762 -10.264 10.517
770 HE3 LYS 106 2HE LYS 106 -8.629 -8.998 11.386
771 HZ1 LYS 106 1HZ LYS 106 -7.007 -10.653 12.604
772 HZ2 LYS 106 2HZ LYS 106 -8.398 -11.613 12.672
773 HZ3 LYS 106 3HZ LYS 106 -8.403 -10.068 13.360
774 H ALA 107 H ALA 107 -11.168 -14.261 8.775
775 HA ALA 107 HA ALA 107 -12.170 -15.343 6.300
776 HB1 ALA 107 1HB ALA 107 -11.406 -16.377 8.818
777 HB2 ALA 107 2HB ALA 107 -13.087 -16.836 8.544
778 HB3 ALA 107 3HB ALA 107 -11.852 -17.264 7.360
779 H ARG 108 H ARG 108 -14.207 -15.321 5.560
780 HA ARG 108 HA ARG 108 -16.127 -13.591 6.732
781 HB2 ARG 108 1HB ARG 108 -17.646 -14.722 4.951
782 HB3 ARG 108 2HB ARG 108 -16.307 -13.712 4.422
783 HG2 ARG 108 1HG ARG 108 -15.119 -15.470 3.597
784 HG3 ARG 108 2HG ARG 108 -15.803 -16.616 4.752
785 HD2 ARG 108 1HD ARG 108 -18.017 -16.192 3.464
786 HD3 ARG 108 2HD ARG 108 -16.957 -15.588 2.191
787 HE ARG 108 HE ARG 108 -15.938 -18.040 2.899
788 HH11 ARG 108 1HH1 ARG 108 -18.969 -16.826 1.692
789 HH12 ARG 108 2HH1 ARG 108 -19.366 -18.286 0.846
790 HH21 ARG 108 1HH2 ARG 108 -16.449 -19.967 1.790
791 HH22 ARG 108 2HH2 ARG 108 -17.932 -20.072 0.903
792 H SER 109 H SER 109 -17.731 -13.984 8.126
793 HA SER 109 HA SER 109 -18.297 -16.793 8.817
794 HB2 SER 109 1HB SER 109 -17.099 -15.550 10.609
795 HB3 SER 109 2HB SER 109 -18.435 -14.400 10.667
796 HG SER 109 HG SER 109 -19.207 -15.760 12.077
797 H GLY 110 H GLY 110 -20.329 -17.453 8.556
798 HA2 GLY 110 1HA GLY 110 -22.680 -17.258 8.752
799 HA3 GLY 110 2HA GLY 110 -22.512 -15.509 8.727
800 HA PRO 111 HA PRO 111 -23.462 -17.463 4.440
801 HB2 PRO 111 1HB PRO 111 -26.175 -17.345 4.432
802 HB3 PRO 111 2HB PRO 111 -25.277 -18.771 4.967
803 HG2 PRO 111 1HG PRO 111 -26.532 -16.600 6.602
804 HG3 PRO 111 2HG PRO 111 -26.544 -18.353 6.871
805 HD2 PRO 111 1HD PRO 111 -24.881 -16.685 8.206
806 HD3 PRO 111 2HD PRO 111 -24.432 -18.353 7.793
807 H SER 112 H SER 112 -25.515 -15.050 6.087
808 HA SER 112 HA SER 112 -26.221 -13.456 3.993
809 HB2 SER 112 1HB SER 112 -25.373 -12.532 6.750
810 HB3 SER 112 2HB SER 112 -26.297 -11.568 5.597
811 HG SER 112 HG SER 112 -27.147 -13.502 7.294
812 H SER 113 H SER 113 -25.093 -12.524 2.435
813 HA SER 113 HA SER 113 -22.579 -11.176 3.089
814 HB2 SER 113 1HB SER 113 -22.925 -13.346 1.029
815 HB3 SER 113 2HB SER 113 -21.649 -12.138 0.884
816 HG SER 113 HG SER 113 -20.565 -13.285 2.254
817 H GLY 114 H GLY 114 -22.127 -9.388 1.835
818 HA2 GLY 114 1HA GLY 114 -23.735 -8.806 -0.509
819 HA3 GLY 114 2HA GLY 114 -24.052 -7.778 0.880
Start of MODEL 3
1 H1 GLY 1 H GLY 1 30.366 11.860 -11.608
2 HA2 GLY 1 1HA GLY 1 28.089 11.371 -10.245
3 HA3 GLY 1 2HA GLY 1 28.670 13.006 -10.526
4 H SER 2 H SER 2 25.968 11.349 -10.585
5 HA SER 2 HA SER 2 24.786 11.536 -13.063
6 HB2 SER 2 1HB SER 2 23.621 11.908 -10.304
7 HB3 SER 2 2HB SER 2 22.621 11.898 -11.757
8 HG SER 2 HG SER 2 22.784 9.822 -10.792
9 H SER 3 H SER 3 22.911 13.128 -13.558
10 HA SER 3 HA SER 3 24.101 15.772 -13.667
11 HB2 SER 3 1HB SER 3 21.682 14.534 -14.981
12 HB3 SER 3 2HB SER 3 22.067 16.248 -15.134
13 HG SER 3 HG SER 3 23.076 14.203 -16.502
14 H GLY 4 H GLY 4 21.059 14.310 -12.539
15 HA2 GLY 4 1HA GLY 4 20.689 15.492 -10.177
16 HA3 GLY 4 2HA GLY 4 20.277 16.808 -11.266
17 H SER 5 H SER 5 19.460 13.467 -10.428
18 HA SER 5 HA SER 5 17.081 13.342 -11.943
19 HB2 SER 5 1HB SER 5 16.539 11.377 -10.555
20 HB3 SER 5 2HB SER 5 18.210 11.327 -11.118
21 HG SER 5 HG SER 5 18.916 11.780 -9.115
22 H SER 6 H SER 6 15.042 13.969 -11.530
23 HA SER 6 HA SER 6 14.565 15.387 -8.997
24 HB2 SER 6 1HB SER 6 12.748 16.560 -10.226
25 HB3 SER 6 2HB SER 6 14.335 16.817 -10.950
26 HG SER 6 HG SER 6 12.159 15.839 -12.097
27 H GLY 7 H GLY 7 13.062 14.675 -7.614
28 HA2 GLY 7 1HA GLY 7 10.801 13.761 -7.309
29 HA3 GLY 7 2HA GLY 7 11.186 12.604 -8.575
30 HA PRO 8 HA PRO 8 12.346 11.136 -4.154
31 HB2 PRO 8 1HB PRO 8 10.097 9.764 -3.497
32 HB3 PRO 8 2HB PRO 8 10.343 11.464 -3.077
33 HG2 PRO 8 1HG PRO 8 8.783 10.277 -5.340
34 HG3 PRO 8 2HG PRO 8 8.353 11.623 -4.270
35 HD2 PRO 8 1HD PRO 8 9.314 12.002 -6.772
36 HD3 PRO 8 2HD PRO 8 9.640 13.133 -5.443
37 H VAL 9 H VAL 9 13.233 9.136 -3.890
38 HA VAL 9 HA VAL 9 12.446 7.027 -5.788
39 HB VAL 9 HB VAL 9 14.861 6.352 -5.888
40 HG11 VAL 9 1HG1 VAL 9 15.004 9.016 -7.035
41 HG12 VAL 9 2HG1 VAL 9 14.980 7.441 -7.831
42 HG13 VAL 9 3HG1 VAL 9 13.466 8.220 -7.370
43 HG21 VAL 9 1HG2 VAL 9 15.827 7.390 -4.014
44 HG22 VAL 9 2HG2 VAL 9 16.477 8.264 -5.402
45 HG23 VAL 9 3HG2 VAL 9 15.174 8.970 -4.447
46 H ALA 10 H ALA 10 14.026 7.822 -2.726
47 HA ALA 10 HA ALA 10 14.603 5.410 -1.645
48 HB1 ALA 10 1HB ALA 10 14.911 7.565 -0.497
49 HB2 ALA 10 2HB ALA 10 13.178 7.620 -0.169
50 HB3 ALA 10 3HB ALA 10 14.171 6.349 0.544
51 H GLY 11 H GLY 11 11.376 6.821 -1.959
52 HA2 GLY 11 1HA GLY 11 9.292 5.867 -1.832
53 HA3 GLY 11 2HA GLY 11 10.087 4.323 -2.100
54 HA PRO 12 HA PRO 12 8.569 5.014 2.412
55 HB2 PRO 12 1HB PRO 12 6.061 3.984 2.267
56 HB3 PRO 12 2HB PRO 12 6.408 5.703 2.041
57 HG2 PRO 12 1HG PRO 12 5.945 3.577 -0.016
58 HG3 PRO 12 2HG PRO 12 5.330 5.239 0.033
59 HD2 PRO 12 1HD PRO 12 7.442 4.512 -1.497
60 HD3 PRO 12 2HD PRO 12 7.300 6.126 -0.770
61 H TYR 13 H TYR 13 8.136 3.279 3.932
62 HA TYR 13 HA TYR 13 8.474 0.582 2.808
63 HB2 TYR 13 1HB TYR 13 10.650 1.005 3.540
64 HB3 TYR 13 2HB TYR 13 10.108 1.941 4.928
65 HD1 TYR 13 1HD TYR 13 9.770 -1.544 3.602
66 HD2 TYR 13 2HD TYR 13 10.353 0.957 6.995
67 HE1 TYR 13 1HE TYR 13 9.996 -3.537 5.026
68 HE2 TYR 13 2HE TYR 13 10.582 -1.029 8.427
69 HH TYR 13 HH TYR 13 11.140 -3.378 8.243
70 H ILE 14 H ILE 14 6.983 -0.788 3.511
71 HA ILE 14 HA ILE 14 5.078 -0.032 5.493
72 HB ILE 14 HB ILE 14 5.493 -2.745 4.232
73 HG12 ILE 14 1HG1 ILE 14 3.355 -0.846 3.373
74 HG13 ILE 14 2HG1 ILE 14 4.995 -0.570 2.796
75 HG21 ILE 14 1HG2 ILE 14 4.035 -3.300 5.858
76 HG22 ILE 14 2HG2 ILE 14 3.512 -1.635 6.105
77 HG23 ILE 14 3HG2 ILE 14 2.855 -2.576 4.766
78 HD11 ILE 14 1HD1 ILE 14 4.904 -2.287 1.371
79 HD12 ILE 14 2HD1 ILE 14 4.066 -3.329 2.521
80 HD13 ILE 14 3HD1 ILE 14 3.158 -2.146 1.579
81 H THR 15 H THR 15 5.130 -0.349 7.616
82 HA THR 15 HA THR 15 6.975 -2.380 8.692
83 HB THR 15 HB THR 15 7.761 -0.983 10.350
84 HG1 THR 15 1HG THR 15 6.136 -0.071 11.394
85 HG21 THR 15 1HG2 THR 15 8.811 0.595 9.149
86 HG22 THR 15 2HG2 THR 15 7.298 1.390 8.711
87 HG23 THR 15 3HG2 THR 15 7.866 0.001 7.783
88 H PHE 16 H PHE 16 3.854 -1.752 8.244
89 HA PHE 16 HA PHE 16 3.041 -3.403 10.470
90 HB2 PHE 16 1HB PHE 16 3.011 -0.878 11.162
91 HB3 PHE 16 2HB PHE 16 1.548 -0.818 10.184
92 HD1 PHE 16 1HD PHE 16 3.087 -2.162 13.219
93 HD2 PHE 16 2HD PHE 16 -0.469 -1.925 10.892
94 HE1 PHE 16 1HE PHE 16 1.788 -3.024 15.122
95 HE2 PHE 16 2HE PHE 16 -1.774 -2.785 12.791
96 HZ PHE 16 HZ PHE 16 -0.646 -3.335 14.911
97 H THR 17 H THR 17 1.592 -4.807 9.745
98 HA THR 17 HA THR 17 -0.323 -3.984 7.688
99 HB THR 17 HB THR 17 0.128 -6.415 6.724
100 HG1 THR 17 1HG THR 17 1.961 -7.239 7.367
101 HG21 THR 17 1HG2 THR 17 1.416 -5.431 4.973
102 HG22 THR 17 2HG2 THR 17 1.996 -4.150 6.038
103 HG23 THR 17 3HG2 THR 17 0.301 -4.194 5.554
104 H ASP 18 H ASP 18 -2.245 -4.353 8.567
105 HA ASP 18 HA ASP 18 -2.759 -6.965 9.785
106 HB2 ASP 18 1HB ASP 18 -3.093 -4.297 11.096
107 HB3 ASP 18 2HB ASP 18 -4.238 -5.582 11.472
108 H ALA 19 H ALA 19 -5.008 -7.554 9.831
109 HA ALA 19 HA ALA 19 -6.488 -6.327 7.627
110 HB1 ALA 19 1HB ALA 19 -6.887 -8.944 9.071
111 HB2 ALA 19 2HB ALA 19 -7.892 -8.362 7.742
112 HB3 ALA 19 3HB ALA 19 -6.185 -8.712 7.469
113 H VAL 20 H VAL 20 -7.802 -4.721 8.202
114 HA VAL 20 HA VAL 20 -8.858 -4.375 10.811
115 HB VAL 20 HB VAL 20 -9.871 -3.093 8.273
116 HG11 VAL 20 1HG1 VAL 20 -11.317 -2.782 10.206
117 HG12 VAL 20 2HG1 VAL 20 -9.948 -2.196 11.153
118 HG13 VAL 20 3HG1 VAL 20 -10.529 -1.267 9.770
119 HG21 VAL 20 1HG2 VAL 20 -7.789 -1.911 10.079
120 HG22 VAL 20 2HG2 VAL 20 -7.346 -2.951 8.725
121 HG23 VAL 20 3HG2 VAL 20 -8.220 -1.448 8.433
122 H ASN 21 H ASN 21 -10.007 -5.988 7.951
123 HA ASN 21 HA ASN 21 -12.141 -7.216 9.426
124 HB2 ASN 21 1HB ASN 21 -12.692 -5.032 7.474
125 HB3 ASN 21 2HB ASN 21 -13.770 -6.425 7.470
126 HD21 ASN 21 1HD2 ASN 21 -14.491 -3.777 8.146
127 HD22 ASN 21 2HD2 ASN 21 -14.988 -3.772 9.800
128 H GLU 22 H GLU 22 -13.606 -8.435 7.632
129 HA GLU 22 HA GLU 22 -11.885 -10.342 6.470
130 HB2 GLU 22 1HB GLU 22 -13.949 -11.242 5.420
131 HB3 GLU 22 2HB GLU 22 -14.111 -10.972 7.149
132 HG2 GLU 22 1HG GLU 22 -14.981 -8.846 5.254
133 HG3 GLU 22 2HG GLU 22 -16.005 -10.258 5.507
134 H THR 23 H THR 23 -13.378 -7.443 5.237
135 HA THR 23 HA THR 23 -12.099 -7.945 2.628
136 HB THR 23 HB THR 23 -13.859 -6.544 1.590
137 HG1 THR 23 1HG THR 23 -15.426 -6.831 3.910
138 HG21 THR 23 1HG2 THR 23 -15.306 -8.293 1.304
139 HG22 THR 23 2HG2 THR 23 -15.371 -8.664 3.027
140 HG23 THR 23 3HG2 THR 23 -13.972 -9.152 2.072
141 H THR 24 H THR 24 -11.272 -6.490 5.168
142 HA THR 24 HA THR 24 -10.419 -4.031 3.817
143 HB THR 24 HB THR 24 -11.092 -3.843 6.719
144 HG1 THR 24 1HG THR 24 -13.234 -3.419 6.254
145 HG21 THR 24 1HG2 THR 24 -11.234 -1.558 6.306
146 HG22 THR 24 2HG2 THR 24 -11.567 -1.788 4.589
147 HG23 THR 24 3HG2 THR 24 -9.943 -2.068 5.219
148 H ILE 25 H ILE 25 -8.401 -3.260 4.424
149 HA ILE 25 HA ILE 25 -6.932 -4.717 6.489
150 HB ILE 25 HB ILE 25 -6.131 -4.567 3.594
151 HG12 ILE 25 1HG1 ILE 25 -6.166 -6.840 5.591
152 HG13 ILE 25 2HG1 ILE 25 -7.407 -6.537 4.380
153 HG21 ILE 25 1HG2 ILE 25 -3.976 -5.699 4.758
154 HG22 ILE 25 2HG2 ILE 25 -4.084 -3.991 4.334
155 HG23 ILE 25 3HG2 ILE 25 -4.418 -4.513 5.985
156 HD11 ILE 25 1HD1 ILE 25 -6.099 -8.210 3.447
157 HD12 ILE 25 2HD1 ILE 25 -5.503 -6.739 2.677
158 HD13 ILE 25 3HD1 ILE 25 -4.594 -7.474 3.997
159 H MET 26 H MET 26 -5.524 -3.474 7.599
160 HA MET 26 HA MET 26 -5.156 -0.709 6.656
161 HB2 MET 26 1HB MET 26 -6.256 -0.429 8.655
162 HB3 MET 26 2HB MET 26 -5.581 -1.894 9.356
163 HG2 MET 26 1HG MET 26 -3.600 -0.851 9.953
164 HG3 MET 26 2HG MET 26 -3.838 0.469 8.810
165 HE1 MET 26 1HE MET 26 -4.205 2.404 9.275
166 HE2 MET 26 2HE MET 26 -5.726 2.940 9.989
167 HE3 MET 26 3HE MET 26 -4.232 3.039 10.921
168 H LEU 27 H LEU 27 -3.179 -0.178 6.025
169 HA LEU 27 HA LEU 27 -0.886 -1.570 7.239
170 HB2 LEU 27 1HB LEU 27 0.144 -1.912 5.211
171 HB3 LEU 27 2HB LEU 27 -1.548 -2.208 4.819
172 HG LEU 27 HG LEU 27 -0.338 0.491 4.349
173 HD11 LEU 27 1HD1 LEU 27 -0.347 -1.594 2.211
174 HD12 LEU 27 2HD1 LEU 27 1.018 -1.469 3.320
175 HD13 LEU 27 3HD1 LEU 27 0.572 -0.093 2.311
176 HD21 LEU 27 1HD2 LEU 27 -2.299 -0.785 2.542
177 HD22 LEU 27 2HD2 LEU 27 -2.182 0.885 3.096
178 HD23 LEU 27 3HD2 LEU 27 -2.870 -0.350 4.153
179 H LYS 28 H LYS 28 0.825 -0.326 7.814
180 HA LYS 28 HA LYS 28 0.611 2.561 7.263
181 HB2 LYS 28 1HB LYS 28 1.869 1.233 9.670
182 HB3 LYS 28 2HB LYS 28 1.700 2.963 9.405
183 HG2 LYS 28 1HG LYS 28 -0.540 2.958 9.874
184 HG3 LYS 28 2HG LYS 28 -0.747 1.271 9.400
185 HD2 LYS 28 1HD LYS 28 0.439 0.557 11.415
186 HD3 LYS 28 2HD LYS 28 0.669 2.243 11.883
187 HE2 LYS 28 1HE LYS 28 -1.906 2.392 11.726
188 HE3 LYS 28 2HE LYS 28 -1.856 0.631 11.797
189 HZ1 LYS 28 1HZ LYS 28 -0.741 0.740 13.899
190 HZ2 LYS 28 2HZ LYS 28 -2.140 1.687 13.986
191 HZ3 LYS 28 3HZ LYS 28 -0.627 2.426 13.817
192 H TRP 29 H TRP 29 2.397 3.659 6.574
193 HA TRP 29 HA TRP 29 4.836 2.064 6.129
194 HB2 TRP 29 1HB TRP 29 5.183 3.411 4.058
195 HB3 TRP 29 2HB TRP 29 3.745 2.396 4.001
196 HD1 TRP 29 HD TRP 29 4.751 6.093 4.441
197 HE1 TRP 29 1HE TRP 29 2.753 7.558 3.744
198 HE3 TRP 29 3HE TRP 29 1.283 2.419 3.661
199 HZ2 TRP 29 2HZ TRP 29 0.063 7.204 2.968
200 HZ3 TRP 29 3HZ TRP 29 -0.980 3.066 2.943
201 HH2 TRP 29 HH TRP 29 -1.575 5.410 2.605
202 H MET 30 H MET 30 6.830 3.153 6.270
203 HA MET 30 HA MET 30 6.701 5.620 7.860
204 HB2 MET 30 1HB MET 30 8.754 5.025 8.838
205 HB3 MET 30 2HB MET 30 7.859 3.515 8.739
206 HG2 MET 30 1HG MET 30 9.119 2.821 6.827
207 HG3 MET 30 2HG MET 30 9.914 4.390 6.727
208 HE1 MET 30 1HE MET 30 11.001 4.789 10.107
209 HE2 MET 30 2HE MET 30 12.512 4.543 9.231
210 HE3 MET 30 3HE MET 30 11.179 5.409 8.465
211 H TYR 31 H TYR 31 8.556 7.150 7.540
212 HA TYR 31 HA TYR 31 9.367 7.271 4.712
213 HB2 TYR 31 1HB TYR 31 7.522 8.857 5.156
214 HB3 TYR 31 2HB TYR 31 8.490 9.613 6.416
215 HD1 TYR 31 1HD TYR 31 8.321 8.974 2.770
216 HD2 TYR 31 2HD TYR 31 10.100 11.259 5.887
217 HE1 TYR 31 1HE TYR 31 9.315 10.475 1.094
218 HE2 TYR 31 2HE TYR 31 11.098 12.767 4.220
219 HH TYR 31 HH TYR 31 10.216 12.664 0.886
220 H ILE 32 H ILE 32 11.458 7.721 4.338
221 HA ILE 32 HA ILE 32 13.122 8.458 6.657
222 HB ILE 32 HB ILE 32 14.022 6.877 4.249
223 HG12 ILE 32 1HG1 ILE 32 14.155 5.084 6.225
224 HG13 ILE 32 2HG1 ILE 32 12.814 6.044 6.841
225 HG21 ILE 32 1HG2 ILE 32 16.065 7.284 5.010
226 HG22 ILE 32 2HG2 ILE 32 15.408 8.192 6.370
227 HG23 ILE 32 3HG2 ILE 32 15.652 6.451 6.507
228 HD11 ILE 32 1HD1 ILE 32 12.813 5.004 4.037
229 HD12 ILE 32 2HD1 ILE 32 12.287 4.007 5.393
230 HD13 ILE 32 3HD1 ILE 32 11.453 5.518 5.033
231 HA PRO 33 HA PRO 33 13.608 12.034 3.887
232 HB2 PRO 33 1HB PRO 33 14.354 13.727 5.874
233 HB3 PRO 33 2HB PRO 33 12.665 13.344 5.522
234 HG2 PRO 33 1HG PRO 33 14.459 12.224 7.639
235 HG3 PRO 33 2HG PRO 33 12.763 12.725 7.761
236 HD2 PRO 33 1HD PRO 33 13.502 10.131 7.515
237 HD3 PRO 33 2HD PRO 33 11.986 10.760 6.839
238 H ALA 34 H ALA 34 15.741 10.201 5.779
239 HA ALA 34 HA ALA 34 18.114 11.678 5.655
240 HB1 ALA 34 1HB ALA 34 17.768 9.634 7.018
241 HB2 ALA 34 2HB ALA 34 17.864 8.676 5.540
242 HB3 ALA 34 3HB ALA 34 19.261 9.608 6.078
243 H SER 35 H SER 35 17.326 8.872 3.595
244 HA SER 35 HA SER 35 19.162 9.865 1.568
245 HB2 SER 35 1HB SER 35 17.823 7.268 2.139
246 HB3 SER 35 2HB SER 35 18.240 7.613 0.461
247 HG SER 35 HG SER 35 20.076 6.773 1.162
248 H ASN 36 H ASN 36 16.932 11.497 1.907
249 HA ASN 36 HA ASN 36 15.342 10.947 -0.511
250 HB2 ASN 36 1HB ASN 36 13.966 11.060 1.496
251 HB3 ASN 36 2HB ASN 36 14.652 12.629 1.908
252 HD21 ASN 36 1HD2 ASN 36 12.966 10.988 -0.743
253 HD22 ASN 36 2HD2 ASN 36 11.982 12.340 -1.181
254 H ASN 37 H ASN 37 14.672 12.865 -1.756
255 HA ASN 37 HA ASN 37 16.930 14.677 -2.066
256 HB2 ASN 37 1HB ASN 37 14.640 13.821 -3.771
257 HB3 ASN 37 2HB ASN 37 15.336 15.410 -4.073
258 HD21 ASN 37 1HD2 ASN 37 15.528 13.789 -6.095
259 HD22 ASN 37 2HD2 ASN 37 17.114 13.127 -6.269
260 H ASN 38 H ASN 38 15.130 14.961 0.217
261 HA ASN 38 HA ASN 38 13.776 16.493 1.273
262 HB2 ASN 38 1HB ASN 38 15.696 18.356 -0.143
263 HB3 ASN 38 2HB ASN 38 14.772 18.726 1.310
264 HD21 ASN 38 1HD2 ASN 38 17.530 17.149 0.000
265 HD22 ASN 38 2HD2 ASN 38 18.238 16.667 1.500
266 H THR 39 H THR 39 12.621 15.674 -1.161
267 HA THR 39 HA THR 39 11.469 18.160 -2.232
268 HB THR 39 HB THR 39 12.533 16.353 -3.764
269 HG1 THR 39 1HG THR 39 11.373 18.046 -4.654
270 HG21 THR 39 1HG2 THR 39 11.190 14.517 -4.393
271 HG22 THR 39 2HG2 THR 39 9.787 15.144 -3.527
272 HG23 THR 39 3HG2 THR 39 11.171 14.520 -2.630
273 HA PRO 40 HA PRO 40 7.672 17.329 -0.152
274 HB2 PRO 40 1HB PRO 40 6.025 18.838 -1.695
275 HB3 PRO 40 2HB PRO 40 7.160 19.536 -0.533
276 HG2 PRO 40 1HG PRO 40 7.435 19.224 -3.498
277 HG3 PRO 40 2HG PRO 40 7.855 20.610 -2.475
278 HD2 PRO 40 1HD PRO 40 9.705 18.848 -3.370
279 HD3 PRO 40 2HD PRO 40 9.851 19.672 -1.805
280 H ILE 41 H ILE 41 6.113 15.811 -0.270
281 HA ILE 41 HA ILE 41 5.769 14.418 -2.823
282 HB ILE 41 HB ILE 41 4.689 13.472 -0.183
283 HG12 ILE 41 1HG1 ILE 41 7.486 13.122 -1.276
284 HG13 ILE 41 2HG1 ILE 41 7.027 13.889 0.240
285 HG21 ILE 41 1HG2 ILE 41 4.485 11.411 -1.186
286 HG22 ILE 41 2HG2 ILE 41 4.158 12.487 -2.543
287 HG23 ILE 41 3HG2 ILE 41 5.748 11.743 -2.371
288 HD11 ILE 41 1HD1 ILE 41 7.723 11.209 -0.206
289 HD12 ILE 41 2HD1 ILE 41 7.164 11.954 1.293
290 HD13 ILE 41 3HD1 ILE 41 6.003 11.227 0.182
291 H HIS 42 H HIS 42 3.774 14.060 -3.754
292 HA HIS 42 HA HIS 42 1.732 15.996 -3.095
293 HB2 HIS 42 1HB HIS 42 2.259 14.124 -5.352
294 HB3 HIS 42 2HB HIS 42 0.597 14.646 -5.092
295 HD1 HIS 42 1HD HIS 42 0.952 15.808 -7.493
296 HD2 HIS 42 2HD HIS 42 3.097 17.430 -4.326
297 HE1 HIS 42 1HE HIS 42 1.689 18.082 -8.275
298 HE2 HIS 42 2HE HIS 42 3.057 19.009 -6.374
299 H GLY 43 H GLY 43 2.102 12.479 -3.058
300 HA2 GLY 43 1HA GLY 43 0.172 12.207 -0.968
301 HA3 GLY 43 2HA GLY 43 -0.473 11.672 -2.513
302 H PHE 44 H PHE 44 -0.653 9.532 -1.797
303 HA PHE 44 HA PHE 44 1.856 8.053 -1.927
304 HB2 PHE 44 1HB PHE 44 -0.025 8.043 0.414
305 HB3 PHE 44 2HB PHE 44 0.929 6.613 0.033
306 HD1 PHE 44 2HD PHE 44 3.514 7.309 -0.533
307 HD2 PHE 44 1HD PHE 44 0.838 9.364 2.062
308 HE1 PHE 44 2HE PHE 44 5.429 8.264 0.680
309 HE2 PHE 44 1HE PHE 44 2.749 10.324 3.279
310 HZ PHE 44 HZ PHE 44 5.048 9.773 2.589
311 H TYR 45 H TYR 45 1.639 6.429 -3.309
312 HA TYR 45 HA TYR 45 -1.046 5.569 -4.074
313 HB2 TYR 45 1HB TYR 45 1.636 5.519 -5.363
314 HB3 TYR 45 2HB TYR 45 0.502 4.248 -5.806
315 HD1 TYR 45 2HD TYR 45 -2.063 5.599 -5.856
316 HD2 TYR 45 1HD TYR 45 1.744 7.004 -7.136
317 HE1 TYR 45 2HE TYR 45 -3.165 7.129 -7.435
318 HE2 TYR 45 1HE TYR 45 0.652 8.539 -8.718
319 HH TYR 45 HH TYR 45 -1.298 9.426 -9.375
320 H ILE 46 H ILE 46 -1.693 3.408 -4.089
321 HA ILE 46 HA ILE 46 0.054 1.478 -2.739
322 HB ILE 46 HB ILE 46 -2.829 1.936 -1.964
323 HG12 ILE 46 1HG1 ILE 46 -0.546 2.263 -0.069
324 HG13 ILE 46 2HG1 ILE 46 -0.865 3.559 -1.216
325 HG21 ILE 46 1HG2 ILE 46 -2.050 -0.419 -1.874
326 HG22 ILE 46 2HG2 ILE 46 -0.790 0.081 -0.747
327 HG23 ILE 46 3HG2 ILE 46 -2.488 0.238 -0.298
328 HD11 ILE 46 1HD1 ILE 46 -2.769 2.459 0.834
329 HD12 ILE 46 2HD1 ILE 46 -1.972 4.033 0.854
330 HD13 ILE 46 3HD1 ILE 46 -3.183 3.673 -0.376
331 H TYR 47 H TYR 47 0.095 -0.415 -3.757
332 HA TYR 47 HA TYR 47 -2.030 -0.987 -5.711
333 HB2 TYR 47 1HB TYR 47 0.822 -1.994 -5.608
334 HB3 TYR 47 2HB TYR 47 -0.367 -2.440 -6.827
335 HD1 TYR 47 2HD TYR 47 0.901 0.742 -5.312
336 HD2 TYR 47 1HD TYR 47 -0.080 -1.400 -8.855
337 HE1 TYR 47 2HE TYR 47 1.566 2.685 -6.664
338 HE2 TYR 47 1HE TYR 47 0.584 0.537 -10.217
339 HH TYR 47 HH TYR 47 2.205 2.562 -9.869
340 H TYR 48 H TYR 48 -2.924 -3.057 -5.838
341 HA TYR 48 HA TYR 48 -2.147 -5.125 -3.994
342 HB2 TYR 48 1HB TYR 48 -4.366 -5.225 -2.863
343 HB3 TYR 48 2HB TYR 48 -3.443 -3.781 -2.463
344 HD1 TYR 48 1HD TYR 48 -6.375 -5.080 -4.244
345 HD2 TYR 48 2HD TYR 48 -4.185 -1.592 -3.177
346 HE1 TYR 48 1HE TYR 48 -8.284 -3.683 -4.918
347 HE2 TYR 48 2HE TYR 48 -6.089 -0.185 -3.847
348 HH TYR 48 HH TYR 48 -8.302 -0.209 -4.370
349 H ARG 49 H ARG 49 -3.225 -7.122 -4.379
350 HA ARG 49 HA ARG 49 -5.306 -7.449 -6.255
351 HB2 ARG 49 1HB ARG 49 -4.129 -8.312 -8.162
352 HB3 ARG 49 2HB ARG 49 -3.490 -6.713 -7.802
353 HG2 ARG 49 1HG ARG 49 -1.539 -7.817 -8.139
354 HG3 ARG 49 2HG ARG 49 -1.738 -8.130 -6.414
355 HD2 ARG 49 1HD ARG 49 -3.082 -10.221 -7.322
356 HD3 ARG 49 2HD ARG 49 -2.057 -9.962 -8.733
357 HE ARG 49 HE ARG 49 -0.508 -9.959 -6.364
358 HH11 ARG 49 1HH1 ARG 49 -2.221 -12.087 -8.522
359 HH12 ARG 49 2HH1 ARG 49 -1.223 -13.459 -8.171
360 HH21 ARG 49 1HH2 ARG 49 0.814 -11.758 -5.894
361 HH22 ARG 49 2HH2 ARG 49 0.502 -13.271 -6.675
362 HA PRO 50 HA PRO 50 -5.306 -11.344 -4.203
363 HB2 PRO 50 1HB PRO 50 -6.964 -12.703 -5.868
364 HB3 PRO 50 2HB PRO 50 -7.535 -11.460 -4.748
365 HG2 PRO 50 1HG PRO 50 -6.963 -11.251 -7.679
366 HG3 PRO 50 2HG PRO 50 -8.325 -10.591 -6.756
367 HD2 PRO 50 1HD PRO 50 -6.204 -9.083 -7.501
368 HD3 PRO 50 2HD PRO 50 -7.103 -8.790 -5.998
369 H THR 51 H THR 51 -4.269 -13.295 -4.276
370 HA THR 51 HA THR 51 -2.165 -13.693 -6.043
371 HB THR 51 HB THR 51 -2.707 -14.820 -3.734
372 HG1 THR 51 1HG THR 51 -1.005 -16.115 -4.161
373 HG21 THR 51 1HG2 THR 51 -3.310 -17.263 -5.243
374 HG22 THR 51 2HG2 THR 51 -4.622 -16.085 -5.213
375 HG23 THR 51 3HG2 THR 51 -3.950 -16.696 -3.702
376 H ASP 52 H ASP 52 -5.500 -14.359 -6.455
377 HA ASP 52 HA ASP 52 -5.226 -16.430 -8.412
378 HB2 ASP 52 1HB ASP 52 -7.455 -14.798 -7.310
379 HB3 ASP 52 2HB ASP 52 -7.695 -15.521 -8.899
380 H SER 53 H SER 53 -5.232 -12.958 -8.452
381 HA SER 53 HA SER 53 -5.998 -12.239 -10.944
382 HB2 SER 53 1HB SER 53 -3.819 -11.279 -9.152
383 HB3 SER 53 2HB SER 53 -3.839 -10.677 -10.810
384 HG SER 53 HG SER 53 -6.261 -10.658 -9.452
385 H ASP 54 H ASP 54 -4.982 -11.998 -12.986
386 HA ASP 54 HA ASP 54 -3.446 -14.273 -13.770
387 HB2 ASP 54 1HB ASP 54 -5.192 -12.806 -15.110
388 HB3 ASP 54 2HB ASP 54 -3.750 -11.900 -15.559
389 H ASN 55 H ASN 55 -2.749 -10.777 -13.953
390 HA ASN 55 HA ASN 55 0.006 -11.269 -13.197
391 HB2 ASN 55 1HB ASN 55 0.706 -9.815 -15.259
392 HB3 ASN 55 2HB ASN 55 0.451 -11.546 -15.457
393 HD21 ASN 55 1HD2 ASN 55 -1.236 -12.274 -16.677
394 HD22 ASN 55 2HD2 ASN 55 -2.238 -11.236 -17.628
395 H ASP 56 H ASP 56 1.203 -8.966 -13.523
396 HA ASP 56 HA ASP 56 0.274 -7.277 -11.582
397 HB2 ASP 56 1HB ASP 56 1.871 -5.695 -12.302
398 HB3 ASP 56 2HB ASP 56 2.537 -7.256 -12.774
399 H SER 57 H SER 57 -0.738 -7.474 -14.900
400 HA SER 57 HA SER 57 -1.863 -5.021 -15.385
401 HB2 SER 57 1HB SER 57 -1.806 -6.973 -16.967
402 HB3 SER 57 2HB SER 57 -3.177 -7.653 -16.092
403 HG SER 57 HG SER 57 -4.147 -6.523 -17.646
404 H ASP 58 H ASP 58 -2.775 -7.299 -13.006
405 HA ASP 58 HA ASP 58 -5.461 -6.246 -12.679
406 HB2 ASP 58 1HB ASP 58 -3.873 -8.431 -11.371
407 HB3 ASP 58 2HB ASP 58 -5.334 -7.820 -10.600
408 H TYR 59 H TYR 59 -2.338 -6.114 -11.051
409 HA TYR 59 HA TYR 59 -2.842 -5.019 -8.647
410 HB2 TYR 59 1HB TYR 59 -0.704 -4.531 -10.656
411 HB3 TYR 59 2HB TYR 59 -0.797 -3.421 -9.293
412 HD1 TYR 59 1HD TYR 59 -1.538 -5.125 -7.067
413 HD2 TYR 59 2HD TYR 59 1.116 -5.917 -10.297
414 HE1 TYR 59 1HE TYR 59 -0.323 -6.740 -5.665
415 HE2 TYR 59 2HE TYR 59 2.337 -7.535 -8.904
416 HH TYR 59 HH TYR 59 1.135 -8.704 -5.961
417 H LYS 60 H LYS 60 -3.979 -3.370 -7.892
418 HA LYS 60 HA LYS 60 -4.902 -1.305 -9.730
419 HB2 LYS 60 1HB LYS 60 -5.742 -2.263 -7.025
420 HB3 LYS 60 2HB LYS 60 -6.182 -0.635 -7.524
421 HG2 LYS 60 1HG LYS 60 -7.351 -1.505 -9.454
422 HG3 LYS 60 2HG LYS 60 -6.844 -3.146 -9.049
423 HD2 LYS 60 1HD LYS 60 -8.004 -2.537 -6.745
424 HD3 LYS 60 2HD LYS 60 -8.899 -1.416 -7.774
425 HE2 LYS 60 1HE LYS 60 -9.455 -3.330 -9.264
426 HE3 LYS 60 2HE LYS 60 -8.681 -4.407 -8.102
427 HZ1 LYS 60 1HZ LYS 60 -10.342 -3.158 -6.489
428 HZ2 LYS 60 2HZ LYS 60 -10.800 -4.536 -7.357
429 HZ3 LYS 60 3HZ LYS 60 -11.230 -3.000 -7.920
430 H LYS 61 H LYS 61 -5.259 0.889 -8.291
431 HA LYS 61 HA LYS 61 -2.805 1.556 -6.872
432 HB2 LYS 61 1HB LYS 61 -2.321 2.002 -9.260
433 HB3 LYS 61 2HB LYS 61 -3.702 3.089 -9.320
434 HG2 LYS 61 1HG LYS 61 -2.664 4.678 -7.967
435 HG3 LYS 61 2HG LYS 61 -1.471 3.522 -7.368
436 HD2 LYS 61 1HD LYS 61 -0.239 4.777 -8.878
437 HD3 LYS 61 2HD LYS 61 -0.728 3.387 -9.851
438 HE2 LYS 61 1HE LYS 61 -2.593 4.694 -10.761
439 HE3 LYS 61 2HE LYS 61 -2.088 6.080 -9.796
440 HZ1 LYS 61 1HZ LYS 61 -0.409 6.549 -11.191
441 HZ2 LYS 61 2HZ LYS 61 -1.323 5.673 -12.313
442 HZ3 LYS 61 3HZ LYS 61 -0.043 4.926 -11.498
443 H ASP 62 H ASP 62 -3.534 2.412 -5.045
444 HA ASP 62 HA ASP 62 -5.855 4.223 -5.168
445 HB2 ASP 62 1HB ASP 62 -5.019 2.160 -3.191
446 HB3 ASP 62 2HB ASP 62 -5.799 3.612 -2.569
447 H MET 63 H MET 63 -5.164 6.262 -5.154
448 HA MET 63 HA MET 63 -2.682 7.060 -3.989
449 HB2 MET 63 1HB MET 63 -4.088 8.107 -5.961
450 HB3 MET 63 2HB MET 63 -4.822 9.035 -4.660
451 HG2 MET 63 1HG MET 63 -1.850 8.899 -4.977
452 HG3 MET 63 2HG MET 63 -2.821 10.034 -5.912
453 HE1 MET 63 1HE MET 63 -5.091 11.156 -3.630
454 HE2 MET 63 2HE MET 63 -4.077 12.597 -3.548
455 HE3 MET 63 3HE MET 63 -4.263 11.734 -5.076
456 H VAL 64 H VAL 64 -2.385 8.546 -2.248
457 HA VAL 64 HA VAL 64 -4.629 8.885 -0.406
458 HB VAL 64 HB VAL 64 -1.997 7.725 0.514
459 HG11 VAL 64 1HG1 VAL 64 -4.583 7.947 2.034
460 HG12 VAL 64 2HG1 VAL 64 -2.980 7.553 2.658
461 HG13 VAL 64 3HG1 VAL 64 -3.330 9.186 2.090
462 HG21 VAL 64 1HG2 VAL 64 -4.549 6.443 -0.314
463 HG22 VAL 64 2HG2 VAL 64 -2.888 5.884 -0.510
464 HG23 VAL 64 3HG2 VAL 64 -3.680 5.762 1.062
465 H GLU 65 H GLU 65 -4.422 10.627 1.005
466 HA GLU 65 HA GLU 65 -3.176 12.896 0.159
467 HB2 GLU 65 1HB GLU 65 -3.360 12.466 3.108
468 HB3 GLU 65 2HB GLU 65 -3.792 13.879 2.156
469 HG2 GLU 65 1HG GLU 65 -5.349 11.373 2.623
470 HG3 GLU 65 2HG GLU 65 -5.835 13.051 2.861
471 H GLY 66 H GLY 66 -1.248 13.960 0.534
472 HA2 GLY 66 1HA GLY 66 1.064 12.371 0.811
473 HA3 GLY 66 2HA GLY 66 1.022 14.128 0.832
474 H ASP 67 H ASP 67 -0.699 14.363 3.121
475 HA ASP 67 HA ASP 67 1.292 14.145 5.169
476 HB2 ASP 67 1HB ASP 67 -0.226 15.327 6.562
477 HB3 ASP 67 2HB ASP 67 -0.426 16.002 4.948
478 H ARG 68 H ARG 68 -1.189 12.118 4.007
479 HA ARG 68 HA ARG 68 -1.637 10.696 6.471
480 HB2 ARG 68 1HB ARG 68 -3.229 10.967 4.419
481 HB3 ARG 68 2HB ARG 68 -2.328 9.606 3.765
482 HG2 ARG 68 1HG ARG 68 -4.225 8.687 4.800
483 HG3 ARG 68 2HG ARG 68 -2.882 8.378 5.903
484 HD2 ARG 68 1HD ARG 68 -4.482 9.152 7.360
485 HD3 ARG 68 2HD ARG 68 -3.627 10.644 6.971
486 HE ARG 68 HE ARG 68 -6.313 9.898 6.138
487 HH11 ARG 68 1HH1 ARG 68 -3.640 12.113 5.873
488 HH12 ARG 68 2HH1 ARG 68 -4.597 13.392 5.203
489 HH21 ARG 68 1HH2 ARG 68 -7.584 11.575 5.257
490 HH22 ARG 68 2HH2 ARG 68 -6.840 13.085 4.854
491 H TYR 69 H TYR 69 -0.615 8.927 7.202
492 HA TYR 69 HA TYR 69 1.480 7.766 5.486
493 HB2 TYR 69 1HB TYR 69 1.414 8.473 8.374
494 HB3 TYR 69 2HB TYR 69 2.305 7.025 7.920
495 HD1 TYR 69 2HD TYR 69 1.931 10.373 6.299
496 HD2 TYR 69 1HD TYR 69 4.568 7.478 7.961
497 HE1 TYR 69 2HE TYR 69 3.854 11.765 5.656
498 HE2 TYR 69 1HE TYR 69 6.499 8.862 7.324
499 HH TYR 69 HH TYR 69 6.060 11.967 5.650
500 H TRP 70 H TRP 70 -1.512 7.126 6.316
501 HA TRP 70 HA TRP 70 -1.064 4.238 6.336
502 HB2 TRP 70 1HB TRP 70 -2.512 3.810 8.171
503 HB3 TRP 70 2HB TRP 70 -1.407 5.071 8.710
504 HD1 TRP 70 HD TRP 70 -2.428 7.524 9.085
505 HE1 TRP 70 1HE TRP 70 -4.843 8.333 9.456
506 HE3 TRP 70 3HE TRP 70 -4.933 3.351 7.519
507 HZ2 TRP 70 2HZ TRP 70 -7.463 7.335 9.129
508 HZ3 TRP 70 3HZ TRP 70 -7.393 3.360 7.580
509 HH2 TRP 70 HH TRP 70 -8.630 5.311 8.370
510 H HIS 71 H HIS 71 -2.896 3.006 5.620
511 HA HIS 71 HA HIS 71 -5.194 4.418 4.572
512 HB2 HIS 71 1HB HIS 71 -3.479 4.669 2.787
513 HB3 HIS 71 2HB HIS 71 -3.365 2.914 2.687
514 HD1 HIS 71 1HD HIS 71 -6.081 5.564 2.357
515 HD2 HIS 71 2HD HIS 71 -4.988 1.872 0.797
516 HE1 HIS 71 1HE HIS 71 -7.764 5.071 0.554
517 HE2 HIS 71 2HE HIS 71 -7.132 2.793 -0.317
518 H SER 72 H SER 72 -6.967 3.136 4.433
519 HA SER 72 HA SER 72 -6.581 0.294 5.099
520 HB2 SER 72 1HB SER 72 -8.924 0.400 5.976
521 HB3 SER 72 2HB SER 72 -7.802 1.458 6.832
522 HG SER 72 HG SER 72 -8.993 3.079 6.261
523 H ILE 73 H ILE 73 -6.639 -0.850 3.266
524 HA ILE 73 HA ILE 73 -8.148 -0.094 0.972
525 HB ILE 73 HB ILE 73 -7.012 -2.829 1.538
526 HG12 ILE 73 1HG1 ILE 73 -5.564 -0.631 0.077
527 HG13 ILE 73 2HG1 ILE 73 -5.406 -0.827 1.820
528 HG21 ILE 73 1HG2 ILE 73 -6.775 -2.828 -0.966
529 HG22 ILE 73 2HG2 ILE 73 -8.431 -2.857 -0.364
530 HG23 ILE 73 3HG2 ILE 73 -7.744 -1.355 -0.981
531 HD11 ILE 73 1HD1 ILE 73 -3.572 -1.928 0.813
532 HD12 ILE 73 2HD1 ILE 73 -4.672 -3.182 1.384
533 HD13 ILE 73 3HD1 ILE 73 -4.618 -2.770 -0.329
534 H SER 74 H SER 74 -9.986 -1.060 0.086
535 HA SER 74 HA SER 74 -11.494 -2.886 1.819
536 HB2 SER 74 1HB SER 74 -12.913 -0.620 0.448
537 HB3 SER 74 2HB SER 74 -13.434 -1.583 1.831
538 HG SER 74 HG SER 74 -12.556 -0.141 3.061
539 H HIS 75 H HIS 75 -13.531 -3.661 0.598
540 HA HIS 75 HA HIS 75 -14.456 -4.766 -1.165
541 HB2 HIS 75 1HB HIS 75 -12.671 -3.249 -3.050
542 HB3 HIS 75 2HB HIS 75 -14.302 -3.856 -3.325
543 HD1 HIS 75 1HD HIS 75 -13.382 -0.865 -3.766
544 HD2 HIS 75 2HD HIS 75 -15.412 -2.327 -0.449
545 HE1 HIS 75 1HE HIS 75 -14.545 1.124 -2.759
546 HE2 HIS 75 2HE HIS 75 -15.698 0.231 -0.706
547 H LEU 76 H LEU 76 -12.415 -6.016 0.169
548 HA LEU 76 HA LEU 76 -10.876 -7.331 -1.971
549 HB2 LEU 76 1HB LEU 76 -10.260 -7.382 0.973
550 HB3 LEU 76 2HB LEU 76 -9.228 -7.914 -0.353
551 HG LEU 76 HG LEU 76 -10.036 -5.047 -0.226
552 HD11 LEU 76 1HD1 LEU 76 -9.063 -4.664 1.726
553 HD12 LEU 76 2HD1 LEU 76 -7.555 -5.325 1.095
554 HD13 LEU 76 3HD1 LEU 76 -8.708 -6.381 1.911
555 HD21 LEU 76 1HD2 LEU 76 -7.377 -6.246 -0.932
556 HD22 LEU 76 2HD2 LEU 76 -8.053 -4.690 -1.414
557 HD23 LEU 76 3HD2 LEU 76 -8.704 -6.183 -2.092
558 H GLN 77 H GLN 77 -10.201 -9.668 -1.082
559 HA GLN 77 HA GLN 77 -12.745 -11.037 -0.630
560 HB2 GLN 77 1HB GLN 77 -10.102 -12.292 -1.362
561 HB3 GLN 77 2HB GLN 77 -11.705 -13.000 -1.507
562 HG2 GLN 77 1HG GLN 77 -11.025 -12.397 -3.683
563 HG3 GLN 77 2HG GLN 77 -12.237 -11.218 -3.185
564 HE21 GLN 77 1HE2 GLN 77 -8.780 -11.493 -2.467
565 HE22 GLN 77 2HE2 GLN 77 -8.350 -9.938 -3.084
566 HA PRO 78 HA PRO 78 -11.753 -11.985 3.556
567 HB2 PRO 78 1HB PRO 78 -13.410 -14.108 3.895
568 HB3 PRO 78 2HB PRO 78 -13.989 -12.440 3.819
569 HG2 PRO 78 1HG PRO 78 -13.951 -14.531 1.677
570 HG3 PRO 78 2HG PRO 78 -15.234 -13.380 2.094
571 HD2 PRO 78 1HD PRO 78 -13.548 -12.991 0.011
572 HD3 PRO 78 2HD PRO 78 -14.223 -11.649 0.957
573 H GLU 79 H GLU 79 -10.692 -13.550 4.841
574 HA GLU 79 HA GLU 79 -8.846 -14.934 5.038
575 HB2 GLU 79 1HB GLU 79 -9.666 -17.351 4.317
576 HB3 GLU 79 2HB GLU 79 -10.313 -16.542 5.737
577 HG2 GLU 79 1HG GLU 79 -12.289 -15.916 4.587
578 HG3 GLU 79 2HG GLU 79 -11.616 -16.407 3.033
579 H THR 80 H THR 80 -8.802 -13.496 2.545
580 HA THR 80 HA THR 80 -7.642 -15.494 0.722
581 HB THR 80 HB THR 80 -8.525 -12.671 0.091
582 HG1 THR 80 1HG THR 80 -10.383 -13.782 0.298
583 HG21 THR 80 1HG2 THR 80 -6.720 -14.264 -1.268
584 HG22 THR 80 2HG2 THR 80 -7.624 -12.909 -1.945
585 HG23 THR 80 3HG2 THR 80 -8.241 -14.552 -2.111
586 H SER 81 H SER 81 -5.524 -15.684 1.123
587 HA SER 81 HA SER 81 -3.928 -13.497 2.073
588 HB2 SER 81 1HB SER 81 -3.663 -16.101 2.444
589 HB3 SER 81 2HB SER 81 -2.700 -15.992 0.971
590 HG SER 81 HG SER 81 -1.157 -15.315 2.210
591 H TYR 82 H TYR 82 -3.405 -11.884 0.751
592 HA TYR 82 HA TYR 82 -2.295 -12.556 -1.885
593 HB2 TYR 82 1HB TYR 82 -3.390 -10.411 -2.722
594 HB3 TYR 82 2HB TYR 82 -4.459 -11.781 -2.447
595 HD1 TYR 82 1HD TYR 82 -3.186 -8.700 -0.776
596 HD2 TYR 82 2HD TYR 82 -6.361 -11.509 -1.138
597 HE1 TYR 82 1HE TYR 82 -4.576 -7.310 0.701
598 HE2 TYR 82 2HE TYR 82 -7.761 -10.125 0.337
599 HH TYR 82 HH TYR 82 -7.938 -8.178 1.413
600 H ASP 83 H ASP 83 -0.848 -10.943 -2.755
601 HA ASP 83 HA ASP 83 0.814 -9.794 -0.709
602 HB2 ASP 83 1HB ASP 83 1.002 -9.828 -3.723
603 HB3 ASP 83 2HB ASP 83 2.192 -9.038 -2.693
604 H ILE 84 H ILE 84 1.432 -7.579 -0.569
605 HA ILE 84 HA ILE 84 -0.311 -5.643 -1.896
606 HB ILE 84 HB ILE 84 0.048 -5.767 1.100
607 HG12 ILE 84 1HG1 ILE 84 -2.604 -5.755 -0.270
608 HG13 ILE 84 2HG1 ILE 84 -1.681 -7.253 -0.260
609 HG21 ILE 84 1HG2 ILE 84 -1.889 -3.854 0.182
610 HG22 ILE 84 2HG2 ILE 84 -0.483 -3.615 1.218
611 HG23 ILE 84 3HG2 ILE 84 -0.312 -3.525 -0.535
612 HD11 ILE 84 1HD1 ILE 84 -2.643 -7.649 1.700
613 HD12 ILE 84 2HD1 ILE 84 -1.562 -6.420 2.358
614 HD13 ILE 84 3HD1 ILE 84 -3.195 -5.982 1.858
615 H LYS 85 H LYS 85 0.695 -3.783 -2.418
616 HA LYS 85 HA LYS 85 3.238 -3.125 -1.120
617 HB2 LYS 85 1HB LYS 85 4.434 -2.908 -3.139
618 HB3 LYS 85 2HB LYS 85 3.588 -4.443 -3.278
619 HG2 LYS 85 1HG LYS 85 2.063 -3.602 -4.825
620 HG3 LYS 85 2HG LYS 85 2.421 -1.925 -4.404
621 HD2 LYS 85 1HD LYS 85 3.594 -2.076 -6.355
622 HD3 LYS 85 2HD LYS 85 4.840 -2.623 -5.232
623 HE2 LYS 85 1HE LYS 85 4.613 -4.048 -7.257
624 HE3 LYS 85 2HE LYS 85 4.377 -4.919 -5.743
625 HZ1 LYS 85 1HZ LYS 85 1.978 -3.825 -6.956
626 HZ2 LYS 85 2HZ LYS 85 2.228 -5.322 -6.208
627 HZ3 LYS 85 3HZ LYS 85 2.715 -5.085 -7.811
628 H MET 86 H MET 86 4.028 -0.917 -2.186
629 HA MET 86 HA MET 86 1.959 0.875 -3.007
630 HB2 MET 86 1HB MET 86 1.891 2.301 -1.066
631 HB3 MET 86 2HB MET 86 1.474 0.664 -0.575
632 HG2 MET 86 1HG MET 86 3.472 0.351 0.547
633 HG3 MET 86 2HG MET 86 4.286 1.638 -0.338
634 HE1 MET 86 1HE MET 86 3.171 4.015 -0.357
635 HE2 MET 86 2HE MET 86 1.518 3.920 0.251
636 HE3 MET 86 3HE MET 86 2.734 4.837 1.141
637 H GLN 87 H GLN 87 2.820 3.207 -2.977
638 HA GLN 87 HA GLN 87 5.638 3.608 -2.868
639 HB2 GLN 87 1HB GLN 87 5.967 2.569 -4.891
640 HB3 GLN 87 2HB GLN 87 4.357 2.963 -5.478
641 HG2 GLN 87 1HG GLN 87 6.346 5.146 -5.080
642 HG3 GLN 87 2HG GLN 87 6.459 4.109 -6.502
643 HE21 GLN 87 1HE2 GLN 87 4.769 4.123 -8.014
644 HE22 GLN 87 2HE2 GLN 87 3.650 5.436 -8.105
645 H CYS 88 H CYS 88 6.224 5.780 -3.120
646 HA CYS 88 HA CYS 88 3.957 7.626 -2.994
647 HB2 CYS 88 1HB CYS 88 5.389 9.144 -1.868
648 HB3 CYS 88 2HB CYS 88 5.752 7.559 -1.194
649 HG CYS 88 HG CYS 88 7.649 8.869 -3.708
650 H PHE 89 H PHE 89 4.054 9.673 -4.114
651 HA PHE 89 HA PHE 89 5.865 9.804 -6.401
652 HB2 PHE 89 1HB PHE 89 4.108 10.094 -8.011
653 HB3 PHE 89 2HB PHE 89 3.782 8.607 -7.126
654 HD1 PHE 89 1HD PHE 89 2.187 8.850 -5.073
655 HD2 PHE 89 2HD PHE 89 2.420 11.634 -8.284
656 HE1 PHE 89 1HE PHE 89 -0.065 9.672 -4.519
657 HE2 PHE 89 2HE PHE 89 0.169 12.461 -7.735
658 HZ PHE 89 HZ PHE 89 -1.076 11.481 -5.850
659 H ASN 90 H ASN 90 5.245 11.936 -7.691
660 HA ASN 90 HA ASN 90 4.119 14.096 -6.271
661 HB2 ASN 90 1HB ASN 90 5.969 14.026 -4.784
662 HB3 ASN 90 2HB ASN 90 7.113 13.777 -6.099
663 HD21 ASN 90 1HD2 ASN 90 8.297 15.485 -6.500
664 HD22 ASN 90 2HD2 ASN 90 7.800 17.133 -6.355
665 H GLU 91 H GLU 91 4.559 16.203 -7.350
666 HA GLU 91 HA GLU 91 4.097 16.166 -10.031
667 HB2 GLU 91 1HB GLU 91 4.358 18.447 -10.012
668 HB3 GLU 91 2HB GLU 91 4.211 18.141 -8.287
669 HG2 GLU 91 1HG GLU 91 6.843 17.933 -8.479
670 HG3 GLU 91 2HG GLU 91 6.568 18.973 -9.875
671 H GLY 92 H GLY 92 7.181 15.862 -8.420
672 HA2 GLY 92 1HA GLY 92 8.783 16.290 -10.753
673 HA3 GLY 92 2HA GLY 92 9.325 15.602 -9.229
674 H GLY 93 H GLY 93 7.593 13.403 -9.069
675 HA2 GLY 93 1HA GLY 93 7.226 11.778 -11.220
676 HA3 GLY 93 2HA GLY 93 8.941 11.612 -10.878
677 H GLU 94 H GLU 94 7.547 9.365 -10.737
678 HA GLU 94 HA GLU 94 6.573 8.918 -8.045
679 HB2 GLU 94 1HB GLU 94 6.935 7.024 -10.373
680 HB3 GLU 94 2HB GLU 94 6.196 6.595 -8.837
681 HG2 GLU 94 1HG GLU 94 4.322 7.038 -10.025
682 HG3 GLU 94 2HG GLU 94 4.651 8.659 -9.415
683 H SER 95 H SER 95 7.397 7.048 -6.781
684 HA SER 95 HA SER 95 10.335 7.008 -6.883
685 HB2 SER 95 1HB SER 95 9.410 7.896 -4.802
686 HB3 SER 95 2HB SER 95 8.457 6.429 -4.578
687 HG SER 95 HG SER 95 10.173 5.417 -3.879
688 H GLU 96 H GLU 96 11.067 4.864 -5.548
689 HA GLU 96 HA GLU 96 10.623 2.731 -7.348
690 HB2 GLU 96 1HB GLU 96 11.873 2.741 -4.596
691 HB3 GLU 96 2HB GLU 96 11.928 1.383 -5.711
692 HG2 GLU 96 1HG GLU 96 12.995 4.097 -6.419
693 HG3 GLU 96 2HG GLU 96 13.971 2.868 -5.616
694 H PHE 97 H PHE 97 9.845 0.560 -6.733
695 HA PHE 97 HA PHE 97 7.244 0.759 -5.520
696 HB2 PHE 97 1HB PHE 97 8.768 -1.481 -6.837
697 HB3 PHE 97 2HB PHE 97 7.219 -1.756 -6.047
698 HD1 PHE 97 1HD PHE 97 8.707 0.663 -8.471
699 HD2 PHE 97 2HD PHE 97 5.378 -1.765 -7.404
700 HE1 PHE 97 1HE PHE 97 7.543 1.362 -10.523
701 HE2 PHE 97 2HE PHE 97 4.209 -1.070 -9.454
702 HZ PHE 97 HZ PHE 97 5.292 0.495 -11.017
703 H SER 98 H SER 98 6.901 0.601 -3.415
704 HA SER 98 HA SER 98 8.788 -0.081 -1.500
705 HB2 SER 98 1HB SER 98 7.051 0.045 0.094
706 HB3 SER 98 2HB SER 98 6.537 1.126 -1.202
707 HG SER 98 HG SER 98 5.151 -0.808 -0.214
708 H ASN 99 H ASN 99 8.573 -1.904 0.106
709 HA ASN 99 HA ASN 99 9.035 -4.353 -1.146
710 HB2 ASN 99 1HB ASN 99 8.697 -5.295 1.220
711 HB3 ASN 99 2HB ASN 99 9.961 -4.087 1.005
712 HD21 ASN 99 1HD2 ASN 99 7.541 -5.017 2.968
713 HD22 ASN 99 2HD2 ASN 99 7.158 -3.506 3.715
714 H VAL 100 H VAL 100 7.804 -6.412 -0.578
715 HA VAL 100 HA VAL 100 4.948 -5.945 -1.109
716 HB VAL 100 HB VAL 100 6.626 -8.394 -1.674
717 HG11 VAL 100 1HG1 VAL 100 3.978 -8.415 -1.155
718 HG12 VAL 100 2HG1 VAL 100 3.961 -8.100 -2.891
719 HG13 VAL 100 3HG1 VAL 100 4.773 -9.534 -2.262
720 HG21 VAL 100 1HG2 VAL 100 7.209 -7.331 -3.538
721 HG22 VAL 100 2HG2 VAL 100 5.516 -7.368 -4.029
722 HG23 VAL 100 3HG2 VAL 100 6.149 -5.973 -3.156
723 H MET 101 H MET 101 3.758 -6.085 0.678
724 HA MET 101 HA MET 101 4.495 -8.055 2.728
725 HB2 MET 101 1HB MET 101 2.716 -5.616 2.876
726 HB3 MET 101 2HB MET 101 2.956 -6.748 4.201
727 HG2 MET 101 1HG MET 101 5.215 -5.261 2.897
728 HG3 MET 101 2HG MET 101 4.315 -4.631 4.275
729 HE1 MET 101 1HE MET 101 4.027 -5.528 6.301
730 HE2 MET 101 2HE MET 101 4.566 -7.101 6.887
731 HE3 MET 101 3HE MET 101 5.578 -5.676 7.128
732 H ILE 102 H ILE 102 3.180 -9.715 3.243
733 HA ILE 102 HA ILE 102 0.724 -10.005 1.659
734 HB ILE 102 HB ILE 102 2.305 -12.117 3.130
735 HG12 ILE 102 1HG1 ILE 102 2.040 -11.742 0.147
736 HG13 ILE 102 2HG1 ILE 102 3.367 -11.053 1.076
737 HG21 ILE 102 1HG2 ILE 102 0.425 -12.961 1.064
738 HG22 ILE 102 2HG2 ILE 102 0.688 -13.596 2.687
739 HG23 ILE 102 3HG2 ILE 102 -0.347 -12.189 2.448
740 HD11 ILE 102 1HD1 ILE 102 2.730 -13.941 0.594
741 HD12 ILE 102 2HD1 ILE 102 4.196 -13.049 0.185
742 HD13 ILE 102 3HD1 ILE 102 3.830 -13.418 1.870
743 H CYS 103 H CYS 103 -0.886 -9.077 2.814
744 HA CYS 103 HA CYS 103 -1.177 -9.834 5.639
745 HB2 CYS 103 1HB CYS 103 -1.109 -7.404 5.109
746 HB3 CYS 103 2HB CYS 103 -2.557 -7.605 4.130
747 HG CYS 103 HG CYS 103 -2.443 -8.264 7.485
748 H GLU 104 H GLU 104 -2.371 -11.621 5.829
749 HA GLU 104 HA GLU 104 -4.407 -12.335 3.947
750 HB2 GLU 104 1HB GLU 104 -2.902 -13.865 5.437
751 HB3 GLU 104 2HB GLU 104 -4.144 -13.599 6.653
752 HG2 GLU 104 1HG GLU 104 -5.758 -14.323 4.725
753 HG3 GLU 104 2HG GLU 104 -4.301 -15.071 4.073
754 H THR 105 H THR 105 -6.463 -11.732 3.945
755 HA THR 105 HA THR 105 -7.528 -9.940 5.845
756 HB THR 105 HB THR 105 -9.758 -10.552 4.696
757 HG1 THR 105 1HG THR 105 -8.179 -11.616 2.641
758 HG21 THR 105 1HG2 THR 105 -8.120 -8.627 4.176
759 HG22 THR 105 2HG2 THR 105 -9.319 -9.056 2.956
760 HG23 THR 105 3HG2 THR 105 -7.651 -9.601 2.783
761 H LYS 106 H LYS 106 -9.775 -10.415 6.850
762 HA LYS 106 HA LYS 106 -9.412 -12.665 8.638
763 HB2 LYS 106 1HB LYS 106 -11.313 -10.337 8.544
764 HB3 LYS 106 2HB LYS 106 -11.587 -11.685 9.640
765 HG2 LYS 106 1HG LYS 106 -9.063 -11.185 10.279
766 HG3 LYS 106 2HG LYS 106 -9.507 -9.578 9.700
767 HD2 LYS 106 1HD LYS 106 -11.608 -9.962 11.233
768 HD3 LYS 106 2HD LYS 106 -10.540 -11.112 12.040
769 HE2 LYS 106 1HE LYS 106 -8.856 -9.089 11.952
770 HE3 LYS 106 2HE LYS 106 -10.341 -8.147 11.830
771 HZ1 LYS 106 1HZ LYS 106 -10.910 -8.605 13.944
772 HZ2 LYS 106 2HZ LYS 106 -9.250 -8.863 14.141
773 HZ3 LYS 106 3HZ LYS 106 -10.288 -10.178 13.907
774 H ALA 107 H ALA 107 -11.033 -14.255 9.048
775 HA ALA 107 HA ALA 107 -12.172 -15.348 6.692
776 HB1 ALA 107 1HB ALA 107 -11.635 -16.229 9.315
777 HB2 ALA 107 2HB ALA 107 -13.355 -16.493 9.025
778 HB3 ALA 107 3HB ALA 107 -12.159 -17.188 7.930
779 H ARG 108 H ARG 108 -14.210 -15.294 5.899
780 HA ARG 108 HA ARG 108 -16.014 -13.316 7.028
781 HB2 ARG 108 1HB ARG 108 -17.308 -13.646 4.954
782 HB3 ARG 108 2HB ARG 108 -15.623 -13.261 4.630
783 HG2 ARG 108 1HG ARG 108 -15.886 -14.962 3.159
784 HG3 ARG 108 2HG ARG 108 -15.422 -15.904 4.578
785 HD2 ARG 108 1HD ARG 108 -17.909 -16.079 5.079
786 HD3 ARG 108 2HD ARG 108 -18.173 -15.459 3.449
787 HE ARG 108 HE ARG 108 -17.453 -18.109 4.158
788 HH11 ARG 108 1HH1 ARG 108 -16.933 -15.662 1.737
789 HH12 ARG 108 2HH1 ARG 108 -16.594 -16.798 0.474
790 HH21 ARG 108 1HH2 ARG 108 -17.008 -19.615 2.503
791 HH22 ARG 108 2HH2 ARG 108 -16.638 -19.047 0.911
792 H SER 109 H SER 109 -15.462 -16.371 7.793
793 HA SER 109 HA SER 109 -17.791 -17.824 7.578
794 HB2 SER 109 1HB SER 109 -15.602 -18.605 8.563
795 HB3 SER 109 2HB SER 109 -16.055 -17.778 10.054
796 HG SER 109 HG SER 109 -16.986 -20.142 8.990
797 H GLY 110 H GLY 110 -19.801 -17.573 8.293
798 HA2 GLY 110 1HA GLY 110 -20.734 -16.948 10.752
799 HA3 GLY 110 2HA GLY 110 -20.433 -15.365 10.050
800 HA PRO 111 HA PRO 111 -24.625 -17.252 8.764
801 HB2 PRO 111 1HB PRO 111 -26.243 -15.868 10.449
802 HB3 PRO 111 2HB PRO 111 -25.566 -17.451 10.851
803 HG2 PRO 111 1HG PRO 111 -24.634 -14.728 11.674
804 HG3 PRO 111 2HG PRO 111 -24.775 -16.204 12.647
805 HD2 PRO 111 1HD PRO 111 -22.414 -15.343 11.639
806 HD3 PRO 111 2HD PRO 111 -22.789 -17.065 11.857
807 H SER 112 H SER 112 -26.403 -16.031 7.775
808 HA SER 112 HA SER 112 -25.834 -13.193 7.315
809 HB2 SER 112 1HB SER 112 -24.769 -14.300 5.447
810 HB3 SER 112 2HB SER 112 -26.212 -15.268 5.145
811 HG SER 112 HG SER 112 -27.184 -13.579 4.259
812 H SER 113 H SER 113 -27.614 -12.226 8.033
813 HA SER 113 HA SER 113 -30.223 -13.473 7.528
814 HB2 SER 113 1HB SER 113 -29.342 -12.613 9.870
815 HB3 SER 113 2HB SER 113 -29.913 -11.059 9.265
816 HG SER 113 HG SER 113 -31.854 -11.691 9.711
817 H GLY 114 H GLY 114 -31.017 -12.846 5.614
818 HA2 GLY 114 1HA GLY 114 -31.666 -11.494 3.870
819 HA3 GLY 114 2HA GLY 114 -32.060 -10.344 5.139
Start of MODEL 4
1 H1 GLY 1 H GLY 1 13.535 19.086 -22.555
2 HA2 GLY 1 1HA GLY 1 13.217 16.399 -21.717
3 HA3 GLY 1 2HA GLY 1 14.539 16.509 -22.869
4 H SER 2 H SER 2 13.338 18.068 -19.903
5 HA SER 2 HA SER 2 15.655 19.361 -19.135
6 HB2 SER 2 1HB SER 2 13.676 19.815 -17.904
7 HB3 SER 2 2HB SER 2 13.447 18.114 -17.498
8 HG SER 2 HG SER 2 15.773 19.454 -16.666
9 H SER 3 H SER 3 17.509 18.808 -18.096
10 HA SER 3 HA SER 3 18.685 16.373 -18.419
11 HB2 SER 3 1HB SER 3 19.594 18.671 -17.463
12 HB3 SER 3 2HB SER 3 19.346 17.865 -15.914
13 HG SER 3 HG SER 3 21.051 17.135 -18.040
14 H GLY 4 H GLY 4 17.123 17.484 -15.407
15 HA2 GLY 4 1HA GLY 4 16.240 14.767 -14.871
16 HA3 GLY 4 2HA GLY 4 17.401 15.422 -13.726
17 H SER 5 H SER 5 15.796 15.201 -12.083
18 HA SER 5 HA SER 5 14.341 17.578 -11.604
19 HB2 SER 5 1HB SER 5 12.867 16.369 -13.307
20 HB3 SER 5 2HB SER 5 12.562 15.179 -12.042
21 HG SER 5 HG SER 5 11.760 17.853 -12.213
22 H SER 6 H SER 6 14.057 17.819 -9.467
23 HA SER 6 HA SER 6 15.100 15.900 -7.673
24 HB2 SER 6 1HB SER 6 13.347 18.275 -7.007
25 HB3 SER 6 2HB SER 6 14.447 17.435 -5.914
26 HG SER 6 HG SER 6 15.742 18.984 -6.568
27 H GLY 7 H GLY 7 14.104 13.986 -7.440
28 HA2 GLY 7 1HA GLY 7 11.315 14.035 -6.512
29 HA3 GLY 7 2HA GLY 7 11.751 12.972 -7.842
30 HA PRO 8 HA PRO 8 12.651 11.150 -3.490
31 HB2 PRO 8 1HB PRO 8 10.340 9.797 -3.041
32 HB3 PRO 8 2HB PRO 8 10.607 11.454 -2.485
33 HG2 PRO 8 1HG PRO 8 9.128 10.482 -4.899
34 HG3 PRO 8 2HG PRO 8 8.681 11.757 -3.751
35 HD2 PRO 8 1HD PRO 8 9.770 12.292 -6.172
36 HD3 PRO 8 2HD PRO 8 10.060 13.312 -4.748
37 H VAL 9 H VAL 9 13.591 9.183 -3.435
38 HA VAL 9 HA VAL 9 12.812 7.222 -5.495
39 HB VAL 9 HB VAL 9 15.176 6.510 -5.611
40 HG11 VAL 9 1HG1 VAL 9 14.096 8.273 -7.120
41 HG12 VAL 9 2HG1 VAL 9 15.039 9.449 -6.204
42 HG13 VAL 9 3HG1 VAL 9 15.857 8.174 -7.108
43 HG21 VAL 9 1HG2 VAL 9 16.896 8.099 -4.714
44 HG22 VAL 9 2HG2 VAL 9 15.605 8.885 -3.806
45 HG23 VAL 9 3HG2 VAL 9 16.009 7.199 -3.483
46 H ALA 10 H ALA 10 14.220 7.731 -2.293
47 HA ALA 10 HA ALA 10 14.631 5.165 -1.433
48 HB1 ALA 10 1HB ALA 10 13.360 7.268 0.303
49 HB2 ALA 10 2HB ALA 10 14.436 5.958 0.790
50 HB3 ALA 10 3HB ALA 10 15.060 7.302 -0.167
51 H GLY 11 H GLY 11 11.566 6.877 -1.730
52 HA2 GLY 11 1HA GLY 11 9.399 6.121 -1.681
53 HA3 GLY 11 2HA GLY 11 10.054 4.520 -1.989
54 HA PRO 12 HA PRO 12 8.350 5.075 2.441
55 HB2 PRO 12 1HB PRO 12 5.929 3.889 2.123
56 HB3 PRO 12 2HB PRO 12 6.182 5.626 1.920
57 HG2 PRO 12 1HG PRO 12 5.999 3.483 -0.162
58 HG3 PRO 12 2HG PRO 12 5.277 5.103 -0.157
59 HD2 PRO 12 1HD PRO 12 7.533 4.517 -1.536
60 HD3 PRO 12 2HD PRO 12 7.238 6.116 -0.822
61 H TYR 13 H TYR 13 8.010 3.331 3.939
62 HA TYR 13 HA TYR 13 8.541 0.653 2.842
63 HB2 TYR 13 1HB TYR 13 10.656 1.320 3.670
64 HB3 TYR 13 2HB TYR 13 9.953 2.050 5.108
65 HD1 TYR 13 1HD TYR 13 10.591 -1.204 3.442
66 HD2 TYR 13 2HD TYR 13 9.685 0.800 7.084
67 HE1 TYR 13 1HE TYR 13 10.974 -3.294 4.681
68 HE2 TYR 13 2HE TYR 13 10.066 -1.284 8.333
69 HH TYR 13 HH TYR 13 9.921 -4.045 7.390
70 H ILE 14 H ILE 14 6.945 -0.667 3.373
71 HA ILE 14 HA ILE 14 5.038 -0.043 5.398
72 HB ILE 14 HB ILE 14 5.427 -2.647 3.918
73 HG12 ILE 14 1HG1 ILE 14 3.376 -0.549 3.266
74 HG13 ILE 14 2HG1 ILE 14 5.000 -0.453 2.594
75 HG21 ILE 14 1HG2 ILE 14 4.088 -2.908 5.928
76 HG22 ILE 14 2HG2 ILE 14 3.057 -1.564 5.436
77 HG23 ILE 14 3HG2 ILE 14 3.075 -3.054 4.491
78 HD11 ILE 14 1HD1 ILE 14 3.838 -3.084 2.266
79 HD12 ILE 14 2HD1 ILE 14 2.861 -1.815 1.526
80 HD13 ILE 14 3HD1 ILE 14 4.555 -2.002 1.072
81 H THR 15 H THR 15 5.147 -0.454 7.497
82 HA THR 15 HA THR 15 6.884 -2.650 8.420
83 HB THR 15 HB THR 15 8.136 -0.954 9.269
84 HG1 THR 15 1HG THR 15 6.027 -0.897 11.186
85 HG21 THR 15 1HG2 THR 15 7.174 0.949 8.344
86 HG22 THR 15 2HG2 THR 15 6.990 1.235 10.075
87 HG23 THR 15 3HG2 THR 15 5.619 0.664 9.124
88 H PHE 16 H PHE 16 3.786 -1.605 8.174
89 HA PHE 16 HA PHE 16 2.940 -3.315 10.389
90 HB2 PHE 16 1HB PHE 16 2.921 -0.793 10.994
91 HB3 PHE 16 2HB PHE 16 1.525 -0.704 9.925
92 HD1 PHE 16 2HD PHE 16 -0.548 -1.878 10.489
93 HD2 PHE 16 1HD PHE 16 2.784 -1.835 13.137
94 HE1 PHE 16 2HE PHE 16 -2.005 -2.620 12.327
95 HE2 PHE 16 1HE PHE 16 1.332 -2.578 14.980
96 HZ PHE 16 HZ PHE 16 -1.065 -2.970 14.577
97 H THR 17 H THR 17 1.621 -4.805 9.606
98 HA THR 17 HA THR 17 -0.328 -4.060 7.547
99 HB THR 17 HB THR 17 0.175 -6.468 6.597
100 HG1 THR 17 1HG THR 17 2.297 -7.080 6.845
101 HG21 THR 17 1HG2 THR 17 0.751 -3.893 5.794
102 HG22 THR 17 2HG2 THR 17 0.921 -5.345 4.807
103 HG23 THR 17 3HG2 THR 17 2.311 -4.707 5.683
104 H ASP 18 H ASP 18 -2.257 -4.497 8.375
105 HA ASP 18 HA ASP 18 -2.728 -7.101 9.603
106 HB2 ASP 18 1HB ASP 18 -2.224 -5.151 11.320
107 HB3 ASP 18 2HB ASP 18 -3.905 -4.736 10.997
108 H ALA 19 H ALA 19 -4.953 -7.721 9.639
109 HA ALA 19 HA ALA 19 -6.484 -6.442 7.507
110 HB1 ALA 19 1HB ALA 19 -6.406 -8.717 7.109
111 HB2 ALA 19 2HB ALA 19 -6.570 -9.127 8.817
112 HB3 ALA 19 3HB ALA 19 -7.964 -8.535 7.914
113 H VAL 20 H VAL 20 -7.898 -4.925 8.049
114 HA VAL 20 HA VAL 20 -8.887 -4.619 10.717
115 HB VAL 20 HB VAL 20 -9.873 -3.220 8.230
116 HG11 VAL 20 1HG1 VAL 20 -11.359 -2.442 9.721
117 HG12 VAL 20 2HG1 VAL 20 -10.393 -2.962 11.104
118 HG13 VAL 20 3HG1 VAL 20 -10.020 -1.444 10.287
119 HG21 VAL 20 1HG2 VAL 20 -7.754 -2.187 10.093
120 HG22 VAL 20 2HG2 VAL 20 -7.359 -3.119 8.649
121 HG23 VAL 20 3HG2 VAL 20 -8.209 -1.581 8.501
122 H ASN 21 H ASN 21 -10.007 -6.182 7.840
123 HA ASN 21 HA ASN 21 -12.169 -7.416 9.241
124 HB2 ASN 21 1HB ASN 21 -12.712 -5.149 7.378
125 HB3 ASN 21 2HB ASN 21 -13.812 -6.524 7.356
126 HD21 ASN 21 1HD2 ASN 21 -14.586 -3.961 8.093
127 HD22 ASN 21 2HD2 ASN 21 -15.008 -3.968 9.768
128 H GLU 22 H GLU 22 -13.582 -8.679 7.548
129 HA GLU 22 HA GLU 22 -11.848 -10.430 6.187
130 HB2 GLU 22 1HB GLU 22 -13.950 -11.395 5.234
131 HB3 GLU 22 2HB GLU 22 -13.951 -11.253 6.987
132 HG2 GLU 22 1HG GLU 22 -15.116 -9.042 5.378
133 HG3 GLU 22 2HG GLU 22 -16.029 -10.539 5.557
134 H THR 23 H THR 23 -13.214 -7.442 5.277
135 HA THR 23 HA THR 23 -12.297 -7.862 2.513
136 HB THR 23 HB THR 23 -14.129 -6.346 1.743
137 HG1 THR 23 1HG THR 23 -15.199 -5.364 3.275
138 HG21 THR 23 1HG2 THR 23 -14.274 -9.090 2.469
139 HG22 THR 23 2HG2 THR 23 -15.138 -8.249 1.182
140 HG23 THR 23 3HG2 THR 23 -15.843 -8.356 2.794
141 H THR 24 H THR 24 -11.347 -6.481 5.114
142 HA THR 24 HA THR 24 -10.477 -4.023 3.772
143 HB THR 24 HB THR 24 -11.137 -3.900 6.691
144 HG1 THR 24 1HG THR 24 -13.237 -3.472 6.266
145 HG21 THR 24 1HG2 THR 24 -9.865 -2.136 5.238
146 HG22 THR 24 2HG2 THR 24 -11.084 -1.607 6.398
147 HG23 THR 24 3HG2 THR 24 -11.484 -1.712 4.684
148 H ILE 25 H ILE 25 -8.443 -3.268 4.384
149 HA ILE 25 HA ILE 25 -6.952 -4.808 6.373
150 HB ILE 25 HB ILE 25 -6.204 -4.567 3.471
151 HG12 ILE 25 1HG1 ILE 25 -6.277 -6.881 5.420
152 HG13 ILE 25 2HG1 ILE 25 -7.450 -6.562 4.147
153 HG21 ILE 25 1HG2 ILE 25 -4.118 -4.086 4.118
154 HG22 ILE 25 2HG2 ILE 25 -4.448 -4.492 5.802
155 HG23 ILE 25 3HG2 ILE 25 -4.046 -5.766 4.650
156 HD11 ILE 25 1HD1 ILE 25 -6.115 -8.211 3.239
157 HD12 ILE 25 2HD1 ILE 25 -5.426 -6.735 2.561
158 HD13 ILE 25 3HD1 ILE 25 -4.637 -7.533 3.921
159 H MET 26 H MET 26 -5.676 -3.556 7.585
160 HA MET 26 HA MET 26 -5.244 -0.784 6.704
161 HB2 MET 26 1HB MET 26 -6.405 -0.702 8.732
162 HB3 MET 26 2HB MET 26 -5.510 -2.056 9.410
163 HG2 MET 26 1HG MET 26 -3.690 -0.759 9.954
164 HG3 MET 26 2HG MET 26 -4.077 0.472 8.754
165 HE1 MET 26 1HE MET 26 -4.193 2.396 9.420
166 HE2 MET 26 2HE MET 26 -5.808 2.935 9.882
167 HE3 MET 26 3HE MET 26 -4.489 2.997 11.052
168 H LEU 27 H LEU 27 -3.253 -0.112 6.244
169 HA LEU 27 HA LEU 27 -0.958 -1.538 7.384
170 HB2 LEU 27 1HB LEU 27 0.067 -1.943 5.368
171 HB3 LEU 27 2HB LEU 27 -1.625 -2.246 4.980
172 HG LEU 27 HG LEU 27 -0.381 0.427 4.434
173 HD11 LEU 27 1HD1 LEU 27 0.783 -0.281 2.672
174 HD12 LEU 27 2HD1 LEU 27 -0.510 -1.356 2.143
175 HD13 LEU 27 3HD1 LEU 27 0.641 -1.897 3.364
176 HD21 LEU 27 1HD2 LEU 27 -2.911 -0.180 4.339
177 HD22 LEU 27 2HD2 LEU 27 -2.477 -0.960 2.817
178 HD23 LEU 27 3HD2 LEU 27 -2.186 0.766 3.038
179 H LYS 28 H LYS 28 0.792 -0.276 7.847
180 HA LYS 28 HA LYS 28 0.557 2.591 7.202
181 HB2 LYS 28 1HB LYS 28 1.659 1.325 9.718
182 HB3 LYS 28 2HB LYS 28 1.688 3.046 9.358
183 HG2 LYS 28 1HG LYS 28 -0.557 3.303 9.721
184 HG3 LYS 28 2HG LYS 28 -0.926 1.625 9.319
185 HD2 LYS 28 1HD LYS 28 -0.089 0.857 11.413
186 HD3 LYS 28 2HD LYS 28 0.603 2.437 11.785
187 HE2 LYS 28 1HE LYS 28 -2.338 1.826 11.502
188 HE3 LYS 28 2HE LYS 28 -1.475 2.024 13.026
189 HZ1 LYS 28 1HZ LYS 28 -0.854 4.286 11.692
190 HZ2 LYS 28 2HZ LYS 28 -2.083 4.149 12.846
191 HZ3 LYS 28 3HZ LYS 28 -2.451 4.022 11.199
192 H TRP 29 H TRP 29 2.299 3.587 6.352
193 HA TRP 29 HA TRP 29 4.747 1.973 6.049
194 HB2 TRP 29 1HB TRP 29 5.158 3.314 3.985
195 HB3 TRP 29 2HB TRP 29 3.696 2.334 3.906
196 HD1 TRP 29 HD TRP 29 4.844 5.981 4.140
197 HE1 TRP 29 1HE TRP 29 2.870 7.504 3.504
198 HE3 TRP 29 3HE TRP 29 1.159 2.450 3.842
199 HZ2 TRP 29 2HZ TRP 29 0.114 7.244 2.950
200 HZ3 TRP 29 3HZ TRP 29 -1.119 3.171 3.253
201 HH2 TRP 29 HH TRP 29 -1.629 5.518 2.817
202 H MET 30 H MET 30 6.776 3.076 6.101
203 HA MET 30 HA MET 30 6.679 5.568 7.668
204 HB2 MET 30 1HB MET 30 8.782 4.926 8.666
205 HB3 MET 30 2HB MET 30 7.636 3.604 8.845
206 HG2 MET 30 1HG MET 30 9.485 2.450 8.196
207 HG3 MET 30 2HG MET 30 8.748 2.761 6.626
208 HE1 MET 30 1HE MET 30 11.092 5.233 8.977
209 HE2 MET 30 2HE MET 30 11.383 3.504 9.165
210 HE3 MET 30 3HE MET 30 12.581 4.518 8.359
211 H TYR 31 H TYR 31 8.766 6.884 7.429
212 HA TYR 31 HA TYR 31 9.724 6.839 4.651
213 HB2 TYR 31 1HB TYR 31 7.910 8.536 4.918
214 HB3 TYR 31 2HB TYR 31 8.901 9.349 6.124
215 HD1 TYR 31 2HD TYR 31 11.204 10.196 5.387
216 HD2 TYR 31 1HD TYR 31 8.167 9.026 2.645
217 HE1 TYR 31 2HE TYR 31 12.321 11.479 3.611
218 HE2 TYR 31 1HE TYR 31 9.277 10.305 0.861
219 HH TYR 31 HH TYR 31 11.591 11.131 0.355
220 H ILE 32 H ILE 32 11.855 7.204 4.405
221 HA ILE 32 HA ILE 32 13.409 7.712 6.842
222 HB ILE 32 HB ILE 32 14.364 6.635 4.187
223 HG12 ILE 32 1HG1 ILE 32 14.627 4.534 5.768
224 HG13 ILE 32 2HG1 ILE 32 13.336 5.322 6.669
225 HG21 ILE 32 1HG2 ILE 32 15.854 7.838 6.112
226 HG22 ILE 32 2HG2 ILE 32 15.925 6.152 6.622
227 HG23 ILE 32 3HG2 ILE 32 16.456 6.607 5.003
228 HD11 ILE 32 1HD1 ILE 32 13.160 4.700 3.736
229 HD12 ILE 32 2HD1 ILE 32 12.598 3.612 5.005
230 HD13 ILE 32 3HD1 ILE 32 11.862 5.203 4.819
231 HA PRO 33 HA PRO 33 13.877 11.796 4.913
232 HB2 PRO 33 1HB PRO 33 14.604 13.028 7.220
233 HB3 PRO 33 2HB PRO 33 12.919 12.707 6.791
234 HG2 PRO 33 1HG PRO 33 14.733 11.178 8.618
235 HG3 PRO 33 2HG PRO 33 13.030 11.618 8.843
236 HD2 PRO 33 1HD PRO 33 13.803 9.150 8.042
237 HD3 PRO 33 2HD PRO 33 12.277 9.890 7.517
238 H ALA 34 H ALA 34 16.065 9.829 6.763
239 HA ALA 34 HA ALA 34 18.389 11.303 6.787
240 HB1 ALA 34 1HB ALA 34 17.951 8.350 6.432
241 HB2 ALA 34 2HB ALA 34 19.559 9.060 6.588
242 HB3 ALA 34 3HB ALA 34 18.391 9.226 7.898
243 H SER 35 H SER 35 17.861 8.758 4.352
244 HA SER 35 HA SER 35 19.617 10.161 2.515
245 HB2 SER 35 1HB SER 35 18.378 7.434 2.604
246 HB3 SER 35 2HB SER 35 18.978 8.060 1.068
247 HG SER 35 HG SER 35 20.616 8.210 3.338
248 H ASN 36 H ASN 36 17.637 11.828 2.756
249 HA ASN 36 HA ASN 36 15.989 11.424 0.349
250 HB2 ASN 36 1HB ASN 36 14.550 11.240 2.297
251 HB3 ASN 36 2HB ASN 36 15.177 12.754 2.942
252 HD21 ASN 36 1HD2 ASN 36 13.389 13.975 2.947
253 HD22 ASN 36 2HD2 ASN 36 12.465 14.371 1.542
254 H ASN 37 H ASN 37 15.237 13.480 -0.637
255 HA ASN 37 HA ASN 37 17.400 15.458 -0.543
256 HB2 ASN 37 1HB ASN 37 16.487 14.220 -2.701
257 HB3 ASN 37 2HB ASN 37 15.284 15.505 -2.651
258 HD21 ASN 37 1HD2 ASN 37 16.081 16.334 -4.601
259 HD22 ASN 37 2HD2 ASN 37 17.551 17.240 -4.663
260 H ASN 38 H ASN 38 14.864 15.152 1.202
261 HA ASN 38 HA ASN 38 13.332 16.498 2.215
262 HB2 ASN 38 1HB ASN 38 15.316 17.737 2.865
263 HB3 ASN 38 2HB ASN 38 15.315 18.604 1.332
264 HD21 ASN 38 1HD2 ASN 38 15.055 20.635 2.078
265 HD22 ASN 38 2HD2 ASN 38 13.661 21.182 2.939
266 H THR 39 H THR 39 12.569 15.761 -0.319
267 HA THR 39 HA THR 39 11.475 18.194 -1.546
268 HB THR 39 HB THR 39 12.727 16.414 -2.920
269 HG1 THR 39 1HG THR 39 11.632 17.188 -4.589
270 HG21 THR 39 1HG2 THR 39 11.553 14.478 -3.603
271 HG22 THR 39 2HG2 THR 39 10.052 15.033 -2.861
272 HG23 THR 39 3HG2 THR 39 11.403 14.527 -1.847
273 HA PRO 40 HA PRO 40 7.475 17.366 0.113
274 HB2 PRO 40 1HB PRO 40 6.001 18.822 -1.642
275 HB3 PRO 40 2HB PRO 40 6.991 19.558 -0.375
276 HG2 PRO 40 1HG PRO 40 7.605 19.184 -3.281
277 HG3 PRO 40 2HG PRO 40 7.893 20.597 -2.250
278 HD2 PRO 40 1HD PRO 40 9.848 18.836 -2.888
279 HD3 PRO 40 2HD PRO 40 9.808 19.697 -1.336
280 H ILE 41 H ILE 41 5.944 15.837 -0.148
281 HA ILE 41 HA ILE 41 5.881 14.413 -2.712
282 HB ILE 41 HB ILE 41 4.675 13.454 -0.125
283 HG12 ILE 41 1HG1 ILE 41 7.489 13.062 -1.162
284 HG13 ILE 41 2HG1 ILE 41 7.016 13.866 0.331
285 HG21 ILE 41 1HG2 ILE 41 4.144 12.464 -2.457
286 HG22 ILE 41 2HG2 ILE 41 5.756 11.759 -2.340
287 HG23 ILE 41 3HG2 ILE 41 4.534 11.370 -1.130
288 HD11 ILE 41 1HD1 ILE 41 5.971 11.194 0.261
289 HD12 ILE 41 2HD1 ILE 41 7.713 11.192 -0.013
290 HD13 ILE 41 3HD1 ILE 41 7.049 11.951 1.433
291 H HIS 42 H HIS 42 4.074 14.254 -3.922
292 HA HIS 42 HA HIS 42 1.922 16.055 -3.424
293 HB2 HIS 42 1HB HIS 42 2.574 14.057 -5.552
294 HB3 HIS 42 2HB HIS 42 0.935 14.694 -5.454
295 HD1 HIS 42 1HD HIS 42 1.590 15.692 -7.877
296 HD2 HIS 42 2HD HIS 42 3.511 17.371 -4.598
297 HE1 HIS 42 1HE HIS 42 2.528 17.878 -8.693
298 HE2 HIS 42 2HE HIS 42 3.758 18.835 -6.715
299 H GLY 43 H GLY 43 2.315 12.548 -3.215
300 HA2 GLY 43 1HA GLY 43 0.290 12.303 -1.239
301 HA3 GLY 43 2HA GLY 43 -0.326 11.795 -2.805
302 H PHE 44 H PHE 44 -0.590 9.694 -1.809
303 HA PHE 44 HA PHE 44 1.868 8.119 -2.025
304 HB2 PHE 44 1HB PHE 44 0.031 8.232 0.347
305 HB3 PHE 44 2HB PHE 44 0.926 6.760 -0.013
306 HD1 PHE 44 2HD PHE 44 3.523 7.391 -0.677
307 HD2 PHE 44 1HD PHE 44 0.969 9.519 1.981
308 HE1 PHE 44 2HE PHE 44 5.493 8.307 0.478
309 HE2 PHE 44 1HE PHE 44 2.935 10.439 3.139
310 HZ PHE 44 HZ PHE 44 5.201 9.832 2.389
311 H TYR 45 H TYR 45 1.561 6.521 -3.416
312 HA TYR 45 HA TYR 45 -1.166 5.694 -4.062
313 HB2 TYR 45 1HB TYR 45 1.473 5.528 -5.457
314 HB3 TYR 45 2HB TYR 45 0.218 4.370 -5.882
315 HD1 TYR 45 2HD TYR 45 -2.219 5.961 -5.763
316 HD2 TYR 45 1HD TYR 45 1.634 7.019 -7.225
317 HE1 TYR 45 2HE TYR 45 -3.249 7.621 -7.258
318 HE2 TYR 45 1HE TYR 45 0.615 8.683 -8.723
319 HH TYR 45 HH TYR 45 -1.929 10.047 -8.499
320 H ILE 46 H ILE 46 -1.909 3.615 -3.872
321 HA ILE 46 HA ILE 46 -0.112 1.656 -2.610
322 HB ILE 46 HB ILE 46 -2.959 2.249 -1.797
323 HG12 ILE 46 1HG1 ILE 46 -0.627 2.233 0.071
324 HG13 ILE 46 2HG1 ILE 46 -0.844 3.623 -0.988
325 HG21 ILE 46 1HG2 ILE 46 -3.044 0.060 -1.331
326 HG22 ILE 46 2HG2 ILE 46 -1.300 -0.137 -1.484
327 HG23 ILE 46 3HG2 ILE 46 -1.990 0.461 0.024
328 HD11 ILE 46 1HD1 ILE 46 -2.640 2.621 1.184
329 HD12 ILE 46 2HD1 ILE 46 -1.922 4.220 0.981
330 HD13 ILE 46 3HD1 ILE 46 -3.232 3.699 -0.079
331 H TYR 47 H TYR 47 0.025 -0.116 -3.801
332 HA TYR 47 HA TYR 47 -2.185 -0.778 -5.620
333 HB2 TYR 47 1HB TYR 47 0.686 -1.730 -5.678
334 HB3 TYR 47 2HB TYR 47 -0.547 -2.089 -6.881
335 HD1 TYR 47 2HD TYR 47 0.981 0.902 -5.230
336 HD2 TYR 47 1HD TYR 47 -0.517 -0.836 -8.813
337 HE1 TYR 47 2HE TYR 47 1.609 2.931 -6.470
338 HE2 TYR 47 1HE TYR 47 0.108 1.188 -10.063
339 HH TYR 47 HH TYR 47 1.578 3.977 -8.425
340 H TYR 48 H TYR 48 -3.026 -2.862 -5.717
341 HA TYR 48 HA TYR 48 -2.073 -4.898 -3.895
342 HB2 TYR 48 1HB TYR 48 -4.462 -5.124 -2.943
343 HB3 TYR 48 2HB TYR 48 -3.431 -3.850 -2.300
344 HD1 TYR 48 2HD TYR 48 -3.705 -1.499 -3.337
345 HD2 TYR 48 1HD TYR 48 -6.579 -4.607 -3.765
346 HE1 TYR 48 2HE TYR 48 -5.424 0.174 -3.884
347 HE2 TYR 48 1HE TYR 48 -8.305 -2.943 -4.314
348 HH TYR 48 HH TYR 48 -8.780 -0.642 -4.098
349 H ARG 49 H ARG 49 -2.866 -6.966 -4.364
350 HA ARG 49 HA ARG 49 -4.921 -7.405 -6.301
351 HB2 ARG 49 1HB ARG 49 -3.598 -8.291 -8.094
352 HB3 ARG 49 2HB ARG 49 -3.012 -6.672 -7.738
353 HG2 ARG 49 1HG ARG 49 -1.022 -7.741 -7.898
354 HG3 ARG 49 2HG ARG 49 -1.342 -8.026 -6.186
355 HD2 ARG 49 1HD ARG 49 -2.386 -10.204 -6.827
356 HD3 ARG 49 2HD ARG 49 -1.837 -9.919 -8.478
357 HE ARG 49 HE ARG 49 -0.267 -10.848 -6.292
358 HH11 ARG 49 1HH1 ARG 49 -0.148 -8.951 -9.208
359 HH12 ARG 49 2HH1 ARG 49 1.542 -9.225 -9.473
360 HH21 ARG 49 1HH2 ARG 49 1.959 -11.216 -6.629
361 HH22 ARG 49 2HH2 ARG 49 2.739 -10.514 -8.006
362 HA PRO 50 HA PRO 50 -4.978 -11.236 -4.136
363 HB2 PRO 50 1HB PRO 50 -6.452 -12.699 -5.885
364 HB3 PRO 50 2HB PRO 50 -7.150 -11.440 -4.859
365 HG2 PRO 50 1HG PRO 50 -6.342 -11.306 -7.739
366 HG3 PRO 50 2HG PRO 50 -7.795 -10.661 -6.953
367 HD2 PRO 50 1HD PRO 50 -5.663 -9.110 -7.573
368 HD3 PRO 50 2HD PRO 50 -6.692 -8.799 -6.160
369 H THR 51 H THR 51 -3.764 -13.051 -4.014
370 HA THR 51 HA THR 51 -1.566 -13.463 -5.637
371 HB THR 51 HB THR 51 -2.193 -14.483 -3.300
372 HG1 THR 51 1HG THR 51 -0.153 -14.740 -4.255
373 HG21 THR 51 1HG2 THR 51 -2.693 -16.946 -4.910
374 HG22 THR 51 2HG2 THR 51 -4.039 -15.856 -4.578
375 HG23 THR 51 3HG2 THR 51 -3.141 -16.580 -3.244
376 H ASP 52 H ASP 52 -4.840 -14.430 -6.130
377 HA ASP 52 HA ASP 52 -4.302 -16.533 -7.996
378 HB2 ASP 52 1HB ASP 52 -6.398 -16.665 -6.919
379 HB3 ASP 52 2HB ASP 52 -6.773 -14.978 -7.259
380 H SER 53 H SER 53 -4.607 -13.084 -8.174
381 HA SER 53 HA SER 53 -5.373 -12.510 -10.699
382 HB2 SER 53 1HB SER 53 -3.183 -11.345 -9.007
383 HB3 SER 53 2HB SER 53 -3.460 -10.733 -10.637
384 HG SER 53 HG SER 53 -4.712 -9.516 -9.289
385 H ASP 54 H ASP 54 -4.108 -12.002 -12.666
386 HA ASP 54 HA ASP 54 -2.391 -14.253 -13.322
387 HB2 ASP 54 1HB ASP 54 -4.343 -13.206 -14.754
388 HB3 ASP 54 2HB ASP 54 -3.076 -12.105 -15.287
389 H ASN 55 H ASN 55 -2.239 -10.720 -13.815
390 HA ASN 55 HA ASN 55 0.604 -10.784 -13.161
391 HB2 ASN 55 1HB ASN 55 1.330 -9.729 -15.155
392 HB3 ASN 55 2HB ASN 55 0.291 -11.052 -15.677
393 HD21 ASN 55 1HD2 ASN 55 -2.007 -10.458 -16.068
394 HD22 ASN 55 2HD2 ASN 55 -2.319 -8.931 -16.815
395 H ASP 56 H ASP 56 1.385 -8.295 -13.565
396 HA ASP 56 HA ASP 56 0.297 -6.814 -11.500
397 HB2 ASP 56 1HB ASP 56 1.491 -5.347 -13.809
398 HB3 ASP 56 2HB ASP 56 1.777 -5.147 -12.082
399 H SER 57 H SER 57 -0.825 -7.183 -14.738
400 HA SER 57 HA SER 57 -2.214 -4.885 -15.266
401 HB2 SER 57 1HB SER 57 -2.070 -6.883 -16.764
402 HB3 SER 57 2HB SER 57 -3.281 -7.676 -15.756
403 HG SER 57 HG SER 57 -3.834 -5.130 -16.786
404 H ASP 58 H ASP 58 -2.787 -7.137 -12.746
405 HA ASP 58 HA ASP 58 -5.520 -6.261 -12.287
406 HB2 ASP 58 1HB ASP 58 -3.818 -8.092 -10.586
407 HB3 ASP 58 2HB ASP 58 -5.567 -7.894 -10.507
408 H TYR 59 H TYR 59 -2.328 -5.929 -10.821
409 HA TYR 59 HA TYR 59 -2.778 -4.803 -8.420
410 HB2 TYR 59 1HB TYR 59 -0.759 -4.259 -10.535
411 HB3 TYR 59 2HB TYR 59 -0.846 -3.123 -9.193
412 HD1 TYR 59 1HD TYR 59 -1.410 -4.821 -6.904
413 HD2 TYR 59 2HD TYR 59 1.152 -5.533 -10.225
414 HE1 TYR 59 1HE TYR 59 -0.055 -6.341 -5.525
415 HE2 TYR 59 2HE TYR 59 2.513 -7.057 -8.856
416 HH TYR 59 HH TYR 59 2.210 -7.253 -5.472
417 H LYS 60 H LYS 60 -3.962 -3.196 -7.649
418 HA LYS 60 HA LYS 60 -5.055 -1.213 -9.488
419 HB2 LYS 60 1HB LYS 60 -5.738 -2.102 -6.704
420 HB3 LYS 60 2HB LYS 60 -6.340 -0.566 -7.316
421 HG2 LYS 60 1HG LYS 60 -7.588 -1.615 -9.015
422 HG3 LYS 60 2HG LYS 60 -6.758 -3.155 -8.779
423 HD2 LYS 60 1HD LYS 60 -7.744 -3.208 -6.464
424 HD3 LYS 60 2HD LYS 60 -8.724 -1.815 -6.928
425 HE2 LYS 60 1HE LYS 60 -9.661 -3.137 -8.789
426 HE3 LYS 60 2HE LYS 60 -8.727 -4.530 -8.245
427 HZ1 LYS 60 1HZ LYS 60 -10.990 -3.199 -6.887
428 HZ2 LYS 60 2HZ LYS 60 -9.926 -4.211 -6.047
429 HZ3 LYS 60 3HZ LYS 60 -10.838 -4.824 -7.333
430 H LYS 61 H LYS 61 -5.475 0.980 -8.060
431 HA LYS 61 HA LYS 61 -3.003 1.790 -6.748
432 HB2 LYS 61 1HB LYS 61 -2.718 2.221 -9.202
433 HB3 LYS 61 2HB LYS 61 -4.089 3.320 -9.117
434 HG2 LYS 61 1HG LYS 61 -2.919 4.835 -7.743
435 HG3 LYS 61 2HG LYS 61 -1.641 3.663 -7.412
436 HD2 LYS 61 1HD LYS 61 -0.726 5.158 -8.986
437 HD3 LYS 61 2HD LYS 61 -1.157 3.716 -9.909
438 HE2 LYS 61 1HE LYS 61 -3.064 4.749 -10.826
439 HE3 LYS 61 2HE LYS 61 -3.014 6.064 -9.653
440 HZ1 LYS 61 1HZ LYS 61 -1.853 7.220 -11.121
441 HZ2 LYS 61 2HZ LYS 61 -1.776 5.907 -12.184
442 HZ3 LYS 61 3HZ LYS 61 -0.589 6.101 -10.994
443 H ASP 62 H ASP 62 -3.539 2.851 -4.968
444 HA ASP 62 HA ASP 62 -6.053 4.390 -4.952
445 HB2 ASP 62 1HB ASP 62 -4.800 2.615 -2.893
446 HB3 ASP 62 2HB ASP 62 -5.795 3.970 -2.366
447 H MET 63 H MET 63 -5.603 6.488 -5.071
448 HA MET 63 HA MET 63 -3.100 7.589 -4.241
449 HB2 MET 63 1HB MET 63 -4.736 8.397 -6.101
450 HB3 MET 63 2HB MET 63 -5.541 9.246 -4.787
451 HG2 MET 63 1HG MET 63 -3.076 10.075 -4.305
452 HG3 MET 63 2HG MET 63 -2.892 9.729 -6.023
453 HE1 MET 63 1HE MET 63 -4.821 11.504 -3.305
454 HE2 MET 63 2HE MET 63 -3.596 12.703 -3.718
455 HE3 MET 63 3HE MET 63 -5.299 13.038 -4.032
456 H VAL 64 H VAL 64 -2.532 8.358 -2.313
457 HA VAL 64 HA VAL 64 -4.660 8.942 -0.358
458 HB VAL 64 HB VAL 64 -1.943 7.841 0.349
459 HG11 VAL 64 1HG1 VAL 64 -4.488 8.262 1.904
460 HG12 VAL 64 2HG1 VAL 64 -3.122 7.316 2.497
461 HG13 VAL 64 3HG1 VAL 64 -2.925 9.037 2.163
462 HG21 VAL 64 1HG2 VAL 64 -3.563 5.798 0.919
463 HG22 VAL 64 2HG2 VAL 64 -4.438 6.463 -0.460
464 HG23 VAL 64 3HG2 VAL 64 -2.756 5.964 -0.640
465 H GLU 65 H GLU 65 -4.097 10.506 1.297
466 HA GLU 65 HA GLU 65 -3.045 12.868 0.298
467 HB2 GLU 65 1HB GLU 65 -2.873 12.351 3.232
468 HB3 GLU 65 2HB GLU 65 -3.435 13.782 2.379
469 HG2 GLU 65 1HG GLU 65 -5.423 12.372 1.653
470 HG3 GLU 65 2HG GLU 65 -4.896 11.210 2.870
471 H GLY 66 H GLY 66 -1.108 14.019 0.736
472 HA2 GLY 66 1HA GLY 66 1.228 12.338 0.709
473 HA3 GLY 66 2HA GLY 66 1.200 14.091 0.580
474 H ASP 67 H ASP 67 -0.578 13.811 3.163
475 HA ASP 67 HA ASP 67 1.729 13.885 4.981
476 HB2 ASP 67 1HB ASP 67 -1.007 15.143 5.113
477 HB3 ASP 67 2HB ASP 67 0.046 15.049 6.523
478 H ARG 68 H ARG 68 -0.718 11.859 4.039
479 HA ARG 68 HA ARG 68 -1.195 10.713 6.677
480 HB2 ARG 68 1HB ARG 68 -2.990 11.028 4.863
481 HB3 ARG 68 2HB ARG 68 -2.248 9.646 4.068
482 HG2 ARG 68 1HG ARG 68 -3.851 8.568 5.256
483 HG3 ARG 68 2HG ARG 68 -2.561 8.563 6.461
484 HD2 ARG 68 1HD ARG 68 -4.443 10.871 6.373
485 HD3 ARG 68 2HD ARG 68 -4.996 9.351 7.073
486 HE ARG 68 HE ARG 68 -2.553 9.897 8.240
487 HH11 ARG 68 1HH1 ARG 68 -5.683 11.409 8.040
488 HH12 ARG 68 2HH1 ARG 68 -5.551 12.184 9.584
489 HH21 ARG 68 1HH2 ARG 68 -2.368 10.912 10.274
490 HH22 ARG 68 2HH2 ARG 68 -3.665 11.901 10.854
491 H TYR 69 H TYR 69 -0.155 8.989 7.443
492 HA TYR 69 HA TYR 69 1.629 7.530 5.614
493 HB2 TYR 69 1HB TYR 69 1.817 8.264 8.505
494 HB3 TYR 69 2HB TYR 69 2.627 6.804 7.950
495 HD1 TYR 69 2HD TYR 69 2.204 10.174 6.390
496 HD2 TYR 69 1HD TYR 69 4.898 7.219 7.844
497 HE1 TYR 69 2HE TYR 69 4.103 11.530 5.611
498 HE2 TYR 69 1HE TYR 69 6.804 8.567 7.070
499 HH TYR 69 HH TYR 69 6.435 11.248 4.993
500 H TRP 70 H TRP 70 -1.321 7.125 6.398
501 HA TRP 70 HA TRP 70 -1.099 4.234 6.673
502 HB2 TRP 70 1HB TRP 70 -2.518 4.030 8.545
503 HB3 TRP 70 2HB TRP 70 -1.391 5.312 8.979
504 HD1 TRP 70 HD TRP 70 -2.374 7.725 9.369
505 HE1 TRP 70 1HE TRP 70 -4.772 8.642 9.555
506 HE3 TRP 70 3HE TRP 70 -4.933 3.675 7.583
507 HZ2 TRP 70 2HZ TRP 70 -7.400 7.764 9.017
508 HZ3 TRP 70 3HZ TRP 70 -7.387 3.794 7.451
509 HH2 TRP 70 HH TRP 70 -8.593 5.797 8.154
510 H HIS 71 H HIS 71 -2.943 3.091 5.939
511 HA HIS 71 HA HIS 71 -5.189 4.562 4.863
512 HB2 HIS 71 1HB HIS 71 -3.531 4.762 3.057
513 HB3 HIS 71 2HB HIS 71 -3.354 3.010 3.024
514 HD1 HIS 71 1HD HIS 71 -6.000 5.653 2.393
515 HD2 HIS 71 2HD HIS 71 -5.090 1.733 1.360
516 HE1 HIS 71 1HE HIS 71 -7.696 5.005 0.652
517 HE2 HIS 71 2HE HIS 71 -7.178 2.602 0.104
518 H SER 72 H SER 72 -6.975 3.255 4.394
519 HA SER 72 HA SER 72 -6.700 0.446 5.245
520 HB2 SER 72 1HB SER 72 -8.994 0.591 6.123
521 HB3 SER 72 2HB SER 72 -7.946 1.786 6.888
522 HG SER 72 HG SER 72 -10.149 2.144 5.302
523 H ILE 73 H ILE 73 -6.728 -0.728 3.431
524 HA ILE 73 HA ILE 73 -8.219 0.036 1.106
525 HB ILE 73 HB ILE 73 -6.952 -2.648 1.644
526 HG12 ILE 73 1HG1 ILE 73 -5.602 -0.424 0.146
527 HG13 ILE 73 2HG1 ILE 73 -5.479 -0.507 1.900
528 HG21 ILE 73 1HG2 ILE 73 -8.375 -2.742 -0.251
529 HG22 ILE 73 2HG2 ILE 73 -7.778 -1.199 -0.860
530 HG23 ILE 73 3HG2 ILE 73 -6.726 -2.614 -0.863
531 HD11 ILE 73 1HD1 ILE 73 -3.571 -1.584 1.100
532 HD12 ILE 73 2HD1 ILE 73 -4.662 -2.892 1.557
533 HD13 ILE 73 3HD1 ILE 73 -4.473 -2.455 -0.140
534 H SER 74 H SER 74 -9.999 -1.018 0.189
535 HA SER 74 HA SER 74 -11.440 -2.910 1.912
536 HB2 SER 74 1HB SER 74 -12.837 -0.621 0.524
537 HB3 SER 74 2HB SER 74 -13.496 -1.720 1.736
538 HG SER 74 HG SER 74 -11.524 0.284 2.110
539 H HIS 75 H HIS 75 -13.572 -3.551 0.565
540 HA HIS 75 HA HIS 75 -14.378 -4.770 -1.178
541 HB2 HIS 75 1HB HIS 75 -12.653 -2.808 -2.689
542 HB3 HIS 75 2HB HIS 75 -13.672 -3.997 -3.494
543 HD1 HIS 75 1HD HIS 75 -15.891 -3.129 -4.124
544 HD2 HIS 75 2HD HIS 75 -14.350 -1.148 -0.813
545 HE1 HIS 75 1HE HIS 75 -17.584 -1.361 -3.550
546 HE2 HIS 75 2HE HIS 75 -16.590 -0.120 -1.597
547 H LEU 76 H LEU 76 -12.445 -6.051 0.196
548 HA LEU 76 HA LEU 76 -10.754 -7.293 -1.870
549 HB2 LEU 76 1HB LEU 76 -10.335 -7.424 1.106
550 HB3 LEU 76 2HB LEU 76 -9.214 -7.916 -0.162
551 HG LEU 76 HG LEU 76 -10.057 -5.054 0.060
552 HD11 LEU 76 1HD1 LEU 76 -7.563 -5.769 1.421
553 HD12 LEU 76 2HD1 LEU 76 -9.029 -6.308 2.240
554 HD13 LEU 76 3HD1 LEU 76 -8.808 -4.600 1.863
555 HD21 LEU 76 1HD2 LEU 76 -7.774 -6.598 -1.102
556 HD22 LEU 76 2HD2 LEU 76 -7.586 -4.890 -0.704
557 HD23 LEU 76 3HD2 LEU 76 -8.816 -5.396 -1.864
558 H GLN 77 H GLN 77 -10.097 -9.644 -0.870
559 HA GLN 77 HA GLN 77 -12.667 -11.041 -0.667
560 HB2 GLN 77 1HB GLN 77 -9.981 -12.278 -1.257
561 HB3 GLN 77 2HB GLN 77 -11.573 -12.971 -1.537
562 HG2 GLN 77 1HG GLN 77 -10.680 -12.292 -3.634
563 HG3 GLN 77 2HG GLN 77 -11.988 -11.187 -3.215
564 HE21 GLN 77 1HE2 GLN 77 -8.601 -11.328 -2.190
565 HE22 GLN 77 2HE2 GLN 77 -8.194 -9.735 -2.719
566 HA PRO 78 HA PRO 78 -11.939 -12.125 3.537
567 HB2 PRO 78 1HB PRO 78 -13.525 -14.324 3.688
568 HB3 PRO 78 2HB PRO 78 -14.168 -12.679 3.621
569 HG2 PRO 78 1HG PRO 78 -13.884 -14.694 1.425
570 HG3 PRO 78 2HG PRO 78 -15.242 -13.610 1.781
571 HD2 PRO 78 1HD PRO 78 -13.428 -13.084 -0.159
572 HD3 PRO 78 2HD PRO 78 -14.227 -11.802 0.774
573 H GLU 79 H GLU 79 -10.739 -13.537 4.788
574 HA GLU 79 HA GLU 79 -8.841 -14.843 5.019
575 HB2 GLU 79 1HB GLU 79 -9.585 -17.319 4.403
576 HB3 GLU 79 2HB GLU 79 -10.225 -16.478 5.808
577 HG2 GLU 79 1HG GLU 79 -12.247 -15.955 4.680
578 HG3 GLU 79 2HG GLU 79 -11.595 -16.499 3.135
579 H THR 80 H THR 80 -8.603 -13.479 2.630
580 HA THR 80 HA THR 80 -7.521 -15.521 0.799
581 HB THR 80 HB THR 80 -8.462 -12.721 0.146
582 HG1 THR 80 1HG THR 80 -10.222 -14.068 0.375
583 HG21 THR 80 1HG2 THR 80 -7.692 -14.806 -1.866
584 HG22 THR 80 2HG2 THR 80 -6.471 -13.745 -1.162
585 HG23 THR 80 3HG2 THR 80 -7.821 -13.059 -2.066
586 H SER 81 H SER 81 -5.418 -15.708 1.330
587 HA SER 81 HA SER 81 -3.826 -13.490 2.191
588 HB2 SER 81 1HB SER 81 -3.584 -16.086 2.663
589 HB3 SER 81 2HB SER 81 -2.577 -16.025 1.216
590 HG SER 81 HG SER 81 -1.674 -14.063 2.510
591 H TYR 82 H TYR 82 -3.299 -11.933 0.802
592 HA TYR 82 HA TYR 82 -2.116 -12.718 -1.770
593 HB2 TYR 82 1HB TYR 82 -3.216 -10.630 -2.739
594 HB3 TYR 82 2HB TYR 82 -4.273 -12.002 -2.427
595 HD1 TYR 82 1HD TYR 82 -3.068 -8.856 -0.820
596 HD2 TYR 82 2HD TYR 82 -6.234 -11.667 -1.237
597 HE1 TYR 82 1HE TYR 82 -4.517 -7.417 0.551
598 HE2 TYR 82 2HE TYR 82 -7.693 -10.236 0.133
599 HH TYR 82 HH TYR 82 -7.819 -8.408 1.394
600 H ASP 83 H ASP 83 -0.684 -11.109 -2.690
601 HA ASP 83 HA ASP 83 0.959 -9.889 -0.686
602 HB2 ASP 83 1HB ASP 83 2.131 -8.995 -2.865
603 HB3 ASP 83 2HB ASP 83 2.250 -10.696 -2.423
604 H ILE 84 H ILE 84 1.536 -7.658 -0.568
605 HA ILE 84 HA ILE 84 -0.244 -5.754 -1.880
606 HB ILE 84 HB ILE 84 0.065 -5.884 1.122
607 HG12 ILE 84 1HG1 ILE 84 -2.506 -6.047 -0.431
608 HG13 ILE 84 2HG1 ILE 84 -1.549 -7.488 -0.108
609 HG21 ILE 84 1HG2 ILE 84 -1.216 -3.851 -0.682
610 HG22 ILE 84 2HG2 ILE 84 -1.620 -3.994 1.027
611 HG23 ILE 84 3HG2 ILE 84 0.028 -3.599 0.542
612 HD11 ILE 84 1HD1 ILE 84 -1.705 -6.408 2.367
613 HD12 ILE 84 2HD1 ILE 84 -3.251 -5.913 1.676
614 HD13 ILE 84 3HD1 ILE 84 -2.814 -7.621 1.728
615 H LYS 85 H LYS 85 0.734 -3.872 -2.369
616 HA LYS 85 HA LYS 85 3.148 -3.063 -0.957
617 HB2 LYS 85 1HB LYS 85 4.503 -2.892 -2.938
618 HB3 LYS 85 2HB LYS 85 3.898 -4.539 -2.819
619 HG2 LYS 85 1HG LYS 85 2.325 -4.187 -4.548
620 HG3 LYS 85 2HG LYS 85 2.580 -2.440 -4.519
621 HD2 LYS 85 1HD LYS 85 4.591 -2.579 -5.630
622 HD3 LYS 85 2HD LYS 85 4.897 -4.231 -5.088
623 HE2 LYS 85 1HE LYS 85 4.366 -4.620 -7.278
624 HE3 LYS 85 2HE LYS 85 2.767 -4.746 -6.548
625 HZ1 LYS 85 1HZ LYS 85 2.064 -3.031 -7.737
626 HZ2 LYS 85 2HZ LYS 85 3.524 -3.064 -8.590
627 HZ3 LYS 85 3HZ LYS 85 3.355 -2.057 -7.241
628 H MET 86 H MET 86 3.931 -0.893 -1.799
629 HA MET 86 HA MET 86 1.904 0.720 -3.105
630 HB2 MET 86 1HB MET 86 1.886 2.396 -1.265
631 HB3 MET 86 2HB MET 86 1.148 0.863 -0.823
632 HG2 MET 86 1HG MET 86 2.928 0.261 0.550
633 HG3 MET 86 2HG MET 86 4.013 1.438 -0.186
634 HE1 MET 86 1HE MET 86 3.258 3.971 -0.269
635 HE2 MET 86 2HE MET 86 1.513 4.003 -0.020
636 HE3 MET 86 3HE MET 86 2.583 4.806 1.130
637 H GLN 87 H GLN 87 2.707 3.079 -3.230
638 HA GLN 87 HA GLN 87 5.550 3.467 -3.078
639 HB2 GLN 87 1HB GLN 87 5.825 2.417 -5.104
640 HB3 GLN 87 2HB GLN 87 4.214 2.843 -5.666
641 HG2 GLN 87 1HG GLN 87 6.186 5.028 -5.288
642 HG3 GLN 87 2HG GLN 87 6.382 3.952 -6.670
643 HE21 GLN 87 1HE2 GLN 87 4.644 3.794 -8.184
644 HE22 GLN 87 2HE2 GLN 87 3.548 5.114 -8.391
645 H CYS 88 H CYS 88 6.133 5.618 -3.190
646 HA CYS 88 HA CYS 88 3.891 7.501 -3.174
647 HB2 CYS 88 1HB CYS 88 5.161 8.888 -1.808
648 HB3 CYS 88 2HB CYS 88 5.680 7.288 -1.293
649 HG CYS 88 HG CYS 88 7.480 9.766 -2.461
650 H PHE 89 H PHE 89 4.382 9.721 -4.061
651 HA PHE 89 HA PHE 89 6.262 9.802 -6.265
652 HB2 PHE 89 1HB PHE 89 4.562 10.353 -7.948
653 HB3 PHE 89 2HB PHE 89 4.304 8.740 -7.293
654 HD1 PHE 89 1HD PHE 89 2.672 8.686 -5.198
655 HD2 PHE 89 2HD PHE 89 2.738 11.719 -8.183
656 HE1 PHE 89 1HE PHE 89 0.352 9.283 -4.637
657 HE2 PHE 89 2HE PHE 89 0.419 12.322 -7.627
658 HZ PHE 89 HZ PHE 89 -0.777 11.104 -5.852
659 H ASN 90 H ASN 90 6.346 11.957 -7.283
660 HA ASN 90 HA ASN 90 5.107 14.125 -5.791
661 HB2 ASN 90 1HB ASN 90 7.007 14.023 -4.446
662 HB3 ASN 90 2HB ASN 90 8.048 13.537 -5.781
663 HD21 ASN 90 1HD2 ASN 90 9.394 15.035 -6.438
664 HD22 ASN 90 2HD2 ASN 90 9.148 16.743 -6.347
665 H GLU 91 H GLU 91 5.676 16.280 -6.783
666 HA GLU 91 HA GLU 91 4.923 16.487 -9.372
667 HB2 GLU 91 1HB GLU 91 5.122 18.450 -7.997
668 HB3 GLU 91 2HB GLU 91 6.864 18.249 -7.874
669 HG2 GLU 91 1HG GLU 91 6.680 19.926 -9.431
670 HG3 GLU 91 2HG GLU 91 6.827 18.495 -10.450
671 H GLY 92 H GLY 92 8.124 15.701 -8.201
672 HA2 GLY 92 1HA GLY 92 9.462 16.048 -10.702
673 HA3 GLY 92 2HA GLY 92 10.085 15.191 -9.300
674 H GLY 93 H GLY 93 8.471 13.116 -8.920
675 HA2 GLY 93 1HA GLY 93 7.446 11.721 -11.078
676 HA3 GLY 93 2HA GLY 93 9.167 11.364 -11.054
677 H GLU 94 H GLU 94 7.067 9.473 -10.682
678 HA GLU 94 HA GLU 94 6.502 8.857 -8.025
679 HB2 GLU 94 1HB GLU 94 6.600 7.312 -10.567
680 HB3 GLU 94 2HB GLU 94 6.544 6.400 -9.065
681 HG2 GLU 94 1HG GLU 94 4.427 7.073 -8.567
682 HG3 GLU 94 2HG GLU 94 4.590 8.602 -9.429
683 H SER 95 H SER 95 7.397 7.245 -6.622
684 HA SER 95 HA SER 95 10.315 7.187 -6.760
685 HB2 SER 95 1HB SER 95 10.280 6.668 -4.416
686 HB3 SER 95 2HB SER 95 9.115 7.965 -4.682
687 HG SER 95 HG SER 95 7.481 6.597 -4.341
688 H GLU 96 H GLU 96 11.103 5.038 -5.458
689 HA GLU 96 HA GLU 96 10.734 2.931 -7.321
690 HB2 GLU 96 1HB GLU 96 12.054 2.966 -4.603
691 HB3 GLU 96 2HB GLU 96 12.118 1.606 -5.714
692 HG2 GLU 96 1HG GLU 96 13.047 4.330 -6.537
693 HG3 GLU 96 2HG GLU 96 14.098 3.224 -5.654
694 H PHE 97 H PHE 97 10.161 0.672 -6.613
695 HA PHE 97 HA PHE 97 7.524 0.718 -5.468
696 HB2 PHE 97 1HB PHE 97 9.258 -1.440 -6.648
697 HB3 PHE 97 2HB PHE 97 7.734 -1.824 -5.855
698 HD1 PHE 97 1HD PHE 97 8.733 0.944 -8.144
699 HD2 PHE 97 2HD PHE 97 6.196 -2.405 -7.460
700 HE1 PHE 97 1HE PHE 97 7.528 1.434 -10.233
701 HE2 PHE 97 2HE PHE 97 4.989 -1.921 -9.548
702 HZ PHE 97 HZ PHE 97 5.654 0.000 -10.938
703 H SER 98 H SER 98 7.043 0.480 -3.396
704 HA SER 98 HA SER 98 8.943 0.111 -1.380
705 HB2 SER 98 1HB SER 98 7.141 0.131 0.148
706 HB3 SER 98 2HB SER 98 6.584 1.115 -1.206
707 HG SER 98 HG SER 98 5.806 -1.202 -1.888
708 H ASN 99 H ASN 99 8.225 -1.712 0.406
709 HA ASN 99 HA ASN 99 9.163 -4.159 -0.746
710 HB2 ASN 99 1HB ASN 99 8.970 -5.039 1.568
711 HB3 ASN 99 2HB ASN 99 9.881 -3.533 1.487
712 HD21 ASN 99 1HD2 ASN 99 8.682 -4.559 3.808
713 HD22 ASN 99 2HD2 ASN 99 7.446 -3.459 4.306
714 H VAL 100 H VAL 100 8.017 -6.265 -0.017
715 HA VAL 100 HA VAL 100 5.185 -6.024 -0.784
716 HB VAL 100 HB VAL 100 6.963 -8.457 -1.001
717 HG11 VAL 100 1HG1 VAL 100 4.365 -8.609 -0.772
718 HG12 VAL 100 2HG1 VAL 100 4.384 -8.086 -2.457
719 HG13 VAL 100 3HG1 VAL 100 5.206 -9.573 -1.985
720 HG21 VAL 100 1HG2 VAL 100 6.159 -6.398 -3.046
721 HG22 VAL 100 2HG2 VAL 100 7.789 -6.848 -2.546
722 HG23 VAL 100 3HG2 VAL 100 6.805 -7.984 -3.468
723 H MET 101 H MET 101 3.794 -6.255 0.828
724 HA MET 101 HA MET 101 4.508 -8.042 3.060
725 HB2 MET 101 1HB MET 101 2.741 -5.590 3.060
726 HB3 MET 101 2HB MET 101 2.956 -6.664 4.435
727 HG2 MET 101 1HG MET 101 5.137 -5.071 3.108
728 HG3 MET 101 2HG MET 101 4.317 -4.640 4.606
729 HE1 MET 101 1HE MET 101 5.471 -5.066 6.820
730 HE2 MET 101 2HE MET 101 4.261 -6.344 6.703
731 HE3 MET 101 3HE MET 101 5.885 -6.717 7.282
732 H ILE 102 H ILE 102 3.289 -9.789 3.336
733 HA ILE 102 HA ILE 102 0.836 -10.051 1.769
734 HB ILE 102 HB ILE 102 2.396 -12.135 3.300
735 HG12 ILE 102 1HG1 ILE 102 2.121 -11.816 0.310
736 HG13 ILE 102 2HG1 ILE 102 3.457 -11.124 1.224
737 HG21 ILE 102 1HG2 ILE 102 0.801 -13.649 2.863
738 HG22 ILE 102 2HG2 ILE 102 -0.249 -12.247 2.672
739 HG23 ILE 102 3HG2 ILE 102 0.485 -12.998 1.255
740 HD11 ILE 102 1HD1 ILE 102 4.533 -13.036 0.982
741 HD12 ILE 102 2HD1 ILE 102 3.308 -13.816 1.983
742 HD13 ILE 102 3HD1 ILE 102 3.123 -13.781 0.229
743 H CYS 103 H CYS 103 -0.794 -9.083 2.870
744 HA CYS 103 HA CYS 103 -1.168 -9.775 5.697
745 HB2 CYS 103 1HB CYS 103 -1.148 -7.354 4.979
746 HB3 CYS 103 2HB CYS 103 -2.644 -7.671 4.108
747 HG CYS 103 HG CYS 103 -2.878 -8.688 7.248
748 H GLU 104 H GLU 104 -2.391 -11.512 6.013
749 HA GLU 104 HA GLU 104 -4.361 -12.346 4.077
750 HB2 GLU 104 1HB GLU 104 -2.831 -13.851 5.519
751 HB3 GLU 104 2HB GLU 104 -3.998 -13.560 6.802
752 HG2 GLU 104 1HG GLU 104 -5.700 -14.311 4.922
753 HG3 GLU 104 2HG GLU 104 -4.269 -15.136 4.307
754 H THR 105 H THR 105 -6.399 -11.699 4.047
755 HA THR 105 HA THR 105 -7.519 -9.947 5.926
756 HB THR 105 HB THR 105 -9.738 -10.641 4.806
757 HG1 THR 105 1HG THR 105 -8.886 -11.597 2.597
758 HG21 THR 105 1HG2 THR 105 -9.262 -9.303 2.862
759 HG22 THR 105 2HG2 THR 105 -7.532 -9.611 3.020
760 HG23 THR 105 3HG2 THR 105 -8.370 -8.638 4.229
761 H LYS 106 H LYS 106 -9.842 -10.538 6.838
762 HA LYS 106 HA LYS 106 -9.385 -12.737 8.695
763 HB2 LYS 106 1HB LYS 106 -11.422 -10.509 8.623
764 HB3 LYS 106 2HB LYS 106 -11.441 -11.793 9.825
765 HG2 LYS 106 1HG LYS 106 -8.933 -11.007 10.160
766 HG3 LYS 106 2HG LYS 106 -9.591 -9.498 9.524
767 HD2 LYS 106 1HD LYS 106 -11.471 -9.895 11.283
768 HD3 LYS 106 2HD LYS 106 -10.285 -10.962 12.039
769 HE2 LYS 106 1HE LYS 106 -9.754 -9.015 13.096
770 HE3 LYS 106 2HE LYS 106 -8.715 -8.860 11.681
771 HZ1 LYS 106 1HZ LYS 106 -10.145 -6.874 12.324
772 HZ2 LYS 106 2HZ LYS 106 -11.453 -7.750 11.707
773 HZ3 LYS 106 3HZ LYS 106 -10.158 -7.341 10.698
774 H ALA 107 H ALA 107 -11.034 -14.305 9.161
775 HA ALA 107 HA ALA 107 -12.250 -15.348 6.786
776 HB1 ALA 107 1HB ALA 107 -12.093 -17.260 7.897
777 HB2 ALA 107 2HB ALA 107 -11.456 -16.373 9.282
778 HB3 ALA 107 3HB ALA 107 -13.190 -16.667 9.144
779 H ARG 108 H ARG 108 -14.230 -14.975 6.042
780 HA ARG 108 HA ARG 108 -16.017 -13.229 7.437
781 HB2 ARG 108 1HB ARG 108 -17.518 -13.639 5.477
782 HB3 ARG 108 2HB ARG 108 -15.914 -13.059 5.049
783 HG2 ARG 108 1HG ARG 108 -15.243 -15.166 4.262
784 HG3 ARG 108 2HG ARG 108 -16.607 -15.977 5.033
785 HD2 ARG 108 1HD ARG 108 -17.178 -13.868 3.017
786 HD3 ARG 108 2HD ARG 108 -16.589 -15.428 2.445
787 HE ARG 108 HE ARG 108 -19.200 -14.853 3.328
788 HH11 ARG 108 1HH1 ARG 108 -16.745 -17.310 3.567
789 HH12 ARG 108 2HH1 ARG 108 -17.877 -18.603 3.795
790 HH21 ARG 108 1HH2 ARG 108 -20.699 -16.546 3.627
791 HH22 ARG 108 2HH2 ARG 108 -20.126 -18.167 3.828
792 H SER 109 H SER 109 -18.079 -13.682 8.236
793 HA SER 109 HA SER 109 -18.429 -16.456 9.106
794 HB2 SER 109 1HB SER 109 -19.568 -13.839 10.088
795 HB3 SER 109 2HB SER 109 -20.172 -15.399 10.645
796 HG SER 109 HG SER 109 -17.625 -14.249 11.014
797 H GLY 110 H GLY 110 -19.669 -17.682 7.853
798 HA2 GLY 110 1HA GLY 110 -22.106 -16.466 6.705
799 HA3 GLY 110 2HA GLY 110 -21.118 -17.609 5.807
800 HA PRO 111 HA PRO 111 -24.580 -19.854 8.014
801 HB2 PRO 111 1HB PRO 111 -25.602 -21.030 5.791
802 HB3 PRO 111 2HB PRO 111 -26.112 -19.434 6.354
803 HG2 PRO 111 1HG PRO 111 -24.165 -20.148 4.195
804 HG3 PRO 111 2HG PRO 111 -25.427 -18.903 4.196
805 HD2 PRO 111 1HD PRO 111 -22.818 -18.333 4.640
806 HD3 PRO 111 2HD PRO 111 -24.137 -17.418 5.398
807 H SER 112 H SER 112 -22.700 -20.997 5.205
808 HA SER 112 HA SER 112 -22.709 -23.686 5.598
809 HB2 SER 112 1HB SER 112 -20.319 -22.003 4.810
810 HB3 SER 112 2HB SER 112 -20.457 -23.744 4.564
811 HG SER 112 HG SER 112 -21.823 -21.647 3.292
812 H SER 113 H SER 113 -20.152 -21.575 6.920
813 HA SER 113 HA SER 113 -20.205 -22.872 9.468
814 HB2 SER 113 1HB SER 113 -17.815 -23.704 9.297
815 HB3 SER 113 2HB SER 113 -19.006 -24.633 8.388
816 HG SER 113 HG SER 113 -17.684 -22.522 7.110
817 H GLY 114 H GLY 114 -19.009 -21.772 11.029
818 HA2 GLY 114 1HA GLY 114 -18.274 -19.069 10.271
819 HA3 GLY 114 2HA GLY 114 -18.383 -19.704 11.906
Start of MODEL 5
1 H1 GLY 1 H GLY 1 21.691 1.007 -15.162
2 HA2 GLY 1 1HA GLY 1 21.569 3.259 -15.956
3 HA3 GLY 1 2HA GLY 1 20.204 2.432 -16.693
4 H SER 2 H SER 2 18.713 4.020 -16.789
5 HA SER 2 HA SER 2 17.179 5.563 -16.120
6 HB2 SER 2 1HB SER 2 17.454 3.861 -13.651
7 HB3 SER 2 2HB SER 2 16.355 5.240 -13.692
8 HG SER 2 HG SER 2 16.224 3.435 -15.809
9 H SER 3 H SER 3 19.807 6.465 -16.121
10 HA SER 3 HA SER 3 20.656 7.718 -13.765
11 HB2 SER 3 1HB SER 3 21.122 8.614 -16.620
12 HB3 SER 3 2HB SER 3 22.063 9.107 -15.213
13 HG SER 3 HG SER 3 21.769 6.387 -15.903
14 H GLY 4 H GLY 4 20.364 9.769 -12.930
15 HA2 GLY 4 1HA GLY 4 19.538 12.045 -13.185
16 HA3 GLY 4 2HA GLY 4 18.252 11.398 -14.194
17 H SER 5 H SER 5 18.832 12.694 -11.275
18 HA SER 5 HA SER 5 17.326 10.984 -9.559
19 HB2 SER 5 1HB SER 5 17.950 13.927 -9.217
20 HB3 SER 5 2HB SER 5 17.440 12.810 -7.951
21 HG SER 5 HG SER 5 19.374 11.706 -8.185
22 H SER 6 H SER 6 15.310 10.550 -10.331
23 HA SER 6 HA SER 6 13.572 12.785 -11.071
24 HB2 SER 6 1HB SER 6 13.507 9.830 -11.542
25 HB3 SER 6 2HB SER 6 11.994 10.734 -11.584
26 HG SER 6 HG SER 6 13.469 12.182 -13.031
27 H GLY 7 H GLY 7 12.823 13.722 -9.241
28 HA2 GLY 7 1HA GLY 7 11.753 13.961 -7.217
29 HA3 GLY 7 2HA GLY 7 10.688 12.712 -7.844
30 HA PRO 8 HA PRO 8 12.473 10.995 -3.986
31 HB2 PRO 8 1HB PRO 8 10.220 9.646 -3.297
32 HB3 PRO 8 2HB PRO 8 10.475 11.352 -2.911
33 HG2 PRO 8 1HG PRO 8 8.903 10.130 -5.146
34 HG3 PRO 8 2HG PRO 8 8.482 11.498 -4.100
35 HD2 PRO 8 1HD PRO 8 9.438 11.826 -6.612
36 HD3 PRO 8 2HD PRO 8 9.772 12.980 -5.305
37 H VAL 9 H VAL 9 13.447 9.051 -3.782
38 HA VAL 9 HA VAL 9 12.623 6.897 -5.618
39 HB VAL 9 HB VAL 9 14.995 6.219 -5.779
40 HG11 VAL 9 1HG1 VAL 9 14.182 7.470 -7.605
41 HG12 VAL 9 2HG1 VAL 9 14.230 8.980 -6.692
42 HG13 VAL 9 3HG1 VAL 9 15.732 8.197 -7.184
43 HG21 VAL 9 1HG2 VAL 9 16.591 8.230 -5.161
44 HG22 VAL 9 2HG2 VAL 9 15.329 8.559 -3.973
45 HG23 VAL 9 3HG2 VAL 9 16.157 7.002 -3.971
46 H ALA 10 H ALA 10 14.206 7.712 -2.559
47 HA ALA 10 HA ALA 10 14.766 5.321 -1.441
48 HB1 ALA 10 1HB ALA 10 13.873 6.363 0.752
49 HB2 ALA 10 2HB ALA 10 15.206 7.153 -0.091
50 HB3 ALA 10 3HB ALA 10 13.567 7.787 -0.243
51 H GLY 11 H GLY 11 11.558 6.622 -2.014
52 HA2 GLY 11 1HA GLY 11 9.476 5.666 -1.876
53 HA3 GLY 11 2HA GLY 11 10.302 4.124 -2.048
54 HA PRO 12 HA PRO 12 8.602 4.982 2.371
55 HB2 PRO 12 1HB PRO 12 6.108 3.927 2.173
56 HB3 PRO 12 2HB PRO 12 6.453 5.638 1.891
57 HG2 PRO 12 1HG PRO 12 6.082 3.429 -0.094
58 HG3 PRO 12 2HG PRO 12 5.454 5.086 -0.135
59 HD2 PRO 12 1HD PRO 12 7.628 4.317 -1.554
60 HD3 PRO 12 2HD PRO 12 7.447 5.957 -0.899
61 H TYR 13 H TYR 13 8.124 3.305 3.942
62 HA TYR 13 HA TYR 13 8.558 0.573 2.937
63 HB2 TYR 13 1HB TYR 13 10.669 1.067 3.805
64 HB3 TYR 13 2HB TYR 13 10.011 2.033 5.121
65 HD1 TYR 13 1HD TYR 13 9.421 -1.475 3.959
66 HD2 TYR 13 2HD TYR 13 10.542 1.097 7.158
67 HE1 TYR 13 1HE TYR 13 9.581 -3.418 5.458
68 HE2 TYR 13 2HE TYR 13 10.706 -0.839 8.665
69 HH TYR 13 HH TYR 13 9.535 -3.948 7.796
70 H ILE 14 H ILE 14 6.955 -0.723 3.505
71 HA ILE 14 HA ILE 14 4.981 0.053 5.418
72 HB ILE 14 HB ILE 14 5.337 -2.656 4.135
73 HG12 ILE 14 1HG1 ILE 14 3.448 -0.547 3.143
74 HG13 ILE 14 2HG1 ILE 14 5.131 -0.528 2.627
75 HG21 ILE 14 1HG2 ILE 14 3.836 -2.688 6.034
76 HG22 ILE 14 2HG2 ILE 14 2.944 -1.313 5.383
77 HG23 ILE 14 3HG2 ILE 14 2.915 -2.862 4.540
78 HD11 ILE 14 1HD1 ILE 14 3.890 -3.146 2.376
79 HD12 ILE 14 2HD1 ILE 14 3.098 -1.896 1.417
80 HD13 ILE 14 3HD1 ILE 14 4.820 -2.210 1.207
81 H THR 15 H THR 15 5.191 -0.118 7.540
82 HA THR 15 HA THR 15 6.765 -2.363 8.627
83 HB THR 15 HB THR 15 7.609 -1.040 10.349
84 HG1 THR 15 1HG THR 15 6.708 1.103 10.753
85 HG21 THR 15 1HG2 THR 15 7.945 -0.166 7.731
86 HG22 THR 15 2HG2 THR 15 8.961 0.240 9.114
87 HG23 THR 15 3HG2 THR 15 7.637 1.307 8.649
88 H PHE 16 H PHE 16 3.778 -1.834 8.053
89 HA PHE 16 HA PHE 16 2.820 -3.186 10.398
90 HB2 PHE 16 1HB PHE 16 2.820 -0.590 10.827
91 HB3 PHE 16 2HB PHE 16 1.375 -0.629 9.822
92 HD1 PHE 16 2HD PHE 16 -0.539 -2.120 10.528
93 HD2 PHE 16 1HD PHE 16 2.735 -1.185 13.082
94 HE1 PHE 16 2HE PHE 16 -1.881 -2.775 12.483
95 HE2 PHE 16 1HE PHE 16 1.398 -1.839 15.041
96 HZ PHE 16 HZ PHE 16 -0.913 -2.635 14.743
97 H THR 17 H THR 17 1.539 -4.704 9.607
98 HA THR 17 HA THR 17 -0.407 -4.008 7.533
99 HB THR 17 HB THR 17 0.196 -6.435 6.611
100 HG1 THR 17 1HG THR 17 1.971 -7.066 7.612
101 HG21 THR 17 1HG2 THR 17 0.381 -3.947 5.631
102 HG22 THR 17 2HG2 THR 17 0.975 -5.363 4.764
103 HG23 THR 17 3HG2 THR 17 2.095 -4.360 5.685
104 H ASP 18 H ASP 18 -2.290 -4.434 8.483
105 HA ASP 18 HA ASP 18 -2.718 -7.096 9.607
106 HB2 ASP 18 1HB ASP 18 -3.145 -4.504 11.079
107 HB3 ASP 18 2HB ASP 18 -4.050 -5.957 11.496
108 H ALA 19 H ALA 19 -4.753 -7.892 9.290
109 HA ALA 19 HA ALA 19 -6.411 -6.462 7.405
110 HB1 ALA 19 1HB ALA 19 -7.712 -8.513 7.292
111 HB2 ALA 19 2HB ALA 19 -5.990 -8.861 7.133
112 HB3 ALA 19 3HB ALA 19 -6.816 -9.175 8.659
113 H VAL 20 H VAL 20 -7.744 -4.942 8.147
114 HA VAL 20 HA VAL 20 -8.715 -4.804 10.798
115 HB VAL 20 HB VAL 20 -9.878 -3.427 8.376
116 HG11 VAL 20 1HG1 VAL 20 -11.329 -3.222 10.259
117 HG12 VAL 20 2HG1 VAL 20 -9.980 -2.832 11.328
118 HG13 VAL 20 3HG1 VAL 20 -10.474 -1.690 10.077
119 HG21 VAL 20 1HG2 VAL 20 -7.358 -3.179 8.754
120 HG22 VAL 20 2HG2 VAL 20 -8.311 -1.702 8.611
121 HG23 VAL 20 3HG2 VAL 20 -7.794 -2.268 10.199
122 H ASN 21 H ASN 21 -9.919 -6.311 7.905
123 HA ASN 21 HA ASN 21 -11.907 -7.744 9.381
124 HB2 ASN 21 1HB ASN 21 -12.686 -5.413 7.702
125 HB3 ASN 21 2HB ASN 21 -13.690 -6.856 7.595
126 HD21 ASN 21 1HD2 ASN 21 -14.541 -4.368 8.588
127 HD22 ASN 21 2HD2 ASN 21 -14.932 -4.564 10.259
128 H GLU 22 H GLU 22 -13.465 -8.808 7.520
129 HA GLU 22 HA GLU 22 -11.678 -10.462 6.031
130 HB2 GLU 22 1HB GLU 22 -13.516 -11.792 5.560
131 HB3 GLU 22 2HB GLU 22 -13.990 -11.040 7.077
132 HG2 GLU 22 1HG GLU 22 -15.114 -9.269 5.557
133 HG3 GLU 22 2HG GLU 22 -14.988 -10.513 4.314
134 H THR 23 H THR 23 -13.098 -7.471 5.420
135 HA THR 23 HA THR 23 -12.456 -7.717 2.562
136 HB THR 23 HB THR 23 -14.382 -6.069 2.161
137 HG1 THR 23 1HG THR 23 -16.107 -6.501 3.796
138 HG21 THR 23 1HG2 THR 23 -14.857 -8.077 1.196
139 HG22 THR 23 2HG2 THR 23 -16.069 -8.120 2.476
140 HG23 THR 23 3HG2 THR 23 -14.545 -8.984 2.675
141 H THR 24 H THR 24 -11.404 -6.429 5.218
142 HA THR 24 HA THR 24 -10.606 -3.921 3.925
143 HB THR 24 HB THR 24 -11.279 -3.968 6.858
144 HG1 THR 24 1HG THR 24 -13.312 -3.996 6.293
145 HG21 THR 24 1HG2 THR 24 -9.814 -2.177 5.739
146 HG22 THR 24 2HG2 THR 24 -11.166 -1.629 6.731
147 HG23 THR 24 3HG2 THR 24 -11.305 -1.629 4.973
148 H ILE 25 H ILE 25 -8.570 -3.141 4.524
149 HA ILE 25 HA ILE 25 -6.999 -4.735 6.404
150 HB ILE 25 HB ILE 25 -6.320 -4.350 3.499
151 HG12 ILE 25 1HG1 ILE 25 -6.320 -6.771 5.316
152 HG13 ILE 25 2HG1 ILE 25 -7.556 -6.382 4.125
153 HG21 ILE 25 1HG2 ILE 25 -4.520 -4.440 5.811
154 HG22 ILE 25 2HG2 ILE 25 -4.130 -5.586 4.529
155 HG23 ILE 25 3HG2 ILE 25 -4.234 -3.863 4.169
156 HD11 ILE 25 1HD1 ILE 25 -6.263 -7.965 3.053
157 HD12 ILE 25 2HD1 ILE 25 -5.614 -6.447 2.432
158 HD13 ILE 25 3HD1 ILE 25 -4.754 -7.321 3.700
159 H MET 26 H MET 26 -5.595 -3.551 7.569
160 HA MET 26 HA MET 26 -5.268 -0.726 6.810
161 HB2 MET 26 1HB MET 26 -6.433 -0.898 8.893
162 HB3 MET 26 2HB MET 26 -5.276 -2.067 9.513
163 HG2 MET 26 1HG MET 26 -4.516 -0.226 10.579
164 HG3 MET 26 2HG MET 26 -3.593 -0.071 9.086
165 HE1 MET 26 1HE MET 26 -3.559 2.566 7.983
166 HE2 MET 26 2HE MET 26 -4.250 1.181 7.137
167 HE3 MET 26 3HE MET 26 -5.112 2.721 7.161
168 H LEU 27 H LEU 27 -3.325 -0.170 6.104
169 HA LEU 27 HA LEU 27 -0.971 -1.554 7.198
170 HB2 LEU 27 1HB LEU 27 -0.044 -1.939 5.144
171 HB3 LEU 27 2HB LEU 27 -1.755 -2.164 4.783
172 HG LEU 27 HG LEU 27 -0.370 0.458 4.299
173 HD11 LEU 27 1HD1 LEU 27 0.441 -0.185 2.280
174 HD12 LEU 27 2HD1 LEU 27 -0.784 -1.434 2.058
175 HD13 LEU 27 3HD1 LEU 27 0.588 -1.726 3.126
176 HD21 LEU 27 1HD2 LEU 27 -2.783 -0.806 3.007
177 HD22 LEU 27 2HD2 LEU 27 -2.189 0.839 2.779
178 HD23 LEU 27 3HD2 LEU 27 -2.852 0.350 4.339
179 H LYS 28 H LYS 28 0.634 -0.260 7.861
180 HA LYS 28 HA LYS 28 0.438 2.605 7.197
181 HB2 LYS 28 1HB LYS 28 1.682 1.403 9.674
182 HB3 LYS 28 2HB LYS 28 1.392 3.108 9.354
183 HG2 LYS 28 1HG LYS 28 -0.880 2.928 9.719
184 HG3 LYS 28 2HG LYS 28 -0.897 1.191 9.405
185 HD2 LYS 28 1HD LYS 28 0.274 0.781 11.497
186 HD3 LYS 28 2HD LYS 28 0.371 2.517 11.803
187 HE2 LYS 28 1HE LYS 28 -2.166 2.526 11.687
188 HE3 LYS 28 2HE LYS 28 -2.076 0.767 11.750
189 HZ1 LYS 28 1HZ LYS 28 -2.239 1.206 13.951
190 HZ2 LYS 28 2HZ LYS 28 -1.520 2.732 13.835
191 HZ3 LYS 28 3HZ LYS 28 -0.558 1.340 13.816
192 H TRP 29 H TRP 29 2.189 3.633 6.394
193 HA TRP 29 HA TRP 29 4.644 2.034 6.076
194 HB2 TRP 29 1HB TRP 29 5.057 3.417 4.032
195 HB3 TRP 29 2HB TRP 29 3.620 2.403 3.927
196 HD1 TRP 29 HD TRP 29 4.673 6.076 4.244
197 HE1 TRP 29 1HE TRP 29 2.672 7.559 3.595
198 HE3 TRP 29 3HE TRP 29 1.091 2.456 3.799
199 HZ2 TRP 29 2HZ TRP 29 -0.064 7.237 2.977
200 HZ3 TRP 29 3HZ TRP 29 -1.193 3.127 3.176
201 HH2 TRP 29 HH TRP 29 -1.756 5.469 2.774
202 H MET 30 H MET 30 6.665 3.162 6.134
203 HA MET 30 HA MET 30 6.539 5.632 7.735
204 HB2 MET 30 1HB MET 30 8.589 4.996 8.787
205 HB3 MET 30 2HB MET 30 7.517 3.603 8.845
206 HG2 MET 30 1HG MET 30 9.492 2.631 8.225
207 HG3 MET 30 2HG MET 30 8.739 2.913 6.658
208 HE1 MET 30 1HE MET 30 12.490 3.947 8.405
209 HE2 MET 30 2HE MET 30 11.675 5.451 8.831
210 HE3 MET 30 3HE MET 30 10.983 3.904 9.320
211 H TYR 31 H TYR 31 8.611 6.972 7.518
212 HA TYR 31 HA TYR 31 9.651 6.935 4.778
213 HB2 TYR 31 1HB TYR 31 7.753 8.521 4.839
214 HB3 TYR 31 2HB TYR 31 8.551 9.406 6.134
215 HD1 TYR 31 2HD TYR 31 10.814 10.466 5.638
216 HD2 TYR 31 1HD TYR 31 8.236 8.991 2.592
217 HE1 TYR 31 2HE TYR 31 12.007 11.831 3.976
218 HE2 TYR 31 1HE TYR 31 9.423 10.351 0.921
219 HH TYR 31 HH TYR 31 11.450 11.481 0.570
220 H ILE 32 H ILE 32 11.754 7.522 4.588
221 HA ILE 32 HA ILE 32 13.172 8.116 7.087
222 HB ILE 32 HB ILE 32 14.242 7.106 4.449
223 HG12 ILE 32 1HG1 ILE 32 14.778 5.122 6.123
224 HG13 ILE 32 2HG1 ILE 32 13.408 5.795 7.000
225 HG21 ILE 32 1HG2 ILE 32 15.547 8.205 6.820
226 HG22 ILE 32 2HG2 ILE 32 16.160 6.624 6.338
227 HG23 ILE 32 3HG2 ILE 32 16.173 7.962 5.190
228 HD11 ILE 32 1HD1 ILE 32 13.342 4.933 4.119
229 HD12 ILE 32 2HD1 ILE 32 12.789 3.961 5.484
230 HD13 ILE 32 3HD1 ILE 32 11.977 5.477 5.095
231 HA PRO 33 HA PRO 33 13.678 12.288 5.619
232 HB2 PRO 33 1HB PRO 33 15.238 13.123 7.678
233 HB3 PRO 33 2HB PRO 33 13.489 12.917 7.821
234 HG2 PRO 33 1HG PRO 33 15.689 11.075 8.673
235 HG3 PRO 33 2HG PRO 33 14.204 11.517 9.534
236 HD2 PRO 33 1HD PRO 33 14.464 9.186 8.181
237 HD3 PRO 33 2HD PRO 33 12.913 10.038 8.326
238 H ALA 34 H ALA 34 15.970 9.840 5.793
239 HA ALA 34 HA ALA 34 18.121 11.575 4.784
240 HB1 ALA 34 1HB ALA 34 18.241 9.696 6.748
241 HB2 ALA 34 2HB ALA 34 18.784 8.776 5.344
242 HB3 ALA 34 3HB ALA 34 19.622 10.258 5.805
243 H SER 35 H SER 35 19.646 9.999 3.317
244 HA SER 35 HA SER 35 19.827 9.459 1.086
245 HB2 SER 35 1HB SER 35 18.046 7.357 2.303
246 HB3 SER 35 2HB SER 35 18.584 7.246 0.627
247 HG SER 35 HG SER 35 20.067 6.158 1.858
248 H ASN 36 H ASN 36 18.065 11.557 1.307
249 HA ASN 36 HA ASN 36 16.353 11.068 -0.990
250 HB2 ASN 36 1HB ASN 36 14.849 10.573 0.856
251 HB3 ASN 36 2HB ASN 36 15.268 12.092 1.642
252 HD21 ASN 36 1HD2 ASN 36 13.960 13.736 1.309
253 HD22 ASN 36 2HD2 ASN 36 12.836 13.892 0.007
254 H ASN 37 H ASN 37 15.457 13.099 -1.878
255 HA ASN 37 HA ASN 37 17.408 15.252 -1.563
256 HB2 ASN 37 1HB ASN 37 15.511 14.421 -3.715
257 HB3 ASN 37 2HB ASN 37 15.993 16.113 -3.633
258 HD21 ASN 37 1HD2 ASN 37 17.431 16.426 -5.174
259 HD22 ASN 37 2HD2 ASN 37 18.814 15.438 -5.484
260 H ASN 38 H ASN 38 15.317 14.780 0.428
261 HA ASN 38 HA ASN 38 13.592 15.839 1.520
262 HB2 ASN 38 1HB ASN 38 14.126 18.324 1.833
263 HB3 ASN 38 2HB ASN 38 15.359 17.173 2.340
264 HD21 ASN 38 1HD2 ASN 38 14.375 19.209 -0.373
265 HD22 ASN 38 2HD2 ASN 38 15.976 19.542 -0.933
266 H THR 39 H THR 39 13.031 15.400 -1.269
267 HA THR 39 HA THR 39 11.760 17.791 -2.274
268 HB THR 39 HB THR 39 12.810 15.941 -3.707
269 HG1 THR 39 1HG THR 39 10.852 16.156 -5.206
270 HG21 THR 39 1HG2 THR 39 11.377 14.084 -4.313
271 HG22 THR 39 2HG2 THR 39 10.123 14.654 -3.212
272 HG23 THR 39 3HG2 THR 39 11.657 14.066 -2.572
273 HA PRO 40 HA PRO 40 7.864 17.204 -0.291
274 HB2 PRO 40 1HB PRO 40 6.343 18.729 -1.943
275 HB3 PRO 40 2HB PRO 40 7.468 19.417 -0.765
276 HG2 PRO 40 1HG PRO 40 7.833 18.988 -3.705
277 HG3 PRO 40 2HG PRO 40 8.279 20.390 -2.715
278 HD2 PRO 40 1HD PRO 40 10.077 18.516 -3.482
279 HD3 PRO 40 2HD PRO 40 10.205 19.389 -1.941
280 H ILE 41 H ILE 41 6.290 15.713 -0.406
281 HA ILE 41 HA ILE 41 5.905 14.324 -2.962
282 HB ILE 41 HB ILE 41 4.944 13.368 -0.275
283 HG12 ILE 41 1HG1 ILE 41 7.620 12.871 -1.597
284 HG13 ILE 41 2HG1 ILE 41 7.344 13.724 -0.082
285 HG21 ILE 41 1HG2 ILE 41 4.648 11.299 -1.282
286 HG22 ILE 41 2HG2 ILE 41 4.145 12.424 -2.543
287 HG23 ILE 41 3HG2 ILE 41 5.742 11.678 -2.612
288 HD11 ILE 41 1HD1 ILE 41 7.837 10.986 -0.476
289 HD12 ILE 41 2HD1 ILE 41 7.485 11.825 1.035
290 HD13 ILE 41 3HD1 ILE 41 6.171 11.133 0.084
291 H HIS 42 H HIS 42 3.919 14.087 -3.898
292 HA HIS 42 HA HIS 42 1.900 15.993 -3.143
293 HB2 HIS 42 1HB HIS 42 2.327 14.116 -5.422
294 HB3 HIS 42 2HB HIS 42 0.691 14.692 -5.118
295 HD1 HIS 42 1HD HIS 42 0.793 15.982 -7.393
296 HD2 HIS 42 2HD HIS 42 3.531 17.257 -4.541
297 HE1 HIS 42 1HE HIS 42 1.644 18.199 -8.222
298 HE2 HIS 42 2HE HIS 42 3.362 18.910 -6.523
299 H GLY 43 H GLY 43 2.281 12.488 -3.060
300 HA2 GLY 43 1HA GLY 43 0.403 12.212 -0.944
301 HA3 GLY 43 2HA GLY 43 -0.311 11.707 -2.468
302 H PHE 44 H PHE 44 -0.470 9.546 -2.064
303 HA PHE 44 HA PHE 44 1.988 8.035 -2.233
304 HB2 PHE 44 1HB PHE 44 0.225 7.965 0.204
305 HB3 PHE 44 2HB PHE 44 1.205 6.576 -0.251
306 HD1 PHE 44 2HD PHE 44 3.742 7.202 -0.782
307 HD2 PHE 44 1HD PHE 44 1.115 9.445 1.704
308 HE1 PHE 44 2HE PHE 44 5.680 8.194 0.363
309 HE2 PHE 44 1HE PHE 44 3.049 10.442 2.854
310 HZ PHE 44 HZ PHE 44 5.335 9.815 2.185
311 H TYR 45 H TYR 45 1.684 6.356 -3.541
312 HA TYR 45 HA TYR 45 -1.057 5.604 -4.227
313 HB2 TYR 45 1HB TYR 45 1.598 5.321 -5.587
314 HB3 TYR 45 2HB TYR 45 0.269 4.261 -6.046
315 HD1 TYR 45 2HD TYR 45 -2.050 6.018 -5.935
316 HD2 TYR 45 1HD TYR 45 1.888 6.823 -7.330
317 HE1 TYR 45 2HE TYR 45 -2.939 7.769 -7.416
318 HE2 TYR 45 1HE TYR 45 1.010 8.576 -8.815
319 HH TYR 45 HH TYR 45 -2.086 8.861 -9.693
320 H ILE 46 H ILE 46 -1.828 3.516 -4.102
321 HA ILE 46 HA ILE 46 -0.099 1.524 -2.805
322 HB ILE 46 HB ILE 46 -2.954 2.107 -2.010
323 HG12 ILE 46 1HG1 ILE 46 -0.627 2.296 -0.145
324 HG13 ILE 46 2HG1 ILE 46 -0.914 3.621 -1.268
325 HG21 ILE 46 1HG2 ILE 46 -2.245 -0.298 -1.957
326 HG22 ILE 46 2HG2 ILE 46 -1.031 0.156 -0.763
327 HG23 ILE 46 3HG2 ILE 46 -2.744 0.365 -0.401
328 HD11 ILE 46 1HD1 ILE 46 -3.271 3.694 -0.368
329 HD12 ILE 46 2HD1 ILE 46 -2.713 2.609 0.906
330 HD13 ILE 46 3HD1 ILE 46 -1.993 4.209 0.731
331 H TYR 47 H TYR 47 -0.052 -0.307 -3.916
332 HA TYR 47 HA TYR 47 -2.260 -0.885 -5.771
333 HB2 TYR 47 1HB TYR 47 0.595 -1.884 -5.799
334 HB3 TYR 47 2HB TYR 47 -0.641 -2.303 -6.979
335 HD1 TYR 47 2HD TYR 47 0.873 0.771 -5.476
336 HD2 TYR 47 1HD TYR 47 -0.613 -1.147 -8.971
337 HE1 TYR 47 2HE TYR 47 1.490 2.741 -6.812
338 HE2 TYR 47 1HE TYR 47 0.002 0.817 -10.317
339 HH TYR 47 HH TYR 47 2.085 3.081 -9.420
340 H TYR 48 H TYR 48 -3.183 -2.931 -5.849
341 HA TYR 48 HA TYR 48 -2.306 -5.001 -4.032
342 HB2 TYR 48 1HB TYR 48 -4.625 -5.134 -2.984
343 HB3 TYR 48 2HB TYR 48 -3.598 -3.811 -2.444
344 HD1 TYR 48 2HD TYR 48 -4.083 -1.504 -3.120
345 HD2 TYR 48 1HD TYR 48 -6.635 -4.716 -4.246
346 HE1 TYR 48 2HE TYR 48 -5.846 0.109 -3.702
347 HE2 TYR 48 1HE TYR 48 -8.405 -3.112 -4.833
348 HH TYR 48 HH TYR 48 -8.780 -0.351 -3.865
349 H ARG 49 H ARG 49 -3.125 -7.028 -4.537
350 HA ARG 49 HA ARG 49 -5.263 -7.387 -6.407
351 HB2 ARG 49 1HB ARG 49 -4.023 -8.283 -8.250
352 HB3 ARG 49 2HB ARG 49 -3.365 -6.694 -7.886
353 HG2 ARG 49 1HG ARG 49 -1.427 -7.844 -8.129
354 HG3 ARG 49 2HG ARG 49 -1.701 -8.124 -6.409
355 HD2 ARG 49 1HD ARG 49 -3.052 -10.201 -7.335
356 HD3 ARG 49 2HD ARG 49 -1.971 -9.986 -8.711
357 HE ARG 49 HE ARG 49 -0.680 -10.068 -6.123
358 HH11 ARG 49 1HH1 ARG 49 -1.721 -11.858 -8.922
359 HH12 ARG 49 2HH1 ARG 49 -0.613 -13.164 -8.660
360 HH21 ARG 49 1HH2 ARG 49 0.782 -11.782 -5.767
361 HH22 ARG 49 2HH2 ARG 49 0.810 -13.120 -6.865
362 HA PRO 50 HA PRO 50 -5.365 -11.232 -4.264
363 HB2 PRO 50 1HB PRO 50 -6.962 -12.623 -5.963
364 HB3 PRO 50 2HB PRO 50 -7.571 -11.352 -4.897
365 HG2 PRO 50 1HG PRO 50 -6.880 -11.215 -7.806
366 HG3 PRO 50 2HG PRO 50 -8.275 -10.528 -6.954
367 HD2 PRO 50 1HD PRO 50 -6.118 -9.046 -7.649
368 HD3 PRO 50 2HD PRO 50 -7.075 -8.714 -6.190
369 H THR 51 H THR 51 -4.289 -13.153 -4.234
370 HA THR 51 HA THR 51 -2.116 -13.620 -5.853
371 HB THR 51 HB THR 51 -2.876 -14.767 -3.613
372 HG1 THR 51 1HG THR 51 -0.844 -15.040 -4.802
373 HG21 THR 51 1HG2 THR 51 -3.725 -16.998 -3.868
374 HG22 THR 51 2HG2 THR 51 -3.673 -16.869 -5.626
375 HG23 THR 51 3HG2 THR 51 -4.820 -15.898 -4.704
376 H ASP 52 H ASP 52 -5.427 -14.246 -6.519
377 HA ASP 52 HA ASP 52 -5.007 -16.265 -8.509
378 HB2 ASP 52 1HB ASP 52 -7.155 -16.425 -7.722
379 HB3 ASP 52 2HB ASP 52 -7.321 -14.684 -7.510
380 H SER 53 H SER 53 -5.208 -12.774 -8.468
381 HA SER 53 HA SER 53 -5.779 -11.965 -10.942
382 HB2 SER 53 1HB SER 53 -3.587 -11.118 -9.090
383 HB3 SER 53 2HB SER 53 -3.656 -10.412 -10.704
384 HG SER 53 HG SER 53 -6.089 -10.455 -9.479
385 H ASP 54 H ASP 54 -4.727 -11.703 -12.949
386 HA ASP 54 HA ASP 54 -3.019 -13.931 -13.644
387 HB2 ASP 54 1HB ASP 54 -5.002 -12.818 -15.005
388 HB3 ASP 54 2HB ASP 54 -3.706 -11.786 -15.604
389 H ASN 55 H ASN 55 -2.795 -10.471 -14.480
390 HA ASN 55 HA ASN 55 0.075 -10.582 -13.859
391 HB2 ASN 55 1HB ASN 55 0.641 -9.391 -15.868
392 HB3 ASN 55 2HB ASN 55 -0.328 -10.788 -16.328
393 HD21 ASN 55 1HD2 ASN 55 -2.744 -10.298 -16.411
394 HD22 ASN 55 2HD2 ASN 55 -3.187 -8.827 -17.202
395 H ASP 56 H ASP 56 0.916 -8.131 -14.187
396 HA ASP 56 HA ASP 56 0.018 -6.678 -12.031
397 HB2 ASP 56 1HB ASP 56 1.070 -4.676 -13.266
398 HB3 ASP 56 2HB ASP 56 2.106 -6.051 -12.897
399 H SER 57 H SER 57 -1.340 -6.883 -15.203
400 HA SER 57 HA SER 57 -2.727 -4.552 -15.526
401 HB2 SER 57 1HB SER 57 -2.796 -6.337 -17.182
402 HB3 SER 57 2HB SER 57 -3.719 -7.359 -16.080
403 HG SER 57 HG SER 57 -4.747 -4.836 -16.671
404 H ASP 58 H ASP 58 -3.306 -7.062 -13.194
405 HA ASP 58 HA ASP 58 -5.933 -6.144 -12.465
406 HB2 ASP 58 1HB ASP 58 -4.033 -8.207 -11.410
407 HB3 ASP 58 2HB ASP 58 -5.398 -7.697 -10.421
408 H TYR 59 H TYR 59 -2.715 -6.031 -10.951
409 HA TYR 59 HA TYR 59 -3.117 -4.840 -8.595
410 HB2 TYR 59 1HB TYR 59 -1.027 -4.461 -10.671
411 HB3 TYR 59 2HB TYR 59 -1.063 -3.290 -9.357
412 HD1 TYR 59 1HD TYR 59 -1.732 -4.831 -7.021
413 HD2 TYR 59 2HD TYR 59 0.736 -5.912 -10.314
414 HE1 TYR 59 1HE TYR 59 -0.509 -6.406 -5.580
415 HE2 TYR 59 2HE TYR 59 1.964 -7.490 -8.883
416 HH TYR 59 HH TYR 59 1.412 -7.648 -5.425
417 H LYS 60 H LYS 60 -4.289 -3.201 -7.882
418 HA LYS 60 HA LYS 60 -5.155 -1.124 -9.733
419 HB2 LYS 60 1HB LYS 60 -5.986 -1.874 -6.933
420 HB3 LYS 60 2HB LYS 60 -6.570 -0.420 -7.732
421 HG2 LYS 60 1HG LYS 60 -7.887 -1.576 -9.187
422 HG3 LYS 60 2HG LYS 60 -6.849 -3.003 -9.167
423 HD2 LYS 60 1HD LYS 60 -8.268 -2.253 -6.660
424 HD3 LYS 60 2HD LYS 60 -9.205 -2.985 -7.965
425 HE2 LYS 60 1HE LYS 60 -7.523 -4.836 -8.018
426 HE3 LYS 60 2HE LYS 60 -6.790 -4.136 -6.576
427 HZ1 LYS 60 1HZ LYS 60 -8.268 -5.212 -5.356
428 HZ2 LYS 60 2HZ LYS 60 -8.989 -5.862 -6.741
429 HZ3 LYS 60 3HZ LYS 60 -9.534 -4.387 -6.117
430 H LYS 61 H LYS 61 -5.502 1.075 -8.292
431 HA LYS 61 HA LYS 61 -3.006 1.708 -6.911
432 HB2 LYS 61 1HB LYS 61 -2.762 2.227 -9.376
433 HB3 LYS 61 2HB LYS 61 -4.027 3.431 -9.170
434 HG2 LYS 61 1HG LYS 61 -2.675 4.699 -7.666
435 HG3 LYS 61 2HG LYS 61 -1.452 3.428 -7.614
436 HD2 LYS 61 1HD LYS 61 -0.714 5.218 -9.067
437 HD3 LYS 61 2HD LYS 61 -1.037 3.770 -10.023
438 HE2 LYS 61 1HE LYS 61 -3.182 4.662 -10.706
439 HE3 LYS 61 2HE LYS 61 -2.956 6.071 -9.671
440 HZ1 LYS 61 1HZ LYS 61 -2.013 7.054 -11.401
441 HZ2 LYS 61 2HZ LYS 61 -2.034 5.632 -12.316
442 HZ3 LYS 61 3HZ LYS 61 -0.728 5.959 -11.292
443 H ASP 62 H ASP 62 -3.444 2.784 -5.110
444 HA ASP 62 HA ASP 62 -5.904 4.407 -5.007
445 HB2 ASP 62 1HB ASP 62 -4.783 2.420 -3.096
446 HB3 ASP 62 2HB ASP 62 -5.557 3.848 -2.415
447 H MET 63 H MET 63 -5.436 6.495 -4.924
448 HA MET 63 HA MET 63 -2.853 7.443 -4.102
449 HB2 MET 63 1HB MET 63 -4.435 8.416 -5.913
450 HB3 MET 63 2HB MET 63 -5.238 9.209 -4.564
451 HG2 MET 63 1HG MET 63 -2.775 9.958 -3.995
452 HG3 MET 63 2HG MET 63 -2.549 9.683 -5.721
453 HE1 MET 63 1HE MET 63 -4.614 13.168 -3.698
454 HE2 MET 63 2HE MET 63 -4.794 11.534 -3.058
455 HE3 MET 63 3HE MET 63 -3.190 12.257 -3.193
456 H VAL 64 H VAL 64 -2.322 8.628 -2.291
457 HA VAL 64 HA VAL 64 -4.387 9.061 -0.261
458 HB VAL 64 HB VAL 64 -1.761 7.784 0.480
459 HG11 VAL 64 1HG1 VAL 64 -4.079 7.356 2.184
460 HG12 VAL 64 2HG1 VAL 64 -2.464 7.938 2.594
461 HG13 VAL 64 3HG1 VAL 64 -3.682 9.063 1.989
462 HG21 VAL 64 1HG2 VAL 64 -2.609 6.010 -0.675
463 HG22 VAL 64 2HG2 VAL 64 -3.433 5.763 0.865
464 HG23 VAL 64 3HG2 VAL 64 -4.281 6.534 -0.475
465 H GLU 65 H GLU 65 -3.983 10.758 1.137
466 HA GLU 65 HA GLU 65 -2.629 12.955 0.278
467 HB2 GLU 65 1HB GLU 65 -2.913 12.224 3.195
468 HB3 GLU 65 2HB GLU 65 -2.776 13.840 2.517
469 HG2 GLU 65 1HG GLU 65 -5.077 11.933 2.177
470 HG3 GLU 65 2HG GLU 65 -5.056 13.411 3.138
471 H GLY 66 H GLY 66 -0.630 13.941 0.727
472 HA2 GLY 66 1HA GLY 66 1.573 12.114 0.852
473 HA3 GLY 66 2HA GLY 66 1.676 13.865 0.742
474 H ASP 67 H ASP 67 -0.188 13.875 3.203
475 HA ASP 67 HA ASP 67 2.002 13.714 5.141
476 HB2 ASP 67 1HB ASP 67 0.430 15.782 4.758
477 HB3 ASP 67 2HB ASP 67 -0.683 14.877 5.780
478 H ARG 68 H ARG 68 -0.579 11.892 4.089
479 HA ARG 68 HA ARG 68 -1.198 10.750 6.701
480 HB2 ARG 68 1HB ARG 68 -2.964 11.248 4.940
481 HB3 ARG 68 2HB ARG 68 -2.306 9.896 4.029
482 HG2 ARG 68 1HG ARG 68 -3.138 8.339 5.464
483 HG3 ARG 68 2HG ARG 68 -3.057 9.419 6.858
484 HD2 ARG 68 1HD ARG 68 -5.082 10.376 6.409
485 HD3 ARG 68 2HD ARG 68 -4.944 10.109 4.672
486 HE ARG 68 HE ARG 68 -5.249 7.697 6.215
487 HH11 ARG 68 1HH1 ARG 68 -6.889 10.285 4.563
488 HH12 ARG 68 2HH1 ARG 68 -8.347 9.381 4.319
489 HH21 ARG 68 1HH2 ARG 68 -7.162 6.496 5.901
490 HH22 ARG 68 2HH2 ARG 68 -8.501 7.226 5.082
491 H TYR 69 H TYR 69 -0.167 9.035 7.467
492 HA TYR 69 HA TYR 69 1.391 7.382 5.598
493 HB2 TYR 69 1HB TYR 69 1.763 8.121 8.480
494 HB3 TYR 69 2HB TYR 69 2.484 6.641 7.859
495 HD1 TYR 69 2HD TYR 69 2.108 9.681 5.822
496 HD2 TYR 69 1HD TYR 69 4.760 7.340 8.186
497 HE1 TYR 69 2HE TYR 69 4.012 10.976 4.957
498 HE2 TYR 69 1HE TYR 69 6.671 8.628 7.329
499 HH TYR 69 HH TYR 69 6.351 10.863 4.702
500 H TRP 70 H TRP 70 -1.523 7.177 6.357
501 HA TRP 70 HA TRP 70 -1.474 4.311 6.920
502 HB2 TRP 70 1HB TRP 70 -3.102 4.408 8.650
503 HB3 TRP 70 2HB TRP 70 -1.874 5.599 9.069
504 HD1 TRP 70 HD TRP 70 -2.562 8.238 8.395
505 HE1 TRP 70 1HE TRP 70 -4.863 9.376 8.587
506 HE3 TRP 70 3HE TRP 70 -5.516 4.069 8.575
507 HZ2 TRP 70 2HZ TRP 70 -7.572 8.607 8.789
508 HZ3 TRP 70 3HZ TRP 70 -7.952 4.358 8.769
509 HH2 TRP 70 HH TRP 70 -8.956 6.580 8.874
510 H HIS 71 H HIS 71 -3.215 3.161 6.061
511 HA HIS 71 HA HIS 71 -5.391 4.533 4.763
512 HB2 HIS 71 1HB HIS 71 -3.599 4.760 3.085
513 HB3 HIS 71 2HB HIS 71 -3.386 3.012 3.083
514 HD1 HIS 71 1HD HIS 71 -6.250 5.450 2.465
515 HD2 HIS 71 2HD HIS 71 -4.751 1.831 1.080
516 HE1 HIS 71 1HE HIS 71 -7.746 4.790 0.555
517 HE2 HIS 71 2HE HIS 71 -6.872 2.556 -0.212
518 H SER 72 H SER 72 -7.155 3.290 4.804
519 HA SER 72 HA SER 72 -6.803 0.441 5.438
520 HB2 SER 72 1HB SER 72 -9.039 0.518 6.401
521 HB3 SER 72 2HB SER 72 -8.057 1.812 7.088
522 HG SER 72 HG SER 72 -9.749 2.221 4.859
523 H ILE 73 H ILE 73 -6.751 -0.630 3.541
524 HA ILE 73 HA ILE 73 -8.273 0.092 1.254
525 HB ILE 73 HB ILE 73 -7.052 -2.608 1.821
526 HG12 ILE 73 1HG1 ILE 73 -5.716 -0.331 0.366
527 HG13 ILE 73 2HG1 ILE 73 -5.498 -0.592 2.093
528 HG21 ILE 73 1HG2 ILE 73 -8.581 -2.546 -0.077
529 HG22 ILE 73 2HG2 ILE 73 -7.686 -1.191 -0.763
530 HG23 ILE 73 3HG2 ILE 73 -6.916 -2.771 -0.615
531 HD11 ILE 73 1HD1 ILE 73 -4.795 -2.973 1.415
532 HD12 ILE 73 2HD1 ILE 73 -4.601 -2.284 -0.198
533 HD13 ILE 73 3HD1 ILE 73 -3.668 -1.642 1.154
534 H SER 74 H SER 74 -10.091 -0.880 0.356
535 HA SER 74 HA SER 74 -11.561 -2.782 2.040
536 HB2 SER 74 1HB SER 74 -12.952 -0.444 0.741
537 HB3 SER 74 2HB SER 74 -13.571 -1.533 1.983
538 HG SER 74 HG SER 74 -11.409 0.270 2.349
539 H HIS 75 H HIS 75 -13.703 -3.371 0.725
540 HA HIS 75 HA HIS 75 -14.555 -4.527 -1.039
541 HB2 HIS 75 1HB HIS 75 -12.826 -2.670 -2.687
542 HB3 HIS 75 2HB HIS 75 -14.185 -3.621 -3.280
543 HD1 HIS 75 1HD HIS 75 -14.036 -0.497 -3.467
544 HD2 HIS 75 2HD HIS 75 -16.046 -2.638 -0.528
545 HE1 HIS 75 1HE HIS 75 -15.796 1.066 -2.582
546 HE2 HIS 75 2HE HIS 75 -16.943 -0.222 -0.746
547 H LEU 76 H LEU 76 -12.631 -5.901 0.193
548 HA LEU 76 HA LEU 76 -10.996 -7.031 -1.982
549 HB2 LEU 76 1HB LEU 76 -10.428 -7.289 0.959
550 HB3 LEU 76 2HB LEU 76 -9.361 -7.677 -0.389
551 HG LEU 76 HG LEU 76 -10.254 -4.855 -0.016
552 HD11 LEU 76 1HD1 LEU 76 -7.745 -5.570 1.322
553 HD12 LEU 76 2HD1 LEU 76 -9.204 -6.153 2.123
554 HD13 LEU 76 3HD1 LEU 76 -9.005 -4.431 1.797
555 HD21 LEU 76 1HD2 LEU 76 -7.479 -5.402 -0.650
556 HD22 LEU 76 2HD2 LEU 76 -8.669 -4.436 -1.523
557 HD23 LEU 76 3HD2 LEU 76 -8.585 -6.180 -1.782
558 H GLN 77 H GLN 77 -10.272 -9.408 -1.057
559 HA GLN 77 HA GLN 77 -12.824 -10.831 -0.802
560 HB2 GLN 77 1HB GLN 77 -10.105 -11.792 -1.708
561 HB3 GLN 77 2HB GLN 77 -11.532 -12.812 -1.579
562 HG2 GLN 77 1HG GLN 77 -12.644 -11.610 -3.304
563 HG3 GLN 77 2HG GLN 77 -11.391 -10.370 -3.324
564 HE21 GLN 77 1HE2 GLN 77 -10.563 -10.548 -5.306
565 HE22 GLN 77 2HE2 GLN 77 -9.892 -11.992 -5.977
566 HA PRO 78 HA PRO 78 -11.925 -12.016 3.341
567 HB2 PRO 78 1HB PRO 78 -13.505 -14.218 3.501
568 HB3 PRO 78 2HB PRO 78 -14.148 -12.571 3.503
569 HG2 PRO 78 1HG PRO 78 -13.958 -14.528 1.245
570 HG3 PRO 78 2HG PRO 78 -15.299 -13.454 1.685
571 HD2 PRO 78 1HD PRO 78 -13.566 -12.878 -0.314
572 HD3 PRO 78 2HD PRO 78 -14.324 -11.621 0.685
573 H GLU 79 H GLU 79 -10.757 -13.536 4.539
574 HA GLU 79 HA GLU 79 -8.857 -14.851 4.686
575 HB2 GLU 79 1HB GLU 79 -9.582 -17.284 3.944
576 HB3 GLU 79 2HB GLU 79 -10.270 -16.519 5.370
577 HG2 GLU 79 1HG GLU 79 -12.275 -15.995 4.246
578 HG3 GLU 79 2HG GLU 79 -11.576 -16.373 2.672
579 H THR 80 H THR 80 -8.601 -13.338 2.399
580 HA THR 80 HA THR 80 -7.575 -15.253 0.409
581 HB THR 80 HB THR 80 -8.214 -12.339 -0.067
582 HG1 THR 80 1HG THR 80 -10.129 -13.495 0.389
583 HG21 THR 80 1HG2 THR 80 -7.737 -12.698 -2.285
584 HG22 THR 80 2HG2 THR 80 -8.090 -14.423 -2.194
585 HG23 THR 80 3HG2 THR 80 -6.578 -13.796 -1.537
586 H SER 81 H SER 81 -5.482 -15.587 0.885
587 HA SER 81 HA SER 81 -3.794 -13.507 1.931
588 HB2 SER 81 1HB SER 81 -3.699 -16.138 2.263
589 HB3 SER 81 2HB SER 81 -2.659 -16.047 0.841
590 HG SER 81 HG SER 81 -1.634 -15.852 2.997
591 H TYR 82 H TYR 82 -3.337 -11.887 0.559
592 HA TYR 82 HA TYR 82 -2.041 -12.602 -1.980
593 HB2 TYR 82 1HB TYR 82 -3.125 -10.506 -2.942
594 HB3 TYR 82 2HB TYR 82 -4.184 -11.889 -2.689
595 HD1 TYR 82 1HD TYR 82 -3.054 -8.755 -1.007
596 HD2 TYR 82 2HD TYR 82 -6.176 -11.597 -1.534
597 HE1 TYR 82 1HE TYR 82 -4.554 -7.350 0.345
598 HE2 TYR 82 2HE TYR 82 -7.685 -10.199 -0.185
599 HH TYR 82 HH TYR 82 -7.525 -7.299 0.344
600 H ASP 83 H ASP 83 -0.583 -10.972 -2.807
601 HA ASP 83 HA ASP 83 0.978 -9.786 -0.721
602 HB2 ASP 83 1HB ASP 83 1.203 -9.861 -3.721
603 HB3 ASP 83 2HB ASP 83 2.288 -8.870 -2.749
604 H ILE 84 H ILE 84 1.506 -7.563 -0.490
605 HA ILE 84 HA ILE 84 -0.252 -5.638 -1.812
606 HB ILE 84 HB ILE 84 0.009 -5.826 1.191
607 HG12 ILE 84 1HG1 ILE 84 -2.551 -5.998 -0.371
608 HG13 ILE 84 2HG1 ILE 84 -1.558 -7.431 -0.131
609 HG21 ILE 84 1HG2 ILE 84 -1.805 -3.938 -0.250
610 HG22 ILE 84 2HG2 ILE 84 -1.161 -3.842 1.388
611 HG23 ILE 84 3HG2 ILE 84 -0.112 -3.517 0.009
612 HD11 ILE 84 1HD1 ILE 84 -3.198 -5.911 1.796
613 HD12 ILE 84 2HD1 ILE 84 -2.908 -7.646 1.664
614 HD13 ILE 84 3HD1 ILE 84 -1.689 -6.600 2.392
615 H LYS 85 H LYS 85 0.849 -3.903 -2.436
616 HA LYS 85 HA LYS 85 3.183 -3.039 -0.893
617 HB2 LYS 85 1HB LYS 85 4.561 -2.825 -2.870
618 HB3 LYS 85 2HB LYS 85 3.998 -4.486 -2.732
619 HG2 LYS 85 1HG LYS 85 2.468 -4.228 -4.495
620 HG3 LYS 85 2HG LYS 85 2.600 -2.469 -4.459
621 HD2 LYS 85 1HD LYS 85 4.590 -2.459 -5.588
622 HD3 LYS 85 2HD LYS 85 5.066 -4.046 -4.982
623 HE2 LYS 85 1HE LYS 85 2.720 -3.861 -6.805
624 HE3 LYS 85 2HE LYS 85 4.334 -3.688 -7.493
625 HZ1 LYS 85 1HZ LYS 85 3.860 -5.934 -5.682
626 HZ2 LYS 85 2HZ LYS 85 4.857 -5.838 -7.044
627 HZ3 LYS 85 3HZ LYS 85 3.187 -6.025 -7.231
628 H MET 86 H MET 86 4.023 -0.882 -1.871
629 HA MET 86 HA MET 86 1.945 0.740 -3.084
630 HB2 MET 86 1HB MET 86 2.083 2.455 -1.275
631 HB3 MET 86 2HB MET 86 1.321 0.952 -0.774
632 HG2 MET 86 1HG MET 86 3.227 0.280 0.446
633 HG3 MET 86 2HG MET 86 4.219 1.546 -0.274
634 HE1 MET 86 1HE MET 86 1.509 3.945 0.202
635 HE2 MET 86 2HE MET 86 2.672 4.764 1.245
636 HE3 MET 86 3HE MET 86 3.211 4.009 -0.256
637 H GLN 87 H GLN 87 2.777 3.082 -3.303
638 HA GLN 87 HA GLN 87 5.641 3.393 -3.356
639 HB2 GLN 87 1HB GLN 87 5.501 2.218 -5.408
640 HB3 GLN 87 2HB GLN 87 4.051 3.086 -5.895
641 HG2 GLN 87 1HG GLN 87 5.463 5.171 -5.962
642 HG3 GLN 87 2HG GLN 87 6.867 4.121 -5.769
643 HE21 GLN 87 1HE2 GLN 87 4.533 5.373 -7.917
644 HE22 GLN 87 2HE2 GLN 87 5.066 4.554 -9.341
645 H CYS 88 H CYS 88 6.276 5.524 -3.471
646 HA CYS 88 HA CYS 88 4.109 7.474 -3.239
647 HB2 CYS 88 1HB CYS 88 5.712 8.922 -2.176
648 HB3 CYS 88 2HB CYS 88 5.855 7.324 -1.455
649 HG CYS 88 HG CYS 88 8.166 9.159 -2.875
650 H PHE 89 H PHE 89 4.379 9.603 -4.244
651 HA PHE 89 HA PHE 89 6.144 9.762 -6.540
652 HB2 PHE 89 1HB PHE 89 4.441 10.021 -8.191
653 HB3 PHE 89 2HB PHE 89 4.064 8.547 -7.306
654 HD1 PHE 89 1HD PHE 89 2.538 9.072 -5.121
655 HD2 PHE 89 2HD PHE 89 2.654 11.341 -8.720
656 HE1 PHE 89 1HE PHE 89 0.281 9.931 -4.648
657 HE2 PHE 89 2HE PHE 89 0.399 12.205 -8.253
658 HZ PHE 89 HZ PHE 89 -0.791 11.501 -6.214
659 H ASN 90 H ASN 90 5.666 11.912 -7.753
660 HA ASN 90 HA ASN 90 4.420 14.026 -6.332
661 HB2 ASN 90 1HB ASN 90 6.167 15.117 -5.295
662 HB3 ASN 90 2HB ASN 90 6.657 13.442 -5.057
663 HD21 ASN 90 1HD2 ASN 90 7.942 16.252 -5.598
664 HD22 ASN 90 2HD2 ASN 90 9.221 15.859 -6.692
665 H GLU 91 H GLU 91 4.873 16.163 -7.343
666 HA GLU 91 HA GLU 91 4.503 16.196 -10.035
667 HB2 GLU 91 1HB GLU 91 5.369 18.536 -10.009
668 HB3 GLU 91 2HB GLU 91 4.198 18.196 -8.742
669 HG2 GLU 91 1HG GLU 91 5.946 18.021 -7.101
670 HG3 GLU 91 2HG GLU 91 7.180 18.194 -8.348
671 H GLY 92 H GLY 92 7.539 15.875 -8.335
672 HA2 GLY 92 1HA GLY 92 9.211 16.365 -10.603
673 HA3 GLY 92 2HA GLY 92 9.707 15.635 -9.083
674 H GLY 93 H GLY 93 7.903 13.447 -9.085
675 HA2 GLY 93 1HA GLY 93 7.635 11.880 -11.276
676 HA3 GLY 93 2HA GLY 93 9.340 11.704 -10.886
677 H GLU 94 H GLU 94 7.880 9.466 -10.864
678 HA GLU 94 HA GLU 94 6.852 8.937 -8.212
679 HB2 GLU 94 1HB GLU 94 7.277 7.095 -10.572
680 HB3 GLU 94 2HB GLU 94 6.460 6.654 -9.079
681 HG2 GLU 94 1HG GLU 94 4.648 7.156 -10.333
682 HG3 GLU 94 2HG GLU 94 4.986 8.764 -9.695
683 H SER 95 H SER 95 7.629 7.008 -6.996
684 HA SER 95 HA SER 95 10.570 6.935 -7.037
685 HB2 SER 95 1HB SER 95 9.518 7.823 -4.967
686 HB3 SER 95 2HB SER 95 8.702 6.275 -4.746
687 HG SER 95 HG SER 95 10.452 5.650 -3.789
688 H GLU 96 H GLU 96 11.237 4.765 -5.712
689 HA GLU 96 HA GLU 96 10.733 2.655 -7.540
690 HB2 GLU 96 1HB GLU 96 12.086 2.677 -4.840
691 HB3 GLU 96 2HB GLU 96 12.039 1.275 -5.899
692 HG2 GLU 96 1HG GLU 96 13.116 3.882 -6.884
693 HG3 GLU 96 2HG GLU 96 14.116 2.805 -5.911
694 H PHE 97 H PHE 97 9.989 0.466 -6.854
695 HA PHE 97 HA PHE 97 7.392 0.687 -5.646
696 HB2 PHE 97 1HB PHE 97 8.944 -1.579 -6.878
697 HB3 PHE 97 2HB PHE 97 7.415 -1.861 -6.054
698 HD1 PHE 97 1HD PHE 97 8.553 0.851 -8.344
699 HD2 PHE 97 2HD PHE 97 5.808 -2.322 -7.630
700 HE1 PHE 97 1HE PHE 97 7.341 1.441 -10.402
701 HE2 PHE 97 2HE PHE 97 4.592 -1.738 -9.688
702 HZ PHE 97 HZ PHE 97 5.359 0.145 -11.077
703 H SER 98 H SER 98 6.962 0.502 -3.558
704 HA SER 98 HA SER 98 8.844 0.009 -1.577
705 HB2 SER 98 1HB SER 98 6.672 1.137 -1.192
706 HB3 SER 98 2HB SER 98 5.851 -0.412 -1.382
707 HG SER 98 HG SER 98 6.163 -0.097 0.789
708 H ASN 99 H ASN 99 8.300 -1.799 0.179
709 HA ASN 99 HA ASN 99 9.077 -4.259 -1.017
710 HB2 ASN 99 1HB ASN 99 8.759 -5.139 1.359
711 HB3 ASN 99 2HB ASN 99 9.932 -3.841 1.150
712 HD21 ASN 99 1HD2 ASN 99 8.313 -4.728 3.475
713 HD22 ASN 99 2HD2 ASN 99 7.490 -3.308 4.016
714 H VAL 100 H VAL 100 7.880 -6.336 -0.136
715 HA VAL 100 HA VAL 100 5.041 -6.030 -0.863
716 HB VAL 100 HB VAL 100 6.814 -8.454 -1.197
717 HG11 VAL 100 1HG1 VAL 100 4.861 -9.550 -1.108
718 HG12 VAL 100 2HG1 VAL 100 3.913 -8.073 -1.299
719 HG13 VAL 100 3HG1 VAL 100 4.588 -8.878 -2.716
720 HG21 VAL 100 1HG2 VAL 100 7.382 -6.724 -2.789
721 HG22 VAL 100 2HG2 VAL 100 6.523 -8.025 -3.612
722 HG23 VAL 100 3HG2 VAL 100 5.684 -6.524 -3.222
723 H MET 101 H MET 101 3.772 -6.135 0.867
724 HA MET 101 HA MET 101 4.529 -7.921 3.076
725 HB2 MET 101 1HB MET 101 2.675 -5.536 3.017
726 HB3 MET 101 2HB MET 101 2.904 -6.574 4.417
727 HG2 MET 101 1HG MET 101 5.015 -4.896 3.082
728 HG3 MET 101 2HG MET 101 4.215 -4.548 4.613
729 HE1 MET 101 1HE MET 101 5.302 -5.096 6.822
730 HE2 MET 101 2HE MET 101 4.233 -6.481 6.596
731 HE3 MET 101 3HE MET 101 5.883 -6.725 7.171
732 H ILE 102 H ILE 102 3.425 -9.740 3.344
733 HA ILE 102 HA ILE 102 0.975 -10.158 1.822
734 HB ILE 102 HB ILE 102 2.666 -12.082 3.420
735 HG12 ILE 102 1HG1 ILE 102 2.220 -12.106 0.447
736 HG13 ILE 102 2HG1 ILE 102 3.467 -11.090 1.161
737 HG21 ILE 102 1HG2 ILE 102 1.030 -13.579 3.330
738 HG22 ILE 102 2HG2 ILE 102 -0.038 -12.315 2.723
739 HG23 ILE 102 3HG2 ILE 102 0.848 -13.339 1.593
740 HD11 ILE 102 1HD1 ILE 102 4.642 -12.984 0.620
741 HD12 ILE 102 2HD1 ILE 102 4.221 -13.299 2.304
742 HD13 ILE 102 3HD1 ILE 102 3.298 -14.059 1.008
743 H CYS 103 H CYS 103 -0.717 -9.240 2.864
744 HA CYS 103 HA CYS 103 -1.111 -9.922 5.699
745 HB2 CYS 103 1HB CYS 103 -1.009 -7.466 4.916
746 HB3 CYS 103 2HB CYS 103 -2.602 -7.761 4.229
747 HG CYS 103 HG CYS 103 -3.073 -8.853 7.122
748 H GLU 104 H GLU 104 -2.351 -11.674 5.883
749 HA GLU 104 HA GLU 104 -4.324 -12.366 3.909
750 HB2 GLU 104 1HB GLU 104 -2.856 -13.928 5.411
751 HB3 GLU 104 2HB GLU 104 -4.137 -13.689 6.590
752 HG2 GLU 104 1HG GLU 104 -5.664 -14.355 4.544
753 HG3 GLU 104 2HG GLU 104 -4.181 -15.141 4.004
754 H THR 105 H THR 105 -6.345 -11.666 3.857
755 HA THR 105 HA THR 105 -7.450 -9.928 5.758
756 HB THR 105 HB THR 105 -9.641 -10.403 4.580
757 HG1 THR 105 1HG THR 105 -9.539 -11.725 2.751
758 HG21 THR 105 1HG2 THR 105 -8.090 -8.599 3.898
759 HG22 THR 105 2HG2 THR 105 -8.984 -9.275 2.536
760 HG23 THR 105 3HG2 THR 105 -7.300 -9.726 2.797
761 H LYS 106 H LYS 106 -9.849 -10.509 6.550
762 HA LYS 106 HA LYS 106 -9.473 -12.684 8.440
763 HB2 LYS 106 1HB LYS 106 -11.701 -10.653 8.196
764 HB3 LYS 106 2HB LYS 106 -11.508 -11.802 9.514
765 HG2 LYS 106 1HG LYS 106 -9.244 -9.978 8.917
766 HG3 LYS 106 2HG LYS 106 -10.675 -9.306 9.701
767 HD2 LYS 106 1HD LYS 106 -10.354 -10.504 11.621
768 HD3 LYS 106 2HD LYS 106 -9.558 -11.838 10.783
769 HE2 LYS 106 1HE LYS 106 -7.555 -10.482 10.502
770 HE3 LYS 106 2HE LYS 106 -8.351 -9.119 11.286
771 HZ1 LYS 106 1HZ LYS 106 -6.807 -10.883 12.562
772 HZ2 LYS 106 2HZ LYS 106 -8.328 -11.580 12.813
773 HZ3 LYS 106 3HZ LYS 106 -8.032 -9.991 13.313
774 H ALA 107 H ALA 107 -11.103 -14.300 8.817
775 HA ALA 107 HA ALA 107 -12.084 -15.445 6.387
776 HB1 ALA 107 1HB ALA 107 -13.227 -16.966 8.300
777 HB2 ALA 107 2HB ALA 107 -11.566 -17.168 7.742
778 HB3 ALA 107 3HB ALA 107 -11.896 -16.252 9.212
779 H ARG 108 H ARG 108 -14.005 -15.180 5.459
780 HA ARG 108 HA ARG 108 -15.918 -13.361 6.477
781 HB2 ARG 108 1HB ARG 108 -17.336 -14.214 4.572
782 HB3 ARG 108 2HB ARG 108 -15.756 -13.593 4.116
783 HG2 ARG 108 1HG ARG 108 -14.956 -15.655 3.535
784 HG3 ARG 108 2HG ARG 108 -16.042 -16.506 4.634
785 HD2 ARG 108 1HD ARG 108 -17.928 -16.005 3.169
786 HD3 ARG 108 2HD ARG 108 -16.857 -15.126 2.079
787 HE ARG 108 HE ARG 108 -15.782 -17.646 2.291
788 HH11 ARG 108 1HH1 ARG 108 -18.825 -16.286 1.284
789 HH12 ARG 108 2HH1 ARG 108 -19.161 -17.549 0.147
790 HH21 ARG 108 1HH2 ARG 108 -16.214 -19.314 0.797
791 HH22 ARG 108 2HH2 ARG 108 -17.676 -19.271 -0.129
792 H SER 109 H SER 109 -18.164 -13.809 6.973
793 HA SER 109 HA SER 109 -18.433 -16.297 8.506
794 HB2 SER 109 1HB SER 109 -19.687 -13.579 8.731
795 HB3 SER 109 2HB SER 109 -20.485 -14.980 9.446
796 HG SER 109 HG SER 109 -18.318 -15.359 10.444
797 H GLY 110 H GLY 110 -20.812 -17.055 8.671
798 HA2 GLY 110 1HA GLY 110 -21.735 -17.448 5.922
799 HA3 GLY 110 2HA GLY 110 -22.194 -18.412 7.318
800 HA PRO 111 HA PRO 111 -25.432 -15.116 6.185
801 HB2 PRO 111 1HB PRO 111 -27.282 -16.759 5.068
802 HB3 PRO 111 2HB PRO 111 -26.018 -15.956 4.129
803 HG2 PRO 111 1HG PRO 111 -26.118 -18.765 5.159
804 HG3 PRO 111 2HG PRO 111 -25.591 -18.173 3.573
805 HD2 PRO 111 1HD PRO 111 -23.846 -18.838 5.534
806 HD3 PRO 111 2HD PRO 111 -23.513 -17.553 4.355
807 H SER 112 H SER 112 -25.441 -18.302 7.606
808 HA SER 112 HA SER 112 -27.833 -18.637 8.777
809 HB2 SER 112 1HB SER 112 -26.683 -19.650 10.718
810 HB3 SER 112 2HB SER 112 -25.951 -20.142 9.191
811 HG SER 112 HG SER 112 -24.296 -18.664 9.551
812 H SER 113 H SER 113 -25.328 -16.423 9.968
813 HA SER 113 HA SER 113 -26.880 -15.480 12.164
814 HB2 SER 113 1HB SER 113 -24.456 -14.280 10.804
815 HB3 SER 113 2HB SER 113 -25.140 -13.712 12.327
816 HG SER 113 HG SER 113 -24.162 -15.283 13.311
817 H GLY 114 H GLY 114 -28.806 -14.575 11.700
818 HA2 GLY 114 1HA GLY 114 -28.785 -12.038 10.290
819 HA3 GLY 114 2HA GLY 114 -29.754 -13.298 9.540
Start of MODEL 6
1 H1 GLY 1 H GLY 1 22.247 13.598 0.283
2 HA2 GLY 1 1HA GLY 1 20.811 12.669 -1.422
3 HA3 GLY 1 2HA GLY 1 21.053 14.364 -1.821
4 H SER 2 H SER 2 20.340 12.805 -3.847
5 HA SER 2 HA SER 2 22.844 12.378 -5.342
6 HB2 SER 2 1HB SER 2 20.301 10.771 -5.324
7 HB3 SER 2 2HB SER 2 21.387 10.732 -6.713
8 HG SER 2 HG SER 2 21.960 9.991 -4.038
9 H SER 3 H SER 3 22.760 12.820 -7.618
10 HA SER 3 HA SER 3 20.798 14.912 -8.262
11 HB2 SER 3 1HB SER 3 23.625 14.411 -9.157
12 HB3 SER 3 2HB SER 3 22.546 15.430 -10.110
13 HG SER 3 HG SER 3 23.089 16.945 -8.769
14 H GLY 4 H GLY 4 22.652 12.350 -9.925
15 HA2 GLY 4 1HA GLY 4 21.499 12.165 -12.326
16 HA3 GLY 4 2HA GLY 4 21.848 10.724 -11.384
17 H SER 5 H SER 5 20.115 10.151 -9.740
18 HA SER 5 HA SER 5 17.691 9.716 -11.096
19 HB2 SER 5 1HB SER 5 16.936 8.635 -9.112
20 HB3 SER 5 2HB SER 5 18.671 8.332 -9.199
21 HG SER 5 HG SER 5 18.344 9.000 -7.153
22 H SER 6 H SER 6 15.743 10.722 -11.056
23 HA SER 6 HA SER 6 15.655 13.336 -9.718
24 HB2 SER 6 1HB SER 6 14.009 13.990 -11.356
25 HB3 SER 6 2HB SER 6 15.367 13.256 -12.208
26 HG SER 6 HG SER 6 14.144 11.321 -12.313
27 H GLY 7 H GLY 7 13.642 14.033 -8.750
28 HA2 GLY 7 1HA GLY 7 11.907 13.744 -7.274
29 HA3 GLY 7 2HA GLY 7 11.414 12.414 -8.311
30 HA PRO 8 HA PRO 8 12.680 10.846 -4.070
31 HB2 PRO 8 1HB PRO 8 10.293 9.706 -3.457
32 HB3 PRO 8 2HB PRO 8 10.681 11.388 -3.075
33 HG2 PRO 8 1HG PRO 8 9.093 10.282 -5.359
34 HG3 PRO 8 2HG PRO 8 8.755 11.694 -4.341
35 HD2 PRO 8 1HD PRO 8 9.829 11.908 -6.817
36 HD3 PRO 8 2HD PRO 8 10.214 13.043 -5.507
37 H VAL 9 H VAL 9 13.635 8.910 -3.991
38 HA VAL 9 HA VAL 9 12.620 6.775 -5.754
39 HB VAL 9 HB VAL 9 14.931 5.935 -5.919
40 HG11 VAL 9 1HG1 VAL 9 15.232 7.162 -7.758
41 HG12 VAL 9 2HG1 VAL 9 13.801 8.066 -7.258
42 HG13 VAL 9 3HG1 VAL 9 15.410 8.652 -6.833
43 HG21 VAL 9 1HG2 VAL 9 16.737 7.647 -5.266
44 HG22 VAL 9 2HG2 VAL 9 15.500 8.335 -4.212
45 HG23 VAL 9 3HG2 VAL 9 16.020 6.664 -3.989
46 H ALA 10 H ALA 10 14.295 7.485 -2.712
47 HA ALA 10 HA ALA 10 14.663 5.075 -1.570
48 HB1 ALA 10 1HB ALA 10 13.414 7.452 -0.196
49 HB2 ALA 10 2HB ALA 10 14.201 6.093 0.608
50 HB3 ALA 10 3HB ALA 10 15.140 7.171 -0.426
51 H GLY 11 H GLY 11 11.548 6.658 -2.037
52 HA2 GLY 11 1HA GLY 11 9.400 5.869 -1.867
53 HA3 GLY 11 2HA GLY 11 10.089 4.275 -2.131
54 HA PRO 12 HA PRO 12 8.527 5.009 2.342
55 HB2 PRO 12 1HB PRO 12 6.037 3.944 2.148
56 HB3 PRO 12 2HB PRO 12 6.369 5.663 1.902
57 HG2 PRO 12 1HG PRO 12 5.988 3.497 -0.130
58 HG3 PRO 12 2HG PRO 12 5.351 5.152 -0.126
59 HD2 PRO 12 1HD PRO 12 7.513 4.428 -1.586
60 HD3 PRO 12 2HD PRO 12 7.330 6.051 -0.891
61 H TYR 13 H TYR 13 8.274 3.330 3.887
62 HA TYR 13 HA TYR 13 8.629 0.609 2.815
63 HB2 TYR 13 1HB TYR 13 10.766 1.152 3.623
64 HB3 TYR 13 2HB TYR 13 10.121 2.016 5.014
65 HD1 TYR 13 1HD TYR 13 10.197 -1.423 3.555
66 HD2 TYR 13 2HD TYR 13 10.143 0.967 7.075
67 HE1 TYR 13 1HE TYR 13 10.462 -3.447 4.926
68 HE2 TYR 13 2HE TYR 13 10.409 -1.051 8.456
69 HH TYR 13 HH TYR 13 11.052 -3.276 8.360
70 H ILE 14 H ILE 14 6.888 -0.545 3.297
71 HA ILE 14 HA ILE 14 5.026 0.127 5.307
72 HB ILE 14 HB ILE 14 5.382 -2.559 3.976
73 HG12 ILE 14 1HG1 ILE 14 3.446 -0.429 3.109
74 HG13 ILE 14 2HG1 ILE 14 5.097 -0.445 2.497
75 HG21 ILE 14 1HG2 ILE 14 2.911 -2.711 4.424
76 HG22 ILE 14 2HG2 ILE 14 3.946 -2.782 5.849
77 HG23 ILE 14 3HG2 ILE 14 3.089 -1.292 5.455
78 HD11 ILE 14 1HD1 ILE 14 2.958 -1.764 1.409
79 HD12 ILE 14 2HD1 ILE 14 4.658 -2.100 1.081
80 HD13 ILE 14 3HD1 ILE 14 3.794 -3.034 2.301
81 H THR 15 H THR 15 5.187 -0.124 7.425
82 HA THR 15 HA THR 15 6.802 -2.359 8.466
83 HB THR 15 HB THR 15 7.799 -1.063 10.082
84 HG1 THR 15 1HG THR 15 5.949 -0.188 11.026
85 HG21 THR 15 1HG2 THR 15 8.052 -0.139 7.575
86 HG22 THR 15 2HG2 THR 15 8.900 0.570 8.949
87 HG23 THR 15 3HG2 THR 15 7.414 1.309 8.353
88 H PHE 16 H PHE 16 3.817 -1.795 7.967
89 HA PHE 16 HA PHE 16 2.896 -3.117 10.344
90 HB2 PHE 16 1HB PHE 16 2.938 -0.522 10.756
91 HB3 PHE 16 2HB PHE 16 1.475 -0.544 9.777
92 HD1 PHE 16 2HD PHE 16 -0.334 -2.286 10.514
93 HD2 PHE 16 1HD PHE 16 2.769 -0.817 13.029
94 HE1 PHE 16 2HE PHE 16 -1.651 -2.910 12.496
95 HE2 PHE 16 1HE PHE 16 1.458 -1.439 15.016
96 HZ PHE 16 HZ PHE 16 -0.756 -2.486 14.751
97 H THR 17 H THR 17 1.560 -4.617 9.612
98 HA THR 17 HA THR 17 -0.420 -3.918 7.575
99 HB THR 17 HB THR 17 0.135 -6.357 6.654
100 HG1 THR 17 1HG THR 17 2.468 -6.559 6.624
101 HG21 THR 17 1HG2 THR 17 2.046 -4.359 5.630
102 HG22 THR 17 2HG2 THR 17 0.361 -3.842 5.684
103 HG23 THR 17 3HG2 THR 17 0.812 -5.287 4.781
104 H ASP 18 H ASP 18 -2.302 -4.358 8.508
105 HA ASP 18 HA ASP 18 -2.717 -6.993 9.689
106 HB2 ASP 18 1HB ASP 18 -2.962 -4.392 11.150
107 HB3 ASP 18 2HB ASP 18 -4.072 -5.703 11.541
108 H ALA 19 H ALA 19 -4.725 -7.803 9.337
109 HA ALA 19 HA ALA 19 -6.411 -6.398 7.479
110 HB1 ALA 19 1HB ALA 19 -6.976 -9.030 8.829
111 HB2 ALA 19 2HB ALA 19 -7.665 -8.417 7.326
112 HB3 ALA 19 3HB ALA 19 -5.960 -8.861 7.397
113 H VAL 20 H VAL 20 -7.907 -4.978 8.057
114 HA VAL 20 HA VAL 20 -8.793 -4.708 10.764
115 HB VAL 20 HB VAL 20 -9.961 -3.363 8.328
116 HG11 VAL 20 1HG1 VAL 20 -10.197 -2.996 11.262
117 HG12 VAL 20 2HG1 VAL 20 -10.176 -1.548 10.253
118 HG13 VAL 20 3HG1 VAL 20 -11.403 -2.788 9.994
119 HG21 VAL 20 1HG2 VAL 20 -7.797 -2.211 10.059
120 HG22 VAL 20 2HG2 VAL 20 -7.424 -3.168 8.626
121 HG23 VAL 20 3HG2 VAL 20 -8.346 -1.673 8.472
122 H ASN 21 H ASN 21 -9.963 -6.328 7.938
123 HA ASN 21 HA ASN 21 -12.006 -7.654 9.432
124 HB2 ASN 21 1HB ASN 21 -12.725 -5.411 7.603
125 HB3 ASN 21 2HB ASN 21 -13.758 -6.838 7.600
126 HD21 ASN 21 1HD2 ASN 21 -14.468 -4.205 8.433
127 HD22 ASN 21 2HD2 ASN 21 -14.899 -4.295 10.104
128 H GLU 22 H GLU 22 -13.541 -8.787 7.596
129 HA GLU 22 HA GLU 22 -11.772 -10.560 6.247
130 HB2 GLU 22 1HB GLU 22 -13.945 -11.457 5.259
131 HB3 GLU 22 2HB GLU 22 -13.785 -11.515 7.009
132 HG2 GLU 22 1HG GLU 22 -15.092 -9.140 5.799
133 HG3 GLU 22 2HG GLU 22 -15.984 -10.660 5.840
134 H THR 23 H THR 23 -13.282 -7.608 5.383
135 HA THR 23 HA THR 23 -12.381 -7.971 2.602
136 HB THR 23 HB THR 23 -14.264 -6.436 1.921
137 HG1 THR 23 1HG THR 23 -15.604 -5.741 3.408
138 HG21 THR 23 1HG2 THR 23 -15.268 -8.314 1.268
139 HG22 THR 23 2HG2 THR 23 -15.841 -8.617 2.909
140 HG23 THR 23 3HG2 THR 23 -14.260 -9.213 2.402
141 H THR 24 H THR 24 -11.415 -6.593 5.204
142 HA THR 24 HA THR 24 -10.643 -4.093 3.874
143 HB THR 24 HB THR 24 -11.186 -4.062 6.821
144 HG1 THR 24 1HG THR 24 -13.315 -3.522 6.436
145 HG21 THR 24 1HG2 THR 24 -11.487 -1.693 6.447
146 HG22 THR 24 2HG2 THR 24 -11.386 -1.921 4.701
147 HG23 THR 24 3HG2 THR 24 -9.969 -2.204 5.712
148 H ILE 25 H ILE 25 -8.628 -3.238 4.519
149 HA ILE 25 HA ILE 25 -7.013 -4.770 6.394
150 HB ILE 25 HB ILE 25 -6.397 -4.568 3.458
151 HG12 ILE 25 1HG1 ILE 25 -6.320 -6.854 5.441
152 HG13 ILE 25 2HG1 ILE 25 -7.583 -6.568 4.249
153 HG21 ILE 25 1HG2 ILE 25 -4.149 -5.668 4.414
154 HG22 ILE 25 2HG2 ILE 25 -4.324 -3.940 4.110
155 HG23 ILE 25 3HG2 ILE 25 -4.526 -4.573 5.744
156 HD11 ILE 25 1HD1 ILE 25 -4.768 -7.475 3.825
157 HD12 ILE 25 2HD1 ILE 25 -6.275 -8.216 3.284
158 HD13 ILE 25 3HD1 ILE 25 -5.695 -6.737 2.519
159 H MET 26 H MET 26 -5.710 -3.479 7.532
160 HA MET 26 HA MET 26 -5.325 -0.726 6.565
161 HB2 MET 26 1HB MET 26 -6.412 -0.481 8.586
162 HB3 MET 26 2HB MET 26 -5.668 -1.913 9.283
163 HG2 MET 26 1HG MET 26 -3.716 -0.796 9.825
164 HG3 MET 26 2HG MET 26 -4.015 0.495 8.663
165 HE1 MET 26 1HE MET 26 -5.810 2.991 9.869
166 HE2 MET 26 2HE MET 26 -4.331 3.047 10.829
167 HE3 MET 26 3HE MET 26 -4.288 2.427 9.178
168 H LEU 27 H LEU 27 -3.336 -0.032 6.104
169 HA LEU 27 HA LEU 27 -1.032 -1.475 7.214
170 HB2 LEU 27 1HB LEU 27 0.000 -1.776 5.171
171 HB3 LEU 27 2HB LEU 27 -1.688 -2.129 4.808
172 HG LEU 27 HG LEU 27 -0.544 0.596 4.301
173 HD11 LEU 27 1HD1 LEU 27 0.465 -1.716 3.127
174 HD12 LEU 27 2HD1 LEU 27 0.654 -0.060 2.552
175 HD13 LEU 27 3HD1 LEU 27 -0.665 -1.060 1.943
176 HD21 LEU 27 1HD2 LEU 27 -2.559 -0.691 2.565
177 HD22 LEU 27 2HD2 LEU 27 -2.443 0.975 3.133
178 HD23 LEU 27 3HD2 LEU 27 -3.076 -0.279 4.200
179 H LYS 28 H LYS 28 0.808 -0.244 7.558
180 HA LYS 28 HA LYS 28 0.551 2.645 7.041
181 HB2 LYS 28 1HB LYS 28 1.776 1.432 9.522
182 HB3 LYS 28 2HB LYS 28 1.497 3.139 9.202
183 HG2 LYS 28 1HG LYS 28 -0.759 2.987 9.600
184 HG3 LYS 28 2HG LYS 28 -0.820 1.266 9.215
185 HD2 LYS 28 1HD LYS 28 0.004 0.642 11.292
186 HD3 LYS 28 2HD LYS 28 0.728 2.223 11.591
187 HE2 LYS 28 1HE LYS 28 -2.245 1.802 11.406
188 HE3 LYS 28 2HE LYS 28 -1.357 1.657 12.922
189 HZ1 LYS 28 1HZ LYS 28 -0.963 3.880 13.013
190 HZ2 LYS 28 2HZ LYS 28 -2.431 3.916 12.175
191 HZ3 LYS 28 3HZ LYS 28 -0.973 4.085 11.334
192 H TRP 29 H TRP 29 2.395 3.728 6.443
193 HA TRP 29 HA TRP 29 4.806 2.075 6.065
194 HB2 TRP 29 1HB TRP 29 5.255 3.532 4.051
195 HB3 TRP 29 2HB TRP 29 3.874 2.448 3.899
196 HD1 TRP 29 HD TRP 29 4.753 6.157 4.193
197 HE1 TRP 29 1HE TRP 29 2.687 7.547 3.543
198 HE3 TRP 29 3HE TRP 29 1.319 2.387 3.829
199 HZ2 TRP 29 2HZ TRP 29 -0.038 7.105 2.954
200 HZ3 TRP 29 3HZ TRP 29 -0.996 2.955 3.218
201 HH2 TRP 29 HH TRP 29 -1.658 5.266 2.791
202 H MET 30 H MET 30 6.839 3.181 6.159
203 HA MET 30 HA MET 30 6.718 5.632 7.787
204 HB2 MET 30 1HB MET 30 8.501 4.906 9.039
205 HB3 MET 30 2HB MET 30 7.755 3.363 8.644
206 HG2 MET 30 1HG MET 30 9.348 2.981 6.888
207 HG3 MET 30 2HG MET 30 10.035 4.589 7.112
208 HE1 MET 30 1HE MET 30 12.716 4.386 8.874
209 HE2 MET 30 2HE MET 30 11.283 5.396 8.682
210 HE3 MET 30 3HE MET 30 11.684 4.725 10.263
211 H TYR 31 H TYR 31 8.182 7.312 7.370
212 HA TYR 31 HA TYR 31 9.404 7.212 4.691
213 HB2 TYR 31 1HB TYR 31 7.485 8.811 4.998
214 HB3 TYR 31 2HB TYR 31 8.475 9.684 6.162
215 HD1 TYR 31 1HD TYR 31 8.361 8.590 2.612
216 HD2 TYR 31 2HD TYR 31 10.007 11.307 5.442
217 HE1 TYR 31 1HE TYR 31 9.361 9.887 0.776
218 HE2 TYR 31 2HE TYR 31 11.010 12.612 3.615
219 HH TYR 31 HH TYR 31 10.309 11.908 0.253
220 H ILE 32 H ILE 32 11.534 7.480 4.541
221 HA ILE 32 HA ILE 32 12.997 8.296 6.956
222 HB ILE 32 HB ILE 32 13.981 6.768 4.544
223 HG12 ILE 32 1HG1 ILE 32 14.301 5.043 6.534
224 HG13 ILE 32 2HG1 ILE 32 12.989 5.975 7.246
225 HG21 ILE 32 1HG2 ILE 32 16.026 6.423 5.878
226 HG22 ILE 32 2HG2 ILE 32 15.753 8.119 5.481
227 HG23 ILE 32 3HG2 ILE 32 15.389 7.523 7.100
228 HD11 ILE 32 1HD1 ILE 32 11.562 5.476 5.382
229 HD12 ILE 32 2HD1 ILE 32 12.884 4.667 4.541
230 HD13 ILE 32 3HD1 ILE 32 12.229 3.976 6.025
231 HA PRO 33 HA PRO 33 13.625 12.048 4.500
232 HB2 PRO 33 1HB PRO 33 14.403 13.555 6.619
233 HB3 PRO 33 2HB PRO 33 12.707 13.232 6.242
234 HG2 PRO 33 1HG PRO 33 14.486 11.906 8.252
235 HG3 PRO 33 2HG PRO 33 12.798 12.424 8.420
236 HD2 PRO 33 1HD PRO 33 13.492 9.848 7.955
237 HD3 PRO 33 2HD PRO 33 11.986 10.558 7.339
238 H ALA 34 H ALA 34 15.740 10.093 6.339
239 HA ALA 34 HA ALA 34 18.129 11.538 6.251
240 HB1 ALA 34 1HB ALA 34 19.250 9.370 6.486
241 HB2 ALA 34 2HB ALA 34 17.875 9.520 7.580
242 HB3 ALA 34 3HB ALA 34 17.733 8.551 6.113
243 H SER 35 H SER 35 17.283 8.826 4.090
244 HA SER 35 HA SER 35 19.144 9.849 2.101
245 HB2 SER 35 1HB SER 35 19.143 7.439 2.614
246 HB3 SER 35 2HB SER 35 17.462 7.330 2.092
247 HG SER 35 HG SER 35 19.239 6.790 0.529
248 H ASN 36 H ASN 36 16.906 11.488 2.538
249 HA ASN 36 HA ASN 36 15.325 11.085 0.087
250 HB2 ASN 36 1HB ASN 36 13.947 11.138 2.093
251 HB3 ASN 36 2HB ASN 36 14.666 12.671 2.578
252 HD21 ASN 36 1HD2 ASN 36 12.880 13.919 2.547
253 HD22 ASN 36 2HD2 ASN 36 11.953 14.252 1.127
254 H ASN 37 H ASN 37 14.861 12.922 -1.232
255 HA ASN 37 HA ASN 37 17.067 14.824 -1.283
256 HB2 ASN 37 1HB ASN 37 14.915 14.096 -3.267
257 HB3 ASN 37 2HB ASN 37 15.990 15.470 -3.510
258 HD21 ASN 37 1HD2 ASN 37 15.523 12.398 -4.369
259 HD22 ASN 37 2HD2 ASN 37 17.150 11.903 -4.675
260 H ASN 38 H ASN 38 15.061 15.085 0.777
261 HA ASN 38 HA ASN 38 13.497 16.552 1.630
262 HB2 ASN 38 1HB ASN 38 15.794 17.623 1.822
263 HB3 ASN 38 2HB ASN 38 15.362 18.593 0.417
264 HD21 ASN 38 1HD2 ASN 38 15.427 20.522 1.515
265 HD22 ASN 38 2HD2 ASN 38 14.249 20.967 2.698
266 H THR 39 H THR 39 12.612 15.648 -0.850
267 HA THR 39 HA THR 39 11.555 18.061 -2.156
268 HB THR 39 HB THR 39 12.745 16.354 -3.573
269 HG1 THR 39 1HG THR 39 11.321 17.724 -4.608
270 HG21 THR 39 1HG2 THR 39 10.262 14.696 -3.145
271 HG22 THR 39 2HG2 THR 39 11.797 14.379 -2.337
272 HG23 THR 39 3HG2 THR 39 11.687 14.277 -4.094
273 HA PRO 40 HA PRO 40 7.578 17.324 -0.401
274 HB2 PRO 40 1HB PRO 40 6.086 18.745 -2.170
275 HB3 PRO 40 2HB PRO 40 7.107 19.506 -0.944
276 HG2 PRO 40 1HG PRO 40 7.663 19.042 -3.848
277 HG3 PRO 40 2HG PRO 40 7.984 20.481 -2.864
278 HD2 PRO 40 1HD PRO 40 9.910 18.682 -3.486
279 HD3 PRO 40 2HD PRO 40 9.906 19.587 -1.959
280 H ILE 41 H ILE 41 6.212 15.659 -0.552
281 HA ILE 41 HA ILE 41 6.006 14.236 -3.100
282 HB ILE 41 HB ILE 41 4.964 13.320 -0.423
283 HG12 ILE 41 1HG1 ILE 41 7.669 12.825 -1.686
284 HG13 ILE 41 2HG1 ILE 41 7.358 13.735 -0.212
285 HG21 ILE 41 1HG2 ILE 41 4.775 11.197 -1.378
286 HG22 ILE 41 2HG2 ILE 41 4.189 12.286 -2.635
287 HG23 ILE 41 3HG2 ILE 41 5.817 11.616 -2.739
288 HD11 ILE 41 1HD1 ILE 41 6.533 10.873 -0.419
289 HD12 ILE 41 2HD1 ILE 41 8.201 11.307 -0.046
290 HD13 ILE 41 3HD1 ILE 41 6.895 11.835 1.014
291 H HIS 42 H HIS 42 4.148 14.017 -4.223
292 HA HIS 42 HA HIS 42 2.019 15.823 -3.748
293 HB2 HIS 42 1HB HIS 42 2.534 13.620 -5.704
294 HB3 HIS 42 2HB HIS 42 0.904 14.271 -5.568
295 HD1 HIS 42 1HD HIS 42 2.631 14.596 -8.135
296 HD2 HIS 42 2HD HIS 42 2.294 17.435 -5.120
297 HE1 HIS 42 1HE HIS 42 3.203 16.794 -9.214
298 HE2 HIS 42 2HE HIS 42 3.075 18.485 -7.352
299 H GLY 43 H GLY 43 2.372 12.329 -3.275
300 HA2 GLY 43 1HA GLY 43 0.529 12.283 -1.122
301 HA3 GLY 43 2HA GLY 43 -0.250 11.703 -2.587
302 H PHE 44 H PHE 44 -0.504 9.601 -1.886
303 HA PHE 44 HA PHE 44 1.929 7.993 -1.957
304 HB2 PHE 44 1HB PHE 44 0.026 8.141 0.360
305 HB3 PHE 44 2HB PHE 44 0.897 6.649 0.023
306 HD1 PHE 44 2HD PHE 44 3.529 7.308 -0.631
307 HD2 PHE 44 1HD PHE 44 0.944 9.315 2.091
308 HE1 PHE 44 2HE PHE 44 5.486 8.176 0.582
309 HE2 PHE 44 1HE PHE 44 2.897 10.187 3.308
310 HZ PHE 44 HZ PHE 44 5.171 9.617 2.554
311 H TYR 45 H TYR 45 1.632 6.421 -3.377
312 HA TYR 45 HA TYR 45 -1.096 5.611 -4.059
313 HB2 TYR 45 1HB TYR 45 1.536 5.520 -5.467
314 HB3 TYR 45 2HB TYR 45 0.305 4.346 -5.914
315 HD1 TYR 45 2HD TYR 45 -2.170 5.825 -5.811
316 HD2 TYR 45 1HD TYR 45 1.662 7.110 -7.141
317 HE1 TYR 45 2HE TYR 45 -3.241 7.496 -7.264
318 HE2 TYR 45 1HE TYR 45 0.601 8.785 -8.597
319 HH TYR 45 HH TYR 45 -1.476 9.265 -9.643
320 H ILE 46 H ILE 46 -1.835 3.539 -3.879
321 HA ILE 46 HA ILE 46 -0.014 1.561 -2.679
322 HB ILE 46 HB ILE 46 -2.885 2.061 -1.885
323 HG12 ILE 46 1HG1 ILE 46 -0.551 2.147 -0.014
324 HG13 ILE 46 2HG1 ILE 46 -0.867 3.537 -1.047
325 HG21 ILE 46 1HG2 ILE 46 -0.942 -0.027 -0.906
326 HG22 ILE 46 2HG2 ILE 46 -2.550 0.272 -0.249
327 HG23 ILE 46 3HG2 ILE 46 -2.368 -0.320 -1.900
328 HD11 ILE 46 1HD1 ILE 46 -3.223 3.501 -0.121
329 HD12 ILE 46 2HD1 ILE 46 -2.617 2.367 1.086
330 HD13 ILE 46 3HD1 ILE 46 -1.940 3.992 0.984
331 H TYR 47 H TYR 47 0.062 -0.306 -3.739
332 HA TYR 47 HA TYR 47 -2.093 -0.910 -5.652
333 HB2 TYR 47 1HB TYR 47 0.804 -1.779 -5.701
334 HB3 TYR 47 2HB TYR 47 -0.413 -2.228 -6.890
335 HD1 TYR 47 2HD TYR 47 0.967 0.877 -5.322
336 HD2 TYR 47 1HD TYR 47 -0.444 -1.028 -8.855
337 HE1 TYR 47 2HE TYR 47 1.494 2.901 -6.616
338 HE2 TYR 47 1HE TYR 47 0.080 0.991 -10.160
339 HH TYR 47 HH TYR 47 1.125 2.984 -10.129
340 H TYR 48 H TYR 48 -2.884 -3.019 -5.808
341 HA TYR 48 HA TYR 48 -1.921 -5.096 -4.064
342 HB2 TYR 48 1HB TYR 48 -4.170 -5.341 -2.920
343 HB3 TYR 48 2HB TYR 48 -3.194 -3.972 -2.400
344 HD1 TYR 48 2HD TYR 48 -3.767 -1.677 -3.234
345 HD2 TYR 48 1HD TYR 48 -6.314 -5.024 -3.875
346 HE1 TYR 48 2HE TYR 48 -5.637 -0.154 -3.717
347 HE2 TYR 48 1HE TYR 48 -8.191 -3.510 -4.361
348 HH TYR 48 HH TYR 48 -8.233 -0.871 -5.287
349 H ARG 49 H ARG 49 -2.749 -7.133 -4.575
350 HA ARG 49 HA ARG 49 -4.888 -7.425 -6.480
351 HB2 ARG 49 1HB ARG 49 -3.605 -8.428 -8.253
352 HB3 ARG 49 2HB ARG 49 -2.941 -6.835 -7.915
353 HG2 ARG 49 1HG ARG 49 -1.013 -8.023 -8.061
354 HG3 ARG 49 2HG ARG 49 -1.342 -8.225 -6.339
355 HD2 ARG 49 1HD ARG 49 -2.691 -10.325 -7.212
356 HD3 ARG 49 2HD ARG 49 -1.572 -10.182 -8.568
357 HE ARG 49 HE ARG 49 -0.270 -10.122 -6.013
358 HH11 ARG 49 1HH1 ARG 49 -1.556 -12.182 -8.507
359 HH12 ARG 49 2HH1 ARG 49 -0.542 -13.527 -8.100
360 HH21 ARG 49 1HH2 ARG 49 1.070 -11.886 -5.467
361 HH22 ARG 49 2HH2 ARG 49 0.950 -13.358 -6.370
362 HA PRO 50 HA PRO 50 -5.234 -11.231 -4.293
363 HB2 PRO 50 1HB PRO 50 -6.843 -12.568 -6.024
364 HB3 PRO 50 2HB PRO 50 -7.423 -11.256 -4.991
365 HG2 PRO 50 1HG PRO 50 -6.641 -11.187 -7.879
366 HG3 PRO 50 2HG PRO 50 -8.027 -10.426 -7.077
367 HD2 PRO 50 1HD PRO 50 -5.783 -9.054 -7.722
368 HD3 PRO 50 2HD PRO 50 -6.767 -8.661 -6.297
369 H THR 51 H THR 51 -4.356 -13.274 -4.251
370 HA THR 51 HA THR 51 -2.137 -13.834 -5.837
371 HB THR 51 HB THR 51 -2.925 -14.855 -3.542
372 HG1 THR 51 1HG THR 51 -1.527 -16.747 -4.138
373 HG21 THR 51 1HG2 THR 51 -3.546 -17.279 -5.112
374 HG22 THR 51 2HG2 THR 51 -4.805 -16.045 -5.067
375 HG23 THR 51 3HG2 THR 51 -4.190 -16.733 -3.564
376 H ASP 52 H ASP 52 -5.482 -14.404 -6.425
377 HA ASP 52 HA ASP 52 -5.062 -16.456 -8.412
378 HB2 ASP 52 1HB ASP 52 -7.416 -15.023 -7.277
379 HB3 ASP 52 2HB ASP 52 -7.587 -15.748 -8.873
380 H SER 53 H SER 53 -4.317 -13.318 -8.426
381 HA SER 53 HA SER 53 -5.460 -12.389 -10.858
382 HB2 SER 53 1HB SER 53 -3.218 -11.475 -9.088
383 HB3 SER 53 2HB SER 53 -3.415 -10.754 -10.685
384 HG SER 53 HG SER 53 -5.792 -10.706 -9.724
385 H ASP 54 H ASP 54 -3.873 -11.610 -12.654
386 HA ASP 54 HA ASP 54 -2.144 -13.888 -13.367
387 HB2 ASP 54 1HB ASP 54 -4.318 -13.453 -14.709
388 HB3 ASP 54 2HB ASP 54 -3.440 -12.091 -15.399
389 H ASN 55 H ASN 55 -2.638 -10.492 -14.353
390 HA ASN 55 HA ASN 55 0.244 -10.049 -14.010
391 HB2 ASN 55 1HB ASN 55 0.274 -8.731 -16.117
392 HB3 ASN 55 2HB ASN 55 -0.066 -10.439 -16.384
393 HD21 ASN 55 1HD2 ASN 55 -2.345 -11.037 -16.621
394 HD22 ASN 55 2HD2 ASN 55 -3.410 -9.926 -17.406
395 H ASP 56 H ASP 56 0.600 -7.521 -14.502
396 HA ASP 56 HA ASP 56 -0.316 -6.098 -12.372
397 HB2 ASP 56 1HB ASP 56 0.441 -5.115 -15.125
398 HB3 ASP 56 2HB ASP 56 0.124 -4.027 -13.777
399 H SER 57 H SER 57 -2.047 -6.850 -15.267
400 HA SER 57 HA SER 57 -3.949 -4.892 -15.460
401 HB2 SER 57 1HB SER 57 -4.096 -7.863 -15.896
402 HB3 SER 57 2HB SER 57 -5.521 -6.851 -16.130
403 HG SER 57 HG SER 57 -3.941 -7.287 -17.972
404 H ASP 58 H ASP 58 -3.467 -7.074 -12.869
405 HA ASP 58 HA ASP 58 -6.144 -6.633 -11.783
406 HB2 ASP 58 1HB ASP 58 -3.922 -8.535 -11.211
407 HB3 ASP 58 2HB ASP 58 -5.017 -8.129 -9.893
408 H TYR 59 H TYR 59 -2.745 -6.035 -10.991
409 HA TYR 59 HA TYR 59 -2.961 -4.924 -8.494
410 HB2 TYR 59 1HB TYR 59 -1.111 -4.500 -10.786
411 HB3 TYR 59 2HB TYR 59 -1.046 -3.337 -9.466
412 HD1 TYR 59 1HD TYR 59 -1.457 -4.955 -7.097
413 HD2 TYR 59 2HD TYR 59 0.762 -5.851 -10.615
414 HE1 TYR 59 1HE TYR 59 -0.042 -6.496 -5.804
415 HE2 TYR 59 2HE TYR 59 2.182 -7.396 -9.333
416 HH TYR 59 HH TYR 59 1.506 -8.749 -6.685
417 H LYS 60 H LYS 60 -3.978 -3.228 -7.668
418 HA LYS 60 HA LYS 60 -5.093 -1.225 -9.493
419 HB2 LYS 60 1HB LYS 60 -5.826 -2.224 -6.777
420 HB3 LYS 60 2HB LYS 60 -6.278 -0.582 -7.214
421 HG2 LYS 60 1HG LYS 60 -7.584 -1.354 -9.055
422 HG3 LYS 60 2HG LYS 60 -6.985 -3.002 -8.855
423 HD2 LYS 60 1HD LYS 60 -7.992 -2.669 -6.423
424 HD3 LYS 60 2HD LYS 60 -9.007 -1.502 -7.274
425 HE2 LYS 60 1HE LYS 60 -9.353 -3.446 -8.967
426 HE3 LYS 60 2HE LYS 60 -8.805 -4.465 -7.637
427 HZ1 LYS 60 1HZ LYS 60 -11.041 -4.445 -7.269
428 HZ2 LYS 60 2HZ LYS 60 -11.259 -2.882 -7.876
429 HZ3 LYS 60 3HZ LYS 60 -10.598 -3.106 -6.335
430 H LYS 61 H LYS 61 -5.427 0.957 -8.024
431 HA LYS 61 HA LYS 61 -2.919 1.655 -6.715
432 HB2 LYS 61 1HB LYS 61 -2.628 2.120 -9.160
433 HB3 LYS 61 2HB LYS 61 -3.964 3.258 -9.055
434 HG2 LYS 61 1HG LYS 61 -2.744 4.709 -7.645
435 HG3 LYS 61 2HG LYS 61 -1.491 3.497 -7.367
436 HD2 LYS 61 1HD LYS 61 -0.554 4.994 -8.917
437 HD3 LYS 61 2HD LYS 61 -1.064 3.605 -9.880
438 HE2 LYS 61 1HE LYS 61 -3.109 4.791 -10.505
439 HE3 LYS 61 2HE LYS 61 -2.608 6.175 -9.534
440 HZ1 LYS 61 1HZ LYS 61 -2.031 5.727 -12.182
441 HZ2 LYS 61 2HZ LYS 61 -0.578 5.418 -11.375
442 HZ3 LYS 61 3HZ LYS 61 -1.348 6.912 -11.186
443 H ASP 62 H ASP 62 -3.502 2.569 -4.869
444 HA ASP 62 HA ASP 62 -5.882 4.307 -4.848
445 HB2 ASP 62 1HB ASP 62 -4.879 2.290 -2.883
446 HB3 ASP 62 2HB ASP 62 -5.753 3.696 -2.281
447 H MET 63 H MET 63 -5.258 6.363 -4.811
448 HA MET 63 HA MET 63 -2.718 7.186 -3.773
449 HB2 MET 63 1HB MET 63 -4.230 8.218 -5.681
450 HB3 MET 63 2HB MET 63 -4.901 9.143 -4.344
451 HG2 MET 63 1HG MET 63 -1.947 9.021 -4.787
452 HG3 MET 63 2HG MET 63 -2.957 10.134 -5.707
453 HE1 MET 63 1HE MET 63 -4.020 12.811 -3.450
454 HE2 MET 63 2HE MET 63 -4.297 11.869 -4.915
455 HE3 MET 63 3HE MET 63 -5.114 11.428 -3.415
456 H VAL 64 H VAL 64 -2.381 8.698 -2.050
457 HA VAL 64 HA VAL 64 -4.548 9.032 -0.127
458 HB VAL 64 HB VAL 64 -1.913 7.866 0.765
459 HG11 VAL 64 1HG1 VAL 64 -3.490 9.254 2.291
460 HG12 VAL 64 2HG1 VAL 64 -4.489 7.799 2.284
461 HG13 VAL 64 3HG1 VAL 64 -2.831 7.730 2.884
462 HG21 VAL 64 1HG2 VAL 64 -2.809 6.099 -0.455
463 HG22 VAL 64 2HG2 VAL 64 -3.393 5.793 1.181
464 HG23 VAL 64 3HG2 VAL 64 -4.468 6.510 -0.020
465 H GLU 65 H GLU 65 -4.349 10.836 1.140
466 HA GLU 65 HA GLU 65 -3.066 13.055 0.324
467 HB2 GLU 65 1HB GLU 65 -3.146 12.599 3.277
468 HB3 GLU 65 2HB GLU 65 -3.571 14.037 2.358
469 HG2 GLU 65 1HG GLU 65 -5.176 11.532 2.734
470 HG3 GLU 65 2HG GLU 65 -5.586 13.178 3.210
471 H GLY 66 H GLY 66 -1.107 14.083 0.604
472 HA2 GLY 66 1HA GLY 66 1.188 12.457 0.798
473 HA3 GLY 66 2HA GLY 66 1.176 14.214 0.803
474 H ASP 67 H ASP 67 -0.603 14.226 3.199
475 HA ASP 67 HA ASP 67 1.524 14.052 5.162
476 HB2 ASP 67 1HB ASP 67 -0.170 15.088 6.685
477 HB3 ASP 67 2HB ASP 67 0.158 16.032 5.235
478 H ARG 68 H ARG 68 -1.142 12.178 4.115
479 HA ARG 68 HA ARG 68 -1.547 10.768 6.588
480 HB2 ARG 68 1HB ARG 68 -3.217 11.124 4.627
481 HB3 ARG 68 2HB ARG 68 -2.404 9.746 3.899
482 HG2 ARG 68 1HG ARG 68 -4.081 8.659 4.970
483 HG3 ARG 68 2HG ARG 68 -2.885 8.672 6.267
484 HD2 ARG 68 1HD ARG 68 -4.017 10.242 7.481
485 HD3 ARG 68 2HD ARG 68 -4.731 10.988 6.053
486 HE ARG 68 HE ARG 68 -5.807 8.808 7.600
487 HH11 ARG 68 1HH1 ARG 68 -5.828 10.453 4.532
488 HH12 ARG 68 2HH1 ARG 68 -7.408 9.892 4.095
489 HH21 ARG 68 1HH2 ARG 68 -7.887 8.063 7.036
490 HH22 ARG 68 2HH2 ARG 68 -8.578 8.533 5.520
491 H TYR 69 H TYR 69 -0.565 8.970 7.288
492 HA TYR 69 HA TYR 69 1.372 7.682 5.479
493 HB2 TYR 69 1HB TYR 69 1.499 8.422 8.358
494 HB3 TYR 69 2HB TYR 69 2.294 6.929 7.872
495 HD1 TYR 69 2HD TYR 69 1.993 10.113 5.971
496 HD2 TYR 69 1HD TYR 69 4.569 7.439 8.048
497 HE1 TYR 69 2HE TYR 69 3.941 11.405 5.207
498 HE2 TYR 69 1HE TYR 69 6.524 8.724 7.291
499 HH TYR 69 HH TYR 69 6.532 10.777 4.825
500 H TRP 70 H TRP 70 -1.593 7.184 6.345
501 HA TRP 70 HA TRP 70 -1.277 4.285 6.476
502 HB2 TRP 70 1HB TRP 70 -2.743 3.990 8.331
503 HB3 TRP 70 2HB TRP 70 -1.554 5.193 8.823
504 HD1 TRP 70 HD TRP 70 -2.415 7.662 9.276
505 HE1 TRP 70 1HE TRP 70 -4.768 8.654 9.595
506 HE3 TRP 70 3HE TRP 70 -5.193 3.743 7.526
507 HZ2 TRP 70 2HZ TRP 70 -7.448 7.878 9.163
508 HZ3 TRP 70 3HZ TRP 70 -7.645 3.948 7.513
509 HH2 TRP 70 HH TRP 70 -8.747 5.974 8.315
510 H HIS 71 H HIS 71 -3.102 3.113 5.733
511 HA HIS 71 HA HIS 71 -5.408 4.541 4.739
512 HB2 HIS 71 1HB HIS 71 -3.753 4.879 2.933
513 HB3 HIS 71 2HB HIS 71 -3.563 3.134 2.796
514 HD1 HIS 71 1HD HIS 71 -6.346 5.710 2.484
515 HD2 HIS 71 2HD HIS 71 -5.209 2.016 0.961
516 HE1 HIS 71 1HE HIS 71 -8.036 5.168 0.702
517 HE2 HIS 71 2HE HIS 71 -7.377 2.890 -0.146
518 H SER 72 H SER 72 -7.171 3.265 4.686
519 HA SER 72 HA SER 72 -6.762 0.410 5.254
520 HB2 SER 72 1HB SER 72 -9.056 0.450 6.167
521 HB3 SER 72 2HB SER 72 -8.018 1.630 6.967
522 HG SER 72 HG SER 72 -10.219 2.015 5.337
523 H ILE 73 H ILE 73 -6.898 -0.820 3.500
524 HA ILE 73 HA ILE 73 -8.343 -0.025 1.158
525 HB ILE 73 HB ILE 73 -7.197 -2.752 1.750
526 HG12 ILE 73 1HG1 ILE 73 -5.797 -0.518 0.285
527 HG13 ILE 73 2HG1 ILE 73 -5.585 -0.784 2.012
528 HG21 ILE 73 1HG2 ILE 73 -7.889 -1.326 -0.813
529 HG22 ILE 73 2HG2 ILE 73 -7.005 -2.849 -0.728
530 HG23 ILE 73 3HG2 ILE 73 -8.667 -2.761 -0.145
531 HD11 ILE 73 1HD1 ILE 73 -4.930 -2.730 -0.187
532 HD12 ILE 73 2HD1 ILE 73 -3.782 -1.799 0.776
533 HD13 ILE 73 3HD1 ILE 73 -4.765 -3.047 1.540
534 H SER 74 H SER 74 -10.072 -1.215 0.166
535 HA SER 74 HA SER 74 -11.639 -2.938 1.935
536 HB2 SER 74 1HB SER 74 -12.923 -0.618 0.488
537 HB3 SER 74 2HB SER 74 -13.654 -1.680 1.690
538 HG SER 74 HG SER 74 -11.779 0.387 2.045
539 H HIS 75 H HIS 75 -13.712 -3.646 0.625
540 HA HIS 75 HA HIS 75 -14.534 -4.877 -1.103
541 HB2 HIS 75 1HB HIS 75 -12.854 -2.897 -2.636
542 HB3 HIS 75 2HB HIS 75 -13.831 -4.123 -3.439
543 HD1 HIS 75 1HD HIS 75 -15.500 -2.536 -4.495
544 HD2 HIS 75 2HD HIS 75 -15.187 -2.072 -0.378
545 HE1 HIS 75 1HE HIS 75 -17.396 -1.018 -3.843
546 HE2 HIS 75 2HE HIS 75 -17.136 -0.683 -1.361
547 H LEU 76 H LEU 76 -12.514 -6.076 0.277
548 HA LEU 76 HA LEU 76 -10.856 -7.343 -1.799
549 HB2 LEU 76 1HB LEU 76 -10.375 -7.530 1.157
550 HB3 LEU 76 2HB LEU 76 -9.250 -7.854 -0.161
551 HG LEU 76 HG LEU 76 -10.286 -5.081 0.169
552 HD11 LEU 76 1HD1 LEU 76 -7.994 -5.016 1.633
553 HD12 LEU 76 2HD1 LEU 76 -8.712 -6.536 2.165
554 HD13 LEU 76 3HD1 LEU 76 -9.624 -5.033 2.308
555 HD21 LEU 76 1HD2 LEU 76 -7.501 -5.254 -0.270
556 HD22 LEU 76 2HD2 LEU 76 -8.755 -4.742 -1.399
557 HD23 LEU 76 3HD2 LEU 76 -8.272 -6.437 -1.326
558 H GLN 77 H GLN 77 -10.231 -9.688 -1.070
559 HA GLN 77 HA GLN 77 -12.758 -11.102 -0.714
560 HB2 GLN 77 1HB GLN 77 -10.025 -12.118 -1.514
561 HB3 GLN 77 2HB GLN 77 -11.490 -13.090 -1.452
562 HG2 GLN 77 1HG GLN 77 -12.429 -12.021 -3.288
563 HG3 GLN 77 2HG GLN 77 -11.353 -10.632 -3.149
564 HE21 GLN 77 1HE2 GLN 77 -10.605 -10.733 -5.231
565 HE22 GLN 77 2HE2 GLN 77 -9.587 -12.003 -5.809
566 HA PRO 78 HA PRO 78 -11.943 -12.208 3.467
567 HB2 PRO 78 1HB PRO 78 -13.502 -14.425 3.632
568 HB3 PRO 78 2HB PRO 78 -14.164 -12.787 3.587
569 HG2 PRO 78 1HG PRO 78 -13.899 -14.784 1.373
570 HG3 PRO 78 2HG PRO 78 -15.261 -13.717 1.760
571 HD2 PRO 78 1HD PRO 78 -13.488 -13.159 -0.208
572 HD3 PRO 78 2HD PRO 78 -14.284 -11.892 0.748
573 H GLU 79 H GLU 79 -10.761 -13.667 4.711
574 HA GLU 79 HA GLU 79 -8.849 -14.956 4.919
575 HB2 GLU 79 1HB GLU 79 -9.527 -17.417 4.264
576 HB3 GLU 79 2HB GLU 79 -10.273 -16.609 5.635
577 HG2 GLU 79 1HG GLU 79 -12.246 -16.156 4.417
578 HG3 GLU 79 2HG GLU 79 -11.490 -16.610 2.891
579 H THR 80 H THR 80 -8.715 -13.518 2.510
580 HA THR 80 HA THR 80 -7.568 -15.481 0.639
581 HB THR 80 HB THR 80 -8.502 -12.656 0.098
582 HG1 THR 80 1HG THR 80 -10.320 -13.811 0.084
583 HG21 THR 80 1HG2 THR 80 -7.809 -12.870 -2.099
584 HG22 THR 80 2HG2 THR 80 -7.756 -14.631 -2.021
585 HG23 THR 80 3HG2 THR 80 -6.500 -13.674 -1.235
586 H SER 81 H SER 81 -5.442 -15.674 0.910
587 HA SER 81 HA SER 81 -3.849 -13.509 1.965
588 HB2 SER 81 1HB SER 81 -3.602 -16.119 2.316
589 HB3 SER 81 2HB SER 81 -2.622 -16.001 0.854
590 HG SER 81 HG SER 81 -1.379 -15.742 2.766
591 H TYR 82 H TYR 82 -3.361 -11.883 0.640
592 HA TYR 82 HA TYR 82 -2.181 -12.539 -1.970
593 HB2 TYR 82 1HB TYR 82 -3.313 -10.433 -2.849
594 HB3 TYR 82 2HB TYR 82 -4.356 -11.826 -2.578
595 HD1 TYR 82 1HD TYR 82 -3.295 -8.577 -1.145
596 HD2 TYR 82 2HD TYR 82 -6.179 -11.704 -1.082
597 HE1 TYR 82 1HE TYR 82 -4.745 -7.202 0.289
598 HE2 TYR 82 2HE TYR 82 -7.638 -10.338 0.351
599 HH TYR 82 HH TYR 82 -7.452 -7.192 0.698
600 H ASP 83 H ASP 83 -0.783 -10.863 -2.829
601 HA ASP 83 HA ASP 83 0.865 -9.720 -0.786
602 HB2 ASP 83 1HB ASP 83 2.421 -9.360 -2.442
603 HB3 ASP 83 2HB ASP 83 1.475 -10.645 -3.187
604 H ILE 84 H ILE 84 1.400 -7.494 -0.540
605 HA ILE 84 HA ILE 84 -0.411 -5.544 -1.736
606 HB ILE 84 HB ILE 84 -0.104 -5.838 1.255
607 HG12 ILE 84 1HG1 ILE 84 -2.662 -5.992 -0.325
608 HG13 ILE 84 2HG1 ILE 84 -1.673 -7.420 -0.043
609 HG21 ILE 84 1HG2 ILE 84 -1.249 -3.860 1.546
610 HG22 ILE 84 2HG2 ILE 84 -0.258 -3.488 0.137
611 HG23 ILE 84 3HG2 ILE 84 -1.959 -3.909 -0.067
612 HD11 ILE 84 1HD1 ILE 84 -2.951 -7.652 1.773
613 HD12 ILE 84 2HD1 ILE 84 -1.888 -6.427 2.467
614 HD13 ILE 84 3HD1 ILE 84 -3.439 -5.958 1.772
615 H LYS 85 H LYS 85 0.895 -4.062 -2.564
616 HA LYS 85 HA LYS 85 3.177 -3.140 -0.947
617 HB2 LYS 85 1HB LYS 85 4.515 -2.896 -2.949
618 HB3 LYS 85 2HB LYS 85 3.937 -4.553 -2.835
619 HG2 LYS 85 1HG LYS 85 2.244 -4.123 -4.496
620 HG3 LYS 85 2HG LYS 85 2.689 -2.415 -4.550
621 HD2 LYS 85 1HD LYS 85 4.739 -2.866 -5.587
622 HD3 LYS 85 2HD LYS 85 4.691 -4.573 -5.142
623 HE2 LYS 85 1HE LYS 85 4.227 -4.297 -7.510
624 HE3 LYS 85 2HE LYS 85 2.803 -4.908 -6.670
625 HZ1 LYS 85 1HZ LYS 85 1.659 -3.011 -7.037
626 HZ2 LYS 85 2HZ LYS 85 2.703 -2.888 -8.362
627 HZ3 LYS 85 3HZ LYS 85 3.024 -2.015 -6.949
628 H MET 86 H MET 86 4.039 -0.985 -2.015
629 HA MET 86 HA MET 86 1.987 0.689 -3.150
630 HB2 MET 86 1HB MET 86 1.971 2.325 -1.314
631 HB3 MET 86 2HB MET 86 1.341 0.766 -0.800
632 HG2 MET 86 1HG MET 86 3.265 0.271 0.440
633 HG3 MET 86 2HG MET 86 4.198 1.543 -0.344
634 HE1 MET 86 1HE MET 86 2.644 4.771 1.092
635 HE2 MET 86 2HE MET 86 3.229 3.978 -0.371
636 HE3 MET 86 3HE MET 86 1.513 3.923 0.036
637 H GLN 87 H GLN 87 2.834 3.043 -3.248
638 HA GLN 87 HA GLN 87 5.678 3.390 -3.166
639 HB2 GLN 87 1HB GLN 87 5.931 2.357 -5.196
640 HB3 GLN 87 2HB GLN 87 4.299 2.750 -5.722
641 HG2 GLN 87 1HG GLN 87 6.248 4.968 -5.412
642 HG3 GLN 87 2HG GLN 87 6.417 3.887 -6.794
643 HE21 GLN 87 1HE2 GLN 87 4.681 3.733 -8.284
644 HE22 GLN 87 2HE2 GLN 87 3.545 5.023 -8.452
645 H CYS 88 H CYS 88 6.300 5.540 -3.368
646 HA CYS 88 HA CYS 88 4.082 7.448 -3.254
647 HB2 CYS 88 1HB CYS 88 5.524 8.906 -2.071
648 HB3 CYS 88 2HB CYS 88 5.845 7.303 -1.421
649 HG CYS 88 HG CYS 88 8.070 9.316 -2.163
650 H PHE 89 H PHE 89 4.470 9.619 -4.230
651 HA PHE 89 HA PHE 89 6.301 9.757 -6.455
652 HB2 PHE 89 1HB PHE 89 4.672 9.960 -8.201
653 HB3 PHE 89 2HB PHE 89 4.329 8.467 -7.335
654 HD1 PHE 89 1HD PHE 89 2.616 8.777 -5.322
655 HD2 PHE 89 2HD PHE 89 2.904 11.317 -8.725
656 HE1 PHE 89 1HE PHE 89 0.297 9.517 -4.961
657 HE2 PHE 89 2HE PHE 89 0.586 12.062 -8.369
658 HZ PHE 89 HZ PHE 89 -0.720 11.162 -6.485
659 H ASN 90 H ASN 90 6.224 11.870 -7.540
660 HA ASN 90 HA ASN 90 4.702 13.989 -6.329
661 HB2 ASN 90 1HB ASN 90 6.349 15.109 -5.164
662 HB3 ASN 90 2HB ASN 90 6.818 13.440 -4.854
663 HD21 ASN 90 1HD2 ASN 90 8.534 15.667 -4.702
664 HD22 ASN 90 2HD2 ASN 90 9.755 15.483 -5.911
665 H GLU 91 H GLU 91 5.426 16.167 -7.254
666 HA GLU 91 HA GLU 91 5.112 16.329 -9.914
667 HB2 GLU 91 1HB GLU 91 5.331 18.249 -8.292
668 HB3 GLU 91 2HB GLU 91 7.075 18.103 -8.462
669 HG2 GLU 91 1HG GLU 91 6.679 18.393 -10.966
670 HG3 GLU 91 2HG GLU 91 5.061 18.928 -10.519
671 H GLY 92 H GLY 92 8.097 15.505 -8.276
672 HA2 GLY 92 1HA GLY 92 9.811 15.738 -10.529
673 HA3 GLY 92 2HA GLY 92 10.149 14.829 -9.063
674 H GLY 93 H GLY 93 8.371 12.856 -8.989
675 HA2 GLY 93 1HA GLY 93 7.488 11.499 -11.151
676 HA3 GLY 93 2HA GLY 93 9.217 11.187 -11.194
677 H GLU 94 H GLU 94 6.924 9.368 -10.748
678 HA GLU 94 HA GLU 94 6.527 8.559 -8.166
679 HB2 GLU 94 1HB GLU 94 6.897 6.830 -10.616
680 HB3 GLU 94 2HB GLU 94 6.262 6.248 -9.084
681 HG2 GLU 94 1HG GLU 94 4.267 7.330 -9.334
682 HG3 GLU 94 2HG GLU 94 4.954 8.592 -10.357
683 H SER 95 H SER 95 7.489 6.957 -6.818
684 HA SER 95 HA SER 95 10.406 6.906 -7.065
685 HB2 SER 95 1HB SER 95 10.524 6.746 -4.762
686 HB3 SER 95 2HB SER 95 9.014 7.639 -4.941
687 HG SER 95 HG SER 95 9.448 5.144 -3.942
688 H GLU 96 H GLU 96 11.201 4.772 -5.708
689 HA GLU 96 HA GLU 96 10.871 2.642 -7.513
690 HB2 GLU 96 1HB GLU 96 11.922 2.588 -4.679
691 HB3 GLU 96 2HB GLU 96 12.126 1.305 -5.863
692 HG2 GLU 96 1HG GLU 96 13.175 3.276 -7.279
693 HG3 GLU 96 2HG GLU 96 13.459 3.945 -5.673
694 H PHE 97 H PHE 97 10.278 0.364 -6.667
695 HA PHE 97 HA PHE 97 7.530 0.522 -5.743
696 HB2 PHE 97 1HB PHE 97 9.218 -1.563 -7.056
697 HB3 PHE 97 2HB PHE 97 7.803 -2.081 -6.146
698 HD1 PHE 97 1HD PHE 97 8.656 0.586 -8.618
699 HD2 PHE 97 2HD PHE 97 5.910 -2.421 -7.380
700 HE1 PHE 97 1HE PHE 97 7.230 1.094 -10.558
701 HE2 PHE 97 2HE PHE 97 4.480 -1.918 -9.318
702 HZ PHE 97 HZ PHE 97 5.140 -0.160 -10.911
703 H SER 98 H SER 98 7.083 0.442 -3.652
704 HA SER 98 HA SER 98 8.859 -0.163 -1.610
705 HB2 SER 98 1HB SER 98 6.661 1.053 -1.385
706 HB3 SER 98 2HB SER 98 5.859 -0.517 -1.444
707 HG SER 98 HG SER 98 6.226 -0.580 0.616
708 H ASN 99 H ASN 99 8.627 -1.946 0.012
709 HA ASN 99 HA ASN 99 9.113 -4.431 -1.192
710 HB2 ASN 99 1HB ASN 99 8.748 -5.269 1.249
711 HB3 ASN 99 2HB ASN 99 10.099 -4.193 0.903
712 HD21 ASN 99 1HD2 ASN 99 7.481 -4.741 2.872
713 HD22 ASN 99 2HD2 ASN 99 7.345 -3.173 3.586
714 H VAL 100 H VAL 100 7.888 -6.472 -0.391
715 HA VAL 100 HA VAL 100 5.037 -6.047 -0.983
716 HB VAL 100 HB VAL 100 6.697 -8.553 -1.295
717 HG11 VAL 100 1HG1 VAL 100 4.613 -9.257 -2.623
718 HG12 VAL 100 2HG1 VAL 100 4.530 -9.307 -0.861
719 HG13 VAL 100 3HG1 VAL 100 3.789 -7.970 -1.743
720 HG21 VAL 100 1HG2 VAL 100 6.128 -6.293 -3.056
721 HG22 VAL 100 2HG2 VAL 100 7.380 -7.530 -3.167
722 HG23 VAL 100 3HG2 VAL 100 5.757 -7.862 -3.773
723 H MET 101 H MET 101 3.651 -6.276 0.633
724 HA MET 101 HA MET 101 4.440 -7.930 2.940
725 HB2 MET 101 1HB MET 101 2.520 -5.597 2.836
726 HB3 MET 101 2HB MET 101 2.890 -6.545 4.269
727 HG2 MET 101 1HG MET 101 4.920 -4.958 2.718
728 HG3 MET 101 2HG MET 101 4.073 -4.371 4.147
729 HE1 MET 101 1HE MET 101 4.436 -4.710 6.233
730 HE2 MET 101 2HE MET 101 4.570 -6.386 6.766
731 HE3 MET 101 3HE MET 101 5.941 -5.290 6.947
732 H ILE 102 H ILE 102 3.352 -9.754 3.225
733 HA ILE 102 HA ILE 102 0.888 -10.198 1.732
734 HB ILE 102 HB ILE 102 2.559 -12.121 3.354
735 HG12 ILE 102 1HG1 ILE 102 2.243 -11.997 0.356
736 HG13 ILE 102 2HG1 ILE 102 3.537 -11.158 1.206
737 HG21 ILE 102 1HG2 ILE 102 -0.077 -12.405 2.789
738 HG22 ILE 102 2HG2 ILE 102 0.656 -13.157 1.373
739 HG23 ILE 102 3HG2 ILE 102 1.050 -13.747 2.987
740 HD11 ILE 102 1HD1 ILE 102 4.531 -13.131 0.535
741 HD12 ILE 102 2HD1 ILE 102 4.067 -13.475 2.202
742 HD13 ILE 102 3HD1 ILE 102 3.090 -14.091 0.869
743 H CYS 103 H CYS 103 -0.778 -9.248 2.797
744 HA CYS 103 HA CYS 103 -1.144 -9.926 5.637
745 HB2 CYS 103 1HB CYS 103 -1.038 -7.474 4.861
746 HB3 CYS 103 2HB CYS 103 -2.631 -7.758 4.171
747 HG CYS 103 HG CYS 103 -3.866 -8.320 6.588
748 H GLU 104 H GLU 104 -2.431 -11.627 5.893
749 HA GLU 104 HA GLU 104 -4.402 -12.356 3.927
750 HB2 GLU 104 1HB GLU 104 -2.951 -13.881 5.500
751 HB3 GLU 104 2HB GLU 104 -4.262 -13.612 6.640
752 HG2 GLU 104 1HG GLU 104 -5.733 -14.322 4.564
753 HG3 GLU 104 2HG GLU 104 -4.239 -15.131 4.094
754 H THR 105 H THR 105 -6.511 -11.902 3.927
755 HA THR 105 HA THR 105 -7.581 -10.009 5.754
756 HB THR 105 HB THR 105 -9.791 -10.622 4.584
757 HG1 THR 105 1HG THR 105 -8.847 -11.622 2.392
758 HG21 THR 105 1HG2 THR 105 -7.676 -9.771 2.639
759 HG22 THR 105 2HG2 THR 105 -8.077 -8.753 4.022
760 HG23 THR 105 3HG2 THR 105 -9.318 -9.162 2.839
761 H LYS 106 H LYS 106 -9.910 -10.512 6.651
762 HA LYS 106 HA LYS 106 -9.554 -12.657 8.561
763 HB2 LYS 106 1HB LYS 106 -11.791 -10.644 8.261
764 HB3 LYS 106 2HB LYS 106 -11.591 -11.752 9.612
765 HG2 LYS 106 1HG LYS 106 -9.340 -9.932 8.954
766 HG3 LYS 106 2HG LYS 106 -10.772 -9.251 9.730
767 HD2 LYS 106 1HD LYS 106 -10.431 -10.399 11.677
768 HD3 LYS 106 2HD LYS 106 -9.626 -11.746 10.869
769 HE2 LYS 106 1HE LYS 106 -8.282 -9.094 10.856
770 HE3 LYS 106 2HE LYS 106 -8.295 -10.010 12.362
771 HZ1 LYS 106 1HZ LYS 106 -6.584 -10.340 10.219
772 HZ2 LYS 106 2HZ LYS 106 -7.601 -11.691 10.194
773 HZ3 LYS 106 3HZ LYS 106 -6.712 -11.328 11.587
774 H ALA 107 H ALA 107 -11.138 -14.292 8.970
775 HA ALA 107 HA ALA 107 -12.143 -15.487 6.574
776 HB1 ALA 107 1HB ALA 107 -11.629 -16.305 9.272
777 HB2 ALA 107 2HB ALA 107 -13.240 -16.829 8.781
778 HB3 ALA 107 3HB ALA 107 -11.832 -17.292 7.825
779 H ARG 108 H ARG 108 -14.155 -15.485 5.755
780 HA ARG 108 HA ARG 108 -16.092 -13.668 6.888
781 HB2 ARG 108 1HB ARG 108 -17.405 -14.168 4.864
782 HB3 ARG 108 2HB ARG 108 -15.757 -13.693 4.479
783 HG2 ARG 108 1HG ARG 108 -15.191 -15.759 3.703
784 HG3 ARG 108 2HG ARG 108 -16.343 -16.589 4.751
785 HD2 ARG 108 1HD ARG 108 -18.185 -15.865 3.365
786 HD3 ARG 108 2HD ARG 108 -17.094 -14.905 2.366
787 HE ARG 108 HE ARG 108 -16.335 -17.649 2.422
788 HH11 ARG 108 1HH1 ARG 108 -18.575 -15.399 0.994
789 HH12 ARG 108 2HH1 ARG 108 -18.811 -16.343 -0.440
790 HH21 ARG 108 1HH2 ARG 108 -16.636 -18.900 0.539
791 HH22 ARG 108 2HH2 ARG 108 -17.708 -18.334 -0.697
792 H SER 109 H SER 109 -15.612 -15.828 8.588
793 HA SER 109 HA SER 109 -17.196 -18.051 8.438
794 HB2 SER 109 1HB SER 109 -16.593 -16.342 10.859
795 HB3 SER 109 2HB SER 109 -17.320 -17.946 10.945
796 HG SER 109 HG SER 109 -15.431 -18.802 10.603
797 H GLY 110 H GLY 110 -19.212 -17.958 7.602
798 HA2 GLY 110 1HA GLY 110 -21.469 -17.556 7.491
799 HA3 GLY 110 2HA GLY 110 -21.375 -17.190 9.208
800 HA PRO 111 HA PRO 111 -22.696 -13.324 7.070
801 HB2 PRO 111 1HB PRO 111 -24.519 -12.640 8.963
802 HB3 PRO 111 2HB PRO 111 -24.890 -13.729 7.621
803 HG2 PRO 111 1HG PRO 111 -24.194 -14.387 10.457
804 HG3 PRO 111 2HG PRO 111 -25.442 -15.098 9.418
805 HD2 PRO 111 1HD PRO 111 -23.058 -16.302 9.862
806 HD3 PRO 111 2HD PRO 111 -23.937 -16.462 8.328
807 H SER 112 H SER 112 -22.380 -11.141 7.707
808 HA SER 112 HA SER 112 -21.556 -10.371 10.303
809 HB2 SER 112 1HB SER 112 -19.528 -11.610 9.778
810 HB3 SER 112 2HB SER 112 -19.358 -10.741 8.253
811 HG SER 112 HG SER 112 -18.597 -9.053 9.287
812 H SER 113 H SER 113 -21.781 -8.225 10.511
813 HA SER 113 HA SER 113 -21.897 -6.618 8.042
814 HB2 SER 113 1HB SER 113 -23.571 -6.354 10.550
815 HB3 SER 113 2HB SER 113 -23.586 -5.203 9.214
816 HG SER 113 HG SER 113 -24.899 -7.532 9.449
817 H GLY 114 H GLY 114 -20.561 -4.930 7.932
818 HA2 GLY 114 1HA GLY 114 -19.782 -2.911 9.212
819 HA3 GLY 114 2HA GLY 114 -19.253 -4.057 10.434
Start of MODEL 7
1 H1 GLY 1 H GLY 1 12.571 21.412 -11.765
2 HA2 GLY 1 1HA GLY 1 11.450 23.606 -12.703
3 HA3 GLY 1 2HA GLY 1 11.604 23.394 -10.965
4 H SER 2 H SER 2 14.087 23.910 -10.318
5 HA SER 2 HA SER 2 14.476 26.677 -11.217
6 HB2 SER 2 1HB SER 2 15.873 26.861 -9.115
7 HB3 SER 2 2HB SER 2 14.159 26.543 -8.847
8 HG SER 2 HG SER 2 16.366 24.927 -8.384
9 H SER 3 H SER 3 16.321 23.737 -10.448
10 HA SER 3 HA SER 3 18.397 24.663 -12.321
11 HB2 SER 3 1HB SER 3 18.668 23.639 -9.534
12 HB3 SER 3 2HB SER 3 19.901 23.169 -10.705
13 HG SER 3 HG SER 3 20.574 25.069 -9.800
14 H GLY 4 H GLY 4 17.012 21.834 -10.669
15 HA2 GLY 4 1HA GLY 4 16.292 20.214 -12.614
16 HA3 GLY 4 2HA GLY 4 18.036 20.095 -12.789
17 H SER 5 H SER 5 15.367 18.726 -11.380
18 HA SER 5 HA SER 5 17.022 17.000 -9.741
19 HB2 SER 5 1HB SER 5 15.908 17.365 -7.678
20 HB3 SER 5 2HB SER 5 16.282 18.974 -8.295
21 HG SER 5 HG SER 5 13.790 17.650 -8.609
22 H SER 6 H SER 6 16.167 14.972 -9.468
23 HA SER 6 HA SER 6 13.850 14.360 -11.119
24 HB2 SER 6 1HB SER 6 15.928 12.631 -9.771
25 HB3 SER 6 2HB SER 6 14.533 11.965 -10.619
26 HG SER 6 HG SER 6 16.023 12.058 -12.175
27 H GLY 7 H GLY 7 12.303 12.669 -10.286
28 HA2 GLY 7 1HA GLY 7 11.092 13.629 -7.893
29 HA3 GLY 7 2HA GLY 7 10.566 12.243 -8.837
30 HA PRO 8 HA PRO 8 12.275 10.809 -4.733
31 HB2 PRO 8 1HB PRO 8 10.082 9.375 -4.022
32 HB3 PRO 8 2HB PRO 8 10.269 11.092 -3.648
33 HG2 PRO 8 1HG PRO 8 8.736 9.793 -5.866
34 HG3 PRO 8 2HG PRO 8 8.266 11.150 -4.826
35 HD2 PRO 8 1HD PRO 8 9.193 11.499 -7.346
36 HD3 PRO 8 2HD PRO 8 9.489 12.674 -6.048
37 H VAL 9 H VAL 9 13.235 8.850 -4.427
38 HA VAL 9 HA VAL 9 12.527 6.678 -6.288
39 HB VAL 9 HB VAL 9 14.940 6.070 -6.376
40 HG11 VAL 9 1HG1 VAL 9 15.291 7.351 -8.217
41 HG12 VAL 9 2HG1 VAL 9 13.592 7.747 -7.953
42 HG13 VAL 9 3HG1 VAL 9 14.852 8.848 -7.395
43 HG21 VAL 9 1HG2 VAL 9 15.153 8.557 -4.738
44 HG22 VAL 9 2HG2 VAL 9 15.983 7.013 -4.547
45 HG23 VAL 9 3HG2 VAL 9 16.465 8.119 -5.833
46 H ALA 10 H ALA 10 14.017 7.571 -3.208
47 HA ALA 10 HA ALA 10 14.615 5.160 -2.094
48 HB1 ALA 10 1HB ALA 10 13.394 7.602 -0.838
49 HB2 ALA 10 2HB ALA 10 13.892 6.199 0.109
50 HB3 ALA 10 3HB ALA 10 15.083 7.093 -0.837
51 H GLY 11 H GLY 11 11.398 6.613 -2.374
52 HA2 GLY 11 1HA GLY 11 9.304 5.686 -2.213
53 HA3 GLY 11 2HA GLY 11 10.075 4.132 -2.492
54 HA PRO 12 HA PRO 12 8.680 4.875 2.059
55 HB2 PRO 12 1HB PRO 12 6.116 3.987 1.979
56 HB3 PRO 12 2HB PRO 12 6.552 5.685 1.754
57 HG2 PRO 12 1HG PRO 12 5.914 3.604 -0.301
58 HG3 PRO 12 2HG PRO 12 5.393 5.298 -0.224
59 HD2 PRO 12 1HD PRO 12 7.418 4.468 -1.819
60 HD3 PRO 12 2HD PRO 12 7.386 6.081 -1.078
61 H TYR 13 H TYR 13 8.192 3.154 3.580
62 HA TYR 13 HA TYR 13 8.317 0.450 2.436
63 HB2 TYR 13 1HB TYR 13 10.534 0.615 3.043
64 HB3 TYR 13 2HB TYR 13 10.203 1.734 4.360
65 HD1 TYR 13 1HD TYR 13 9.467 -1.810 3.412
66 HD2 TYR 13 2HD TYR 13 10.439 0.939 6.511
67 HE1 TYR 13 1HE TYR 13 9.595 -3.671 5.015
68 HE2 TYR 13 2HE TYR 13 10.570 -0.914 8.122
69 HH TYR 13 HH TYR 13 9.908 -4.261 7.130
70 H ILE 14 H ILE 14 6.613 -0.649 3.116
71 HA ILE 14 HA ILE 14 4.962 0.169 5.259
72 HB ILE 14 HB ILE 14 5.058 -2.527 3.900
73 HG12 ILE 14 1HG1 ILE 14 3.041 -0.403 3.291
74 HG13 ILE 14 2HG1 ILE 14 4.639 -0.294 2.561
75 HG21 ILE 14 1HG2 ILE 14 2.579 -2.455 4.623
76 HG22 ILE 14 2HG2 ILE 14 3.804 -2.869 5.821
77 HG23 ILE 14 3HG2 ILE 14 3.120 -1.244 5.785
78 HD11 ILE 14 1HD1 ILE 14 3.908 -2.908 2.108
79 HD12 ILE 14 2HD1 ILE 14 2.403 -2.011 1.899
80 HD13 ILE 14 3HD1 ILE 14 3.825 -1.581 0.949
81 H THR 15 H THR 15 5.230 -0.107 7.365
82 HA THR 15 HA THR 15 6.921 -2.340 8.290
83 HB THR 15 HB THR 15 7.894 -1.043 9.931
84 HG1 THR 15 1HG THR 15 5.567 0.563 9.729
85 HG21 THR 15 1HG2 THR 15 8.971 0.534 8.739
86 HG22 THR 15 2HG2 THR 15 7.479 1.376 8.322
87 HG23 THR 15 3HG2 THR 15 7.981 -0.038 7.397
88 H PHE 16 H PHE 16 3.878 -1.810 7.929
89 HA PHE 16 HA PHE 16 3.091 -3.302 10.250
90 HB2 PHE 16 1HB PHE 16 3.132 -0.776 10.891
91 HB3 PHE 16 2HB PHE 16 1.661 -0.683 9.928
92 HD1 PHE 16 1HD PHE 16 3.198 -2.125 12.936
93 HD2 PHE 16 2HD PHE 16 -0.395 -1.602 10.715
94 HE1 PHE 16 1HE PHE 16 1.892 -2.904 14.871
95 HE2 PHE 16 2HE PHE 16 -1.706 -2.379 12.646
96 HZ PHE 16 HZ PHE 16 -0.563 -3.030 14.728
97 H THR 17 H THR 17 1.658 -4.730 9.552
98 HA THR 17 HA THR 17 -0.357 -3.918 7.588
99 HB THR 17 HB THR 17 0.088 -6.356 6.609
100 HG1 THR 17 1HG THR 17 1.979 -7.120 7.148
101 HG21 THR 17 1HG2 THR 17 1.975 -4.225 5.695
102 HG22 THR 17 2HG2 THR 17 0.236 -3.964 5.563
103 HG23 THR 17 3HG2 THR 17 0.987 -5.332 4.743
104 H ASP 18 H ASP 18 -2.212 -4.278 8.612
105 HA ASP 18 HA ASP 18 -2.659 -6.917 9.804
106 HB2 ASP 18 1HB ASP 18 -3.108 -4.262 11.158
107 HB3 ASP 18 2HB ASP 18 -3.958 -5.721 11.659
108 H ALA 19 H ALA 19 -4.692 -7.725 9.523
109 HA ALA 19 HA ALA 19 -6.364 -6.361 7.599
110 HB1 ALA 19 1HB ALA 19 -7.129 -8.940 8.895
111 HB2 ALA 19 2HB ALA 19 -7.409 -8.385 7.244
112 HB3 ALA 19 3HB ALA 19 -5.796 -8.898 7.739
113 H VAL 20 H VAL 20 -7.922 -4.999 8.150
114 HA VAL 20 HA VAL 20 -8.847 -4.799 10.869
115 HB VAL 20 HB VAL 20 -9.931 -3.332 8.465
116 HG11 VAL 20 1HG1 VAL 20 -11.396 -2.887 10.182
117 HG12 VAL 20 2HG1 VAL 20 -10.149 -3.011 11.424
118 HG13 VAL 20 3HG1 VAL 20 -10.225 -1.585 10.388
119 HG21 VAL 20 1HG2 VAL 20 -7.395 -3.197 8.832
120 HG22 VAL 20 2HG2 VAL 20 -8.290 -1.683 8.700
121 HG23 VAL 20 3HG2 VAL 20 -7.790 -2.277 10.284
122 H ASN 21 H ASN 21 -9.953 -6.256 7.926
123 HA ASN 21 HA ASN 21 -12.063 -7.617 9.299
124 HB2 ASN 21 1HB ASN 21 -12.674 -5.292 7.541
125 HB3 ASN 21 2HB ASN 21 -13.718 -6.705 7.412
126 HD21 ASN 21 1HD2 ASN 21 -14.359 -4.057 8.374
127 HD22 ASN 21 2HD2 ASN 21 -14.910 -4.246 10.001
128 H GLU 22 H GLU 22 -13.515 -8.723 7.424
129 HA GLU 22 HA GLU 22 -11.691 -10.413 6.032
130 HB2 GLU 22 1HB GLU 22 -13.553 -11.691 5.420
131 HB3 GLU 22 2HB GLU 22 -14.008 -11.005 6.974
132 HG2 GLU 22 1HG GLU 22 -14.796 -9.745 4.368
133 HG3 GLU 22 2HG GLU 22 -15.764 -10.992 5.152
134 H THR 23 H THR 23 -13.318 -7.495 5.250
135 HA THR 23 HA THR 23 -12.451 -7.770 2.447
136 HB THR 23 HB THR 23 -14.354 -6.088 1.972
137 HG1 THR 23 1HG THR 23 -16.132 -6.414 3.478
138 HG21 THR 23 1HG2 THR 23 -16.046 -8.129 2.128
139 HG22 THR 23 2HG2 THR 23 -14.556 -9.015 2.454
140 HG23 THR 23 3HG2 THR 23 -14.730 -8.102 0.956
141 H THR 24 H THR 24 -11.557 -6.399 5.150
142 HA THR 24 HA THR 24 -10.672 -3.933 3.823
143 HB THR 24 HB THR 24 -11.464 -3.927 6.728
144 HG1 THR 24 1HG THR 24 -13.475 -3.909 6.092
145 HG21 THR 24 1HG2 THR 24 -11.184 -1.645 6.639
146 HG22 THR 24 2HG2 THR 24 -11.502 -1.565 4.906
147 HG23 THR 24 3HG2 THR 24 -9.951 -2.166 5.491
148 H ILE 25 H ILE 25 -8.633 -3.208 4.398
149 HA ILE 25 HA ILE 25 -7.146 -4.753 6.394
150 HB ILE 25 HB ILE 25 -6.388 -4.437 3.503
151 HG12 ILE 25 1HG1 ILE 25 -6.456 -6.785 5.410
152 HG13 ILE 25 2HG1 ILE 25 -7.594 -6.467 4.106
153 HG21 ILE 25 1HG2 ILE 25 -4.168 -5.514 4.404
154 HG22 ILE 25 2HG2 ILE 25 -4.383 -3.765 4.382
155 HG23 ILE 25 3HG2 ILE 25 -4.614 -4.662 5.883
156 HD11 ILE 25 1HD1 ILE 25 -6.201 -8.086 3.224
157 HD12 ILE 25 2HD1 ILE 25 -5.528 -6.590 2.577
158 HD13 ILE 25 3HD1 ILE 25 -4.756 -7.382 3.950
159 H MET 26 H MET 26 -5.551 -3.628 7.447
160 HA MET 26 HA MET 26 -5.304 -0.780 6.735
161 HB2 MET 26 1HB MET 26 -6.413 -0.954 8.840
162 HB3 MET 26 2HB MET 26 -5.259 -2.145 9.424
163 HG2 MET 26 1HG MET 26 -4.443 -0.334 10.494
164 HG3 MET 26 2HG MET 26 -3.564 -0.157 8.977
165 HE1 MET 26 1HE MET 26 -3.985 1.271 7.213
166 HE2 MET 26 2HE MET 26 -4.900 2.779 7.242
167 HE3 MET 26 3HE MET 26 -3.433 2.618 8.209
168 H LEU 27 H LEU 27 -3.363 -0.130 6.094
169 HA LEU 27 HA LEU 27 -0.987 -1.548 7.082
170 HB2 LEU 27 1HB LEU 27 -0.086 -1.870 5.000
171 HB3 LEU 27 2HB LEU 27 -1.798 -2.138 4.680
172 HG LEU 27 HG LEU 27 -0.527 0.538 4.203
173 HD11 LEU 27 1HD1 LEU 27 0.672 -0.247 2.514
174 HD12 LEU 27 2HD1 LEU 27 -0.805 -0.844 1.759
175 HD13 LEU 27 3HD1 LEU 27 0.113 -1.886 2.845
176 HD21 LEU 27 1HD2 LEU 27 -3.102 -0.131 4.213
177 HD22 LEU 27 2HD2 LEU 27 -2.712 -0.608 2.560
178 HD23 LEU 27 3HD2 LEU 27 -2.437 1.053 3.087
179 H LYS 28 H LYS 28 0.657 -0.263 7.689
180 HA LYS 28 HA LYS 28 0.417 2.615 7.098
181 HB2 LYS 28 1HB LYS 28 1.611 1.291 9.542
182 HB3 LYS 28 2HB LYS 28 1.554 3.024 9.245
183 HG2 LYS 28 1HG LYS 28 -0.706 3.157 9.640
184 HG3 LYS 28 2HG LYS 28 -0.983 1.459 9.245
185 HD2 LYS 28 1HD LYS 28 0.279 0.859 11.322
186 HD3 LYS 28 2HD LYS 28 0.304 2.576 11.733
187 HE2 LYS 28 1HE LYS 28 -2.210 2.532 11.552
188 HE3 LYS 28 2HE LYS 28 -2.094 0.777 11.443
189 HZ1 LYS 28 1HZ LYS 28 -2.381 1.047 13.674
190 HZ2 LYS 28 2HZ LYS 28 -1.579 2.535 13.730
191 HZ3 LYS 28 3HZ LYS 28 -0.691 1.100 13.610
192 H TRP 29 H TRP 29 2.145 3.670 6.279
193 HA TRP 29 HA TRP 29 4.597 2.089 5.864
194 HB2 TRP 29 1HB TRP 29 4.954 3.536 3.847
195 HB3 TRP 29 2HB TRP 29 3.533 2.500 3.748
196 HD1 TRP 29 HD TRP 29 4.522 6.185 4.160
197 HE1 TRP 29 1HE TRP 29 2.483 7.645 3.582
198 HE3 TRP 29 3HE TRP 29 1.009 2.507 3.642
199 HZ2 TRP 29 2HZ TRP 29 -0.252 7.286 2.986
200 HZ3 TRP 29 3HZ TRP 29 -1.295 3.149 3.067
201 HH2 TRP 29 HH TRP 29 -1.911 5.490 2.747
202 H MET 30 H MET 30 6.616 3.255 5.848
203 HA MET 30 HA MET 30 6.519 5.713 7.472
204 HB2 MET 30 1HB MET 30 8.331 5.015 8.729
205 HB3 MET 30 2HB MET 30 7.484 3.497 8.461
206 HG2 MET 30 1HG MET 30 9.013 2.885 6.718
207 HG3 MET 30 2HG MET 30 9.794 4.462 6.796
208 HE1 MET 30 1HE MET 30 11.302 5.259 8.275
209 HE2 MET 30 2HE MET 30 10.718 5.033 9.924
210 HE3 MET 30 3HE MET 30 12.269 4.348 9.436
211 H TYR 31 H TYR 31 8.433 7.137 7.207
212 HA TYR 31 HA TYR 31 9.488 7.031 4.458
213 HB2 TYR 31 1HB TYR 31 7.696 8.774 4.821
214 HB3 TYR 31 2HB TYR 31 8.794 9.568 5.945
215 HD1 TYR 31 1HD TYR 31 8.241 8.675 2.413
216 HD2 TYR 31 2HD TYR 31 10.658 10.849 5.158
217 HE1 TYR 31 1HE TYR 31 9.281 9.876 0.536
218 HE2 TYR 31 2HE TYR 31 11.705 12.057 3.288
219 HH TYR 31 HH TYR 31 10.498 12.305 0.353
220 H ILE 32 H ILE 32 11.626 7.373 4.205
221 HA ILE 32 HA ILE 32 13.175 8.010 6.629
222 HB ILE 32 HB ILE 32 14.147 6.443 4.241
223 HG12 ILE 32 1HG1 ILE 32 14.061 4.578 6.125
224 HG13 ILE 32 2HG1 ILE 32 12.774 5.600 6.756
225 HG21 ILE 32 1HG2 ILE 32 16.105 7.050 5.171
226 HG22 ILE 32 2HG2 ILE 32 15.369 7.431 6.726
227 HG23 ILE 32 3HG2 ILE 32 15.739 5.757 6.313
228 HD11 ILE 32 1HD1 ILE 32 12.788 4.662 3.912
229 HD12 ILE 32 2HD1 ILE 32 12.119 3.685 5.219
230 HD13 ILE 32 3HD1 ILE 32 11.439 5.274 4.869
231 HA PRO 33 HA PRO 33 14.022 11.627 4.015
232 HB2 PRO 33 1HB PRO 33 14.792 13.200 6.089
233 HB3 PRO 33 2HB PRO 33 13.097 12.938 5.659
234 HG2 PRO 33 1HG PRO 33 14.732 11.634 7.801
235 HG3 PRO 33 2HG PRO 33 13.066 12.238 7.876
236 HD2 PRO 33 1HD PRO 33 13.651 9.612 7.564
237 HD3 PRO 33 2HD PRO 33 12.205 10.360 6.855
238 H ALA 34 H ALA 34 15.963 9.636 5.979
239 HA ALA 34 HA ALA 34 18.422 10.950 5.977
240 HB1 ALA 34 1HB ALA 34 19.362 8.567 6.032
241 HB2 ALA 34 2HB ALA 34 18.275 9.054 7.333
242 HB3 ALA 34 3HB ALA 34 17.677 8.045 6.017
243 H SER 35 H SER 35 17.614 8.229 3.819
244 HA SER 35 HA SER 35 19.561 9.199 1.890
245 HB2 SER 35 1HB SER 35 18.086 6.646 2.330
246 HB3 SER 35 2HB SER 35 18.611 7.014 0.687
247 HG SER 35 HG SER 35 20.277 6.961 2.987
248 H ASN 36 H ASN 36 17.363 10.898 2.193
249 HA ASN 36 HA ASN 36 15.896 10.491 -0.329
250 HB2 ASN 36 1HB ASN 36 14.439 10.526 1.652
251 HB3 ASN 36 2HB ASN 36 15.075 12.107 2.094
252 HD21 ASN 36 1HD2 ASN 36 13.948 10.667 -0.947
253 HD22 ASN 36 2HD2 ASN 36 12.804 11.910 -1.308
254 H ASN 37 H ASN 37 15.184 12.618 -1.345
255 HA ASN 37 HA ASN 37 17.502 14.422 -1.386
256 HB2 ASN 37 1HB ASN 37 16.586 13.166 -3.487
257 HB3 ASN 37 2HB ASN 37 15.351 14.421 -3.479
258 HD21 ASN 37 1HD2 ASN 37 15.804 15.919 -4.906
259 HD22 ASN 37 2HD2 ASN 37 17.368 16.575 -5.239
260 H ASN 38 H ASN 38 15.206 14.474 0.532
261 HA ASN 38 HA ASN 38 13.720 15.943 1.459
262 HB2 ASN 38 1HB ASN 38 16.117 17.062 1.484
263 HB3 ASN 38 2HB ASN 38 15.350 18.208 0.388
264 HD21 ASN 38 1HD2 ASN 38 16.364 18.522 3.133
265 HD22 ASN 38 2HD2 ASN 38 15.035 19.138 4.049
266 H THR 39 H THR 39 12.829 15.101 -1.008
267 HA THR 39 HA THR 39 11.847 17.514 -2.356
268 HB THR 39 HB THR 39 12.893 15.711 -3.739
269 HG1 THR 39 1HG THR 39 11.594 16.858 -5.002
270 HG21 THR 39 1HG2 THR 39 11.793 13.635 -4.097
271 HG22 THR 39 2HG2 THR 39 10.383 14.144 -3.168
272 HG23 THR 39 3HG2 THR 39 11.915 13.838 -2.350
273 HA PRO 40 HA PRO 40 7.881 17.096 -0.469
274 HB2 PRO 40 1HB PRO 40 6.449 18.582 -2.232
275 HB3 PRO 40 2HB PRO 40 7.550 19.295 -1.047
276 HG2 PRO 40 1HG PRO 40 8.000 18.735 -3.953
277 HG3 PRO 40 2HG PRO 40 8.445 20.168 -3.007
278 HD2 PRO 40 1HD PRO 40 10.224 18.226 -3.636
279 HD3 PRO 40 2HD PRO 40 10.322 19.159 -2.129
280 H ILE 41 H ILE 41 6.378 15.546 -0.555
281 HA ILE 41 HA ILE 41 6.014 14.090 -3.069
282 HB ILE 41 HB ILE 41 4.903 13.246 -0.407
283 HG12 ILE 41 1HG1 ILE 41 7.692 12.794 -1.484
284 HG13 ILE 41 2HG1 ILE 41 7.251 13.623 0.005
285 HG21 ILE 41 1HG2 ILE 41 4.754 11.116 -1.343
286 HG22 ILE 41 2HG2 ILE 41 4.275 12.186 -2.659
287 HG23 ILE 41 3HG2 ILE 41 5.898 11.498 -2.629
288 HD11 ILE 41 1HD1 ILE 41 6.131 11.042 0.135
289 HD12 ILE 41 2HD1 ILE 41 7.798 10.867 -0.416
290 HD13 ILE 41 3HD1 ILE 41 7.451 11.714 1.091
291 H HIS 42 H HIS 42 4.050 13.827 -4.052
292 HA HIS 42 HA HIS 42 2.033 15.793 -3.431
293 HB2 HIS 42 1HB HIS 42 2.526 13.861 -5.651
294 HB3 HIS 42 2HB HIS 42 0.887 14.464 -5.424
295 HD1 HIS 42 1HD HIS 42 1.290 15.585 -7.823
296 HD2 HIS 42 2HD HIS 42 3.543 17.123 -4.690
297 HE1 HIS 42 1HE HIS 42 2.153 17.801 -8.640
298 HE2 HIS 42 2HE HIS 42 3.583 18.674 -6.759
299 H GLY 43 H GLY 43 2.341 12.275 -3.312
300 HA2 GLY 43 1HA GLY 43 0.413 12.053 -1.234
301 HA3 GLY 43 2HA GLY 43 -0.282 11.565 -2.773
302 H PHE 44 H PHE 44 -0.538 9.457 -1.810
303 HA PHE 44 HA PHE 44 1.911 7.864 -2.071
304 HB2 PHE 44 1HB PHE 44 -0.030 7.819 0.236
305 HB3 PHE 44 2HB PHE 44 1.024 6.455 -0.125
306 HD1 PHE 44 2HD PHE 44 3.572 7.104 -0.420
307 HD2 PHE 44 1HD PHE 44 0.700 9.387 1.739
308 HE1 PHE 44 2HE PHE 44 5.384 8.165 0.862
309 HE2 PHE 44 1HE PHE 44 2.509 10.452 3.024
310 HZ PHE 44 HZ PHE 44 4.854 9.840 2.587
311 H TYR 45 H TYR 45 1.658 6.125 -3.319
312 HA TYR 45 HA TYR 45 -1.072 5.395 -4.119
313 HB2 TYR 45 1HB TYR 45 1.571 5.354 -5.480
314 HB3 TYR 45 2HB TYR 45 0.429 4.087 -5.910
315 HD1 TYR 45 2HD TYR 45 -2.138 5.500 -5.806
316 HD2 TYR 45 1HD TYR 45 1.628 6.796 -7.302
317 HE1 TYR 45 2HE TYR 45 -3.285 7.049 -7.334
318 HE2 TYR 45 1HE TYR 45 0.491 8.350 -8.834
319 HH TYR 45 HH TYR 45 -2.564 9.332 -8.521
320 H ILE 46 H ILE 46 -1.888 3.418 -3.742
321 HA ILE 46 HA ILE 46 -0.091 1.398 -2.565
322 HB ILE 46 HB ILE 46 -2.946 2.021 -1.807
323 HG12 ILE 46 1HG1 ILE 46 -0.677 1.867 0.125
324 HG13 ILE 46 2HG1 ILE 46 -0.791 3.288 -0.908
325 HG21 ILE 46 1HG2 ILE 46 -2.857 0.157 -0.286
326 HG22 ILE 46 2HG2 ILE 46 -2.509 -0.414 -1.917
327 HG23 ILE 46 3HG2 ILE 46 -1.196 -0.199 -0.760
328 HD11 ILE 46 1HD1 ILE 46 -3.276 3.294 -0.053
329 HD12 ILE 46 2HD1 ILE 46 -2.572 2.387 1.286
330 HD13 ILE 46 3HD1 ILE 46 -1.971 3.999 0.901
331 H TYR 47 H TYR 47 0.097 -0.325 -3.819
332 HA TYR 47 HA TYR 47 -2.079 -0.982 -5.678
333 HB2 TYR 47 1HB TYR 47 0.782 -1.961 -5.695
334 HB3 TYR 47 2HB TYR 47 -0.425 -2.235 -6.946
335 HD1 TYR 47 2HD TYR 47 1.445 0.479 -5.215
336 HD2 TYR 47 1HD TYR 47 -0.630 -0.738 -8.725
337 HE1 TYR 47 2HE TYR 47 2.157 2.544 -6.345
338 HE2 TYR 47 1HE TYR 47 0.078 1.324 -9.865
339 HH TYR 47 HH TYR 47 1.845 3.854 -8.155
340 H TYR 48 H TYR 48 -2.939 -3.046 -5.798
341 HA TYR 48 HA TYR 48 -1.999 -5.138 -4.041
342 HB2 TYR 48 1HB TYR 48 -4.374 -5.342 -3.041
343 HB3 TYR 48 2HB TYR 48 -3.294 -4.119 -2.381
344 HD1 TYR 48 2HD TYR 48 -3.586 -1.723 -3.106
345 HD2 TYR 48 1HD TYR 48 -6.438 -4.746 -4.020
346 HE1 TYR 48 2HE TYR 48 -5.272 0.011 -3.553
347 HE2 TYR 48 1HE TYR 48 -8.131 -3.020 -4.472
348 HH TYR 48 HH TYR 48 -8.088 -0.092 -3.460
349 H ARG 49 H ARG 49 -2.678 -7.159 -4.663
350 HA ARG 49 HA ARG 49 -4.833 -7.493 -6.554
351 HB2 ARG 49 1HB ARG 49 -3.539 -8.381 -8.361
352 HB3 ARG 49 2HB ARG 49 -2.872 -6.805 -7.956
353 HG2 ARG 49 1HG ARG 49 -0.940 -7.972 -8.134
354 HG3 ARG 49 2HG ARG 49 -1.288 -8.288 -6.433
355 HD2 ARG 49 1HD ARG 49 -2.474 -10.381 -7.185
356 HD3 ARG 49 2HD ARG 49 -1.808 -10.086 -8.791
357 HE ARG 49 HE ARG 49 -0.380 -11.012 -6.450
358 HH11 ARG 49 1HH1 ARG 49 -0.170 -9.639 -9.642
359 HH12 ARG 49 2HH1 ARG 49 1.466 -10.151 -9.897
360 HH21 ARG 49 1HH2 ARG 49 1.773 -11.692 -6.773
361 HH22 ARG 49 2HH2 ARG 49 2.569 -11.320 -8.265
362 HA PRO 50 HA PRO 50 -5.050 -11.361 -4.466
363 HB2 PRO 50 1HB PRO 50 -6.555 -12.738 -6.257
364 HB3 PRO 50 2HB PRO 50 -7.219 -11.473 -5.215
365 HG2 PRO 50 1HG PRO 50 -6.375 -11.316 -8.083
366 HG3 PRO 50 2HG PRO 50 -7.812 -10.634 -7.301
367 HD2 PRO 50 1HD PRO 50 -5.620 -9.150 -7.869
368 HD3 PRO 50 2HD PRO 50 -6.653 -8.827 -6.462
369 H THR 51 H THR 51 -3.950 -13.259 -4.381
370 HA THR 51 HA THR 51 -1.740 -13.707 -6.006
371 HB THR 51 HB THR 51 -2.394 -14.715 -3.667
372 HG1 THR 51 1HG THR 51 -0.892 -16.094 -5.660
373 HG21 THR 51 1HG2 THR 51 -2.909 -17.200 -5.203
374 HG22 THR 51 2HG2 THR 51 -4.246 -16.059 -5.048
375 HG23 THR 51 3HG2 THR 51 -3.476 -16.718 -3.605
376 H ASP 52 H ASP 52 -5.034 -14.453 -6.560
377 HA ASP 52 HA ASP 52 -4.577 -16.604 -8.415
378 HB2 ASP 52 1HB ASP 52 -6.942 -15.080 -7.437
379 HB3 ASP 52 2HB ASP 52 -7.083 -15.895 -8.993
380 H SER 53 H SER 53 -4.702 -13.156 -8.553
381 HA SER 53 HA SER 53 -5.482 -12.539 -11.081
382 HB2 SER 53 1HB SER 53 -3.327 -11.432 -9.322
383 HB3 SER 53 2HB SER 53 -3.471 -10.835 -10.975
384 HG SER 53 HG SER 53 -4.729 -9.568 -9.611
385 H ASP 54 H ASP 54 -4.058 -11.924 -12.980
386 HA ASP 54 HA ASP 54 -2.453 -14.255 -13.682
387 HB2 ASP 54 1HB ASP 54 -4.329 -13.089 -15.124
388 HB3 ASP 54 2HB ASP 54 -3.007 -12.026 -15.597
389 H ASN 55 H ASN 55 -2.144 -10.729 -14.159
390 HA ASN 55 HA ASN 55 0.681 -10.924 -13.425
391 HB2 ASN 55 1HB ASN 55 -0.312 -9.632 -15.976
392 HB3 ASN 55 2HB ASN 55 1.342 -9.556 -15.375
393 HD21 ASN 55 1HD2 ASN 55 -0.830 -11.234 -17.289
394 HD22 ASN 55 2HD2 ASN 55 0.112 -12.656 -17.564
395 H ASP 56 H ASP 56 1.571 -8.464 -13.706
396 HA ASP 56 HA ASP 56 0.473 -7.018 -11.610
397 HB2 ASP 56 1HB ASP 56 2.360 -6.373 -13.828
398 HB3 ASP 56 2HB ASP 56 1.708 -5.037 -12.882
399 H SER 57 H SER 57 -0.612 -7.294 -14.835
400 HA SER 57 HA SER 57 -1.817 -4.866 -15.358
401 HB2 SER 57 1HB SER 57 -1.715 -6.790 -16.939
402 HB3 SER 57 2HB SER 57 -2.980 -7.587 -16.003
403 HG SER 57 HG SER 57 -3.530 -6.196 -17.956
404 H ASP 58 H ASP 58 -2.560 -7.112 -12.904
405 HA ASP 58 HA ASP 58 -5.287 -6.163 -12.543
406 HB2 ASP 58 1HB ASP 58 -3.650 -8.149 -10.952
407 HB3 ASP 58 2HB ASP 58 -5.348 -7.779 -10.666
408 H TYR 59 H TYR 59 -2.156 -6.003 -10.909
409 HA TYR 59 HA TYR 59 -2.619 -4.907 -8.523
410 HB2 TYR 59 1HB TYR 59 -0.566 -4.337 -10.591
411 HB3 TYR 59 2HB TYR 59 -0.672 -3.206 -9.246
412 HD1 TYR 59 1HD TYR 59 -1.281 -4.911 -6.973
413 HD2 TYR 59 2HD TYR 59 1.335 -5.619 -10.253
414 HE1 TYR 59 1HE TYR 59 0.044 -6.442 -5.578
415 HE2 TYR 59 2HE TYR 59 2.667 -7.153 -8.867
416 HH TYR 59 HH TYR 59 2.902 -7.263 -5.953
417 H LYS 60 H LYS 60 -3.919 -3.386 -7.771
418 HA LYS 60 HA LYS 60 -4.957 -1.334 -9.543
419 HB2 LYS 60 1HB LYS 60 -5.662 -2.370 -6.834
420 HB3 LYS 60 2HB LYS 60 -6.167 -0.740 -7.260
421 HG2 LYS 60 1HG LYS 60 -7.405 -1.566 -9.152
422 HG3 LYS 60 2HG LYS 60 -6.807 -3.203 -8.870
423 HD2 LYS 60 1HD LYS 60 -8.923 -3.254 -7.915
424 HD3 LYS 60 2HD LYS 60 -7.878 -2.934 -6.529
425 HE2 LYS 60 1HE LYS 60 -8.470 -0.657 -6.479
426 HE3 LYS 60 2HE LYS 60 -9.174 -0.721 -8.093
427 HZ1 LYS 60 1HZ LYS 60 -10.354 -2.469 -6.085
428 HZ2 LYS 60 2HZ LYS 60 -11.096 -1.584 -7.321
429 HZ3 LYS 60 3HZ LYS 60 -10.628 -0.810 -5.891
430 H LYS 61 H LYS 61 -5.376 0.832 -8.073
431 HA LYS 61 HA LYS 61 -2.899 1.621 -6.756
432 HB2 LYS 61 1HB LYS 61 -2.564 2.114 -9.163
433 HB3 LYS 61 2HB LYS 61 -3.998 3.132 -9.134
434 HG2 LYS 61 1HG LYS 61 -2.970 4.769 -7.858
435 HG3 LYS 61 2HG LYS 61 -1.727 3.665 -7.264
436 HD2 LYS 61 1HD LYS 61 -0.623 5.031 -8.822
437 HD3 LYS 61 2HD LYS 61 -0.936 3.525 -9.687
438 HE2 LYS 61 1HE LYS 61 -3.014 4.606 -10.600
439 HE3 LYS 61 2HE LYS 61 -2.448 6.122 -9.900
440 HZ1 LYS 61 1HZ LYS 61 -0.678 6.232 -11.356
441 HZ2 LYS 61 2HZ LYS 61 -1.899 5.600 -12.340
442 HZ3 LYS 61 3HZ LYS 61 -0.708 4.578 -11.709
443 H ASP 62 H ASP 62 -3.347 2.793 -5.013
444 HA ASP 62 HA ASP 62 -5.890 4.281 -4.939
445 HB2 ASP 62 1HB ASP 62 -4.672 2.415 -2.961
446 HB3 ASP 62 2HB ASP 62 -5.536 3.818 -2.337
447 H MET 63 H MET 63 -5.402 6.373 -5.070
448 HA MET 63 HA MET 63 -2.899 7.444 -4.197
449 HB2 MET 63 1HB MET 63 -4.568 8.256 -6.073
450 HB3 MET 63 2HB MET 63 -5.263 9.186 -4.752
451 HG2 MET 63 1HG MET 63 -2.730 9.861 -4.387
452 HG3 MET 63 2HG MET 63 -2.641 9.466 -6.102
453 HE1 MET 63 1HE MET 63 -3.102 12.206 -3.657
454 HE2 MET 63 2HE MET 63 -4.526 13.115 -4.162
455 HE3 MET 63 3HE MET 63 -4.711 11.515 -3.441
456 H VAL 64 H VAL 64 -2.448 8.733 -2.437
457 HA VAL 64 HA VAL 64 -4.573 9.257 -0.500
458 HB VAL 64 HB VAL 64 -2.004 8.041 0.470
459 HG11 VAL 64 1HG1 VAL 64 -3.489 7.441 2.398
460 HG12 VAL 64 2HG1 VAL 64 -3.260 9.173 2.151
461 HG13 VAL 64 3HG1 VAL 64 -4.758 8.398 1.635
462 HG21 VAL 64 1HG2 VAL 64 -3.389 5.906 0.698
463 HG22 VAL 64 2HG2 VAL 64 -4.470 6.623 -0.497
464 HG23 VAL 64 3HG2 VAL 64 -2.784 6.310 -0.908
465 H GLU 65 H GLU 65 -4.006 10.843 1.097
466 HA GLU 65 HA GLU 65 -2.706 13.073 0.141
467 HB2 GLU 65 1HB GLU 65 -2.690 12.544 3.085
468 HB3 GLU 65 2HB GLU 65 -3.038 14.036 2.223
469 HG2 GLU 65 1HG GLU 65 -4.814 11.705 2.763
470 HG3 GLU 65 2HG GLU 65 -5.110 13.425 3.012
471 H GLY 66 H GLY 66 -0.674 13.966 0.348
472 HA2 GLY 66 1HA GLY 66 1.502 12.133 0.513
473 HA3 GLY 66 2HA GLY 66 1.626 13.877 0.334
474 H ASP 67 H ASP 67 -0.243 13.699 2.912
475 HA ASP 67 HA ASP 67 2.045 13.716 4.758
476 HB2 ASP 67 1HB ASP 67 -0.694 14.943 5.142
477 HB3 ASP 67 2HB ASP 67 0.698 15.133 6.205
478 H ARG 68 H ARG 68 -0.744 11.978 3.908
479 HA ARG 68 HA ARG 68 -1.205 10.832 6.522
480 HB2 ARG 68 1HB ARG 68 -2.942 11.234 4.636
481 HB3 ARG 68 2HB ARG 68 -2.313 9.740 3.954
482 HG2 ARG 68 1HG ARG 68 -4.025 8.894 5.178
483 HG3 ARG 68 2HG ARG 68 -2.759 8.858 6.407
484 HD2 ARG 68 1HD ARG 68 -4.449 11.299 6.114
485 HD3 ARG 68 2HD ARG 68 -5.110 9.887 6.937
486 HE ARG 68 HE ARG 68 -2.583 10.446 8.008
487 HH11 ARG 68 1HH1 ARG 68 -5.783 11.811 7.881
488 HH12 ARG 68 2HH1 ARG 68 -5.640 12.621 9.406
489 HH21 ARG 68 1HH2 ARG 68 -2.382 11.507 10.017
490 HH22 ARG 68 2HH2 ARG 68 -3.704 12.448 10.620
491 H TYR 69 H TYR 69 -0.268 9.069 7.325
492 HA TYR 69 HA TYR 69 1.389 7.440 5.517
493 HB2 TYR 69 1HB TYR 69 1.702 8.260 8.378
494 HB3 TYR 69 2HB TYR 69 2.423 6.749 7.837
495 HD1 TYR 69 2HD TYR 69 2.158 9.529 5.497
496 HD2 TYR 69 1HD TYR 69 4.661 7.617 8.357
497 HE1 TYR 69 2HE TYR 69 4.094 10.770 4.624
498 HE2 TYR 69 1HE TYR 69 6.604 8.853 7.493
499 HH TYR 69 HH TYR 69 7.052 10.944 6.254
500 H TRP 70 H TRP 70 -1.563 7.305 6.556
501 HA TRP 70 HA TRP 70 -1.486 4.406 7.008
502 HB2 TRP 70 1HB TRP 70 -3.020 4.482 8.802
503 HB3 TRP 70 2HB TRP 70 -1.840 5.739 9.162
504 HD1 TRP 70 HD TRP 70 -2.669 8.328 8.548
505 HE1 TRP 70 1HE TRP 70 -5.019 9.356 8.763
506 HE3 TRP 70 3HE TRP 70 -5.427 4.026 8.697
507 HZ2 TRP 70 2HZ TRP 70 -7.689 8.462 8.969
508 HZ3 TRP 70 3HZ TRP 70 -7.873 4.200 8.904
509 HH2 TRP 70 HH TRP 70 -8.978 6.372 9.038
510 H HIS 71 H HIS 71 -3.210 3.251 6.153
511 HA HIS 71 HA HIS 71 -5.459 4.594 4.960
512 HB2 HIS 71 1HB HIS 71 -3.774 4.956 3.223
513 HB3 HIS 71 2HB HIS 71 -3.423 3.231 3.185
514 HD1 HIS 71 1HD HIS 71 -6.438 5.490 2.627
515 HD2 HIS 71 2HD HIS 71 -4.796 1.927 1.258
516 HE1 HIS 71 1HE HIS 71 -7.942 4.729 0.760
517 HE2 HIS 71 2HE HIS 71 -6.977 2.529 0.005
518 H SER 72 H SER 72 -7.185 3.272 4.847
519 HA SER 72 HA SER 72 -6.728 0.429 5.451
520 HB2 SER 72 1HB SER 72 -8.920 0.389 6.462
521 HB3 SER 72 2HB SER 72 -8.037 1.768 7.119
522 HG SER 72 HG SER 72 -9.820 1.965 4.926
523 H ILE 73 H ILE 73 -6.727 -0.691 3.602
524 HA ILE 73 HA ILE 73 -8.206 0.061 1.290
525 HB ILE 73 HB ILE 73 -7.011 -2.649 1.865
526 HG12 ILE 73 1HG1 ILE 73 -5.642 -0.384 0.422
527 HG13 ILE 73 2HG1 ILE 73 -5.449 -0.637 2.153
528 HG21 ILE 73 1HG2 ILE 73 -8.456 -2.688 -0.040
529 HG22 ILE 73 2HG2 ILE 73 -7.732 -1.215 -0.683
530 HG23 ILE 73 3HG2 ILE 73 -6.790 -2.704 -0.618
531 HD11 ILE 73 1HD1 ILE 73 -3.610 -1.612 0.910
532 HD12 ILE 73 2HD1 ILE 73 -4.550 -2.864 1.723
533 HD13 ILE 73 3HD1 ILE 73 -4.741 -2.604 -0.011
534 H SER 74 H SER 74 -9.927 -1.097 0.284
535 HA SER 74 HA SER 74 -11.457 -2.922 1.979
536 HB2 SER 74 1HB SER 74 -12.845 -0.600 0.651
537 HB3 SER 74 2HB SER 74 -13.464 -1.679 1.901
538 HG SER 74 HG SER 74 -12.448 0.629 2.323
539 H HIS 75 H HIS 75 -13.561 -3.544 0.637
540 HA HIS 75 HA HIS 75 -14.388 -4.687 -1.147
541 HB2 HIS 75 1HB HIS 75 -12.630 -2.786 -2.713
542 HB3 HIS 75 2HB HIS 75 -13.886 -3.808 -3.405
543 HD1 HIS 75 1HD HIS 75 -15.423 -1.967 -4.199
544 HD2 HIS 75 2HD HIS 75 -14.467 -1.655 -0.168
545 HE1 HIS 75 1HE HIS 75 -16.941 -0.183 -3.284
546 HE2 HIS 75 2HE HIS 75 -16.286 0.048 -0.864
547 H LEU 76 H LEU 76 -12.411 -5.994 0.161
548 HA LEU 76 HA LEU 76 -10.796 -7.192 -1.993
549 HB2 LEU 76 1HB LEU 76 -10.213 -7.269 0.960
550 HB3 LEU 76 2HB LEU 76 -9.168 -7.820 -0.348
551 HG LEU 76 HG LEU 76 -9.962 -4.941 -0.197
552 HD11 LEU 76 1HD1 LEU 76 -8.688 -6.257 1.920
553 HD12 LEU 76 2HD1 LEU 76 -8.813 -4.520 1.651
554 HD13 LEU 76 3HD1 LEU 76 -7.416 -5.407 1.042
555 HD21 LEU 76 1HD2 LEU 76 -8.810 -5.673 -2.180
556 HD22 LEU 76 2HD2 LEU 76 -7.547 -6.435 -1.213
557 HD23 LEU 76 3HD2 LEU 76 -7.719 -4.679 -1.214
558 H GLN 77 H GLN 77 -10.149 -9.543 -1.354
559 HA GLN 77 HA GLN 77 -12.643 -10.976 -0.954
560 HB2 GLN 77 1HB GLN 77 -9.888 -11.985 -1.681
561 HB3 GLN 77 2HB GLN 77 -11.353 -12.959 -1.649
562 HG2 GLN 77 1HG GLN 77 -12.210 -11.981 -3.545
563 HG3 GLN 77 2HG GLN 77 -11.257 -10.511 -3.346
564 HE21 GLN 77 1HE2 GLN 77 -10.201 -10.416 -5.233
565 HE22 GLN 77 2HE2 GLN 77 -9.138 -11.639 -5.831
566 HA PRO 78 HA PRO 78 -11.890 -12.002 3.261
567 HB2 PRO 78 1HB PRO 78 -13.462 -14.208 3.441
568 HB3 PRO 78 2HB PRO 78 -14.114 -12.568 3.361
569 HG2 PRO 78 1HG PRO 78 -13.830 -14.602 1.183
570 HG3 PRO 78 2HG PRO 78 -15.192 -13.523 1.535
571 HD2 PRO 78 1HD PRO 78 -13.391 -13.005 -0.419
572 HD3 PRO 78 2HD PRO 78 -14.192 -11.719 0.506
573 H GLU 79 H GLU 79 -10.697 -13.415 4.529
574 HA GLU 79 HA GLU 79 -8.794 -14.710 4.774
575 HB2 GLU 79 1HB GLU 79 -9.507 -17.188 4.158
576 HB3 GLU 79 2HB GLU 79 -10.188 -16.351 5.545
577 HG2 GLU 79 1HG GLU 79 -12.197 -15.883 4.399
578 HG3 GLU 79 2HG GLU 79 -11.506 -16.357 2.848
579 H THR 80 H THR 80 -8.708 -13.352 2.292
580 HA THR 80 HA THR 80 -7.561 -15.375 0.487
581 HB THR 80 HB THR 80 -8.499 -12.564 -0.117
582 HG1 THR 80 1HG THR 80 -9.927 -14.654 0.143
583 HG21 THR 80 1HG2 THR 80 -6.470 -13.598 -1.415
584 HG22 THR 80 2HG2 THR 80 -7.767 -12.789 -2.294
585 HG23 THR 80 3HG2 THR 80 -7.723 -14.550 -2.209
586 H SER 81 H SER 81 -5.465 -15.592 1.050
587 HA SER 81 HA SER 81 -3.848 -13.415 1.945
588 HB2 SER 81 1HB SER 81 -3.622 -16.011 2.363
589 HB3 SER 81 2HB SER 81 -2.648 -15.949 0.894
590 HG SER 81 HG SER 81 -1.432 -14.250 1.975
591 H TYR 82 H TYR 82 -3.432 -11.811 0.552
592 HA TYR 82 HA TYR 82 -2.234 -12.536 -2.036
593 HB2 TYR 82 1HB TYR 82 -3.310 -10.417 -2.937
594 HB3 TYR 82 2HB TYR 82 -4.401 -11.761 -2.618
595 HD1 TYR 82 1HD TYR 82 -3.106 -8.613 -1.107
596 HD2 TYR 82 2HD TYR 82 -6.274 -11.449 -1.263
597 HE1 TYR 82 1HE TYR 82 -4.475 -7.152 0.321
598 HE2 TYR 82 2HE TYR 82 -7.653 -9.995 0.164
599 HH TYR 82 HH TYR 82 -7.783 -8.066 1.248
600 H ASP 83 H ASP 83 -0.794 -10.910 -2.926
601 HA ASP 83 HA ASP 83 0.908 -9.800 -0.910
602 HB2 ASP 83 1HB ASP 83 2.308 -9.073 -2.791
603 HB3 ASP 83 2HB ASP 83 1.836 -10.761 -2.965
604 H ILE 84 H ILE 84 1.512 -7.590 -0.689
605 HA ILE 84 HA ILE 84 -0.253 -5.598 -1.887
606 HB ILE 84 HB ILE 84 0.089 -5.869 1.102
607 HG12 ILE 84 1HG1 ILE 84 -2.499 -5.950 -0.433
608 HG13 ILE 84 2HG1 ILE 84 -1.552 -7.409 -0.165
609 HG21 ILE 84 1HG2 ILE 84 -1.315 -3.778 -0.552
610 HG22 ILE 84 2HG2 ILE 84 -1.483 -3.948 1.194
611 HG23 ILE 84 3HG2 ILE 84 0.085 -3.547 0.494
612 HD11 ILE 84 1HD1 ILE 84 -2.736 -7.613 1.705
613 HD12 ILE 84 2HD1 ILE 84 -1.707 -6.330 2.344
614 HD13 ILE 84 3HD1 ILE 84 -3.280 -5.937 1.650
615 H LYS 85 H LYS 85 0.766 -3.732 -2.328
616 HA LYS 85 HA LYS 85 3.192 -3.007 -0.889
617 HB2 LYS 85 1HB LYS 85 4.651 -3.078 -2.667
618 HB3 LYS 85 2HB LYS 85 3.639 -4.470 -3.032
619 HG2 LYS 85 1HG LYS 85 2.344 -3.129 -4.602
620 HG3 LYS 85 2HG LYS 85 3.338 -1.720 -4.225
621 HD2 LYS 85 1HD LYS 85 4.411 -2.454 -6.105
622 HD3 LYS 85 2HD LYS 85 5.295 -3.375 -4.886
623 HE2 LYS 85 1HE LYS 85 3.576 -5.217 -5.278
624 HE3 LYS 85 2HE LYS 85 3.099 -4.311 -6.713
625 HZ1 LYS 85 1HZ LYS 85 5.845 -4.494 -6.822
626 HZ2 LYS 85 2HZ LYS 85 4.732 -5.342 -7.771
627 HZ3 LYS 85 3HZ LYS 85 5.324 -6.031 -6.344
628 H MET 86 H MET 86 3.963 -0.813 -1.512
629 HA MET 86 HA MET 86 2.130 0.895 -2.934
630 HB2 MET 86 1HB MET 86 1.530 2.326 -1.101
631 HB3 MET 86 2HB MET 86 1.084 0.678 -0.678
632 HG2 MET 86 1HG MET 86 2.049 1.316 1.270
633 HG3 MET 86 2HG MET 86 3.470 0.688 0.439
634 HE1 MET 86 1HE MET 86 2.040 4.535 -0.527
635 HE2 MET 86 2HE MET 86 1.219 3.633 0.746
636 HE3 MET 86 3HE MET 86 2.256 4.998 1.161
637 H GLN 87 H GLN 87 2.934 3.097 -3.139
638 HA GLN 87 HA GLN 87 5.682 3.560 -2.293
639 HB2 GLN 87 1HB GLN 87 6.447 4.087 -4.555
640 HB3 GLN 87 2HB GLN 87 5.920 2.413 -4.443
641 HG2 GLN 87 1HG GLN 87 4.976 3.041 -6.426
642 HG3 GLN 87 2HG GLN 87 3.653 3.365 -5.306
643 HE21 GLN 87 1HE2 GLN 87 2.800 4.837 -6.832
644 HE22 GLN 87 2HE2 GLN 87 3.466 6.421 -7.007
645 H CYS 88 H CYS 88 6.398 5.809 -3.192
646 HA CYS 88 HA CYS 88 4.112 7.645 -2.888
647 HB2 CYS 88 1HB CYS 88 5.455 9.133 -1.653
648 HB3 CYS 88 2HB CYS 88 5.866 7.544 -1.019
649 HG CYS 88 HG CYS 88 8.244 7.357 -2.536
650 H PHE 89 H PHE 89 3.958 9.408 -4.232
651 HA PHE 89 HA PHE 89 5.989 9.663 -6.342
652 HB2 PHE 89 1HB PHE 89 4.364 9.771 -8.058
653 HB3 PHE 89 2HB PHE 89 3.900 8.390 -7.070
654 HD1 PHE 89 1HD PHE 89 2.158 8.876 -5.196
655 HD2 PHE 89 2HD PHE 89 2.786 11.360 -8.595
656 HE1 PHE 89 1HE PHE 89 -0.088 9.838 -4.904
657 HE2 PHE 89 2HE PHE 89 0.542 12.326 -8.308
658 HZ PHE 89 HZ PHE 89 -0.898 11.566 -6.460
659 H ASN 90 H ASN 90 6.015 11.748 -7.411
660 HA ASN 90 HA ASN 90 4.610 13.914 -6.053
661 HB2 ASN 90 1HB ASN 90 6.478 15.054 -5.307
662 HB3 ASN 90 2HB ASN 90 6.979 13.387 -5.038
663 HD21 ASN 90 1HD2 ASN 90 8.593 15.769 -5.455
664 HD22 ASN 90 2HD2 ASN 90 9.581 15.445 -6.835
665 H GLU 91 H GLU 91 5.395 16.092 -7.154
666 HA GLU 91 HA GLU 91 4.419 16.237 -9.676
667 HB2 GLU 91 1HB GLU 91 4.972 18.214 -8.357
668 HB3 GLU 91 2HB GLU 91 6.688 17.885 -8.548
669 HG2 GLU 91 1HG GLU 91 6.650 18.424 -10.831
670 HG3 GLU 91 2HG GLU 91 4.890 18.358 -10.899
671 H GLY 92 H GLY 92 7.673 15.297 -8.750
672 HA2 GLY 92 1HA GLY 92 8.754 15.343 -11.393
673 HA3 GLY 92 2HA GLY 92 9.469 14.560 -9.992
674 H GLY 93 H GLY 93 7.655 12.684 -9.288
675 HA2 GLY 93 1HA GLY 93 6.341 11.179 -11.150
676 HA3 GLY 93 2HA GLY 93 8.026 10.724 -11.357
677 H GLU 94 H GLU 94 6.416 8.735 -10.696
678 HA GLU 94 HA GLU 94 5.954 8.362 -7.932
679 HB2 GLU 94 1HB GLU 94 6.349 6.226 -10.033
680 HB3 GLU 94 2HB GLU 94 5.534 6.042 -8.486
681 HG2 GLU 94 1HG GLU 94 3.651 7.127 -9.185
682 HG3 GLU 94 2HG GLU 94 4.516 8.087 -10.384
683 H SER 95 H SER 95 6.973 6.258 -6.892
684 HA SER 95 HA SER 95 9.892 6.358 -7.248
685 HB2 SER 95 1HB SER 95 10.254 6.417 -4.878
686 HB3 SER 95 2HB SER 95 9.113 7.707 -5.258
687 HG SER 95 HG SER 95 7.537 5.805 -4.783
688 H GLU 96 H GLU 96 10.950 4.489 -5.988
689 HA GLU 96 HA GLU 96 10.304 2.085 -7.088
690 HB2 GLU 96 1HB GLU 96 11.523 2.522 -4.356
691 HB3 GLU 96 2HB GLU 96 11.588 1.020 -5.266
692 HG2 GLU 96 1HG GLU 96 12.740 3.630 -6.219
693 HG3 GLU 96 2HG GLU 96 13.659 2.376 -5.387
694 H PHE 97 H PHE 97 9.397 0.111 -6.179
695 HA PHE 97 HA PHE 97 6.898 0.673 -4.800
696 HB2 PHE 97 1HB PHE 97 7.972 -1.761 -6.221
697 HB3 PHE 97 2HB PHE 97 6.464 -1.787 -5.313
698 HD1 PHE 97 2HD PHE 97 4.574 -0.338 -6.035
699 HD2 PHE 97 1HD PHE 97 8.089 -0.832 -8.384
700 HE1 PHE 97 2HE PHE 97 3.373 0.514 -8.005
701 HE2 PHE 97 1HE PHE 97 6.893 0.020 -10.359
702 HZ PHE 97 HZ PHE 97 4.531 0.693 -10.171
703 H SER 98 H SER 98 6.689 0.456 -2.683
704 HA SER 98 HA SER 98 8.623 -0.260 -0.893
705 HB2 SER 98 1HB SER 98 6.604 0.830 -0.146
706 HB3 SER 98 2HB SER 98 5.624 -0.557 -0.622
707 HG SER 98 HG SER 98 6.229 -1.604 1.127
708 H ASN 99 H ASN 99 8.439 -2.164 0.710
709 HA ASN 99 HA ASN 99 9.026 -4.538 -0.702
710 HB2 ASN 99 1HB ASN 99 9.644 -5.420 1.334
711 HB3 ASN 99 2HB ASN 99 9.724 -3.701 1.709
712 HD21 ASN 99 1HD2 ASN 99 7.165 -3.000 2.089
713 HD22 ASN 99 2HD2 ASN 99 6.483 -3.866 3.419
714 H VAL 100 H VAL 100 7.929 -6.539 -0.725
715 HA VAL 100 HA VAL 100 5.078 -6.290 -0.981
716 HB VAL 100 HB VAL 100 6.809 -8.758 -1.186
717 HG11 VAL 100 1HG1 VAL 100 4.637 -9.541 -0.865
718 HG12 VAL 100 2HG1 VAL 100 3.923 -8.221 -1.794
719 HG13 VAL 100 3HG1 VAL 100 4.810 -9.503 -2.620
720 HG21 VAL 100 1HG2 VAL 100 7.223 -6.780 -2.783
721 HG22 VAL 100 2HG2 VAL 100 6.997 -8.385 -3.478
722 HG23 VAL 100 3HG2 VAL 100 5.671 -7.222 -3.495
723 H MET 101 H MET 101 3.747 -6.381 0.697
724 HA MET 101 HA MET 101 4.479 -8.069 2.994
725 HB2 MET 101 1HB MET 101 2.590 -5.711 2.874
726 HB3 MET 101 2HB MET 101 2.948 -6.657 4.313
727 HG2 MET 101 1HG MET 101 5.006 -5.114 2.755
728 HG3 MET 101 2HG MET 101 4.154 -4.489 4.165
729 HE1 MET 101 1HE MET 101 4.089 -5.368 6.280
730 HE2 MET 101 2HE MET 101 5.166 -6.540 7.039
731 HE3 MET 101 3HE MET 101 5.712 -4.884 6.771
732 H ILE 102 H ILE 102 3.383 -9.893 3.234
733 HA ILE 102 HA ILE 102 0.923 -10.309 1.735
734 HB ILE 102 HB ILE 102 2.604 -12.208 3.371
735 HG12 ILE 102 1HG1 ILE 102 2.123 -12.134 0.389
736 HG13 ILE 102 2HG1 ILE 102 3.508 -11.377 1.167
737 HG21 ILE 102 1HG2 ILE 102 0.759 -13.514 1.615
738 HG22 ILE 102 2HG2 ILE 102 0.945 -13.680 3.360
739 HG23 ILE 102 3HG2 ILE 102 -0.116 -12.435 2.701
740 HD11 ILE 102 1HD1 ILE 102 4.351 -13.474 1.883
741 HD12 ILE 102 2HD1 ILE 102 2.867 -14.301 1.409
742 HD13 ILE 102 3HD1 ILE 102 3.933 -13.628 0.177
743 H CYS 103 H CYS 103 -0.752 -9.331 2.756
744 HA CYS 103 HA CYS 103 -1.167 -9.948 5.602
745 HB2 CYS 103 1HB CYS 103 -1.056 -7.508 4.680
746 HB3 CYS 103 2HB CYS 103 -2.693 -7.831 4.121
747 HG CYS 103 HG CYS 103 -3.902 -7.584 6.397
748 H GLU 104 H GLU 104 -2.394 -11.715 5.789
749 HA GLU 104 HA GLU 104 -4.372 -12.432 3.838
750 HB2 GLU 104 1HB GLU 104 -2.948 -14.002 5.310
751 HB3 GLU 104 2HB GLU 104 -4.123 -13.659 6.572
752 HG2 GLU 104 1HG GLU 104 -5.828 -14.338 4.672
753 HG3 GLU 104 2HG GLU 104 -4.425 -15.219 4.070
754 H THR 105 H THR 105 -6.385 -11.713 3.752
755 HA THR 105 HA THR 105 -7.489 -9.927 5.616
756 HB THR 105 HB THR 105 -9.701 -10.550 4.402
757 HG1 THR 105 1HG THR 105 -8.033 -11.551 2.385
758 HG21 THR 105 1HG2 THR 105 -8.072 -8.593 3.980
759 HG22 THR 105 2HG2 THR 105 -9.220 -9.014 2.709
760 HG23 THR 105 3HG2 THR 105 -7.539 -9.532 2.586
761 H LYS 106 H LYS 106 -9.733 -10.332 6.604
762 HA LYS 106 HA LYS 106 -9.466 -12.502 8.466
763 HB2 LYS 106 1HB LYS 106 -11.713 -10.511 8.095
764 HB3 LYS 106 2HB LYS 106 -11.532 -11.603 9.462
765 HG2 LYS 106 1HG LYS 106 -9.267 -9.793 8.850
766 HG3 LYS 106 2HG LYS 106 -10.727 -9.081 9.542
767 HD2 LYS 106 1HD LYS 106 -10.599 -10.504 11.456
768 HD3 LYS 106 2HD LYS 106 -9.307 -11.461 10.727
769 HE2 LYS 106 1HE LYS 106 -8.101 -10.108 12.136
770 HE3 LYS 106 2HE LYS 106 -8.063 -9.157 10.653
771 HZ1 LYS 106 1HZ LYS 106 -9.000 -7.502 11.755
772 HZ2 LYS 106 2HZ LYS 106 -9.092 -8.436 13.162
773 HZ3 LYS 106 3HZ LYS 106 -10.368 -8.451 12.052
774 H ALA 107 H ALA 107 -11.108 -14.107 8.877
775 HA ALA 107 HA ALA 107 -12.084 -15.285 6.432
776 HB1 ALA 107 1HB ALA 107 -12.857 -16.478 9.017
777 HB2 ALA 107 2HB ALA 107 -12.181 -17.231 7.573
778 HB3 ALA 107 3HB ALA 107 -11.127 -16.370 8.694
779 H ARG 108 H ARG 108 -14.050 -15.037 5.604
780 HA ARG 108 HA ARG 108 -16.003 -13.397 6.862
781 HB2 ARG 108 1HB ARG 108 -17.418 -13.992 4.911
782 HB3 ARG 108 2HB ARG 108 -15.820 -13.415 4.455
783 HG2 ARG 108 1HG ARG 108 -15.175 -15.427 3.624
784 HG3 ARG 108 2HG ARG 108 -16.179 -16.340 4.752
785 HD2 ARG 108 1HD ARG 108 -16.910 -16.425 2.349
786 HD3 ARG 108 2HD ARG 108 -18.143 -15.897 3.494
787 HE ARG 108 HE ARG 108 -17.089 -13.567 2.661
788 HH11 ARG 108 1HH1 ARG 108 -18.267 -16.360 0.949
789 HH12 ARG 108 2HH1 ARG 108 -18.782 -15.455 -0.436
790 HH21 ARG 108 1HH2 ARG 108 -17.763 -12.365 0.844
791 HH22 ARG 108 2HH2 ARG 108 -18.494 -13.183 -0.495
792 H SER 109 H SER 109 -17.846 -13.911 7.933
793 HA SER 109 HA SER 109 -18.181 -16.736 8.663
794 HB2 SER 109 1HB SER 109 -17.836 -15.235 10.552
795 HB3 SER 109 2HB SER 109 -19.179 -14.222 10.024
796 HG SER 109 HG SER 109 -20.596 -15.798 10.572
797 H GLY 110 H GLY 110 -19.990 -17.843 8.179
798 HA2 GLY 110 1HA GLY 110 -22.563 -16.982 7.886
799 HA3 GLY 110 2HA GLY 110 -21.843 -16.681 6.312
800 HA PRO 111 HA PRO 111 -23.496 -21.041 6.469
801 HB2 PRO 111 1HB PRO 111 -24.993 -20.832 4.213
802 HB3 PRO 111 2HB PRO 111 -25.604 -20.400 5.814
803 HG2 PRO 111 1HG PRO 111 -24.535 -18.626 3.653
804 HG3 PRO 111 2HG PRO 111 -25.952 -18.394 4.692
805 HD2 PRO 111 1HD PRO 111 -23.587 -17.160 5.156
806 HD3 PRO 111 2HD PRO 111 -24.686 -17.642 6.465
807 H SER 112 H SER 112 -21.706 -19.057 4.349
808 HA SER 112 HA SER 112 -21.265 -20.647 2.131
809 HB2 SER 112 1HB SER 112 -19.478 -18.708 3.590
810 HB3 SER 112 2HB SER 112 -18.942 -19.536 2.128
811 HG SER 112 HG SER 112 -21.147 -17.779 2.420
812 H SER 113 H SER 113 -19.862 -22.292 1.609
813 HA SER 113 HA SER 113 -18.383 -23.523 3.838
814 HB2 SER 113 1HB SER 113 -18.995 -25.750 2.896
815 HB3 SER 113 2HB SER 113 -20.388 -24.842 3.483
816 HG SER 113 HG SER 113 -20.624 -25.854 1.364
817 H GLY 114 H GLY 114 -18.756 -23.424 0.299
818 HA2 GLY 114 1HA GLY 114 -16.585 -22.687 -0.801
819 HA3 GLY 114 2HA GLY 114 -15.879 -24.040 0.070
Start of MODEL 8
1 H1 GLY 1 H GLY 1 27.061 15.994 -13.416
2 HA2 GLY 1 1HA GLY 1 27.045 13.176 -12.865
3 HA3 GLY 1 2HA GLY 1 27.639 14.123 -11.509
4 H SER 2 H SER 2 25.084 12.513 -12.217
5 HA SER 2 HA SER 2 23.316 14.146 -10.676
6 HB2 SER 2 1HB SER 2 21.550 14.404 -12.358
7 HB3 SER 2 2HB SER 2 23.027 15.214 -12.880
8 HG SER 2 HG SER 2 23.292 12.862 -13.852
9 H SER 3 H SER 3 21.020 13.068 -10.708
10 HA SER 3 HA SER 3 21.475 10.173 -10.476
11 HB2 SER 3 1HB SER 3 20.827 11.303 -8.391
12 HB3 SER 3 2HB SER 3 19.363 11.906 -9.167
13 HG SER 3 HG SER 3 20.022 9.293 -8.382
14 H GLY 4 H GLY 4 21.003 11.155 -13.027
15 HA2 GLY 4 1HA GLY 4 19.744 10.538 -14.857
16 HA3 GLY 4 2HA GLY 4 18.722 9.604 -13.775
17 H SER 5 H SER 5 17.082 10.790 -12.543
18 HA SER 5 HA SER 5 16.321 13.376 -13.675
19 HB2 SER 5 1HB SER 5 14.116 12.696 -14.269
20 HB3 SER 5 2HB SER 5 15.200 11.497 -14.973
21 HG SER 5 HG SER 5 13.772 10.245 -13.976
22 H SER 6 H SER 6 14.916 14.598 -12.364
23 HA SER 6 HA SER 6 15.292 14.286 -9.594
24 HB2 SER 6 1HB SER 6 13.432 16.028 -11.211
25 HB3 SER 6 2HB SER 6 13.489 16.094 -9.449
26 HG SER 6 HG SER 6 15.934 16.290 -10.015
27 H GLY 7 H GLY 7 13.604 14.062 -7.946
28 HA2 GLY 7 1HA GLY 7 11.237 13.384 -7.565
29 HA3 GLY 7 2HA GLY 7 11.496 12.183 -8.821
30 HA PRO 8 HA PRO 8 12.757 10.739 -4.410
31 HB2 PRO 8 1HB PRO 8 10.430 9.633 -3.555
32 HB3 PRO 8 2HB PRO 8 10.879 11.309 -3.216
33 HG2 PRO 8 1HG PRO 8 9.051 10.227 -5.325
34 HG3 PRO 8 2HG PRO 8 8.838 11.643 -4.279
35 HD2 PRO 8 1HD PRO 8 9.657 11.842 -6.852
36 HD3 PRO 8 2HD PRO 8 10.190 12.971 -5.590
37 H VAL 9 H VAL 9 13.446 8.664 -4.129
38 HA VAL 9 HA VAL 9 12.316 6.594 -5.892
39 HB VAL 9 HB VAL 9 14.669 5.665 -6.066
40 HG11 VAL 9 1HG1 VAL 9 13.475 7.930 -7.461
41 HG12 VAL 9 2HG1 VAL 9 15.229 7.845 -7.637
42 HG13 VAL 9 3HG1 VAL 9 14.227 6.471 -8.104
43 HG21 VAL 9 1HG2 VAL 9 15.319 8.416 -5.020
44 HG22 VAL 9 2HG2 VAL 9 15.756 6.865 -4.302
45 HG23 VAL 9 3HG2 VAL 9 16.484 7.366 -5.828
46 H ALA 10 H ALA 10 14.024 7.379 -2.920
47 HA ALA 10 HA ALA 10 14.544 4.997 -1.759
48 HB1 ALA 10 1HB ALA 10 13.111 6.691 0.117
49 HB2 ALA 10 2HB ALA 10 14.805 6.199 0.101
50 HB3 ALA 10 3HB ALA 10 14.281 7.588 -0.851
51 H GLY 11 H GLY 11 11.352 6.413 -2.220
52 HA2 GLY 11 1HA GLY 11 9.248 5.517 -2.026
53 HA3 GLY 11 2HA GLY 11 10.018 3.951 -2.237
54 HA PRO 12 HA PRO 12 8.481 4.813 2.236
55 HB2 PRO 12 1HB PRO 12 5.975 3.776 2.111
56 HB3 PRO 12 2HB PRO 12 6.324 5.484 1.821
57 HG2 PRO 12 1HG PRO 12 5.879 3.280 -0.155
58 HG3 PRO 12 2HG PRO 12 5.262 4.942 -0.176
59 HD2 PRO 12 1HD PRO 12 7.387 4.159 -1.659
60 HD3 PRO 12 2HD PRO 12 7.238 5.799 -0.997
61 H TYR 13 H TYR 13 8.248 3.173 3.821
62 HA TYR 13 HA TYR 13 8.546 0.424 2.803
63 HB2 TYR 13 1HB TYR 13 10.704 0.953 3.559
64 HB3 TYR 13 2HB TYR 13 10.097 1.863 4.939
65 HD1 TYR 13 1HD TYR 13 10.135 -1.611 3.568
66 HD2 TYR 13 2HD TYR 13 10.107 0.865 7.029
67 HE1 TYR 13 1HE TYR 13 10.398 -3.602 4.987
68 HE2 TYR 13 2HE TYR 13 10.372 -1.120 8.457
69 HH TYR 13 HH TYR 13 10.598 -3.323 8.525
70 H ILE 14 H ILE 14 6.825 -0.723 3.358
71 HA ILE 14 HA ILE 14 4.991 0.021 5.371
72 HB ILE 14 HB ILE 14 5.323 -2.706 4.117
73 HG12 ILE 14 1HG1 ILE 14 3.319 -0.674 3.211
74 HG13 ILE 14 2HG1 ILE 14 4.977 -0.565 2.628
75 HG21 ILE 14 1HG2 ILE 14 3.291 -1.465 5.878
76 HG22 ILE 14 2HG2 ILE 14 2.710 -2.506 4.580
77 HG23 ILE 14 3HG2 ILE 14 3.837 -3.139 5.779
78 HD11 ILE 14 1HD1 ILE 14 4.463 -2.030 1.059
79 HD12 ILE 14 2HD1 ILE 14 4.207 -3.243 2.314
80 HD13 ILE 14 3HD1 ILE 14 2.856 -2.260 1.749
81 H THR 15 H THR 15 5.071 -0.254 7.495
82 HA THR 15 HA THR 15 6.820 -2.367 8.578
83 HB THR 15 HB THR 15 7.659 -0.998 10.219
84 HG1 THR 15 1HG THR 15 5.196 0.339 9.982
85 HG21 THR 15 1HG2 THR 15 8.661 0.694 9.100
86 HG22 THR 15 2HG2 THR 15 7.130 1.368 8.540
87 HG23 THR 15 3HG2 THR 15 7.843 -0.014 7.708
88 H PHE 16 H PHE 16 3.698 -1.430 8.200
89 HA PHE 16 HA PHE 16 2.840 -3.073 10.457
90 HB2 PHE 16 1HB PHE 16 2.776 -0.506 10.952
91 HB3 PHE 16 2HB PHE 16 1.352 -0.525 9.918
92 HD1 PHE 16 2HD PHE 16 -0.518 -2.169 10.534
93 HD2 PHE 16 1HD PHE 16 2.603 -1.042 13.199
94 HE1 PHE 16 2HE PHE 16 -1.893 -2.888 12.443
95 HE2 PHE 16 1HE PHE 16 1.233 -1.760 15.113
96 HZ PHE 16 HZ PHE 16 -1.019 -2.683 14.736
97 H THR 17 H THR 17 1.523 -4.587 9.717
98 HA THR 17 HA THR 17 -0.393 -3.925 7.601
99 HB THR 17 HB THR 17 0.165 -6.372 6.748
100 HG1 THR 17 1HG THR 17 1.819 -6.869 8.156
101 HG21 THR 17 1HG2 THR 17 0.677 -3.797 5.855
102 HG22 THR 17 2HG2 THR 17 0.826 -5.280 4.911
103 HG23 THR 17 3HG2 THR 17 2.237 -4.609 5.729
104 H ASP 18 H ASP 18 -2.321 -4.341 8.443
105 HA ASP 18 HA ASP 18 -2.770 -6.918 9.748
106 HB2 ASP 18 1HB ASP 18 -2.332 -5.042 11.457
107 HB3 ASP 18 2HB ASP 18 -3.902 -4.409 10.968
108 H ALA 19 H ALA 19 -5.024 -7.535 9.832
109 HA ALA 19 HA ALA 19 -6.516 -6.405 7.581
110 HB1 ALA 19 1HB ALA 19 -6.868 -8.542 7.100
111 HB2 ALA 19 2HB ALA 19 -6.143 -9.052 8.625
112 HB3 ALA 19 3HB ALA 19 -7.862 -8.663 8.552
113 H VAL 20 H VAL 20 -7.906 -4.847 8.095
114 HA VAL 20 HA VAL 20 -8.999 -4.524 10.713
115 HB VAL 20 HB VAL 20 -9.905 -3.174 8.169
116 HG11 VAL 20 1HG1 VAL 20 -11.503 -2.682 9.774
117 HG12 VAL 20 2HG1 VAL 20 -10.324 -2.653 11.087
118 HG13 VAL 20 3HG1 VAL 20 -10.382 -1.330 9.921
119 HG21 VAL 20 1HG2 VAL 20 -7.899 -2.071 10.112
120 HG22 VAL 20 2HG2 VAL 20 -7.412 -3.033 8.717
121 HG23 VAL 20 3HG2 VAL 20 -8.277 -1.514 8.482
122 H ASN 21 H ASN 21 -10.070 -6.034 7.762
123 HA ASN 21 HA ASN 21 -12.266 -7.281 9.143
124 HB2 ASN 21 1HB ASN 21 -12.715 -5.100 7.150
125 HB3 ASN 21 2HB ASN 21 -13.822 -6.470 7.159
126 HD21 ASN 21 1HD2 ASN 21 -14.577 -3.845 7.736
127 HD22 ASN 21 2HD2 ASN 21 -15.075 -3.769 9.388
128 H GLU 22 H GLU 22 -13.669 -8.437 7.234
129 HA GLU 22 HA GLU 22 -11.855 -10.311 6.095
130 HB2 GLU 22 1HB GLU 22 -13.774 -11.472 5.312
131 HB3 GLU 22 2HB GLU 22 -14.203 -10.803 6.880
132 HG2 GLU 22 1HG GLU 22 -14.843 -9.234 4.439
133 HG3 GLU 22 2HG GLU 22 -15.831 -10.639 4.832
134 H THR 23 H THR 23 -13.319 -7.395 4.977
135 HA THR 23 HA THR 23 -12.209 -7.887 2.291
136 HB THR 23 HB THR 23 -13.986 -6.228 1.495
137 HG1 THR 23 1HG THR 23 -15.757 -5.957 2.826
138 HG21 THR 23 1HG2 THR 23 -15.090 -8.020 0.733
139 HG22 THR 23 2HG2 THR 23 -15.566 -8.513 2.359
140 HG23 THR 23 3HG2 THR 23 -13.993 -8.986 1.719
141 H THR 24 H THR 24 -11.621 -6.292 5.008
142 HA THR 24 HA THR 24 -10.543 -3.944 3.595
143 HB THR 24 HB THR 24 -11.373 -3.777 6.476
144 HG1 THR 24 1HG THR 24 -13.243 -4.387 5.310
145 HG21 THR 24 1HG2 THR 24 -9.908 -2.057 5.259
146 HG22 THR 24 2HG2 THR 24 -11.310 -1.454 6.141
147 HG23 THR 24 3HG2 THR 24 -11.375 -1.616 4.387
148 H ILE 25 H ILE 25 -8.523 -3.209 4.253
149 HA ILE 25 HA ILE 25 -7.139 -4.685 6.363
150 HB ILE 25 HB ILE 25 -6.277 -4.598 3.485
151 HG12 ILE 25 1HG1 ILE 25 -6.527 -6.794 5.550
152 HG13 ILE 25 2HG1 ILE 25 -7.561 -6.544 4.147
153 HG21 ILE 25 1HG2 ILE 25 -4.604 -4.550 5.910
154 HG22 ILE 25 2HG2 ILE 25 -4.162 -5.745 4.692
155 HG23 ILE 25 3HG2 ILE 25 -4.236 -4.036 4.263
156 HD11 ILE 25 1HD1 ILE 25 -5.316 -6.814 2.833
157 HD12 ILE 25 2HD1 ILE 25 -4.807 -7.646 4.303
158 HD13 ILE 25 3HD1 ILE 25 -6.209 -8.224 3.403
159 H MET 26 H MET 26 -5.706 -3.474 7.483
160 HA MET 26 HA MET 26 -5.283 -0.716 6.544
161 HB2 MET 26 1HB MET 26 -6.346 -0.427 8.559
162 HB3 MET 26 2HB MET 26 -5.701 -1.915 9.237
163 HG2 MET 26 1HG MET 26 -3.739 -0.930 9.898
164 HG3 MET 26 2HG MET 26 -3.846 0.343 8.685
165 HE1 MET 26 1HE MET 26 -5.600 2.981 9.646
166 HE2 MET 26 2HE MET 26 -4.158 3.048 10.660
167 HE3 MET 26 3HE MET 26 -4.076 2.320 9.055
168 H LEU 27 H LEU 27 -3.271 0.009 6.194
169 HA LEU 27 HA LEU 27 -1.000 -1.493 7.276
170 HB2 LEU 27 1HB LEU 27 0.036 -1.830 5.246
171 HB3 LEU 27 2HB LEU 27 -1.656 -2.138 4.862
172 HG LEU 27 HG LEU 27 -0.461 0.565 4.377
173 HD11 LEU 27 1HD1 LEU 27 -0.519 -1.242 2.078
174 HD12 LEU 27 2HD1 LEU 27 0.692 -1.653 3.291
175 HD13 LEU 27 3HD1 LEU 27 0.688 -0.049 2.558
176 HD21 LEU 27 1HD2 LEU 27 -2.360 -0.585 2.486
177 HD22 LEU 27 2HD2 LEU 27 -2.377 0.978 3.303
178 HD23 LEU 27 3HD2 LEU 27 -2.996 -0.455 4.126
179 H LYS 28 H LYS 28 0.888 -0.292 7.562
180 HA LYS 28 HA LYS 28 0.635 2.606 7.098
181 HB2 LYS 28 1HB LYS 28 1.952 1.343 9.505
182 HB3 LYS 28 2HB LYS 28 1.666 3.056 9.228
183 HG2 LYS 28 1HG LYS 28 -0.612 2.872 9.635
184 HG3 LYS 28 2HG LYS 28 -0.619 1.128 9.359
185 HD2 LYS 28 1HD LYS 28 0.583 0.755 11.420
186 HD3 LYS 28 2HD LYS 28 0.753 2.494 11.674
187 HE2 LYS 28 1HE LYS 28 -1.036 1.962 13.043
188 HE3 LYS 28 2HE LYS 28 -1.836 2.510 11.571
189 HZ1 LYS 28 1HZ LYS 28 -2.941 0.565 12.072
190 HZ2 LYS 28 2HZ LYS 28 -1.549 -0.232 12.607
191 HZ3 LYS 28 3HZ LYS 28 -1.792 0.027 10.953
192 H TRP 29 H TRP 29 2.474 3.700 6.480
193 HA TRP 29 HA TRP 29 4.853 2.038 5.964
194 HB2 TRP 29 1HB TRP 29 5.238 3.506 3.959
195 HB3 TRP 29 2HB TRP 29 3.817 2.472 3.848
196 HD1 TRP 29 HD TRP 29 4.809 6.153 4.286
197 HE1 TRP 29 1HE TRP 29 2.775 7.621 3.709
198 HE3 TRP 29 3HE TRP 29 1.293 2.484 3.732
199 HZ2 TRP 29 2HZ TRP 29 0.041 7.269 3.101
200 HZ3 TRP 29 3HZ TRP 29 -1.009 3.134 3.153
201 HH2 TRP 29 HH TRP 29 -1.620 5.477 2.845
202 H MET 30 H MET 30 6.895 3.206 5.888
203 HA MET 30 HA MET 30 6.850 5.635 7.556
204 HB2 MET 30 1HB MET 30 8.676 4.902 8.779
205 HB3 MET 30 2HB MET 30 7.791 3.404 8.521
206 HG2 MET 30 1HG MET 30 9.274 2.795 6.717
207 HG3 MET 30 2HG MET 30 10.119 4.334 6.859
208 HE1 MET 30 1HE MET 30 10.451 4.859 9.857
209 HE2 MET 30 2HE MET 30 11.950 4.024 10.264
210 HE3 MET 30 3HE MET 30 11.828 4.933 8.757
211 H TYR 31 H TYR 31 8.571 7.161 7.201
212 HA TYR 31 HA TYR 31 9.752 6.982 4.508
213 HB2 TYR 31 1HB TYR 31 7.843 8.626 4.725
214 HB3 TYR 31 2HB TYR 31 8.854 9.541 5.838
215 HD1 TYR 31 1HD TYR 31 8.399 8.504 2.345
216 HD2 TYR 31 2HD TYR 31 10.737 10.824 5.039
217 HE1 TYR 31 1HE TYR 31 9.429 9.670 0.439
218 HE2 TYR 31 2HE TYR 31 11.772 11.997 3.141
219 HH TYR 31 HH TYR 31 10.825 11.270 -0.205
220 H ILE 32 H ILE 32 11.885 7.307 4.366
221 HA ILE 32 HA ILE 32 13.296 8.170 6.799
222 HB ILE 32 HB ILE 32 14.337 6.536 4.482
223 HG12 ILE 32 1HG1 ILE 32 14.550 4.857 6.504
224 HG13 ILE 32 2HG1 ILE 32 13.267 5.847 7.190
225 HG21 ILE 32 1HG2 ILE 32 15.761 8.134 6.238
226 HG22 ILE 32 2HG2 ILE 32 15.903 6.514 6.918
227 HG23 ILE 32 3HG2 ILE 32 16.406 6.819 5.255
228 HD11 ILE 32 1HD1 ILE 32 11.862 5.385 5.265
229 HD12 ILE 32 2HD1 ILE 32 13.154 4.425 4.542
230 HD13 ILE 32 3HD1 ILE 32 12.389 3.890 6.038
231 HA PRO 33 HA PRO 33 14.197 11.852 4.419
232 HB2 PRO 33 1HB PRO 33 15.495 13.133 6.430
233 HB3 PRO 33 2HB PRO 33 13.733 13.032 6.334
234 HG2 PRO 33 1HG PRO 33 15.639 11.394 7.962
235 HG3 PRO 33 2HG PRO 33 14.080 12.095 8.434
236 HD2 PRO 33 1HD PRO 33 14.361 9.487 7.762
237 HD3 PRO 33 2HD PRO 33 12.874 10.402 7.438
238 H ALA 34 H ALA 34 16.502 9.943 6.273
239 HA ALA 34 HA ALA 34 18.916 11.014 5.637
240 HB1 ALA 34 1HB ALA 34 18.225 8.079 5.612
241 HB2 ALA 34 2HB ALA 34 19.851 8.750 5.739
242 HB3 ALA 34 3HB ALA 34 18.677 9.033 7.024
243 H SER 35 H SER 35 17.574 8.343 3.692
244 HA SER 35 HA SER 35 19.169 9.203 1.422
245 HB2 SER 35 1HB SER 35 19.059 6.810 1.964
246 HB3 SER 35 2HB SER 35 17.311 6.831 1.736
247 HG SER 35 HG SER 35 17.880 6.287 -0.231
248 H ASN 36 H ASN 36 17.313 11.115 2.014
249 HA ASN 36 HA ASN 36 15.328 10.810 -0.143
250 HB2 ASN 36 1HB ASN 36 14.224 10.940 2.025
251 HB3 ASN 36 2HB ASN 36 15.107 12.413 2.414
252 HD21 ASN 36 1HD2 ASN 36 13.163 13.522 2.723
253 HD22 ASN 36 2HD2 ASN 36 12.191 14.036 1.391
254 H ASN 37 H ASN 37 14.913 12.618 -1.464
255 HA ASN 37 HA ASN 37 17.192 14.423 -1.692
256 HB2 ASN 37 1HB ASN 37 16.039 13.069 -3.625
257 HB3 ASN 37 2HB ASN 37 14.894 14.407 -3.615
258 HD21 ASN 37 1HD2 ASN 37 16.296 13.965 -5.853
259 HD22 ASN 37 2HD2 ASN 37 17.498 15.185 -6.079
260 H ASN 38 H ASN 38 15.275 14.783 0.461
261 HA ASN 38 HA ASN 38 13.826 16.330 1.365
262 HB2 ASN 38 1HB ASN 38 15.770 18.218 0.024
263 HB3 ASN 38 2HB ASN 38 14.821 18.528 1.475
264 HD21 ASN 38 1HD2 ASN 38 17.582 18.821 1.359
265 HD22 ASN 38 2HD2 ASN 38 18.309 17.639 2.390
266 H THR 39 H THR 39 12.783 15.424 -1.051
267 HA THR 39 HA THR 39 11.729 17.866 -2.311
268 HB THR 39 HB THR 39 12.870 16.094 -3.752
269 HG1 THR 39 1HG THR 39 11.651 17.524 -4.866
270 HG21 THR 39 1HG2 THR 39 11.624 14.137 -4.349
271 HG22 THR 39 2HG2 THR 39 10.251 14.646 -3.366
272 HG23 THR 39 3HG2 THR 39 11.762 14.168 -2.592
273 HA PRO 40 HA PRO 40 7.811 17.129 -0.427
274 HB2 PRO 40 1HB PRO 40 6.270 18.592 -2.117
275 HB3 PRO 40 2HB PRO 40 7.339 19.324 -0.914
276 HG2 PRO 40 1HG PRO 40 7.788 18.907 -3.845
277 HG3 PRO 40 2HG PRO 40 8.156 20.326 -2.847
278 HD2 PRO 40 1HD PRO 40 10.043 18.524 -3.569
279 HD3 PRO 40 2HD PRO 40 10.101 19.402 -2.027
280 H ILE 41 H ILE 41 6.337 15.546 -0.569
281 HA ILE 41 HA ILE 41 6.080 14.123 -3.115
282 HB ILE 41 HB ILE 41 5.052 13.234 -0.424
283 HG12 ILE 41 1HG1 ILE 41 7.707 12.625 -1.742
284 HG13 ILE 41 2HG1 ILE 41 7.471 13.580 -0.283
285 HG21 ILE 41 1HG2 ILE 41 4.764 11.125 -1.377
286 HG22 ILE 41 2HG2 ILE 41 4.204 12.232 -2.629
287 HG23 ILE 41 3HG2 ILE 41 5.804 11.501 -2.751
288 HD11 ILE 41 1HD1 ILE 41 7.447 11.768 0.991
289 HD12 ILE 41 2HD1 ILE 41 6.273 10.962 -0.051
290 HD13 ILE 41 3HD1 ILE 41 7.993 10.873 -0.427
291 H HIS 42 H HIS 42 4.198 13.942 -4.211
292 HA HIS 42 HA HIS 42 2.127 15.810 -3.716
293 HB2 HIS 42 1HB HIS 42 2.585 13.610 -5.680
294 HB3 HIS 42 2HB HIS 42 0.952 14.246 -5.510
295 HD1 HIS 42 1HD HIS 42 2.657 14.589 -8.102
296 HD2 HIS 42 2HD HIS 42 2.289 17.425 -5.089
297 HE1 HIS 42 1HE HIS 42 3.178 16.796 -9.189
298 HE2 HIS 42 2HE HIS 42 3.032 18.486 -7.327
299 H GLY 43 H GLY 43 2.384 12.307 -3.242
300 HA2 GLY 43 1HA GLY 43 0.554 12.330 -1.071
301 HA3 GLY 43 2HA GLY 43 -0.237 11.741 -2.525
302 H PHE 44 H PHE 44 -0.518 9.644 -1.865
303 HA PHE 44 HA PHE 44 1.872 7.991 -1.921
304 HB2 PHE 44 1HB PHE 44 0.041 8.211 0.451
305 HB3 PHE 44 2HB PHE 44 0.906 6.713 0.123
306 HD1 PHE 44 2HD PHE 44 3.515 7.258 -0.537
307 HD2 PHE 44 1HD PHE 44 1.006 9.533 2.041
308 HE1 PHE 44 2HE PHE 44 5.503 8.158 0.598
309 HE2 PHE 44 1HE PHE 44 2.990 10.437 3.180
310 HZ PHE 44 HZ PHE 44 5.243 9.749 2.460
311 H TYR 45 H TYR 45 1.493 6.389 -3.289
312 HA TYR 45 HA TYR 45 -1.278 5.608 -3.833
313 HB2 TYR 45 1HB TYR 45 1.275 5.469 -5.383
314 HB3 TYR 45 2HB TYR 45 -0.014 4.332 -5.761
315 HD1 TYR 45 2HD TYR 45 -2.435 5.877 -5.529
316 HD2 TYR 45 1HD TYR 45 1.356 7.064 -7.054
317 HE1 TYR 45 2HE TYR 45 -3.535 7.581 -6.919
318 HE2 TYR 45 1HE TYR 45 0.267 8.773 -8.447
319 HH TYR 45 HH TYR 45 -1.987 10.104 -8.301
320 H ILE 46 H ILE 46 -1.972 3.482 -3.744
321 HA ILE 46 HA ILE 46 -0.112 1.531 -2.567
322 HB ILE 46 HB ILE 46 -2.968 1.953 -1.678
323 HG12 ILE 46 1HG1 ILE 46 -0.615 2.230 0.137
324 HG13 ILE 46 2HG1 ILE 46 -0.974 3.555 -0.965
325 HG21 ILE 46 1HG2 ILE 46 -2.638 0.188 -0.131
326 HG22 ILE 46 2HG2 ILE 46 -2.100 -0.411 -1.700
327 HG23 ILE 46 3HG2 ILE 46 -0.915 0.098 -0.497
328 HD11 ILE 46 1HD1 ILE 46 -2.858 2.393 1.074
329 HD12 ILE 46 2HD1 ILE 46 -1.983 3.919 1.209
330 HD13 ILE 46 3HD1 ILE 46 -3.221 3.719 -0.031
331 H TYR 47 H TYR 47 -0.010 -0.257 -3.741
332 HA TYR 47 HA TYR 47 -2.236 -0.882 -5.555
333 HB2 TYR 47 1HB TYR 47 0.660 -1.751 -5.646
334 HB3 TYR 47 2HB TYR 47 -0.576 -2.245 -6.797
335 HD1 TYR 47 2HD TYR 47 0.766 0.927 -5.332
336 HD2 TYR 47 1HD TYR 47 -0.630 -1.109 -8.798
337 HE1 TYR 47 2HE TYR 47 1.240 2.923 -6.688
338 HE2 TYR 47 1HE TYR 47 -0.158 0.881 -10.164
339 HH TYR 47 HH TYR 47 0.330 3.096 -10.085
340 H TYR 48 H TYR 48 -3.129 -2.929 -5.630
341 HA TYR 48 HA TYR 48 -2.141 -5.029 -3.906
342 HB2 TYR 48 1HB TYR 48 -4.447 -5.228 -2.801
343 HB3 TYR 48 2HB TYR 48 -3.384 -3.950 -2.223
344 HD1 TYR 48 2HD TYR 48 -3.798 -1.592 -2.949
345 HD2 TYR 48 1HD TYR 48 -6.549 -4.729 -3.782
346 HE1 TYR 48 2HE TYR 48 -5.554 0.073 -3.386
347 HE2 TYR 48 1HE TYR 48 -8.313 -3.073 -4.223
348 HH TYR 48 HH TYR 48 -8.862 -0.793 -3.735
349 H ARG 49 H ARG 49 -3.053 -7.064 -4.353
350 HA ARG 49 HA ARG 49 -5.222 -7.420 -6.158
351 HB2 ARG 49 1HB ARG 49 -4.081 -8.197 -8.101
352 HB3 ARG 49 2HB ARG 49 -3.391 -6.631 -7.697
353 HG2 ARG 49 1HG ARG 49 -1.479 -7.780 -8.101
354 HG3 ARG 49 2HG ARG 49 -1.661 -8.139 -6.383
355 HD2 ARG 49 1HD ARG 49 -3.076 -10.164 -7.327
356 HD3 ARG 49 2HD ARG 49 -2.074 -9.889 -8.752
357 HE ARG 49 HE ARG 49 -0.637 -10.098 -6.249
358 HH11 ARG 49 1HH1 ARG 49 -1.853 -11.752 -9.061
359 HH12 ARG 49 2HH1 ARG 49 -0.743 -13.075 -8.924
360 HH21 ARG 49 1HH2 ARG 49 0.829 -11.835 -6.058
361 HH22 ARG 49 2HH2 ARG 49 0.781 -13.122 -7.214
362 HA PRO 50 HA PRO 50 -5.111 -11.325 -4.128
363 HB2 PRO 50 1HB PRO 50 -6.775 -12.704 -5.771
364 HB3 PRO 50 2HB PRO 50 -7.347 -11.479 -4.633
365 HG2 PRO 50 1HG PRO 50 -6.834 -11.240 -7.572
366 HG3 PRO 50 2HG PRO 50 -8.191 -10.612 -6.619
367 HD2 PRO 50 1HD PRO 50 -6.112 -9.059 -7.393
368 HD3 PRO 50 2HD PRO 50 -6.988 -8.794 -5.871
369 H THR 51 H THR 51 -3.928 -13.165 -4.202
370 HA THR 51 HA THR 51 -1.926 -13.528 -6.093
371 HB THR 51 HB THR 51 -2.246 -14.574 -3.706
372 HG1 THR 51 1HG THR 51 -0.587 -15.994 -4.240
373 HG21 THR 51 1HG2 THR 51 -3.298 -16.574 -3.517
374 HG22 THR 51 2HG2 THR 51 -2.852 -17.082 -5.146
375 HG23 THR 51 3HG2 THR 51 -4.206 -15.979 -4.906
376 H ASP 52 H ASP 52 -5.237 -14.402 -6.232
377 HA ASP 52 HA ASP 52 -5.011 -16.559 -8.082
378 HB2 ASP 52 1HB ASP 52 -7.056 -16.641 -7.046
379 HB3 ASP 52 2HB ASP 52 -7.222 -14.888 -6.997
380 H SER 53 H SER 53 -4.901 -13.134 -8.359
381 HA SER 53 HA SER 53 -5.847 -12.640 -10.898
382 HB2 SER 53 1HB SER 53 -3.745 -11.403 -9.189
383 HB3 SER 53 2HB SER 53 -3.786 -10.939 -10.890
384 HG SER 53 HG SER 53 -5.560 -10.370 -8.854
385 H ASP 54 H ASP 54 -4.071 -11.817 -12.657
386 HA ASP 54 HA ASP 54 -2.547 -14.244 -13.330
387 HB2 ASP 54 1HB ASP 54 -4.478 -13.325 -14.828
388 HB3 ASP 54 2HB ASP 54 -3.281 -12.136 -15.336
389 H ASN 55 H ASN 55 -2.429 -10.701 -13.692
390 HA ASN 55 HA ASN 55 0.414 -10.748 -13.096
391 HB2 ASN 55 1HB ASN 55 -0.523 -9.363 -15.607
392 HB3 ASN 55 2HB ASN 55 1.132 -9.661 -15.085
393 HD21 ASN 55 1HD2 ASN 55 -1.466 -10.785 -16.909
394 HD22 ASN 55 2HD2 ASN 55 -0.828 -12.336 -17.322
395 H ASP 56 H ASP 56 1.174 -8.250 -13.492
396 HA ASP 56 HA ASP 56 -0.007 -6.788 -11.438
397 HB2 ASP 56 1HB ASP 56 1.585 -5.693 -13.766
398 HB3 ASP 56 2HB ASP 56 1.331 -4.901 -12.213
399 H SER 57 H SER 57 -1.137 -7.327 -14.568
400 HA SER 57 HA SER 57 -2.371 -4.945 -15.279
401 HB2 SER 57 1HB SER 57 -2.251 -6.936 -16.743
402 HB3 SER 57 2HB SER 57 -3.434 -7.748 -15.717
403 HG SER 57 HG SER 57 -4.006 -5.239 -16.864
404 H ASP 58 H ASP 58 -3.072 -7.055 -12.683
405 HA ASP 58 HA ASP 58 -5.790 -6.047 -12.351
406 HB2 ASP 58 1HB ASP 58 -4.257 -8.009 -10.633
407 HB3 ASP 58 2HB ASP 58 -5.982 -7.665 -10.545
408 H TYR 59 H TYR 59 -2.630 -5.907 -10.794
409 HA TYR 59 HA TYR 59 -3.033 -4.794 -8.396
410 HB2 TYR 59 1HB TYR 59 -1.013 -4.265 -10.511
411 HB3 TYR 59 2HB TYR 59 -1.071 -3.137 -9.160
412 HD1 TYR 59 1HD TYR 59 -1.707 -4.899 -6.904
413 HD2 TYR 59 2HD TYR 59 0.917 -5.522 -10.196
414 HE1 TYR 59 1HE TYR 59 -0.379 -6.458 -5.543
415 HE2 TYR 59 2HE TYR 59 2.251 -7.084 -8.843
416 HH TYR 59 HH TYR 59 1.290 -7.939 -5.540
417 H LYS 60 H LYS 60 -4.252 -3.220 -7.616
418 HA LYS 60 HA LYS 60 -5.275 -1.158 -9.399
419 HB2 LYS 60 1HB LYS 60 -5.983 -2.077 -6.627
420 HB3 LYS 60 2HB LYS 60 -6.581 -0.543 -7.246
421 HG2 LYS 60 1HG LYS 60 -7.803 -1.601 -8.965
422 HG3 LYS 60 2HG LYS 60 -6.986 -3.143 -8.696
423 HD2 LYS 60 1HD LYS 60 -8.005 -3.125 -6.378
424 HD3 LYS 60 2HD LYS 60 -8.999 -1.772 -6.924
425 HE2 LYS 60 1HE LYS 60 -10.021 -3.116 -8.613
426 HE3 LYS 60 2HE LYS 60 -8.888 -4.435 -8.328
427 HZ1 LYS 60 1HZ LYS 60 -9.847 -4.474 -5.993
428 HZ2 LYS 60 2HZ LYS 60 -10.833 -5.064 -7.235
429 HZ3 LYS 60 3HZ LYS 60 -11.105 -3.519 -6.600
430 H LYS 61 H LYS 61 -5.665 1.005 -7.917
431 HA LYS 61 HA LYS 61 -3.181 1.735 -6.577
432 HB2 LYS 61 1HB LYS 61 -3.035 2.220 -9.098
433 HB3 LYS 61 2HB LYS 61 -4.222 3.482 -8.797
434 HG2 LYS 61 1HG LYS 61 -2.691 4.535 -7.204
435 HG3 LYS 61 2HG LYS 61 -1.498 3.275 -7.528
436 HD2 LYS 61 1HD LYS 61 -0.958 5.249 -8.813
437 HD3 LYS 61 2HD LYS 61 -1.474 3.960 -9.904
438 HE2 LYS 61 1HE LYS 61 -3.630 4.954 -10.168
439 HE3 LYS 61 2HE LYS 61 -3.307 6.127 -8.892
440 HZ1 LYS 61 1HZ LYS 61 -2.762 6.341 -11.636
441 HZ2 LYS 61 2HZ LYS 61 -1.290 6.369 -10.803
442 HZ3 LYS 61 3HZ LYS 61 -2.500 7.487 -10.419
443 H ASP 62 H ASP 62 -3.649 2.836 -4.798
444 HA ASP 62 HA ASP 62 -6.172 4.358 -4.713
445 HB2 ASP 62 1HB ASP 62 -4.901 2.527 -2.729
446 HB3 ASP 62 2HB ASP 62 -5.805 3.912 -2.122
447 H MET 63 H MET 63 -5.802 6.468 -4.715
448 HA MET 63 HA MET 63 -3.261 7.576 -3.992
449 HB2 MET 63 1HB MET 63 -5.060 8.400 -5.732
450 HB3 MET 63 2HB MET 63 -5.703 9.265 -4.343
451 HG2 MET 63 1HG MET 63 -3.194 10.028 -4.091
452 HG3 MET 63 2HG MET 63 -3.157 9.658 -5.813
453 HE1 MET 63 1HE MET 63 -5.089 13.216 -3.755
454 HE2 MET 63 2HE MET 63 -5.352 11.599 -3.101
455 HE3 MET 63 3HE MET 63 -3.714 12.240 -3.236
456 H VAL 64 H VAL 64 -2.669 8.639 -2.168
457 HA VAL 64 HA VAL 64 -4.694 9.077 -0.087
458 HB VAL 64 HB VAL 64 -1.990 7.893 0.530
459 HG11 VAL 64 1HG1 VAL 64 -3.071 9.165 2.328
460 HG12 VAL 64 2HG1 VAL 64 -4.500 8.141 2.186
461 HG13 VAL 64 3HG1 VAL 64 -2.966 7.448 2.713
462 HG21 VAL 64 1HG2 VAL 64 -4.603 6.556 -0.060
463 HG22 VAL 64 2HG2 VAL 64 -2.986 6.142 -0.627
464 HG23 VAL 64 3HG2 VAL 64 -3.444 5.816 1.044
465 H GLU 65 H GLU 65 -4.116 10.656 1.499
466 HA GLU 65 HA GLU 65 -2.959 12.964 0.504
467 HB2 GLU 65 1HB GLU 65 -2.837 12.458 3.443
468 HB3 GLU 65 2HB GLU 65 -3.332 13.906 2.576
469 HG2 GLU 65 1HG GLU 65 -5.306 12.330 1.801
470 HG3 GLU 65 2HG GLU 65 -4.897 11.494 3.297
471 H GLY 66 H GLY 66 -0.973 13.994 0.799
472 HA2 GLY 66 1HA GLY 66 1.292 12.250 0.847
473 HA3 GLY 66 2HA GLY 66 1.331 14.003 0.725
474 H ASP 67 H ASP 67 -0.420 13.941 3.277
475 HA ASP 67 HA ASP 67 1.866 13.898 5.105
476 HB2 ASP 67 1HB ASP 67 -0.904 15.073 5.433
477 HB3 ASP 67 2HB ASP 67 0.384 15.173 6.631
478 H ARG 68 H ARG 68 -0.529 11.855 4.142
479 HA ARG 68 HA ARG 68 -1.030 10.713 6.784
480 HB2 ARG 68 1HB ARG 68 -2.799 11.055 4.902
481 HB3 ARG 68 2HB ARG 68 -2.104 9.593 4.216
482 HG2 ARG 68 1HG ARG 68 -3.792 8.693 5.450
483 HG3 ARG 68 2HG ARG 68 -2.495 8.665 6.646
484 HD2 ARG 68 1HD ARG 68 -4.283 11.050 6.436
485 HD3 ARG 68 2HD ARG 68 -4.839 9.609 7.285
486 HE ARG 68 HE ARG 68 -2.395 10.104 8.367
487 HH11 ARG 68 1HH1 ARG 68 -5.285 11.993 7.920
488 HH12 ARG 68 2HH1 ARG 68 -5.021 12.968 9.328
489 HH21 ARG 68 1HH2 ARG 68 -2.037 11.381 10.222
490 HH22 ARG 68 2HH2 ARG 68 -3.173 12.620 10.636
491 H TYR 69 H TYR 69 -0.157 8.850 7.493
492 HA TYR 69 HA TYR 69 1.656 7.429 5.656
493 HB2 TYR 69 1HB TYR 69 1.896 8.185 8.530
494 HB3 TYR 69 2HB TYR 69 2.632 6.673 8.012
495 HD1 TYR 69 2HD TYR 69 2.421 9.475 5.683
496 HD2 TYR 69 1HD TYR 69 4.862 7.517 8.566
497 HE1 TYR 69 2HE TYR 69 4.379 10.714 4.859
498 HE2 TYR 69 1HE TYR 69 6.826 8.752 7.751
499 HH TYR 69 HH TYR 69 6.815 10.505 4.837
500 H TRP 70 H TRP 70 -1.293 7.068 6.469
501 HA TRP 70 HA TRP 70 -1.112 4.171 6.734
502 HB2 TRP 70 1HB TRP 70 -2.496 3.980 8.621
503 HB3 TRP 70 2HB TRP 70 -1.393 5.288 9.039
504 HD1 TRP 70 HD TRP 70 -2.430 7.635 9.526
505 HE1 TRP 70 1HE TRP 70 -4.840 8.530 9.658
506 HE3 TRP 70 3HE TRP 70 -4.890 3.640 7.497
507 HZ2 TRP 70 2HZ TRP 70 -7.440 7.657 8.990
508 HZ3 TRP 70 3HZ TRP 70 -7.339 3.749 7.279
509 HH2 TRP 70 HH TRP 70 -8.585 5.717 8.011
510 H HIS 71 H HIS 71 -2.819 3.065 5.810
511 HA HIS 71 HA HIS 71 -5.142 4.513 4.857
512 HB2 HIS 71 1HB HIS 71 -3.531 4.919 3.063
513 HB3 HIS 71 2HB HIS 71 -3.217 3.191 2.933
514 HD1 HIS 71 1HD HIS 71 -5.978 5.705 2.336
515 HD2 HIS 71 2HD HIS 71 -4.927 1.825 1.286
516 HE1 HIS 71 1HE HIS 71 -7.635 5.013 0.575
517 HE2 HIS 71 2HE HIS 71 -7.031 2.632 0.016
518 H SER 72 H SER 72 -6.905 3.216 4.555
519 HA SER 72 HA SER 72 -6.508 0.358 5.142
520 HB2 SER 72 1HB SER 72 -8.802 0.363 6.019
521 HB3 SER 72 2HB SER 72 -7.817 1.576 6.838
522 HG SER 72 HG SER 72 -9.634 2.055 4.707
523 H ILE 73 H ILE 73 -6.591 -0.828 3.354
524 HA ILE 73 HA ILE 73 -7.958 0.018 0.988
525 HB ILE 73 HB ILE 73 -6.894 -2.748 1.540
526 HG12 ILE 73 1HG1 ILE 73 -5.289 -0.625 0.163
527 HG13 ILE 73 2HG1 ILE 73 -5.304 -0.693 1.922
528 HG21 ILE 73 1HG2 ILE 73 -6.552 -2.741 -0.922
529 HG22 ILE 73 2HG2 ILE 73 -8.243 -2.624 -0.439
530 HG23 ILE 73 3HG2 ILE 73 -7.383 -1.187 -0.990
531 HD11 ILE 73 1HD1 ILE 73 -4.510 -3.012 1.817
532 HD12 ILE 73 2HD1 ILE 73 -4.441 -2.890 0.058
533 HD13 ILE 73 3HD1 ILE 73 -3.395 -1.878 1.054
534 H SER 74 H SER 74 -9.678 -1.106 -0.072
535 HA SER 74 HA SER 74 -11.324 -2.838 1.623
536 HB2 SER 74 1HB SER 74 -12.535 -0.519 0.114
537 HB3 SER 74 2HB SER 74 -13.308 -1.558 1.311
538 HG SER 74 HG SER 74 -12.273 0.714 1.815
539 H HIS 75 H HIS 75 -13.403 -3.418 0.176
540 HA HIS 75 HA HIS 75 -14.154 -4.666 -1.572
541 HB2 HIS 75 1HB HIS 75 -12.513 -2.547 -2.876
542 HB3 HIS 75 2HB HIS 75 -13.042 -3.903 -3.868
543 HD1 HIS 75 1HD HIS 75 -15.259 -3.613 -4.917
544 HD2 HIS 75 2HD HIS 75 -14.849 -1.280 -1.504
545 HE1 HIS 75 1HE HIS 75 -17.374 -2.261 -4.769
546 HE2 HIS 75 2HE HIS 75 -17.067 -0.795 -2.744
547 H LEU 76 H LEU 76 -12.300 -5.967 -0.116
548 HA LEU 76 HA LEU 76 -10.570 -7.271 -2.112
549 HB2 LEU 76 1HB LEU 76 -10.191 -7.424 0.861
550 HB3 LEU 76 2HB LEU 76 -9.035 -7.811 -0.412
551 HG LEU 76 HG LEU 76 -9.994 -4.999 -0.136
552 HD11 LEU 76 1HD1 LEU 76 -7.751 -4.917 1.339
553 HD12 LEU 76 2HD1 LEU 76 -8.385 -6.485 1.837
554 HD13 LEU 76 3HD1 LEU 76 -9.370 -5.035 2.030
555 HD21 LEU 76 1HD2 LEU 76 -8.116 -6.377 -1.704
556 HD22 LEU 76 2HD2 LEU 76 -7.187 -5.396 -0.570
557 HD23 LEU 76 3HD2 LEU 76 -8.384 -4.636 -1.620
558 H GLN 77 H GLN 77 -10.004 -9.619 -1.224
559 HA GLN 77 HA GLN 77 -12.587 -10.964 -0.971
560 HB2 GLN 77 1HB GLN 77 -9.858 -12.065 -1.661
561 HB3 GLN 77 2HB GLN 77 -11.350 -12.996 -1.634
562 HG2 GLN 77 1HG GLN 77 -12.222 -11.851 -3.493
563 HG3 GLN 77 2HG GLN 77 -10.998 -10.586 -3.385
564 HE21 GLN 77 1HE2 GLN 77 -10.402 -10.913 -5.537
565 HE22 GLN 77 2HE2 GLN 77 -9.467 -12.281 -6.026
566 HA PRO 78 HA PRO 78 -11.934 -12.006 3.255
567 HB2 PRO 78 1HB PRO 78 -13.566 -14.170 3.414
568 HB3 PRO 78 2HB PRO 78 -14.174 -12.513 3.318
569 HG2 PRO 78 1HG PRO 78 -13.905 -14.561 1.151
570 HG3 PRO 78 2HG PRO 78 -15.245 -13.445 1.476
571 HD2 PRO 78 1HD PRO 78 -13.396 -12.981 -0.447
572 HD3 PRO 78 2HD PRO 78 -14.180 -11.671 0.460
573 H GLU 79 H GLU 79 -10.836 -13.475 4.562
574 HA GLU 79 HA GLU 79 -8.972 -14.818 4.852
575 HB2 GLU 79 1HB GLU 79 -9.741 -17.272 4.162
576 HB3 GLU 79 2HB GLU 79 -10.404 -16.444 5.563
577 HG2 GLU 79 1HG GLU 79 -12.357 -15.795 4.316
578 HG3 GLU 79 2HG GLU 79 -11.679 -16.476 2.838
579 H THR 80 H THR 80 -8.695 -13.432 2.438
580 HA THR 80 HA THR 80 -7.538 -15.470 0.653
581 HB THR 80 HB THR 80 -8.405 -12.654 -0.033
582 HG1 THR 80 1HG THR 80 -10.214 -13.933 0.172
583 HG21 THR 80 1HG2 THR 80 -6.426 -13.720 -1.296
584 HG22 THR 80 2HG2 THR 80 -7.759 -13.060 -2.243
585 HG23 THR 80 3HG2 THR 80 -7.637 -14.800 -1.987
586 H SER 81 H SER 81 -5.448 -15.675 1.200
587 HA SER 81 HA SER 81 -3.876 -13.452 2.124
588 HB2 SER 81 1HB SER 81 -3.679 -16.034 2.671
589 HB3 SER 81 2HB SER 81 -2.623 -16.027 1.259
590 HG SER 81 HG SER 81 -1.153 -15.017 2.375
591 H TYR 82 H TYR 82 -3.285 -11.932 0.719
592 HA TYR 82 HA TYR 82 -1.988 -12.785 -1.774
593 HB2 TYR 82 1HB TYR 82 -3.048 -10.713 -2.841
594 HB3 TYR 82 2HB TYR 82 -4.098 -12.099 -2.572
595 HD1 TYR 82 1HD TYR 82 -3.022 -8.946 -0.879
596 HD2 TYR 82 2HD TYR 82 -6.149 -11.750 -1.561
597 HE1 TYR 82 1HE TYR 82 -4.571 -7.517 0.388
598 HE2 TYR 82 2HE TYR 82 -7.707 -10.328 -0.297
599 HH TYR 82 HH TYR 82 -6.609 -7.506 1.458
600 H ASP 83 H ASP 83 -0.522 -11.193 -2.674
601 HA ASP 83 HA ASP 83 1.048 -9.936 -0.647
602 HB2 ASP 83 1HB ASP 83 1.277 -9.788 -3.661
603 HB3 ASP 83 2HB ASP 83 2.495 -9.231 -2.517
604 H ILE 84 H ILE 84 1.578 -7.708 -0.478
605 HA ILE 84 HA ILE 84 -0.212 -5.822 -1.819
606 HB ILE 84 HB ILE 84 0.121 -5.941 1.181
607 HG12 ILE 84 1HG1 ILE 84 -2.501 -6.064 -0.257
608 HG13 ILE 84 2HG1 ILE 84 -1.517 -7.519 -0.149
609 HG21 ILE 84 1HG2 ILE 84 -1.892 -4.117 0.389
610 HG22 ILE 84 2HG2 ILE 84 -0.376 -3.781 1.225
611 HG23 ILE 84 3HG2 ILE 84 -0.438 -3.743 -0.537
612 HD11 ILE 84 1HD1 ILE 84 -2.235 -7.888 1.905
613 HD12 ILE 84 2HD1 ILE 84 -1.687 -6.294 2.424
614 HD13 ILE 84 3HD1 ILE 84 -3.304 -6.495 1.750
615 H LYS 85 H LYS 85 0.789 -3.996 -2.405
616 HA LYS 85 HA LYS 85 3.209 -3.152 -1.000
617 HB2 LYS 85 1HB LYS 85 4.550 -3.025 -2.948
618 HB3 LYS 85 2HB LYS 85 3.820 -4.625 -2.972
619 HG2 LYS 85 1HG LYS 85 2.219 -3.931 -4.621
620 HG3 LYS 85 2HG LYS 85 2.775 -2.259 -4.514
621 HD2 LYS 85 1HD LYS 85 4.970 -2.935 -5.358
622 HD3 LYS 85 2HD LYS 85 4.420 -4.610 -5.454
623 HE2 LYS 85 1HE LYS 85 4.286 -3.650 -7.643
624 HE3 LYS 85 2HE LYS 85 2.646 -3.865 -7.035
625 HZ1 LYS 85 1HZ LYS 85 2.437 -1.748 -7.718
626 HZ2 LYS 85 2HZ LYS 85 4.094 -1.422 -7.633
627 HZ3 LYS 85 3HZ LYS 85 3.151 -1.382 -6.229
628 H MET 86 H MET 86 3.955 -0.966 -1.836
629 HA MET 86 HA MET 86 1.835 0.650 -3.006
630 HB2 MET 86 1HB MET 86 1.868 2.291 -1.200
631 HB3 MET 86 2HB MET 86 1.373 0.716 -0.595
632 HG2 MET 86 1HG MET 86 3.413 0.366 0.494
633 HG3 MET 86 2HG MET 86 4.212 1.650 -0.409
634 HE1 MET 86 1HE MET 86 2.973 3.960 -0.505
635 HE2 MET 86 2HE MET 86 1.380 3.944 0.250
636 HE3 MET 86 3HE MET 86 2.699 4.852 0.991
637 H GLN 87 H GLN 87 2.645 3.018 -3.173
638 HA GLN 87 HA GLN 87 5.499 3.354 -3.322
639 HB2 GLN 87 1HB GLN 87 5.291 2.212 -5.393
640 HB3 GLN 87 2HB GLN 87 3.834 3.100 -5.821
641 HG2 GLN 87 1HG GLN 87 5.329 5.180 -5.793
642 HG3 GLN 87 2HG GLN 87 6.675 4.042 -5.829
643 HE21 GLN 87 1HE2 GLN 87 3.997 5.376 -7.580
644 HE22 GLN 87 2HE2 GLN 87 4.427 4.742 -9.129
645 H CYS 88 H CYS 88 6.126 5.513 -3.592
646 HA CYS 88 HA CYS 88 3.935 7.435 -3.235
647 HB2 CYS 88 1HB CYS 88 5.381 8.776 -1.981
648 HB3 CYS 88 2HB CYS 88 5.843 7.144 -1.512
649 HG CYS 88 HG CYS 88 8.190 7.060 -2.853
650 H PHE 89 H PHE 89 4.017 9.474 -4.304
651 HA PHE 89 HA PHE 89 5.828 9.662 -6.597
652 HB2 PHE 89 1HB PHE 89 4.098 10.014 -8.178
653 HB3 PHE 89 2HB PHE 89 3.615 8.590 -7.262
654 HD1 PHE 89 1HD PHE 89 2.101 9.111 -5.161
655 HD2 PHE 89 2HD PHE 89 2.537 11.654 -8.547
656 HE1 PHE 89 1HE PHE 89 -0.051 10.181 -4.631
657 HE2 PHE 89 2HE PHE 89 0.387 12.728 -8.022
658 HZ PHE 89 HZ PHE 89 -0.910 11.992 -6.062
659 H ASN 90 H ASN 90 5.775 11.831 -7.613
660 HA ASN 90 HA ASN 90 4.571 14.014 -6.216
661 HB2 ASN 90 1HB ASN 90 6.355 14.926 -5.074
662 HB3 ASN 90 2HB ASN 90 6.690 13.210 -4.863
663 HD21 ASN 90 1HD2 ASN 90 8.545 15.398 -4.762
664 HD22 ASN 90 2HD2 ASN 90 9.713 15.124 -6.004
665 H GLU 91 H GLU 91 5.562 16.162 -7.057
666 HA GLU 91 HA GLU 91 5.103 16.526 -9.672
667 HB2 GLU 91 1HB GLU 91 6.671 18.462 -9.619
668 HB3 GLU 91 2HB GLU 91 5.573 18.405 -8.248
669 HG2 GLU 91 1HG GLU 91 7.461 17.257 -6.989
670 HG3 GLU 91 2HG GLU 91 8.500 17.767 -8.318
671 H GLY 92 H GLY 92 8.161 15.392 -8.311
672 HA2 GLY 92 1HA GLY 92 9.649 15.422 -10.708
673 HA3 GLY 92 2HA GLY 92 10.009 14.447 -9.291
674 H GLY 93 H GLY 93 7.912 12.750 -9.108
675 HA2 GLY 93 1HA GLY 93 6.711 11.533 -11.161
676 HA3 GLY 93 2HA GLY 93 8.378 11.036 -11.411
677 H GLU 94 H GLU 94 6.690 9.040 -11.079
678 HA GLU 94 HA GLU 94 6.113 8.276 -8.428
679 HB2 GLU 94 1HB GLU 94 6.421 6.698 -10.978
680 HB3 GLU 94 2HB GLU 94 5.995 5.940 -9.450
681 HG2 GLU 94 1HG GLU 94 3.944 7.073 -9.334
682 HG3 GLU 94 2HG GLU 94 4.412 8.217 -10.590
683 H SER 95 H SER 95 7.225 7.110 -6.933
684 HA SER 95 HA SER 95 10.098 6.947 -7.297
685 HB2 SER 95 1HB SER 95 9.260 7.842 -5.192
686 HB3 SER 95 2HB SER 95 8.350 6.360 -4.894
687 HG SER 95 HG SER 95 10.118 5.838 -3.860
688 H GLU 96 H GLU 96 11.011 4.878 -5.978
689 HA GLU 96 HA GLU 96 10.647 2.693 -7.699
690 HB2 GLU 96 1HB GLU 96 11.856 2.815 -4.932
691 HB3 GLU 96 2HB GLU 96 11.963 1.420 -5.997
692 HG2 GLU 96 1HG GLU 96 12.935 3.225 -7.665
693 HG3 GLU 96 2HG GLU 96 13.335 4.042 -6.156
694 H PHE 97 H PHE 97 10.124 0.431 -6.811
695 HA PHE 97 HA PHE 97 7.423 0.543 -5.766
696 HB2 PHE 97 1HB PHE 97 9.120 -1.566 -7.045
697 HB3 PHE 97 2HB PHE 97 7.704 -2.047 -6.117
698 HD1 PHE 97 1HD PHE 97 8.135 0.939 -8.275
699 HD2 PHE 97 2HD PHE 97 6.238 -2.833 -7.743
700 HE1 PHE 97 1HE PHE 97 6.709 1.385 -10.230
701 HE2 PHE 97 2HE PHE 97 4.809 -2.394 -9.698
702 HZ PHE 97 HZ PHE 97 5.044 -0.283 -10.944
703 H SER 98 H SER 98 6.930 0.311 -3.696
704 HA SER 98 HA SER 98 8.841 -0.133 -1.687
705 HB2 SER 98 1HB SER 98 6.691 1.070 -1.345
706 HB3 SER 98 2HB SER 98 5.839 -0.468 -1.476
707 HG SER 98 HG SER 98 6.539 -1.044 0.455
708 H ASN 99 H ASN 99 8.723 -1.886 -0.035
709 HA ASN 99 HA ASN 99 9.235 -4.378 -1.175
710 HB2 ASN 99 1HB ASN 99 8.889 -5.193 1.267
711 HB3 ASN 99 2HB ASN 99 10.192 -4.057 0.930
712 HD21 ASN 99 1HD2 ASN 99 8.085 -4.736 3.179
713 HD22 ASN 99 2HD2 ASN 99 7.670 -3.162 3.758
714 H VAL 100 H VAL 100 8.046 -6.431 -0.286
715 HA VAL 100 HA VAL 100 5.194 -6.091 -0.935
716 HB VAL 100 HB VAL 100 6.905 -8.572 -1.171
717 HG11 VAL 100 1HG1 VAL 100 4.816 -9.249 -2.581
718 HG12 VAL 100 2HG1 VAL 100 4.787 -9.416 -0.824
719 HG13 VAL 100 3HG1 VAL 100 3.997 -8.040 -1.594
720 HG21 VAL 100 1HG2 VAL 100 7.589 -7.679 -3.093
721 HG22 VAL 100 2HG2 VAL 100 5.934 -7.855 -3.676
722 HG23 VAL 100 3HG2 VAL 100 6.455 -6.335 -2.949
723 H MET 101 H MET 101 3.763 -6.401 0.631
724 HA MET 101 HA MET 101 4.563 -8.015 2.964
725 HB2 MET 101 1HB MET 101 2.722 -5.618 2.885
726 HB3 MET 101 2HB MET 101 3.053 -6.593 4.310
727 HG2 MET 101 1HG MET 101 5.186 -5.129 2.782
728 HG3 MET 101 2HG MET 101 4.312 -4.432 4.145
729 HE1 MET 101 1HE MET 101 5.484 -6.360 7.189
730 HE2 MET 101 2HE MET 101 5.261 -4.696 6.649
731 HE3 MET 101 3HE MET 101 3.999 -5.893 6.360
732 H ILE 102 H ILE 102 3.443 -9.824 3.204
733 HA ILE 102 HA ILE 102 0.947 -10.180 1.746
734 HB ILE 102 HB ILE 102 2.611 -12.148 3.319
735 HG12 ILE 102 1HG1 ILE 102 2.158 -12.004 0.337
736 HG13 ILE 102 2HG1 ILE 102 3.527 -11.237 1.134
737 HG21 ILE 102 1HG2 ILE 102 -0.091 -12.324 2.719
738 HG22 ILE 102 2HG2 ILE 102 0.699 -13.282 1.468
739 HG23 ILE 102 3HG2 ILE 102 0.977 -13.653 3.170
740 HD11 ILE 102 1HD1 ILE 102 2.990 -14.093 0.609
741 HD12 ILE 102 2HD1 ILE 102 4.505 -13.191 0.565
742 HD13 ILE 102 3HD1 ILE 102 3.820 -13.689 2.112
743 H CYS 103 H CYS 103 -0.738 -9.289 2.798
744 HA CYS 103 HA CYS 103 -1.074 -9.930 5.651
745 HB2 CYS 103 1HB CYS 103 -0.948 -7.481 4.870
746 HB3 CYS 103 2HB CYS 103 -2.550 -7.749 4.192
747 HG CYS 103 HG CYS 103 -2.922 -6.409 6.576
748 H GLU 104 H GLU 104 -2.365 -11.631 5.905
749 HA GLU 104 HA GLU 104 -4.336 -12.373 3.960
750 HB2 GLU 104 1HB GLU 104 -2.966 -13.918 5.504
751 HB3 GLU 104 2HB GLU 104 -4.145 -13.504 6.740
752 HG2 GLU 104 1HG GLU 104 -5.842 -14.215 4.841
753 HG3 GLU 104 2HG GLU 104 -4.451 -15.152 4.297
754 H THR 105 H THR 105 -6.412 -11.817 3.879
755 HA THR 105 HA THR 105 -7.490 -9.869 5.628
756 HB THR 105 HB THR 105 -9.698 -10.537 4.433
757 HG1 THR 105 1HG THR 105 -8.636 -11.508 2.267
758 HG21 THR 105 1HG2 THR 105 -9.174 -9.131 2.613
759 HG22 THR 105 2HG2 THR 105 -7.473 -9.598 2.638
760 HG23 THR 105 3HG2 THR 105 -8.130 -8.591 3.927
761 H LYS 106 H LYS 106 -9.923 -10.369 6.388
762 HA LYS 106 HA LYS 106 -9.631 -12.484 8.374
763 HB2 LYS 106 1HB LYS 106 -11.359 -10.062 8.096
764 HB3 LYS 106 2HB LYS 106 -11.917 -11.384 9.113
765 HG2 LYS 106 1HG LYS 106 -9.471 -11.160 10.106
766 HG3 LYS 106 2HG LYS 106 -9.652 -9.512 9.500
767 HD2 LYS 106 1HD LYS 106 -11.839 -9.410 10.739
768 HD3 LYS 106 2HD LYS 106 -11.407 -10.951 11.484
769 HE2 LYS 106 1HE LYS 106 -9.421 -8.745 11.595
770 HE3 LYS 106 2HE LYS 106 -10.846 -8.620 12.625
771 HZ1 LYS 106 1HZ LYS 106 -9.971 -10.081 14.019
772 HZ2 LYS 106 2HZ LYS 106 -8.546 -10.081 13.108
773 HZ3 LYS 106 3HZ LYS 106 -9.753 -11.222 12.788
774 H ALA 107 H ALA 107 -11.383 -13.964 8.823
775 HA ALA 107 HA ALA 107 -12.436 -15.131 6.432
776 HB1 ALA 107 1HB ALA 107 -13.687 -16.414 8.526
777 HB2 ALA 107 2HB ALA 107 -12.162 -16.888 7.777
778 HB3 ALA 107 3HB ALA 107 -12.158 -15.883 9.226
779 H ARG 108 H ARG 108 -14.422 -14.971 5.570
780 HA ARG 108 HA ARG 108 -16.229 -12.991 6.645
781 HB2 ARG 108 1HB ARG 108 -17.542 -13.426 4.593
782 HB3 ARG 108 2HB ARG 108 -15.861 -13.037 4.252
783 HG2 ARG 108 1HG ARG 108 -15.354 -15.204 3.609
784 HG3 ARG 108 2HG ARG 108 -16.743 -15.885 4.460
785 HD2 ARG 108 1HD ARG 108 -17.233 -13.963 2.241
786 HD3 ARG 108 2HD ARG 108 -16.733 -15.604 1.836
787 HE ARG 108 HE ARG 108 -18.872 -15.624 3.700
788 HH11 ARG 108 1HH1 ARG 108 -18.143 -15.110 0.334
789 HH12 ARG 108 2HH1 ARG 108 -19.718 -15.582 -0.213
790 HH21 ARG 108 1HH2 ARG 108 -20.949 -16.247 2.991
791 HH22 ARG 108 2HH2 ARG 108 -21.313 -16.228 1.299
792 H SER 109 H SER 109 -16.270 -14.691 8.578
793 HA SER 109 HA SER 109 -18.280 -16.752 8.178
794 HB2 SER 109 1HB SER 109 -16.126 -16.834 9.703
795 HB3 SER 109 2HB SER 109 -17.189 -16.059 10.877
796 HG SER 109 HG SER 109 -17.309 -18.625 9.777
797 H GLY 110 H GLY 110 -20.355 -16.205 8.211
798 HA2 GLY 110 1HA GLY 110 -21.215 -14.156 10.160
799 HA3 GLY 110 2HA GLY 110 -21.901 -14.271 8.546
800 HA PRO 111 HA PRO 111 -24.077 -17.043 11.806
801 HB2 PRO 111 1HB PRO 111 -26.066 -15.377 12.605
802 HB3 PRO 111 2HB PRO 111 -24.512 -15.487 13.440
803 HG2 PRO 111 1HG PRO 111 -25.451 -13.462 11.445
804 HG3 PRO 111 2HG PRO 111 -24.549 -13.214 12.951
805 HD2 PRO 111 1HD PRO 111 -23.354 -13.219 10.522
806 HD3 PRO 111 2HD PRO 111 -22.536 -13.793 11.989
807 H SER 112 H SER 112 -25.167 -14.772 9.365
808 HA SER 112 HA SER 112 -27.705 -15.925 8.885
809 HB2 SER 112 1HB SER 112 -26.688 -13.630 8.114
810 HB3 SER 112 2HB SER 112 -26.161 -14.557 6.710
811 HG SER 112 HG SER 112 -28.832 -14.368 7.656
812 H SER 113 H SER 113 -24.623 -16.246 7.125
813 HA SER 113 HA SER 113 -25.597 -18.272 5.380
814 HB2 SER 113 1HB SER 113 -23.164 -18.572 4.814
815 HB3 SER 113 2HB SER 113 -23.746 -16.915 4.652
816 HG SER 113 HG SER 113 -22.235 -18.009 6.789
817 H GLY 114 H GLY 114 -25.562 -20.447 5.549
818 HA2 GLY 114 1HA GLY 114 -24.530 -22.474 6.405
819 HA3 GLY 114 2HA GLY 114 -24.219 -21.612 7.905
Start of MODEL 9
1 H1 GLY 1 H GLY 1 26.060 22.503 -12.768
2 HA2 GLY 1 1HA GLY 1 25.943 20.309 -14.625
3 HA3 GLY 1 2HA GLY 1 26.279 19.793 -12.979
4 H SER 2 H SER 2 24.543 19.167 -11.903
5 HA SER 2 HA SER 2 22.091 20.720 -12.061
6 HB2 SER 2 1HB SER 2 22.225 17.794 -12.821
7 HB3 SER 2 2HB SER 2 20.725 18.646 -12.455
8 HG SER 2 HG SER 2 22.005 18.546 -14.760
9 H SER 3 H SER 3 20.509 20.064 -10.414
10 HA SER 3 HA SER 3 21.893 19.199 -7.992
11 HB2 SER 3 1HB SER 3 19.793 20.037 -6.858
12 HB3 SER 3 2HB SER 3 20.706 21.263 -7.737
13 HG SER 3 HG SER 3 19.161 21.382 -9.220
14 H GLY 4 H GLY 4 18.988 18.438 -9.882
15 HA2 GLY 4 1HA GLY 4 18.942 15.787 -9.880
16 HA3 GLY 4 2HA GLY 4 18.468 16.099 -8.217
17 H SER 5 H SER 5 17.453 15.958 -11.478
18 HA SER 5 HA SER 5 14.985 17.393 -11.097
19 HB2 SER 5 1HB SER 5 16.258 15.879 -13.334
20 HB3 SER 5 2HB SER 5 14.513 16.128 -13.385
21 HG SER 5 HG SER 5 15.563 17.837 -14.414
22 H SER 6 H SER 6 15.768 13.977 -11.771
23 HA SER 6 HA SER 6 13.349 12.795 -11.609
24 HB2 SER 6 1HB SER 6 16.010 11.889 -10.531
25 HB3 SER 6 2HB SER 6 14.579 10.867 -10.396
26 HG SER 6 HG SER 6 14.428 11.384 -12.798
27 H GLY 7 H GLY 7 11.881 12.165 -10.075
28 HA2 GLY 7 1HA GLY 7 11.836 13.687 -7.645
29 HA3 GLY 7 2HA GLY 7 10.638 12.510 -8.160
30 HA PRO 8 HA PRO 8 12.734 10.680 -4.507
31 HB2 PRO 8 1HB PRO 8 10.480 9.527 -3.526
32 HB3 PRO 8 2HB PRO 8 10.922 11.206 -3.196
33 HG2 PRO 8 1HG PRO 8 8.987 10.116 -5.204
34 HG3 PRO 8 2HG PRO 8 8.816 11.517 -4.131
35 HD2 PRO 8 1HD PRO 8 9.475 11.758 -6.746
36 HD3 PRO 8 2HD PRO 8 10.065 12.882 -5.505
37 H VAL 9 H VAL 9 13.409 8.584 -4.225
38 HA VAL 9 HA VAL 9 12.250 6.540 -5.999
39 HB VAL 9 HB VAL 9 14.550 5.617 -6.314
40 HG11 VAL 9 1HG1 VAL 9 15.000 8.183 -7.515
41 HG12 VAL 9 2HG1 VAL 9 14.507 6.667 -8.271
42 HG13 VAL 9 3HG1 VAL 9 13.290 7.762 -7.614
43 HG21 VAL 9 1HG2 VAL 9 16.378 7.425 -5.987
44 HG22 VAL 9 2HG2 VAL 9 15.252 8.113 -4.817
45 HG23 VAL 9 3HG2 VAL 9 15.857 6.471 -4.598
46 H ALA 10 H ALA 10 14.132 7.231 -3.091
47 HA ALA 10 HA ALA 10 14.620 4.836 -1.975
48 HB1 ALA 10 1HB ALA 10 13.414 7.219 -0.578
49 HB2 ALA 10 2HB ALA 10 14.159 5.846 0.241
50 HB3 ALA 10 3HB ALA 10 15.129 6.878 -0.811
51 H GLY 11 H GLY 11 11.439 6.321 -2.284
52 HA2 GLY 11 1HA GLY 11 9.329 5.449 -2.050
53 HA3 GLY 11 2HA GLY 11 10.069 3.870 -2.273
54 HA PRO 12 HA PRO 12 8.659 4.767 2.232
55 HB2 PRO 12 1HB PRO 12 6.148 3.737 2.176
56 HB3 PRO 12 2HB PRO 12 6.494 5.442 1.865
57 HG2 PRO 12 1HG PRO 12 5.994 3.225 -0.083
58 HG3 PRO 12 2HG PRO 12 5.381 4.889 -0.101
59 HD2 PRO 12 1HD PRO 12 7.467 4.088 -1.630
60 HD3 PRO 12 2HD PRO 12 7.339 5.734 -0.977
61 H TYR 13 H TYR 13 8.245 3.104 3.837
62 HA TYR 13 HA TYR 13 8.597 0.362 2.828
63 HB2 TYR 13 1HB TYR 13 10.761 0.880 3.574
64 HB3 TYR 13 2HB TYR 13 10.166 1.799 4.952
65 HD1 TYR 13 1HD TYR 13 9.252 -1.633 3.825
66 HD2 TYR 13 2HD TYR 13 11.101 0.762 6.816
67 HE1 TYR 13 1HE TYR 13 9.505 -3.621 5.252
68 HE2 TYR 13 2HE TYR 13 11.361 -1.219 8.250
69 HH TYR 13 HH TYR 13 9.871 -3.681 8.272
70 H ILE 14 H ILE 14 6.805 -0.699 3.353
71 HA ILE 14 HA ILE 14 5.052 0.050 5.441
72 HB ILE 14 HB ILE 14 5.212 -2.624 4.047
73 HG12 ILE 14 1HG1 ILE 14 3.272 -0.478 3.292
74 HG13 ILE 14 2HG1 ILE 14 4.925 -0.371 2.694
75 HG21 ILE 14 1HG2 ILE 14 2.594 -2.189 4.615
76 HG22 ILE 14 2HG2 ILE 14 3.692 -3.132 5.621
77 HG23 ILE 14 3HG2 ILE 14 3.377 -1.440 6.007
78 HD11 ILE 14 1HD1 ILE 14 4.696 -2.191 1.342
79 HD12 ILE 14 2HD1 ILE 14 3.460 -2.932 2.359
80 HD13 ILE 14 3HD1 ILE 14 3.046 -1.571 1.318
81 H THR 15 H THR 15 5.410 -0.164 7.540
82 HA THR 15 HA THR 15 7.000 -2.461 8.477
83 HB THR 15 HB THR 15 7.798 -1.195 10.290
84 HG1 THR 15 1HG THR 15 5.968 0.886 9.627
85 HG21 THR 15 1HG2 THR 15 8.072 1.197 8.850
86 HG22 THR 15 2HG2 THR 15 7.980 -0.084 7.642
87 HG23 THR 15 3HG2 THR 15 9.204 -0.153 8.909
88 H PHE 16 H PHE 16 3.944 -1.786 8.068
89 HA PHE 16 HA PHE 16 3.089 -3.368 10.327
90 HB2 PHE 16 1HB PHE 16 3.095 -0.858 10.998
91 HB3 PHE 16 2HB PHE 16 1.678 -0.742 9.959
92 HD1 PHE 16 2HD PHE 16 -0.379 -1.955 10.528
93 HD2 PHE 16 1HD PHE 16 2.996 -1.930 13.122
94 HE1 PHE 16 2HE PHE 16 -1.797 -2.746 12.376
95 HE2 PHE 16 1HE PHE 16 1.583 -2.722 14.974
96 HZ PHE 16 HZ PHE 16 -0.817 -3.129 14.603
97 H THR 17 H THR 17 1.565 -4.736 9.673
98 HA THR 17 HA THR 17 -0.329 -3.941 7.600
99 HB THR 17 HB THR 17 0.123 -6.361 6.616
100 HG1 THR 17 1HG THR 17 2.545 -5.614 7.892
101 HG21 THR 17 1HG2 THR 17 0.617 -5.110 4.841
102 HG22 THR 17 2HG2 THR 17 2.209 -4.753 5.511
103 HG23 THR 17 3HG2 THR 17 0.835 -3.718 5.900
104 H ASP 18 H ASP 18 -2.226 -4.303 8.541
105 HA ASP 18 HA ASP 18 -2.730 -6.937 9.712
106 HB2 ASP 18 1HB ASP 18 -2.184 -5.034 11.444
107 HB3 ASP 18 2HB ASP 18 -3.841 -4.536 11.113
108 H ALA 19 H ALA 19 -4.866 -7.640 9.571
109 HA ALA 19 HA ALA 19 -6.428 -6.299 7.523
110 HB1 ALA 19 1HB ALA 19 -6.112 -8.695 7.335
111 HB2 ALA 19 2HB ALA 19 -6.855 -8.939 8.916
112 HB3 ALA 19 3HB ALA 19 -7.820 -8.325 7.574
113 H VAL 20 H VAL 20 -7.987 -4.904 7.983
114 HA VAL 20 HA VAL 20 -8.923 -4.544 10.678
115 HB VAL 20 HB VAL 20 -9.957 -3.213 8.173
116 HG11 VAL 20 1HG1 VAL 20 -11.462 -2.451 9.652
117 HG12 VAL 20 2HG1 VAL 20 -10.484 -2.927 11.042
118 HG13 VAL 20 3HG1 VAL 20 -10.149 -1.411 10.205
119 HG21 VAL 20 1HG2 VAL 20 -7.436 -3.050 8.629
120 HG22 VAL 20 2HG2 VAL 20 -8.328 -1.550 8.377
121 HG23 VAL 20 3HG2 VAL 20 -7.889 -2.051 10.010
122 H ASN 21 H ASN 21 -10.002 -6.225 7.863
123 HA ASN 21 HA ASN 21 -12.123 -7.480 9.293
124 HB2 ASN 21 1HB ASN 21 -12.749 -5.247 7.418
125 HB3 ASN 21 2HB ASN 21 -13.805 -6.656 7.402
126 HD21 ASN 21 1HD2 ASN 21 -14.422 -3.957 8.205
127 HD22 ASN 21 2HD2 ASN 21 -14.931 -4.036 9.855
128 H GLU 22 H GLU 22 -13.606 -8.642 7.459
129 HA GLU 22 HA GLU 22 -11.796 -10.406 6.135
130 HB2 GLU 22 1HB GLU 22 -13.674 -11.698 5.582
131 HB3 GLU 22 2HB GLU 22 -14.093 -10.965 7.124
132 HG2 GLU 22 1HG GLU 22 -15.181 -9.129 5.616
133 HG3 GLU 22 2HG GLU 22 -15.172 -10.411 4.407
134 H THR 23 H THR 23 -13.144 -7.436 5.291
135 HA THR 23 HA THR 23 -12.400 -7.866 2.479
136 HB THR 23 HB THR 23 -14.265 -6.322 1.816
137 HG1 THR 23 1HG THR 23 -15.659 -5.632 3.291
138 HG21 THR 23 1HG2 THR 23 -14.349 -9.083 2.449
139 HG22 THR 23 2HG2 THR 23 -15.312 -8.207 1.259
140 HG23 THR 23 3HG2 THR 23 -15.902 -8.387 2.910
141 H THR 24 H THR 24 -11.534 -6.377 5.150
142 HA THR 24 HA THR 24 -10.602 -3.984 3.721
143 HB THR 24 HB THR 24 -11.415 -3.873 6.621
144 HG1 THR 24 1HG THR 24 -13.336 -4.224 5.600
145 HG21 THR 24 1HG2 THR 24 -11.096 -1.592 6.467
146 HG22 THR 24 2HG2 THR 24 -11.345 -1.567 4.721
147 HG23 THR 24 3HG2 THR 24 -9.834 -2.184 5.389
148 H ILE 25 H ILE 25 -8.563 -3.237 4.296
149 HA ILE 25 HA ILE 25 -7.086 -4.758 6.321
150 HB ILE 25 HB ILE 25 -6.309 -4.455 3.432
151 HG12 ILE 25 1HG1 ILE 25 -6.421 -6.790 5.352
152 HG13 ILE 25 2HG1 ILE 25 -7.512 -6.483 4.005
153 HG21 ILE 25 1HG2 ILE 25 -4.089 -5.496 4.302
154 HG22 ILE 25 2HG2 ILE 25 -4.327 -3.751 4.379
155 HG23 ILE 25 3HG2 ILE 25 -4.546 -4.735 5.826
156 HD11 ILE 25 1HD1 ILE 25 -6.152 -8.025 3.052
157 HD12 ILE 25 2HD1 ILE 25 -5.254 -6.565 2.637
158 HD13 ILE 25 3HD1 ILE 25 -4.751 -7.549 4.011
159 H MET 26 H MET 26 -5.718 -3.555 7.509
160 HA MET 26 HA MET 26 -5.376 -0.741 6.718
161 HB2 MET 26 1HB MET 26 -6.431 -0.585 8.749
162 HB3 MET 26 2HB MET 26 -5.753 -2.095 9.341
163 HG2 MET 26 1HG MET 26 -3.839 -1.109 10.091
164 HG3 MET 26 2HG MET 26 -3.917 0.196 8.909
165 HE1 MET 26 1HE MET 26 -4.228 2.169 9.280
166 HE2 MET 26 2HE MET 26 -5.792 2.759 9.842
167 HE3 MET 26 3HE MET 26 -4.373 2.895 10.881
168 H LEU 27 H LEU 27 -3.429 -0.226 5.990
169 HA LEU 27 HA LEU 27 -1.089 -1.609 7.125
170 HB2 LEU 27 1HB LEU 27 -0.094 -1.850 5.058
171 HB3 LEU 27 2HB LEU 27 -1.788 -2.192 4.711
172 HG LEU 27 HG LEU 27 -0.721 0.568 4.288
173 HD11 LEU 27 1HD1 LEU 27 -0.398 -0.306 1.850
174 HD12 LEU 27 2HD1 LEU 27 -0.136 -1.855 2.651
175 HD13 LEU 27 3HD1 LEU 27 0.896 -0.478 3.036
176 HD21 LEU 27 1HD2 LEU 27 -2.643 -0.861 2.521
177 HD22 LEU 27 2HD2 LEU 27 -2.556 0.848 2.949
178 HD23 LEU 27 3HD2 LEU 27 -3.192 -0.321 4.108
179 H LYS 28 H LYS 28 0.715 -0.378 7.544
180 HA LYS 28 HA LYS 28 0.444 2.524 7.110
181 HB2 LYS 28 1HB LYS 28 1.750 1.219 9.501
182 HB3 LYS 28 2HB LYS 28 1.458 2.937 9.259
183 HG2 LYS 28 1HG LYS 28 -0.797 2.754 9.693
184 HG3 LYS 28 2HG LYS 28 -0.843 1.037 9.283
185 HD2 LYS 28 1HD LYS 28 0.538 0.597 11.321
186 HD3 LYS 28 2HD LYS 28 0.346 2.299 11.751
187 HE2 LYS 28 1HE LYS 28 -2.196 1.788 11.465
188 HE3 LYS 28 2HE LYS 28 -1.692 0.113 11.680
189 HZ1 LYS 28 1HZ LYS 28 -2.323 1.696 13.699
190 HZ2 LYS 28 2HZ LYS 28 -0.669 2.037 13.610
191 HZ3 LYS 28 3HZ LYS 28 -1.193 0.445 13.841
192 H TRP 29 H TRP 29 2.258 3.647 6.498
193 HA TRP 29 HA TRP 29 4.673 2.036 5.988
194 HB2 TRP 29 1HB TRP 29 5.052 3.477 3.990
195 HB3 TRP 29 2HB TRP 29 3.591 2.501 3.878
196 HD1 TRP 29 HD TRP 29 4.748 6.129 4.249
197 HE1 TRP 29 1HE TRP 29 2.763 7.683 3.729
198 HE3 TRP 29 3HE TRP 29 1.043 2.623 3.900
199 HZ2 TRP 29 2HZ TRP 29 -0.007 7.453 3.237
200 HZ3 TRP 29 3HZ TRP 29 -1.247 3.373 3.402
201 HH2 TRP 29 HH TRP 29 -1.759 5.738 3.078
202 H MET 30 H MET 30 6.693 3.252 5.926
203 HA MET 30 HA MET 30 6.594 5.635 7.657
204 HB2 MET 30 1HB MET 30 8.493 4.935 8.805
205 HB3 MET 30 2HB MET 30 7.610 3.433 8.566
206 HG2 MET 30 1HG MET 30 9.032 2.989 6.575
207 HG3 MET 30 2HG MET 30 9.978 4.416 6.996
208 HE1 MET 30 1HE MET 30 11.245 3.579 10.505
209 HE2 MET 30 2HE MET 30 12.152 4.087 9.080
210 HE3 MET 30 3HE MET 30 10.579 4.807 9.428
211 H TYR 31 H TYR 31 8.584 7.033 7.435
212 HA TYR 31 HA TYR 31 9.624 7.041 4.688
213 HB2 TYR 31 1HB TYR 31 7.710 8.634 4.882
214 HB3 TYR 31 2HB TYR 31 8.611 9.506 6.117
215 HD1 TYR 31 1HD TYR 31 8.584 8.563 2.542
216 HD2 TYR 31 2HD TYR 31 10.321 11.045 5.529
217 HE1 TYR 31 1HE TYR 31 9.683 9.893 0.789
218 HE2 TYR 31 2HE TYR 31 11.423 12.383 3.784
219 HH TYR 31 HH TYR 31 10.571 12.415 0.677
220 H ILE 32 H ILE 32 11.706 7.761 4.453
221 HA ILE 32 HA ILE 32 13.125 8.449 6.944
222 HB ILE 32 HB ILE 32 14.536 7.218 4.610
223 HG12 ILE 32 1HG1 ILE 32 12.506 5.821 5.221
224 HG13 ILE 32 2HG1 ILE 32 14.060 5.003 5.335
225 HG21 ILE 32 1HG2 ILE 32 16.155 6.607 6.188
226 HG22 ILE 32 2HG2 ILE 32 15.658 8.229 6.669
227 HG23 ILE 32 3HG2 ILE 32 15.045 6.824 7.541
228 HD11 ILE 32 1HD1 ILE 32 12.185 4.895 7.236
229 HD12 ILE 32 2HD1 ILE 32 13.912 4.755 7.566
230 HD13 ILE 32 3HD1 ILE 32 13.093 6.300 7.796
231 HA PRO 33 HA PRO 33 13.858 12.259 4.714
232 HB2 PRO 33 1HB PRO 33 15.145 13.498 6.758
233 HB3 PRO 33 2HB PRO 33 13.387 13.336 6.688
234 HG2 PRO 33 1HG PRO 33 15.380 11.700 8.209
235 HG3 PRO 33 2HG PRO 33 13.805 12.322 8.738
236 HD2 PRO 33 1HD PRO 33 14.168 9.758 7.946
237 HD3 PRO 33 2HD PRO 33 12.644 10.630 7.688
238 H ALA 34 H ALA 34 16.202 10.199 6.273
239 HA ALA 34 HA ALA 34 18.542 11.550 5.415
240 HB1 ALA 34 1HB ALA 34 18.361 8.600 5.958
241 HB2 ALA 34 2HB ALA 34 19.742 9.676 6.177
242 HB3 ALA 34 3HB ALA 34 18.347 9.803 7.248
243 H SER 35 H SER 35 17.310 8.402 4.272
244 HA SER 35 HA SER 35 18.800 8.597 1.832
245 HB2 SER 35 1HB SER 35 18.069 6.419 1.377
246 HB3 SER 35 2HB SER 35 18.103 6.462 3.140
247 HG SER 35 HG SER 35 15.957 6.454 3.203
248 H ASN 36 H ASN 36 17.310 10.837 1.896
249 HA ASN 36 HA ASN 36 15.225 10.339 -0.127
250 HB2 ASN 36 1HB ASN 36 14.252 11.111 2.002
251 HB3 ASN 36 2HB ASN 36 15.278 12.542 1.948
252 HD21 ASN 36 1HD2 ASN 36 13.794 14.107 1.745
253 HD22 ASN 36 2HD2 ASN 36 12.677 14.238 0.434
254 H ASN 37 H ASN 37 14.807 12.309 -1.514
255 HA ASN 37 HA ASN 37 17.395 13.443 -2.309
256 HB2 ASN 37 1HB ASN 37 14.833 12.930 -3.808
257 HB3 ASN 37 2HB ASN 37 16.075 14.001 -4.450
258 HD21 ASN 37 1HD2 ASN 37 15.112 11.522 -5.550
259 HD22 ASN 37 2HD2 ASN 37 16.472 10.460 -5.649
260 H ASN 38 H ASN 38 15.483 14.409 -0.162
261 HA ASN 38 HA ASN 38 14.620 16.365 0.628
262 HB2 ASN 38 1HB ASN 38 17.073 16.913 0.227
263 HB3 ASN 38 2HB ASN 38 16.557 17.708 -1.258
264 HD21 ASN 38 1HD2 ASN 38 17.874 19.014 0.820
265 HD22 ASN 38 2HD2 ASN 38 16.798 20.174 1.512
266 H THR 39 H THR 39 12.996 15.327 -1.273
267 HA THR 39 HA THR 39 12.055 17.727 -2.697
268 HB THR 39 HB THR 39 13.084 15.815 -4.143
269 HG1 THR 39 1HG THR 39 11.129 16.192 -5.630
270 HG21 THR 39 1HG2 THR 39 11.752 14.032 -3.003
271 HG22 THR 39 2HG2 THR 39 11.572 14.052 -4.758
272 HG23 THR 39 3HG2 THR 39 10.302 14.720 -3.733
273 HA PRO 40 HA PRO 40 8.271 17.033 -0.543
274 HB2 PRO 40 1HB PRO 40 6.628 18.499 -2.130
275 HB3 PRO 40 2HB PRO 40 7.784 19.229 -1.010
276 HG2 PRO 40 1HG PRO 40 8.024 18.792 -3.962
277 HG3 PRO 40 2HG PRO 40 8.472 20.213 -3.001
278 HD2 PRO 40 1HD PRO 40 10.290 18.391 -3.842
279 HD3 PRO 40 2HD PRO 40 10.463 19.277 -2.313
280 H ILE 41 H ILE 41 6.492 15.713 -0.632
281 HA ILE 41 HA ILE 41 6.166 14.159 -3.106
282 HB ILE 41 HB ILE 41 5.127 13.354 -0.400
283 HG12 ILE 41 1HG1 ILE 41 7.853 12.843 -1.601
284 HG13 ILE 41 2HG1 ILE 41 7.494 13.664 -0.086
285 HG21 ILE 41 1HG2 ILE 41 5.030 11.161 -1.324
286 HG22 ILE 41 2HG2 ILE 41 4.277 12.254 -2.484
287 HG23 ILE 41 3HG2 ILE 41 5.915 11.665 -2.764
288 HD11 ILE 41 1HD1 ILE 41 8.318 11.442 0.342
289 HD12 ILE 41 2HD1 ILE 41 6.623 11.552 0.819
290 HD13 ILE 41 3HD1 ILE 41 7.065 10.748 -0.686
291 H HIS 42 H HIS 42 4.228 14.009 -4.116
292 HA HIS 42 HA HIS 42 2.240 15.970 -3.516
293 HB2 HIS 42 1HB HIS 42 2.598 13.863 -5.604
294 HB3 HIS 42 2HB HIS 42 0.997 14.562 -5.378
295 HD1 HIS 42 1HD HIS 42 1.546 15.380 -7.929
296 HD2 HIS 42 2HD HIS 42 3.629 17.235 -4.850
297 HE1 HIS 42 1HE HIS 42 2.445 17.511 -8.915
298 HE2 HIS 42 2HE HIS 42 3.773 18.575 -7.058
299 H GLY 43 H GLY 43 2.441 12.449 -3.212
300 HA2 GLY 43 1HA GLY 43 0.581 12.424 -1.050
301 HA3 GLY 43 2HA GLY 43 -0.166 11.845 -2.532
302 H PHE 44 H PHE 44 -0.438 9.739 -1.879
303 HA PHE 44 HA PHE 44 1.964 8.108 -1.943
304 HB2 PHE 44 1HB PHE 44 0.206 8.391 0.459
305 HB3 PHE 44 2HB PHE 44 0.921 6.821 0.108
306 HD1 PHE 44 2HD PHE 44 3.558 7.251 -0.725
307 HD2 PHE 44 1HD PHE 44 1.323 9.492 2.120
308 HE1 PHE 44 2HE PHE 44 5.652 7.964 0.353
309 HE2 PHE 44 1HE PHE 44 3.412 10.210 3.202
310 HZ PHE 44 HZ PHE 44 5.581 9.445 2.320
311 H TYR 45 H TYR 45 1.575 6.556 -3.363
312 HA TYR 45 HA TYR 45 -1.186 5.748 -3.885
313 HB2 TYR 45 1HB TYR 45 1.386 5.490 -5.419
314 HB3 TYR 45 2HB TYR 45 -0.014 4.508 -5.837
315 HD1 TYR 45 2HD TYR 45 -2.259 6.296 -5.565
316 HD2 TYR 45 1HD TYR 45 1.647 7.115 -7.043
317 HE1 TYR 45 2HE TYR 45 -3.161 8.148 -6.908
318 HE2 TYR 45 1HE TYR 45 0.755 8.970 -8.389
319 HH TYR 45 HH TYR 45 -2.594 9.444 -8.874
320 H ILE 46 H ILE 46 -1.905 3.649 -3.730
321 HA ILE 46 HA ILE 46 -0.050 1.705 -2.524
322 HB ILE 46 HB ILE 46 -2.927 2.177 -1.739
323 HG12 ILE 46 1HG1 ILE 46 -0.634 2.242 0.171
324 HG13 ILE 46 2HG1 ILE 46 -0.871 3.627 -0.889
325 HG21 ILE 46 1HG2 ILE 46 -2.312 -0.218 -1.800
326 HG22 ILE 46 2HG2 ILE 46 -0.999 0.120 -0.674
327 HG23 ILE 46 3HG2 ILE 46 -2.673 0.361 -0.174
328 HD11 ILE 46 1HD1 ILE 46 -3.162 3.856 -0.037
329 HD12 ILE 46 2HD1 ILE 46 -2.867 2.509 1.063
330 HD13 ILE 46 3HD1 ILE 46 -1.946 4.004 1.231
331 H TYR 47 H TYR 47 0.069 -0.160 -3.581
332 HA TYR 47 HA TYR 47 -2.040 -0.792 -5.533
333 HB2 TYR 47 1HB TYR 47 0.871 -1.598 -5.445
334 HB3 TYR 47 2HB TYR 47 -0.288 -2.228 -6.610
335 HD1 TYR 47 2HD TYR 47 0.593 1.168 -5.301
336 HD2 TYR 47 1HD TYR 47 -0.048 -1.306 -8.702
337 HE1 TYR 47 2HE TYR 47 1.040 3.087 -6.774
338 HE2 TYR 47 1HE TYR 47 0.398 0.605 -10.184
339 HH TYR 47 HH TYR 47 0.219 3.215 -9.926
340 H TYR 48 H TYR 48 -2.924 -2.845 -5.630
341 HA TYR 48 HA TYR 48 -2.039 -4.930 -3.845
342 HB2 TYR 48 1HB TYR 48 -4.423 -5.067 -2.842
343 HB3 TYR 48 2HB TYR 48 -3.303 -3.879 -2.185
344 HD1 TYR 48 2HD TYR 48 -3.477 -1.478 -3.068
345 HD2 TYR 48 1HD TYR 48 -6.510 -4.403 -3.661
346 HE1 TYR 48 2HE TYR 48 -5.106 0.310 -3.515
347 HE2 TYR 48 1HE TYR 48 -8.147 -2.623 -4.111
348 HH TYR 48 HH TYR 48 -8.440 -0.435 -4.453
349 H ARG 49 H ARG 49 -3.088 -6.949 -4.229
350 HA ARG 49 HA ARG 49 -5.173 -7.282 -6.110
351 HB2 ARG 49 1HB ARG 49 -3.975 -8.155 -8.002
352 HB3 ARG 49 2HB ARG 49 -3.346 -6.552 -7.644
353 HG2 ARG 49 1HG ARG 49 -1.387 -7.646 -7.953
354 HG3 ARG 49 2HG ARG 49 -1.604 -7.958 -6.229
355 HD2 ARG 49 1HD ARG 49 -2.818 -10.089 -6.961
356 HD3 ARG 49 2HD ARG 49 -2.112 -9.795 -8.550
357 HE ARG 49 HE ARG 49 -0.779 -10.818 -6.246
358 HH11 ARG 49 1HH1 ARG 49 -0.337 -8.914 -9.126
359 HH12 ARG 49 2HH1 ARG 49 1.356 -9.261 -9.253
360 HH21 ARG 49 1HH2 ARG 49 1.449 -11.283 -6.402
361 HH22 ARG 49 2HH2 ARG 49 2.370 -10.609 -7.703
362 HA PRO 50 HA PRO 50 -5.190 -11.168 -4.040
363 HB2 PRO 50 1HB PRO 50 -6.838 -12.532 -5.711
364 HB3 PRO 50 2HB PRO 50 -7.415 -11.285 -4.600
365 HG2 PRO 50 1HG PRO 50 -6.824 -11.087 -7.528
366 HG3 PRO 50 2HG PRO 50 -8.192 -10.423 -6.615
367 HD2 PRO 50 1HD PRO 50 -6.064 -8.918 -7.352
368 HD3 PRO 50 2HD PRO 50 -6.972 -8.620 -5.856
369 H THR 51 H THR 51 -4.208 -13.162 -4.120
370 HA THR 51 HA THR 51 -2.079 -13.555 -5.878
371 HB THR 51 HB THR 51 -2.626 -14.659 -3.553
372 HG1 THR 51 1HG THR 51 -1.356 -16.378 -5.391
373 HG21 THR 51 1HG2 THR 51 -4.589 -15.895 -4.811
374 HG22 THR 51 2HG2 THR 51 -3.669 -16.706 -3.544
375 HG23 THR 51 3HG2 THR 51 -3.303 -17.022 -5.239
376 H ASP 52 H ASP 52 -5.415 -14.237 -6.265
377 HA ASP 52 HA ASP 52 -5.103 -16.301 -8.242
378 HB2 ASP 52 1HB ASP 52 -7.397 -16.449 -8.249
379 HB3 ASP 52 2HB ASP 52 -7.149 -15.721 -6.664
380 H SER 53 H SER 53 -5.228 -12.840 -8.217
381 HA SER 53 HA SER 53 -6.131 -12.057 -10.627
382 HB2 SER 53 1HB SER 53 -3.724 -11.172 -9.070
383 HB3 SER 53 2HB SER 53 -4.067 -10.449 -10.641
384 HG SER 53 HG SER 53 -6.339 -10.434 -9.367
385 H ASP 54 H ASP 54 -5.236 -11.739 -12.726
386 HA ASP 54 HA ASP 54 -3.870 -14.016 -13.730
387 HB2 ASP 54 1HB ASP 54 -5.544 -12.313 -14.880
388 HB3 ASP 54 2HB ASP 54 -4.046 -11.504 -15.335
389 H ASN 55 H ASN 55 -2.913 -10.588 -13.516
390 HA ASN 55 HA ASN 55 -0.199 -11.299 -12.913
391 HB2 ASN 55 1HB ASN 55 0.572 -9.843 -14.972
392 HB3 ASN 55 2HB ASN 55 0.258 -11.566 -15.160
393 HD21 ASN 55 1HD2 ASN 55 -0.415 -8.510 -16.308
394 HD22 ASN 55 2HD2 ASN 55 -1.788 -8.891 -17.286
395 H ASP 56 H ASP 56 1.162 -9.068 -13.272
396 HA ASP 56 HA ASP 56 0.350 -7.339 -11.289
397 HB2 ASP 56 1HB ASP 56 1.991 -6.465 -13.667
398 HB3 ASP 56 2HB ASP 56 2.065 -5.849 -12.019
399 H SER 57 H SER 57 -0.609 -7.426 -14.625
400 HA SER 57 HA SER 57 -1.523 -4.854 -15.051
401 HB2 SER 57 1HB SER 57 -1.484 -6.807 -16.692
402 HB3 SER 57 2HB SER 57 -3.020 -7.305 -15.983
403 HG SER 57 HG SER 57 -2.734 -4.654 -16.831
404 H ASP 58 H ASP 58 -2.640 -7.134 -12.797
405 HA ASP 58 HA ASP 58 -5.318 -6.040 -12.595
406 HB2 ASP 58 1HB ASP 58 -4.547 -8.501 -12.159
407 HB3 ASP 58 2HB ASP 58 -4.113 -7.889 -10.565
408 H TYR 59 H TYR 59 -2.258 -5.878 -10.872
409 HA TYR 59 HA TYR 59 -2.803 -4.818 -8.474
410 HB2 TYR 59 1HB TYR 59 -0.694 -4.182 -10.479
411 HB3 TYR 59 2HB TYR 59 -0.828 -3.134 -9.072
412 HD1 TYR 59 1HD TYR 59 -1.434 -4.893 -6.886
413 HD2 TYR 59 2HD TYR 59 1.136 -5.565 -10.209
414 HE1 TYR 59 1HE TYR 59 -0.144 -6.509 -5.554
415 HE2 TYR 59 2HE TYR 59 2.433 -7.183 -8.887
416 HH TYR 59 HH TYR 59 1.897 -7.611 -5.469
417 H LYS 60 H LYS 60 -3.914 -3.173 -7.656
418 HA LYS 60 HA LYS 60 -4.963 -1.144 -9.478
419 HB2 LYS 60 1HB LYS 60 -5.747 -2.150 -6.769
420 HB3 LYS 60 2HB LYS 60 -6.270 -0.550 -7.278
421 HG2 LYS 60 1HG LYS 60 -7.361 -1.520 -9.232
422 HG3 LYS 60 2HG LYS 60 -6.826 -3.127 -8.734
423 HD2 LYS 60 1HD LYS 60 -8.045 -2.422 -6.486
424 HD3 LYS 60 2HD LYS 60 -8.946 -1.384 -7.593
425 HE2 LYS 60 1HE LYS 60 -9.424 -3.391 -8.983
426 HE3 LYS 60 2HE LYS 60 -8.647 -4.381 -7.748
427 HZ1 LYS 60 1HZ LYS 60 -10.433 -2.925 -6.332
428 HZ2 LYS 60 2HZ LYS 60 -10.675 -4.511 -6.867
429 HZ3 LYS 60 3HZ LYS 60 -11.272 -3.212 -7.773
430 H LYS 61 H LYS 61 -5.398 1.014 -8.003
431 HA LYS 61 HA LYS 61 -2.967 1.757 -6.584
432 HB2 LYS 61 1HB LYS 61 -2.695 2.215 -9.093
433 HB3 LYS 61 2HB LYS 61 -3.909 3.469 -8.877
434 HG2 LYS 61 1HG LYS 61 -2.418 4.442 -7.093
435 HG3 LYS 61 2HG LYS 61 -1.177 3.310 -7.637
436 HD2 LYS 61 1HD LYS 61 -0.765 5.358 -8.761
437 HD3 LYS 61 2HD LYS 61 -1.483 4.268 -9.951
438 HE2 LYS 61 1HE LYS 61 -3.619 5.338 -9.724
439 HE3 LYS 61 2HE LYS 61 -3.039 6.315 -8.376
440 HZ1 LYS 61 1HZ LYS 61 -3.101 7.146 -10.914
441 HZ2 LYS 61 2HZ LYS 61 -1.514 6.568 -10.824
442 HZ3 LYS 61 3HZ LYS 61 -2.041 7.761 -9.747
443 H ASP 62 H ASP 62 -3.483 2.919 -4.855
444 HA ASP 62 HA ASP 62 -6.011 4.435 -4.890
445 HB2 ASP 62 1HB ASP 62 -4.805 2.678 -2.785
446 HB3 ASP 62 2HB ASP 62 -5.832 4.026 -2.304
447 H MET 63 H MET 63 -5.655 6.546 -4.868
448 HA MET 63 HA MET 63 -3.139 7.674 -4.128
449 HB2 MET 63 1HB MET 63 -4.878 8.532 -5.852
450 HB3 MET 63 2HB MET 63 -5.662 9.269 -4.462
451 HG2 MET 63 1HG MET 63 -3.210 10.173 -4.032
452 HG3 MET 63 2HG MET 63 -3.095 9.941 -5.775
453 HE1 MET 63 1HE MET 63 -5.092 11.521 -2.882
454 HE2 MET 63 2HE MET 63 -3.734 12.593 -3.218
455 HE3 MET 63 3HE MET 63 -5.385 13.144 -3.506
456 H VAL 64 H VAL 64 -2.575 8.848 -2.333
457 HA VAL 64 HA VAL 64 -4.559 9.154 -0.196
458 HB VAL 64 HB VAL 64 -1.808 8.052 0.360
459 HG11 VAL 64 1HG1 VAL 64 -2.970 7.407 2.520
460 HG12 VAL 64 2HG1 VAL 64 -2.678 9.130 2.271
461 HG13 VAL 64 3HG1 VAL 64 -4.289 8.460 2.009
462 HG21 VAL 64 1HG2 VAL 64 -2.513 6.087 -0.416
463 HG22 VAL 64 2HG2 VAL 64 -3.661 6.059 0.922
464 HG23 VAL 64 3HG2 VAL 64 -4.153 6.690 -0.650
465 H GLU 65 H GLU 65 -4.016 10.743 1.384
466 HA GLU 65 HA GLU 65 -2.909 13.082 0.381
467 HB2 GLU 65 1HB GLU 65 -3.062 12.354 3.307
468 HB3 GLU 65 2HB GLU 65 -3.060 13.968 2.613
469 HG2 GLU 65 1HG GLU 65 -5.234 11.902 2.425
470 HG3 GLU 65 2HG GLU 65 -5.283 13.443 3.280
471 H GLY 66 H GLY 66 -0.959 14.183 0.776
472 HA2 GLY 66 1HA GLY 66 1.348 12.489 0.838
473 HA3 GLY 66 2HA GLY 66 1.346 14.244 0.736
474 H ASP 67 H ASP 67 -0.453 14.123 3.246
475 HA ASP 67 HA ASP 67 1.793 14.104 5.124
476 HB2 ASP 67 1HB ASP 67 -0.862 15.464 5.038
477 HB3 ASP 67 2HB ASP 67 -0.150 15.133 6.615
478 H ARG 68 H ARG 68 -0.889 12.238 4.208
479 HA ARG 68 HA ARG 68 -1.244 10.981 6.800
480 HB2 ARG 68 1HB ARG 68 -3.153 11.391 5.229
481 HB3 ARG 68 2HB ARG 68 -2.450 10.201 4.142
482 HG2 ARG 68 1HG ARG 68 -3.040 8.441 5.458
483 HG3 ARG 68 2HG ARG 68 -2.952 9.383 6.948
484 HD2 ARG 68 1HD ARG 68 -5.079 10.183 6.730
485 HD3 ARG 68 2HD ARG 68 -5.042 10.109 4.968
486 HE ARG 68 HE ARG 68 -4.977 7.495 5.922
487 HH11 ARG 68 1HH1 ARG 68 -7.139 10.223 5.914
488 HH12 ARG 68 2HH1 ARG 68 -8.573 9.252 5.962
489 HH21 ARG 68 1HH2 ARG 68 -6.857 6.206 5.985
490 HH22 ARG 68 2HH2 ARG 68 -8.412 6.967 6.004
491 H TYR 69 H TYR 69 -0.279 9.167 7.461
492 HA TYR 69 HA TYR 69 1.338 7.678 5.499
493 HB2 TYR 69 1HB TYR 69 1.801 8.379 8.374
494 HB3 TYR 69 2HB TYR 69 2.538 6.926 7.710
495 HD1 TYR 69 2HD TYR 69 1.997 10.272 6.154
496 HD2 TYR 69 1HD TYR 69 4.808 7.388 7.527
497 HE1 TYR 69 2HE TYR 69 3.831 11.628 5.233
498 HE2 TYR 69 1HE TYR 69 6.649 8.737 6.611
499 HH TYR 69 HH TYR 69 7.170 10.884 5.879
500 H TRP 70 H TRP 70 -1.521 7.310 6.282
501 HA TRP 70 HA TRP 70 -1.339 4.445 6.796
502 HB2 TRP 70 1HB TRP 70 -2.865 4.417 8.602
503 HB3 TRP 70 2HB TRP 70 -1.721 5.699 8.989
504 HD1 TRP 70 HD TRP 70 -2.621 8.252 8.733
505 HE1 TRP 70 1HE TRP 70 -5.005 9.210 8.892
506 HE3 TRP 70 3HE TRP 70 -5.277 3.926 8.124
507 HZ2 TRP 70 2HZ TRP 70 -7.659 8.258 8.774
508 HZ3 TRP 70 3HZ TRP 70 -7.735 4.036 8.160
509 HH2 TRP 70 HH TRP 70 -8.899 6.158 8.479
510 H HIS 71 H HIS 71 -3.079 3.248 5.988
511 HA HIS 71 HA HIS 71 -5.346 4.569 4.796
512 HB2 HIS 71 1HB HIS 71 -3.553 4.853 3.082
513 HB3 HIS 71 2HB HIS 71 -3.416 3.100 2.989
514 HD1 HIS 71 1HD HIS 71 -6.032 5.798 2.433
515 HD2 HIS 71 2HD HIS 71 -5.074 1.959 1.168
516 HE1 HIS 71 1HE HIS 71 -7.672 5.265 0.603
517 HE2 HIS 71 2HE HIS 71 -7.128 2.905 -0.088
518 H SER 72 H SER 72 -7.028 3.157 4.297
519 HA SER 72 HA SER 72 -6.571 0.340 5.034
520 HB2 SER 72 1HB SER 72 -8.799 0.296 6.046
521 HB3 SER 72 2HB SER 72 -7.810 1.548 6.799
522 HG SER 72 HG SER 72 -9.806 1.912 4.813
523 H ILE 73 H ILE 73 -6.734 -0.844 3.251
524 HA ILE 73 HA ILE 73 -8.252 -0.008 0.970
525 HB ILE 73 HB ILE 73 -7.083 -2.749 1.426
526 HG12 ILE 73 1HG1 ILE 73 -5.643 -0.489 0.057
527 HG13 ILE 73 2HG1 ILE 73 -5.490 -0.746 1.792
528 HG21 ILE 73 1HG2 ILE 73 -8.640 -2.411 -0.485
529 HG22 ILE 73 2HG2 ILE 73 -7.522 -1.207 -1.124
530 HG23 ILE 73 3HG2 ILE 73 -7.012 -2.888 -0.966
531 HD11 ILE 73 1HD1 ILE 73 -3.649 -1.814 0.794
532 HD12 ILE 73 2HD1 ILE 73 -4.768 -3.100 1.245
533 HD13 ILE 73 3HD1 ILE 73 -4.658 -2.575 -0.435
534 H SER 74 H SER 74 -10.032 -1.101 0.028
535 HA SER 74 HA SER 74 -11.516 -2.918 1.787
536 HB2 SER 74 1HB SER 74 -12.979 -0.720 0.353
537 HB3 SER 74 2HB SER 74 -13.490 -1.668 1.750
538 HG SER 74 HG SER 74 -11.429 0.286 1.721
539 H HIS 75 H HIS 75 -13.646 -3.570 0.476
540 HA HIS 75 HA HIS 75 -14.477 -4.805 -1.244
541 HB2 HIS 75 1HB HIS 75 -12.766 -2.899 -2.850
542 HB3 HIS 75 2HB HIS 75 -13.913 -4.030 -3.562
543 HD1 HIS 75 1HD HIS 75 -15.729 -2.552 -4.399
544 HD2 HIS 75 2HD HIS 75 -14.602 -1.602 -0.515
545 HE1 HIS 75 1HE HIS 75 -17.362 -0.799 -3.635
546 HE2 HIS 75 2HE HIS 75 -16.608 -0.178 -1.313
547 H LEU 76 H LEU 76 -12.424 -6.001 0.109
548 HA LEU 76 HA LEU 76 -10.792 -7.256 -1.993
549 HB2 LEU 76 1HB LEU 76 -10.296 -7.490 0.956
550 HB3 LEU 76 2HB LEU 76 -9.177 -7.784 -0.373
551 HG LEU 76 HG LEU 76 -10.231 -5.025 0.085
552 HD11 LEU 76 1HD1 LEU 76 -9.446 -5.128 2.193
553 HD12 LEU 76 2HD1 LEU 76 -7.882 -4.940 1.401
554 HD13 LEU 76 3HD1 LEU 76 -8.446 -6.544 1.868
555 HD21 LEU 76 1HD2 LEU 76 -7.498 -5.096 -0.551
556 HD22 LEU 76 2HD2 LEU 76 -8.840 -4.635 -1.599
557 HD23 LEU 76 3HD2 LEU 76 -8.274 -6.306 -1.573
558 H GLN 77 H GLN 77 -10.095 -9.600 -1.004
559 HA GLN 77 HA GLN 77 -12.647 -11.024 -0.760
560 HB2 GLN 77 1HB GLN 77 -9.942 -12.176 -1.446
561 HB3 GLN 77 2HB GLN 77 -11.505 -12.965 -1.608
562 HG2 GLN 77 1HG GLN 77 -10.937 -12.334 -3.775
563 HG3 GLN 77 2HG GLN 77 -12.089 -11.109 -3.246
564 HE21 GLN 77 1HE2 GLN 77 -10.864 -10.183 -5.222
565 HE22 GLN 77 2HE2 GLN 77 -9.524 -9.163 -4.840
566 HA PRO 78 HA PRO 78 -11.825 -12.108 3.427
567 HB2 PRO 78 1HB PRO 78 -13.392 -14.318 3.606
568 HB3 PRO 78 2HB PRO 78 -14.048 -12.677 3.555
569 HG2 PRO 78 1HG PRO 78 -13.796 -14.686 1.350
570 HG3 PRO 78 2HG PRO 78 -15.154 -13.612 1.736
571 HD2 PRO 78 1HD PRO 78 -13.384 -13.069 -0.240
572 HD3 PRO 78 2HD PRO 78 -14.172 -11.795 0.713
573 H GLU 79 H GLU 79 -10.640 -13.561 4.672
574 HA GLU 79 HA GLU 79 -8.726 -14.852 4.872
575 HB2 GLU 79 1HB GLU 79 -9.434 -17.319 4.242
576 HB3 GLU 79 2HB GLU 79 -10.133 -16.495 5.629
577 HG2 GLU 79 1HG GLU 79 -12.142 -16.059 4.495
578 HG3 GLU 79 2HG GLU 79 -11.437 -16.457 2.930
579 H THR 80 H THR 80 -8.473 -13.439 2.527
580 HA THR 80 HA THR 80 -7.424 -15.434 0.629
581 HB THR 80 HB THR 80 -8.268 -12.582 0.079
582 HG1 THR 80 1HG THR 80 -10.085 -13.848 0.271
583 HG21 THR 80 1HG2 THR 80 -6.332 -13.761 -1.269
584 HG22 THR 80 2HG2 THR 80 -7.569 -12.817 -2.098
585 HG23 THR 80 3HG2 THR 80 -7.681 -14.577 -2.058
586 H SER 81 H SER 81 -5.326 -15.700 1.130
587 HA SER 81 HA SER 81 -3.679 -13.551 2.078
588 HB2 SER 81 1HB SER 81 -3.505 -16.138 2.528
589 HB3 SER 81 2HB SER 81 -2.535 -16.124 1.055
590 HG SER 81 HG SER 81 -1.998 -15.023 3.558
591 H TYR 82 H TYR 82 -3.331 -11.958 0.632
592 HA TYR 82 HA TYR 82 -2.031 -12.718 -1.897
593 HB2 TYR 82 1HB TYR 82 -3.155 -10.727 -2.940
594 HB3 TYR 82 2HB TYR 82 -4.247 -12.038 -2.507
595 HD1 TYR 82 1HD TYR 82 -3.014 -8.713 -1.419
596 HD2 TYR 82 2HD TYR 82 -6.046 -11.673 -1.029
597 HE1 TYR 82 1HE TYR 82 -4.379 -7.135 -0.116
598 HE2 TYR 82 2HE TYR 82 -7.420 -10.103 0.274
599 HH TYR 82 HH TYR 82 -7.365 -7.196 0.303
600 H ASP 83 H ASP 83 -0.497 -11.226 -2.714
601 HA ASP 83 HA ASP 83 1.054 -9.947 -0.709
602 HB2 ASP 83 1HB ASP 83 1.241 -9.842 -3.726
603 HB3 ASP 83 2HB ASP 83 2.445 -9.168 -2.631
604 H ILE 84 H ILE 84 1.492 -7.750 -0.400
605 HA ILE 84 HA ILE 84 -0.248 -5.829 -1.763
606 HB ILE 84 HB ILE 84 0.000 -6.029 1.241
607 HG12 ILE 84 1HG1 ILE 84 -2.588 -6.114 -0.254
608 HG13 ILE 84 2HG1 ILE 84 -1.598 -7.568 -0.198
609 HG21 ILE 84 1HG2 ILE 84 -0.598 -3.804 -0.473
610 HG22 ILE 84 2HG2 ILE 84 -1.994 -4.196 0.530
611 HG23 ILE 84 3HG2 ILE 84 -0.437 -3.852 1.283
612 HD11 ILE 84 1HD1 ILE 84 -3.254 -6.347 1.858
613 HD12 ILE 84 2HD1 ILE 84 -2.681 -8.007 1.694
614 HD13 ILE 84 3HD1 ILE 84 -1.640 -6.783 2.420
615 H LYS 85 H LYS 85 0.741 -3.961 -2.241
616 HA LYS 85 HA LYS 85 3.093 -3.121 -0.738
617 HB2 LYS 85 1HB LYS 85 4.589 -3.112 -2.517
618 HB3 LYS 85 2HB LYS 85 3.718 -4.619 -2.763
619 HG2 LYS 85 1HG LYS 85 2.323 -3.559 -4.449
620 HG3 LYS 85 2HG LYS 85 3.153 -2.023 -4.183
621 HD2 LYS 85 1HD LYS 85 4.335 -2.777 -5.984
622 HD3 LYS 85 2HD LYS 85 5.286 -3.511 -4.691
623 HE2 LYS 85 1HE LYS 85 3.846 -5.562 -4.956
624 HE3 LYS 85 2HE LYS 85 3.180 -4.814 -6.406
625 HZ1 LYS 85 1HZ LYS 85 5.092 -6.405 -6.731
626 HZ2 LYS 85 2HZ LYS 85 6.087 -5.227 -6.036
627 HZ3 LYS 85 3HZ LYS 85 5.254 -4.891 -7.469
628 H MET 86 H MET 86 3.942 -0.976 -1.867
629 HA MET 86 HA MET 86 1.844 0.620 -3.047
630 HB2 MET 86 1HB MET 86 1.853 2.327 -1.274
631 HB3 MET 86 2HB MET 86 1.249 0.782 -0.691
632 HG2 MET 86 1HG MET 86 3.242 0.337 0.490
633 HG3 MET 86 2HG MET 86 4.095 1.652 -0.315
634 HE1 MET 86 1HE MET 86 2.823 3.883 -0.475
635 HE2 MET 86 2HE MET 86 1.324 4.133 0.419
636 HE3 MET 86 3HE MET 86 2.839 4.795 1.034
637 H GLN 87 H GLN 87 2.646 2.964 -3.293
638 HA GLN 87 HA GLN 87 5.510 3.305 -3.324
639 HB2 GLN 87 1HB GLN 87 5.433 2.151 -5.372
640 HB3 GLN 87 2HB GLN 87 3.931 2.928 -5.854
641 HG2 GLN 87 1HG GLN 87 5.236 5.092 -5.938
642 HG3 GLN 87 2HG GLN 87 6.689 4.107 -5.785
643 HE21 GLN 87 1HE2 GLN 87 4.096 5.090 -7.838
644 HE22 GLN 87 2HE2 GLN 87 4.685 4.363 -9.290
645 H CYS 88 H CYS 88 6.124 5.439 -3.419
646 HA CYS 88 HA CYS 88 3.946 7.370 -3.181
647 HB2 CYS 88 1HB CYS 88 5.378 8.700 -1.942
648 HB3 CYS 88 2HB CYS 88 5.985 7.095 -1.553
649 HG CYS 88 HG CYS 88 7.485 9.609 -3.162
650 H PHE 89 H PHE 89 4.167 9.494 -4.205
651 HA PHE 89 HA PHE 89 5.846 9.604 -6.580
652 HB2 PHE 89 1HB PHE 89 4.076 9.929 -8.129
653 HB3 PHE 89 2HB PHE 89 3.639 8.504 -7.193
654 HD1 PHE 89 1HD PHE 89 2.073 8.886 -5.176
655 HD2 PHE 89 2HD PHE 89 2.573 11.668 -8.357
656 HE1 PHE 89 1HE PHE 89 -0.084 9.922 -4.603
657 HE2 PHE 89 2HE PHE 89 0.417 12.710 -7.789
658 HZ PHE 89 HZ PHE 89 -0.914 11.838 -5.910
659 H ASN 90 H ASN 90 5.811 11.748 -7.609
660 HA ASN 90 HA ASN 90 4.683 13.928 -6.066
661 HB2 ASN 90 1HB ASN 90 6.650 14.917 -5.343
662 HB3 ASN 90 2HB ASN 90 7.028 13.209 -5.134
663 HD21 ASN 90 1HD2 ASN 90 8.875 15.364 -5.455
664 HD22 ASN 90 2HD2 ASN 90 9.779 15.051 -6.894
665 H GLU 91 H GLU 91 5.689 16.092 -7.098
666 HA GLU 91 HA GLU 91 4.642 16.355 -9.626
667 HB2 GLU 91 1HB GLU 91 5.070 18.338 -8.427
668 HB3 GLU 91 2HB GLU 91 6.761 17.926 -8.181
669 HG2 GLU 91 1HG GLU 91 7.241 18.310 -10.510
670 HG3 GLU 91 2HG GLU 91 5.535 18.598 -10.845
671 H GLY 92 H GLY 92 7.881 15.366 -8.694
672 HA2 GLY 92 1HA GLY 92 9.032 15.540 -11.291
673 HA3 GLY 92 2HA GLY 92 9.677 14.633 -9.930
674 H GLY 93 H GLY 93 8.256 12.606 -9.409
675 HA2 GLY 93 1HA GLY 93 6.843 11.337 -11.497
676 HA3 GLY 93 2HA GLY 93 8.524 10.826 -11.546
677 H GLU 94 H GLU 94 7.114 8.765 -11.182
678 HA GLU 94 HA GLU 94 6.302 8.322 -8.452
679 HB2 GLU 94 1HB GLU 94 6.366 6.656 -10.943
680 HB3 GLU 94 2HB GLU 94 6.139 5.883 -9.380
681 HG2 GLU 94 1HG GLU 94 4.113 7.003 -8.998
682 HG3 GLU 94 2HG GLU 94 4.415 8.160 -10.293
683 H SER 95 H SER 95 7.303 7.039 -6.928
684 HA SER 95 HA SER 95 10.173 6.793 -7.216
685 HB2 SER 95 1HB SER 95 10.264 6.635 -4.912
686 HB3 SER 95 2HB SER 95 8.758 7.532 -5.108
687 HG SER 95 HG SER 95 8.071 5.940 -3.874
688 H GLU 96 H GLU 96 10.957 4.660 -5.868
689 HA GLU 96 HA GLU 96 10.560 2.522 -7.674
690 HB2 GLU 96 1HB GLU 96 11.791 2.518 -4.913
691 HB3 GLU 96 2HB GLU 96 11.909 1.202 -6.072
692 HG2 GLU 96 1HG GLU 96 13.010 2.822 -7.642
693 HG3 GLU 96 2HG GLU 96 13.074 3.961 -6.299
694 H PHE 97 H PHE 97 9.944 0.279 -6.907
695 HA PHE 97 HA PHE 97 7.286 0.423 -5.785
696 HB2 PHE 97 1HB PHE 97 8.920 -1.710 -7.110
697 HB3 PHE 97 2HB PHE 97 7.489 -2.160 -6.190
698 HD1 PHE 97 1HD PHE 97 7.987 0.864 -8.273
699 HD2 PHE 97 2HD PHE 97 6.029 -2.891 -7.855
700 HE1 PHE 97 1HE PHE 97 6.576 1.387 -10.220
701 HE2 PHE 97 2HE PHE 97 4.616 -2.375 -9.802
702 HZ PHE 97 HZ PHE 97 4.889 -0.234 -10.988
703 H SER 98 H SER 98 6.903 0.304 -3.684
704 HA SER 98 HA SER 98 8.771 -0.214 -1.708
705 HB2 SER 98 1HB SER 98 6.548 0.899 -1.380
706 HB3 SER 98 2HB SER 98 5.793 -0.693 -1.462
707 HG SER 98 HG SER 98 6.137 -0.273 0.676
708 H ASN 99 H ASN 99 8.394 -2.016 0.013
709 HA ASN 99 HA ASN 99 9.107 -4.473 -1.190
710 HB2 ASN 99 1HB ASN 99 8.717 -5.329 1.237
711 HB3 ASN 99 2HB ASN 99 10.014 -4.176 0.937
712 HD21 ASN 99 1HD2 ASN 99 7.619 -4.909 2.993
713 HD22 ASN 99 2HD2 ASN 99 7.273 -3.344 3.637
714 H VAL 100 H VAL 100 7.946 -6.565 -0.359
715 HA VAL 100 HA VAL 100 5.098 -6.276 -1.049
716 HB VAL 100 HB VAL 100 6.829 -8.738 -1.305
717 HG11 VAL 100 1HG1 VAL 100 3.952 -8.165 -1.787
718 HG12 VAL 100 2HG1 VAL 100 4.780 -9.273 -2.883
719 HG13 VAL 100 3HG1 VAL 100 4.725 -9.617 -1.153
720 HG21 VAL 100 1HG2 VAL 100 6.286 -6.482 -3.127
721 HG22 VAL 100 2HG2 VAL 100 7.674 -7.568 -3.046
722 HG23 VAL 100 3HG2 VAL 100 6.187 -8.094 -3.836
723 H MET 101 H MET 101 3.852 -6.322 0.704
724 HA MET 101 HA MET 101 4.608 -8.068 2.942
725 HB2 MET 101 1HB MET 101 2.610 -5.799 2.881
726 HB3 MET 101 2HB MET 101 3.092 -6.715 4.303
727 HG2 MET 101 1HG MET 101 5.020 -5.107 2.655
728 HG3 MET 101 2HG MET 101 4.144 -4.451 4.036
729 HE1 MET 101 1HE MET 101 4.139 -5.837 6.390
730 HE2 MET 101 2HE MET 101 5.755 -5.945 7.087
731 HE3 MET 101 3HE MET 101 5.200 -4.427 6.379
732 H ILE 102 H ILE 102 3.414 -9.796 3.466
733 HA ILE 102 HA ILE 102 1.021 -10.333 1.864
734 HB ILE 102 HB ILE 102 2.687 -12.192 3.565
735 HG12 ILE 102 1HG1 ILE 102 2.371 -12.121 0.560
736 HG13 ILE 102 2HG1 ILE 102 3.697 -11.339 1.413
737 HG21 ILE 102 1HG2 ILE 102 0.869 -13.409 1.653
738 HG22 ILE 102 2HG2 ILE 102 1.131 -13.775 3.358
739 HG23 ILE 102 3HG2 ILE 102 0.028 -12.480 2.895
740 HD11 ILE 102 1HD1 ILE 102 4.577 -13.372 0.714
741 HD12 ILE 102 2HD1 ILE 102 4.163 -13.649 2.406
742 HD13 ILE 102 3HD1 ILE 102 3.109 -14.257 1.129
743 H CYS 103 H CYS 103 -0.638 -9.308 2.889
744 HA CYS 103 HA CYS 103 -1.069 -9.932 5.731
745 HB2 CYS 103 1HB CYS 103 -0.962 -7.487 4.731
746 HB3 CYS 103 2HB CYS 103 -2.637 -7.823 4.308
747 HG CYS 103 HG CYS 103 -3.640 -7.860 6.762
748 H GLU 104 H GLU 104 -2.359 -11.635 5.976
749 HA GLU 104 HA GLU 104 -4.308 -12.375 3.997
750 HB2 GLU 104 1HB GLU 104 -2.895 -13.875 5.639
751 HB3 GLU 104 2HB GLU 104 -4.245 -13.589 6.728
752 HG2 GLU 104 1HG GLU 104 -5.665 -14.340 4.656
753 HG3 GLU 104 2HG GLU 104 -4.155 -15.111 4.176
754 H THR 105 H THR 105 -6.395 -11.852 3.933
755 HA THR 105 HA THR 105 -7.481 -9.946 5.735
756 HB THR 105 HB THR 105 -9.678 -10.577 4.498
757 HG1 THR 105 1HG THR 105 -8.701 -11.468 2.307
758 HG21 THR 105 1HG2 THR 105 -9.128 -9.123 2.707
759 HG22 THR 105 2HG2 THR 105 -7.420 -9.552 2.788
760 HG23 THR 105 3HG2 THR 105 -8.152 -8.597 4.077
761 H LYS 106 H LYS 106 -9.807 -10.378 6.614
762 HA LYS 106 HA LYS 106 -9.552 -12.514 8.533
763 HB2 LYS 106 1HB LYS 106 -11.851 -10.594 8.125
764 HB3 LYS 106 2HB LYS 106 -11.555 -11.589 9.545
765 HG2 LYS 106 1HG LYS 106 -9.421 -9.704 8.723
766 HG3 LYS 106 2HG LYS 106 -10.885 -9.031 9.442
767 HD2 LYS 106 1HD LYS 106 -10.598 -10.365 11.418
768 HD3 LYS 106 2HD LYS 106 -9.252 -11.241 10.685
769 HE2 LYS 106 1HE LYS 106 -8.238 -9.677 12.104
770 HE3 LYS 106 2HE LYS 106 -8.104 -8.970 10.495
771 HZ1 LYS 106 1HZ LYS 106 -10.040 -8.242 12.620
772 HZ2 LYS 106 2HZ LYS 106 -10.150 -7.682 11.028
773 HZ3 LYS 106 3HZ LYS 106 -8.809 -7.276 11.977
774 H ALA 107 H ALA 107 -11.201 -14.116 8.925
775 HA ALA 107 HA ALA 107 -12.092 -15.358 6.496
776 HB1 ALA 107 1HB ALA 107 -13.162 -16.967 8.261
777 HB2 ALA 107 2HB ALA 107 -11.415 -16.940 8.018
778 HB3 ALA 107 3HB ALA 107 -12.128 -16.087 9.387
779 H ARG 108 H ARG 108 -13.998 -15.132 5.532
780 HA ARG 108 HA ARG 108 -15.943 -13.309 6.387
781 HB2 ARG 108 1HB ARG 108 -17.395 -14.545 4.645
782 HB3 ARG 108 2HB ARG 108 -15.936 -13.733 4.093
783 HG2 ARG 108 1HG ARG 108 -14.810 -15.718 3.728
784 HG3 ARG 108 2HG ARG 108 -15.858 -16.629 4.817
785 HD2 ARG 108 1HD ARG 108 -17.699 -15.928 3.059
786 HD3 ARG 108 2HD ARG 108 -16.300 -15.802 1.993
787 HE ARG 108 HE ARG 108 -16.223 -18.262 3.358
788 HH11 ARG 108 1HH1 ARG 108 -18.001 -16.612 0.861
789 HH12 ARG 108 2HH1 ARG 108 -18.440 -18.068 0.030
790 HH21 ARG 108 1HH2 ARG 108 -16.793 -20.186 2.273
791 HH22 ARG 108 2HH2 ARG 108 -17.753 -20.100 0.834
792 H SER 109 H SER 109 -16.549 -13.782 8.508
793 HA SER 109 HA SER 109 -18.105 -16.257 8.870
794 HB2 SER 109 1HB SER 109 -16.374 -14.664 10.704
795 HB3 SER 109 2HB SER 109 -17.772 -15.486 11.396
796 HG SER 109 HG SER 109 -16.132 -16.941 9.672
797 H GLY 110 H GLY 110 -20.152 -16.165 9.790
798 HA2 GLY 110 1HA GLY 110 -21.275 -13.491 10.277
799 HA3 GLY 110 2HA GLY 110 -22.063 -14.553 9.120
800 HA PRO 111 HA PRO 111 -23.867 -15.209 13.383
801 HB2 PRO 111 1HB PRO 111 -26.443 -14.751 12.659
802 HB3 PRO 111 2HB PRO 111 -25.349 -13.465 13.182
803 HG2 PRO 111 1HG PRO 111 -26.130 -14.277 10.408
804 HG3 PRO 111 2HG PRO 111 -25.965 -12.649 11.093
805 HD2 PRO 111 1HD PRO 111 -24.051 -13.780 9.546
806 HD3 PRO 111 2HD PRO 111 -23.671 -12.647 10.860
807 H SER 112 H SER 112 -23.807 -16.654 10.411
808 HA SER 112 HA SER 112 -25.766 -18.424 10.059
809 HB2 SER 112 1HB SER 112 -22.793 -18.859 9.965
810 HB3 SER 112 2HB SER 112 -23.903 -20.177 9.589
811 HG SER 112 HG SER 112 -23.092 -18.335 7.953
812 H SER 113 H SER 113 -23.296 -18.726 12.582
813 HA SER 113 HA SER 113 -24.577 -21.095 13.667
814 HB2 SER 113 1HB SER 113 -22.728 -21.006 15.342
815 HB3 SER 113 2HB SER 113 -22.154 -21.050 13.675
816 HG SER 113 HG SER 113 -21.649 -18.910 13.790
817 H GLY 114 H GLY 114 -26.228 -20.964 15.026
818 HA2 GLY 114 1HA GLY 114 -26.516 -19.935 17.424
819 HA3 GLY 114 2HA GLY 114 -26.689 -18.463 16.479
Start of MODEL 10
1 H1 GLY 1 H GLY 1 22.714 18.924 -9.834
2 HA2 GLY 1 1HA GLY 1 25.007 17.404 -10.859
3 HA3 GLY 1 2HA GLY 1 25.084 18.961 -10.048
4 H SER 2 H SER 2 25.585 19.003 -7.946
5 HA SER 2 HA SER 2 26.388 16.632 -6.628
6 HB2 SER 2 1HB SER 2 27.448 18.787 -6.157
7 HB3 SER 2 2HB SER 2 25.930 19.409 -5.509
8 HG SER 2 HG SER 2 27.757 17.641 -4.388
9 H SER 3 H SER 3 25.043 15.146 -5.870
10 HA SER 3 HA SER 3 23.138 14.161 -5.060
11 HB2 SER 3 1HB SER 3 24.373 15.136 -3.037
12 HB3 SER 3 2HB SER 3 23.157 16.413 -3.052
13 HG SER 3 HG SER 3 22.904 13.712 -2.411
14 H GLY 4 H GLY 4 22.478 15.715 -7.210
15 HA2 GLY 4 1HA GLY 4 20.001 17.079 -6.354
16 HA3 GLY 4 2HA GLY 4 20.898 17.482 -7.811
17 H SER 5 H SER 5 19.014 14.905 -6.275
18 HA SER 5 HA SER 5 18.468 13.759 -8.917
19 HB2 SER 5 1HB SER 5 19.235 12.236 -7.107
20 HB3 SER 5 2HB SER 5 17.793 12.650 -6.181
21 HG SER 5 HG SER 5 17.650 11.610 -8.807
22 H SER 6 H SER 6 16.493 13.790 -9.840
23 HA SER 6 HA SER 6 14.495 15.521 -8.655
24 HB2 SER 6 1HB SER 6 14.635 14.117 -11.331
25 HB3 SER 6 2HB SER 6 13.305 15.166 -10.839
26 HG SER 6 HG SER 6 14.604 16.892 -10.933
27 H GLY 7 H GLY 7 12.587 14.918 -7.792
28 HA2 GLY 7 1HA GLY 7 10.897 13.569 -7.012
29 HA3 GLY 7 2HA GLY 7 11.291 12.453 -8.311
30 HA PRO 8 HA PRO 8 12.735 11.003 -3.967
31 HB2 PRO 8 1HB PRO 8 10.595 9.510 -3.217
32 HB3 PRO 8 2HB PRO 8 10.774 11.216 -2.789
33 HG2 PRO 8 1HG PRO 8 9.166 9.973 -4.987
34 HG3 PRO 8 2HG PRO 8 8.721 11.285 -3.880
35 HD2 PRO 8 1HD PRO 8 9.537 11.738 -6.422
36 HD3 PRO 8 2HD PRO 8 9.870 12.870 -5.096
37 H VAL 9 H VAL 9 13.672 9.007 -3.712
38 HA VAL 9 HA VAL 9 12.983 6.943 -5.699
39 HB VAL 9 HB VAL 9 15.376 6.313 -5.776
40 HG11 VAL 9 1HG1 VAL 9 14.111 8.213 -7.201
41 HG12 VAL 9 2HG1 VAL 9 15.453 9.156 -6.552
42 HG13 VAL 9 3HG1 VAL 9 15.772 7.707 -7.506
43 HG21 VAL 9 1HG2 VAL 9 15.568 8.561 -3.847
44 HG22 VAL 9 2HG2 VAL 9 16.458 7.040 -3.904
45 HG23 VAL 9 3HG2 VAL 9 16.884 8.353 -5.002
46 H ALA 10 H ALA 10 14.320 7.655 -2.511
47 HA ALA 10 HA ALA 10 14.839 5.138 -1.545
48 HB1 ALA 10 1HB ALA 10 13.598 7.438 -0.039
49 HB2 ALA 10 2HB ALA 10 14.379 6.035 0.691
50 HB3 ALA 10 3HB ALA 10 15.323 7.160 -0.286
51 H GLY 11 H GLY 11 11.725 6.697 -1.998
52 HA2 GLY 11 1HA GLY 11 9.581 5.891 -1.866
53 HA3 GLY 11 2HA GLY 11 10.287 4.306 -2.148
54 HA PRO 12 HA PRO 12 8.709 4.995 2.340
55 HB2 PRO 12 1HB PRO 12 6.166 4.069 2.121
56 HB3 PRO 12 2HB PRO 12 6.587 5.775 1.927
57 HG2 PRO 12 1HG PRO 12 6.090 3.697 -0.170
58 HG3 PRO 12 2HG PRO 12 5.541 5.382 -0.112
59 HD2 PRO 12 1HD PRO 12 7.659 4.590 -1.601
60 HD3 PRO 12 2HD PRO 12 7.564 6.199 -0.855
61 H TYR 13 H TYR 13 8.170 3.259 3.825
62 HA TYR 13 HA TYR 13 8.394 0.563 2.676
63 HB2 TYR 13 1HB TYR 13 10.585 0.818 3.395
64 HB3 TYR 13 2HB TYR 13 10.130 1.841 4.754
65 HD1 TYR 13 1HD TYR 13 9.355 -1.638 3.602
66 HD2 TYR 13 2HD TYR 13 10.510 0.900 6.816
67 HE1 TYR 13 1HE TYR 13 9.459 -3.588 5.097
68 HE2 TYR 13 2HE TYR 13 10.618 -1.043 8.319
69 HH TYR 13 HH TYR 13 9.255 -3.640 8.070
70 H ILE 14 H ILE 14 6.700 -0.595 3.277
71 HA ILE 14 HA ILE 14 4.925 0.196 5.341
72 HB ILE 14 HB ILE 14 5.096 -2.501 3.993
73 HG12 ILE 14 1HG1 ILE 14 3.173 -0.350 3.194
74 HG13 ILE 14 2HG1 ILE 14 4.823 -0.294 2.583
75 HG21 ILE 14 1HG2 ILE 14 2.480 -2.083 4.535
76 HG22 ILE 14 2HG2 ILE 14 3.581 -2.969 5.588
77 HG23 ILE 14 3HG2 ILE 14 3.234 -1.270 5.906
78 HD11 ILE 14 1HD1 ILE 14 4.555 -2.170 1.302
79 HD12 ILE 14 2HD1 ILE 14 3.273 -2.819 2.325
80 HD13 ILE 14 3HD1 ILE 14 2.934 -1.478 1.231
81 H THR 15 H THR 15 5.061 -0.136 7.452
82 HA THR 15 HA THR 15 6.734 -2.362 8.423
83 HB THR 15 HB THR 15 7.483 -1.077 10.257
84 HG1 THR 15 1HG THR 15 5.952 0.170 11.059
85 HG21 THR 15 1HG2 THR 15 7.734 1.266 8.637
86 HG22 THR 15 2HG2 THR 15 7.881 -0.163 7.613
87 HG23 THR 15 3HG2 THR 15 8.946 0.040 9.004
88 H PHE 16 H PHE 16 3.675 -1.656 7.984
89 HA PHE 16 HA PHE 16 2.810 -3.178 10.302
90 HB2 PHE 16 1HB PHE 16 2.696 -0.640 10.799
91 HB3 PHE 16 2HB PHE 16 1.337 -0.631 9.679
92 HD1 PHE 16 2HD PHE 16 -0.727 -1.824 10.222
93 HD2 PHE 16 1HD PHE 16 2.511 -1.609 12.975
94 HE1 PHE 16 2HE PHE 16 -2.229 -2.528 12.039
95 HE2 PHE 16 1HE PHE 16 1.015 -2.314 14.796
96 HZ PHE 16 HZ PHE 16 -1.359 -2.774 14.329
97 H THR 17 H THR 17 1.455 -4.698 9.638
98 HA THR 17 HA THR 17 -0.440 -4.126 7.489
99 HB THR 17 HB THR 17 0.188 -6.562 6.652
100 HG1 THR 17 1HG THR 17 2.205 -7.159 7.093
101 HG21 THR 17 1HG2 THR 17 0.687 -5.401 4.817
102 HG22 THR 17 2HG2 THR 17 2.202 -4.853 5.534
103 HG23 THR 17 3HG2 THR 17 0.720 -3.933 5.793
104 H ASP 18 H ASP 18 -2.329 -4.531 8.437
105 HA ASP 18 HA ASP 18 -2.772 -7.159 9.615
106 HB2 ASP 18 1HB ASP 18 -3.123 -4.556 11.086
107 HB3 ASP 18 2HB ASP 18 -4.055 -5.987 11.520
108 H ALA 19 H ALA 19 -4.753 -7.958 9.177
109 HA ALA 19 HA ALA 19 -6.436 -6.496 7.368
110 HB1 ALA 19 1HB ALA 19 -7.797 -8.537 7.331
111 HB2 ALA 19 2HB ALA 19 -6.089 -8.879 7.057
112 HB3 ALA 19 3HB ALA 19 -6.812 -9.209 8.631
113 H VAL 20 H VAL 20 -7.873 -5.043 8.018
114 HA VAL 20 HA VAL 20 -8.790 -4.869 10.716
115 HB VAL 20 HB VAL 20 -9.933 -3.433 8.320
116 HG11 VAL 20 1HG1 VAL 20 -10.380 -1.679 10.080
117 HG12 VAL 20 2HG1 VAL 20 -11.340 -3.154 10.205
118 HG13 VAL 20 3HG1 VAL 20 -9.966 -2.902 11.282
119 HG21 VAL 20 1HG2 VAL 20 -7.382 -3.290 8.679
120 HG22 VAL 20 2HG2 VAL 20 -8.291 -1.792 8.483
121 HG23 VAL 20 3HG2 VAL 20 -7.790 -2.315 10.091
122 H ASN 21 H ASN 21 -9.937 -6.426 7.857
123 HA ASN 21 HA ASN 21 -12.001 -7.771 9.286
124 HB2 ASN 21 1HB ASN 21 -12.703 -5.443 7.567
125 HB3 ASN 21 2HB ASN 21 -13.738 -6.865 7.470
126 HD21 ASN 21 1HD2 ASN 21 -14.726 -4.487 8.361
127 HD22 ASN 21 2HD2 ASN 21 -15.072 -4.592 10.050
128 H GLU 22 H GLU 22 -13.472 -8.970 7.550
129 HA GLU 22 HA GLU 22 -11.732 -10.638 6.084
130 HB2 GLU 22 1HB GLU 22 -13.714 -11.766 5.310
131 HB3 GLU 22 2HB GLU 22 -13.935 -11.342 7.002
132 HG2 GLU 22 1HG GLU 22 -14.937 -9.464 4.930
133 HG3 GLU 22 2HG GLU 22 -15.830 -10.955 5.226
134 H THR 23 H THR 23 -13.125 -7.630 5.345
135 HA THR 23 HA THR 23 -12.272 -7.913 2.546
136 HB THR 23 HB THR 23 -14.188 -6.329 1.955
137 HG1 THR 23 1HG THR 23 -16.018 -6.738 3.502
138 HG21 THR 23 1HG2 THR 23 -15.213 -8.139 1.132
139 HG22 THR 23 2HG2 THR 23 -15.590 -8.748 2.744
140 HG23 THR 23 3HG2 THR 23 -14.022 -9.095 2.014
141 H THR 24 H THR 24 -11.307 -6.618 5.171
142 HA THR 24 HA THR 24 -10.576 -4.063 3.931
143 HB THR 24 HB THR 24 -11.242 -4.178 6.863
144 HG1 THR 24 1HG THR 24 -13.308 -3.909 6.426
145 HG21 THR 24 1HG2 THR 24 -11.099 -1.910 4.872
146 HG22 THR 24 2HG2 THR 24 -9.870 -2.309 6.072
147 HG23 THR 24 3HG2 THR 24 -11.462 -1.755 6.590
148 H ILE 25 H ILE 25 -8.538 -3.302 4.454
149 HA ILE 25 HA ILE 25 -6.937 -4.848 6.356
150 HB ILE 25 HB ILE 25 -6.288 -4.475 3.443
151 HG12 ILE 25 1HG1 ILE 25 -6.177 -6.883 5.272
152 HG13 ILE 25 2HG1 ILE 25 -7.481 -6.526 4.144
153 HG21 ILE 25 1HG2 ILE 25 -4.206 -3.939 4.080
154 HG22 ILE 25 2HG2 ILE 25 -4.465 -4.489 5.735
155 HG23 ILE 25 3HG2 ILE 25 -4.062 -5.652 4.472
156 HD11 ILE 25 1HD1 ILE 25 -4.657 -7.323 3.545
157 HD12 ILE 25 2HD1 ILE 25 -6.158 -8.116 3.065
158 HD13 ILE 25 3HD1 ILE 25 -5.698 -6.580 2.330
159 H MET 26 H MET 26 -5.582 -3.623 7.526
160 HA MET 26 HA MET 26 -5.317 -0.795 6.763
161 HB2 MET 26 1HB MET 26 -6.407 -0.996 8.874
162 HB3 MET 26 2HB MET 26 -5.226 -2.166 9.448
163 HG2 MET 26 1HG MET 26 -4.443 -0.340 10.519
164 HG3 MET 26 2HG MET 26 -3.571 -0.146 9.000
165 HE1 MET 26 1HE MET 26 -4.228 1.182 7.131
166 HE2 MET 26 2HE MET 26 -5.109 2.707 7.214
167 HE3 MET 26 3HE MET 26 -3.557 2.539 8.036
168 H LEU 27 H LEU 27 -3.404 -0.144 6.051
169 HA LEU 27 HA LEU 27 -0.985 -1.485 7.047
170 HB2 LEU 27 1HB LEU 27 -0.098 -1.810 4.960
171 HB3 LEU 27 2HB LEU 27 -1.807 -2.112 4.656
172 HG LEU 27 HG LEU 27 -0.608 0.590 4.154
173 HD11 LEU 27 1HD1 LEU 27 -0.681 -0.511 1.690
174 HD12 LEU 27 2HD1 LEU 27 -0.163 -1.897 2.650
175 HD13 LEU 27 3HD1 LEU 27 0.772 -0.402 2.683
176 HD21 LEU 27 1HD2 LEU 27 -2.853 -0.815 2.733
177 HD22 LEU 27 2HD2 LEU 27 -2.468 0.906 2.748
178 HD23 LEU 27 3HD2 LEU 27 -3.107 0.132 4.199
179 H LYS 28 H LYS 28 0.652 -0.161 7.602
180 HA LYS 28 HA LYS 28 0.379 2.696 6.931
181 HB2 LYS 28 1HB LYS 28 1.336 1.436 9.506
182 HB3 LYS 28 2HB LYS 28 1.495 3.148 9.133
183 HG2 LYS 28 1HG LYS 28 -0.723 3.563 9.421
184 HG3 LYS 28 2HG LYS 28 -1.205 1.937 8.930
185 HD2 LYS 28 1HD LYS 28 0.048 1.261 11.147
186 HD3 LYS 28 2HD LYS 28 -0.297 2.935 11.588
187 HE2 LYS 28 1HE LYS 28 -2.506 1.297 10.460
188 HE3 LYS 28 2HE LYS 28 -1.990 0.965 12.112
189 HZ1 LYS 28 1HZ LYS 28 -3.765 2.867 11.387
190 HZ2 LYS 28 2HZ LYS 28 -2.341 3.764 11.552
191 HZ3 LYS 28 3HZ LYS 28 -2.914 2.841 12.849
192 H TRP 29 H TRP 29 2.174 3.769 6.248
193 HA TRP 29 HA TRP 29 4.619 2.155 5.936
194 HB2 TRP 29 1HB TRP 29 5.109 3.720 4.008
195 HB3 TRP 29 2HB TRP 29 3.738 2.639 3.776
196 HD1 TRP 29 HD TRP 29 4.604 6.328 4.218
197 HE1 TRP 29 1HE TRP 29 2.538 7.742 3.622
198 HE3 TRP 29 3HE TRP 29 1.166 2.576 3.730
199 HZ2 TRP 29 2HZ TRP 29 -0.189 7.323 3.024
200 HZ3 TRP 29 3HZ TRP 29 -1.150 3.167 3.144
201 HH2 TRP 29 HH TRP 29 -1.811 5.492 2.800
202 H MET 30 H MET 30 6.656 3.452 5.833
203 HA MET 30 HA MET 30 6.527 5.758 7.662
204 HB2 MET 30 1HB MET 30 8.425 5.028 8.825
205 HB3 MET 30 2HB MET 30 7.483 3.561 8.593
206 HG2 MET 30 1HG MET 30 8.900 2.857 6.800
207 HG3 MET 30 2HG MET 30 9.760 4.395 6.816
208 HE1 MET 30 1HE MET 30 11.060 4.743 10.102
209 HE2 MET 30 2HE MET 30 12.380 4.290 9.023
210 HE3 MET 30 3HE MET 30 11.049 5.280 8.421
211 H TYR 31 H TYR 31 8.485 7.178 7.516
212 HA TYR 31 HA TYR 31 9.625 7.220 4.807
213 HB2 TYR 31 1HB TYR 31 7.680 8.828 5.078
214 HB3 TYR 31 2HB TYR 31 8.677 9.708 6.231
215 HD1 TYR 31 1HD TYR 31 8.309 8.747 2.695
216 HD2 TYR 31 2HD TYR 31 10.495 11.089 5.495
217 HE1 TYR 31 1HE TYR 31 9.340 9.991 0.841
218 HE2 TYR 31 2HE TYR 31 11.532 12.340 3.648
219 HH TYR 31 HH TYR 31 10.632 12.783 0.992
220 H ILE 32 H ILE 32 11.754 7.608 4.730
221 HA ILE 32 HA ILE 32 13.080 8.418 7.234
222 HB ILE 32 HB ILE 32 14.246 6.800 4.966
223 HG12 ILE 32 1HG1 ILE 32 14.270 5.069 6.964
224 HG13 ILE 32 2HG1 ILE 32 12.929 6.051 7.544
225 HG21 ILE 32 1HG2 ILE 32 15.789 6.436 7.226
226 HG22 ILE 32 2HG2 ILE 32 16.189 7.450 5.841
227 HG23 ILE 32 3HG2 ILE 32 15.406 8.157 7.254
228 HD11 ILE 32 1HD1 ILE 32 11.762 4.536 6.342
229 HD12 ILE 32 2HD1 ILE 32 12.103 5.684 5.047
230 HD13 ILE 32 3HD1 ILE 32 13.090 4.233 5.221
231 HA PRO 33 HA PRO 33 13.920 12.019 4.604
232 HB2 PRO 33 1HB PRO 33 14.501 13.660 6.687
233 HB3 PRO 33 2HB PRO 33 12.847 13.311 6.172
234 HG2 PRO 33 1HG PRO 33 14.421 12.121 8.423
235 HG3 PRO 33 2HG PRO 33 12.727 12.646 8.397
236 HD2 PRO 33 1HD PRO 33 13.450 10.047 8.166
237 HD3 PRO 33 2HD PRO 33 12.012 10.713 7.366
238 H ALA 34 H ALA 34 15.843 10.217 6.795
239 HA ALA 34 HA ALA 34 18.230 11.627 6.874
240 HB1 ALA 34 1HB ALA 34 19.307 9.367 7.122
241 HB2 ALA 34 2HB ALA 34 17.985 9.703 8.242
242 HB3 ALA 34 3HB ALA 34 17.714 8.661 6.844
243 H SER 35 H SER 35 17.537 8.917 4.653
244 HA SER 35 HA SER 35 19.591 9.929 2.840
245 HB2 SER 35 1HB SER 35 18.170 7.309 3.159
246 HB3 SER 35 2HB SER 35 18.928 7.702 1.615
247 HG SER 35 HG SER 35 20.379 8.023 3.998
248 H ASN 36 H ASN 36 17.219 11.459 3.048
249 HA ASN 36 HA ASN 36 15.952 10.969 0.434
250 HB2 ASN 36 1HB ASN 36 14.367 10.878 2.299
251 HB3 ASN 36 2HB ASN 36 14.874 12.480 2.825
252 HD21 ASN 36 1HD2 ASN 36 14.041 11.076 -0.325
253 HD22 ASN 36 2HD2 ASN 36 12.845 12.256 -0.725
254 H ASN 37 H ASN 37 15.379 12.872 -0.828
255 HA ASN 37 HA ASN 37 17.474 14.896 -0.653
256 HB2 ASN 37 1HB ASN 37 16.690 13.542 -2.791
257 HB3 ASN 37 2HB ASN 37 15.494 14.831 -2.888
258 HD21 ASN 37 1HD2 ASN 37 18.291 13.919 -4.125
259 HD22 ASN 37 2HD2 ASN 37 19.041 15.448 -4.417
260 H ASN 38 H ASN 38 15.278 14.943 1.231
261 HA ASN 38 HA ASN 38 13.543 16.270 1.980
262 HB2 ASN 38 1HB ASN 38 15.533 18.360 1.064
263 HB3 ASN 38 2HB ASN 38 14.273 18.590 2.274
264 HD21 ASN 38 1HD2 ASN 38 15.544 19.022 3.995
265 HD22 ASN 38 2HD2 ASN 38 16.658 17.894 4.684
266 H THR 39 H THR 39 12.883 15.429 -0.551
267 HA THR 39 HA THR 39 11.928 17.821 -1.956
268 HB THR 39 HB THR 39 13.154 16.055 -3.251
269 HG1 THR 39 1HG THR 39 11.894 16.458 -4.966
270 HG21 THR 39 1HG2 THR 39 10.630 14.439 -2.924
271 HG22 THR 39 2HG2 THR 39 12.098 14.140 -1.993
272 HG23 THR 39 3HG2 THR 39 12.116 13.970 -3.748
273 HA PRO 40 HA PRO 40 7.831 17.242 -0.432
274 HB2 PRO 40 1HB PRO 40 6.491 18.641 -2.335
275 HB3 PRO 40 2HB PRO 40 7.454 19.417 -1.071
276 HG2 PRO 40 1HG PRO 40 8.175 18.843 -3.919
277 HG3 PRO 40 2HG PRO 40 8.474 20.306 -2.962
278 HD2 PRO 40 1HD PRO 40 10.385 18.439 -3.406
279 HD3 PRO 40 2HD PRO 40 10.312 19.394 -1.911
280 H ILE 41 H ILE 41 6.347 15.677 -0.639
281 HA ILE 41 HA ILE 41 6.264 14.181 -3.162
282 HB ILE 41 HB ILE 41 5.110 13.296 -0.523
283 HG12 ILE 41 1HG1 ILE 41 7.866 12.739 -1.645
284 HG13 ILE 41 2HG1 ILE 41 7.511 13.737 -0.239
285 HG21 ILE 41 1HG2 ILE 41 5.076 11.124 -1.473
286 HG22 ILE 41 2HG2 ILE 41 4.381 12.210 -2.675
287 HG23 ILE 41 3HG2 ILE 41 6.039 11.640 -2.857
288 HD11 ILE 41 1HD1 ILE 41 8.040 10.991 -0.311
289 HD12 ILE 41 2HD1 ILE 41 7.545 11.963 1.075
290 HD13 ILE 41 3HD1 ILE 41 6.329 11.153 0.087
291 H HIS 42 H HIS 42 4.416 13.914 -4.313
292 HA HIS 42 HA HIS 42 2.310 15.776 -3.955
293 HB2 HIS 42 1HB HIS 42 2.870 13.526 -5.831
294 HB3 HIS 42 2HB HIS 42 1.219 14.132 -5.735
295 HD1 HIS 42 1HD HIS 42 1.557 14.932 -8.234
296 HD2 HIS 42 2HD HIS 42 3.929 16.849 -5.413
297 HE1 HIS 42 1HE HIS 42 2.438 16.989 -9.382
298 HE2 HIS 42 2HE HIS 42 3.938 18.088 -7.683
299 H GLY 43 H GLY 43 2.553 12.276 -3.413
300 HA2 GLY 43 1HA GLY 43 0.678 12.340 -1.279
301 HA3 GLY 43 2HA GLY 43 -0.083 11.733 -2.742
302 H PHE 44 H PHE 44 -0.391 9.651 -2.040
303 HA PHE 44 HA PHE 44 2.006 7.995 -1.990
304 HB2 PHE 44 1HB PHE 44 0.027 8.202 0.264
305 HB3 PHE 44 2HB PHE 44 0.943 6.722 -0.003
306 HD1 PHE 44 2HD PHE 44 3.580 7.432 -0.587
307 HD2 PHE 44 1HD PHE 44 0.856 9.437 1.997
308 HE1 PHE 44 2HE PHE 44 5.473 8.377 0.669
309 HE2 PHE 44 1HE PHE 44 2.744 10.387 3.256
310 HZ PHE 44 HZ PHE 44 5.056 9.856 2.594
311 H TYR 45 H TYR 45 1.703 6.429 -3.415
312 HA TYR 45 HA TYR 45 -1.020 5.648 -4.136
313 HB2 TYR 45 1HB TYR 45 1.649 5.453 -5.466
314 HB3 TYR 45 2HB TYR 45 0.393 4.308 -5.923
315 HD1 TYR 45 2HD TYR 45 -2.031 5.913 -5.871
316 HD2 TYR 45 1HD TYR 45 1.868 6.953 -7.220
317 HE1 TYR 45 2HE TYR 45 -3.008 7.584 -7.388
318 HE2 TYR 45 1HE TYR 45 0.902 8.628 -8.740
319 HH TYR 45 HH TYR 45 -2.608 9.166 -8.889
320 H ILE 46 H ILE 46 -1.843 3.642 -3.831
321 HA ILE 46 HA ILE 46 -0.086 1.610 -2.628
322 HB ILE 46 HB ILE 46 -2.921 2.191 -1.764
323 HG12 ILE 46 1HG1 ILE 46 -0.532 2.479 0.015
324 HG13 ILE 46 2HG1 ILE 46 -0.917 3.776 -1.111
325 HG21 ILE 46 1HG2 ILE 46 -2.344 -0.170 -1.614
326 HG22 ILE 46 2HG2 ILE 46 -0.891 0.232 -0.699
327 HG23 ILE 46 3HG2 ILE 46 -2.483 0.542 -0.006
328 HD11 ILE 46 1HD1 ILE 46 -3.143 3.963 -0.121
329 HD12 ILE 46 2HD1 ILE 46 -2.737 2.679 1.018
330 HD13 ILE 46 3HD1 ILE 46 -1.866 4.212 1.070
331 H TYR 47 H TYR 47 -0.105 -0.242 -3.706
332 HA TYR 47 HA TYR 47 -2.343 -0.780 -5.534
333 HB2 TYR 47 1HB TYR 47 0.479 -1.869 -5.554
334 HB3 TYR 47 2HB TYR 47 -0.775 -2.277 -6.720
335 HD1 TYR 47 2HD TYR 47 0.742 0.826 -5.274
336 HD2 TYR 47 1HD TYR 47 -0.630 -1.208 -8.750
337 HE1 TYR 47 2HE TYR 47 1.408 2.749 -6.655
338 HE2 TYR 47 1HE TYR 47 0.033 0.709 -10.141
339 HH TYR 47 HH TYR 47 1.202 3.702 -8.706
340 H TYR 48 H TYR 48 -3.297 -2.827 -5.612
341 HA TYR 48 HA TYR 48 -2.496 -4.891 -3.764
342 HB2 TYR 48 1HB TYR 48 -4.816 -4.926 -2.697
343 HB3 TYR 48 2HB TYR 48 -3.722 -3.652 -2.169
344 HD1 TYR 48 2HD TYR 48 -4.042 -1.326 -3.038
345 HD2 TYR 48 1HD TYR 48 -6.880 -4.416 -3.749
346 HE1 TYR 48 2HE TYR 48 -5.733 0.366 -3.608
347 HE2 TYR 48 1HE TYR 48 -8.578 -2.732 -4.322
348 HH TYR 48 HH TYR 48 -8.183 0.572 -3.672
349 H ARG 49 H ARG 49 -3.343 -6.890 -4.275
350 HA ARG 49 HA ARG 49 -5.558 -7.242 -6.035
351 HB2 ARG 49 1HB ARG 49 -4.445 -8.037 -7.989
352 HB3 ARG 49 2HB ARG 49 -3.754 -6.466 -7.606
353 HG2 ARG 49 1HG ARG 49 -1.841 -7.605 -8.022
354 HG3 ARG 49 2HG ARG 49 -2.005 -7.970 -6.303
355 HD2 ARG 49 1HD ARG 49 -3.434 -9.991 -7.261
356 HD3 ARG 49 2HD ARG 49 -2.411 -9.716 -8.671
357 HE ARG 49 HE ARG 49 -0.992 -9.919 -6.164
358 HH11 ARG 49 1HH1 ARG 49 -2.241 -11.616 -8.936
359 HH12 ARG 49 2HH1 ARG 49 -1.153 -12.954 -8.770
360 HH21 ARG 49 1HH2 ARG 49 0.446 -11.675 -5.936
361 HH22 ARG 49 2HH2 ARG 49 0.374 -12.987 -7.063
362 HA PRO 50 HA PRO 50 -5.415 -11.120 -3.943
363 HB2 PRO 50 1HB PRO 50 -7.210 -12.464 -5.473
364 HB3 PRO 50 2HB PRO 50 -7.681 -11.221 -4.308
365 HG2 PRO 50 1HG PRO 50 -7.346 -11.007 -7.275
366 HG3 PRO 50 2HG PRO 50 -8.625 -10.342 -6.242
367 HD2 PRO 50 1HD PRO 50 -6.562 -8.844 -7.153
368 HD3 PRO 50 2HD PRO 50 -7.335 -8.550 -5.582
369 H THR 51 H THR 51 -4.437 -13.105 -4.115
370 HA THR 51 HA THR 51 -2.456 -13.509 -6.012
371 HB THR 51 HB THR 51 -2.817 -14.669 -3.718
372 HG1 THR 51 1HG THR 51 -1.282 -15.163 -5.733
373 HG21 THR 51 1HG2 THR 51 -4.986 -15.755 -4.917
374 HG22 THR 51 2HG2 THR 51 -4.139 -16.497 -3.561
375 HG23 THR 51 3HG2 THR 51 -3.792 -17.018 -5.209
376 H ASP 52 H ASP 52 -5.829 -14.166 -6.204
377 HA ASP 52 HA ASP 52 -5.701 -16.160 -8.247
378 HB2 ASP 52 1HB ASP 52 -7.648 -15.775 -6.679
379 HB3 ASP 52 2HB ASP 52 -8.034 -14.343 -7.629
380 H SER 53 H SER 53 -5.545 -12.715 -8.188
381 HA SER 53 HA SER 53 -6.504 -11.919 -10.619
382 HB2 SER 53 1HB SER 53 -4.184 -11.006 -8.962
383 HB3 SER 53 2HB SER 53 -4.417 -10.310 -10.566
384 HG SER 53 HG SER 53 -6.715 -10.424 -9.084
385 H ASP 54 H ASP 54 -5.608 -11.643 -12.704
386 HA ASP 54 HA ASP 54 -4.226 -13.882 -13.703
387 HB2 ASP 54 1HB ASP 54 -5.777 -12.078 -14.872
388 HB3 ASP 54 2HB ASP 54 -4.228 -11.320 -15.236
389 H ASN 55 H ASN 55 -3.140 -10.489 -13.485
390 HA ASN 55 HA ASN 55 -0.498 -11.304 -12.697
391 HB2 ASN 55 1HB ASN 55 0.496 -9.971 -14.704
392 HB3 ASN 55 2HB ASN 55 0.003 -11.644 -14.945
393 HD21 ASN 55 1HD2 ASN 55 -0.386 -8.435 -15.927
394 HD22 ASN 55 2HD2 ASN 55 -1.687 -8.676 -17.038
395 H ASP 56 H ASP 56 0.971 -9.127 -13.031
396 HA ASP 56 HA ASP 56 0.192 -7.349 -11.102
397 HB2 ASP 56 1HB ASP 56 2.014 -7.004 -13.474
398 HB3 ASP 56 2HB ASP 56 1.767 -5.707 -12.308
399 H SER 57 H SER 57 -0.537 -7.246 -14.545
400 HA SER 57 HA SER 57 -1.485 -4.734 -14.935
401 HB2 SER 57 1HB SER 57 -1.486 -6.720 -16.558
402 HB3 SER 57 2HB SER 57 -3.064 -7.123 -15.882
403 HG SER 57 HG SER 57 -2.349 -4.665 -17.113
404 H ASP 58 H ASP 58 -2.798 -7.115 -12.827
405 HA ASP 58 HA ASP 58 -5.408 -5.921 -12.609
406 HB2 ASP 58 1HB ASP 58 -4.629 -8.396 -12.134
407 HB3 ASP 58 2HB ASP 58 -4.303 -7.760 -10.524
408 H TYR 59 H TYR 59 -2.418 -5.908 -10.727
409 HA TYR 59 HA TYR 59 -3.011 -4.786 -8.384
410 HB2 TYR 59 1HB TYR 59 -0.786 -4.287 -10.293
411 HB3 TYR 59 2HB TYR 59 -0.942 -3.181 -8.933
412 HD1 TYR 59 1HD TYR 59 -1.833 -4.959 -6.779
413 HD2 TYR 59 2HD TYR 59 1.070 -5.604 -9.821
414 HE1 TYR 59 1HE TYR 59 -0.681 -6.576 -5.328
415 HE2 TYR 59 2HE TYR 59 2.230 -7.225 -8.379
416 HH TYR 59 HH TYR 59 2.187 -8.338 -6.456
417 H LYS 60 H LYS 60 -4.234 -3.172 -7.696
418 HA LYS 60 HA LYS 60 -5.099 -1.109 -9.546
419 HB2 LYS 60 1HB LYS 60 -5.937 -1.978 -6.801
420 HB3 LYS 60 2HB LYS 60 -6.426 -0.402 -7.409
421 HG2 LYS 60 1HG LYS 60 -7.580 -1.408 -9.256
422 HG3 LYS 60 2HG LYS 60 -6.970 -3.005 -8.819
423 HD2 LYS 60 1HD LYS 60 -8.141 -2.560 -6.550
424 HD3 LYS 60 2HD LYS 60 -9.030 -1.322 -7.440
425 HE2 LYS 60 1HE LYS 60 -9.651 -3.092 -9.100
426 HE3 LYS 60 2HE LYS 60 -8.926 -4.279 -8.017
427 HZ1 LYS 60 1HZ LYS 60 -10.522 -3.144 -6.303
428 HZ2 LYS 60 2HZ LYS 60 -11.085 -4.356 -7.340
429 HZ3 LYS 60 3HZ LYS 60 -11.392 -2.731 -7.694
430 H LYS 61 H LYS 61 -5.476 1.102 -8.129
431 HA LYS 61 HA LYS 61 -3.018 1.799 -6.726
432 HB2 LYS 61 1HB LYS 61 -2.685 2.213 -9.204
433 HB3 LYS 61 2HB LYS 61 -3.944 3.435 -9.088
434 HG2 LYS 61 1HG LYS 61 -2.634 4.761 -7.611
435 HG3 LYS 61 2HG LYS 61 -1.439 3.475 -7.424
436 HD2 LYS 61 1HD LYS 61 -0.492 5.029 -8.933
437 HD3 LYS 61 2HD LYS 61 -1.038 3.670 -9.918
438 HE2 LYS 61 1HE LYS 61 -2.857 4.860 -10.761
439 HE3 LYS 61 2HE LYS 61 -2.805 6.047 -9.458
440 HZ1 LYS 61 1HZ LYS 61 -1.957 6.769 -11.719
441 HZ2 LYS 61 2HZ LYS 61 -0.608 5.794 -11.422
442 HZ3 LYS 61 3HZ LYS 61 -0.955 7.092 -10.394
443 H ASP 62 H ASP 62 -3.516 2.960 -4.994
444 HA ASP 62 HA ASP 62 -5.961 4.606 -5.061
445 HB2 ASP 62 1HB ASP 62 -4.964 2.678 -3.018
446 HB3 ASP 62 2HB ASP 62 -5.788 4.126 -2.447
447 H MET 63 H MET 63 -5.401 6.677 -5.089
448 HA MET 63 HA MET 63 -2.869 7.606 -4.135
449 HB2 MET 63 1HB MET 63 -4.385 8.541 -6.049
450 HB3 MET 63 2HB MET 63 -5.163 9.435 -4.749
451 HG2 MET 63 1HG MET 63 -2.675 10.086 -4.175
452 HG3 MET 63 2HG MET 63 -2.435 9.714 -5.881
453 HE1 MET 63 1HE MET 63 -3.192 12.996 -3.724
454 HE2 MET 63 2HE MET 63 -4.939 12.958 -3.961
455 HE3 MET 63 3HE MET 63 -4.119 11.580 -3.225
456 H VAL 64 H VAL 64 -2.373 8.685 -2.285
457 HA VAL 64 HA VAL 64 -4.537 9.297 -0.400
458 HB VAL 64 HB VAL 64 -2.009 7.923 0.495
459 HG11 VAL 64 1HG1 VAL 64 -3.443 9.377 2.050
460 HG12 VAL 64 2HG1 VAL 64 -4.628 8.074 1.948
461 HG13 VAL 64 3HG1 VAL 64 -3.018 7.754 2.593
462 HG21 VAL 64 1HG2 VAL 64 -3.789 6.004 0.875
463 HG22 VAL 64 2HG2 VAL 64 -4.564 6.779 -0.507
464 HG23 VAL 64 3HG2 VAL 64 -2.917 6.166 -0.650
465 H GLU 65 H GLU 65 -4.184 11.054 0.906
466 HA GLU 65 HA GLU 65 -2.715 13.169 0.107
467 HB2 GLU 65 1HB GLU 65 -2.866 12.693 3.055
468 HB3 GLU 65 2HB GLU 65 -3.149 14.173 2.148
469 HG2 GLU 65 1HG GLU 65 -4.977 11.819 2.483
470 HG3 GLU 65 2HG GLU 65 -5.244 13.494 2.965
471 H GLY 66 H GLY 66 -0.702 14.104 0.600
472 HA2 GLY 66 1HA GLY 66 1.453 12.244 0.767
473 HA3 GLY 66 2HA GLY 66 1.594 13.995 0.732
474 H ASP 67 H ASP 67 -0.235 14.183 3.102
475 HA ASP 67 HA ASP 67 1.848 13.846 5.105
476 HB2 ASP 67 1HB ASP 67 -0.835 15.232 5.152
477 HB3 ASP 67 2HB ASP 67 0.203 15.095 6.568
478 H ARG 68 H ARG 68 -0.524 11.941 3.889
479 HA ARG 68 HA ARG 68 -1.367 10.785 6.429
480 HB2 ARG 68 1HB ARG 68 -2.887 11.175 4.372
481 HB3 ARG 68 2HB ARG 68 -2.113 9.740 3.711
482 HG2 ARG 68 1HG ARG 68 -3.929 8.786 4.689
483 HG3 ARG 68 2HG ARG 68 -2.799 8.718 6.042
484 HD2 ARG 68 1HD ARG 68 -3.877 10.361 7.205
485 HD3 ARG 68 2HD ARG 68 -4.462 11.159 5.745
486 HE ARG 68 HE ARG 68 -5.770 9.059 7.223
487 HH11 ARG 68 1HH1 ARG 68 -5.518 10.714 4.171
488 HH12 ARG 68 2HH1 ARG 68 -7.111 10.273 3.652
489 HH21 ARG 68 1HH2 ARG 68 -7.869 8.472 6.551
490 HH22 ARG 68 2HH2 ARG 68 -8.448 8.998 5.007
491 H TYR 69 H TYR 69 -0.483 9.023 7.298
492 HA TYR 69 HA TYR 69 1.388 7.457 5.645
493 HB2 TYR 69 1HB TYR 69 1.508 8.376 8.485
494 HB3 TYR 69 2HB TYR 69 2.273 6.848 8.064
495 HD1 TYR 69 2HD TYR 69 2.057 9.941 6.012
496 HD2 TYR 69 1HD TYR 69 4.556 7.332 8.260
497 HE1 TYR 69 2HE TYR 69 4.039 11.158 5.211
498 HE2 TYR 69 1HE TYR 69 6.544 8.542 7.466
499 HH TYR 69 HH TYR 69 7.043 10.892 6.598
500 H TRP 70 H TRP 70 -1.613 7.233 6.458
501 HA TRP 70 HA TRP 70 -1.488 4.347 6.920
502 HB2 TRP 70 1HB TRP 70 -3.089 4.367 8.683
503 HB3 TRP 70 2HB TRP 70 -1.868 5.561 9.112
504 HD1 TRP 70 HD TRP 70 -2.605 8.211 8.502
505 HE1 TRP 70 1HE TRP 70 -4.914 9.312 8.785
506 HE3 TRP 70 3HE TRP 70 -5.496 3.998 8.687
507 HZ2 TRP 70 2HZ TRP 70 -7.605 8.502 9.052
508 HZ3 TRP 70 3HZ TRP 70 -7.928 4.248 8.959
509 HH2 TRP 70 HH TRP 70 -8.959 6.454 9.138
510 H HIS 71 H HIS 71 -3.247 3.184 6.097
511 HA HIS 71 HA HIS 71 -5.470 4.542 4.871
512 HB2 HIS 71 1HB HIS 71 -3.664 4.816 3.178
513 HB3 HIS 71 2HB HIS 71 -3.523 3.063 3.089
514 HD1 HIS 71 1HD HIS 71 -6.411 5.537 2.781
515 HD2 HIS 71 2HD HIS 71 -4.873 2.138 0.952
516 HE1 HIS 71 1HE HIS 71 -7.953 5.055 0.853
517 HE2 HIS 71 2HE HIS 71 -7.051 2.945 -0.186
518 H SER 72 H SER 72 -7.209 3.258 4.884
519 HA SER 72 HA SER 72 -6.788 0.405 5.457
520 HB2 SER 72 1HB SER 72 -8.820 0.393 6.641
521 HB3 SER 72 2HB SER 72 -8.101 1.947 7.063
522 HG SER 72 HG SER 72 -10.321 1.377 5.475
523 H ILE 73 H ILE 73 -6.820 -0.706 3.601
524 HA ILE 73 HA ILE 73 -8.378 0.062 1.335
525 HB ILE 73 HB ILE 73 -7.117 -2.637 1.797
526 HG12 ILE 73 1HG1 ILE 73 -5.794 -0.261 0.487
527 HG13 ILE 73 2HG1 ILE 73 -5.552 -0.668 2.182
528 HG21 ILE 73 1HG2 ILE 73 -7.432 -1.191 -0.810
529 HG22 ILE 73 2HG2 ILE 73 -7.181 -2.911 -0.519
530 HG23 ILE 73 3HG2 ILE 73 -8.736 -2.171 -0.139
531 HD11 ILE 73 1HD1 ILE 73 -4.871 -2.399 -0.182
532 HD12 ILE 73 2HD1 ILE 73 -3.737 -1.518 0.842
533 HD13 ILE 73 3HD1 ILE 73 -4.672 -2.855 1.510
534 H SER 74 H SER 74 -10.199 -0.925 0.464
535 HA SER 74 HA SER 74 -11.602 -2.854 2.182
536 HB2 SER 74 1HB SER 74 -13.153 -0.707 0.778
537 HB3 SER 74 2HB SER 74 -13.585 -1.640 2.211
538 HG SER 74 HG SER 74 -11.659 -0.444 3.147
539 H HIS 75 H HIS 75 -13.753 -3.487 0.854
540 HA HIS 75 HA HIS 75 -14.538 -4.771 -0.854
541 HB2 HIS 75 1HB HIS 75 -13.093 -2.570 -2.295
542 HB3 HIS 75 2HB HIS 75 -13.828 -3.889 -3.202
543 HD1 HIS 75 1HD HIS 75 -16.458 -4.114 -3.007
544 HD2 HIS 75 2HD HIS 75 -14.840 -0.652 -1.376
545 HE1 HIS 75 1HE HIS 75 -18.399 -2.547 -2.696
546 HE2 HIS 75 2HE HIS 75 -17.384 -0.428 -1.788
547 H LEU 76 H LEU 76 -12.545 -6.031 0.373
548 HA LEU 76 HA LEU 76 -10.811 -7.060 -1.774
549 HB2 LEU 76 1HB LEU 76 -10.406 -7.273 1.204
550 HB3 LEU 76 2HB LEU 76 -9.284 -7.797 -0.050
551 HG LEU 76 HG LEU 76 -10.083 -4.916 0.203
552 HD11 LEU 76 1HD1 LEU 76 -7.555 -5.305 1.387
553 HD12 LEU 76 2HD1 LEU 76 -8.667 -6.432 2.162
554 HD13 LEU 76 3HD1 LEU 76 -9.033 -4.706 2.141
555 HD21 LEU 76 1HD2 LEU 76 -7.492 -5.018 -0.582
556 HD22 LEU 76 2HD2 LEU 76 -8.866 -4.964 -1.687
557 HD23 LEU 76 3HD2 LEU 76 -8.114 -6.510 -1.288
558 H GLN 77 H GLN 77 -10.046 -9.440 -0.933
559 HA GLN 77 HA GLN 77 -12.541 -10.970 -0.875
560 HB2 GLN 77 1HB GLN 77 -9.754 -11.984 -1.438
561 HB3 GLN 77 2HB GLN 77 -11.271 -12.820 -1.742
562 HG2 GLN 77 1HG GLN 77 -10.606 -12.063 -3.834
563 HG3 GLN 77 2HG GLN 77 -11.817 -10.890 -3.317
564 HE21 GLN 77 1HE2 GLN 77 -10.523 -9.818 -5.155
565 HE22 GLN 77 2HE2 GLN 77 -9.223 -8.800 -4.649
566 HA PRO 78 HA PRO 78 -11.924 -12.188 3.313
567 HB2 PRO 78 1HB PRO 78 -13.484 -14.410 3.323
568 HB3 PRO 78 2HB PRO 78 -14.146 -12.771 3.307
569 HG2 PRO 78 1HG PRO 78 -13.773 -14.684 1.036
570 HG3 PRO 78 2HG PRO 78 -15.155 -13.633 1.398
571 HD2 PRO 78 1HD PRO 78 -13.292 -13.002 -0.463
572 HD3 PRO 78 2HD PRO 78 -14.134 -11.771 0.501
573 H GLU 79 H GLU 79 -10.719 -13.620 4.528
574 HA GLU 79 HA GLU 79 -8.809 -14.910 4.748
575 HB2 GLU 79 1HB GLU 79 -9.504 -17.373 4.063
576 HB3 GLU 79 2HB GLU 79 -10.206 -16.575 5.463
577 HG2 GLU 79 1HG GLU 79 -12.204 -16.086 4.302
578 HG3 GLU 79 2HG GLU 79 -11.492 -16.524 2.751
579 H THR 80 H THR 80 -8.570 -13.469 2.394
580 HA THR 80 HA THR 80 -7.460 -15.438 0.504
581 HB THR 80 HB THR 80 -8.276 -12.579 -0.053
582 HG1 THR 80 1HG THR 80 -10.121 -13.802 0.178
583 HG21 THR 80 1HG2 THR 80 -6.383 -13.811 -1.404
584 HG22 THR 80 2HG2 THR 80 -7.617 -12.867 -2.239
585 HG23 THR 80 3HG2 THR 80 -7.752 -14.623 -2.162
586 H SER 81 H SER 81 -5.372 -15.693 1.072
587 HA SER 81 HA SER 81 -3.757 -13.531 2.042
588 HB2 SER 81 1HB SER 81 -3.582 -16.132 2.478
589 HB3 SER 81 2HB SER 81 -2.554 -16.083 1.046
590 HG SER 81 HG SER 81 -1.296 -15.782 2.886
591 H TYR 82 H TYR 82 -3.375 -11.938 0.607
592 HA TYR 82 HA TYR 82 -2.054 -12.699 -1.912
593 HB2 TYR 82 1HB TYR 82 -3.127 -10.600 -2.884
594 HB3 TYR 82 2HB TYR 82 -4.195 -11.973 -2.610
595 HD1 TYR 82 1HD TYR 82 -3.044 -8.809 -1.008
596 HD2 TYR 82 2HD TYR 82 -6.159 -11.681 -1.398
597 HE1 TYR 82 1HE TYR 82 -4.521 -7.381 0.343
598 HE2 TYR 82 2HE TYR 82 -7.645 -10.260 -0.049
599 HH TYR 82 HH TYR 82 -7.309 -7.200 0.453
600 H ASP 83 H ASP 83 -0.561 -11.127 -2.755
601 HA ASP 83 HA ASP 83 1.019 -9.920 -0.703
602 HB2 ASP 83 1HB ASP 83 1.222 -10.172 -3.678
603 HB3 ASP 83 2HB ASP 83 2.241 -8.999 -2.848
604 H ILE 84 H ILE 84 1.597 -7.694 -0.536
605 HA ILE 84 HA ILE 84 -0.167 -5.773 -1.854
606 HB ILE 84 HB ILE 84 0.164 -5.893 1.146
607 HG12 ILE 84 1HG1 ILE 84 -2.437 -6.098 -0.341
608 HG13 ILE 84 2HG1 ILE 84 -1.439 -7.528 -0.099
609 HG21 ILE 84 1HG2 ILE 84 -1.519 -3.996 -0.478
610 HG22 ILE 84 2HG2 ILE 84 -1.231 -3.960 1.261
611 HG23 ILE 84 3HG2 ILE 84 0.085 -3.604 0.142
612 HD11 ILE 84 1HD1 ILE 84 -1.528 -6.508 2.413
613 HD12 ILE 84 2HD1 ILE 84 -3.116 -6.058 1.789
614 HD13 ILE 84 3HD1 ILE 84 -2.613 -7.748 1.785
615 H LYS 85 H LYS 85 0.883 -3.985 -2.452
616 HA LYS 85 HA LYS 85 3.279 -3.149 -1.004
617 HB2 LYS 85 1HB LYS 85 4.658 -3.043 -2.949
618 HB3 LYS 85 2HB LYS 85 3.967 -4.660 -2.894
619 HG2 LYS 85 1HG LYS 85 2.441 -4.169 -4.633
620 HG3 LYS 85 2HG LYS 85 2.795 -2.441 -4.547
621 HD2 LYS 85 1HD LYS 85 4.797 -2.658 -5.648
622 HD3 LYS 85 2HD LYS 85 5.028 -4.328 -5.123
623 HE2 LYS 85 1HE LYS 85 4.548 -4.553 -7.382
624 HE3 LYS 85 2HE LYS 85 2.985 -4.837 -6.618
625 HZ1 LYS 85 1HZ LYS 85 2.827 -3.348 -8.532
626 HZ2 LYS 85 2HZ LYS 85 3.870 -2.250 -7.779
627 HZ3 LYS 85 3HZ LYS 85 2.353 -2.574 -7.104
628 H MET 86 H MET 86 4.037 -0.976 -1.733
629 HA MET 86 HA MET 86 2.019 0.640 -3.077
630 HB2 MET 86 1HB MET 86 1.913 2.283 -1.284
631 HB3 MET 86 2HB MET 86 1.398 0.708 -0.694
632 HG2 MET 86 1HG MET 86 3.369 0.393 0.525
633 HG3 MET 86 2HG MET 86 4.209 1.678 -0.339
634 HE1 MET 86 1HE MET 86 1.382 4.028 0.137
635 HE2 MET 86 2HE MET 86 2.703 4.882 0.934
636 HE3 MET 86 3HE MET 86 3.010 3.959 -0.538
637 H GLN 87 H GLN 87 2.876 3.049 -3.059
638 HA GLN 87 HA GLN 87 5.701 3.409 -3.006
639 HB2 GLN 87 1HB GLN 87 5.714 2.142 -5.033
640 HB3 GLN 87 2HB GLN 87 4.348 3.043 -5.677
641 HG2 GLN 87 1HG GLN 87 6.004 5.076 -5.383
642 HG3 GLN 87 2HG GLN 87 7.211 3.797 -5.502
643 HE21 GLN 87 1HE2 GLN 87 4.974 5.752 -7.175
644 HE22 GLN 87 2HE2 GLN 87 5.243 5.111 -8.757
645 H CYS 88 H CYS 88 6.291 5.560 -3.189
646 HA CYS 88 HA CYS 88 4.041 7.442 -3.247
647 HB2 CYS 88 1HB CYS 88 5.230 8.826 -1.817
648 HB3 CYS 88 2HB CYS 88 5.762 7.235 -1.287
649 HG CYS 88 HG CYS 88 8.233 7.327 -2.426
650 H PHE 89 H PHE 89 4.265 9.466 -4.352
651 HA PHE 89 HA PHE 89 6.350 9.580 -6.404
652 HB2 PHE 89 1HB PHE 89 4.742 10.044 -8.166
653 HB3 PHE 89 2HB PHE 89 4.370 8.492 -7.422
654 HD1 PHE 89 1HD PHE 89 2.579 8.518 -5.553
655 HD2 PHE 89 2HD PHE 89 3.078 11.623 -8.421
656 HE1 PHE 89 1HE PHE 89 0.272 9.268 -5.137
657 HE2 PHE 89 2HE PHE 89 0.773 12.379 -8.009
658 HZ PHE 89 HZ PHE 89 -0.633 11.202 -6.365
659 H ASN 90 H ASN 90 6.091 11.748 -7.662
660 HA ASN 90 HA ASN 90 4.866 13.945 -6.367
661 HB2 ASN 90 1HB ASN 90 6.573 14.938 -5.173
662 HB3 ASN 90 2HB ASN 90 6.920 13.238 -4.872
663 HD21 ASN 90 1HD2 ASN 90 8.720 15.494 -4.789
664 HD22 ASN 90 2HD2 ASN 90 9.965 15.173 -5.943
665 H GLU 91 H GLU 91 5.722 16.071 -7.273
666 HA GLU 91 HA GLU 91 5.459 16.282 -9.928
667 HB2 GLU 91 1HB GLU 91 6.832 18.340 -9.861
668 HB3 GLU 91 2HB GLU 91 5.692 18.241 -8.526
669 HG2 GLU 91 1HG GLU 91 7.406 17.678 -6.989
670 HG3 GLU 91 2HG GLU 91 8.575 17.432 -8.285
671 H GLY 92 H GLY 92 8.452 15.400 -8.278
672 HA2 GLY 92 1HA GLY 92 10.134 15.449 -10.547
673 HA3 GLY 92 2HA GLY 92 10.437 14.557 -9.063
674 H GLY 93 H GLY 93 8.300 12.800 -9.044
675 HA2 GLY 93 1HA GLY 93 7.482 11.434 -11.205
676 HA3 GLY 93 2HA GLY 93 9.167 10.946 -11.103
677 H GLU 94 H GLU 94 8.039 8.805 -10.890
678 HA GLU 94 HA GLU 94 6.864 8.282 -8.286
679 HB2 GLU 94 1HB GLU 94 7.231 6.700 -10.801
680 HB3 GLU 94 2HB GLU 94 6.906 5.860 -9.291
681 HG2 GLU 94 1HG GLU 94 4.829 7.032 -9.022
682 HG3 GLU 94 2HG GLU 94 5.170 8.036 -10.430
683 H SER 95 H SER 95 7.691 6.744 -6.801
684 HA SER 95 HA SER 95 10.615 6.623 -6.817
685 HB2 SER 95 1HB SER 95 10.544 6.527 -4.506
686 HB3 SER 95 2HB SER 95 9.081 7.454 -4.836
687 HG SER 95 HG SER 95 8.013 5.916 -3.909
688 H GLU 96 H GLU 96 11.252 4.521 -5.329
689 HA GLU 96 HA GLU 96 10.934 2.329 -7.098
690 HB2 GLU 96 1HB GLU 96 12.027 2.406 -4.280
691 HB3 GLU 96 2HB GLU 96 12.186 1.051 -5.389
692 HG2 GLU 96 1HG GLU 96 13.249 3.802 -5.965
693 HG3 GLU 96 2HG GLU 96 14.195 2.524 -5.203
694 H PHE 97 H PHE 97 10.117 0.187 -6.486
695 HA PHE 97 HA PHE 97 7.469 0.403 -5.388
696 HB2 PHE 97 1HB PHE 97 9.057 -1.763 -6.708
697 HB3 PHE 97 2HB PHE 97 7.606 -2.191 -5.808
698 HD1 PHE 97 1HD PHE 97 8.016 0.944 -7.689
699 HD2 PHE 97 2HD PHE 97 6.326 -2.962 -7.653
700 HE1 PHE 97 1HE PHE 97 6.638 1.526 -9.643
701 HE2 PHE 97 2HE PHE 97 4.947 -2.387 -9.607
702 HZ PHE 97 HZ PHE 97 5.102 -0.141 -10.605
703 H SER 98 H SER 98 7.070 0.339 -3.286
704 HA SER 98 HA SER 98 8.846 -0.285 -1.272
705 HB2 SER 98 1HB SER 98 6.739 0.921 -0.889
706 HB3 SER 98 2HB SER 98 5.831 -0.559 -1.194
707 HG SER 98 HG SER 98 6.080 -0.318 1.014
708 H ASN 99 H ASN 99 8.659 -2.078 0.342
709 HA ASN 99 HA ASN 99 9.172 -4.550 -0.876
710 HB2 ASN 99 1HB ASN 99 9.634 -5.337 1.241
711 HB3 ASN 99 2HB ASN 99 9.771 -3.602 1.516
712 HD21 ASN 99 1HD2 ASN 99 7.389 -2.658 1.878
713 HD22 ASN 99 2HD2 ASN 99 6.536 -3.456 3.151
714 H VAL 100 H VAL 100 8.012 -6.600 -0.447
715 HA VAL 100 HA VAL 100 5.154 -6.225 -0.929
716 HB VAL 100 HB VAL 100 6.793 -8.754 -1.134
717 HG11 VAL 100 1HG1 VAL 100 4.096 -8.170 -2.334
718 HG12 VAL 100 2HG1 VAL 100 4.933 -9.720 -2.241
719 HG13 VAL 100 3HG1 VAL 100 4.306 -8.966 -0.775
720 HG21 VAL 100 1HG2 VAL 100 7.188 -8.332 -3.353
721 HG22 VAL 100 2HG2 VAL 100 5.795 -7.261 -3.512
722 HG23 VAL 100 3HG2 VAL 100 7.257 -6.694 -2.703
723 H MET 101 H MET 101 3.873 -6.236 0.794
724 HA MET 101 HA MET 101 4.578 -7.944 3.079
725 HB2 MET 101 1HB MET 101 2.723 -5.564 2.904
726 HB3 MET 101 2HB MET 101 2.975 -6.528 4.353
727 HG2 MET 101 1HG MET 101 5.159 -5.041 2.919
728 HG3 MET 101 2HG MET 101 4.253 -4.399 4.286
729 HE1 MET 101 1HE MET 101 4.196 -6.300 6.743
730 HE2 MET 101 2HE MET 101 5.785 -5.783 7.309
731 HE3 MET 101 3HE MET 101 4.720 -4.634 6.497
732 H ILE 102 H ILE 102 3.492 -9.773 3.334
733 HA ILE 102 HA ILE 102 1.043 -10.222 1.829
734 HB ILE 102 HB ILE 102 2.682 -12.104 3.530
735 HG12 ILE 102 1HG1 ILE 102 2.351 -12.106 0.532
736 HG13 ILE 102 2HG1 ILE 102 3.646 -11.225 1.334
737 HG21 ILE 102 1HG2 ILE 102 0.940 -13.417 1.680
738 HG22 ILE 102 2HG2 ILE 102 1.023 -13.574 3.434
739 HG23 ILE 102 3HG2 ILE 102 0.001 -12.334 2.708
740 HD11 ILE 102 1HD1 ILE 102 4.844 -13.080 1.218
741 HD12 ILE 102 2HD1 ILE 102 3.751 -13.785 2.410
742 HD13 ILE 102 3HD1 ILE 102 3.449 -14.019 0.688
743 H CYS 103 H CYS 103 -0.662 -9.271 2.812
744 HA CYS 103 HA CYS 103 -1.086 -9.829 5.669
745 HB2 CYS 103 1HB CYS 103 -0.977 -7.416 4.861
746 HB3 CYS 103 2HB CYS 103 -2.502 -7.722 4.039
747 HG CYS 103 HG CYS 103 -2.208 -6.541 6.934
748 H GLU 104 H GLU 104 -2.323 -11.573 5.922
749 HA GLU 104 HA GLU 104 -4.277 -12.357 3.960
750 HB2 GLU 104 1HB GLU 104 -2.810 -13.855 5.521
751 HB3 GLU 104 2HB GLU 104 -4.089 -13.572 6.694
752 HG2 GLU 104 1HG GLU 104 -5.611 -14.319 4.663
753 HG3 GLU 104 2HG GLU 104 -4.128 -15.140 4.180
754 H THR 105 H THR 105 -6.377 -11.886 3.932
755 HA THR 105 HA THR 105 -7.479 -10.033 5.788
756 HB THR 105 HB THR 105 -9.656 -10.562 4.551
757 HG1 THR 105 1HG THR 105 -8.740 -11.579 2.370
758 HG21 THR 105 1HG2 THR 105 -8.010 -8.696 4.036
759 HG22 THR 105 2HG2 THR 105 -9.064 -9.194 2.712
760 HG23 THR 105 3HG2 THR 105 -7.385 -9.734 2.755
761 H LYS 106 H LYS 106 -9.887 -10.609 6.531
762 HA LYS 106 HA LYS 106 -9.561 -12.793 8.414
763 HB2 LYS 106 1HB LYS 106 -11.835 -10.823 8.110
764 HB3 LYS 106 2HB LYS 106 -11.595 -11.926 9.459
765 HG2 LYS 106 1HG LYS 106 -9.415 -10.019 8.804
766 HG3 LYS 106 2HG LYS 106 -10.869 -9.398 9.588
767 HD2 LYS 106 1HD LYS 106 -10.485 -10.557 11.525
768 HD3 LYS 106 2HD LYS 106 -9.609 -11.851 10.705
769 HE2 LYS 106 1HE LYS 106 -7.846 -9.986 10.249
770 HE3 LYS 106 2HE LYS 106 -8.641 -9.164 11.591
771 HZ1 LYS 106 1HZ LYS 106 -6.644 -10.750 12.019
772 HZ2 LYS 106 2HZ LYS 106 -7.818 -11.963 11.921
773 HZ3 LYS 106 3HZ LYS 106 -7.960 -10.741 13.082
774 H ALA 107 H ALA 107 -11.113 -14.468 8.704
775 HA ALA 107 HA ALA 107 -12.084 -15.542 6.228
776 HB1 ALA 107 1HB ALA 107 -11.768 -17.438 7.331
777 HB2 ALA 107 2HB ALA 107 -11.462 -16.542 8.819
778 HB3 ALA 107 3HB ALA 107 -13.106 -17.030 8.405
779 H ARG 108 H ARG 108 -14.102 -15.537 5.428
780 HA ARG 108 HA ARG 108 -16.057 -13.805 6.602
781 HB2 ARG 108 1HB ARG 108 -17.472 -14.613 4.654
782 HB3 ARG 108 2HB ARG 108 -15.968 -13.802 4.238
783 HG2 ARG 108 1HG ARG 108 -15.011 -15.694 3.410
784 HG3 ARG 108 2HG ARG 108 -15.926 -16.758 4.481
785 HD2 ARG 108 1HD ARG 108 -17.825 -16.680 3.134
786 HD3 ARG 108 2HD ARG 108 -17.299 -15.209 2.316
787 HE ARG 108 HE ARG 108 -15.425 -17.118 1.682
788 HH11 ARG 108 1HH1 ARG 108 -18.864 -16.741 1.300
789 HH12 ARG 108 2HH1 ARG 108 -18.937 -17.678 -0.156
790 HH21 ARG 108 1HH2 ARG 108 -15.507 -18.354 -0.233
791 HH22 ARG 108 2HH2 ARG 108 -17.027 -18.596 -1.026
792 H SER 109 H SER 109 -16.330 -14.933 8.639
793 HA SER 109 HA SER 109 -18.114 -17.268 8.403
794 HB2 SER 109 1HB SER 109 -15.942 -17.804 9.476
795 HB3 SER 109 2HB SER 109 -16.276 -16.593 10.714
796 HG SER 109 HG SER 109 -16.934 -18.535 11.533
797 H GLY 110 H GLY 110 -20.030 -17.245 9.490
798 HA2 GLY 110 1HA GLY 110 -21.803 -16.425 10.702
799 HA3 GLY 110 2HA GLY 110 -20.646 -15.465 11.612
800 HA PRO 111 HA PRO 111 -23.278 -12.914 8.533
801 HB2 PRO 111 1HB PRO 111 -25.183 -11.989 10.232
802 HB3 PRO 111 2HB PRO 111 -25.376 -13.470 9.287
803 HG2 PRO 111 1HG PRO 111 -24.576 -13.144 12.153
804 HG3 PRO 111 2HG PRO 111 -25.696 -14.313 11.430
805 HD2 PRO 111 1HD PRO 111 -23.148 -14.951 12.087
806 HD3 PRO 111 2HD PRO 111 -23.993 -15.691 10.712
807 H SER 112 H SER 112 -22.445 -10.948 8.248
808 HA SER 112 HA SER 112 -20.843 -9.667 10.179
809 HB2 SER 112 1HB SER 112 -20.758 -7.792 8.573
810 HB3 SER 112 2HB SER 112 -20.495 -9.343 7.775
811 HG SER 112 HG SER 112 -22.266 -7.543 7.137
812 H SER 113 H SER 113 -21.542 -8.719 11.967
813 HA SER 113 HA SER 113 -23.686 -6.765 11.817
814 HB2 SER 113 1HB SER 113 -24.910 -8.813 12.341
815 HB3 SER 113 2HB SER 113 -23.822 -9.142 13.690
816 HG SER 113 HG SER 113 -24.605 -6.845 14.300
817 H GLY 114 H GLY 114 -22.671 -5.035 12.602
818 HA2 GLY 114 1HA GLY 114 -21.643 -5.113 15.310
819 HA3 GLY 114 2HA GLY 114 -20.435 -4.784 14.078
Start of MODEL 11
1 H1 GLY 1 H GLY 1 17.444 18.070 -22.711
2 HA2 GLY 1 1HA GLY 1 16.129 16.473 -24.812
3 HA3 GLY 1 2HA GLY 1 16.709 15.702 -23.343
4 H SER 2 H SER 2 14.725 15.011 -22.618
5 HA SER 2 HA SER 2 12.867 17.149 -21.804
6 HB2 SER 2 1HB SER 2 11.999 15.712 -23.679
7 HB3 SER 2 2HB SER 2 12.061 14.338 -22.576
8 HG SER 2 HG SER 2 10.404 15.122 -21.470
9 H SER 3 H SER 3 14.963 16.280 -20.190
10 HA SER 3 HA SER 3 13.478 14.920 -18.045
11 HB2 SER 3 1HB SER 3 16.170 14.279 -19.159
12 HB3 SER 3 2HB SER 3 15.932 14.101 -17.421
13 HG SER 3 HG SER 3 15.421 12.170 -18.461
14 H GLY 4 H GLY 4 14.379 15.347 -15.867
15 HA2 GLY 4 1HA GLY 4 16.000 17.765 -15.640
16 HA3 GLY 4 2HA GLY 4 14.359 17.853 -15.017
17 H SER 5 H SER 5 14.926 18.136 -12.883
18 HA SER 5 HA SER 5 16.871 16.835 -11.434
19 HB2 SER 5 1HB SER 5 15.450 17.291 -9.429
20 HB3 SER 5 2HB SER 5 15.637 18.690 -10.486
21 HG SER 5 HG SER 5 13.545 17.643 -11.428
22 H SER 6 H SER 6 16.326 15.279 -9.536
23 HA SER 6 HA SER 6 14.850 12.993 -10.668
24 HB2 SER 6 1HB SER 6 17.439 12.907 -10.256
25 HB3 SER 6 2HB SER 6 16.971 12.663 -8.573
26 HG SER 6 HG SER 6 15.482 10.995 -9.714
27 H GLY 7 H GLY 7 12.914 12.893 -9.716
28 HA2 GLY 7 1HA GLY 7 12.213 13.961 -7.238
29 HA3 GLY 7 2HA GLY 7 11.321 12.699 -8.075
30 HA PRO 8 HA PRO 8 12.862 10.923 -4.094
31 HB2 PRO 8 1HB PRO 8 10.533 9.663 -3.494
32 HB3 PRO 8 2HB PRO 8 10.852 11.348 -3.065
33 HG2 PRO 8 1HG PRO 8 9.290 10.242 -5.367
34 HG3 PRO 8 2HG PRO 8 8.902 11.607 -4.304
35 HD2 PRO 8 1HD PRO 8 9.940 11.940 -6.782
36 HD3 PRO 8 2HD PRO 8 10.290 13.052 -5.443
37 H VAL 9 H VAL 9 13.684 8.903 -3.850
38 HA VAL 9 HA VAL 9 12.814 6.821 -5.742
39 HB VAL 9 HB VAL 9 15.204 6.048 -5.824
40 HG11 VAL 9 1HG1 VAL 9 15.257 7.065 -7.798
41 HG12 VAL 9 2HG1 VAL 9 13.895 8.058 -7.278
42 HG13 VAL 9 3HG1 VAL 9 15.547 8.627 -7.035
43 HG21 VAL 9 1HG2 VAL 9 16.389 6.985 -4.117
44 HG22 VAL 9 2HG2 VAL 9 16.779 8.136 -5.395
45 HG23 VAL 9 3HG2 VAL 9 15.529 8.522 -4.213
46 H ALA 10 H ALA 10 14.295 7.603 -2.644
47 HA ALA 10 HA ALA 10 14.828 5.174 -1.548
48 HB1 ALA 10 1HB ALA 10 14.751 6.175 0.514
49 HB2 ALA 10 2HB ALA 10 14.865 7.590 -0.533
50 HB3 ALA 10 3HB ALA 10 13.304 7.108 0.130
51 H GLY 11 H GLY 11 11.637 6.647 -1.942
52 HA2 GLY 11 1HA GLY 11 9.528 5.751 -1.821
53 HA3 GLY 11 2HA GLY 11 10.288 4.198 -2.141
54 HA PRO 12 HA PRO 12 8.793 4.786 2.399
55 HB2 PRO 12 1HB PRO 12 6.234 3.895 2.226
56 HB3 PRO 12 2HB PRO 12 6.670 5.601 2.068
57 HG2 PRO 12 1HG PRO 12 6.090 3.588 -0.070
58 HG3 PRO 12 2HG PRO 12 5.562 5.276 0.049
59 HD2 PRO 12 1HD PRO 12 7.629 4.504 -1.520
60 HD3 PRO 12 2HD PRO 12 7.573 6.092 -0.728
61 H TYR 13 H TYR 13 8.289 3.017 3.851
62 HA TYR 13 HA TYR 13 8.410 0.350 2.628
63 HB2 TYR 13 1HB TYR 13 10.647 0.553 3.217
64 HB3 TYR 13 2HB TYR 13 10.293 1.538 4.632
65 HD1 TYR 13 1HD TYR 13 9.456 -1.898 3.400
66 HD2 TYR 13 2HD TYR 13 10.711 0.535 6.657
67 HE1 TYR 13 1HE TYR 13 9.615 -3.897 4.824
68 HE2 TYR 13 2HE TYR 13 10.875 -1.458 8.089
69 HH TYR 13 HH TYR 13 11.179 -4.359 7.178
70 H ILE 14 H ILE 14 6.688 -0.738 3.281
71 HA ILE 14 HA ILE 14 5.049 0.017 5.444
72 HB ILE 14 HB ILE 14 5.147 -2.707 4.150
73 HG12 ILE 14 1HG1 ILE 14 3.229 -0.588 3.290
74 HG13 ILE 14 2HG1 ILE 14 4.883 -0.504 2.692
75 HG21 ILE 14 1HG2 ILE 14 3.752 -2.920 5.978
76 HG22 ILE 14 2HG2 ILE 14 3.172 -1.259 5.861
77 HG23 ILE 14 3HG2 ILE 14 2.619 -2.470 4.704
78 HD11 ILE 14 1HD1 ILE 14 2.963 -1.803 1.410
79 HD12 ILE 14 2HD1 ILE 14 4.645 -2.334 1.383
80 HD13 ILE 14 3HD1 ILE 14 3.494 -3.106 2.473
81 H THR 15 H THR 15 5.153 -0.413 7.549
82 HA THR 15 HA THR 15 6.974 -2.550 8.451
83 HB THR 15 HB THR 15 7.757 -1.267 10.224
84 HG1 THR 15 1HG THR 15 5.388 0.235 9.857
85 HG21 THR 15 1HG2 THR 15 7.860 -0.149 7.663
86 HG22 THR 15 2HG2 THR 15 8.933 0.197 9.019
87 HG23 THR 15 3HG2 THR 15 7.507 1.198 8.744
88 H PHE 16 H PHE 16 3.820 -1.665 8.228
89 HA PHE 16 HA PHE 16 3.061 -3.497 10.363
90 HB2 PHE 16 1HB PHE 16 3.027 -1.116 11.260
91 HB3 PHE 16 2HB PHE 16 1.709 -0.808 10.134
92 HD1 PHE 16 1HD PHE 16 2.719 -3.021 12.940
93 HD2 PHE 16 2HD PHE 16 -0.481 -1.289 10.733
94 HE1 PHE 16 1HE PHE 16 1.115 -3.891 14.590
95 HE2 PHE 16 2HE PHE 16 -2.091 -2.155 12.380
96 HZ PHE 16 HZ PHE 16 -1.293 -3.457 14.312
97 H THR 17 H THR 17 1.531 -4.852 9.693
98 HA THR 17 HA THR 17 -0.383 -3.999 7.655
99 HB THR 17 HB THR 17 0.033 -6.400 6.627
100 HG1 THR 17 1HG THR 17 2.082 -7.125 6.867
101 HG21 THR 17 1HG2 THR 17 2.157 -4.552 5.766
102 HG22 THR 17 2HG2 THR 17 0.535 -3.862 5.812
103 HG23 THR 17 3HG2 THR 17 0.856 -5.297 4.838
104 H ASP 18 H ASP 18 -2.272 -4.337 8.623
105 HA ASP 18 HA ASP 18 -2.808 -6.985 9.751
106 HB2 ASP 18 1HB ASP 18 -3.072 -4.360 11.175
107 HB3 ASP 18 2HB ASP 18 -4.176 -5.677 11.560
108 H ALA 19 H ALA 19 -4.846 -7.738 9.389
109 HA ALA 19 HA ALA 19 -6.438 -6.297 7.461
110 HB1 ALA 19 1HB ALA 19 -7.799 -8.311 7.372
111 HB2 ALA 19 2HB ALA 19 -6.085 -8.711 7.243
112 HB3 ALA 19 3HB ALA 19 -6.939 -8.970 8.764
113 H VAL 20 H VAL 20 -7.902 -4.839 8.028
114 HA VAL 20 HA VAL 20 -8.870 -4.588 10.705
115 HB VAL 20 HB VAL 20 -9.956 -3.205 8.253
116 HG11 VAL 20 1HG1 VAL 20 -10.099 -1.426 10.284
117 HG12 VAL 20 2HG1 VAL 20 -11.413 -2.510 9.824
118 HG13 VAL 20 3HG1 VAL 20 -10.341 -2.938 11.158
119 HG21 VAL 20 1HG2 VAL 20 -7.828 -2.075 10.037
120 HG22 VAL 20 2HG2 VAL 20 -7.414 -3.065 8.637
121 HG23 VAL 20 3HG2 VAL 20 -8.309 -1.562 8.419
122 H ASN 21 H ASN 21 -10.012 -6.124 7.810
123 HA ASN 21 HA ASN 21 -12.096 -7.461 9.238
124 HB2 ASN 21 1HB ASN 21 -12.753 -5.166 7.447
125 HB3 ASN 21 2HB ASN 21 -13.810 -6.575 7.410
126 HD21 ASN 21 1HD2 ASN 21 -14.479 -3.942 8.283
127 HD22 ASN 21 2HD2 ASN 21 -14.928 -4.054 9.948
128 H GLU 22 H GLU 22 -13.573 -8.622 7.446
129 HA GLU 22 HA GLU 22 -11.793 -10.314 6.019
130 HB2 GLU 22 1HB GLU 22 -13.708 -11.551 5.378
131 HB3 GLU 22 2HB GLU 22 -14.041 -10.956 6.998
132 HG2 GLU 22 1HG GLU 22 -14.988 -9.486 4.567
133 HG3 GLU 22 2HG GLU 22 -15.904 -10.824 5.258
134 H THR 23 H THR 23 -13.243 -7.340 5.268
135 HA THR 23 HA THR 23 -12.479 -7.665 2.444
136 HB THR 23 HB THR 23 -14.365 -6.053 1.895
137 HG1 THR 23 1HG THR 23 -15.794 -5.571 3.420
138 HG21 THR 23 1HG2 THR 23 -15.302 -7.920 1.122
139 HG22 THR 23 2HG2 THR 23 -15.967 -8.245 2.723
140 HG23 THR 23 3HG2 THR 23 -14.380 -8.875 2.282
141 H THR 24 H THR 24 -11.493 -6.312 5.095
142 HA THR 24 HA THR 24 -10.640 -3.843 3.757
143 HB THR 24 HB THR 24 -11.303 -3.798 6.687
144 HG1 THR 24 1HG THR 24 -13.233 -4.365 5.604
145 HG21 THR 24 1HG2 THR 24 -11.471 -1.401 6.309
146 HG22 THR 24 2HG2 THR 24 -11.205 -1.635 4.581
147 HG23 THR 24 3HG2 THR 24 -9.917 -1.998 5.729
148 H ILE 25 H ILE 25 -8.606 -3.065 4.375
149 HA ILE 25 HA ILE 25 -7.073 -4.627 6.310
150 HB ILE 25 HB ILE 25 -6.372 -4.362 3.398
151 HG12 ILE 25 1HG1 ILE 25 -6.447 -6.687 5.333
152 HG13 ILE 25 2HG1 ILE 25 -7.602 -6.363 4.044
153 HG21 ILE 25 1HG2 ILE 25 -4.327 -3.744 4.187
154 HG22 ILE 25 2HG2 ILE 25 -4.566 -4.534 5.745
155 HG23 ILE 25 3HG2 ILE 25 -4.162 -5.494 4.323
156 HD11 ILE 25 1HD1 ILE 25 -5.554 -6.535 2.487
157 HD12 ILE 25 2HD1 ILE 25 -4.790 -7.343 3.856
158 HD13 ILE 25 3HD1 ILE 25 -6.260 -8.010 3.147
159 H MET 26 H MET 26 -5.687 -3.414 7.460
160 HA MET 26 HA MET 26 -5.267 -0.636 6.577
161 HB2 MET 26 1HB MET 26 -6.484 -0.530 8.582
162 HB3 MET 26 2HB MET 26 -5.578 -1.850 9.308
163 HG2 MET 26 1HG MET 26 -3.818 -0.513 9.887
164 HG3 MET 26 2HG MET 26 -4.127 0.641 8.592
165 HE1 MET 26 1HE MET 26 -4.428 3.227 10.747
166 HE2 MET 26 2HE MET 26 -4.263 2.596 9.108
167 HE3 MET 26 3HE MET 26 -5.800 3.280 9.640
168 H LEU 27 H LEU 27 -3.265 -0.085 6.040
169 HA LEU 27 HA LEU 27 -1.017 -1.534 7.262
170 HB2 LEU 27 1HB LEU 27 0.020 -1.945 5.263
171 HB3 LEU 27 2HB LEU 27 -1.673 -2.146 4.814
172 HG LEU 27 HG LEU 27 -0.244 0.460 4.389
173 HD11 LEU 27 1HD1 LEU 27 -0.466 -1.135 2.003
174 HD12 LEU 27 2HD1 LEU 27 0.531 -1.945 3.210
175 HD13 LEU 27 3HD1 LEU 27 0.941 -0.314 2.680
176 HD21 LEU 27 1HD2 LEU 27 -2.069 1.068 3.219
177 HD22 LEU 27 2HD2 LEU 27 -2.859 -0.179 4.183
178 HD23 LEU 27 3HD2 LEU 27 -2.308 -0.546 2.548
179 H LYS 28 H LYS 28 0.724 -0.317 7.827
180 HA LYS 28 HA LYS 28 0.555 2.571 7.260
181 HB2 LYS 28 1HB LYS 28 1.599 1.160 9.720
182 HB3 LYS 28 2HB LYS 28 1.762 2.887 9.427
183 HG2 LYS 28 1HG LYS 28 -0.449 3.305 9.813
184 HG3 LYS 28 2HG LYS 28 -0.956 1.688 9.315
185 HD2 LYS 28 1HD LYS 28 -0.476 0.761 11.367
186 HD3 LYS 28 2HD LYS 28 0.727 1.992 11.760
187 HE2 LYS 28 1HE LYS 28 -1.151 3.639 11.941
188 HE3 LYS 28 2HE LYS 28 -2.272 2.289 11.765
189 HZ1 LYS 28 1HZ LYS 28 -2.142 2.162 13.973
190 HZ2 LYS 28 2HZ LYS 28 -0.747 3.115 14.057
191 HZ3 LYS 28 3HZ LYS 28 -0.622 1.458 13.740
192 H TRP 29 H TRP 29 2.320 3.588 6.469
193 HA TRP 29 HA TRP 29 4.747 1.957 6.100
194 HB2 TRP 29 1HB TRP 29 5.149 3.369 4.059
195 HB3 TRP 29 2HB TRP 29 3.733 2.326 3.959
196 HD1 TRP 29 HD TRP 29 4.717 6.016 4.252
197 HE1 TRP 29 1HE TRP 29 2.679 7.460 3.630
198 HE3 TRP 29 3HE TRP 29 1.193 2.330 3.885
199 HZ2 TRP 29 2HZ TRP 29 -0.061 7.085 3.059
200 HZ3 TRP 29 3HZ TRP 29 -1.113 2.957 3.297
201 HH2 TRP 29 HH TRP 29 -1.724 5.286 2.894
202 H MET 30 H MET 30 6.781 3.131 6.031
203 HA MET 30 HA MET 30 6.695 5.591 7.652
204 HB2 MET 30 1HB MET 30 8.685 4.935 8.758
205 HB3 MET 30 2HB MET 30 7.646 3.516 8.756
206 HG2 MET 30 1HG MET 30 8.892 2.556 6.928
207 HG3 MET 30 2HG MET 30 9.881 4.009 6.805
208 HE1 MET 30 1HE MET 30 11.956 4.119 9.890
209 HE2 MET 30 2HE MET 30 12.512 3.859 8.237
210 HE3 MET 30 3HE MET 30 11.169 4.959 8.553
211 H TYR 31 H TYR 31 8.635 7.002 7.370
212 HA TYR 31 HA TYR 31 9.703 6.878 4.632
213 HB2 TYR 31 1HB TYR 31 7.813 8.525 4.833
214 HB3 TYR 31 2HB TYR 31 8.793 9.423 5.986
215 HD1 TYR 31 2HD TYR 31 10.957 10.437 5.219
216 HD2 TYR 31 1HD TYR 31 8.154 8.747 2.501
217 HE1 TYR 31 2HE TYR 31 12.030 11.651 3.368
218 HE2 TYR 31 1HE TYR 31 9.220 9.956 0.642
219 HH TYR 31 HH TYR 31 11.140 11.077 0.035
220 H ILE 32 H ILE 32 11.830 7.280 4.442
221 HA ILE 32 HA ILE 32 13.270 8.079 6.882
222 HB ILE 32 HB ILE 32 14.286 6.509 4.511
223 HG12 ILE 32 1HG1 ILE 32 14.533 4.748 6.409
224 HG13 ILE 32 2HG1 ILE 32 13.356 5.739 7.262
225 HG21 ILE 32 1HG2 ILE 32 15.672 8.005 6.500
226 HG22 ILE 32 2HG2 ILE 32 15.987 6.290 6.756
227 HG23 ILE 32 3HG2 ILE 32 16.333 7.026 5.191
228 HD11 ILE 32 1HD1 ILE 32 12.498 5.196 4.566
229 HD12 ILE 32 2HD1 ILE 32 12.836 3.708 5.451
230 HD13 ILE 32 3HD1 ILE 32 11.684 4.877 6.097
231 HA PRO 33 HA PRO 33 14.017 11.808 4.473
232 HB2 PRO 33 1HB PRO 33 15.052 13.212 6.553
233 HB3 PRO 33 2HB PRO 33 13.315 12.993 6.312
234 HG2 PRO 33 1HG PRO 33 15.174 11.517 8.135
235 HG3 PRO 33 2HG PRO 33 13.539 12.123 8.456
236 HD2 PRO 33 1HD PRO 33 14.043 9.526 7.877
237 HD3 PRO 33 2HD PRO 33 12.534 10.334 7.405
238 H ALA 34 H ALA 34 16.208 9.837 6.297
239 HA ALA 34 HA ALA 34 18.635 11.089 6.001
240 HB1 ALA 34 1HB ALA 34 17.974 8.156 5.839
241 HB2 ALA 34 2HB ALA 34 19.619 8.785 5.927
242 HB3 ALA 34 3HB ALA 34 18.494 9.070 7.255
243 H SER 35 H SER 35 17.725 8.426 3.825
244 HA SER 35 HA SER 35 19.413 9.522 1.750
245 HB2 SER 35 1HB SER 35 19.416 7.111 2.108
246 HB3 SER 35 2HB SER 35 17.680 7.040 1.807
247 HG SER 35 HG SER 35 19.792 7.389 0.014
248 H ASN 36 H ASN 36 17.407 11.301 2.278
249 HA ASN 36 HA ASN 36 15.625 11.023 -0.053
250 HB2 ASN 36 1HB ASN 36 14.326 11.026 1.988
251 HB3 ASN 36 2HB ASN 36 15.153 12.472 2.559
252 HD21 ASN 36 1HD2 ASN 36 13.526 13.890 2.672
253 HD22 ASN 36 2HD2 ASN 36 12.532 14.360 1.339
254 H ASN 37 H ASN 37 15.096 12.990 -1.197
255 HA ASN 37 HA ASN 37 17.369 14.833 -1.249
256 HB2 ASN 37 1HB ASN 37 16.367 13.558 -3.313
257 HB3 ASN 37 2HB ASN 37 15.174 14.854 -3.290
258 HD21 ASN 37 1HD2 ASN 37 15.907 15.583 -5.301
259 HD22 ASN 37 2HD2 ASN 37 17.381 16.469 -5.460
260 H ASN 38 H ASN 38 15.060 14.884 0.693
261 HA ASN 38 HA ASN 38 13.632 16.378 1.661
262 HB2 ASN 38 1HB ASN 38 15.987 17.491 1.698
263 HB3 ASN 38 2HB ASN 38 15.311 18.573 0.483
264 HD21 ASN 38 1HD2 ASN 38 15.168 20.416 1.613
265 HD22 ASN 38 2HD2 ASN 38 14.224 20.619 3.046
266 H THR 39 H THR 39 12.628 15.498 -0.725
267 HA THR 39 HA THR 39 11.563 17.910 -2.030
268 HB THR 39 HB THR 39 12.719 16.054 -3.396
269 HG1 THR 39 1HG THR 39 10.076 16.868 -4.099
270 HG21 THR 39 1HG2 THR 39 10.014 14.749 -3.135
271 HG22 THR 39 2HG2 THR 39 11.430 14.224 -2.224
272 HG23 THR 39 3HG2 THR 39 11.434 14.141 -3.985
273 HA PRO 40 HA PRO 40 7.664 17.184 -0.090
274 HB2 PRO 40 1HB PRO 40 6.137 18.725 -1.722
275 HB3 PRO 40 2HB PRO 40 7.226 19.401 -0.505
276 HG2 PRO 40 1HG PRO 40 7.650 19.069 -3.449
277 HG3 PRO 40 2HG PRO 40 8.048 20.450 -2.411
278 HD2 PRO 40 1HD PRO 40 9.900 18.640 -3.201
279 HD3 PRO 40 2HD PRO 40 9.982 19.468 -1.633
280 H ILE 41 H ILE 41 6.149 15.643 -0.273
281 HA ILE 41 HA ILE 41 5.832 14.330 -2.876
282 HB ILE 41 HB ILE 41 4.803 13.256 -0.265
283 HG12 ILE 41 1HG1 ILE 41 7.583 12.974 -1.421
284 HG13 ILE 41 2HG1 ILE 41 7.149 13.701 0.122
285 HG21 ILE 41 1HG2 ILE 41 4.135 12.317 -2.534
286 HG22 ILE 41 2HG2 ILE 41 5.800 11.750 -2.664
287 HG23 ILE 41 3HG2 ILE 41 4.771 11.173 -1.352
288 HD11 ILE 41 1HD1 ILE 41 7.722 10.969 -0.505
289 HD12 ILE 41 2HD1 ILE 41 7.494 11.735 1.068
290 HD13 ILE 41 3HD1 ILE 41 6.104 11.109 0.182
291 H HIS 42 H HIS 42 3.869 14.078 -3.857
292 HA HIS 42 HA HIS 42 1.808 15.934 -3.134
293 HB2 HIS 42 1HB HIS 42 2.230 13.977 -5.358
294 HB3 HIS 42 2HB HIS 42 0.616 14.629 -5.088
295 HD1 HIS 42 1HD HIS 42 0.988 15.708 -7.515
296 HD2 HIS 42 2HD HIS 42 3.357 17.224 -4.458
297 HE1 HIS 42 1HE HIS 42 1.885 17.893 -8.380
298 HE2 HIS 42 2HE HIS 42 3.384 18.749 -6.546
299 H GLY 43 H GLY 43 2.145 12.406 -3.115
300 HA2 GLY 43 1HA GLY 43 0.296 12.153 -0.948
301 HA3 GLY 43 2HA GLY 43 -0.413 11.630 -2.468
302 H PHE 44 H PHE 44 -0.585 9.481 -1.873
303 HA PHE 44 HA PHE 44 1.891 7.973 -2.074
304 HB2 PHE 44 1HB PHE 44 0.100 7.917 0.346
305 HB3 PHE 44 2HB PHE 44 1.118 6.544 -0.077
306 HD1 PHE 44 2HD PHE 44 3.645 7.291 -0.647
307 HD2 PHE 44 1HD PHE 44 0.939 9.369 1.898
308 HE1 PHE 44 2HE PHE 44 5.545 8.344 0.508
309 HE2 PHE 44 1HE PHE 44 2.834 10.426 3.056
310 HZ PHE 44 HZ PHE 44 5.141 9.913 2.363
311 H TYR 45 H TYR 45 1.594 6.310 -3.398
312 HA TYR 45 HA TYR 45 -1.143 5.500 -4.039
313 HB2 TYR 45 1HB TYR 45 1.480 5.338 -5.467
314 HB3 TYR 45 2HB TYR 45 0.206 4.200 -5.891
315 HD1 TYR 45 2HD TYR 45 -2.206 5.843 -5.697
316 HD2 TYR 45 1HD TYR 45 1.634 6.825 -7.244
317 HE1 TYR 45 2HE TYR 45 -3.234 7.534 -7.157
318 HE2 TYR 45 1HE TYR 45 0.617 8.520 -8.708
319 HH TYR 45 HH TYR 45 -1.722 9.953 -8.514
320 H ILE 46 H ILE 46 -1.889 3.434 -3.814
321 HA ILE 46 HA ILE 46 -0.063 1.464 -2.610
322 HB ILE 46 HB ILE 46 -2.911 1.987 -1.747
323 HG12 ILE 46 1HG1 ILE 46 -0.553 2.164 0.077
324 HG13 ILE 46 2HG1 ILE 46 -0.858 3.502 -1.026
325 HG21 ILE 46 1HG2 ILE 46 -2.247 -0.404 -1.731
326 HG22 ILE 46 2HG2 ILE 46 -0.927 0.009 -0.637
327 HG23 ILE 46 3HG2 ILE 46 -2.599 0.238 -0.127
328 HD11 ILE 46 1HD1 ILE 46 -3.272 3.373 -0.058
329 HD12 ILE 46 2HD1 ILE 46 -2.476 2.538 1.276
330 HD13 ILE 46 3HD1 ILE 46 -1.989 4.177 0.845
331 H TYR 47 H TYR 47 0.075 -0.252 -3.881
332 HA TYR 47 HA TYR 47 -2.169 -0.908 -5.651
333 HB2 TYR 47 1HB TYR 47 0.699 -1.870 -5.714
334 HB3 TYR 47 2HB TYR 47 -0.541 -2.269 -6.898
335 HD1 TYR 47 2HD TYR 47 0.966 0.777 -5.330
336 HD2 TYR 47 1HD TYR 47 -0.532 -1.065 -8.861
337 HE1 TYR 47 2HE TYR 47 1.565 2.781 -6.623
338 HE2 TYR 47 1HE TYR 47 0.064 0.934 -10.164
339 HH TYR 47 HH TYR 47 1.405 2.843 -10.097
340 H TYR 48 H TYR 48 -2.941 -3.049 -5.830
341 HA TYR 48 HA TYR 48 -2.044 -5.086 -4.007
342 HB2 TYR 48 1HB TYR 48 -4.401 -5.286 -2.996
343 HB3 TYR 48 2HB TYR 48 -3.354 -4.012 -2.380
344 HD1 TYR 48 2HD TYR 48 -3.748 -1.656 -3.060
345 HD2 TYR 48 1HD TYR 48 -6.436 -4.775 -4.129
346 HE1 TYR 48 2HE TYR 48 -5.477 0.017 -3.571
347 HE2 TYR 48 1HE TYR 48 -8.172 -3.111 -4.644
348 HH TYR 48 HH TYR 48 -8.114 -0.020 -3.631
349 H ARG 49 H ARG 49 -2.832 -7.131 -4.518
350 HA ARG 49 HA ARG 49 -4.952 -7.518 -6.402
351 HB2 ARG 49 1HB ARG 49 -3.662 -8.416 -8.230
352 HB3 ARG 49 2HB ARG 49 -3.099 -6.785 -7.890
353 HG2 ARG 49 1HG ARG 49 -1.099 -7.836 -8.114
354 HG3 ARG 49 2HG ARG 49 -1.358 -8.081 -6.386
355 HD2 ARG 49 1HD ARG 49 -2.591 -10.257 -7.256
356 HD3 ARG 49 2HD ARG 49 -1.514 -10.021 -8.632
357 HE ARG 49 HE ARG 49 -0.224 -9.945 -6.049
358 HH11 ARG 49 1HH1 ARG 49 -1.199 -11.910 -8.752
359 HH12 ARG 49 2HH1 ARG 49 -0.036 -13.154 -8.435
360 HH21 ARG 49 1HH2 ARG 49 1.312 -11.576 -5.620
361 HH22 ARG 49 2HH2 ARG 49 1.391 -12.964 -6.653
362 HA PRO 50 HA PRO 50 -4.996 -11.382 -4.295
363 HB2 PRO 50 1HB PRO 50 -6.536 -12.798 -6.026
364 HB3 PRO 50 2HB PRO 50 -7.189 -11.548 -4.961
365 HG2 PRO 50 1HG PRO 50 -6.459 -11.376 -7.859
366 HG3 PRO 50 2HG PRO 50 -7.882 -10.727 -7.023
367 HD2 PRO 50 1HD PRO 50 -5.750 -9.191 -7.676
368 HD3 PRO 50 2HD PRO 50 -6.735 -8.891 -6.230
369 H THR 51 H THR 51 -3.951 -13.338 -4.290
370 HA THR 51 HA THR 51 -1.718 -13.729 -5.872
371 HB THR 51 HB THR 51 -2.409 -14.888 -3.651
372 HG1 THR 51 1HG THR 51 -0.557 -15.810 -4.057
373 HG21 THR 51 1HG2 THR 51 -4.341 -16.023 -5.166
374 HG22 THR 51 2HG2 THR 51 -3.696 -16.747 -3.693
375 HG23 THR 51 3HG2 THR 51 -3.088 -17.259 -5.267
376 H ASP 52 H ASP 52 -5.025 -14.634 -6.464
377 HA ASP 52 HA ASP 52 -4.545 -16.565 -8.483
378 HB2 ASP 52 1HB ASP 52 -6.696 -16.627 -7.540
379 HB3 ASP 52 2HB ASP 52 -6.924 -14.890 -7.722
380 H SER 53 H SER 53 -4.737 -13.080 -8.475
381 HA SER 53 HA SER 53 -5.293 -12.293 -10.964
382 HB2 SER 53 1HB SER 53 -2.981 -11.435 -9.228
383 HB3 SER 53 2HB SER 53 -3.341 -10.640 -10.760
384 HG SER 53 HG SER 53 -5.613 -10.646 -9.649
385 H ASP 54 H ASP 54 -4.224 -12.053 -12.964
386 HA ASP 54 HA ASP 54 -2.514 -14.285 -13.625
387 HB2 ASP 54 1HB ASP 54 -4.466 -13.186 -15.023
388 HB3 ASP 54 2HB ASP 54 -3.176 -12.127 -15.587
389 H ASN 55 H ASN 55 -2.283 -10.747 -14.034
390 HA ASN 55 HA ASN 55 0.563 -10.879 -13.449
391 HB2 ASN 55 1HB ASN 55 -0.271 -9.422 -15.940
392 HB3 ASN 55 2HB ASN 55 1.333 -9.972 -15.465
393 HD21 ASN 55 1HD2 ASN 55 -1.366 -10.620 -17.324
394 HD22 ASN 55 2HD2 ASN 55 -1.004 -12.254 -17.751
395 H ASP 56 H ASP 56 1.481 -8.519 -13.637
396 HA ASP 56 HA ASP 56 0.389 -6.959 -11.681
397 HB2 ASP 56 1HB ASP 56 1.625 -5.030 -12.773
398 HB3 ASP 56 2HB ASP 56 2.591 -6.461 -12.426
399 H SER 57 H SER 57 -0.723 -7.323 -14.911
400 HA SER 57 HA SER 57 -2.013 -4.952 -15.451
401 HB2 SER 57 1HB SER 57 -1.892 -6.875 -17.012
402 HB3 SER 57 2HB SER 57 -3.083 -7.726 -16.028
403 HG SER 57 HG SER 57 -3.408 -5.576 -17.764
404 H ASP 58 H ASP 58 -2.657 -7.162 -12.940
405 HA ASP 58 HA ASP 58 -5.400 -6.263 -12.553
406 HB2 ASP 58 1HB ASP 58 -3.708 -8.209 -10.969
407 HB3 ASP 58 2HB ASP 58 -5.407 -7.862 -10.660
408 H TYR 59 H TYR 59 -2.256 -6.067 -10.939
409 HA TYR 59 HA TYR 59 -2.716 -4.940 -8.568
410 HB2 TYR 59 1HB TYR 59 -0.672 -4.371 -10.651
411 HB3 TYR 59 2HB TYR 59 -0.772 -3.251 -9.297
412 HD1 TYR 59 1HD TYR 59 -1.356 -4.961 -7.030
413 HD2 TYR 59 2HD TYR 59 1.221 -5.667 -10.340
414 HE1 TYR 59 1HE TYR 59 -0.020 -6.501 -5.654
415 HE2 TYR 59 2HE TYR 59 2.563 -7.210 -8.974
416 HH TYR 59 HH TYR 59 1.576 -8.583 -6.244
417 H LYS 60 H LYS 60 -3.932 -3.360 -7.793
418 HA LYS 60 HA LYS 60 -4.981 -1.332 -9.605
419 HB2 LYS 60 1HB LYS 60 -5.745 -2.364 -6.908
420 HB3 LYS 60 2HB LYS 60 -6.253 -0.743 -7.363
421 HG2 LYS 60 1HG LYS 60 -7.462 -1.582 -9.250
422 HG3 LYS 60 2HG LYS 60 -6.822 -3.207 -8.994
423 HD2 LYS 60 1HD LYS 60 -8.957 -3.318 -8.072
424 HD3 LYS 60 2HD LYS 60 -7.923 -3.037 -6.669
425 HE2 LYS 60 1HE LYS 60 -8.481 -0.695 -6.668
426 HE3 LYS 60 2HE LYS 60 -9.382 -0.869 -8.173
427 HZ1 LYS 60 1HZ LYS 60 -10.746 -0.802 -6.089
428 HZ2 LYS 60 2HZ LYS 60 -10.106 -2.315 -5.690
429 HZ3 LYS 60 3HZ LYS 60 -11.035 -2.133 -7.092
430 H LYS 61 H LYS 61 -5.422 0.835 -8.157
431 HA LYS 61 HA LYS 61 -2.962 1.609 -6.791
432 HB2 LYS 61 1HB LYS 61 -2.732 2.112 -9.261
433 HB3 LYS 61 2HB LYS 61 -4.052 3.259 -9.072
434 HG2 LYS 61 1HG LYS 61 -2.779 4.652 -7.668
435 HG3 LYS 61 2HG LYS 61 -1.548 3.411 -7.423
436 HD2 LYS 61 1HD LYS 61 -0.582 4.905 -8.948
437 HD3 LYS 61 2HD LYS 61 -1.151 3.564 -9.945
438 HE2 LYS 61 1HE LYS 61 -2.876 4.794 -10.848
439 HE3 LYS 61 2HE LYS 61 -2.951 5.896 -9.474
440 HZ1 LYS 61 1HZ LYS 61 -0.436 6.149 -10.682
441 HZ2 LYS 61 2HZ LYS 61 -1.667 7.303 -10.573
442 HZ3 LYS 61 3HZ LYS 61 -1.609 6.252 -11.898
443 H ASP 62 H ASP 62 -3.384 2.831 -5.067
444 HA ASP 62 HA ASP 62 -5.930 4.308 -4.985
445 HB2 ASP 62 1HB ASP 62 -4.792 2.367 -3.033
446 HB3 ASP 62 2HB ASP 62 -5.647 3.766 -2.391
447 H MET 63 H MET 63 -5.468 6.403 -4.963
448 HA MET 63 HA MET 63 -2.944 7.408 -4.045
449 HB2 MET 63 1HB MET 63 -4.593 8.309 -5.904
450 HB3 MET 63 2HB MET 63 -5.273 9.206 -4.554
451 HG2 MET 63 1HG MET 63 -2.774 9.867 -4.137
452 HG3 MET 63 2HG MET 63 -2.602 9.445 -5.839
453 HE1 MET 63 1HE MET 63 -3.349 12.739 -3.679
454 HE2 MET 63 2HE MET 63 -5.091 12.738 -3.952
455 HE3 MET 63 3HE MET 63 -4.316 11.347 -3.192
456 H VAL 64 H VAL 64 -2.474 8.525 -2.199
457 HA VAL 64 HA VAL 64 -4.633 8.954 -0.257
458 HB VAL 64 HB VAL 64 -1.972 7.773 0.531
459 HG11 VAL 64 1HG1 VAL 64 -3.142 7.299 2.644
460 HG12 VAL 64 2HG1 VAL 64 -3.083 9.026 2.286
461 HG13 VAL 64 3HG1 VAL 64 -4.573 8.119 2.020
462 HG21 VAL 64 1HG2 VAL 64 -2.738 5.880 -0.404
463 HG22 VAL 64 2HG2 VAL 64 -3.790 5.806 1.009
464 HG23 VAL 64 3HG2 VAL 64 -4.393 6.480 -0.505
465 H GLU 65 H GLU 65 -4.230 10.586 1.292
466 HA GLU 65 HA GLU 65 -3.011 12.881 0.398
467 HB2 GLU 65 1HB GLU 65 -3.068 12.346 3.339
468 HB3 GLU 65 2HB GLU 65 -3.475 13.816 2.466
469 HG2 GLU 65 1HG GLU 65 -5.122 11.347 2.848
470 HG3 GLU 65 2HG GLU 65 -5.511 13.014 3.265
471 H GLY 66 H GLY 66 -1.052 13.924 0.782
472 HA2 GLY 66 1HA GLY 66 1.228 12.225 0.927
473 HA3 GLY 66 2HA GLY 66 1.246 13.981 0.872
474 H ASP 67 H ASP 67 -0.442 14.235 3.257
475 HA ASP 67 HA ASP 67 1.673 14.062 5.211
476 HB2 ASP 67 1HB ASP 67 0.357 16.050 5.277
477 HB3 ASP 67 2HB ASP 67 -1.147 15.133 5.311
478 H ARG 68 H ARG 68 -0.964 12.129 4.242
479 HA ARG 68 HA ARG 68 -1.309 10.807 6.790
480 HB2 ARG 68 1HB ARG 68 -3.095 11.166 4.954
481 HB3 ARG 68 2HB ARG 68 -2.345 9.788 4.160
482 HG2 ARG 68 1HG ARG 68 -4.002 8.748 5.334
483 HG3 ARG 68 2HG ARG 68 -2.679 8.654 6.499
484 HD2 ARG 68 1HD ARG 68 -4.519 11.006 6.536
485 HD3 ARG 68 2HD ARG 68 -5.044 9.479 7.246
486 HE ARG 68 HE ARG 68 -2.530 10.023 8.278
487 HH11 ARG 68 1HH1 ARG 68 -5.699 11.463 8.307
488 HH12 ARG 68 2HH1 ARG 68 -5.494 12.197 9.863
489 HH21 ARG 68 1HH2 ARG 68 -2.248 10.984 10.327
490 HH22 ARG 68 2HH2 ARG 68 -3.530 11.925 11.011
491 H TYR 69 H TYR 69 -0.337 8.990 7.462
492 HA TYR 69 HA TYR 69 1.484 7.646 5.575
493 HB2 TYR 69 1HB TYR 69 1.737 8.366 8.455
494 HB3 TYR 69 2HB TYR 69 2.496 6.873 7.916
495 HD1 TYR 69 2HD TYR 69 2.147 10.091 6.080
496 HD2 TYR 69 1HD TYR 69 4.782 7.353 7.995
497 HE1 TYR 69 2HE TYR 69 4.074 11.375 5.252
498 HE2 TYR 69 1HE TYR 69 6.716 8.630 7.173
499 HH TYR 69 HH TYR 69 7.053 11.193 6.444
500 H TRP 70 H TRP 70 -1.451 7.204 6.486
501 HA TRP 70 HA TRP 70 -1.185 4.302 6.674
502 HB2 TRP 70 1HB TRP 70 -2.740 4.106 8.510
503 HB3 TRP 70 2HB TRP 70 -1.428 5.174 9.000
504 HD1 TRP 70 HD TRP 70 -2.030 7.678 9.561
505 HE1 TRP 70 1HE TRP 70 -4.260 8.925 9.870
506 HE3 TRP 70 3HE TRP 70 -5.196 4.175 7.601
507 HZ2 TRP 70 2HZ TRP 70 -6.999 8.482 9.352
508 HZ3 TRP 70 3HZ TRP 70 -7.607 4.664 7.546
509 HH2 TRP 70 HH TRP 70 -8.488 6.773 8.404
510 H HIS 71 H HIS 71 -2.964 3.148 5.872
511 HA HIS 71 HA HIS 71 -5.276 4.584 4.884
512 HB2 HIS 71 1HB HIS 71 -3.712 4.934 3.053
513 HB3 HIS 71 2HB HIS 71 -3.355 3.211 2.992
514 HD1 HIS 71 1HD HIS 71 -6.165 5.637 2.289
515 HD2 HIS 71 2HD HIS 71 -5.058 1.724 1.438
516 HE1 HIS 71 1HE HIS 71 -7.818 4.828 0.575
517 HE2 HIS 71 2HE HIS 71 -7.180 2.431 0.139
518 H SER 72 H SER 72 -7.039 3.264 4.494
519 HA SER 72 HA SER 72 -6.658 0.425 5.190
520 HB2 SER 72 1HB SER 72 -8.995 0.496 6.056
521 HB3 SER 72 2HB SER 72 -7.905 1.574 6.927
522 HG SER 72 HG SER 72 -9.938 2.204 5.088
523 H ILE 73 H ILE 73 -6.694 -0.684 3.336
524 HA ILE 73 HA ILE 73 -8.169 0.118 1.037
525 HB ILE 73 HB ILE 73 -7.023 -2.619 1.583
526 HG12 ILE 73 1HG1 ILE 73 -5.595 -0.435 0.092
527 HG13 ILE 73 2HG1 ILE 73 -5.454 -0.565 1.842
528 HG21 ILE 73 1HG2 ILE 73 -8.588 -2.381 -0.334
529 HG22 ILE 73 2HG2 ILE 73 -7.489 -1.190 -1.028
530 HG23 ILE 73 3HG2 ILE 73 -6.956 -2.856 -0.804
531 HD11 ILE 73 1HD1 ILE 73 -3.594 -1.661 0.801
532 HD12 ILE 73 2HD1 ILE 73 -4.628 -2.873 1.560
533 HD13 ILE 73 3HD1 ILE 73 -4.675 -2.642 -0.188
534 H SER 74 H SER 74 -9.975 -0.873 0.084
535 HA SER 74 HA SER 74 -11.530 -2.684 1.795
536 HB2 SER 74 1HB SER 74 -12.903 -0.443 0.337
537 HB3 SER 74 2HB SER 74 -13.477 -1.390 1.710
538 HG SER 74 HG SER 74 -12.429 -0.115 3.041
539 H HIS 75 H HIS 75 -13.599 -3.366 0.472
540 HA HIS 75 HA HIS 75 -14.417 -4.582 -1.268
541 HB2 HIS 75 1HB HIS 75 -12.756 -2.570 -2.782
542 HB3 HIS 75 2HB HIS 75 -13.743 -3.783 -3.593
543 HD1 HIS 75 1HD HIS 75 -15.735 -2.608 -4.461
544 HD2 HIS 75 2HD HIS 75 -14.750 -1.350 -0.626
545 HE1 HIS 75 1HE HIS 75 -17.543 -0.991 -3.799
546 HE2 HIS 75 2HE HIS 75 -16.881 -0.179 -1.509
547 H LEU 76 H LEU 76 -12.417 -5.821 0.071
548 HA LEU 76 HA LEU 76 -10.751 -7.030 -2.034
549 HB2 LEU 76 1HB LEU 76 -10.255 -7.258 0.917
550 HB3 LEU 76 2HB LEU 76 -9.137 -7.572 -0.409
551 HG LEU 76 HG LEU 76 -10.171 -4.801 -0.001
552 HD11 LEU 76 1HD1 LEU 76 -9.441 -4.896 2.131
553 HD12 LEU 76 2HD1 LEU 76 -7.865 -4.689 1.367
554 HD13 LEU 76 3HD1 LEU 76 -8.413 -6.299 1.835
555 HD21 LEU 76 1HD2 LEU 76 -8.738 -4.448 -1.657
556 HD22 LEU 76 2HD2 LEU 76 -8.199 -6.126 -1.600
557 HD23 LEU 76 3HD2 LEU 76 -7.423 -4.915 -0.579
558 H GLN 77 H GLN 77 -10.053 -9.380 -1.137
559 HA GLN 77 HA GLN 77 -12.589 -10.820 -0.882
560 HB2 GLN 77 1HB GLN 77 -9.872 -11.960 -1.538
561 HB3 GLN 77 2HB GLN 77 -11.432 -12.746 -1.735
562 HG2 GLN 77 1HG GLN 77 -10.787 -12.087 -3.885
563 HG3 GLN 77 2HG GLN 77 -11.998 -10.910 -3.379
564 HE21 GLN 77 1HE2 GLN 77 -8.485 -11.378 -3.137
565 HE22 GLN 77 2HE2 GLN 77 -8.069 -9.751 -3.542
566 HA PRO 78 HA PRO 78 -11.782 -11.863 3.323
567 HB2 PRO 78 1HB PRO 78 -13.438 -14.004 3.527
568 HB3 PRO 78 2HB PRO 78 -14.025 -12.338 3.471
569 HG2 PRO 78 1HG PRO 78 -13.873 -14.368 1.276
570 HG3 PRO 78 2HG PRO 78 -15.182 -13.237 1.665
571 HD2 PRO 78 1HD PRO 78 -13.406 -12.780 -0.326
572 HD3 PRO 78 2HD PRO 78 -14.133 -11.469 0.624
573 H GLU 79 H GLU 79 -10.713 -13.409 4.594
574 HA GLU 79 HA GLU 79 -8.858 -14.779 4.811
575 HB2 GLU 79 1HB GLU 79 -9.623 -17.201 4.153
576 HB3 GLU 79 2HB GLU 79 -10.392 -16.358 5.491
577 HG2 GLU 79 1HG GLU 79 -12.233 -15.706 4.026
578 HG3 GLU 79 2HG GLU 79 -11.463 -16.551 2.684
579 H THR 80 H THR 80 -8.643 -13.328 2.409
580 HA THR 80 HA THR 80 -7.541 -15.326 0.547
581 HB THR 80 HB THR 80 -8.247 -12.453 -0.072
582 HG1 THR 80 1HG THR 80 -10.167 -13.513 0.279
583 HG21 THR 80 1HG2 THR 80 -7.836 -14.704 -2.021
584 HG22 THR 80 2HG2 THR 80 -6.495 -13.704 -1.462
585 HG23 THR 80 3HG2 THR 80 -7.843 -12.968 -2.327
586 H SER 81 H SER 81 -5.448 -15.602 1.046
587 HA SER 81 HA SER 81 -3.803 -13.470 2.039
588 HB2 SER 81 1HB SER 81 -3.654 -16.088 2.421
589 HB3 SER 81 2HB SER 81 -2.619 -16.008 0.995
590 HG SER 81 HG SER 81 -2.278 -14.636 3.454
591 H TYR 82 H TYR 82 -3.275 -11.873 0.684
592 HA TYR 82 HA TYR 82 -2.012 -12.605 -1.865
593 HB2 TYR 82 1HB TYR 82 -3.093 -10.537 -2.856
594 HB3 TYR 82 2HB TYR 82 -4.175 -11.890 -2.544
595 HD1 TYR 82 1HD TYR 82 -3.018 -8.648 -1.140
596 HD2 TYR 82 2HD TYR 82 -6.073 -11.609 -1.198
597 HE1 TYR 82 1HE TYR 82 -4.464 -7.173 0.195
598 HE2 TYR 82 2HE TYR 82 -7.528 -10.141 0.137
599 HH TYR 82 HH TYR 82 -7.061 -6.934 0.509
600 H ASP 83 H ASP 83 -0.517 -11.029 -2.685
601 HA ASP 83 HA ASP 83 1.014 -9.795 -0.602
602 HB2 ASP 83 1HB ASP 83 1.311 -9.957 -3.595
603 HB3 ASP 83 2HB ASP 83 2.397 -8.978 -2.613
604 H ILE 84 H ILE 84 1.571 -7.570 -0.446
605 HA ILE 84 HA ILE 84 -0.147 -5.678 -1.867
606 HB ILE 84 HB ILE 84 0.081 -5.769 1.143
607 HG12 ILE 84 1HG1 ILE 84 -2.465 -5.901 -0.443
608 HG13 ILE 84 2HG1 ILE 84 -1.521 -7.358 -0.157
609 HG21 ILE 84 1HG2 ILE 84 -1.853 -3.918 0.462
610 HG22 ILE 84 2HG2 ILE 84 -0.224 -3.564 1.036
611 HG23 ILE 84 3HG2 ILE 84 -0.556 -3.616 -0.695
612 HD11 ILE 84 1HD1 ILE 84 -3.266 -5.876 1.633
613 HD12 ILE 84 2HD1 ILE 84 -2.714 -7.550 1.707
614 HD13 ILE 84 3HD1 ILE 84 -1.697 -6.258 2.343
615 H LYS 85 H LYS 85 0.838 -3.794 -2.347
616 HA LYS 85 HA LYS 85 3.255 -3.014 -0.911
617 HB2 LYS 85 1HB LYS 85 4.663 -2.955 -2.777
618 HB3 LYS 85 2HB LYS 85 3.805 -4.479 -2.958
619 HG2 LYS 85 1HG LYS 85 2.278 -3.420 -4.555
620 HG3 LYS 85 2HG LYS 85 3.169 -1.905 -4.388
621 HD2 LYS 85 1HD LYS 85 4.199 -2.740 -6.246
622 HD3 LYS 85 2HD LYS 85 5.217 -3.471 -5.003
623 HE2 LYS 85 1HE LYS 85 3.585 -5.449 -5.117
624 HE3 LYS 85 2HE LYS 85 3.031 -4.732 -6.629
625 HZ1 LYS 85 1HZ LYS 85 5.282 -4.872 -7.484
626 HZ2 LYS 85 2HZ LYS 85 4.736 -6.400 -7.008
627 HZ3 LYS 85 3HZ LYS 85 5.823 -5.548 -6.031
628 H MET 86 H MET 86 4.085 -0.848 -1.930
629 HA MET 86 HA MET 86 1.993 0.809 -3.045
630 HB2 MET 86 1HB MET 86 2.104 2.472 -1.207
631 HB3 MET 86 2HB MET 86 1.401 0.939 -0.707
632 HG2 MET 86 1HG MET 86 3.345 0.318 0.471
633 HG3 MET 86 2HG MET 86 4.292 1.609 -0.266
634 HE1 MET 86 1HE MET 86 3.198 4.027 -0.240
635 HE2 MET 86 2HE MET 86 1.528 3.965 0.323
636 HE3 MET 86 3HE MET 86 2.754 4.787 1.288
637 H GLN 87 H GLN 87 2.871 3.214 -3.033
638 HA GLN 87 HA GLN 87 5.696 3.554 -3.105
639 HB2 GLN 87 1HB GLN 87 5.673 2.338 -5.138
640 HB3 GLN 87 2HB GLN 87 4.221 3.156 -5.700
641 HG2 GLN 87 1HG GLN 87 6.686 4.749 -5.192
642 HG3 GLN 87 2HG GLN 87 6.563 3.782 -6.661
643 HE21 GLN 87 1HE2 GLN 87 6.660 5.783 -7.812
644 HE22 GLN 87 2HE2 GLN 87 5.242 6.754 -7.989
645 H CYS 88 H CYS 88 6.291 5.701 -3.283
646 HA CYS 88 HA CYS 88 4.083 7.597 -3.077
647 HB2 CYS 88 1HB CYS 88 5.586 9.068 -2.018
648 HB3 CYS 88 2HB CYS 88 6.036 7.475 -1.420
649 HG CYS 88 HG CYS 88 8.337 7.228 -2.827
650 H PHE 89 H PHE 89 4.052 9.573 -4.259
651 HA PHE 89 HA PHE 89 5.819 9.862 -6.536
652 HB2 PHE 89 1HB PHE 89 4.188 9.698 -8.238
653 HB3 PHE 89 2HB PHE 89 3.919 8.292 -7.213
654 HD1 PHE 89 1HD PHE 89 2.184 8.722 -5.246
655 HD2 PHE 89 2HD PHE 89 2.358 10.908 -8.893
656 HE1 PHE 89 1HE PHE 89 -0.170 9.378 -4.960
657 HE2 PHE 89 2HE PHE 89 0.004 11.569 -8.614
658 HZ PHE 89 HZ PHE 89 -1.263 10.804 -6.645
659 H ASN 90 H ASN 90 5.681 11.925 -7.538
660 HA ASN 90 HA ASN 90 3.808 13.902 -6.751
661 HB2 ASN 90 1HB ASN 90 4.921 15.138 -5.161
662 HB3 ASN 90 2HB ASN 90 5.466 13.522 -4.721
663 HD21 ASN 90 1HD2 ASN 90 7.496 12.824 -5.927
664 HD22 ASN 90 2HD2 ASN 90 8.755 14.002 -6.033
665 H GLU 91 H GLU 91 4.936 16.211 -7.250
666 HA GLU 91 HA GLU 91 5.212 16.465 -9.930
667 HB2 GLU 91 1HB GLU 91 6.536 18.553 -9.477
668 HB3 GLU 91 2HB GLU 91 5.027 18.427 -8.585
669 HG2 GLU 91 1HG GLU 91 6.182 17.826 -6.582
670 HG3 GLU 91 2HG GLU 91 7.713 17.702 -7.445
671 H GLY 92 H GLY 92 7.714 15.507 -7.665
672 HA2 GLY 92 1HA GLY 92 9.935 15.762 -9.383
673 HA3 GLY 92 2HA GLY 92 9.843 14.708 -7.979
674 H GLY 93 H GLY 93 7.885 12.938 -8.662
675 HA2 GLY 93 1HA GLY 93 7.448 11.737 -10.928
676 HA3 GLY 93 2HA GLY 93 9.189 11.503 -10.868
677 H GLU 94 H GLU 94 6.847 9.613 -10.780
678 HA GLU 94 HA GLU 94 6.312 8.442 -8.403
679 HB2 GLU 94 1HB GLU 94 6.930 7.183 -11.065
680 HB3 GLU 94 2HB GLU 94 6.463 6.209 -9.678
681 HG2 GLU 94 1HG GLU 94 4.319 7.054 -9.634
682 HG3 GLU 94 2HG GLU 94 4.766 8.516 -10.512
683 H SER 95 H SER 95 7.310 7.194 -6.899
684 HA SER 95 HA SER 95 10.221 7.044 -7.067
685 HB2 SER 95 1HB SER 95 9.060 8.006 -5.042
686 HB3 SER 95 2HB SER 95 8.467 6.382 -4.694
687 HG SER 95 HG SER 95 10.299 6.266 -3.644
688 H GLU 96 H GLU 96 11.072 5.002 -5.753
689 HA GLU 96 HA GLU 96 10.584 2.767 -7.400
690 HB2 GLU 96 1HB GLU 96 11.944 2.919 -4.704
691 HB3 GLU 96 2HB GLU 96 12.006 1.535 -5.786
692 HG2 GLU 96 1HG GLU 96 12.993 4.280 -6.516
693 HG3 GLU 96 2HG GLU 96 14.013 3.005 -5.852
694 H PHE 97 H PHE 97 9.901 0.608 -6.625
695 HA PHE 97 HA PHE 97 7.372 0.834 -5.240
696 HB2 PHE 97 1HB PHE 97 8.762 -1.382 -6.726
697 HB3 PHE 97 2HB PHE 97 7.321 -1.697 -5.765
698 HD1 PHE 97 1HD PHE 97 8.646 0.054 -8.709
699 HD2 PHE 97 2HD PHE 97 5.163 -1.001 -6.502
700 HE1 PHE 97 1HE PHE 97 7.239 0.753 -10.602
701 HE2 PHE 97 2HE PHE 97 3.750 -0.304 -8.392
702 HZ PHE 97 HZ PHE 97 4.787 0.573 -10.446
703 H SER 98 H SER 98 7.197 0.643 -3.117
704 HA SER 98 HA SER 98 9.236 -0.024 -1.365
705 HB2 SER 98 1HB SER 98 7.604 -0.006 0.365
706 HB3 SER 98 2HB SER 98 7.031 1.145 -0.842
707 HG SER 98 HG SER 98 5.952 -1.017 -1.622
708 H ASN 99 H ASN 99 8.588 -1.884 0.410
709 HA ASN 99 HA ASN 99 9.231 -4.323 -0.930
710 HB2 ASN 99 1HB ASN 99 9.682 -5.183 1.160
711 HB3 ASN 99 2HB ASN 99 9.852 -3.461 1.489
712 HD21 ASN 99 1HD2 ASN 99 7.701 -2.396 2.105
713 HD22 ASN 99 2HD2 ASN 99 6.753 -3.252 3.270
714 H VAL 100 H VAL 100 8.011 -6.386 -0.265
715 HA VAL 100 HA VAL 100 5.162 -5.933 -0.820
716 HB VAL 100 HB VAL 100 6.772 -8.471 -1.134
717 HG11 VAL 100 1HG1 VAL 100 4.534 -9.101 -0.786
718 HG12 VAL 100 2HG1 VAL 100 3.919 -7.764 -1.759
719 HG13 VAL 100 3HG1 VAL 100 4.748 -9.113 -2.536
720 HG21 VAL 100 1HG2 VAL 100 6.128 -6.234 -2.991
721 HG22 VAL 100 2HG2 VAL 100 7.607 -7.182 -2.838
722 HG23 VAL 100 3HG2 VAL 100 6.193 -7.876 -3.630
723 H MET 101 H MET 101 3.736 -6.229 0.752
724 HA MET 101 HA MET 101 4.510 -7.896 3.054
725 HB2 MET 101 1HB MET 101 2.661 -5.512 2.911
726 HB3 MET 101 2HB MET 101 2.830 -6.536 4.330
727 HG2 MET 101 1HG MET 101 5.020 -4.912 3.055
728 HG3 MET 101 2HG MET 101 4.146 -4.501 4.529
729 HE1 MET 101 1HE MET 101 5.199 -4.802 6.698
730 HE2 MET 101 2HE MET 101 4.170 -6.234 6.707
731 HE3 MET 101 3HE MET 101 5.840 -6.344 7.264
732 H ILE 102 H ILE 102 3.364 -9.677 3.431
733 HA ILE 102 HA ILE 102 0.946 -10.140 1.852
734 HB ILE 102 HB ILE 102 2.607 -12.065 3.482
735 HG12 ILE 102 1HG1 ILE 102 2.306 -11.940 0.482
736 HG13 ILE 102 2HG1 ILE 102 3.589 -11.091 1.338
737 HG21 ILE 102 1HG2 ILE 102 -0.044 -12.325 2.808
738 HG22 ILE 102 2HG2 ILE 102 0.781 -13.176 1.503
739 HG23 ILE 102 3HG2 ILE 102 1.060 -13.649 3.179
740 HD11 ILE 102 1HD1 ILE 102 4.687 -13.021 1.883
741 HD12 ILE 102 2HD1 ILE 102 3.224 -14.004 1.811
742 HD13 ILE 102 3HD1 ILE 102 3.994 -13.458 0.321
743 H CYS 103 H CYS 103 -0.729 -9.188 2.906
744 HA CYS 103 HA CYS 103 -1.130 -9.884 5.736
745 HB2 CYS 103 1HB CYS 103 -1.038 -7.421 4.888
746 HB3 CYS 103 2HB CYS 103 -2.670 -7.737 4.311
747 HG CYS 103 HG CYS 103 -2.474 -6.341 6.870
748 H GLU 104 H GLU 104 -2.431 -11.572 5.990
749 HA GLU 104 HA GLU 104 -4.357 -12.326 3.992
750 HB2 GLU 104 1HB GLU 104 -2.951 -13.839 5.599
751 HB3 GLU 104 2HB GLU 104 -4.260 -13.534 6.732
752 HG2 GLU 104 1HG GLU 104 -5.750 -14.272 4.694
753 HG3 GLU 104 2HG GLU 104 -4.265 -15.082 4.199
754 H THR 105 H THR 105 -6.415 -11.728 3.886
755 HA THR 105 HA THR 105 -7.533 -9.873 5.708
756 HB THR 105 HB THR 105 -9.714 -10.491 4.429
757 HG1 THR 105 1HG THR 105 -8.675 -11.327 2.235
758 HG21 THR 105 1HG2 THR 105 -9.220 -8.876 2.858
759 HG22 THR 105 2HG2 THR 105 -7.578 -9.470 2.608
760 HG23 THR 105 3HG2 THR 105 -7.974 -8.561 4.066
761 H LYS 106 H LYS 106 -9.868 -10.311 6.552
762 HA LYS 106 HA LYS 106 -9.648 -12.500 8.422
763 HB2 LYS 106 1HB LYS 106 -11.836 -10.445 8.052
764 HB3 LYS 106 2HB LYS 106 -11.715 -11.573 9.395
765 HG2 LYS 106 1HG LYS 106 -9.398 -9.798 8.869
766 HG3 LYS 106 2HG LYS 106 -10.851 -9.082 9.568
767 HD2 LYS 106 1HD LYS 106 -10.641 -10.236 11.528
768 HD3 LYS 106 2HD LYS 106 -9.844 -11.611 10.759
769 HE2 LYS 106 1HE LYS 106 -8.413 -9.004 10.826
770 HE3 LYS 106 2HE LYS 106 -8.528 -9.930 12.322
771 HZ1 LYS 106 1HZ LYS 106 -6.676 -10.886 11.513
772 HZ2 LYS 106 2HZ LYS 106 -7.021 -10.492 9.904
773 HZ3 LYS 106 3HZ LYS 106 -7.767 -11.829 10.626
774 H ALA 107 H ALA 107 -11.263 -14.120 8.737
775 HA ALA 107 HA ALA 107 -12.255 -15.192 6.256
776 HB1 ALA 107 1HB ALA 107 -11.652 -16.991 7.453
777 HB2 ALA 107 2HB ALA 107 -11.863 -16.161 8.996
778 HB3 ALA 107 3HB ALA 107 -13.260 -16.843 8.163
779 H ARG 108 H ARG 108 -14.246 -15.014 5.450
780 HA ARG 108 HA ARG 108 -16.153 -13.274 6.577
781 HB2 ARG 108 1HB ARG 108 -17.674 -14.462 4.804
782 HB3 ARG 108 2HB ARG 108 -16.355 -13.422 4.284
783 HG2 ARG 108 1HG ARG 108 -15.135 -15.145 3.454
784 HG3 ARG 108 2HG ARG 108 -15.754 -16.299 4.637
785 HD2 ARG 108 1HD ARG 108 -16.570 -16.842 2.416
786 HD3 ARG 108 2HD ARG 108 -17.902 -16.343 3.457
787 HE ARG 108 HE ARG 108 -16.804 -14.196 1.901
788 HH11 ARG 108 1HH1 ARG 108 -19.060 -16.847 1.913
789 HH12 ARG 108 2HH1 ARG 108 -20.068 -16.166 0.680
790 HH21 ARG 108 1HH2 ARG 108 -18.123 -13.288 0.277
791 HH22 ARG 108 2HH2 ARG 108 -19.534 -14.142 -0.251
792 H SER 109 H SER 109 -17.632 -13.599 8.097
793 HA SER 109 HA SER 109 -18.446 -16.369 8.694
794 HB2 SER 109 1HB SER 109 -18.636 -15.731 11.058
795 HB3 SER 109 2HB SER 109 -16.996 -15.465 10.468
796 HG SER 109 HG SER 109 -17.750 -13.224 10.092
797 H GLY 110 H GLY 110 -20.537 -16.744 8.400
798 HA2 GLY 110 1HA GLY 110 -22.710 -15.505 9.377
799 HA3 GLY 110 2HA GLY 110 -22.353 -14.524 7.963
800 HA PRO 111 HA PRO 111 -25.099 -18.130 6.788
801 HB2 PRO 111 1HB PRO 111 -27.086 -16.624 5.713
802 HB3 PRO 111 2HB PRO 111 -27.033 -17.065 7.424
803 HG2 PRO 111 1HG PRO 111 -26.215 -14.507 6.101
804 HG3 PRO 111 2HG PRO 111 -27.122 -14.748 7.605
805 HD2 PRO 111 1HD PRO 111 -24.480 -14.156 7.576
806 HD3 PRO 111 2HD PRO 111 -25.218 -15.168 8.834
807 H SER 112 H SER 112 -25.830 -18.687 4.592
808 HA SER 112 HA SER 112 -23.940 -17.690 2.622
809 HB2 SER 112 1HB SER 112 -25.726 -20.078 2.837
810 HB3 SER 112 2HB SER 112 -25.194 -19.564 1.236
811 HG SER 112 HG SER 112 -23.804 -20.829 3.200
812 H SER 113 H SER 113 -27.461 -18.236 2.775
813 HA SER 113 HA SER 113 -27.922 -15.788 1.293
814 HB2 SER 113 1HB SER 113 -28.675 -18.499 0.182
815 HB3 SER 113 2HB SER 113 -29.363 -16.982 -0.398
816 HG SER 113 HG SER 113 -26.925 -16.448 -0.554
817 H GLY 114 H GLY 114 -30.105 -15.071 1.375
818 HA2 GLY 114 1HA GLY 114 -32.410 -15.449 2.019
819 HA3 GLY 114 2HA GLY 114 -31.830 -16.587 3.227
Start of MODEL 12
1 H1 GLY 1 H GLY 1 25.238 7.679 -16.997
2 HA2 GLY 1 1HA GLY 1 24.927 8.119 -14.743
3 HA3 GLY 1 2HA GLY 1 25.887 9.578 -14.928
4 H SER 2 H SER 2 23.683 9.646 -13.340
5 HA SER 2 HA SER 2 21.468 10.723 -14.891
6 HB2 SER 2 1HB SER 2 21.312 9.210 -12.764
7 HB3 SER 2 2HB SER 2 21.566 10.721 -11.891
8 HG SER 2 HG SER 2 19.414 10.630 -12.111
9 H SER 3 H SER 3 20.866 12.835 -14.962
10 HA SER 3 HA SER 3 22.065 14.811 -13.240
11 HB2 SER 3 1HB SER 3 23.077 16.124 -15.071
12 HB3 SER 3 2HB SER 3 23.845 14.546 -14.902
13 HG SER 3 HG SER 3 21.734 15.007 -16.726
14 H GLY 4 H GLY 4 20.264 15.854 -12.679
15 HA2 GLY 4 1HA GLY 4 18.923 17.719 -14.012
16 HA3 GLY 4 2HA GLY 4 18.142 16.273 -14.635
17 H SER 5 H SER 5 16.299 15.819 -13.658
18 HA SER 5 HA SER 5 15.695 16.944 -11.064
19 HB2 SER 5 1HB SER 5 13.445 16.179 -11.440
20 HB3 SER 5 2HB SER 5 14.037 16.860 -12.956
21 HG SER 5 HG SER 5 14.688 14.474 -13.276
22 H SER 6 H SER 6 15.766 15.926 -9.165
23 HA SER 6 HA SER 6 16.200 13.010 -9.177
24 HB2 SER 6 1HB SER 6 17.461 13.399 -7.021
25 HB3 SER 6 2HB SER 6 18.234 14.056 -8.463
26 HG SER 6 HG SER 6 17.977 16.007 -7.708
27 H GLY 7 H GLY 7 14.018 12.499 -8.913
28 HA2 GLY 7 1HA GLY 7 12.455 13.668 -6.799
29 HA3 GLY 7 2HA GLY 7 11.980 12.326 -7.830
30 HA PRO 8 HA PRO 8 12.990 10.871 -3.464
31 HB2 PRO 8 1HB PRO 8 10.507 9.955 -2.859
32 HB3 PRO 8 2HB PRO 8 11.024 11.614 -2.536
33 HG2 PRO 8 1HG PRO 8 9.394 10.547 -4.808
34 HG3 PRO 8 2HG PRO 8 9.153 12.023 -3.855
35 HD2 PRO 8 1HD PRO 8 10.288 12.045 -6.313
36 HD3 PRO 8 2HD PRO 8 10.741 13.199 -5.042
37 H VAL 9 H VAL 9 14.184 9.130 -4.097
38 HA VAL 9 HA VAL 9 12.884 6.930 -5.513
39 HB VAL 9 HB VAL 9 15.147 5.964 -5.686
40 HG11 VAL 9 1HG1 VAL 9 14.450 7.339 -7.495
41 HG12 VAL 9 2HG1 VAL 9 14.799 8.815 -6.592
42 HG13 VAL 9 3HG1 VAL 9 16.119 7.777 -7.131
43 HG21 VAL 9 1HG2 VAL 9 15.972 8.451 -4.193
44 HG22 VAL 9 2HG2 VAL 9 16.134 6.782 -3.646
45 HG23 VAL 9 3HG2 VAL 9 17.086 7.358 -5.014
46 H ALA 10 H ALA 10 14.630 7.562 -2.492
47 HA ALA 10 HA ALA 10 14.944 5.214 -1.291
48 HB1 ALA 10 1HB ALA 10 13.407 7.290 0.225
49 HB2 ALA 10 2HB ALA 10 14.707 6.236 0.783
50 HB3 ALA 10 3HB ALA 10 15.066 7.587 -0.292
51 H GLY 11 H GLY 11 11.799 6.694 -1.895
52 HA2 GLY 11 1HA GLY 11 9.671 5.837 -1.807
53 HA3 GLY 11 2HA GLY 11 10.422 4.270 -2.069
54 HA PRO 12 HA PRO 12 8.695 4.902 2.365
55 HB2 PRO 12 1HB PRO 12 6.220 3.825 2.073
56 HB3 PRO 12 2HB PRO 12 6.547 5.551 1.874
57 HG2 PRO 12 1HG PRO 12 6.242 3.427 -0.214
58 HG3 PRO 12 2HG PRO 12 5.593 5.077 -0.193
59 HD2 PRO 12 1HD PRO 12 7.803 4.399 -1.604
60 HD3 PRO 12 2HD PRO 12 7.588 6.006 -0.880
61 H TYR 13 H TYR 13 8.197 3.149 3.849
62 HA TYR 13 HA TYR 13 8.590 0.458 2.744
63 HB2 TYR 13 1HB TYR 13 10.763 0.832 3.466
64 HB3 TYR 13 2HB TYR 13 10.253 1.849 4.809
65 HD1 TYR 13 1HD TYR 13 9.443 -1.653 3.764
66 HD2 TYR 13 2HD TYR 13 10.884 0.929 6.824
67 HE1 TYR 13 1HE TYR 13 9.638 -3.575 5.286
68 HE2 TYR 13 2HE TYR 13 11.084 -0.986 8.353
69 HH TYR 13 HH TYR 13 10.715 -3.157 8.644
70 H ILE 14 H ILE 14 6.799 -0.605 3.265
71 HA ILE 14 HA ILE 14 5.081 0.084 5.396
72 HB ILE 14 HB ILE 14 5.221 -2.565 3.954
73 HG12 ILE 14 1HG1 ILE 14 3.321 -0.360 3.244
74 HG13 ILE 14 2HG1 ILE 14 4.961 -0.329 2.605
75 HG21 ILE 14 1HG2 ILE 14 2.688 -2.411 4.503
76 HG22 ILE 14 2HG2 ILE 14 3.819 -2.922 5.756
77 HG23 ILE 14 3HG2 ILE 14 3.208 -1.268 5.741
78 HD11 ILE 14 1HD1 ILE 14 4.527 -1.932 1.121
79 HD12 ILE 14 2HD1 ILE 14 3.628 -2.902 2.288
80 HD13 ILE 14 3HD1 ILE 14 2.833 -1.571 1.448
81 H THR 15 H THR 15 5.339 -0.260 7.491
82 HA THR 15 HA THR 15 6.952 -2.572 8.355
83 HB THR 15 HB THR 15 7.906 -1.367 10.098
84 HG1 THR 15 1HG THR 15 6.005 -0.435 10.937
85 HG21 THR 15 1HG2 THR 15 8.222 -0.402 7.581
86 HG22 THR 15 2HG2 THR 15 9.135 0.163 8.981
87 HG23 THR 15 3HG2 THR 15 7.715 1.055 8.435
88 H PHE 16 H PHE 16 3.932 -1.920 7.985
89 HA PHE 16 HA PHE 16 3.087 -3.418 10.300
90 HB2 PHE 16 1HB PHE 16 3.102 -0.909 10.922
91 HB3 PHE 16 2HB PHE 16 1.707 -0.783 9.856
92 HD1 PHE 16 1HD PHE 16 2.984 -2.274 12.965
93 HD2 PHE 16 2HD PHE 16 -0.427 -1.608 10.507
94 HE1 PHE 16 1HE PHE 16 1.520 -3.001 14.804
95 HE2 PHE 16 2HE PHE 16 -1.896 -2.333 12.342
96 HZ PHE 16 HZ PHE 16 -0.923 -3.030 14.495
97 H THR 17 H THR 17 1.565 -4.807 9.692
98 HA THR 17 HA THR 17 -0.339 -4.070 7.603
99 HB THR 17 HB THR 17 0.080 -6.505 6.681
100 HG1 THR 17 1HG THR 17 2.287 -7.061 6.815
101 HG21 THR 17 1HG2 THR 17 0.442 -4.148 5.619
102 HG22 THR 17 2HG2 THR 17 1.187 -5.564 4.876
103 HG23 THR 17 3HG2 THR 17 2.149 -4.492 5.893
104 H ASP 18 H ASP 18 -2.231 -4.375 8.576
105 HA ASP 18 HA ASP 18 -2.768 -6.970 9.811
106 HB2 ASP 18 1HB ASP 18 -3.506 -6.143 11.846
107 HB3 ASP 18 2HB ASP 18 -2.140 -5.082 11.514
108 H ALA 19 H ALA 19 -4.767 -7.744 9.395
109 HA ALA 19 HA ALA 19 -6.387 -6.326 7.486
110 HB1 ALA 19 1HB ALA 19 -5.997 -8.778 7.388
111 HB2 ALA 19 2HB ALA 19 -6.976 -8.951 8.846
112 HB3 ALA 19 3HB ALA 19 -7.702 -8.329 7.364
113 H VAL 20 H VAL 20 -7.868 -4.874 8.020
114 HA VAL 20 HA VAL 20 -8.812 -4.572 10.706
115 HB VAL 20 HB VAL 20 -9.887 -3.213 8.235
116 HG11 VAL 20 1HG1 VAL 20 -10.292 -1.382 9.976
117 HG12 VAL 20 2HG1 VAL 20 -11.352 -2.792 10.012
118 HG13 VAL 20 3HG1 VAL 20 -10.036 -2.646 11.178
119 HG21 VAL 20 1HG2 VAL 20 -7.765 -2.073 10.021
120 HG22 VAL 20 2HG2 VAL 20 -7.348 -3.076 8.631
121 HG23 VAL 20 3HG2 VAL 20 -8.237 -1.571 8.397
122 H ASN 21 H ASN 21 -9.951 -6.169 7.852
123 HA ASN 21 HA ASN 21 -12.056 -7.449 9.301
124 HB2 ASN 21 1HB ASN 21 -12.683 -5.202 7.441
125 HB3 ASN 21 2HB ASN 21 -13.748 -6.605 7.430
126 HD21 ASN 21 1HD2 ASN 21 -14.437 -3.964 8.219
127 HD22 ASN 21 2HD2 ASN 21 -14.893 -4.022 9.884
128 H GLU 22 H GLU 22 -13.561 -8.576 7.451
129 HA GLU 22 HA GLU 22 -11.787 -10.368 6.131
130 HB2 GLU 22 1HB GLU 22 -13.677 -11.612 5.571
131 HB3 GLU 22 2HB GLU 22 -14.154 -10.818 7.065
132 HG2 GLU 22 1HG GLU 22 -15.042 -8.998 5.336
133 HG3 GLU 22 2HG GLU 22 -15.136 -10.425 4.306
134 H THR 23 H THR 23 -13.339 -7.436 5.225
135 HA THR 23 HA THR 23 -12.411 -7.816 2.454
136 HB THR 23 HB THR 23 -14.284 -6.177 1.836
137 HG1 THR 23 1HG THR 23 -15.280 -7.102 4.346
138 HG21 THR 23 1HG2 THR 23 -15.989 -8.266 2.311
139 HG22 THR 23 2HG2 THR 23 -14.411 -9.050 2.394
140 HG23 THR 23 3HG2 THR 23 -14.876 -8.155 0.947
141 H THR 24 H THR 24 -11.465 -6.415 5.072
142 HA THR 24 HA THR 24 -10.604 -3.963 3.709
143 HB THR 24 HB THR 24 -11.321 -3.878 6.626
144 HG1 THR 24 1HG THR 24 -13.249 -4.414 5.602
145 HG21 THR 24 1HG2 THR 24 -11.369 -1.513 6.299
146 HG22 THR 24 2HG2 THR 24 -11.278 -1.694 4.547
147 HG23 THR 24 3HG2 THR 24 -9.889 -2.112 5.550
148 H ILE 25 H ILE 25 -8.579 -3.177 4.335
149 HA ILE 25 HA ILE 25 -7.070 -4.723 6.306
150 HB ILE 25 HB ILE 25 -6.327 -4.431 3.408
151 HG12 ILE 25 1HG1 ILE 25 -6.393 -6.763 5.334
152 HG13 ILE 25 2HG1 ILE 25 -7.529 -6.456 4.026
153 HG21 ILE 25 1HG2 ILE 25 -4.121 -5.560 4.421
154 HG22 ILE 25 2HG2 ILE 25 -4.286 -3.823 4.170
155 HG23 ILE 25 3HG2 ILE 25 -4.556 -4.511 5.771
156 HD11 ILE 25 1HD1 ILE 25 -4.813 -7.590 3.955
157 HD12 ILE 25 2HD1 ILE 25 -6.225 -7.944 2.958
158 HD13 ILE 25 3HD1 ILE 25 -5.248 -6.513 2.628
159 H MET 26 H MET 26 -5.601 -3.547 7.426
160 HA MET 26 HA MET 26 -5.242 -0.740 6.601
161 HB2 MET 26 1HB MET 26 -6.427 -0.580 8.590
162 HB3 MET 26 2HB MET 26 -5.653 -1.998 9.285
163 HG2 MET 26 1HG MET 26 -3.773 -0.830 9.921
164 HG3 MET 26 2HG MET 26 -4.037 0.444 8.733
165 HE1 MET 26 1HE MET 26 -4.598 3.046 10.946
166 HE2 MET 26 2HE MET 26 -4.167 2.386 9.368
167 HE3 MET 26 3HE MET 26 -5.827 2.890 9.691
168 H LEU 27 H LEU 27 -3.241 -0.153 6.098
169 HA LEU 27 HA LEU 27 -0.985 -1.563 7.341
170 HB2 LEU 27 1HB LEU 27 0.100 -1.964 5.343
171 HB3 LEU 27 2HB LEU 27 -1.581 -2.321 4.952
172 HG LEU 27 HG LEU 27 -0.409 0.372 4.353
173 HD11 LEU 27 1HD1 LEU 27 -0.119 -2.154 2.751
174 HD12 LEU 27 2HD1 LEU 27 1.144 -1.045 3.282
175 HD13 LEU 27 3HD1 LEU 27 -0.001 -0.546 2.037
176 HD21 LEU 27 1HD2 LEU 27 -2.146 -0.319 2.367
177 HD22 LEU 27 2HD2 LEU 27 -2.564 0.628 3.796
178 HD23 LEU 27 3HD2 LEU 27 -2.865 -1.110 3.770
179 H LYS 28 H LYS 28 0.776 -0.317 7.817
180 HA LYS 28 HA LYS 28 0.550 2.554 7.189
181 HB2 LYS 28 1HB LYS 28 1.719 1.246 9.652
182 HB3 LYS 28 2HB LYS 28 1.744 2.973 9.319
183 HG2 LYS 28 1HG LYS 28 -0.078 2.885 10.667
184 HG3 LYS 28 2HG LYS 28 -0.867 2.602 9.114
185 HD2 LYS 28 1HD LYS 28 -0.991 0.266 9.500
186 HD3 LYS 28 2HD LYS 28 0.105 0.367 10.881
187 HE2 LYS 28 1HE LYS 28 -2.470 1.881 10.915
188 HE3 LYS 28 2HE LYS 28 -2.471 0.151 11.255
189 HZ1 LYS 28 1HZ LYS 28 -0.913 2.217 12.712
190 HZ2 LYS 28 2HZ LYS 28 -0.850 0.556 13.020
191 HZ3 LYS 28 3HZ LYS 28 -2.284 1.411 13.288
192 H TRP 29 H TRP 29 2.304 3.598 6.385
193 HA TRP 29 HA TRP 29 4.722 1.971 5.948
194 HB2 TRP 29 1HB TRP 29 5.089 3.382 3.919
195 HB3 TRP 29 2HB TRP 29 3.629 2.400 3.843
196 HD1 TRP 29 HD TRP 29 4.758 6.048 4.239
197 HE1 TRP 29 1HE TRP 29 2.771 7.582 3.670
198 HE3 TRP 29 3HE TRP 29 1.111 2.500 3.741
199 HZ2 TRP 29 2HZ TRP 29 0.021 7.322 3.088
200 HZ3 TRP 29 3HZ TRP 29 -1.171 3.226 3.178
201 HH2 TRP 29 HH TRP 29 -1.703 5.587 2.859
202 H MET 30 H MET 30 6.760 3.088 5.936
203 HA MET 30 HA MET 30 6.715 5.558 7.544
204 HB2 MET 30 1HB MET 30 8.567 4.844 8.761
205 HB3 MET 30 2HB MET 30 7.634 3.365 8.571
206 HG2 MET 30 1HG MET 30 9.073 2.630 6.788
207 HG3 MET 30 2HG MET 30 9.951 4.157 6.824
208 HE1 MET 30 1HE MET 30 12.218 4.278 9.388
209 HE2 MET 30 2HE MET 30 10.733 5.108 8.922
210 HE3 MET 30 3HE MET 30 10.823 4.264 10.468
211 H TYR 31 H TYR 31 8.519 7.032 7.210
212 HA TYR 31 HA TYR 31 9.569 6.888 4.459
213 HB2 TYR 31 1HB TYR 31 7.856 8.679 4.864
214 HB3 TYR 31 2HB TYR 31 8.966 9.406 6.020
215 HD1 TYR 31 2HD TYR 31 11.076 10.419 5.246
216 HD2 TYR 31 1HD TYR 31 8.206 8.894 2.500
217 HE1 TYR 31 2HE TYR 31 12.166 11.662 3.425
218 HE2 TYR 31 1HE TYR 31 9.289 10.132 0.671
219 HH TYR 31 HH TYR 31 10.878 11.582 0.117
220 H ILE 32 H ILE 32 11.700 7.374 4.106
221 HA ILE 32 HA ILE 32 13.371 7.560 6.514
222 HB ILE 32 HB ILE 32 14.127 6.705 3.718
223 HG12 ILE 32 1HG1 ILE 32 12.709 5.058 4.820
224 HG13 ILE 32 2HG1 ILE 32 14.364 4.463 4.739
225 HG21 ILE 32 1HG2 ILE 32 15.739 7.666 5.818
226 HG22 ILE 32 2HG2 ILE 32 15.996 5.925 5.731
227 HG23 ILE 32 3HG2 ILE 32 16.255 6.926 4.303
228 HD11 ILE 32 1HD1 ILE 32 13.401 3.950 6.883
229 HD12 ILE 32 2HD1 ILE 32 14.689 5.140 7.080
230 HD13 ILE 32 3HD1 ILE 32 13.001 5.648 7.144
231 HA PRO 33 HA PRO 33 13.838 11.813 4.973
232 HB2 PRO 33 1HB PRO 33 14.617 12.813 7.374
233 HB3 PRO 33 2HB PRO 33 12.922 12.556 6.944
234 HG2 PRO 33 1HG PRO 33 14.740 10.839 8.589
235 HG3 PRO 33 2HG PRO 33 13.047 11.277 8.882
236 HD2 PRO 33 1HD PRO 33 13.773 8.886 7.840
237 HD3 PRO 33 2HD PRO 33 12.250 9.692 7.412
238 H ALA 34 H ALA 34 16.022 9.631 6.551
239 HA ALA 34 HA ALA 34 18.366 11.157 6.578
240 HB1 ALA 34 1HB ALA 34 17.893 8.198 6.365
241 HB2 ALA 34 2HB ALA 34 19.513 8.894 6.438
242 HB3 ALA 34 3HB ALA 34 18.389 9.133 7.776
243 H SER 35 H SER 35 17.780 8.511 4.269
244 HA SER 35 HA SER 35 19.533 9.771 2.347
245 HB2 SER 35 1HB SER 35 19.659 7.360 2.604
246 HB3 SER 35 2HB SER 35 17.943 7.197 2.230
247 HG SER 35 HG SER 35 19.809 6.997 0.520
248 H ASN 36 H ASN 36 17.291 11.345 2.875
249 HA ASN 36 HA ASN 36 15.668 11.057 0.438
250 HB2 ASN 36 1HB ASN 36 14.316 11.058 2.445
251 HB3 ASN 36 2HB ASN 36 15.095 12.530 3.016
252 HD21 ASN 36 1HD2 ASN 36 13.102 13.573 3.164
253 HD22 ASN 36 2HD2 ASN 36 12.262 14.134 1.762
254 H ASN 37 H ASN 37 15.170 12.960 -0.788
255 HA ASN 37 HA ASN 37 17.397 14.847 -0.818
256 HB2 ASN 37 1HB ASN 37 15.385 13.914 -2.804
257 HB3 ASN 37 2HB ASN 37 16.011 15.549 -2.993
258 HD21 ASN 37 1HD2 ASN 37 16.416 12.502 -3.992
259 HD22 ASN 37 2HD2 ASN 37 18.101 12.519 -4.374
260 H ASN 38 H ASN 38 15.021 14.867 1.086
261 HA ASN 38 HA ASN 38 13.582 16.360 2.037
262 HB2 ASN 38 1HB ASN 38 15.928 17.949 1.125
263 HB3 ASN 38 2HB ASN 38 14.510 18.843 1.667
264 HD21 ASN 38 1HD2 ASN 38 16.613 16.163 2.636
265 HD22 ASN 38 2HD2 ASN 38 16.587 16.527 4.324
266 H THR 39 H THR 39 12.642 15.503 -0.388
267 HA THR 39 HA THR 39 11.603 17.929 -1.688
268 HB THR 39 HB THR 39 12.800 16.154 -3.080
269 HG1 THR 39 1HG THR 39 10.118 16.869 -3.741
270 HG21 THR 39 1HG2 THR 39 11.752 14.135 -3.586
271 HG22 THR 39 2HG2 THR 39 10.190 14.682 -2.978
272 HG23 THR 39 3HG2 THR 39 11.488 14.293 -1.850
273 HA PRO 40 HA PRO 40 7.657 17.157 0.136
274 HB2 PRO 40 1HB PRO 40 6.168 18.717 -1.513
275 HB3 PRO 40 2HB PRO 40 7.220 19.378 -0.256
276 HG2 PRO 40 1HG PRO 40 7.724 19.094 -3.193
277 HG3 PRO 40 2HG PRO 40 8.088 20.460 -2.123
278 HD2 PRO 40 1HD PRO 40 9.969 18.670 -2.891
279 HD3 PRO 40 2HD PRO 40 10.006 19.474 -1.308
280 H ILE 41 H ILE 41 6.015 15.735 -0.140
281 HA ILE 41 HA ILE 41 5.808 14.431 -2.768
282 HB ILE 41 HB ILE 41 4.740 13.281 -0.206
283 HG12 ILE 41 1HG1 ILE 41 7.543 13.023 -1.315
284 HG13 ILE 41 2HG1 ILE 41 7.085 13.747 0.222
285 HG21 ILE 41 1HG2 ILE 41 4.872 11.192 -1.364
286 HG22 ILE 41 2HG2 ILE 41 4.054 12.348 -2.414
287 HG23 ILE 41 3HG2 ILE 41 5.743 11.933 -2.706
288 HD11 ILE 41 1HD1 ILE 41 6.032 11.165 0.274
289 HD12 ILE 41 2HD1 ILE 41 7.651 11.010 -0.409
290 HD13 ILE 41 3HD1 ILE 41 7.426 11.779 1.163
291 H HIS 42 H HIS 42 3.888 14.281 -3.818
292 HA HIS 42 HA HIS 42 1.806 16.086 -3.070
293 HB2 HIS 42 1HB HIS 42 2.180 14.120 -5.312
294 HB3 HIS 42 2HB HIS 42 0.631 14.922 -5.072
295 HD1 HIS 42 1HD HIS 42 1.012 16.077 -7.407
296 HD2 HIS 42 2HD HIS 42 3.735 17.132 -4.452
297 HE1 HIS 42 1HE HIS 42 2.167 18.140 -8.263
298 HE2 HIS 42 2HE HIS 42 3.870 18.711 -6.496
299 H GLY 43 H GLY 43 2.151 12.561 -3.100
300 HA2 GLY 43 1HA GLY 43 0.266 12.264 -0.973
301 HA3 GLY 43 2HA GLY 43 -0.424 11.776 -2.514
302 H PHE 44 H PHE 44 -0.613 9.618 -1.910
303 HA PHE 44 HA PHE 44 1.869 8.110 -2.118
304 HB2 PHE 44 1HB PHE 44 0.043 8.049 0.267
305 HB3 PHE 44 2HB PHE 44 0.988 6.631 -0.173
306 HD1 PHE 44 2HD PHE 44 3.559 7.263 -0.713
307 HD2 PHE 44 1HD PHE 44 0.941 9.408 1.867
308 HE1 PHE 44 2HE PHE 44 5.501 8.187 0.483
309 HE2 PHE 44 1HE PHE 44 2.878 10.336 3.067
310 HZ PHE 44 HZ PHE 44 5.162 9.725 2.376
311 H TYR 45 H TYR 45 1.620 6.399 -3.404
312 HA TYR 45 HA TYR 45 -1.101 5.648 -4.186
313 HB2 TYR 45 1HB TYR 45 1.576 5.484 -5.500
314 HB3 TYR 45 2HB TYR 45 0.338 4.323 -5.969
315 HD1 TYR 45 2HD TYR 45 -2.106 5.918 -5.904
316 HD2 TYR 45 1HD TYR 45 1.784 6.970 -7.270
317 HE1 TYR 45 2HE TYR 45 -3.095 7.582 -7.422
318 HE2 TYR 45 1HE TYR 45 0.806 8.638 -8.791
319 HH TYR 45 HH TYR 45 -1.343 9.996 -8.895
320 H ILE 46 H ILE 46 -1.898 3.608 -3.967
321 HA ILE 46 HA ILE 46 -0.152 1.597 -2.714
322 HB ILE 46 HB ILE 46 -3.007 2.206 -1.939
323 HG12 ILE 46 1HG1 ILE 46 -0.708 2.238 -0.034
324 HG13 ILE 46 2HG1 ILE 46 -0.907 3.608 -1.122
325 HG21 ILE 46 1HG2 ILE 46 -1.784 -0.251 -1.914
326 HG22 ILE 46 2HG2 ILE 46 -1.506 0.341 -0.277
327 HG23 ILE 46 3HG2 ILE 46 -3.149 0.229 -0.906
328 HD11 ILE 46 1HD1 ILE 46 -1.963 4.054 1.000
329 HD12 ILE 46 2HD1 ILE 46 -3.184 3.927 -0.267
330 HD13 ILE 46 3HD1 ILE 46 -2.934 2.589 0.855
331 H TYR 47 H TYR 47 -0.126 -0.279 -3.756
332 HA TYR 47 HA TYR 47 -2.283 -0.837 -5.679
333 HB2 TYR 47 1HB TYR 47 0.574 -1.830 -5.643
334 HB3 TYR 47 2HB TYR 47 -0.638 -2.280 -6.837
335 HD1 TYR 47 2HD TYR 47 0.831 0.829 -5.361
336 HD2 TYR 47 1HD TYR 47 -0.593 -1.154 -8.846
337 HE1 TYR 47 2HE TYR 47 1.454 2.782 -6.719
338 HE2 TYR 47 1HE TYR 47 0.027 0.794 -10.214
339 HH TYR 47 HH TYR 47 1.981 3.328 -9.025
340 H TYR 48 H TYR 48 -3.138 -2.935 -5.830
341 HA TYR 48 HA TYR 48 -2.329 -4.993 -3.988
342 HB2 TYR 48 1HB TYR 48 -4.681 -5.107 -2.979
343 HB3 TYR 48 2HB TYR 48 -3.616 -3.837 -2.387
344 HD1 TYR 48 2HD TYR 48 -3.932 -1.491 -3.229
345 HD2 TYR 48 1HD TYR 48 -6.739 -4.588 -4.024
346 HE1 TYR 48 2HE TYR 48 -5.630 0.199 -3.785
347 HE2 TYR 48 1HE TYR 48 -8.445 -2.906 -4.583
348 HH TYR 48 HH TYR 48 -8.966 -0.670 -4.367
349 H ARG 49 H ARG 49 -3.344 -7.009 -4.394
350 HA ARG 49 HA ARG 49 -5.430 -7.371 -6.260
351 HB2 ARG 49 1HB ARG 49 -4.307 -8.081 -8.207
352 HB3 ARG 49 2HB ARG 49 -3.513 -6.581 -7.744
353 HG2 ARG 49 1HG ARG 49 -1.680 -7.842 -8.169
354 HG3 ARG 49 2HG ARG 49 -1.908 -8.259 -6.470
355 HD2 ARG 49 1HD ARG 49 -3.087 -10.282 -7.096
356 HD3 ARG 49 2HD ARG 49 -2.970 -9.850 -8.801
357 HE ARG 49 HE ARG 49 -0.955 -11.087 -7.204
358 HH11 ARG 49 1HH1 ARG 49 -1.482 -8.948 -9.900
359 HH12 ARG 49 2HH1 ARG 49 0.042 -9.301 -10.645
360 HH21 ARG 49 1HH2 ARG 49 1.053 -11.560 -8.176
361 HH22 ARG 49 2HH2 ARG 49 1.483 -10.788 -9.664
362 HA PRO 50 HA PRO 50 -5.330 -11.264 -4.202
363 HB2 PRO 50 1HB PRO 50 -7.015 -12.637 -5.829
364 HB3 PRO 50 2HB PRO 50 -7.571 -11.405 -4.690
365 HG2 PRO 50 1HG PRO 50 -7.078 -11.178 -7.634
366 HG3 PRO 50 2HG PRO 50 -8.424 -10.539 -6.672
367 HD2 PRO 50 1HD PRO 50 -6.341 -9.001 -7.466
368 HD3 PRO 50 2HD PRO 50 -7.204 -8.726 -5.939
369 H THR 51 H THR 51 -4.121 -13.080 -4.272
370 HA THR 51 HA THR 51 -2.163 -13.467 -6.206
371 HB THR 51 HB THR 51 -2.414 -14.463 -3.788
372 HG1 THR 51 1HG THR 51 -1.122 -15.594 -6.036
373 HG21 THR 51 1HG2 THR 51 -3.401 -16.501 -3.539
374 HG22 THR 51 2HG2 THR 51 -3.066 -16.988 -5.201
375 HG23 THR 51 3HG2 THR 51 -4.404 -15.893 -4.855
376 H ASP 52 H ASP 52 -5.470 -14.376 -6.232
377 HA ASP 52 HA ASP 52 -5.274 -16.568 -8.043
378 HB2 ASP 52 1HB ASP 52 -7.271 -16.586 -6.864
379 HB3 ASP 52 2HB ASP 52 -7.501 -14.847 -7.024
380 H SER 53 H SER 53 -5.224 -13.145 -8.394
381 HA SER 53 HA SER 53 -6.231 -12.743 -10.933
382 HB2 SER 53 1HB SER 53 -4.149 -11.391 -9.283
383 HB3 SER 53 2HB SER 53 -4.243 -10.965 -10.992
384 HG SER 53 HG SER 53 -5.723 -10.016 -9.082
385 H ASP 54 H ASP 54 -4.578 -11.947 -12.772
386 HA ASP 54 HA ASP 54 -3.109 -14.364 -13.506
387 HB2 ASP 54 1HB ASP 54 -4.834 -13.187 -15.019
388 HB3 ASP 54 2HB ASP 54 -3.574 -11.986 -15.293
389 H ASN 55 H ASN 55 -2.579 -10.844 -13.791
390 HA ASN 55 HA ASN 55 0.146 -11.168 -12.842
391 HB2 ASN 55 1HB ASN 55 1.105 -9.980 -14.801
392 HB3 ASN 55 2HB ASN 55 0.434 -11.553 -15.221
393 HD21 ASN 55 1HD2 ASN 55 -1.553 -11.641 -16.338
394 HD22 ASN 55 2HD2 ASN 55 -2.113 -10.294 -17.264
395 H ASP 56 H ASP 56 1.230 -8.795 -13.206
396 HA ASP 56 HA ASP 56 0.085 -7.119 -11.351
397 HB2 ASP 56 1HB ASP 56 1.557 -5.358 -12.213
398 HB3 ASP 56 2HB ASP 56 2.405 -6.900 -12.127
399 H SER 57 H SER 57 -0.881 -7.638 -14.584
400 HA SER 57 HA SER 57 -1.983 -5.226 -15.356
401 HB2 SER 57 1HB SER 57 -2.687 -8.082 -15.912
402 HB3 SER 57 2HB SER 57 -3.770 -6.809 -16.474
403 HG SER 57 HG SER 57 -1.534 -5.922 -17.236
404 H ASP 58 H ASP 58 -2.872 -7.201 -12.739
405 HA ASP 58 HA ASP 58 -5.574 -6.102 -12.574
406 HB2 ASP 58 1HB ASP 58 -4.875 -8.572 -12.072
407 HB3 ASP 58 2HB ASP 58 -4.377 -7.922 -10.513
408 H TYR 59 H TYR 59 -2.476 -6.008 -10.908
409 HA TYR 59 HA TYR 59 -2.914 -4.847 -8.545
410 HB2 TYR 59 1HB TYR 59 -0.847 -4.360 -10.626
411 HB3 TYR 59 2HB TYR 59 -0.919 -3.223 -9.285
412 HD1 TYR 59 1HD TYR 59 -1.615 -4.958 -7.028
413 HD2 TYR 59 2HD TYR 59 1.060 -5.639 -10.265
414 HE1 TYR 59 1HE TYR 59 -0.330 -6.521 -5.629
415 HE2 TYR 59 2HE TYR 59 2.352 -7.205 -8.877
416 HH TYR 59 HH TYR 59 1.998 -7.424 -5.541
417 H LYS 60 H LYS 60 -4.100 -3.231 -7.798
418 HA LYS 60 HA LYS 60 -5.081 -1.193 -9.636
419 HB2 LYS 60 1HB LYS 60 -5.870 -2.144 -6.911
420 HB3 LYS 60 2HB LYS 60 -6.356 -0.535 -7.429
421 HG2 LYS 60 1HG LYS 60 -7.541 -1.447 -9.315
422 HG3 LYS 60 2HG LYS 60 -6.960 -3.070 -8.937
423 HD2 LYS 60 1HD LYS 60 -9.018 -3.177 -7.958
424 HD3 LYS 60 2HD LYS 60 -8.092 -2.529 -6.602
425 HE2 LYS 60 1HE LYS 60 -9.815 -1.042 -6.600
426 HE3 LYS 60 2HE LYS 60 -8.751 -0.228 -7.745
427 HZ1 LYS 60 1HZ LYS 60 -10.259 -0.450 -9.336
428 HZ2 LYS 60 2HZ LYS 60 -11.350 -1.025 -8.179
429 HZ3 LYS 60 3HZ LYS 60 -10.409 -2.114 -9.068
430 H LYS 61 H LYS 61 -5.469 0.998 -8.195
431 HA LYS 61 HA LYS 61 -2.990 1.722 -6.840
432 HB2 LYS 61 1HB LYS 61 -2.640 2.205 -9.255
433 HB3 LYS 61 2HB LYS 61 -4.031 3.279 -9.213
434 HG2 LYS 61 1HG LYS 61 -2.930 4.883 -7.991
435 HG3 LYS 61 2HG LYS 61 -1.787 3.727 -7.303
436 HD2 LYS 61 1HD LYS 61 -0.443 4.819 -8.815
437 HD3 LYS 61 2HD LYS 61 -1.022 3.473 -9.800
438 HE2 LYS 61 1HE LYS 61 -2.735 4.899 -10.772
439 HE3 LYS 61 2HE LYS 61 -2.226 6.240 -9.747
440 HZ1 LYS 61 1HZ LYS 61 -0.246 4.975 -11.504
441 HZ2 LYS 61 2HZ LYS 61 -0.337 6.575 -10.963
442 HZ3 LYS 61 3HZ LYS 61 -1.373 6.035 -12.187
443 H ASP 62 H ASP 62 -3.476 2.815 -5.062
444 HA ASP 62 HA ASP 62 -5.910 4.475 -5.049
445 HB2 ASP 62 1HB ASP 62 -4.996 2.395 -3.126
446 HB3 ASP 62 2HB ASP 62 -5.765 3.833 -2.460
447 H MET 63 H MET 63 -5.207 6.514 -5.062
448 HA MET 63 HA MET 63 -2.706 7.318 -3.952
449 HB2 MET 63 1HB MET 63 -4.171 8.374 -5.875
450 HB3 MET 63 2HB MET 63 -4.877 9.285 -4.546
451 HG2 MET 63 1HG MET 63 -1.913 9.174 -4.944
452 HG3 MET 63 2HG MET 63 -2.918 10.312 -5.839
453 HE1 MET 63 1HE MET 63 -4.136 12.837 -3.498
454 HE2 MET 63 2HE MET 63 -4.500 11.825 -4.896
455 HE3 MET 63 3HE MET 63 -5.123 11.388 -3.304
456 H VAL 64 H VAL 64 -2.366 8.787 -2.205
457 HA VAL 64 HA VAL 64 -4.557 9.126 -0.306
458 HB VAL 64 HB VAL 64 -1.930 7.931 0.575
459 HG11 VAL 64 1HG1 VAL 64 -2.863 7.765 2.708
460 HG12 VAL 64 2HG1 VAL 64 -3.382 9.355 2.144
461 HG13 VAL 64 3HG1 VAL 64 -4.506 7.996 2.110
462 HG21 VAL 64 1HG2 VAL 64 -4.542 6.623 -0.117
463 HG22 VAL 64 2HG2 VAL 64 -2.917 6.199 -0.656
464 HG23 VAL 64 3HG2 VAL 64 -3.404 5.883 1.009
465 H GLU 65 H GLU 65 -4.354 10.906 1.007
466 HA GLU 65 HA GLU 65 -3.043 13.130 0.196
467 HB2 GLU 65 1HB GLU 65 -3.232 12.680 3.145
468 HB3 GLU 65 2HB GLU 65 -3.607 14.121 2.210
469 HG2 GLU 65 1HG GLU 65 -5.256 11.651 2.587
470 HG3 GLU 65 2HG GLU 65 -5.672 13.326 2.946
471 H GLY 66 H GLY 66 -1.078 14.117 0.490
472 HA2 GLY 66 1HA GLY 66 1.189 12.475 0.799
473 HA3 GLY 66 2HA GLY 66 1.197 14.232 0.772
474 H ASP 67 H ASP 67 -0.625 14.372 3.099
475 HA ASP 67 HA ASP 67 1.424 14.187 5.134
476 HB2 ASP 67 1HB ASP 67 -1.428 15.187 5.287
477 HB3 ASP 67 2HB ASP 67 -0.232 15.325 6.573
478 H ARG 68 H ARG 68 -0.863 12.112 3.911
479 HA ARG 68 HA ARG 68 -1.489 10.820 6.446
480 HB2 ARG 68 1HB ARG 68 -3.097 11.147 4.420
481 HB3 ARG 68 2HB ARG 68 -2.268 9.745 3.756
482 HG2 ARG 68 1HG ARG 68 -4.194 8.923 4.826
483 HG3 ARG 68 2HG ARG 68 -2.845 8.544 5.899
484 HD2 ARG 68 1HD ARG 68 -4.371 9.392 7.393
485 HD3 ARG 68 2HD ARG 68 -3.452 10.842 6.987
486 HE ARG 68 HE ARG 68 -6.190 10.232 6.217
487 HH11 ARG 68 1HH1 ARG 68 -3.415 12.308 5.884
488 HH12 ARG 68 2HH1 ARG 68 -4.322 13.634 5.234
489 HH21 ARG 68 1HH2 ARG 68 -7.395 11.971 5.364
490 HH22 ARG 68 2HH2 ARG 68 -6.586 13.441 4.940
491 H TYR 69 H TYR 69 -0.572 8.987 7.172
492 HA TYR 69 HA TYR 69 1.419 7.685 5.430
493 HB2 TYR 69 1HB TYR 69 1.499 8.422 8.327
494 HB3 TYR 69 2HB TYR 69 2.387 7.002 7.786
495 HD1 TYR 69 2HD TYR 69 1.857 10.431 6.382
496 HD2 TYR 69 1HD TYR 69 4.637 7.445 7.589
497 HE1 TYR 69 2HE TYR 69 3.713 11.874 5.658
498 HE2 TYR 69 1HE TYR 69 6.500 8.880 6.870
499 HH TYR 69 HH TYR 69 7.069 10.755 5.787
500 H TRP 70 H TRP 70 -1.556 7.217 6.326
501 HA TRP 70 HA TRP 70 -1.233 4.319 6.544
502 HB2 TRP 70 1HB TRP 70 -2.668 4.075 8.399
503 HB3 TRP 70 2HB TRP 70 -1.593 5.398 8.842
504 HD1 TRP 70 HD TRP 70 -2.670 7.756 9.257
505 HE1 TRP 70 1HE TRP 70 -5.099 8.597 9.385
506 HE3 TRP 70 3HE TRP 70 -5.049 3.659 7.334
507 HZ2 TRP 70 2HZ TRP 70 -7.682 7.649 8.755
508 HZ3 TRP 70 3HZ TRP 70 -7.501 3.707 7.131
509 HH2 TRP 70 HH TRP 70 -8.789 5.661 7.828
510 H HIS 71 H HIS 71 -2.990 3.112 5.747
511 HA HIS 71 HA HIS 71 -5.271 4.515 4.629
512 HB2 HIS 71 1HB HIS 71 -3.515 4.671 2.872
513 HB3 HIS 71 2HB HIS 71 -3.431 2.912 2.841
514 HD1 HIS 71 1HD HIS 71 -5.873 5.714 2.113
515 HD2 HIS 71 2HD HIS 71 -5.256 1.707 1.204
516 HE1 HIS 71 1HE HIS 71 -7.584 5.151 0.358
517 HE2 HIS 71 2HE HIS 71 -7.248 2.700 -0.114
518 H SER 72 H SER 72 -7.031 3.178 4.199
519 HA SER 72 HA SER 72 -6.710 0.379 5.068
520 HB2 SER 72 1HB SER 72 -8.918 0.474 6.059
521 HB3 SER 72 2HB SER 72 -7.959 1.812 6.691
522 HG SER 72 HG SER 72 -9.103 3.220 5.488
523 H ILE 73 H ILE 73 -6.669 -0.716 3.185
524 HA ILE 73 HA ILE 73 -8.187 -0.005 0.891
525 HB ILE 73 HB ILE 73 -6.994 -2.714 1.475
526 HG12 ILE 73 1HG1 ILE 73 -5.581 -0.535 -0.034
527 HG13 ILE 73 2HG1 ILE 73 -5.459 -0.625 1.720
528 HG21 ILE 73 1HG2 ILE 73 -6.847 -2.893 -0.951
529 HG22 ILE 73 2HG2 ILE 73 -8.511 -2.612 -0.440
530 HG23 ILE 73 3HG2 ILE 73 -7.563 -1.291 -1.122
531 HD11 ILE 73 1HD1 ILE 73 -4.516 -2.606 -0.320
532 HD12 ILE 73 2HD1 ILE 73 -3.581 -1.751 0.907
533 HD13 ILE 73 3HD1 ILE 73 -4.703 -3.025 1.383
534 H SER 74 H SER 74 -10.025 -0.945 0.019
535 HA SER 74 HA SER 74 -11.511 -2.805 1.743
536 HB2 SER 74 1HB SER 74 -12.969 -0.614 0.304
537 HB3 SER 74 2HB SER 74 -13.460 -1.531 1.728
538 HG SER 74 HG SER 74 -11.190 0.100 1.890
539 H HIS 75 H HIS 75 -13.602 -3.503 0.450
540 HA HIS 75 HA HIS 75 -14.437 -4.724 -1.278
541 HB2 HIS 75 1HB HIS 75 -12.736 -2.845 -2.930
542 HB3 HIS 75 2HB HIS 75 -13.971 -3.921 -3.577
543 HD1 HIS 75 1HD HIS 75 -15.467 -2.051 -4.450
544 HD2 HIS 75 2HD HIS 75 -14.674 -1.769 -0.382
545 HE1 HIS 75 1HE HIS 75 -17.046 -0.299 -3.577
546 HE2 HIS 75 2HE HIS 75 -16.489 -0.085 -1.130
547 H LEU 76 H LEU 76 -12.495 -6.016 0.025
548 HA LEU 76 HA LEU 76 -10.833 -7.216 -2.092
549 HB2 LEU 76 1HB LEU 76 -10.275 -7.405 0.851
550 HB3 LEU 76 2HB LEU 76 -9.186 -7.742 -0.493
551 HG LEU 76 HG LEU 76 -10.199 -4.962 -0.147
552 HD11 LEU 76 1HD1 LEU 76 -9.432 -4.832 1.940
553 HD12 LEU 76 2HD1 LEU 76 -7.820 -4.984 1.241
554 HD13 LEU 76 3HD1 LEU 76 -8.658 -6.414 1.844
555 HD21 LEU 76 1HD2 LEU 76 -8.491 -6.169 -1.897
556 HD22 LEU 76 2HD2 LEU 76 -7.377 -5.508 -0.700
557 HD23 LEU 76 3HD2 LEU 76 -8.514 -4.444 -1.529
558 H GLN 77 H GLN 77 -10.094 -9.548 -1.080
559 HA GLN 77 HA GLN 77 -12.629 -10.992 -0.803
560 HB2 GLN 77 1HB GLN 77 -9.906 -12.111 -1.475
561 HB3 GLN 77 2HB GLN 77 -11.451 -12.942 -1.600
562 HG2 GLN 77 1HG GLN 77 -10.948 -12.360 -3.788
563 HG3 GLN 77 2HG GLN 77 -12.089 -11.119 -3.272
564 HE21 GLN 77 1HE2 GLN 77 -10.863 -10.294 -5.317
565 HE22 GLN 77 2HE2 GLN 77 -9.530 -9.248 -4.981
566 HA PRO 78 HA PRO 78 -11.797 -11.966 3.411
567 HB2 PRO 78 1HB PRO 78 -13.394 -14.149 3.650
568 HB3 PRO 78 2HB PRO 78 -14.026 -12.500 3.566
569 HG2 PRO 78 1HG PRO 78 -13.816 -14.562 1.406
570 HG3 PRO 78 2HG PRO 78 -15.157 -13.461 1.775
571 HD2 PRO 78 1HD PRO 78 -13.391 -12.989 -0.223
572 HD3 PRO 78 2HD PRO 78 -14.156 -11.682 0.704
573 H GLU 79 H GLU 79 -10.697 -13.469 4.711
574 HA GLU 79 HA GLU 79 -8.806 -14.785 4.957
575 HB2 GLU 79 1HB GLU 79 -9.537 -17.237 4.250
576 HB3 GLU 79 2HB GLU 79 -10.227 -16.434 5.653
577 HG2 GLU 79 1HG GLU 79 -12.193 -15.839 4.426
578 HG3 GLU 79 2HG GLU 79 -11.487 -16.430 2.923
579 H THR 80 H THR 80 -8.662 -13.362 2.510
580 HA THR 80 HA THR 80 -7.488 -15.347 0.682
581 HB THR 80 HB THR 80 -8.303 -12.498 0.076
582 HG1 THR 80 1HG THR 80 -10.177 -13.619 0.263
583 HG21 THR 80 1HG2 THR 80 -6.417 -13.599 -1.271
584 HG22 THR 80 2HG2 THR 80 -7.773 -12.920 -2.170
585 HG23 THR 80 3HG2 THR 80 -7.670 -14.661 -1.911
586 H SER 81 H SER 81 -5.392 -15.583 1.184
587 HA SER 81 HA SER 81 -3.792 -13.390 2.144
588 HB2 SER 81 1HB SER 81 -3.618 -15.987 2.643
589 HB3 SER 81 2HB SER 81 -2.563 -15.956 1.230
590 HG SER 81 HG SER 81 -1.652 -14.011 2.527
591 H TYR 82 H TYR 82 -3.373 -11.841 0.679
592 HA TYR 82 HA TYR 82 -2.046 -12.673 -1.813
593 HB2 TYR 82 1HB TYR 82 -3.121 -10.671 -2.903
594 HB3 TYR 82 2HB TYR 82 -4.230 -11.973 -2.487
595 HD1 TYR 82 1HD TYR 82 -3.056 -8.612 -1.490
596 HD2 TYR 82 2HD TYR 82 -6.012 -11.626 -0.956
597 HE1 TYR 82 1HE TYR 82 -4.444 -7.019 -0.231
598 HE2 TYR 82 2HE TYR 82 -7.409 -10.041 0.304
599 HH TYR 82 HH TYR 82 -7.590 -7.986 1.112
600 H ASP 83 H ASP 83 -0.549 -11.127 -2.691
601 HA ASP 83 HA ASP 83 1.036 -9.876 -0.681
602 HB2 ASP 83 1HB ASP 83 1.186 -10.046 -3.676
603 HB3 ASP 83 2HB ASP 83 2.268 -8.976 -2.788
604 H ILE 84 H ILE 84 1.601 -7.644 -0.531
605 HA ILE 84 HA ILE 84 -0.181 -5.734 -1.833
606 HB ILE 84 HB ILE 84 0.104 -5.924 1.168
607 HG12 ILE 84 1HG1 ILE 84 -2.469 -5.974 -0.382
608 HG13 ILE 84 2HG1 ILE 84 -1.534 -7.449 -0.163
609 HG21 ILE 84 1HG2 ILE 84 -1.287 -3.956 1.297
610 HG22 ILE 84 2HG2 ILE 84 0.144 -3.601 0.331
611 HG23 ILE 84 3HG2 ILE 84 -1.406 -3.885 -0.461
612 HD11 ILE 84 1HD1 ILE 84 -3.296 -6.097 1.668
613 HD12 ILE 84 2HD1 ILE 84 -2.606 -7.718 1.753
614 HD13 ILE 84 3HD1 ILE 84 -1.699 -6.339 2.375
615 H LYS 85 H LYS 85 0.723 -3.755 -2.170
616 HA LYS 85 HA LYS 85 3.134 -2.967 -0.772
617 HB2 LYS 85 1HB LYS 85 4.589 -2.900 -2.618
618 HB3 LYS 85 2HB LYS 85 3.808 -4.472 -2.728
619 HG2 LYS 85 1HG LYS 85 2.253 -3.556 -4.402
620 HG3 LYS 85 2HG LYS 85 3.110 -2.015 -4.324
621 HD2 LYS 85 1HD LYS 85 4.948 -2.825 -5.423
622 HD3 LYS 85 2HD LYS 85 4.693 -4.477 -4.856
623 HE2 LYS 85 1HE LYS 85 4.145 -4.649 -7.092
624 HE3 LYS 85 2HE LYS 85 2.568 -4.378 -6.351
625 HZ1 LYS 85 1HZ LYS 85 3.680 -2.922 -8.381
626 HZ2 LYS 85 2HZ LYS 85 3.865 -1.928 -7.026
627 HZ3 LYS 85 3HZ LYS 85 2.329 -2.485 -7.462
628 H MET 86 H MET 86 3.905 -0.786 -1.576
629 HA MET 86 HA MET 86 1.920 0.811 -2.956
630 HB2 MET 86 1HB MET 86 1.551 2.381 -1.172
631 HB3 MET 86 2HB MET 86 1.157 0.772 -0.583
632 HG2 MET 86 1HG MET 86 2.357 1.501 1.186
633 HG3 MET 86 2HG MET 86 3.679 0.854 0.216
634 HE1 MET 86 1HE MET 86 2.026 4.530 -0.831
635 HE2 MET 86 2HE MET 86 1.425 3.811 0.663
636 HE3 MET 86 3HE MET 86 2.479 5.224 0.726
637 H GLN 87 H GLN 87 2.685 2.964 -3.461
638 HA GLN 87 HA GLN 87 5.525 3.461 -3.004
639 HB2 GLN 87 1HB GLN 87 5.619 2.273 -5.069
640 HB3 GLN 87 2HB GLN 87 4.250 3.165 -5.720
641 HG2 GLN 87 1HG GLN 87 5.798 5.232 -5.396
642 HG3 GLN 87 2HG GLN 87 7.082 4.025 -5.383
643 HE21 GLN 87 1HE2 GLN 87 7.463 2.797 -7.244
644 HE22 GLN 87 2HE2 GLN 87 6.895 3.302 -8.796
645 H CYS 88 H CYS 88 6.133 5.627 -3.181
646 HA CYS 88 HA CYS 88 3.886 7.499 -3.083
647 HB2 CYS 88 1HB CYS 88 5.203 8.891 -1.772
648 HB3 CYS 88 2HB CYS 88 5.773 7.298 -1.291
649 HG CYS 88 HG CYS 88 8.234 7.579 -2.018
650 H PHE 89 H PHE 89 4.262 9.691 -4.030
651 HA PHE 89 HA PHE 89 6.104 9.879 -6.239
652 HB2 PHE 89 1HB PHE 89 4.497 10.054 -8.004
653 HB3 PHE 89 2HB PHE 89 4.159 8.556 -7.143
654 HD1 PHE 89 1HD PHE 89 2.400 8.813 -5.181
655 HD2 PHE 89 2HD PHE 89 2.735 11.424 -8.526
656 HE1 PHE 89 1HE PHE 89 0.068 9.527 -4.853
657 HE2 PHE 89 2HE PHE 89 0.404 12.142 -8.203
658 HZ PHE 89 HZ PHE 89 -0.933 11.194 -6.365
659 H ASN 90 H ASN 90 6.042 11.999 -7.278
660 HA ASN 90 HA ASN 90 4.419 14.090 -6.212
661 HB2 ASN 90 1HB ASN 90 5.855 15.182 -4.784
662 HB3 ASN 90 2HB ASN 90 6.326 13.515 -4.467
663 HD21 ASN 90 1HD2 ASN 90 8.071 12.711 -6.037
664 HD22 ASN 90 2HD2 ASN 90 9.398 13.788 -6.288
665 H GLU 91 H GLU 91 5.239 16.282 -6.997
666 HA GLU 91 HA GLU 91 5.309 16.500 -9.662
667 HB2 GLU 91 1HB GLU 91 5.213 18.486 -8.351
668 HB3 GLU 91 2HB GLU 91 6.795 18.182 -7.649
669 HG2 GLU 91 1HG GLU 91 7.918 18.881 -9.525
670 HG3 GLU 91 2HG GLU 91 6.559 18.543 -10.595
671 H GLY 92 H GLY 92 8.047 15.633 -7.649
672 HA2 GLY 92 1HA GLY 92 10.037 15.874 -9.666
673 HA3 GLY 92 2HA GLY 92 10.187 14.969 -8.167
674 H GLY 93 H GLY 93 8.237 13.068 -8.412
675 HA2 GLY 93 1HA GLY 93 7.731 11.702 -10.664
676 HA3 GLY 93 2HA GLY 93 9.433 11.342 -10.417
677 H GLU 94 H GLU 94 7.792 9.243 -10.464
678 HA GLU 94 HA GLU 94 6.756 8.565 -7.881
679 HB2 GLU 94 1HB GLU 94 7.150 7.068 -10.453
680 HB3 GLU 94 2HB GLU 94 6.699 6.213 -8.985
681 HG2 GLU 94 1HG GLU 94 4.636 7.287 -8.847
682 HG3 GLU 94 2HG GLU 94 5.129 8.573 -9.948
683 H SER 95 H SER 95 7.642 7.322 -6.297
684 HA SER 95 HA SER 95 10.515 7.043 -6.322
685 HB2 SER 95 1HB SER 95 10.312 6.466 -3.996
686 HB3 SER 95 2HB SER 95 9.203 7.801 -4.311
687 HG SER 95 HG SER 95 7.687 5.852 -4.724
688 H GLU 96 H GLU 96 11.238 4.872 -5.083
689 HA GLU 96 HA GLU 96 10.926 2.806 -6.991
690 HB2 GLU 96 1HB GLU 96 12.110 2.773 -4.212
691 HB3 GLU 96 2HB GLU 96 12.209 1.429 -5.341
692 HG2 GLU 96 1HG GLU 96 13.208 3.318 -6.910
693 HG3 GLU 96 2HG GLU 96 13.626 4.028 -5.351
694 H PHE 97 H PHE 97 10.343 0.516 -6.288
695 HA PHE 97 HA PHE 97 7.642 0.586 -5.260
696 HB2 PHE 97 1HB PHE 97 9.355 -1.533 -6.531
697 HB3 PHE 97 2HB PHE 97 7.827 -1.948 -5.762
698 HD1 PHE 97 1HD PHE 97 8.957 0.825 -7.992
699 HD2 PHE 97 2HD PHE 97 6.181 -2.327 -7.304
700 HE1 PHE 97 1HE PHE 97 7.761 1.434 -10.054
701 HE2 PHE 97 2HE PHE 97 4.981 -1.724 -9.366
702 HZ PHE 97 HZ PHE 97 5.771 0.158 -10.744
703 H SER 98 H SER 98 7.074 0.190 -3.231
704 HA SER 98 HA SER 98 8.929 -0.304 -1.187
705 HB2 SER 98 1HB SER 98 7.038 -0.454 0.294
706 HB3 SER 98 2HB SER 98 6.678 0.783 -0.910
707 HG SER 98 HG SER 98 5.711 -1.879 -0.805
708 H ASN 99 H ASN 99 8.436 -2.179 0.458
709 HA ASN 99 HA ASN 99 9.140 -4.602 -0.889
710 HB2 ASN 99 1HB ASN 99 9.678 -5.437 1.195
711 HB3 ASN 99 2HB ASN 99 9.821 -3.707 1.495
712 HD21 ASN 99 1HD2 ASN 99 7.424 -2.794 1.937
713 HD22 ASN 99 2HD2 ASN 99 6.634 -3.610 3.239
714 H VAL 100 H VAL 100 8.028 -6.672 -0.519
715 HA VAL 100 HA VAL 100 5.169 -6.356 -0.945
716 HB VAL 100 HB VAL 100 6.870 -8.851 -1.066
717 HG11 VAL 100 1HG1 VAL 100 4.673 -9.574 -0.712
718 HG12 VAL 100 2HG1 VAL 100 3.994 -8.298 -1.724
719 HG13 VAL 100 3HG1 VAL 100 4.873 -9.637 -2.463
720 HG21 VAL 100 1HG2 VAL 100 7.439 -7.068 -2.729
721 HG22 VAL 100 2HG2 VAL 100 6.894 -8.587 -3.440
722 HG23 VAL 100 3HG2 VAL 100 5.796 -7.210 -3.354
723 H MET 101 H MET 101 3.783 -6.461 0.684
724 HA MET 101 HA MET 101 4.518 -8.032 3.063
725 HB2 MET 101 1HB MET 101 2.604 -5.703 2.832
726 HB3 MET 101 2HB MET 101 2.958 -6.588 4.310
727 HG2 MET 101 1HG MET 101 5.049 -5.126 2.723
728 HG3 MET 101 2HG MET 101 4.135 -4.391 4.038
729 HE1 MET 101 1HE MET 101 3.880 -5.579 6.322
730 HE2 MET 101 2HE MET 101 5.332 -6.078 7.190
731 HE3 MET 101 3HE MET 101 5.201 -4.435 6.561
732 H ILE 102 H ILE 102 3.387 -9.810 3.468
733 HA ILE 102 HA ILE 102 0.966 -10.329 1.922
734 HB ILE 102 HB ILE 102 2.628 -12.150 3.665
735 HG12 ILE 102 1HG1 ILE 102 2.241 -12.142 0.666
736 HG13 ILE 102 2HG1 ILE 102 3.620 -11.415 1.483
737 HG21 ILE 102 1HG2 ILE 102 0.808 -13.489 1.880
738 HG22 ILE 102 2HG2 ILE 102 1.008 -13.670 3.622
739 HG23 ILE 102 3HG2 ILE 102 -0.064 -12.424 2.983
740 HD11 ILE 102 1HD1 ILE 102 3.572 -13.962 2.505
741 HD12 ILE 102 2HD1 ILE 102 3.093 -14.190 0.822
742 HD13 ILE 102 3HD1 ILE 102 4.612 -13.381 1.205
743 H CYS 103 H CYS 103 -0.700 -9.276 2.900
744 HA CYS 103 HA CYS 103 -1.150 -9.799 5.759
745 HB2 CYS 103 1HB CYS 103 -1.000 -7.402 4.916
746 HB3 CYS 103 2HB CYS 103 -2.526 -7.696 4.090
747 HG CYS 103 HG CYS 103 -2.708 -6.231 6.611
748 H GLU 104 H GLU 104 -2.364 -11.576 5.973
749 HA GLU 104 HA GLU 104 -4.342 -12.337 4.039
750 HB2 GLU 104 1HB GLU 104 -2.907 -13.852 5.586
751 HB3 GLU 104 2HB GLU 104 -4.138 -13.513 6.793
752 HG2 GLU 104 1HG GLU 104 -5.754 -14.254 4.845
753 HG3 GLU 104 2HG GLU 104 -4.312 -15.108 4.298
754 H THR 105 H THR 105 -6.421 -11.797 3.984
755 HA THR 105 HA THR 105 -7.508 -9.931 5.832
756 HB THR 105 HB THR 105 -9.684 -10.423 4.577
757 HG1 THR 105 1HG THR 105 -8.782 -11.454 2.404
758 HG21 THR 105 1HG2 THR 105 -7.777 -8.677 4.061
759 HG22 THR 105 2HG2 THR 105 -9.111 -8.920 2.934
760 HG23 THR 105 3HG2 THR 105 -7.551 -9.682 2.630
761 H LYS 106 H LYS 106 -9.832 -10.382 6.696
762 HA LYS 106 HA LYS 106 -9.590 -12.546 8.573
763 HB2 LYS 106 1HB LYS 106 -11.861 -10.602 8.114
764 HB3 LYS 106 2HB LYS 106 -11.711 -11.692 9.486
765 HG2 LYS 106 1HG LYS 106 -9.473 -9.818 8.956
766 HG3 LYS 106 2HG LYS 106 -10.972 -9.160 9.616
767 HD2 LYS 106 1HD LYS 106 -10.763 -10.306 11.595
768 HD3 LYS 106 2HD LYS 106 -9.810 -11.602 10.868
769 HE2 LYS 106 1HE LYS 106 -8.000 -9.798 10.553
770 HE3 LYS 106 2HE LYS 106 -8.931 -8.863 11.721
771 HZ1 LYS 106 1HZ LYS 106 -7.230 -11.144 12.137
772 HZ2 LYS 106 2HZ LYS 106 -8.729 -11.281 12.909
773 HZ3 LYS 106 3HZ LYS 106 -7.730 -9.955 13.231
774 H ALA 107 H ALA 107 -10.976 -14.316 8.809
775 HA ALA 107 HA ALA 107 -11.870 -15.486 6.374
776 HB1 ALA 107 1HB ALA 107 -11.067 -16.511 8.721
777 HB2 ALA 107 2HB ALA 107 -12.815 -16.643 8.920
778 HB3 ALA 107 3HB ALA 107 -12.024 -17.412 7.544
779 H ARG 108 H ARG 108 -13.760 -15.252 5.386
780 HA ARG 108 HA ARG 108 -15.817 -13.606 6.388
781 HB2 ARG 108 1HB ARG 108 -17.130 -14.523 4.432
782 HB3 ARG 108 2HB ARG 108 -15.590 -13.775 4.031
783 HG2 ARG 108 1HG ARG 108 -14.601 -15.782 3.485
784 HG3 ARG 108 2HG ARG 108 -15.729 -16.722 4.465
785 HD2 ARG 108 1HD ARG 108 -16.743 -15.184 2.116
786 HD3 ARG 108 2HD ARG 108 -15.919 -16.721 1.856
787 HE ARG 108 HE ARG 108 -18.566 -16.367 2.781
788 HH11 ARG 108 1HH1 ARG 108 -15.743 -18.347 3.263
789 HH12 ARG 108 2HH1 ARG 108 -16.643 -19.729 3.794
790 HH21 ARG 108 1HH2 ARG 108 -19.762 -18.180 3.479
791 HH22 ARG 108 2HH2 ARG 108 -18.929 -19.633 3.915
792 H SER 109 H SER 109 -16.037 -14.717 8.505
793 HA SER 109 HA SER 109 -18.059 -16.848 8.317
794 HB2 SER 109 1HB SER 109 -15.705 -16.673 10.200
795 HB3 SER 109 2HB SER 109 -17.098 -17.706 10.518
796 HG SER 109 HG SER 109 -15.840 -17.874 8.022
797 H GLY 110 H GLY 110 -19.756 -16.749 9.767
798 HA2 GLY 110 1HA GLY 110 -20.427 -14.168 10.749
799 HA3 GLY 110 2HA GLY 110 -21.332 -15.649 11.029
800 HA PRO 111 HA PRO 111 -18.764 -14.159 14.809
801 HB2 PRO 111 1HB PRO 111 -20.598 -12.611 16.079
802 HB3 PRO 111 2HB PRO 111 -19.423 -11.961 14.929
803 HG2 PRO 111 1HG PRO 111 -22.301 -12.664 14.502
804 HG3 PRO 111 2HG PRO 111 -21.400 -11.246 13.936
805 HD2 PRO 111 1HD PRO 111 -21.936 -13.365 12.338
806 HD3 PRO 111 2HD PRO 111 -20.461 -12.390 12.170
807 H SER 112 H SER 112 -18.985 -15.119 16.823
808 HA SER 112 HA SER 112 -21.047 -17.144 17.005
809 HB2 SER 112 1HB SER 112 -19.746 -18.114 18.732
810 HB3 SER 112 2HB SER 112 -18.575 -17.494 17.569
811 HG SER 112 HG SER 112 -18.867 -15.505 19.107
812 H SER 113 H SER 113 -21.989 -17.532 19.269
813 HA SER 113 HA SER 113 -22.857 -14.955 20.407
814 HB2 SER 113 1HB SER 113 -24.463 -17.440 19.815
815 HB3 SER 113 2HB SER 113 -25.025 -16.210 20.946
816 HG SER 113 HG SER 113 -25.074 -14.728 19.295
817 H GLY 114 H GLY 114 -22.377 -18.413 21.050
818 HA2 GLY 114 1HA GLY 114 -20.909 -18.298 23.308
819 HA3 GLY 114 2HA GLY 114 -22.534 -18.014 23.914
Start of MODEL 13
1 H1 GLY 1 H GLY 1 23.913 12.116 -21.182
2 HA2 GLY 1 1HA GLY 1 24.164 10.770 -18.619
3 HA3 GLY 1 2HA GLY 1 25.674 11.327 -19.326
4 H SER 2 H SER 2 22.574 12.325 -18.022
5 HA SER 2 HA SER 2 23.750 14.950 -17.433
6 HB2 SER 2 1HB SER 2 21.509 15.987 -17.918
7 HB3 SER 2 2HB SER 2 22.343 15.363 -19.340
8 HG SER 2 HG SER 2 20.966 13.658 -19.410
9 H SER 3 H SER 3 23.583 15.467 -15.356
10 HA SER 3 HA SER 3 22.656 13.846 -13.368
11 HB2 SER 3 1HB SER 3 22.613 15.845 -11.911
12 HB3 SER 3 2HB SER 3 24.054 15.802 -12.927
13 HG SER 3 HG SER 3 22.885 17.867 -12.799
14 H GLY 4 H GLY 4 20.759 13.417 -12.363
15 HA2 GLY 4 1HA GLY 4 18.390 14.971 -13.173
16 HA3 GLY 4 2HA GLY 4 18.373 13.218 -13.295
17 H SER 5 H SER 5 18.262 11.965 -11.421
18 HA SER 5 HA SER 5 17.286 11.506 -9.398
19 HB2 SER 5 1HB SER 5 19.244 13.644 -8.526
20 HB3 SER 5 2HB SER 5 18.536 12.403 -7.493
21 HG SER 5 HG SER 5 19.926 11.634 -9.804
22 H SER 6 H SER 6 15.869 13.478 -10.934
23 HA SER 6 HA SER 6 14.989 15.496 -9.045
24 HB2 SER 6 1HB SER 6 14.289 14.866 -11.907
25 HB3 SER 6 2HB SER 6 13.366 16.039 -10.968
26 HG SER 6 HG SER 6 15.681 16.861 -10.529
27 H GLY 7 H GLY 7 14.092 14.182 -7.402
28 HA2 GLY 7 1HA GLY 7 11.586 13.919 -6.906
29 HA3 GLY 7 2HA GLY 7 11.667 12.689 -8.159
30 HA PRO 8 HA PRO 8 12.758 11.037 -3.823
31 HB2 PRO 8 1HB PRO 8 10.423 9.765 -3.276
32 HB3 PRO 8 2HB PRO 8 10.739 11.439 -2.804
33 HG2 PRO 8 1HG PRO 8 9.199 10.391 -5.147
34 HG3 PRO 8 2HG PRO 8 8.801 11.730 -4.055
35 HD2 PRO 8 1HD PRO 8 9.864 12.122 -6.514
36 HD3 PRO 8 2HD PRO 8 10.201 13.201 -5.145
37 H VAL 9 H VAL 9 13.865 9.193 -3.940
38 HA VAL 9 HA VAL 9 12.948 7.118 -5.822
39 HB VAL 9 HB VAL 9 15.283 6.367 -5.955
40 HG11 VAL 9 1HG1 VAL 9 15.900 9.049 -6.677
41 HG12 VAL 9 2HG1 VAL 9 15.431 7.704 -7.720
42 HG13 VAL 9 3HG1 VAL 9 14.196 8.754 -7.023
43 HG21 VAL 9 1HG2 VAL 9 16.300 6.929 -3.950
44 HG22 VAL 9 2HG2 VAL 9 16.998 8.099 -5.070
45 HG23 VAL 9 3HG2 VAL 9 15.693 8.585 -3.988
46 H ALA 10 H ALA 10 14.493 7.650 -2.674
47 HA ALA 10 HA ALA 10 14.851 5.154 -1.705
48 HB1 ALA 10 1HB ALA 10 13.482 6.676 0.317
49 HB2 ALA 10 2HB ALA 10 15.188 6.239 0.204
50 HB3 ALA 10 3HB ALA 10 14.598 7.702 -0.585
51 H GLY 11 H GLY 11 11.738 6.860 -1.847
52 HA2 GLY 11 1HA GLY 11 9.588 6.049 -1.866
53 HA3 GLY 11 2HA GLY 11 10.267 4.465 -2.212
54 HA PRO 12 HA PRO 12 8.750 5.028 2.322
55 HB2 PRO 12 1HB PRO 12 6.156 4.259 2.100
56 HB3 PRO 12 2HB PRO 12 6.671 5.946 1.982
57 HG2 PRO 12 1HG PRO 12 6.028 4.006 -0.204
58 HG3 PRO 12 2HG PRO 12 5.576 5.714 -0.056
59 HD2 PRO 12 1HD PRO 12 7.625 4.879 -1.616
60 HD3 PRO 12 2HD PRO 12 7.632 6.451 -0.792
61 H TYR 13 H TYR 13 8.160 3.256 3.731
62 HA TYR 13 HA TYR 13 8.168 0.611 2.455
63 HB2 TYR 13 1HB TYR 13 10.389 0.630 3.070
64 HB3 TYR 13 2HB TYR 13 10.112 1.698 4.441
65 HD1 TYR 13 1HD TYR 13 8.948 -1.702 3.387
66 HD2 TYR 13 2HD TYR 13 10.550 0.737 6.482
67 HE1 TYR 13 1HE TYR 13 8.974 -3.644 4.896
68 HE2 TYR 13 2HE TYR 13 10.582 -1.198 7.999
69 HH TYR 13 HH TYR 13 9.162 -3.484 8.094
70 H ILE 14 H ILE 14 6.747 -0.786 3.301
71 HA ILE 14 HA ILE 14 4.926 0.103 5.316
72 HB ILE 14 HB ILE 14 5.158 -2.684 4.184
73 HG12 ILE 14 1HG1 ILE 14 3.220 -0.675 3.121
74 HG13 ILE 14 2HG1 ILE 14 4.892 -0.594 2.575
75 HG21 ILE 14 1HG2 ILE 14 3.036 -1.186 5.675
76 HG22 ILE 14 2HG2 ILE 14 2.628 -2.549 4.636
77 HG23 ILE 14 3HG2 ILE 14 3.714 -2.780 6.006
78 HD11 ILE 14 1HD1 ILE 14 3.225 -3.087 2.419
79 HD12 ILE 14 2HD1 ILE 14 3.341 -1.903 1.116
80 HD13 ILE 14 3HD1 ILE 14 4.781 -2.771 1.650
81 H THR 15 H THR 15 5.028 -0.181 7.442
82 HA THR 15 HA THR 15 6.871 -2.226 8.497
83 HB THR 15 HB THR 15 7.532 -0.820 10.266
84 HG1 THR 15 1HG THR 15 5.576 0.099 10.862
85 HG21 THR 15 1HG2 THR 15 7.421 1.414 8.374
86 HG22 THR 15 2HG2 THR 15 8.017 -0.091 7.674
87 HG23 THR 15 3HG2 THR 15 8.814 0.601 9.087
88 H PHE 16 H PHE 16 3.745 -1.665 8.070
89 HA PHE 16 HA PHE 16 2.977 -3.301 10.324
90 HB2 PHE 16 1HB PHE 16 2.894 -0.827 11.052
91 HB3 PHE 16 2HB PHE 16 1.502 -0.699 9.982
92 HD1 PHE 16 2HD PHE 16 -0.484 -2.197 10.408
93 HD2 PHE 16 1HD PHE 16 2.685 -1.704 13.207
94 HE1 PHE 16 2HE PHE 16 -1.939 -3.048 12.200
95 HE2 PHE 16 1HE PHE 16 1.235 -2.555 15.004
96 HZ PHE 16 HZ PHE 16 -1.081 -3.227 14.502
97 H THR 17 H THR 17 1.607 -4.771 9.584
98 HA THR 17 HA THR 17 -0.358 -4.019 7.545
99 HB THR 17 HB THR 17 0.163 -6.430 6.581
100 HG1 THR 17 1HG THR 17 2.189 -7.104 6.915
101 HG21 THR 17 1HG2 THR 17 2.177 -4.432 5.724
102 HG22 THR 17 2HG2 THR 17 0.484 -3.941 5.651
103 HG23 THR 17 3HG2 THR 17 1.029 -5.366 4.766
104 H ASP 18 H ASP 18 -2.236 -4.397 8.526
105 HA ASP 18 HA ASP 18 -2.679 -7.043 9.705
106 HB2 ASP 18 1HB ASP 18 -2.928 -4.414 11.078
107 HB3 ASP 18 2HB ASP 18 -4.164 -5.622 11.413
108 H ALA 19 H ALA 19 -4.864 -7.734 9.699
109 HA ALA 19 HA ALA 19 -6.443 -6.459 7.600
110 HB1 ALA 19 1HB ALA 19 -6.154 -8.781 7.257
111 HB2 ALA 19 2HB ALA 19 -6.605 -9.157 8.921
112 HB3 ALA 19 3HB ALA 19 -7.822 -8.565 7.790
113 H VAL 20 H VAL 20 -7.853 -4.961 8.217
114 HA VAL 20 HA VAL 20 -8.856 -4.757 10.879
115 HB VAL 20 HB VAL 20 -9.924 -3.345 8.435
116 HG11 VAL 20 1HG1 VAL 20 -10.325 -3.105 11.344
117 HG12 VAL 20 2HG1 VAL 20 -10.109 -1.588 10.470
118 HG13 VAL 20 3HG1 VAL 20 -11.402 -2.695 10.010
119 HG21 VAL 20 1HG2 VAL 20 -7.845 -2.186 10.248
120 HG22 VAL 20 2HG2 VAL 20 -7.373 -3.218 8.897
121 HG23 VAL 20 3HG2 VAL 20 -8.270 -1.729 8.598
122 H ASN 21 H ASN 21 -10.010 -6.190 7.920
123 HA ASN 21 HA ASN 21 -12.112 -7.547 9.335
124 HB2 ASN 21 1HB ASN 21 -12.701 -5.261 7.518
125 HB3 ASN 21 2HB ASN 21 -13.756 -6.669 7.426
126 HD21 ASN 21 1HD2 ASN 21 -14.642 -4.168 8.225
127 HD22 ASN 21 2HD2 ASN 21 -15.094 -4.240 9.891
128 H GLU 22 H GLU 22 -13.547 -8.720 7.514
129 HA GLU 22 HA GLU 22 -11.715 -10.416 6.137
130 HB2 GLU 22 1HB GLU 22 -13.739 -11.562 5.312
131 HB3 GLU 22 2HB GLU 22 -13.771 -11.322 7.053
132 HG2 GLU 22 1HG GLU 22 -15.067 -9.284 5.325
133 HG3 GLU 22 2HG GLU 22 -15.873 -10.835 5.553
134 H THR 23 H THR 23 -13.132 -7.462 5.359
135 HA THR 23 HA THR 23 -12.418 -7.831 2.530
136 HB THR 23 HB THR 23 -14.317 -6.259 1.955
137 HG1 THR 23 1HG THR 23 -14.766 -5.515 4.070
138 HG21 THR 23 1HG2 THR 23 -15.779 -8.531 3.014
139 HG22 THR 23 2HG2 THR 23 -14.270 -9.020 2.244
140 HG23 THR 23 3HG2 THR 23 -15.457 -8.081 1.340
141 H THR 24 H THR 24 -11.534 -6.376 5.214
142 HA THR 24 HA THR 24 -10.618 -3.967 3.807
143 HB THR 24 HB THR 24 -11.479 -3.845 6.692
144 HG1 THR 24 1HG THR 24 -13.465 -3.876 5.974
145 HG21 THR 24 1HG2 THR 24 -9.899 -2.145 5.528
146 HG22 THR 24 2HG2 THR 24 -11.245 -1.540 6.493
147 HG23 THR 24 3HG2 THR 24 -11.368 -1.579 4.735
148 H ILE 25 H ILE 25 -8.585 -3.235 4.382
149 HA ILE 25 HA ILE 25 -7.143 -4.717 6.461
150 HB ILE 25 HB ILE 25 -6.320 -4.457 3.581
151 HG12 ILE 25 1HG1 ILE 25 -6.421 -6.770 5.530
152 HG13 ILE 25 2HG1 ILE 25 -7.540 -6.476 4.203
153 HG21 ILE 25 1HG2 ILE 25 -4.133 -5.549 4.624
154 HG22 ILE 25 2HG2 ILE 25 -4.316 -3.806 4.432
155 HG23 ILE 25 3HG2 ILE 25 -4.611 -4.556 6.000
156 HD11 ILE 25 1HD1 ILE 25 -4.902 -7.713 4.197
157 HD12 ILE 25 2HD1 ILE 25 -6.243 -7.882 3.064
158 HD13 ILE 25 3HD1 ILE 25 -5.134 -6.519 2.921
159 H MET 26 H MET 26 -5.564 -3.568 7.517
160 HA MET 26 HA MET 26 -5.338 -0.727 6.773
161 HB2 MET 26 1HB MET 26 -6.439 -0.909 8.886
162 HB3 MET 26 2HB MET 26 -5.256 -2.070 9.474
163 HG2 MET 26 1HG MET 26 -4.438 -0.252 10.513
164 HG3 MET 26 2HG MET 26 -3.620 -0.026 8.969
165 HE1 MET 26 1HE MET 26 -4.546 1.068 7.098
166 HE2 MET 26 2HE MET 26 -5.836 2.269 7.053
167 HE3 MET 26 3HE MET 26 -4.216 2.734 7.573
168 H LEU 27 H LEU 27 -3.425 -0.146 6.007
169 HA LEU 27 HA LEU 27 -1.024 -1.523 7.009
170 HB2 LEU 27 1HB LEU 27 -0.123 -1.756 4.904
171 HB3 LEU 27 2HB LEU 27 -1.830 -2.091 4.619
172 HG LEU 27 HG LEU 27 -0.701 0.649 4.159
173 HD11 LEU 27 1HD1 LEU 27 0.537 -0.053 2.462
174 HD12 LEU 27 2HD1 LEU 27 -0.916 -0.694 1.695
175 HD13 LEU 27 3HD1 LEU 27 0.048 -1.723 2.754
176 HD21 LEU 27 1HD2 LEU 27 -2.687 1.098 3.223
177 HD22 LEU 27 2HD2 LEU 27 -3.247 -0.316 4.117
178 HD23 LEU 27 3HD2 LEU 27 -2.777 -0.472 2.424
179 H LYS 28 H LYS 28 0.646 -0.251 7.594
180 HA LYS 28 HA LYS 28 0.407 2.635 7.045
181 HB2 LYS 28 1HB LYS 28 1.544 1.320 9.519
182 HB3 LYS 28 2HB LYS 28 1.457 3.051 9.223
183 HG2 LYS 28 1HG LYS 28 -0.806 3.140 9.581
184 HG3 LYS 28 2HG LYS 28 -1.051 1.447 9.144
185 HD2 LYS 28 1HD LYS 28 -0.142 0.701 11.219
186 HD3 LYS 28 2HD LYS 28 0.414 2.326 11.626
187 HE2 LYS 28 1HE LYS 28 -2.023 3.022 11.552
188 HE3 LYS 28 2HE LYS 28 -2.413 1.304 11.495
189 HZ1 LYS 28 1HZ LYS 28 -0.598 1.705 13.577
190 HZ2 LYS 28 2HZ LYS 28 -2.220 1.237 13.684
191 HZ3 LYS 28 3HZ LYS 28 -1.807 2.877 13.735
192 H TRP 29 H TRP 29 2.157 3.672 6.258
193 HA TRP 29 HA TRP 29 4.606 2.072 5.901
194 HB2 TRP 29 1HB TRP 29 5.039 3.558 3.927
195 HB3 TRP 29 2HB TRP 29 3.609 2.541 3.767
196 HD1 TRP 29 HD TRP 29 4.648 6.199 4.202
197 HE1 TRP 29 1HE TRP 29 2.635 7.698 3.630
198 HE3 TRP 29 3HE TRP 29 1.063 2.588 3.702
199 HZ2 TRP 29 2HZ TRP 29 -0.109 7.391 3.045
200 HZ3 TRP 29 3HZ TRP 29 -1.231 3.275 3.136
201 HH2 TRP 29 HH TRP 29 -1.803 5.627 2.815
202 H MET 30 H MET 30 6.635 3.342 5.779
203 HA MET 30 HA MET 30 6.532 5.718 7.518
204 HB2 MET 30 1HB MET 30 8.375 5.000 8.753
205 HB3 MET 30 2HB MET 30 7.446 3.523 8.531
206 HG2 MET 30 1HG MET 30 8.912 2.854 6.712
207 HG3 MET 30 2HG MET 30 9.825 4.351 6.885
208 HE1 MET 30 1HE MET 30 11.505 4.296 10.067
209 HE2 MET 30 2HE MET 30 12.432 3.878 8.627
210 HE3 MET 30 3HE MET 30 11.117 5.049 8.520
211 H TYR 31 H TYR 31 8.437 7.148 7.300
212 HA TYR 31 HA TYR 31 9.591 7.051 4.592
213 HB2 TYR 31 1HB TYR 31 7.725 8.747 4.869
214 HB3 TYR 31 2HB TYR 31 8.777 9.599 5.995
215 HD1 TYR 31 1HD TYR 31 8.378 8.550 2.477
216 HD2 TYR 31 2HD TYR 31 10.579 10.949 5.216
217 HE1 TYR 31 1HE TYR 31 9.433 9.724 0.591
218 HE2 TYR 31 2HE TYR 31 11.639 12.131 3.338
219 HH TYR 31 HH TYR 31 11.280 12.589 1.012
220 H ILE 32 H ILE 32 11.728 7.458 4.432
221 HA ILE 32 HA ILE 32 13.150 8.101 6.928
222 HB ILE 32 HB ILE 32 14.146 6.618 4.492
223 HG12 ILE 32 1HG1 ILE 32 14.373 4.763 6.255
224 HG13 ILE 32 2HG1 ILE 32 13.317 5.752 7.258
225 HG21 ILE 32 1HG2 ILE 32 15.523 7.803 6.814
226 HG22 ILE 32 2HG2 ILE 32 16.008 6.165 6.379
227 HG23 ILE 32 3HG2 ILE 32 16.119 7.462 5.190
228 HD11 ILE 32 1HD1 ILE 32 12.572 4.856 4.491
229 HD12 ILE 32 2HD1 ILE 32 12.202 3.928 5.945
230 HD13 ILE 32 3HD1 ILE 32 11.527 5.543 5.734
231 HA PRO 33 HA PRO 33 13.933 11.922 4.642
232 HB2 PRO 33 1HB PRO 33 14.766 13.305 6.825
233 HB3 PRO 33 2HB PRO 33 13.059 13.058 6.438
234 HG2 PRO 33 1HG PRO 33 14.794 11.583 8.382
235 HG3 PRO 33 2HG PRO 33 13.125 12.151 8.578
236 HD2 PRO 33 1HD PRO 33 13.730 9.576 7.997
237 HD3 PRO 33 2HD PRO 33 12.248 10.363 7.417
238 H ALA 34 H ALA 34 15.990 9.850 6.445
239 HA ALA 34 HA ALA 34 18.421 11.207 6.392
240 HB1 ALA 34 1HB ALA 34 19.426 8.875 6.351
241 HB2 ALA 34 2HB ALA 34 18.309 9.234 7.669
242 HB3 ALA 34 3HB ALA 34 17.768 8.276 6.291
243 H SER 35 H SER 35 17.574 8.565 4.151
244 HA SER 35 HA SER 35 19.438 9.628 2.197
245 HB2 SER 35 1HB SER 35 19.436 7.224 2.561
246 HB3 SER 35 2HB SER 35 17.717 7.137 2.176
247 HG SER 35 HG SER 35 19.728 6.926 0.509
248 H ASN 36 H ASN 36 17.342 11.373 2.619
249 HA ASN 36 HA ASN 36 15.748 11.089 0.157
250 HB2 ASN 36 1HB ASN 36 14.321 11.059 2.123
251 HB3 ASN 36 2HB ASN 36 15.064 12.539 2.722
252 HD21 ASN 36 1HD2 ASN 36 14.003 11.688 -0.539
253 HD22 ASN 36 2HD2 ASN 36 12.850 12.967 -0.687
254 H ASN 37 H ASN 37 15.209 13.109 -0.950
255 HA ASN 37 HA ASN 37 17.501 14.920 -0.934
256 HB2 ASN 37 1HB ASN 37 15.342 14.290 -2.924
257 HB3 ASN 37 2HB ASN 37 16.278 15.775 -3.071
258 HD21 ASN 37 1HD2 ASN 37 18.301 15.695 -3.867
259 HD22 ASN 37 2HD2 ASN 37 19.090 14.245 -4.379
260 H ASN 38 H ASN 38 15.088 14.898 0.966
261 HA ASN 38 HA ASN 38 13.761 16.401 2.044
262 HB2 ASN 38 1HB ASN 38 16.160 17.486 2.014
263 HB3 ASN 38 2HB ASN 38 15.396 18.651 0.935
264 HD21 ASN 38 1HD2 ASN 38 14.667 16.988 3.988
265 HD22 ASN 38 2HD2 ASN 38 14.073 18.390 4.804
266 H THR 39 H THR 39 12.877 15.639 -0.523
267 HA THR 39 HA THR 39 11.736 18.111 -1.627
268 HB THR 39 HB THR 39 12.947 16.373 -3.105
269 HG1 THR 39 1HG THR 39 11.407 16.805 -4.789
270 HG21 THR 39 1HG2 THR 39 10.255 15.022 -2.931
271 HG22 THR 39 2HG2 THR 39 11.707 14.431 -2.123
272 HG23 THR 39 3HG2 THR 39 11.650 14.515 -3.883
273 HA PRO 40 HA PRO 40 7.820 17.176 0.179
274 HB2 PRO 40 1HB PRO 40 6.274 18.745 -1.409
275 HB3 PRO 40 2HB PRO 40 7.320 19.396 -0.142
276 HG2 PRO 40 1HG PRO 40 7.804 19.214 -3.091
277 HG3 PRO 40 2HG PRO 40 8.141 20.556 -1.982
278 HD2 PRO 40 1HD PRO 40 10.062 18.842 -2.821
279 HD3 PRO 40 2HD PRO 40 10.092 19.598 -1.215
280 H ILE 41 H ILE 41 6.383 15.580 -0.100
281 HA ILE 41 HA ILE 41 6.199 14.321 -2.729
282 HB ILE 41 HB ILE 41 5.001 13.293 -0.164
283 HG12 ILE 41 1HG1 ILE 41 7.754 12.720 -1.282
284 HG13 ILE 41 2HG1 ILE 41 7.422 13.692 0.146
285 HG21 ILE 41 1HG2 ILE 41 4.212 12.305 -2.277
286 HG22 ILE 41 2HG2 ILE 41 5.873 11.871 -2.674
287 HG23 ILE 41 3HG2 ILE 41 5.083 11.144 -1.275
288 HD11 ILE 41 1HD1 ILE 41 6.136 11.194 0.482
289 HD12 ILE 41 2HD1 ILE 41 7.793 10.895 -0.046
290 HD13 ILE 41 3HD1 ILE 41 7.487 11.872 1.390
291 H HIS 42 H HIS 42 4.301 14.029 -3.843
292 HA HIS 42 HA HIS 42 2.236 15.950 -3.378
293 HB2 HIS 42 1HB HIS 42 2.726 13.812 -5.418
294 HB3 HIS 42 2HB HIS 42 1.134 14.558 -5.310
295 HD1 HIS 42 1HD HIS 42 2.244 15.129 -7.882
296 HD2 HIS 42 2HD HIS 42 3.432 17.359 -4.585
297 HE1 HIS 42 1HE HIS 42 3.176 17.269 -8.818
298 HE2 HIS 42 2HE HIS 42 3.966 18.566 -6.809
299 H GLY 43 H GLY 43 2.457 12.419 -3.116
300 HA2 GLY 43 1HA GLY 43 0.502 12.353 -1.035
301 HA3 GLY 43 2HA GLY 43 -0.165 11.783 -2.557
302 H PHE 44 H PHE 44 -0.429 9.659 -2.027
303 HA PHE 44 HA PHE 44 1.981 8.055 -1.974
304 HB2 PHE 44 1HB PHE 44 0.135 8.297 0.367
305 HB3 PHE 44 2HB PHE 44 0.875 6.737 0.025
306 HD1 PHE 44 2HD PHE 44 3.524 7.060 -0.602
307 HD2 PHE 44 1HD PHE 44 1.195 9.524 1.972
308 HE1 PHE 44 2HE PHE 44 5.572 7.778 0.558
309 HE2 PHE 44 1HE PHE 44 3.239 10.246 3.136
310 HZ PHE 44 HZ PHE 44 5.431 9.372 2.430
311 H TYR 45 H TYR 45 1.663 6.497 -3.404
312 HA TYR 45 HA TYR 45 -1.068 5.689 -4.063
313 HB2 TYR 45 1HB TYR 45 1.564 5.562 -5.466
314 HB3 TYR 45 2HB TYR 45 0.331 4.383 -5.897
315 HD1 TYR 45 2HD TYR 45 -2.138 5.915 -5.772
316 HD2 TYR 45 1HD TYR 45 1.692 7.079 -7.214
317 HE1 TYR 45 2HE TYR 45 -3.203 7.565 -7.253
318 HE2 TYR 45 1HE TYR 45 0.637 8.733 -8.698
319 HH TYR 45 HH TYR 45 -1.505 9.162 -9.749
320 H ILE 46 H ILE 46 -1.795 3.587 -3.954
321 HA ILE 46 HA ILE 46 -0.009 1.625 -2.681
322 HB ILE 46 HB ILE 46 -2.906 2.070 -1.949
323 HG12 ILE 46 1HG1 ILE 46 -0.636 2.368 -0.028
324 HG13 ILE 46 2HG1 ILE 46 -0.968 3.684 -1.149
325 HG21 ILE 46 1HG2 ILE 46 -0.885 0.175 -0.760
326 HG22 ILE 46 2HG2 ILE 46 -2.570 0.360 -0.275
327 HG23 ILE 46 3HG2 ILE 46 -2.176 -0.286 -1.868
328 HD11 ILE 46 1HD1 ILE 46 -2.686 2.601 1.042
329 HD12 ILE 46 2HD1 ILE 46 -2.165 4.260 0.746
330 HD13 ILE 46 3HD1 ILE 46 -3.383 3.519 -0.292
331 H TYR 47 H TYR 47 0.068 -0.261 -3.708
332 HA TYR 47 HA TYR 47 -2.071 -0.883 -5.636
333 HB2 TYR 47 1HB TYR 47 0.822 -1.764 -5.701
334 HB3 TYR 47 2HB TYR 47 -0.401 -2.139 -6.910
335 HD1 TYR 47 2HD TYR 47 1.027 0.878 -5.218
336 HD2 TYR 47 1HD TYR 47 -0.378 -0.873 -8.832
337 HE1 TYR 47 2HE TYR 47 1.606 2.936 -6.434
338 HE2 TYR 47 1HE TYR 47 0.198 1.180 -10.058
339 HH TYR 47 HH TYR 47 1.709 3.940 -8.410
340 H TYR 48 H TYR 48 -2.790 -3.030 -5.818
341 HA TYR 48 HA TYR 48 -1.812 -5.057 -4.018
342 HB2 TYR 48 1HB TYR 48 -4.178 -5.354 -3.037
343 HB3 TYR 48 2HB TYR 48 -3.172 -4.064 -2.387
344 HD1 TYR 48 2HD TYR 48 -3.485 -1.722 -3.572
345 HD2 TYR 48 1HD TYR 48 -6.355 -4.862 -3.635
346 HE1 TYR 48 2HE TYR 48 -5.253 -0.087 -4.070
347 HE2 TYR 48 1HE TYR 48 -8.132 -3.236 -4.134
348 HH TYR 48 HH TYR 48 -8.081 -0.763 -5.320
349 H ARG 49 H ARG 49 -2.455 -7.118 -4.593
350 HA ARG 49 HA ARG 49 -4.543 -7.536 -6.537
351 HB2 ARG 49 1HB ARG 49 -3.195 -8.397 -8.306
352 HB3 ARG 49 2HB ARG 49 -2.546 -6.817 -7.888
353 HG2 ARG 49 1HG ARG 49 -0.609 -7.989 -8.031
354 HG3 ARG 49 2HG ARG 49 -0.983 -8.270 -6.329
355 HD2 ARG 49 1HD ARG 49 -2.290 -10.336 -7.310
356 HD3 ARG 49 2HD ARG 49 -1.168 -10.123 -8.653
357 HE ARG 49 HE ARG 49 0.109 -10.179 -6.079
358 HH11 ARG 49 1HH1 ARG 49 -1.093 -12.100 -8.722
359 HH12 ARG 49 2HH1 ARG 49 -0.057 -13.447 -8.386
360 HH21 ARG 49 1HH2 ARG 49 1.479 -11.946 -5.627
361 HH22 ARG 49 2HH2 ARG 49 1.406 -13.359 -6.625
362 HA PRO 50 HA PRO 50 -4.694 -11.347 -4.328
363 HB2 PRO 50 1HB PRO 50 -6.256 -12.751 -6.049
364 HB3 PRO 50 2HB PRO 50 -6.886 -11.471 -5.005
365 HG2 PRO 50 1HG PRO 50 -6.136 -11.356 -7.901
366 HG3 PRO 50 2HG PRO 50 -7.548 -10.663 -7.082
367 HD2 PRO 50 1HD PRO 50 -5.377 -9.186 -7.744
368 HD3 PRO 50 2HD PRO 50 -6.364 -8.844 -6.308
369 H THR 51 H THR 51 -3.644 -13.286 -4.270
370 HA THR 51 HA THR 51 -1.442 -13.754 -5.880
371 HB THR 51 HB THR 51 -2.141 -14.823 -3.594
372 HG1 THR 51 1HG THR 51 -0.612 -15.992 -5.670
373 HG21 THR 51 1HG2 THR 51 -4.058 -16.032 -4.989
374 HG22 THR 51 2HG2 THR 51 -3.288 -16.800 -3.600
375 HG23 THR 51 3HG2 THR 51 -2.777 -17.218 -5.235
376 H ASP 52 H ASP 52 -4.766 -14.661 -6.361
377 HA ASP 52 HA ASP 52 -4.316 -16.663 -8.329
378 HB2 ASP 52 1HB ASP 52 -6.450 -16.192 -6.941
379 HB3 ASP 52 2HB ASP 52 -6.811 -14.991 -8.178
380 H SER 53 H SER 53 -4.319 -13.220 -8.382
381 HA SER 53 HA SER 53 -5.066 -12.531 -10.914
382 HB2 SER 53 1HB SER 53 -2.833 -11.499 -9.177
383 HB3 SER 53 2HB SER 53 -3.161 -10.795 -10.761
384 HG SER 53 HG SER 53 -5.472 -10.825 -9.740
385 H ASP 54 H ASP 54 -3.573 -11.876 -12.756
386 HA ASP 54 HA ASP 54 -1.815 -14.154 -13.359
387 HB2 ASP 54 1HB ASP 54 -3.896 -13.419 -14.808
388 HB3 ASP 54 2HB ASP 54 -2.754 -12.250 -15.464
389 H ASN 55 H ASN 55 -2.025 -10.713 -14.287
390 HA ASN 55 HA ASN 55 0.855 -10.476 -13.759
391 HB2 ASN 55 1HB ASN 55 -0.501 -9.244 -16.163
392 HB3 ASN 55 2HB ASN 55 1.222 -9.262 -15.800
393 HD21 ASN 55 1HD2 ASN 55 -1.274 -10.778 -17.429
394 HD22 ASN 55 2HD2 ASN 55 -0.455 -12.238 -17.860
395 H ASP 56 H ASP 56 1.411 -7.965 -14.098
396 HA ASP 56 HA ASP 56 0.394 -6.590 -11.953
397 HB2 ASP 56 1HB ASP 56 1.285 -4.534 -13.028
398 HB3 ASP 56 2HB ASP 56 2.423 -5.877 -13.071
399 H SER 57 H SER 57 -1.032 -7.034 -15.061
400 HA SER 57 HA SER 57 -2.677 -4.888 -15.417
401 HB2 SER 57 1HB SER 57 -3.112 -7.821 -15.914
402 HB3 SER 57 2HB SER 57 -4.378 -6.651 -16.287
403 HG SER 57 HG SER 57 -1.746 -6.273 -17.219
404 H ASP 58 H ASP 58 -2.812 -7.227 -12.886
405 HA ASP 58 HA ASP 58 -5.515 -6.535 -12.093
406 HB2 ASP 58 1HB ASP 58 -3.426 -8.393 -10.968
407 HB3 ASP 58 2HB ASP 58 -4.925 -8.049 -10.110
408 H TYR 59 H TYR 59 -2.215 -6.063 -10.891
409 HA TYR 59 HA TYR 59 -2.551 -4.911 -8.480
410 HB2 TYR 59 1HB TYR 59 -0.661 -4.375 -10.712
411 HB3 TYR 59 2HB TYR 59 -0.696 -3.210 -9.394
412 HD1 TYR 59 1HD TYR 59 -1.115 -4.880 -7.044
413 HD2 TYR 59 2HD TYR 59 1.299 -5.592 -10.474
414 HE1 TYR 59 1HE TYR 59 0.340 -6.344 -5.707
415 HE2 TYR 59 2HE TYR 59 2.761 -7.059 -9.147
416 HH TYR 59 HH TYR 59 1.923 -8.274 -6.158
417 H LYS 60 H LYS 60 -3.753 -3.333 -7.681
418 HA LYS 60 HA LYS 60 -4.924 -1.365 -9.494
419 HB2 LYS 60 1HB LYS 60 -5.561 -2.293 -6.711
420 HB3 LYS 60 2HB LYS 60 -6.203 -0.767 -7.306
421 HG2 LYS 60 1HG LYS 60 -7.464 -1.822 -8.978
422 HG3 LYS 60 2HG LYS 60 -6.573 -3.337 -8.809
423 HD2 LYS 60 1HD LYS 60 -7.493 -3.437 -6.441
424 HD3 LYS 60 2HD LYS 60 -8.583 -2.134 -6.920
425 HE2 LYS 60 1HE LYS 60 -9.397 -3.566 -8.774
426 HE3 LYS 60 2HE LYS 60 -8.380 -4.873 -8.169
427 HZ1 LYS 60 1HZ LYS 60 -9.627 -4.949 -6.161
428 HZ2 LYS 60 2HZ LYS 60 -10.733 -4.985 -7.440
429 HZ3 LYS 60 3HZ LYS 60 -10.500 -3.557 -6.564
430 H LYS 61 H LYS 61 -5.373 0.802 -8.029
431 HA LYS 61 HA LYS 61 -2.907 1.644 -6.729
432 HB2 LYS 61 1HB LYS 61 -2.700 2.090 -9.215
433 HB3 LYS 61 2HB LYS 61 -4.024 3.234 -9.038
434 HG2 LYS 61 1HG LYS 61 -2.737 4.631 -7.614
435 HG3 LYS 61 2HG LYS 61 -1.466 3.415 -7.469
436 HD2 LYS 61 1HD LYS 61 -0.742 5.123 -9.003
437 HD3 LYS 61 2HD LYS 61 -1.047 3.637 -9.906
438 HE2 LYS 61 1HE LYS 61 -3.073 4.465 -10.779
439 HE3 LYS 61 2HE LYS 61 -3.122 5.792 -9.621
440 HZ1 LYS 61 1HZ LYS 61 -2.364 6.207 -12.055
441 HZ2 LYS 61 2HZ LYS 61 -0.876 5.621 -11.505
442 HZ3 LYS 61 3HZ LYS 61 -1.568 6.984 -10.781
443 H ASP 62 H ASP 62 -3.316 2.938 -5.051
444 HA ASP 62 HA ASP 62 -5.846 4.435 -5.005
445 HB2 ASP 62 1HB ASP 62 -4.847 2.424 -3.052
446 HB3 ASP 62 2HB ASP 62 -5.653 3.850 -2.405
447 H MET 63 H MET 63 -5.260 6.504 -5.009
448 HA MET 63 HA MET 63 -2.756 7.427 -4.012
449 HB2 MET 63 1HB MET 63 -4.331 8.427 -5.854
450 HB3 MET 63 2HB MET 63 -5.075 9.260 -4.495
451 HG2 MET 63 1HG MET 63 -2.594 9.918 -3.953
452 HG3 MET 63 2HG MET 63 -2.364 9.585 -5.668
453 HE1 MET 63 1HE MET 63 -4.529 13.101 -3.746
454 HE2 MET 63 2HE MET 63 -4.483 11.479 -3.056
455 HE3 MET 63 3HE MET 63 -2.990 12.400 -3.246
456 H VAL 64 H VAL 64 -2.291 8.616 -2.178
457 HA VAL 64 HA VAL 64 -4.423 9.004 -0.209
458 HB VAL 64 HB VAL 64 -1.806 7.679 0.507
459 HG11 VAL 64 1HG1 VAL 64 -2.716 8.976 2.322
460 HG12 VAL 64 2HG1 VAL 64 -4.305 8.241 2.099
461 HG13 VAL 64 3HG1 VAL 64 -2.950 7.262 2.663
462 HG21 VAL 64 1HG2 VAL 64 -3.598 5.786 1.052
463 HG22 VAL 64 2HG2 VAL 64 -4.432 6.559 -0.296
464 HG23 VAL 64 3HG2 VAL 64 -2.807 5.912 -0.519
465 H GLU 65 H GLU 65 -3.955 10.571 1.398
466 HA GLU 65 HA GLU 65 -2.796 12.892 0.623
467 HB2 GLU 65 1HB GLU 65 -2.693 11.903 3.475
468 HB3 GLU 65 2HB GLU 65 -2.733 13.574 2.931
469 HG2 GLU 65 1HG GLU 65 -4.907 13.281 3.548
470 HG3 GLU 65 2HG GLU 65 -4.998 12.847 1.842
471 H GLY 66 H GLY 66 -0.811 13.977 1.062
472 HA2 GLY 66 1HA GLY 66 1.481 12.268 0.729
473 HA3 GLY 66 2HA GLY 66 1.485 14.025 0.769
474 H ASP 67 H ASP 67 -0.063 13.799 3.397
475 HA ASP 67 HA ASP 67 2.327 13.522 5.069
476 HB2 ASP 67 1HB ASP 67 1.136 14.836 6.725
477 HB3 ASP 67 2HB ASP 67 1.060 15.653 5.166
478 H ARG 68 H ARG 68 -0.880 12.224 4.587
479 HA ARG 68 HA ARG 68 -1.100 10.793 7.010
480 HB2 ARG 68 1HB ARG 68 -3.003 11.273 5.496
481 HB3 ARG 68 2HB ARG 68 -2.335 10.139 4.330
482 HG2 ARG 68 1HG ARG 68 -2.980 8.319 5.518
483 HG3 ARG 68 2HG ARG 68 -2.809 9.135 7.073
484 HD2 ARG 68 1HD ARG 68 -4.910 10.028 6.991
485 HD3 ARG 68 2HD ARG 68 -4.932 10.090 5.229
486 HE ARG 68 HE ARG 68 -4.949 7.410 6.197
487 HH11 ARG 68 1HH1 ARG 68 -6.959 10.200 5.657
488 HH12 ARG 68 2HH1 ARG 68 -8.417 9.279 5.487
489 HH21 ARG 68 1HH2 ARG 68 -6.861 6.186 5.974
490 HH22 ARG 68 2HH2 ARG 68 -8.360 6.996 5.668
491 H TYR 69 H TYR 69 -0.195 8.953 7.677
492 HA TYR 69 HA TYR 69 1.371 7.403 5.725
493 HB2 TYR 69 1HB TYR 69 1.792 8.041 8.620
494 HB3 TYR 69 2HB TYR 69 2.470 6.557 7.959
495 HD1 TYR 69 2HD TYR 69 2.191 9.409 5.737
496 HD2 TYR 69 1HD TYR 69 4.721 7.436 8.532
497 HE1 TYR 69 2HE TYR 69 4.117 10.675 4.879
498 HE2 TYR 69 1HE TYR 69 6.653 8.698 7.682
499 HH TYR 69 HH TYR 69 6.608 10.405 4.794
500 H TRP 70 H TRP 70 -1.533 7.181 6.509
501 HA TRP 70 HA TRP 70 -1.496 4.293 6.947
502 HB2 TRP 70 1HB TRP 70 -3.126 4.333 8.692
503 HB3 TRP 70 2HB TRP 70 -1.851 5.454 9.161
504 HD1 TRP 70 HD TRP 70 -2.439 8.128 8.857
505 HE1 TRP 70 1HE TRP 70 -4.698 9.343 9.064
506 HE3 TRP 70 3HE TRP 70 -5.567 4.118 8.340
507 HZ2 TRP 70 2HZ TRP 70 -7.443 8.688 9.015
508 HZ3 TRP 70 3HZ TRP 70 -7.996 4.498 8.432
509 HH2 TRP 70 HH TRP 70 -8.913 6.736 8.763
510 H HIS 71 H HIS 71 -3.215 3.192 6.019
511 HA HIS 71 HA HIS 71 -5.439 4.606 4.858
512 HB2 HIS 71 1HB HIS 71 -3.667 4.998 3.178
513 HB3 HIS 71 2HB HIS 71 -3.443 3.258 3.026
514 HD1 HIS 71 1HD HIS 71 -6.325 5.724 2.658
515 HD2 HIS 71 2HD HIS 71 -4.848 2.229 0.967
516 HE1 HIS 71 1HE HIS 71 -7.856 5.211 0.730
517 HE2 HIS 71 2HE HIS 71 -6.992 3.047 -0.226
518 H SER 72 H SER 72 -7.169 3.321 4.869
519 HA SER 72 HA SER 72 -6.740 0.442 5.262
520 HB2 SER 72 1HB SER 72 -8.766 0.360 6.450
521 HB3 SER 72 2HB SER 72 -8.056 1.895 6.948
522 HG SER 72 HG SER 72 -10.089 1.490 5.012
523 H ILE 73 H ILE 73 -7.000 -0.781 3.526
524 HA ILE 73 HA ILE 73 -8.479 0.165 1.233
525 HB ILE 73 HB ILE 73 -7.293 -2.583 1.559
526 HG12 ILE 73 1HG1 ILE 73 -5.808 -0.263 0.353
527 HG13 ILE 73 2HG1 ILE 73 -5.712 -0.592 2.080
528 HG21 ILE 73 1HG2 ILE 73 -8.163 -0.878 -0.736
529 HG22 ILE 73 2HG2 ILE 73 -6.935 -2.120 -0.970
530 HG23 ILE 73 3HG2 ILE 73 -8.540 -2.565 -0.389
531 HD11 ILE 73 1HD1 ILE 73 -5.014 -2.578 -0.067
532 HD12 ILE 73 2HD1 ILE 73 -3.850 -1.550 0.771
533 HD13 ILE 73 3HD1 ILE 73 -4.771 -2.755 1.670
534 H SER 74 H SER 74 -10.226 -0.962 0.243
535 HA SER 74 HA SER 74 -11.683 -2.835 1.968
536 HB2 SER 74 1HB SER 74 -13.076 -0.552 0.565
537 HB3 SER 74 2HB SER 74 -13.738 -1.646 1.779
538 HG SER 74 HG SER 74 -13.225 0.296 2.765
539 H HIS 75 H HIS 75 -13.773 -3.541 0.637
540 HA HIS 75 HA HIS 75 -14.562 -4.774 -1.105
541 HB2 HIS 75 1HB HIS 75 -12.857 -2.863 -2.715
542 HB3 HIS 75 2HB HIS 75 -14.050 -3.964 -3.398
543 HD1 HIS 75 1HD HIS 75 -16.589 -3.491 -2.663
544 HD2 HIS 75 2HD HIS 75 -13.855 -0.466 -1.866
545 HE1 HIS 75 1HE HIS 75 -17.969 -1.430 -2.245
546 HE2 HIS 75 2HE HIS 75 -16.290 0.405 -1.849
547 H LEU 76 H LEU 76 -12.464 -5.904 0.269
548 HA LEU 76 HA LEU 76 -10.772 -7.099 -1.817
549 HB2 LEU 76 1HB LEU 76 -10.405 -7.255 1.167
550 HB3 LEU 76 2HB LEU 76 -9.255 -7.742 -0.077
551 HG LEU 76 HG LEU 76 -10.108 -4.889 0.035
552 HD11 LEU 76 1HD1 LEU 76 -9.629 -5.403 2.360
553 HD12 LEU 76 2HD1 LEU 76 -8.349 -4.406 1.669
554 HD13 LEU 76 3HD1 LEU 76 -8.092 -6.135 1.899
555 HD21 LEU 76 1HD2 LEU 76 -8.689 -5.271 -1.743
556 HD22 LEU 76 2HD2 LEU 76 -7.741 -6.473 -0.867
557 HD23 LEU 76 3HD2 LEU 76 -7.562 -4.760 -0.486
558 H GLN 77 H GLN 77 -10.058 -9.453 -0.888
559 HA GLN 77 HA GLN 77 -12.585 -10.933 -0.741
560 HB2 GLN 77 1HB GLN 77 -9.856 -12.056 -1.366
561 HB3 GLN 77 2HB GLN 77 -11.420 -12.807 -1.656
562 HG2 GLN 77 1HG GLN 77 -10.898 -12.096 -3.757
563 HG3 GLN 77 2HG GLN 77 -11.808 -10.707 -3.165
564 HE21 GLN 77 1HE2 GLN 77 -10.636 -9.608 -4.898
565 HE22 GLN 77 2HE2 GLN 77 -9.057 -8.990 -4.570
566 HA PRO 78 HA PRO 78 -11.824 -12.085 3.443
567 HB2 PRO 78 1HB PRO 78 -13.418 -14.279 3.556
568 HB3 PRO 78 2HB PRO 78 -14.054 -12.630 3.534
569 HG2 PRO 78 1HG PRO 78 -13.801 -14.593 1.288
570 HG3 PRO 78 2HG PRO 78 -15.150 -13.512 1.683
571 HD2 PRO 78 1HD PRO 78 -13.352 -12.947 -0.261
572 HD3 PRO 78 2HD PRO 78 -14.136 -11.685 0.710
573 H GLU 79 H GLU 79 -10.645 -13.556 4.659
574 HA GLU 79 HA GLU 79 -8.751 -14.876 4.848
575 HB2 GLU 79 1HB GLU 79 -9.491 -17.326 4.170
576 HB3 GLU 79 2HB GLU 79 -10.169 -16.519 5.577
577 HG2 GLU 79 1HG GLU 79 -12.173 -16.010 4.442
578 HG3 GLU 79 2HG GLU 79 -11.481 -16.438 2.879
579 H THR 80 H THR 80 -8.566 -13.433 2.469
580 HA THR 80 HA THR 80 -7.488 -15.414 0.573
581 HB THR 80 HB THR 80 -8.289 -12.552 0.011
582 HG1 THR 80 1HG THR 80 -10.188 -13.580 0.162
583 HG21 THR 80 1HG2 THR 80 -8.017 -14.455 -2.203
584 HG22 THR 80 2HG2 THR 80 -6.504 -14.087 -1.375
585 HG23 THR 80 3HG2 THR 80 -7.469 -12.785 -2.070
586 H SER 81 H SER 81 -5.398 -15.675 1.151
587 HA SER 81 HA SER 81 -3.757 -13.516 2.070
588 HB2 SER 81 1HB SER 81 -3.578 -16.103 2.529
589 HB3 SER 81 2HB SER 81 -2.599 -16.088 1.062
590 HG SER 81 HG SER 81 -1.153 -14.746 2.039
591 H TYR 82 H TYR 82 -3.280 -11.935 0.674
592 HA TYR 82 HA TYR 82 -2.012 -12.700 -1.864
593 HB2 TYR 82 1HB TYR 82 -3.123 -10.714 -2.925
594 HB3 TYR 82 2HB TYR 82 -4.225 -12.017 -2.491
595 HD1 TYR 82 1HD TYR 82 -2.957 -8.712 -1.362
596 HD2 TYR 82 2HD TYR 82 -6.057 -11.614 -1.079
597 HE1 TYR 82 1HE TYR 82 -4.322 -7.120 -0.078
598 HE2 TYR 82 2HE TYR 82 -7.431 -10.029 0.205
599 HH TYR 82 HH TYR 82 -6.198 -6.820 1.084
600 H ASP 83 H ASP 83 -0.582 -11.069 -2.747
601 HA ASP 83 HA ASP 83 1.005 -9.840 -0.712
602 HB2 ASP 83 1HB ASP 83 2.433 -9.101 -2.575
603 HB3 ASP 83 2HB ASP 83 2.042 -10.813 -2.702
604 H ILE 84 H ILE 84 1.490 -7.618 -0.476
605 HA ILE 84 HA ILE 84 -0.295 -5.715 -1.794
606 HB ILE 84 HB ILE 84 -0.022 -5.896 1.209
607 HG12 ILE 84 1HG1 ILE 84 -2.571 -6.119 -0.372
608 HG13 ILE 84 2HG1 ILE 84 -1.566 -7.533 -0.072
609 HG21 ILE 84 1HG2 ILE 84 -1.032 -3.793 -0.614
610 HG22 ILE 84 2HG2 ILE 84 -1.961 -4.103 0.852
611 HG23 ILE 84 3HG2 ILE 84 -0.260 -3.652 0.965
612 HD11 ILE 84 1HD1 ILE 84 -3.422 -6.176 1.674
613 HD12 ILE 84 2HD1 ILE 84 -2.694 -7.777 1.818
614 HD13 ILE 84 3HD1 ILE 84 -1.833 -6.359 2.416
615 H LYS 85 H LYS 85 0.877 -4.084 -2.533
616 HA LYS 85 HA LYS 85 3.190 -3.166 -0.970
617 HB2 LYS 85 1HB LYS 85 4.580 -3.018 -2.892
618 HB3 LYS 85 2HB LYS 85 3.875 -4.629 -2.913
619 HG2 LYS 85 1HG LYS 85 2.200 -3.837 -4.544
620 HG3 LYS 85 2HG LYS 85 3.006 -2.267 -4.567
621 HD2 LYS 85 1HD LYS 85 5.071 -3.357 -5.339
622 HD3 LYS 85 2HD LYS 85 4.234 -4.912 -5.349
623 HE2 LYS 85 1HE LYS 85 2.566 -3.809 -6.932
624 HE3 LYS 85 2HE LYS 85 3.751 -2.514 -7.095
625 HZ1 LYS 85 1HZ LYS 85 3.686 -4.961 -8.433
626 HZ2 LYS 85 2HZ LYS 85 5.053 -4.974 -7.438
627 HZ3 LYS 85 3HZ LYS 85 4.840 -3.731 -8.566
628 H MET 86 H MET 86 3.982 -0.985 -1.843
629 HA MET 86 HA MET 86 1.950 0.644 -3.106
630 HB2 MET 86 1HB MET 86 1.667 2.200 -1.305
631 HB3 MET 86 2HB MET 86 1.321 0.591 -0.684
632 HG2 MET 86 1HG MET 86 3.439 0.485 0.414
633 HG3 MET 86 2HG MET 86 3.964 1.983 -0.351
634 HE1 MET 86 1HE MET 86 2.589 3.970 -0.335
635 HE2 MET 86 2HE MET 86 1.223 4.303 0.730
636 HE3 MET 86 3HE MET 86 2.860 4.725 1.236
637 H GLN 87 H GLN 87 2.728 2.959 -3.308
638 HA GLN 87 HA GLN 87 5.567 3.393 -3.066
639 HB2 GLN 87 1HB GLN 87 5.867 2.321 -5.086
640 HB3 GLN 87 2HB GLN 87 4.279 2.779 -5.687
641 HG2 GLN 87 1HG GLN 87 6.318 4.901 -5.249
642 HG3 GLN 87 2HG GLN 87 6.458 3.853 -6.659
643 HE21 GLN 87 1HE2 GLN 87 5.039 4.072 -8.330
644 HE22 GLN 87 2HE2 GLN 87 3.867 5.338 -8.428
645 H CYS 88 H CYS 88 6.145 5.555 -3.233
646 HA CYS 88 HA CYS 88 3.882 7.412 -3.207
647 HB2 CYS 88 1HB CYS 88 5.130 8.802 -1.843
648 HB3 CYS 88 2HB CYS 88 5.744 7.223 -1.367
649 HG CYS 88 HG CYS 88 7.313 9.218 -3.659
650 H PHE 89 H PHE 89 4.262 9.594 -4.165
651 HA PHE 89 HA PHE 89 6.153 9.725 -6.355
652 HB2 PHE 89 1HB PHE 89 4.513 10.045 -8.097
653 HB3 PHE 89 2HB PHE 89 4.189 8.510 -7.298
654 HD1 PHE 89 1HD PHE 89 2.449 8.628 -5.338
655 HD2 PHE 89 2HD PHE 89 2.770 11.496 -8.465
656 HE1 PHE 89 1HE PHE 89 0.128 9.331 -4.926
657 HE2 PHE 89 2HE PHE 89 0.450 12.205 -8.058
658 HZ PHE 89 HZ PHE 89 -0.875 11.123 -6.286
659 H ASN 90 H ASN 90 6.250 11.847 -7.341
660 HA ASN 90 HA ASN 90 4.765 13.997 -6.096
661 HB2 ASN 90 1HB ASN 90 6.482 15.044 -4.965
662 HB3 ASN 90 2HB ASN 90 6.910 13.357 -4.700
663 HD21 ASN 90 1HD2 ASN 90 8.585 15.746 -4.720
664 HD22 ASN 90 2HD2 ASN 90 9.803 15.463 -5.913
665 H GLU 91 H GLU 91 5.766 16.187 -6.954
666 HA GLU 91 HA GLU 91 5.289 16.420 -9.617
667 HB2 GLU 91 1HB GLU 91 6.533 18.521 -9.580
668 HB3 GLU 91 2HB GLU 91 5.572 18.340 -8.120
669 HG2 GLU 91 1HG GLU 91 7.531 17.697 -6.864
670 HG3 GLU 91 2HG GLU 91 8.517 17.754 -8.324
671 H GLY 92 H GLY 92 8.299 15.441 -8.098
672 HA2 GLY 92 1HA GLY 92 9.907 15.596 -10.443
673 HA3 GLY 92 2HA GLY 92 10.296 14.708 -8.977
674 H GLY 93 H GLY 93 7.929 13.051 -9.019
675 HA2 GLY 93 1HA GLY 93 7.133 11.634 -11.082
676 HA3 GLY 93 2HA GLY 93 8.827 11.165 -11.071
677 H GLU 94 H GLU 94 7.434 9.064 -10.853
678 HA GLU 94 HA GLU 94 6.477 8.485 -8.208
679 HB2 GLU 94 1HB GLU 94 6.818 6.917 -10.737
680 HB3 GLU 94 2HB GLU 94 6.540 6.067 -9.223
681 HG2 GLU 94 1HG GLU 94 4.437 7.121 -8.917
682 HG3 GLU 94 2HG GLU 94 4.739 8.245 -10.242
683 H SER 95 H SER 95 7.395 7.107 -6.680
684 HA SER 95 HA SER 95 10.307 6.985 -6.790
685 HB2 SER 95 1HB SER 95 10.119 6.385 -4.375
686 HB3 SER 95 2HB SER 95 9.357 7.926 -4.768
687 HG SER 95 HG SER 95 8.209 6.133 -3.449
688 H GLU 96 H GLU 96 11.059 4.918 -5.345
689 HA GLU 96 HA GLU 96 10.748 2.705 -7.069
690 HB2 GLU 96 1HB GLU 96 11.878 2.877 -4.271
691 HB3 GLU 96 2HB GLU 96 11.995 1.455 -5.299
692 HG2 GLU 96 1HG GLU 96 13.061 4.143 -6.109
693 HG3 GLU 96 2HG GLU 96 14.017 2.954 -5.226
694 H PHE 97 H PHE 97 10.052 0.513 -6.331
695 HA PHE 97 HA PHE 97 7.391 0.711 -5.196
696 HB2 PHE 97 1HB PHE 97 8.922 -1.466 -6.595
697 HB3 PHE 97 2HB PHE 97 7.414 -1.816 -5.757
698 HD1 PHE 97 2HD PHE 97 5.301 -0.916 -6.567
699 HD2 PHE 97 1HD PHE 97 8.952 -0.214 -8.641
700 HE1 PHE 97 2HE PHE 97 4.033 -0.203 -8.551
701 HE2 PHE 97 1HE PHE 97 7.689 0.501 -10.628
702 HZ PHE 97 HZ PHE 97 5.227 0.506 -10.586
703 H SER 98 H SER 98 7.101 0.574 -3.079
704 HA SER 98 HA SER 98 8.950 -0.114 -1.169
705 HB2 SER 98 1HB SER 98 7.107 -0.306 0.397
706 HB3 SER 98 2HB SER 98 6.764 1.007 -0.730
707 HG SER 98 HG SER 98 5.691 -1.616 -0.745
708 H ASN 99 H ASN 99 8.393 -2.010 0.496
709 HA ASN 99 HA ASN 99 9.065 -4.422 -0.898
710 HB2 ASN 99 1HB ASN 99 9.636 -5.284 1.160
711 HB3 ASN 99 2HB ASN 99 9.774 -3.562 1.499
712 HD21 ASN 99 1HD2 ASN 99 7.359 -2.679 1.966
713 HD22 ASN 99 2HD2 ASN 99 6.591 -3.525 3.262
714 H VAL 100 H VAL 100 7.920 -6.440 -0.725
715 HA VAL 100 HA VAL 100 5.055 -6.075 -1.002
716 HB VAL 100 HB VAL 100 6.739 -8.560 -1.352
717 HG11 VAL 100 1HG1 VAL 100 4.405 -8.819 -2.822
718 HG12 VAL 100 2HG1 VAL 100 4.789 -9.638 -1.307
719 HG13 VAL 100 3HG1 VAL 100 3.873 -8.130 -1.289
720 HG21 VAL 100 1HG2 VAL 100 5.475 -7.051 -3.593
721 HG22 VAL 100 2HG2 VAL 100 6.996 -6.474 -2.913
722 HG23 VAL 100 3HG2 VAL 100 6.896 -8.095 -3.601
723 H MET 101 H MET 101 3.735 -6.247 0.676
724 HA MET 101 HA MET 101 4.535 -7.948 2.939
725 HB2 MET 101 1HB MET 101 2.634 -5.601 2.825
726 HB3 MET 101 2HB MET 101 2.891 -6.599 4.250
727 HG2 MET 101 1HG MET 101 5.080 -5.071 2.869
728 HG3 MET 101 2HG MET 101 4.141 -4.439 4.219
729 HE1 MET 101 1HE MET 101 4.694 -6.448 7.077
730 HE2 MET 101 2HE MET 101 5.720 -5.015 7.000
731 HE3 MET 101 3HE MET 101 4.102 -4.980 6.299
732 H ILE 102 H ILE 102 3.432 -9.753 3.314
733 HA ILE 102 HA ILE 102 1.010 -10.271 1.772
734 HB ILE 102 HB ILE 102 2.694 -12.115 3.470
735 HG12 ILE 102 1HG1 ILE 102 2.350 -12.043 0.468
736 HG13 ILE 102 2HG1 ILE 102 3.687 -11.272 1.313
737 HG21 ILE 102 1HG2 ILE 102 0.013 -12.401 2.658
738 HG22 ILE 102 2HG2 ILE 102 0.971 -13.474 1.639
739 HG23 ILE 102 3HG2 ILE 102 1.059 -13.613 3.395
740 HD11 ILE 102 1HD1 ILE 102 3.416 -14.019 2.120
741 HD12 ILE 102 2HD1 ILE 102 3.572 -13.879 0.369
742 HD13 ILE 102 3HD1 ILE 102 4.800 -13.179 1.423
743 H CYS 103 H CYS 103 -0.656 -9.250 2.794
744 HA CYS 103 HA CYS 103 -1.087 -9.868 5.637
745 HB2 CYS 103 1HB CYS 103 -1.015 -7.432 4.640
746 HB3 CYS 103 2HB CYS 103 -2.671 -7.795 4.171
747 HG CYS 103 HG CYS 103 -2.316 -6.275 6.657
748 H GLU 104 H GLU 104 -2.377 -11.559 5.931
749 HA GLU 104 HA GLU 104 -4.332 -12.324 3.946
750 HB2 GLU 104 1HB GLU 104 -2.862 -13.884 5.404
751 HB3 GLU 104 2HB GLU 104 -4.058 -13.585 6.658
752 HG2 GLU 104 1HG GLU 104 -5.721 -14.267 4.715
753 HG3 GLU 104 2HG GLU 104 -4.291 -15.121 4.137
754 H THR 105 H THR 105 -6.388 -11.721 3.920
755 HA THR 105 HA THR 105 -7.473 -9.931 5.811
756 HB THR 105 HB THR 105 -9.689 -10.526 4.634
757 HG1 THR 105 1HG THR 105 -8.173 -11.574 2.552
758 HG21 THR 105 1HG2 THR 105 -9.196 -9.081 2.839
759 HG22 THR 105 2HG2 THR 105 -7.507 -9.585 2.789
760 HG23 THR 105 3HG2 THR 105 -8.094 -8.598 4.128
761 H LYS 106 H LYS 106 -9.855 -10.502 6.628
762 HA LYS 106 HA LYS 106 -9.478 -12.699 8.495
763 HB2 LYS 106 1HB LYS 106 -11.524 -10.491 8.297
764 HB3 LYS 106 2HB LYS 106 -11.634 -11.785 9.483
765 HG2 LYS 106 1HG LYS 106 -9.164 -11.013 10.023
766 HG3 LYS 106 2HG LYS 106 -9.753 -9.498 9.335
767 HD2 LYS 106 1HD LYS 106 -11.763 -9.829 10.928
768 HD3 LYS 106 2HD LYS 106 -10.707 -10.968 11.767
769 HE2 LYS 106 1HE LYS 106 -9.267 -9.327 12.464
770 HE3 LYS 106 2HE LYS 106 -9.643 -8.269 11.106
771 HZ1 LYS 106 1HZ LYS 106 -11.943 -8.122 12.234
772 HZ2 LYS 106 2HZ LYS 106 -10.661 -7.215 12.862
773 HZ3 LYS 106 3HZ LYS 106 -11.128 -8.655 13.617
774 H ALA 107 H ALA 107 -11.126 -14.293 8.882
775 HA ALA 107 HA ALA 107 -12.149 -15.418 6.469
776 HB1 ALA 107 1HB ALA 107 -12.226 -17.294 7.663
777 HB2 ALA 107 2HB ALA 107 -11.529 -16.373 8.996
778 HB3 ALA 107 3HB ALA 107 -13.278 -16.563 8.875
779 H ARG 108 H ARG 108 -14.107 -15.240 5.570
780 HA ARG 108 HA ARG 108 -15.977 -13.339 6.607
781 HB2 ARG 108 1HB ARG 108 -17.356 -14.053 4.623
782 HB3 ARG 108 2HB ARG 108 -15.750 -13.448 4.240
783 HG2 ARG 108 1HG ARG 108 -14.941 -15.577 3.721
784 HG3 ARG 108 2HG ARG 108 -16.285 -16.381 4.536
785 HD2 ARG 108 1HD ARG 108 -16.861 -14.577 2.235
786 HD3 ARG 108 2HD ARG 108 -16.205 -16.182 1.914
787 HE ARG 108 HE ARG 108 -18.855 -15.542 2.820
788 HH11 ARG 108 1HH1 ARG 108 -16.381 -17.988 2.713
789 HH12 ARG 108 2HH1 ARG 108 -17.492 -19.305 2.895
790 HH21 ARG 108 1HH2 ARG 108 -20.328 -17.267 3.059
791 HH22 ARG 108 2HH2 ARG 108 -19.737 -18.894 3.091
792 H SER 109 H SER 109 -18.103 -13.703 7.295
793 HA SER 109 HA SER 109 -18.519 -16.352 8.480
794 HB2 SER 109 1HB SER 109 -18.624 -14.063 9.771
795 HB3 SER 109 2HB SER 109 -20.253 -13.987 9.100
796 HG SER 109 HG SER 109 -19.201 -15.672 11.034
797 H GLY 110 H GLY 110 -20.309 -17.585 8.071
798 HA2 GLY 110 1HA GLY 110 -22.423 -16.519 6.364
799 HA3 GLY 110 2HA GLY 110 -21.471 -17.840 5.702
800 HA PRO 111 HA PRO 111 -25.102 -19.571 8.060
801 HB2 PRO 111 1HB PRO 111 -25.985 -21.158 6.042
802 HB3 PRO 111 2HB PRO 111 -26.489 -19.475 6.231
803 HG2 PRO 111 1HG PRO 111 -24.404 -20.635 4.424
804 HG3 PRO 111 2HG PRO 111 -25.625 -19.399 4.073
805 HD2 PRO 111 1HD PRO 111 -23.042 -18.785 4.605
806 HD3 PRO 111 2HD PRO 111 -24.389 -17.719 5.055
807 H SER 112 H SER 112 -22.844 -21.150 5.819
808 HA SER 112 HA SER 112 -22.888 -23.567 7.470
809 HB2 SER 112 1HB SER 112 -23.033 -23.512 4.861
810 HB3 SER 112 2HB SER 112 -21.286 -23.287 4.945
811 HG SER 112 HG SER 112 -21.559 -25.225 6.502
812 H SER 113 H SER 113 -21.557 -23.466 9.161
813 HA SER 113 HA SER 113 -18.866 -22.337 8.754
814 HB2 SER 113 1HB SER 113 -20.542 -21.335 10.503
815 HB3 SER 113 2HB SER 113 -20.063 -22.725 11.477
816 HG SER 113 HG SER 113 -18.258 -21.749 11.892
817 H GLY 114 H GLY 114 -17.073 -23.471 9.472
818 HA2 GLY 114 1HA GLY 114 -17.530 -26.146 10.598
819 HA3 GLY 114 2HA GLY 114 -16.612 -26.001 9.106
Start of MODEL 14
1 H1 GLY 1 H GLY 1 25.861 9.258 -11.974
2 HA2 GLY 1 1HA GLY 1 27.696 10.198 -13.448
3 HA3 GLY 1 2HA GLY 1 26.497 11.399 -13.905
4 H SER 2 H SER 2 25.703 12.846 -12.239
5 HA SER 2 HA SER 2 27.557 13.136 -9.971
6 HB2 SER 2 1HB SER 2 26.478 15.409 -11.655
7 HB3 SER 2 2HB SER 2 27.577 15.553 -10.284
8 HG SER 2 HG SER 2 28.065 14.563 -12.866
9 H SER 3 H SER 3 24.440 14.209 -11.313
10 HA SER 3 HA SER 3 23.128 13.654 -8.802
11 HB2 SER 3 1HB SER 3 23.918 15.881 -8.302
12 HB3 SER 3 2HB SER 3 23.334 16.485 -9.853
13 HG SER 3 HG SER 3 21.587 15.307 -7.973
14 H GLY 4 H GLY 4 21.449 12.508 -9.497
15 HA2 GLY 4 1HA GLY 4 19.671 13.697 -11.489
16 HA3 GLY 4 2HA GLY 4 20.337 12.113 -11.858
17 H SER 5 H SER 5 19.367 13.274 -8.673
18 HA SER 5 HA SER 5 17.670 10.956 -8.345
19 HB2 SER 5 1HB SER 5 17.382 11.792 -6.031
20 HB3 SER 5 2HB SER 5 19.082 11.663 -6.482
21 HG SER 5 HG SER 5 17.542 14.048 -6.555
22 H SER 6 H SER 6 16.782 12.752 -10.348
23 HA SER 6 HA SER 6 14.951 14.660 -9.787
24 HB2 SER 6 1HB SER 6 14.572 12.415 -11.784
25 HB3 SER 6 2HB SER 6 13.706 13.951 -11.797
26 HG SER 6 HG SER 6 15.437 14.097 -13.204
27 H GLY 7 H GLY 7 13.612 14.630 -8.080
28 HA2 GLY 7 1HA GLY 7 11.659 14.122 -6.949
29 HA3 GLY 7 2HA GLY 7 11.359 12.846 -8.120
30 HA PRO 8 HA PRO 8 12.712 11.136 -3.921
31 HB2 PRO 8 1HB PRO 8 10.353 9.971 -3.251
32 HB3 PRO 8 2HB PRO 8 10.764 11.633 -2.810
33 HG2 PRO 8 1HG PRO 8 9.068 10.636 -5.067
34 HG3 PRO 8 2HG PRO 8 8.781 11.999 -3.969
35 HD2 PRO 8 1HD PRO 8 9.740 12.327 -6.480
36 HD3 PRO 8 2HD PRO 8 10.189 13.400 -5.139
37 H VAL 9 H VAL 9 13.533 9.120 -3.820
38 HA VAL 9 HA VAL 9 12.490 7.107 -5.704
39 HB VAL 9 HB VAL 9 14.788 6.234 -5.939
40 HG11 VAL 9 1HG1 VAL 9 13.711 8.606 -7.060
41 HG12 VAL 9 2HG1 VAL 9 15.448 8.841 -6.857
42 HG13 VAL 9 3HG1 VAL 9 14.845 7.466 -7.783
43 HG21 VAL 9 1HG2 VAL 9 15.455 8.614 -4.228
44 HG22 VAL 9 2HG2 VAL 9 15.866 6.921 -3.957
45 HG23 VAL 9 3HG2 VAL 9 16.650 7.821 -5.255
46 H ALA 10 H ALA 10 14.197 7.670 -2.654
47 HA ALA 10 HA ALA 10 14.572 5.213 -1.620
48 HB1 ALA 10 1HB ALA 10 13.334 7.532 -0.141
49 HB2 ALA 10 2HB ALA 10 14.115 6.136 0.604
50 HB3 ALA 10 3HB ALA 10 15.058 7.250 -0.385
51 H GLY 11 H GLY 11 11.455 6.811 -2.008
52 HA2 GLY 11 1HA GLY 11 9.307 6.016 -1.861
53 HA3 GLY 11 2HA GLY 11 9.996 4.433 -2.191
54 HA PRO 12 HA PRO 12 8.463 4.999 2.320
55 HB2 PRO 12 1HB PRO 12 5.957 3.978 2.100
56 HB3 PRO 12 2HB PRO 12 6.311 5.701 1.925
57 HG2 PRO 12 1HG PRO 12 5.885 3.631 -0.194
58 HG3 PRO 12 2HG PRO 12 5.271 5.292 -0.114
59 HD2 PRO 12 1HD PRO 12 7.411 4.602 -1.622
60 HD3 PRO 12 2HD PRO 12 7.257 6.196 -0.856
61 H TYR 13 H TYR 13 8.029 3.230 3.788
62 HA TYR 13 HA TYR 13 8.314 0.555 2.609
63 HB2 TYR 13 1HB TYR 13 10.516 0.871 3.263
64 HB3 TYR 13 2HB TYR 13 10.073 1.873 4.641
65 HD1 TYR 13 1HD TYR 13 9.754 -1.641 3.415
66 HD2 TYR 13 2HD TYR 13 10.161 0.952 6.764
67 HE1 TYR 13 1HE TYR 13 9.967 -3.594 4.894
68 HE2 TYR 13 2HE TYR 13 10.376 -0.994 8.252
69 HH TYR 13 HH TYR 13 10.348 -4.303 6.965
70 H ILE 14 H ILE 14 6.558 -0.530 3.186
71 HA ILE 14 HA ILE 14 4.861 0.146 5.320
72 HB ILE 14 HB ILE 14 5.080 -2.553 3.984
73 HG12 ILE 14 1HG1 ILE 14 3.134 -0.410 3.191
74 HG13 ILE 14 2HG1 ILE 14 4.762 -0.411 2.523
75 HG21 ILE 14 1HG2 ILE 14 3.751 -2.610 6.001
76 HG22 ILE 14 2HG2 ILE 14 2.821 -1.212 5.463
77 HG23 ILE 14 3HG2 ILE 14 2.696 -2.741 4.594
78 HD11 ILE 14 1HD1 ILE 14 4.324 -2.120 1.155
79 HD12 ILE 14 2HD1 ILE 14 3.393 -2.991 2.375
80 HD13 ILE 14 3HD1 ILE 14 2.637 -1.697 1.445
81 H THR 15 H THR 15 5.129 -0.123 7.425
82 HA THR 15 HA THR 15 6.856 -2.323 8.359
83 HB THR 15 HB THR 15 7.795 -1.014 9.997
84 HG1 THR 15 1HG THR 15 5.773 0.965 9.827
85 HG21 THR 15 1HG2 THR 15 8.716 0.789 8.936
86 HG22 THR 15 2HG2 THR 15 7.165 1.357 8.318
87 HG23 THR 15 3HG2 THR 15 7.977 -0.004 7.546
88 H PHE 16 H PHE 16 3.755 -1.581 8.050
89 HA PHE 16 HA PHE 16 2.982 -3.200 10.328
90 HB2 PHE 16 1HB PHE 16 2.962 -0.694 10.981
91 HB3 PHE 16 2HB PHE 16 1.541 -0.589 9.948
92 HD1 PHE 16 2HD PHE 16 -0.292 -2.432 10.434
93 HD2 PHE 16 1HD PHE 16 2.657 -1.124 13.212
94 HE1 PHE 16 2HE PHE 16 -1.701 -3.215 12.293
95 HE2 PHE 16 1HE PHE 16 1.252 -1.906 15.075
96 HZ PHE 16 HZ PHE 16 -0.930 -2.951 14.617
97 H THR 17 H THR 17 1.648 -4.688 9.567
98 HA THR 17 HA THR 17 -0.376 -3.928 7.588
99 HB THR 17 HB THR 17 0.149 -6.343 6.606
100 HG1 THR 17 1HG THR 17 2.327 -6.820 6.697
101 HG21 THR 17 1HG2 THR 17 0.874 -5.248 4.758
102 HG22 THR 17 2HG2 THR 17 2.088 -4.330 5.649
103 HG23 THR 17 3HG2 THR 17 0.399 -3.825 5.685
104 H ASP 18 H ASP 18 -2.238 -4.348 8.577
105 HA ASP 18 HA ASP 18 -2.626 -6.999 9.758
106 HB2 ASP 18 1HB ASP 18 -3.631 -6.157 11.748
107 HB3 ASP 18 2HB ASP 18 -2.100 -5.305 11.563
108 H ALA 19 H ALA 19 -4.674 -7.833 9.529
109 HA ALA 19 HA ALA 19 -6.332 -6.552 7.537
110 HB1 ALA 19 1HB ALA 19 -5.813 -9.010 7.564
111 HB2 ALA 19 2HB ALA 19 -6.875 -9.145 8.966
112 HB3 ALA 19 3HB ALA 19 -7.524 -8.604 7.418
113 H VAL 20 H VAL 20 -7.918 -5.193 8.011
114 HA VAL 20 HA VAL 20 -8.875 -4.905 10.716
115 HB VAL 20 HB VAL 20 -9.931 -3.501 8.265
116 HG11 VAL 20 1HG1 VAL 20 -11.392 -2.950 9.937
117 HG12 VAL 20 2HG1 VAL 20 -10.180 -3.128 11.207
118 HG13 VAL 20 3HG1 VAL 20 -10.172 -1.699 10.173
119 HG21 VAL 20 1HG2 VAL 20 -7.406 -3.361 8.589
120 HG22 VAL 20 2HG2 VAL 20 -8.285 -1.837 8.482
121 HG23 VAL 20 3HG2 VAL 20 -7.760 -2.443 10.053
122 H ASN 21 H ASN 21 -9.922 -6.457 7.805
123 HA ASN 21 HA ASN 21 -12.039 -7.801 9.160
124 HB2 ASN 21 1HB ASN 21 -12.671 -5.481 7.396
125 HB3 ASN 21 2HB ASN 21 -13.717 -6.895 7.304
126 HD21 ASN 21 1HD2 ASN 21 -14.455 -4.304 8.202
127 HD22 ASN 21 2HD2 ASN 21 -14.933 -4.445 9.857
128 H GLU 22 H GLU 22 -13.519 -8.839 7.222
129 HA GLU 22 HA GLU 22 -11.713 -10.569 5.861
130 HB2 GLU 22 1HB GLU 22 -13.661 -11.690 5.030
131 HB3 GLU 22 2HB GLU 22 -13.971 -11.240 6.701
132 HG2 GLU 22 1HG GLU 22 -14.863 -9.464 4.471
133 HG3 GLU 22 2HG GLU 22 -15.808 -10.882 4.922
134 H THR 23 H THR 23 -13.310 -7.623 5.042
135 HA THR 23 HA THR 23 -12.298 -7.865 2.284
136 HB THR 23 HB THR 23 -14.166 -6.286 1.634
137 HG1 THR 23 1HG THR 23 -14.577 -5.903 4.041
138 HG21 THR 23 1HG2 THR 23 -14.146 -9.080 1.932
139 HG22 THR 23 2HG2 THR 23 -15.166 -8.121 0.858
140 HG23 THR 23 3HG2 THR 23 -15.737 -8.543 2.472
141 H THR 24 H THR 24 -11.389 -6.587 4.957
142 HA THR 24 HA THR 24 -10.554 -4.057 3.732
143 HB THR 24 HB THR 24 -11.367 -4.165 6.631
144 HG1 THR 24 1HG THR 24 -13.272 -4.511 5.547
145 HG21 THR 24 1HG2 THR 24 -9.832 -2.357 5.491
146 HG22 THR 24 2HG2 THR 24 -11.080 -1.882 6.643
147 HG23 THR 24 3HG2 THR 24 -11.373 -1.728 4.911
148 H ILE 25 H ILE 25 -8.525 -3.328 4.342
149 HA ILE 25 HA ILE 25 -7.029 -4.900 6.305
150 HB ILE 25 HB ILE 25 -6.275 -4.574 3.413
151 HG12 ILE 25 1HG1 ILE 25 -6.396 -6.919 5.318
152 HG13 ILE 25 2HG1 ILE 25 -7.471 -6.605 3.960
153 HG21 ILE 25 1HG2 ILE 25 -4.487 -4.911 5.787
154 HG22 ILE 25 2HG2 ILE 25 -4.046 -5.609 4.230
155 HG23 ILE 25 3HG2 ILE 25 -4.291 -3.869 4.378
156 HD11 ILE 25 1HD1 ILE 25 -6.051 -8.230 3.144
157 HD12 ILE 25 2HD1 ILE 25 -5.324 -6.742 2.537
158 HD13 ILE 25 3HD1 ILE 25 -4.639 -7.546 3.949
159 H MET 26 H MET 26 -5.634 -3.718 7.487
160 HA MET 26 HA MET 26 -5.355 -0.881 6.775
161 HB2 MET 26 1HB MET 26 -6.373 -1.101 8.907
162 HB3 MET 26 2HB MET 26 -5.225 -2.334 9.412
163 HG2 MET 26 1HG MET 26 -4.360 -0.573 10.532
164 HG3 MET 26 2HG MET 26 -3.502 -0.368 9.006
165 HE1 MET 26 1HE MET 26 -3.708 1.182 7.439
166 HE2 MET 26 2HE MET 26 -4.704 2.637 7.398
167 HE3 MET 26 3HE MET 26 -3.318 2.547 8.486
168 H LEU 27 H LEU 27 -3.449 -0.150 6.114
169 HA LEU 27 HA LEU 27 -1.008 -1.532 6.979
170 HB2 LEU 27 1HB LEU 27 -0.177 -1.823 4.867
171 HB3 LEU 27 2HB LEU 27 -1.895 -2.111 4.596
172 HG LEU 27 HG LEU 27 -0.675 0.589 4.115
173 HD11 LEU 27 1HD1 LEU 27 0.034 -1.773 2.743
174 HD12 LEU 27 2HD1 LEU 27 0.433 -0.107 2.329
175 HD13 LEU 27 3HD1 LEU 27 -1.030 -0.850 1.682
176 HD21 LEU 27 1HD2 LEU 27 -2.952 -0.678 2.647
177 HD22 LEU 27 2HD2 LEU 27 -2.594 1.031 2.898
178 HD23 LEU 27 3HD2 LEU 27 -3.208 0.053 4.232
179 H LYS 28 H LYS 28 0.608 -0.208 7.564
180 HA LYS 28 HA LYS 28 0.324 2.658 6.934
181 HB2 LYS 28 1HB LYS 28 1.484 1.446 9.450
182 HB3 LYS 28 2HB LYS 28 1.325 3.163 9.105
183 HG2 LYS 28 1HG LYS 28 -0.976 3.137 9.375
184 HG3 LYS 28 2HG LYS 28 -1.085 1.393 9.126
185 HD2 LYS 28 1HD LYS 28 0.003 1.004 11.269
186 HD3 LYS 28 2HD LYS 28 0.178 2.743 11.513
187 HE2 LYS 28 1HE LYS 28 -2.535 1.621 11.000
188 HE3 LYS 28 2HE LYS 28 -1.815 1.410 12.595
189 HZ1 LYS 28 1HZ LYS 28 -2.901 3.775 11.374
190 HZ2 LYS 28 2HZ LYS 28 -1.381 4.027 12.072
191 HZ3 LYS 28 3HZ LYS 28 -2.651 3.420 13.010
192 H TRP 29 H TRP 29 2.107 3.754 6.250
193 HA TRP 29 HA TRP 29 4.547 2.151 5.855
194 HB2 TRP 29 1HB TRP 29 4.994 3.801 3.967
195 HB3 TRP 29 2HB TRP 29 3.666 2.672 3.718
196 HD1 TRP 29 HD TRP 29 4.382 6.381 4.263
197 HE1 TRP 29 1HE TRP 29 2.256 7.724 3.711
198 HE3 TRP 29 3HE TRP 29 1.104 2.504 3.668
199 HZ2 TRP 29 2HZ TRP 29 -0.452 7.208 3.104
200 HZ3 TRP 29 3HZ TRP 29 -1.236 3.014 3.103
201 HH2 TRP 29 HH TRP 29 -1.996 5.318 2.828
202 H MET 30 H MET 30 6.590 3.360 5.856
203 HA MET 30 HA MET 30 6.489 5.688 7.661
204 HB2 MET 30 1HB MET 30 8.332 4.909 8.872
205 HB3 MET 30 2HB MET 30 7.362 3.464 8.618
206 HG2 MET 30 1HG MET 30 8.808 2.717 6.872
207 HG3 MET 30 2HG MET 30 9.696 4.239 6.890
208 HE1 MET 30 1HE MET 30 10.530 5.174 9.141
209 HE2 MET 30 2HE MET 30 11.518 4.211 10.240
210 HE3 MET 30 3HE MET 30 12.040 4.460 8.573
211 H TYR 31 H TYR 31 8.370 7.133 7.505
212 HA TYR 31 HA TYR 31 9.679 7.065 4.875
213 HB2 TYR 31 1HB TYR 31 7.685 8.628 4.918
214 HB3 TYR 31 2HB TYR 31 8.568 9.594 6.095
215 HD1 TYR 31 2HD TYR 31 10.842 10.527 5.400
216 HD2 TYR 31 1HD TYR 31 8.049 8.918 2.622
217 HE1 TYR 31 2HE TYR 31 11.981 11.718 3.574
218 HE2 TYR 31 1HE TYR 31 9.181 10.104 0.789
219 HH TYR 31 HH TYR 31 11.298 11.091 0.264
220 H ILE 32 H ILE 32 11.759 7.829 4.812
221 HA ILE 32 HA ILE 32 12.907 8.707 7.381
222 HB ILE 32 HB ILE 32 14.367 7.087 5.298
223 HG12 ILE 32 1HG1 ILE 32 14.160 5.258 7.097
224 HG13 ILE 32 2HG1 ILE 32 12.851 6.232 7.757
225 HG21 ILE 32 1HG2 ILE 32 15.211 7.189 8.129
226 HG22 ILE 32 2HG2 ILE 32 16.178 7.143 6.656
227 HG23 ILE 32 3HG2 ILE 32 15.438 8.656 7.178
228 HD11 ILE 32 1HD1 ILE 32 11.451 5.768 6.026
229 HD12 ILE 32 2HD1 ILE 32 12.767 5.541 4.874
230 HD13 ILE 32 3HD1 ILE 32 12.402 4.283 6.054
231 HA PRO 33 HA PRO 33 14.001 12.285 4.962
232 HB2 PRO 33 1HB PRO 33 15.295 13.585 6.964
233 HB3 PRO 33 2HB PRO 33 13.533 13.510 6.849
234 HG2 PRO 33 1HG PRO 33 15.392 11.875 8.531
235 HG3 PRO 33 2HG PRO 33 13.839 12.609 8.971
236 HD2 PRO 33 1HD PRO 33 14.086 9.985 8.353
237 HD3 PRO 33 2HD PRO 33 12.619 10.916 7.993
238 H ALA 34 H ALA 34 16.266 10.413 6.914
239 HA ALA 34 HA ALA 34 18.703 11.387 6.342
240 HB1 ALA 34 1HB ALA 34 19.527 9.022 6.237
241 HB2 ALA 34 2HB ALA 34 18.509 9.394 7.629
242 HB3 ALA 34 3HB ALA 34 17.842 8.502 6.261
243 H SER 35 H SER 35 17.465 8.782 4.255
244 HA SER 35 HA SER 35 19.069 9.800 2.057
245 HB2 SER 35 1HB SER 35 19.080 7.391 2.489
246 HB3 SER 35 2HB SER 35 17.332 7.327 2.262
247 HG SER 35 HG SER 35 18.910 8.398 0.215
248 H ASN 36 H ASN 36 17.202 11.649 2.583
249 HA ASN 36 HA ASN 36 15.252 11.314 0.399
250 HB2 ASN 36 1HB ASN 36 14.052 11.314 2.499
251 HB3 ASN 36 2HB ASN 36 14.897 12.766 3.028
252 HD21 ASN 36 1HD2 ASN 36 12.992 13.898 3.324
253 HD22 ASN 36 2HD2 ASN 36 12.040 14.468 2.000
254 H ASN 37 H ASN 37 14.887 13.075 -0.944
255 HA ASN 37 HA ASN 37 17.050 15.019 -0.999
256 HB2 ASN 37 1HB ASN 37 14.814 14.807 -3.008
257 HB3 ASN 37 2HB ASN 37 16.436 15.453 -3.241
258 HD21 ASN 37 1HD2 ASN 37 14.451 12.666 -3.253
259 HD22 ASN 37 2HD2 ASN 37 15.657 11.533 -3.750
260 H ASN 38 H ASN 38 14.999 15.212 1.064
261 HA ASN 38 HA ASN 38 13.430 16.661 1.931
262 HB2 ASN 38 1HB ASN 38 15.711 17.741 2.176
263 HB3 ASN 38 2HB ASN 38 15.308 18.722 0.770
264 HD21 ASN 38 1HD2 ASN 38 15.875 19.617 3.435
265 HD22 ASN 38 2HD2 ASN 38 14.470 20.450 3.996
266 H THR 39 H THR 39 12.570 15.797 -0.570
267 HA THR 39 HA THR 39 11.513 18.227 -1.845
268 HB THR 39 HB THR 39 12.734 16.494 -3.248
269 HG1 THR 39 1HG THR 39 11.380 16.925 -4.938
270 HG21 THR 39 1HG2 THR 39 11.597 14.487 -3.867
271 HG22 THR 39 2HG2 THR 39 10.156 14.955 -2.964
272 HG23 THR 39 3HG2 THR 39 11.639 14.539 -2.105
273 HA PRO 40 HA PRO 40 7.525 17.442 -0.136
274 HB2 PRO 40 1HB PRO 40 6.043 18.890 -1.890
275 HB3 PRO 40 2HB PRO 40 7.050 19.632 -0.641
276 HG2 PRO 40 1HG PRO 40 7.632 19.224 -3.549
277 HG3 PRO 40 2HG PRO 40 7.939 20.646 -2.535
278 HD2 PRO 40 1HD PRO 40 9.877 18.866 -3.175
279 HD3 PRO 40 2HD PRO 40 9.858 19.743 -1.631
280 H ILE 41 H ILE 41 6.214 15.741 -0.324
281 HA ILE 41 HA ILE 41 6.063 14.330 -2.867
282 HB ILE 41 HB ILE 41 4.821 13.476 -0.258
283 HG12 ILE 41 1HG1 ILE 41 7.618 12.972 -1.294
284 HG13 ILE 41 2HG1 ILE 41 7.178 13.847 0.169
285 HG21 ILE 41 1HG2 ILE 41 5.797 11.793 -2.553
286 HG22 ILE 41 2HG2 ILE 41 4.788 11.299 -1.195
287 HG23 ILE 41 3HG2 ILE 41 4.141 12.385 -2.424
288 HD11 ILE 41 1HD1 ILE 41 7.586 11.030 -0.235
289 HD12 ILE 41 2HD1 ILE 41 7.437 11.945 1.266
290 HD13 ILE 41 3HD1 ILE 41 5.992 11.350 0.449
291 H HIS 42 H HIS 42 4.241 14.055 -4.062
292 HA HIS 42 HA HIS 42 2.121 15.934 -3.716
293 HB2 HIS 42 1HB HIS 42 2.791 13.807 -5.697
294 HB3 HIS 42 2HB HIS 42 1.132 14.396 -5.642
295 HD1 HIS 42 1HD HIS 42 1.486 15.407 -8.031
296 HD2 HIS 42 2HD HIS 42 3.892 17.046 -5.068
297 HE1 HIS 42 1HE HIS 42 2.424 17.520 -9.019
298 HE2 HIS 42 2HE HIS 42 3.943 18.451 -7.239
299 H GLY 43 H GLY 43 2.434 12.435 -3.282
300 HA2 GLY 43 1HA GLY 43 0.426 12.357 -1.282
301 HA3 GLY 43 2HA GLY 43 -0.230 11.792 -2.812
302 H PHE 44 H PHE 44 -0.543 9.694 -2.053
303 HA PHE 44 HA PHE 44 1.879 8.072 -2.046
304 HB2 PHE 44 1HB PHE 44 -0.080 8.234 0.229
305 HB3 PHE 44 2HB PHE 44 0.839 6.762 -0.064
306 HD1 PHE 44 2HD PHE 44 3.468 7.461 -0.646
307 HD2 PHE 44 1HD PHE 44 0.763 9.480 1.946
308 HE1 PHE 44 2HE PHE 44 5.369 8.400 0.601
309 HE2 PHE 44 1HE PHE 44 2.660 10.423 3.197
310 HZ PHE 44 HZ PHE 44 4.967 9.882 2.526
311 H TYR 45 H TYR 45 1.603 6.445 -3.410
312 HA TYR 45 HA TYR 45 -1.120 5.654 -4.142
313 HB2 TYR 45 1HB TYR 45 1.547 5.451 -5.495
314 HB3 TYR 45 2HB TYR 45 0.242 4.372 -5.975
315 HD1 TYR 45 2HD TYR 45 -2.124 5.881 -6.079
316 HD2 TYR 45 1HD TYR 45 1.825 7.185 -6.980
317 HE1 TYR 45 2HE TYR 45 -3.042 7.635 -7.539
318 HE2 TYR 45 1HE TYR 45 0.917 8.943 -8.441
319 HH TYR 45 HH TYR 45 -1.571 10.226 -8.448
320 H ILE 46 H ILE 46 -1.916 3.649 -3.806
321 HA ILE 46 HA ILE 46 -0.115 1.652 -2.602
322 HB ILE 46 HB ILE 46 -2.984 2.184 -1.823
323 HG12 ILE 46 1HG1 ILE 46 -0.686 2.371 0.073
324 HG13 ILE 46 2HG1 ILE 46 -0.943 3.699 -1.053
325 HG21 ILE 46 1HG2 ILE 46 -2.659 0.465 -0.134
326 HG22 ILE 46 2HG2 ILE 46 -2.398 -0.194 -1.748
327 HG23 ILE 46 3HG2 ILE 46 -1.018 0.183 -0.716
328 HD11 ILE 46 1HD1 ILE 46 -2.732 2.720 1.134
329 HD12 ILE 46 2HD1 ILE 46 -2.089 4.339 0.861
330 HD13 ILE 46 3HD1 ILE 46 -3.352 3.703 -0.192
331 H TYR 47 H TYR 47 0.017 -0.128 -3.782
332 HA TYR 47 HA TYR 47 -2.196 -0.788 -5.602
333 HB2 TYR 47 1HB TYR 47 0.677 -1.728 -5.703
334 HB3 TYR 47 2HB TYR 47 -0.567 -2.051 -6.905
335 HD1 TYR 47 2HD TYR 47 0.967 0.900 -5.189
336 HD2 TYR 47 1HD TYR 47 -0.526 -0.760 -8.811
337 HE1 TYR 47 2HE TYR 47 1.596 2.956 -6.383
338 HE2 TYR 47 1HE TYR 47 0.100 1.291 -10.016
339 HH TYR 47 HH TYR 47 1.983 3.214 -9.520
340 H TYR 48 H TYR 48 -2.931 -2.935 -5.771
341 HA TYR 48 HA TYR 48 -1.957 -4.958 -3.967
342 HB2 TYR 48 1HB TYR 48 -4.334 -5.220 -2.976
343 HB3 TYR 48 2HB TYR 48 -3.287 -3.966 -2.321
344 HD1 TYR 48 2HD TYR 48 -3.632 -1.584 -3.069
345 HD2 TYR 48 1HD TYR 48 -6.409 -4.681 -3.965
346 HE1 TYR 48 2HE TYR 48 -5.357 0.106 -3.536
347 HE2 TYR 48 1HE TYR 48 -8.141 -3.000 -4.437
348 HH TYR 48 HH TYR 48 -8.386 -0.301 -3.510
349 H ARG 49 H ARG 49 -2.492 -6.991 -4.626
350 HA ARG 49 HA ARG 49 -4.655 -7.421 -6.503
351 HB2 ARG 49 1HB ARG 49 -3.315 -8.294 -8.286
352 HB3 ARG 49 2HB ARG 49 -2.710 -6.689 -7.900
353 HG2 ARG 49 1HG ARG 49 -0.735 -7.787 -8.044
354 HG3 ARG 49 2HG ARG 49 -1.086 -8.089 -6.341
355 HD2 ARG 49 1HD ARG 49 -2.159 -10.241 -7.035
356 HD3 ARG 49 2HD ARG 49 -1.565 -9.943 -8.668
357 HE ARG 49 HE ARG 49 -0.063 -10.924 -6.454
358 HH11 ARG 49 1HH1 ARG 49 0.153 -9.009 -9.353
359 HH12 ARG 49 2HH1 ARG 49 1.843 -9.313 -9.584
360 HH21 ARG 49 1HH2 ARG 49 2.162 -11.331 -6.747
361 HH22 ARG 49 2HH2 ARG 49 2.985 -10.635 -8.102
362 HA PRO 50 HA PRO 50 -4.755 -11.245 -4.317
363 HB2 PRO 50 1HB PRO 50 -6.319 -12.655 -6.030
364 HB3 PRO 50 2HB PRO 50 -6.952 -11.385 -4.976
365 HG2 PRO 50 1HG PRO 50 -6.226 -11.252 -7.877
366 HG3 PRO 50 2HG PRO 50 -7.637 -10.573 -7.045
367 HD2 PRO 50 1HD PRO 50 -5.484 -9.076 -7.717
368 HD3 PRO 50 2HD PRO 50 -6.462 -8.748 -6.272
369 H THR 51 H THR 51 -3.802 -13.263 -4.321
370 HA THR 51 HA THR 51 -1.568 -13.683 -5.936
371 HB THR 51 HB THR 51 -2.249 -14.768 -3.649
372 HG1 THR 51 1HG THR 51 -0.871 -16.296 -5.624
373 HG21 THR 51 1HG2 THR 51 -3.364 -16.772 -3.667
374 HG22 THR 51 2HG2 THR 51 -2.902 -17.139 -5.329
375 HG23 THR 51 3HG2 THR 51 -4.179 -15.966 -5.007
376 H ASP 52 H ASP 52 -4.895 -14.523 -6.429
377 HA ASP 52 HA ASP 52 -4.437 -16.519 -8.426
378 HB2 ASP 52 1HB ASP 52 -6.519 -16.688 -7.348
379 HB3 ASP 52 2HB ASP 52 -6.852 -14.967 -7.526
380 H SER 53 H SER 53 -4.282 -13.132 -8.396
381 HA SER 53 HA SER 53 -5.203 -12.320 -10.853
382 HB2 SER 53 1HB SER 53 -2.849 -11.425 -9.206
383 HB3 SER 53 2HB SER 53 -3.208 -10.667 -10.758
384 HG SER 53 HG SER 53 -5.463 -10.562 -9.706
385 H ASP 54 H ASP 54 -3.547 -11.502 -12.636
386 HA ASP 54 HA ASP 54 -1.959 -13.852 -13.441
387 HB2 ASP 54 1HB ASP 54 -4.125 -13.107 -14.751
388 HB3 ASP 54 2HB ASP 54 -3.032 -11.921 -15.457
389 H ASN 55 H ASN 55 -2.234 -10.351 -14.078
390 HA ASN 55 HA ASN 55 0.649 -10.093 -13.718
391 HB2 ASN 55 1HB ASN 55 0.505 -8.545 -15.870
392 HB3 ASN 55 2HB ASN 55 0.825 -10.272 -16.002
393 HD21 ASN 55 1HD2 ASN 55 -1.287 -7.717 -16.767
394 HD22 ASN 55 2HD2 ASN 55 -2.486 -8.645 -17.596
395 H ASP 56 H ASP 56 1.149 -7.577 -14.220
396 HA ASP 56 HA ASP 56 0.153 -6.113 -12.130
397 HB2 ASP 56 1HB ASP 56 1.435 -5.366 -14.721
398 HB3 ASP 56 2HB ASP 56 0.751 -4.084 -13.726
399 H SER 57 H SER 57 -1.335 -6.734 -15.188
400 HA SER 57 HA SER 57 -3.072 -4.656 -15.553
401 HB2 SER 57 1HB SER 57 -2.984 -6.500 -17.118
402 HB3 SER 57 2HB SER 57 -3.614 -7.613 -15.904
403 HG SER 57 HG SER 57 -5.385 -7.065 -17.012
404 H ASP 58 H ASP 58 -3.002 -6.870 -12.939
405 HA ASP 58 HA ASP 58 -5.733 -6.259 -12.113
406 HB2 ASP 58 1HB ASP 58 -3.706 -7.966 -10.663
407 HB3 ASP 58 2HB ASP 58 -5.451 -7.942 -10.429
408 H TYR 59 H TYR 59 -2.424 -5.942 -10.849
409 HA TYR 59 HA TYR 59 -2.731 -4.784 -8.457
410 HB2 TYR 59 1HB TYR 59 -0.813 -4.289 -10.671
411 HB3 TYR 59 2HB TYR 59 -0.825 -3.121 -9.354
412 HD1 TYR 59 1HD TYR 59 -1.281 -4.743 -6.995
413 HD2 TYR 59 2HD TYR 59 1.086 -5.591 -10.428
414 HE1 TYR 59 1HE TYR 59 0.125 -6.245 -5.648
415 HE2 TYR 59 2HE TYR 59 2.497 -7.097 -9.090
416 HH TYR 59 HH TYR 59 1.759 -8.459 -6.462
417 H LYS 60 H LYS 60 -3.955 -3.221 -7.666
418 HA LYS 60 HA LYS 60 -5.054 -1.193 -9.445
419 HB2 LYS 60 1HB LYS 60 -5.736 -2.258 -6.752
420 HB3 LYS 60 2HB LYS 60 -6.187 -0.594 -7.100
421 HG2 LYS 60 1HG LYS 60 -7.674 -1.203 -8.757
422 HG3 LYS 60 2HG LYS 60 -6.898 -2.765 -9.023
423 HD2 LYS 60 1HD LYS 60 -8.213 -2.136 -6.405
424 HD3 LYS 60 2HD LYS 60 -9.170 -2.684 -7.784
425 HE2 LYS 60 1HE LYS 60 -6.764 -4.161 -6.733
426 HE3 LYS 60 2HE LYS 60 -8.413 -4.490 -6.203
427 HZ1 LYS 60 1HZ LYS 60 -7.617 -5.971 -7.998
428 HZ2 LYS 60 2HZ LYS 60 -7.517 -4.634 -9.029
429 HZ3 LYS 60 3HZ LYS 60 -9.017 -5.114 -8.411
430 H LYS 61 H LYS 61 -5.433 0.978 -7.963
431 HA LYS 61 HA LYS 61 -2.930 1.753 -6.692
432 HB2 LYS 61 1HB LYS 61 -2.670 2.220 -9.135
433 HB3 LYS 61 2HB LYS 61 -4.047 3.309 -9.030
434 HG2 LYS 61 1HG LYS 61 -2.879 4.842 -7.705
435 HG3 LYS 61 2HG LYS 61 -1.622 3.670 -7.304
436 HD2 LYS 61 1HD LYS 61 -0.556 4.971 -8.883
437 HD3 LYS 61 2HD LYS 61 -1.202 3.666 -9.880
438 HE2 LYS 61 1HE LYS 61 -2.951 5.007 -10.691
439 HE3 LYS 61 2HE LYS 61 -2.725 6.213 -9.425
440 HZ1 LYS 61 1HZ LYS 61 -1.016 5.706 -11.787
441 HZ2 LYS 61 2HZ LYS 61 -0.474 6.609 -10.464
442 HZ3 LYS 61 3HZ LYS 61 -1.809 7.137 -11.357
443 H ASP 62 H ASP 62 -3.326 2.968 -4.963
444 HA ASP 62 HA ASP 62 -5.864 4.462 -4.855
445 HB2 ASP 62 1HB ASP 62 -4.624 2.604 -2.886
446 HB3 ASP 62 2HB ASP 62 -5.455 4.023 -2.253
447 H MET 63 H MET 63 -5.429 6.562 -4.934
448 HA MET 63 HA MET 63 -2.884 7.623 -4.124
449 HB2 MET 63 1HB MET 63 -4.543 8.415 -6.016
450 HB3 MET 63 2HB MET 63 -5.235 9.371 -4.713
451 HG2 MET 63 1HG MET 63 -2.699 10.036 -4.353
452 HG3 MET 63 2HG MET 63 -2.609 9.611 -6.061
453 HE1 MET 63 1HE MET 63 -5.061 11.938 -3.635
454 HE2 MET 63 2HE MET 63 -3.307 11.995 -3.455
455 HE3 MET 63 3HE MET 63 -4.165 13.358 -4.175
456 H VAL 64 H VAL 64 -2.386 8.788 -2.328
457 HA VAL 64 HA VAL 64 -4.510 9.481 -0.442
458 HB VAL 64 HB VAL 64 -2.064 8.024 0.536
459 HG11 VAL 64 1HG1 VAL 64 -3.169 7.896 2.592
460 HG12 VAL 64 2HG1 VAL 64 -3.516 9.529 2.019
461 HG13 VAL 64 3HG1 VAL 64 -4.738 8.264 1.876
462 HG21 VAL 64 1HG2 VAL 64 -3.917 6.158 0.866
463 HG22 VAL 64 2HG2 VAL 64 -4.597 6.931 -0.567
464 HG23 VAL 64 3HG2 VAL 64 -2.963 6.269 -0.614
465 H GLU 65 H GLU 65 -4.029 11.201 0.903
466 HA GLU 65 HA GLU 65 -2.567 13.284 0.102
467 HB2 GLU 65 1HB GLU 65 -2.711 12.443 3.002
468 HB3 GLU 65 2HB GLU 65 -2.439 14.073 2.401
469 HG2 GLU 65 1HG GLU 65 -4.942 12.459 1.967
470 HG3 GLU 65 2HG GLU 65 -4.736 13.721 3.181
471 H GLY 66 H GLY 66 -0.491 14.172 0.474
472 HA2 GLY 66 1HA GLY 66 1.612 12.200 0.399
473 HA3 GLY 66 2HA GLY 66 1.802 13.939 0.230
474 H ASP 67 H ASP 67 -0.010 13.477 2.932
475 HA ASP 67 HA ASP 67 2.377 13.467 4.660
476 HB2 ASP 67 1HB ASP 67 -0.258 14.817 5.266
477 HB3 ASP 67 2HB ASP 67 1.253 14.972 6.158
478 H ARG 68 H ARG 68 -0.538 11.916 3.890
479 HA ARG 68 HA ARG 68 -1.104 10.804 6.466
480 HB2 ARG 68 1HB ARG 68 -2.710 11.110 4.471
481 HB3 ARG 68 2HB ARG 68 -2.002 9.626 3.849
482 HG2 ARG 68 1HG ARG 68 -3.814 8.794 4.957
483 HG3 ARG 68 2HG ARG 68 -2.597 8.712 6.232
484 HD2 ARG 68 1HD ARG 68 -4.243 9.750 7.403
485 HD3 ARG 68 2HD ARG 68 -3.487 11.175 6.693
486 HE ARG 68 HE ARG 68 -5.460 11.561 5.637
487 HH11 ARG 68 1HH1 ARG 68 -5.182 8.137 6.198
488 HH12 ARG 68 2HH1 ARG 68 -6.727 7.766 5.508
489 HH21 ARG 68 1HH2 ARG 68 -7.496 11.085 4.725
490 HH22 ARG 68 2HH2 ARG 68 -8.042 9.444 4.669
491 H TYR 69 H TYR 69 -0.374 8.972 7.375
492 HA TYR 69 HA TYR 69 1.432 7.283 5.770
493 HB2 TYR 69 1HB TYR 69 1.652 8.289 8.584
494 HB3 TYR 69 2HB TYR 69 2.407 6.761 8.146
495 HD1 TYR 69 2HD TYR 69 2.101 10.002 6.312
496 HD2 TYR 69 1HD TYR 69 4.692 7.091 8.019
497 HE1 TYR 69 2HE TYR 69 4.044 11.222 5.428
498 HE2 TYR 69 1HE TYR 69 6.643 8.304 7.140
499 HH TYR 69 HH TYR 69 6.287 11.029 4.969
500 H TRP 70 H TRP 70 -1.541 7.180 6.566
501 HA TRP 70 HA TRP 70 -1.516 4.333 7.207
502 HB2 TRP 70 1HB TRP 70 -2.934 4.460 9.061
503 HB3 TRP 70 2HB TRP 70 -1.816 5.796 9.322
504 HD1 TRP 70 HD TRP 70 -2.792 8.303 8.764
505 HE1 TRP 70 1HE TRP 70 -5.195 9.211 8.939
506 HE3 TRP 70 3HE TRP 70 -5.333 3.867 8.836
507 HZ2 TRP 70 2HZ TRP 70 -7.819 8.182 9.089
508 HZ3 TRP 70 3HZ TRP 70 -7.787 3.916 8.998
509 HH2 TRP 70 HH TRP 70 -9.003 6.030 9.122
510 H HIS 71 H HIS 71 -3.193 3.191 6.313
511 HA HIS 71 HA HIS 71 -5.503 4.512 5.215
512 HB2 HIS 71 1HB HIS 71 -3.868 4.963 3.449
513 HB3 HIS 71 2HB HIS 71 -3.482 3.248 3.351
514 HD1 HIS 71 1HD HIS 71 -6.365 5.616 2.702
515 HD2 HIS 71 2HD HIS 71 -5.068 1.810 1.654
516 HE1 HIS 71 1HE HIS 71 -7.948 4.836 0.911
517 HE2 HIS 71 2HE HIS 71 -7.195 2.498 0.353
518 H SER 72 H SER 72 -7.194 3.127 4.914
519 HA SER 72 HA SER 72 -6.658 0.286 5.483
520 HB2 SER 72 1HB SER 72 -8.770 0.146 6.590
521 HB3 SER 72 2HB SER 72 -7.981 1.599 7.203
522 HG SER 72 HG SER 72 -9.237 2.649 5.387
523 H ILE 73 H ILE 73 -6.727 -0.827 3.643
524 HA ILE 73 HA ILE 73 -8.207 -0.013 1.354
525 HB ILE 73 HB ILE 73 -7.066 -2.756 1.882
526 HG12 ILE 73 1HG1 ILE 73 -5.682 -0.437 0.527
527 HG13 ILE 73 2HG1 ILE 73 -5.423 -0.864 2.215
528 HG21 ILE 73 1HG2 ILE 73 -8.571 -2.650 -0.019
529 HG22 ILE 73 2HG2 ILE 73 -7.680 -1.277 -0.672
530 HG23 ILE 73 3HG2 ILE 73 -6.908 -2.859 -0.568
531 HD11 ILE 73 1HD1 ILE 73 -4.515 -2.989 1.595
532 HD12 ILE 73 2HD1 ILE 73 -4.923 -2.716 -0.099
533 HD13 ILE 73 3HD1 ILE 73 -3.689 -1.727 0.681
534 H SER 74 H SER 74 -9.905 -1.234 0.305
535 HA SER 74 HA SER 74 -11.489 -2.986 2.021
536 HB2 SER 74 1HB SER 74 -12.768 -0.612 0.659
537 HB3 SER 74 2HB SER 74 -13.506 -1.722 1.814
538 HG SER 74 HG SER 74 -12.933 -0.238 3.197
539 H HIS 75 H HIS 75 -13.638 -3.500 0.623
540 HA HIS 75 HA HIS 75 -14.436 -4.711 -1.131
541 HB2 HIS 75 1HB HIS 75 -12.893 -2.510 -2.419
542 HB3 HIS 75 2HB HIS 75 -13.448 -3.832 -3.441
543 HD1 HIS 75 1HD HIS 75 -16.120 -4.260 -3.365
544 HD2 HIS 75 2HD HIS 75 -14.776 -0.615 -1.894
545 HE1 HIS 75 1HE HIS 75 -18.144 -2.768 -3.315
546 HE2 HIS 75 2HE HIS 75 -17.289 -0.543 -2.502
547 H LEU 76 H LEU 76 -12.444 -5.996 0.195
548 HA LEU 76 HA LEU 76 -10.805 -7.196 -1.938
549 HB2 LEU 76 1HB LEU 76 -10.321 -7.292 1.034
550 HB3 LEU 76 2HB LEU 76 -9.249 -7.887 -0.231
551 HG LEU 76 HG LEU 76 -9.964 -4.985 -0.138
552 HD11 LEU 76 1HD1 LEU 76 -8.964 -4.649 1.809
553 HD12 LEU 76 2HD1 LEU 76 -7.488 -5.372 1.170
554 HD13 LEU 76 3HD1 LEU 76 -8.682 -6.381 1.985
555 HD21 LEU 76 1HD2 LEU 76 -7.771 -4.750 -1.158
556 HD22 LEU 76 2HD2 LEU 76 -8.756 -5.895 -2.069
557 HD23 LEU 76 3HD2 LEU 76 -7.488 -6.483 -0.992
558 H GLN 77 H GLN 77 -10.143 -9.563 -1.159
559 HA GLN 77 HA GLN 77 -12.675 -10.988 -0.914
560 HB2 GLN 77 1HB GLN 77 -9.903 -12.007 -1.562
561 HB3 GLN 77 2HB GLN 77 -11.375 -12.970 -1.590
562 HG2 GLN 77 1HG GLN 77 -12.235 -11.770 -3.437
563 HG3 GLN 77 2HG GLN 77 -10.990 -10.530 -3.297
564 HE21 GLN 77 1HE2 GLN 77 -10.242 -10.789 -5.373
565 HE22 GLN 77 2HE2 GLN 77 -9.375 -12.190 -5.891
566 HA PRO 78 HA PRO 78 -12.062 -12.068 3.308
567 HB2 PRO 78 1HB PRO 78 -13.621 -14.288 3.409
568 HB3 PRO 78 2HB PRO 78 -14.284 -12.652 3.324
569 HG2 PRO 78 1HG PRO 78 -13.906 -14.660 1.136
570 HG3 PRO 78 2HG PRO 78 -15.289 -13.595 1.451
571 HD2 PRO 78 1HD PRO 78 -13.424 -13.042 -0.433
572 HD3 PRO 78 2HD PRO 78 -14.268 -11.773 0.477
573 H GLU 79 H GLU 79 -10.840 -13.430 4.577
574 HA GLU 79 HA GLU 79 -8.927 -14.706 4.846
575 HB2 GLU 79 1HB GLU 79 -9.591 -17.194 4.368
576 HB3 GLU 79 2HB GLU 79 -10.389 -16.297 5.652
577 HG2 GLU 79 1HG GLU 79 -12.331 -15.973 4.359
578 HG3 GLU 79 2HG GLU 79 -11.523 -16.491 2.881
579 H THR 80 H THR 80 -8.640 -13.389 2.460
580 HA THR 80 HA THR 80 -7.575 -15.456 0.649
581 HB THR 80 HB THR 80 -8.457 -12.639 -0.009
582 HG1 THR 80 1HG THR 80 -10.265 -13.867 0.093
583 HG21 THR 80 1HG2 THR 80 -7.772 -14.650 -2.094
584 HG22 THR 80 2HG2 THR 80 -6.451 -13.817 -1.274
585 HG23 THR 80 3HG2 THR 80 -7.671 -12.891 -2.147
586 H SER 81 H SER 81 -5.480 -15.693 1.177
587 HA SER 81 HA SER 81 -3.844 -13.533 2.090
588 HB2 SER 81 1HB SER 81 -3.649 -16.130 2.512
589 HB3 SER 81 2HB SER 81 -2.667 -16.080 1.049
590 HG SER 81 HG SER 81 -2.212 -14.338 3.229
591 H TYR 82 H TYR 82 -3.448 -11.932 0.678
592 HA TYR 82 HA TYR 82 -2.210 -12.672 -1.886
593 HB2 TYR 82 1HB TYR 82 -3.299 -10.604 -2.847
594 HB3 TYR 82 2HB TYR 82 -4.397 -11.928 -2.475
595 HD1 TYR 82 1HD TYR 82 -3.134 -8.676 -1.209
596 HD2 TYR 82 2HD TYR 82 -6.206 -11.613 -1.004
597 HE1 TYR 82 1HE TYR 82 -4.489 -7.153 0.167
598 HE2 TYR 82 2HE TYR 82 -7.570 -10.098 0.372
599 HH TYR 82 HH TYR 82 -7.702 -8.114 1.348
600 H ASP 83 H ASP 83 -0.777 -11.040 -2.776
601 HA ASP 83 HA ASP 83 0.874 -9.875 -0.741
602 HB2 ASP 83 1HB ASP 83 2.250 -9.098 -2.686
603 HB3 ASP 83 2HB ASP 83 1.957 -10.835 -2.662
604 H ILE 84 H ILE 84 1.447 -7.657 -0.554
605 HA ILE 84 HA ILE 84 -0.303 -5.713 -1.850
606 HB ILE 84 HB ILE 84 -0.021 -5.887 1.152
607 HG12 ILE 84 1HG1 ILE 84 -2.573 -6.081 -0.433
608 HG13 ILE 84 2HG1 ILE 84 -1.602 -7.508 -0.086
609 HG21 ILE 84 1HG2 ILE 84 -0.068 -3.579 0.177
610 HG22 ILE 84 2HG2 ILE 84 -1.671 -3.950 -0.456
611 HG23 ILE 84 3HG2 ILE 84 -1.392 -3.943 1.285
612 HD11 ILE 84 1HD1 ILE 84 -2.917 -7.638 1.721
613 HD12 ILE 84 2HD1 ILE 84 -1.808 -6.435 2.380
614 HD13 ILE 84 3HD1 ILE 84 -3.340 -5.927 1.668
615 H LYS 85 H LYS 85 0.736 -3.886 -2.363
616 HA LYS 85 HA LYS 85 3.123 -3.097 -0.880
617 HB2 LYS 85 1HB LYS 85 4.586 -3.104 -2.689
618 HB3 LYS 85 2HB LYS 85 3.684 -4.596 -2.919
619 HG2 LYS 85 1HG LYS 85 2.280 -3.519 -4.580
620 HG3 LYS 85 2HG LYS 85 3.125 -1.991 -4.323
621 HD2 LYS 85 1HD LYS 85 5.055 -2.734 -5.358
622 HD3 LYS 85 2HD LYS 85 4.676 -4.434 -5.071
623 HE2 LYS 85 1HE LYS 85 4.400 -3.998 -7.405
624 HE3 LYS 85 2HE LYS 85 2.800 -4.216 -6.699
625 HZ1 LYS 85 1HZ LYS 85 3.802 -1.488 -6.796
626 HZ2 LYS 85 2HZ LYS 85 2.243 -2.079 -7.077
627 HZ3 LYS 85 3HZ LYS 85 3.420 -2.189 -8.287
628 H MET 86 H MET 86 3.987 -0.950 -1.907
629 HA MET 86 HA MET 86 1.965 0.703 -3.129
630 HB2 MET 86 1HB MET 86 1.812 2.329 -1.332
631 HB3 MET 86 2HB MET 86 1.299 0.749 -0.753
632 HG2 MET 86 1HG MET 86 3.259 0.444 0.492
633 HG3 MET 86 2HG MET 86 4.094 1.749 -0.348
634 HE1 MET 86 1HE MET 86 1.253 4.119 0.152
635 HE2 MET 86 2HE MET 86 2.629 4.919 0.912
636 HE3 MET 86 3HE MET 86 2.858 3.988 -0.569
637 H GLN 87 H GLN 87 2.830 3.106 -3.081
638 HA GLN 87 HA GLN 87 5.643 3.480 -2.941
639 HB2 GLN 87 1HB GLN 87 5.747 2.175 -4.942
640 HB3 GLN 87 2HB GLN 87 4.407 3.059 -5.660
641 HG2 GLN 87 1HG GLN 87 6.048 5.103 -5.322
642 HG3 GLN 87 2HG GLN 87 7.258 3.822 -5.385
643 HE21 GLN 87 1HE2 GLN 87 4.511 5.196 -7.118
644 HE22 GLN 87 2HE2 GLN 87 5.058 4.758 -8.697
645 H CYS 88 H CYS 88 6.206 5.628 -3.069
646 HA CYS 88 HA CYS 88 3.959 7.493 -3.207
647 HB2 CYS 88 1HB CYS 88 5.197 8.950 -1.877
648 HB3 CYS 88 2HB CYS 88 5.696 7.373 -1.277
649 HG CYS 88 HG CYS 88 7.696 9.630 -1.839
650 H PHE 89 H PHE 89 4.451 9.681 -4.167
651 HA PHE 89 HA PHE 89 6.376 9.690 -6.336
652 HB2 PHE 89 1HB PHE 89 4.791 10.042 -8.103
653 HB3 PHE 89 2HB PHE 89 4.322 8.573 -7.254
654 HD1 PHE 89 1HD PHE 89 2.619 9.013 -5.248
655 HD2 PHE 89 2HD PHE 89 3.134 11.524 -8.646
656 HE1 PHE 89 1HE PHE 89 0.361 9.929 -4.909
657 HE2 PHE 89 2HE PHE 89 0.877 12.445 -8.312
658 HZ PHE 89 HZ PHE 89 -0.512 11.648 -6.441
659 H ASN 90 H ASN 90 6.311 11.821 -7.525
660 HA ASN 90 HA ASN 90 5.049 14.037 -6.197
661 HB2 ASN 90 1HB ASN 90 6.874 13.794 -4.659
662 HB3 ASN 90 2HB ASN 90 8.034 13.624 -5.974
663 HD21 ASN 90 1HD2 ASN 90 9.310 15.331 -5.861
664 HD22 ASN 90 2HD2 ASN 90 8.789 16.976 -5.766
665 H GLU 91 H GLU 91 5.578 16.117 -7.253
666 HA GLU 91 HA GLU 91 5.152 16.246 -9.879
667 HB2 GLU 91 1HB GLU 91 5.321 18.256 -8.550
668 HB3 GLU 91 2HB GLU 91 7.048 18.013 -8.327
669 HG2 GLU 91 1HG GLU 91 6.844 19.690 -9.950
670 HG3 GLU 91 2HG GLU 91 7.274 18.225 -10.832
671 H GLY 92 H GLY 92 8.266 15.529 -8.413
672 HA2 GLY 92 1HA GLY 92 9.793 15.674 -10.807
673 HA3 GLY 92 2HA GLY 92 10.273 14.868 -9.321
674 H GLY 93 H GLY 93 8.962 12.759 -8.921
675 HA2 GLY 93 1HA GLY 93 7.960 11.318 -11.140
676 HA3 GLY 93 2HA GLY 93 9.656 10.925 -10.902
677 H GLU 94 H GLU 94 7.852 8.925 -10.704
678 HA GLU 94 HA GLU 94 6.884 8.522 -8.055
679 HB2 GLU 94 1HB GLU 94 7.185 6.791 -10.482
680 HB3 GLU 94 2HB GLU 94 6.797 6.058 -8.933
681 HG2 GLU 94 1HG GLU 94 4.716 6.997 -8.847
682 HG3 GLU 94 2HG GLU 94 5.172 8.367 -9.858
683 H SER 95 H SER 95 7.682 7.202 -6.423
684 HA SER 95 HA SER 95 10.559 7.012 -6.325
685 HB2 SER 95 1HB SER 95 10.265 6.401 -4.008
686 HB3 SER 95 2HB SER 95 9.163 7.730 -4.368
687 HG SER 95 HG SER 95 8.621 5.107 -3.699
688 H GLU 96 H GLU 96 11.227 4.841 -4.980
689 HA GLU 96 HA GLU 96 11.075 2.769 -6.924
690 HB2 GLU 96 1HB GLU 96 12.209 2.858 -4.130
691 HB3 GLU 96 2HB GLU 96 12.309 1.435 -5.157
692 HG2 GLU 96 1HG GLU 96 13.396 3.026 -6.869
693 HG3 GLU 96 2HG GLU 96 13.635 4.093 -5.486
694 H PHE 97 H PHE 97 10.482 0.492 -6.321
695 HA PHE 97 HA PHE 97 7.772 0.477 -5.345
696 HB2 PHE 97 1HB PHE 97 9.586 -1.612 -6.531
697 HB3 PHE 97 2HB PHE 97 8.025 -2.043 -5.840
698 HD1 PHE 97 1HD PHE 97 9.225 0.742 -8.017
699 HD2 PHE 97 2HD PHE 97 6.474 -2.459 -7.470
700 HE1 PHE 97 1HE PHE 97 8.129 1.325 -10.142
701 HE2 PHE 97 2HE PHE 97 5.375 -1.882 -9.594
702 HZ PHE 97 HZ PHE 97 6.202 0.012 -10.933
703 H SER 98 H SER 98 7.223 0.218 -3.294
704 HA SER 98 HA SER 98 9.025 -0.305 -1.221
705 HB2 SER 98 1HB SER 98 7.160 -0.279 0.235
706 HB3 SER 98 2HB SER 98 6.708 0.790 -1.093
707 HG SER 98 HG SER 98 5.756 -1.761 -0.449
708 H ASN 99 H ASN 99 8.444 -2.148 0.446
709 HA ASN 99 HA ASN 99 9.131 -4.604 -0.858
710 HB2 ASN 99 1HB ASN 99 9.637 -5.412 1.241
711 HB3 ASN 99 2HB ASN 99 9.790 -3.681 1.527
712 HD21 ASN 99 1HD2 ASN 99 7.418 -2.729 1.947
713 HD22 ASN 99 2HD2 ASN 99 6.592 -3.532 3.235
714 H VAL 100 H VAL 100 7.974 -6.636 -0.532
715 HA VAL 100 HA VAL 100 5.123 -6.267 -0.961
716 HB VAL 100 HB VAL 100 6.747 -8.813 -1.066
717 HG11 VAL 100 1HG1 VAL 100 4.273 -9.032 -0.710
718 HG12 VAL 100 2HG1 VAL 100 4.046 -8.243 -2.272
719 HG13 VAL 100 3HG1 VAL 100 4.884 -9.792 -2.179
720 HG21 VAL 100 1HG2 VAL 100 5.823 -7.124 -3.382
721 HG22 VAL 100 2HG2 VAL 100 7.442 -7.025 -2.689
722 HG23 VAL 100 3HG2 VAL 100 6.889 -8.529 -3.426
723 H MET 101 H MET 101 3.725 -6.360 0.658
724 HA MET 101 HA MET 101 4.428 -7.935 3.043
725 HB2 MET 101 1HB MET 101 2.550 -5.582 2.766
726 HB3 MET 101 2HB MET 101 2.816 -6.486 4.251
727 HG2 MET 101 1HG MET 101 4.897 -4.910 2.753
728 HG3 MET 101 2HG MET 101 4.070 -4.400 4.223
729 HE1 MET 101 1HE MET 101 4.171 -5.497 6.393
730 HE2 MET 101 2HE MET 101 5.644 -6.223 7.038
731 HE3 MET 101 3HE MET 101 5.656 -4.549 6.482
732 H ILE 102 H ILE 102 3.337 -9.753 3.350
733 HA ILE 102 HA ILE 102 0.882 -10.222 1.842
734 HB ILE 102 HB ILE 102 2.619 -12.097 3.448
735 HG12 ILE 102 1HG1 ILE 102 2.081 -12.052 0.476
736 HG13 ILE 102 2HG1 ILE 102 3.455 -11.239 1.217
737 HG21 ILE 102 1HG2 ILE 102 -0.121 -12.360 2.623
738 HG22 ILE 102 2HG2 ILE 102 0.882 -13.563 1.814
739 HG23 ILE 102 3HG2 ILE 102 0.872 -13.463 3.575
740 HD11 ILE 102 1HD1 ILE 102 3.088 -14.094 1.871
741 HD12 ILE 102 2HD1 ILE 102 3.588 -13.701 0.226
742 HD13 ILE 102 3HD1 ILE 102 4.563 -13.168 1.595
743 H CYS 103 H CYS 103 -0.761 -9.220 2.910
744 HA CYS 103 HA CYS 103 -1.140 -9.885 5.750
745 HB2 CYS 103 1HB CYS 103 -1.001 -7.461 5.138
746 HB3 CYS 103 2HB CYS 103 -2.458 -7.667 4.174
747 HG CYS 103 HG CYS 103 -2.340 -8.247 7.543
748 H GLU 104 H GLU 104 -2.353 -11.668 5.901
749 HA GLU 104 HA GLU 104 -4.357 -12.355 3.978
750 HB2 GLU 104 1HB GLU 104 -2.913 -13.890 5.537
751 HB3 GLU 104 2HB GLU 104 -4.209 -13.611 6.692
752 HG2 GLU 104 1HG GLU 104 -5.733 -14.326 4.688
753 HG3 GLU 104 2HG GLU 104 -4.254 -15.091 4.112
754 H THR 105 H THR 105 -6.419 -11.762 3.932
755 HA THR 105 HA THR 105 -7.498 -9.916 5.774
756 HB THR 105 HB THR 105 -9.695 -10.436 4.599
757 HG1 THR 105 1HG THR 105 -9.619 -11.812 2.858
758 HG21 THR 105 1HG2 THR 105 -9.155 -9.060 2.825
759 HG22 THR 105 2HG2 THR 105 -7.590 -9.832 2.565
760 HG23 THR 105 3HG2 THR 105 -7.818 -8.736 3.928
761 H LYS 106 H LYS 106 -9.935 -10.494 6.523
762 HA LYS 106 HA LYS 106 -9.573 -12.623 8.476
763 HB2 LYS 106 1HB LYS 106 -11.768 -10.563 8.187
764 HB3 LYS 106 2HB LYS 106 -11.612 -11.699 9.520
765 HG2 LYS 106 1HG LYS 106 -9.299 -9.938 8.935
766 HG3 LYS 106 2HG LYS 106 -10.728 -9.212 9.675
767 HD2 LYS 106 1HD LYS 106 -10.477 -10.375 11.625
768 HD3 LYS 106 2HD LYS 106 -9.706 -11.751 10.832
769 HE2 LYS 106 1HE LYS 106 -8.265 -9.148 10.878
770 HE3 LYS 106 2HE LYS 106 -8.339 -10.090 12.366
771 HZ1 LYS 106 1HZ LYS 106 -6.402 -10.457 10.719
772 HZ2 LYS 106 2HZ LYS 106 -7.519 -11.386 9.854
773 HZ3 LYS 106 3HZ LYS 106 -7.129 -11.800 11.448
774 H ALA 107 H ALA 107 -11.154 -14.256 8.845
775 HA ALA 107 HA ALA 107 -12.190 -15.385 6.429
776 HB1 ALA 107 1HB ALA 107 -13.243 -16.989 8.268
777 HB2 ALA 107 2HB ALA 107 -11.543 -17.074 7.805
778 HB3 ALA 107 3HB ALA 107 -12.016 -16.213 9.270
779 H ARG 108 H ARG 108 -14.176 -15.243 5.592
780 HA ARG 108 HA ARG 108 -16.096 -13.479 6.804
781 HB2 ARG 108 1HB ARG 108 -17.440 -13.936 4.780
782 HB3 ARG 108 2HB ARG 108 -15.798 -13.436 4.398
783 HG2 ARG 108 1HG ARG 108 -15.208 -15.494 3.591
784 HG3 ARG 108 2HG ARG 108 -16.397 -16.343 4.581
785 HD2 ARG 108 1HD ARG 108 -18.119 -15.046 3.106
786 HD3 ARG 108 2HD ARG 108 -16.760 -14.900 1.991
787 HE ARG 108 HE ARG 108 -17.059 -17.584 2.824
788 HH11 ARG 108 1HH1 ARG 108 -18.528 -15.177 0.783
789 HH12 ARG 108 2HH1 ARG 108 -19.199 -16.333 -0.319
790 HH21 ARG 108 1HH2 ARG 108 -17.938 -19.116 1.381
791 HH22 ARG 108 2HH2 ARG 108 -18.864 -18.574 0.023
792 H SER 109 H SER 109 -18.223 -14.004 7.424
793 HA SER 109 HA SER 109 -18.457 -16.648 8.597
794 HB2 SER 109 1HB SER 109 -19.835 -14.030 8.941
795 HB3 SER 109 2HB SER 109 -20.744 -15.486 9.343
796 HG SER 109 HG SER 109 -19.665 -15.517 11.132
797 H GLY 110 H GLY 110 -18.866 -18.056 6.920
798 HA2 GLY 110 1HA GLY 110 -21.448 -17.649 5.540
799 HA3 GLY 110 2HA GLY 110 -20.045 -18.323 4.723
800 HA PRO 111 HA PRO 111 -22.759 -21.702 6.575
801 HB2 PRO 111 1HB PRO 111 -23.450 -22.874 4.226
802 HB3 PRO 111 2HB PRO 111 -24.391 -21.573 4.964
803 HG2 PRO 111 1HG PRO 111 -22.380 -21.436 2.751
804 HG3 PRO 111 2HG PRO 111 -23.952 -20.628 2.885
805 HD2 PRO 111 1HD PRO 111 -21.616 -19.364 3.409
806 HD3 PRO 111 2HD PRO 111 -23.125 -18.971 4.257
807 H SER 112 H SER 112 -22.166 -23.876 6.756
808 HA SER 112 HA SER 112 -19.725 -24.665 5.309
809 HB2 SER 112 1HB SER 112 -18.908 -25.754 7.352
810 HB3 SER 112 2HB SER 112 -19.168 -24.032 7.625
811 HG SER 112 HG SER 112 -20.395 -24.641 9.207
812 H SER 113 H SER 113 -20.076 -26.399 4.108
813 HA SER 113 HA SER 113 -22.209 -28.263 4.892
814 HB2 SER 113 1HB SER 113 -22.409 -27.199 2.655
815 HB3 SER 113 2HB SER 113 -20.876 -27.938 2.191
816 HG SER 113 HG SER 113 -22.119 -29.962 2.963
817 H GLY 114 H GLY 114 -21.790 -30.360 5.320
818 HA2 GLY 114 1HA GLY 114 -20.386 -32.332 4.792
819 HA3 GLY 114 2HA GLY 114 -18.999 -31.267 4.966
Start of MODEL 15
1 H1 GLY 1 H GLY 1 19.826 16.224 -24.250
2 HA2 GLY 1 1HA GLY 1 20.287 16.585 -22.031
3 HA3 GLY 1 2HA GLY 1 18.659 17.237 -21.905
4 H SER 2 H SER 2 20.675 14.961 -20.696
5 HA SER 2 HA SER 2 18.467 13.119 -20.052
6 HB2 SER 2 1HB SER 2 20.598 12.291 -21.310
7 HB3 SER 2 2HB SER 2 21.362 12.387 -19.723
8 HG SER 2 HG SER 2 20.103 10.795 -18.997
9 H SER 3 H SER 3 18.200 12.432 -17.919
10 HA SER 3 HA SER 3 18.300 12.517 -15.640
11 HB2 SER 3 1HB SER 3 20.867 12.503 -16.185
12 HB3 SER 3 2HB SER 3 20.783 14.198 -15.708
13 HG SER 3 HG SER 3 19.618 13.235 -13.774
14 H GLY 4 H GLY 4 16.803 14.380 -17.089
15 HA2 GLY 4 1HA GLY 4 17.243 17.033 -16.088
16 HA3 GLY 4 2HA GLY 4 15.828 16.470 -16.965
17 H SER 5 H SER 5 14.100 15.522 -15.813
18 HA SER 5 HA SER 5 13.718 16.649 -13.209
19 HB2 SER 5 1HB SER 5 11.484 15.735 -13.335
20 HB3 SER 5 2HB SER 5 11.897 16.408 -14.912
21 HG SER 5 HG SER 5 12.663 14.037 -15.210
22 H SER 6 H SER 6 13.728 15.676 -11.244
23 HA SER 6 HA SER 6 14.029 12.786 -11.051
24 HB2 SER 6 1HB SER 6 16.049 12.925 -9.676
25 HB3 SER 6 2HB SER 6 16.342 13.632 -11.265
26 HG SER 6 HG SER 6 16.292 15.641 -10.390
27 H GLY 7 H GLY 7 12.621 12.152 -9.566
28 HA2 GLY 7 1HA GLY 7 12.003 13.997 -7.346
29 HA3 GLY 7 2HA GLY 7 10.878 12.818 -8.003
30 HA PRO 8 HA PRO 8 12.645 10.970 -4.175
31 HB2 PRO 8 1HB PRO 8 10.301 9.863 -3.369
32 HB3 PRO 8 2HB PRO 8 10.751 11.532 -3.002
33 HG2 PRO 8 1HG PRO 8 8.950 10.485 -5.151
34 HG3 PRO 8 2HG PRO 8 8.727 11.888 -4.090
35 HD2 PRO 8 1HD PRO 8 9.585 12.118 -6.648
36 HD3 PRO 8 2HD PRO 8 10.104 13.228 -5.364
37 H VAL 9 H VAL 9 13.461 8.956 -4.061
38 HA VAL 9 HA VAL 9 12.305 6.892 -5.820
39 HB VAL 9 HB VAL 9 14.589 5.980 -6.113
40 HG11 VAL 9 1HG1 VAL 9 15.430 8.039 -7.487
41 HG12 VAL 9 2HG1 VAL 9 13.950 7.200 -7.958
42 HG13 VAL 9 3HG1 VAL 9 13.859 8.715 -7.058
43 HG21 VAL 9 1HG2 VAL 9 15.918 6.668 -4.379
44 HG22 VAL 9 2HG2 VAL 9 16.410 7.820 -5.620
45 HG23 VAL 9 3HG2 VAL 9 15.258 8.303 -4.375
46 H ALA 10 H ALA 10 14.165 7.529 -2.875
47 HA ALA 10 HA ALA 10 14.583 5.132 -1.759
48 HB1 ALA 10 1HB ALA 10 14.176 6.112 0.440
49 HB2 ALA 10 2HB ALA 10 15.039 7.236 -0.610
50 HB3 ALA 10 3HB ALA 10 13.315 7.455 -0.312
51 H GLY 11 H GLY 11 11.430 6.611 -2.213
52 HA2 GLY 11 1HA GLY 11 9.305 5.771 -1.999
53 HA3 GLY 11 2HA GLY 11 10.036 4.190 -2.231
54 HA PRO 12 HA PRO 12 8.523 5.020 2.251
55 HB2 PRO 12 1HB PRO 12 6.016 3.988 2.119
56 HB3 PRO 12 2HB PRO 12 6.367 5.698 1.841
57 HG2 PRO 12 1HG PRO 12 5.919 3.508 -0.151
58 HG3 PRO 12 2HG PRO 12 5.304 5.171 -0.160
59 HD2 PRO 12 1HD PRO 12 7.429 4.395 -1.648
60 HD3 PRO 12 2HD PRO 12 7.282 6.031 -0.975
61 H TYR 13 H TYR 13 8.089 3.337 3.823
62 HA TYR 13 HA TYR 13 8.470 0.609 2.784
63 HB2 TYR 13 1HB TYR 13 10.614 1.224 3.608
64 HB3 TYR 13 2HB TYR 13 9.928 1.968 5.048
65 HD1 TYR 13 1HD TYR 13 9.890 -1.377 3.367
66 HD2 TYR 13 2HD TYR 13 10.183 0.798 7.012
67 HE1 TYR 13 1HE TYR 13 10.194 -3.486 4.594
68 HE2 TYR 13 2HE TYR 13 10.489 -1.305 8.249
69 HH TYR 13 HH TYR 13 11.467 -3.861 7.320
70 H ILE 14 H ILE 14 6.932 -0.733 3.429
71 HA ILE 14 HA ILE 14 4.981 0.052 5.368
72 HB ILE 14 HB ILE 14 5.332 -2.664 4.097
73 HG12 ILE 14 1HG1 ILE 14 3.393 -0.594 3.128
74 HG13 ILE 14 2HG1 ILE 14 5.068 -0.535 2.588
75 HG21 ILE 14 1HG2 ILE 14 2.683 -2.354 4.480
76 HG22 ILE 14 2HG2 ILE 14 3.758 -3.128 5.642
77 HG23 ILE 14 3HG2 ILE 14 3.309 -1.436 5.849
78 HD11 ILE 14 1HD1 ILE 14 4.043 -3.199 2.331
79 HD12 ILE 14 2HD1 ILE 14 2.981 -2.047 1.520
80 HD13 ILE 14 3HD1 ILE 14 4.691 -2.120 1.096
81 H THR 15 H THR 15 5.081 -0.221 7.488
82 HA THR 15 HA THR 15 6.758 -2.398 8.556
83 HB THR 15 HB THR 15 7.518 -1.051 10.341
84 HG1 THR 15 1HG THR 15 5.570 0.047 10.805
85 HG21 THR 15 1HG2 THR 15 7.927 -0.235 7.658
86 HG22 THR 15 2HG2 THR 15 9.006 -0.030 9.038
87 HG23 THR 15 3HG2 THR 15 7.828 1.222 8.646
88 H PHE 16 H PHE 16 3.709 -1.643 8.082
89 HA PHE 16 HA PHE 16 2.805 -3.096 10.422
90 HB2 PHE 16 1HB PHE 16 2.789 -0.533 10.876
91 HB3 PHE 16 2HB PHE 16 1.390 -0.521 9.808
92 HD1 PHE 16 2HD PHE 16 -0.644 -1.792 10.430
93 HD2 PHE 16 1HD PHE 16 2.641 -1.330 13.097
94 HE1 PHE 16 2HE PHE 16 -2.088 -2.436 12.315
95 HE2 PHE 16 1HE PHE 16 1.202 -1.973 14.987
96 HZ PHE 16 HZ PHE 16 -1.166 -2.526 14.597
97 H THR 17 H THR 17 1.504 -4.624 9.685
98 HA THR 17 HA THR 17 -0.417 -3.975 7.567
99 HB THR 17 HB THR 17 0.120 -6.450 6.768
100 HG1 THR 17 1HG THR 17 2.068 -7.137 7.294
101 HG21 THR 17 1HG2 THR 17 0.693 -5.361 4.907
102 HG22 THR 17 2HG2 THR 17 2.188 -4.785 5.645
103 HG23 THR 17 3HG2 THR 17 0.695 -3.868 5.846
104 H ASP 18 H ASP 18 -2.340 -4.332 8.454
105 HA ASP 18 HA ASP 18 -2.832 -6.895 9.768
106 HB2 ASP 18 1HB ASP 18 -2.331 -4.923 11.423
107 HB3 ASP 18 2HB ASP 18 -3.976 -4.430 11.029
108 H ALA 19 H ALA 19 -5.010 -7.570 9.721
109 HA ALA 19 HA ALA 19 -6.535 -6.361 7.552
110 HB1 ALA 19 1HB ALA 19 -6.653 -8.993 8.974
111 HB2 ALA 19 2HB ALA 19 -8.003 -8.442 7.981
112 HB3 ALA 19 3HB ALA 19 -6.409 -8.660 7.259
113 H VAL 20 H VAL 20 -7.938 -4.812 8.038
114 HA VAL 20 HA VAL 20 -8.983 -4.439 10.675
115 HB VAL 20 HB VAL 20 -9.938 -3.099 8.146
116 HG11 VAL 20 1HG1 VAL 20 -10.330 -2.664 11.049
117 HG12 VAL 20 2HG1 VAL 20 -10.144 -1.231 10.035
118 HG13 VAL 20 3HG1 VAL 20 -11.433 -2.388 9.701
119 HG21 VAL 20 1HG2 VAL 20 -8.239 -1.516 8.305
120 HG22 VAL 20 2HG2 VAL 20 -7.834 -1.973 9.959
121 HG23 VAL 20 3HG2 VAL 20 -7.404 -3.037 8.620
122 H ASN 21 H ASN 21 -10.097 -5.979 7.759
123 HA ASN 21 HA ASN 21 -12.296 -7.178 9.171
124 HB2 ASN 21 1HB ASN 21 -12.732 -4.970 7.224
125 HB3 ASN 21 2HB ASN 21 -13.827 -6.347 7.140
126 HD21 ASN 21 1HD2 ASN 21 -14.734 -3.840 7.770
127 HD22 ASN 21 2HD2 ASN 21 -15.239 -3.806 9.422
128 H GLU 22 H GLU 22 -13.724 -8.367 7.327
129 HA GLU 22 HA GLU 22 -11.968 -10.278 6.191
130 HB2 GLU 22 1HB GLU 22 -13.949 -11.333 5.308
131 HB3 GLU 22 2HB GLU 22 -14.284 -10.775 6.941
132 HG2 GLU 22 1HG GLU 22 -15.171 -8.649 5.656
133 HG3 GLU 22 2HG GLU 22 -15.358 -9.816 4.348
134 H THR 23 H THR 23 -13.397 -7.354 5.005
135 HA THR 23 HA THR 23 -12.204 -7.878 2.361
136 HB THR 23 HB THR 23 -13.960 -6.353 1.413
137 HG1 THR 23 1HG THR 23 -14.968 -5.298 2.977
138 HG21 THR 23 1HG2 THR 23 -15.258 -8.133 0.916
139 HG22 THR 23 2HG2 THR 23 -15.532 -8.537 2.611
140 HG23 THR 23 3HG2 THR 23 -14.038 -9.032 1.816
141 H THR 24 H THR 24 -11.394 -6.406 4.946
142 HA THR 24 HA THR 24 -10.430 -4.002 3.568
143 HB THR 24 HB THR 24 -11.222 -3.771 6.446
144 HG1 THR 24 1HG THR 24 -13.303 -3.321 5.903
145 HG21 THR 24 1HG2 THR 24 -11.301 -1.456 5.993
146 HG22 THR 24 2HG2 THR 24 -11.351 -1.717 4.250
147 HG23 THR 24 3HG2 THR 24 -9.870 -2.044 5.148
148 H ILE 25 H ILE 25 -8.414 -3.262 4.232
149 HA ILE 25 HA ILE 25 -7.043 -4.719 6.362
150 HB ILE 25 HB ILE 25 -6.161 -4.655 3.489
151 HG12 ILE 25 1HG1 ILE 25 -6.435 -6.837 5.565
152 HG13 ILE 25 2HG1 ILE 25 -7.456 -6.593 4.151
153 HG21 ILE 25 1HG2 ILE 25 -4.502 -4.701 5.948
154 HG22 ILE 25 2HG2 ILE 25 -4.036 -5.765 4.622
155 HG23 ILE 25 3HG2 ILE 25 -4.152 -4.025 4.357
156 HD11 ILE 25 1HD1 ILE 25 -6.150 -8.117 3.189
157 HD12 ILE 25 2HD1 ILE 25 -4.972 -6.812 3.041
158 HD13 ILE 25 3HD1 ILE 25 -4.883 -7.932 4.401
159 H MET 26 H MET 26 -5.784 -3.428 7.554
160 HA MET 26 HA MET 26 -5.302 -0.703 6.570
161 HB2 MET 26 1HB MET 26 -6.438 -0.489 8.582
162 HB3 MET 26 2HB MET 26 -5.647 -1.887 9.297
163 HG2 MET 26 1HG MET 26 -3.776 -0.703 9.889
164 HG3 MET 26 2HG MET 26 -4.016 0.511 8.634
165 HE1 MET 26 1HE MET 26 -5.841 3.102 9.630
166 HE2 MET 26 2HE MET 26 -4.379 3.182 10.613
167 HE3 MET 26 3HE MET 26 -4.319 2.471 8.999
168 H LEU 27 H LEU 27 -3.292 0.037 6.237
169 HA LEU 27 HA LEU 27 -1.021 -1.442 7.348
170 HB2 LEU 27 1HB LEU 27 0.049 -1.755 5.324
171 HB3 LEU 27 2HB LEU 27 -1.632 -2.121 4.943
172 HG LEU 27 HG LEU 27 -0.586 0.630 4.440
173 HD11 LEU 27 1HD1 LEU 27 0.112 -0.068 2.190
174 HD12 LEU 27 2HD1 LEU 27 -0.140 -1.752 2.648
175 HD13 LEU 27 3HD1 LEU 27 1.104 -0.796 3.453
176 HD21 LEU 27 1HD2 LEU 27 -2.346 0.794 2.964
177 HD22 LEU 27 2HD2 LEU 27 -3.028 -0.258 4.205
178 HD23 LEU 27 3HD2 LEU 27 -2.426 -0.948 2.697
179 H LYS 28 H LYS 28 0.837 -0.222 7.683
180 HA LYS 28 HA LYS 28 0.577 2.670 7.186
181 HB2 LYS 28 1HB LYS 28 1.859 1.436 9.626
182 HB3 LYS 28 2HB LYS 28 1.559 3.144 9.331
183 HG2 LYS 28 1HG LYS 28 -0.715 2.946 9.715
184 HG3 LYS 28 2HG LYS 28 -0.714 1.205 9.420
185 HD2 LYS 28 1HD LYS 28 0.570 0.878 11.496
186 HD3 LYS 28 2HD LYS 28 0.502 2.616 11.796
187 HE2 LYS 28 1HE LYS 28 -2.049 2.330 11.624
188 HE3 LYS 28 2HE LYS 28 -1.727 0.608 11.825
189 HZ1 LYS 28 1HZ LYS 28 -0.450 2.391 13.735
190 HZ2 LYS 28 2HZ LYS 28 -1.156 0.874 13.976
191 HZ3 LYS 28 3HZ LYS 28 -2.131 2.251 13.860
192 H TRP 29 H TRP 29 2.367 3.730 6.467
193 HA TRP 29 HA TRP 29 4.790 2.100 6.065
194 HB2 TRP 29 1HB TRP 29 5.183 3.543 4.034
195 HB3 TRP 29 2HB TRP 29 3.794 2.465 3.922
196 HD1 TRP 29 HD TRP 29 4.656 6.187 4.352
197 HE1 TRP 29 1HE TRP 29 2.596 7.579 3.685
198 HE3 TRP 29 3HE TRP 29 1.295 2.393 3.681
199 HZ2 TRP 29 2HZ TRP 29 -0.097 7.128 2.969
200 HZ3 TRP 29 3HZ TRP 29 -1.002 2.959 3.006
201 HH2 TRP 29 HH TRP 29 -1.682 5.278 2.658
202 H MET 30 H MET 30 6.819 3.269 6.023
203 HA MET 30 HA MET 30 6.724 5.709 7.672
204 HB2 MET 30 1HB MET 30 8.749 5.062 8.721
205 HB3 MET 30 2HB MET 30 7.730 3.628 8.710
206 HG2 MET 30 1HG MET 30 8.951 2.720 6.843
207 HG3 MET 30 2HG MET 30 9.910 4.193 6.715
208 HE1 MET 30 1HE MET 30 11.267 5.118 8.292
209 HE2 MET 30 2HE MET 30 11.399 4.588 9.969
210 HE3 MET 30 3HE MET 30 12.613 4.092 8.789
211 H TYR 31 H TYR 31 8.621 7.168 7.382
212 HA TYR 31 HA TYR 31 9.643 7.123 4.624
213 HB2 TYR 31 1HB TYR 31 7.721 8.730 4.918
214 HB3 TYR 31 2HB TYR 31 8.730 9.629 6.045
215 HD1 TYR 31 1HD TYR 31 8.294 8.650 2.524
216 HD2 TYR 31 2HD TYR 31 10.529 11.016 5.264
217 HE1 TYR 31 1HE TYR 31 9.274 9.894 0.642
218 HE2 TYR 31 2HE TYR 31 11.514 12.267 3.390
219 HH TYR 31 HH TYR 31 10.316 12.077 0.221
220 H ILE 32 H ILE 32 11.765 7.498 4.428
221 HA ILE 32 HA ILE 32 13.229 8.320 6.846
222 HB ILE 32 HB ILE 32 14.268 6.789 4.459
223 HG12 ILE 32 1HG1 ILE 32 14.476 5.003 6.384
224 HG13 ILE 32 2HG1 ILE 32 13.186 5.948 7.121
225 HG21 ILE 32 1HG2 ILE 32 15.588 8.197 6.575
226 HG22 ILE 32 2HG2 ILE 32 15.926 6.472 6.704
227 HG23 ILE 32 3HG2 ILE 32 16.286 7.331 5.206
228 HD11 ILE 32 1HD1 ILE 32 11.682 5.432 5.432
229 HD12 ILE 32 2HD1 ILE 32 12.956 4.958 4.309
230 HD13 ILE 32 3HD1 ILE 32 12.561 3.925 5.682
231 HA PRO 33 HA PRO 33 13.822 12.015 4.283
232 HB2 PRO 33 1HB PRO 33 14.515 13.603 6.373
233 HB3 PRO 33 2HB PRO 33 12.836 13.236 5.961
234 HG2 PRO 33 1HG PRO 33 14.583 12.009 8.060
235 HG3 PRO 33 2HG PRO 33 12.882 12.500 8.166
236 HD2 PRO 33 1HD PRO 33 13.636 9.924 7.803
237 HD3 PRO 33 2HD PRO 33 12.134 10.585 7.125
238 H ALA 34 H ALA 34 15.931 10.261 6.377
239 HA ALA 34 HA ALA 34 18.283 11.691 6.311
240 HB1 ALA 34 1HB ALA 34 18.183 9.722 7.621
241 HB2 ALA 34 2HB ALA 34 17.821 8.720 6.215
242 HB3 ALA 34 3HB ALA 34 19.420 9.442 6.395
243 H SER 35 H SER 35 17.566 9.015 4.060
244 HA SER 35 HA SER 35 19.462 10.146 2.157
245 HB2 SER 35 1HB SER 35 18.113 7.490 2.470
246 HB3 SER 35 2HB SER 35 18.750 7.951 0.892
247 HG SER 35 HG SER 35 20.160 7.686 3.333
248 H ASN 36 H ASN 36 17.137 11.667 2.528
249 HA ASN 36 HA ASN 36 15.674 11.216 0.012
250 HB2 ASN 36 1HB ASN 36 14.209 11.121 1.952
251 HB3 ASN 36 2HB ASN 36 14.806 12.680 2.514
252 HD21 ASN 36 1HD2 ASN 36 12.852 13.703 2.470
253 HD22 ASN 36 2HD2 ASN 36 12.004 14.066 1.009
254 H ASN 37 H ASN 37 15.076 13.102 -1.227
255 HA ASN 37 HA ASN 37 17.185 15.114 -1.179
256 HB2 ASN 37 1HB ASN 37 15.127 14.292 -3.215
257 HB3 ASN 37 2HB ASN 37 16.027 15.796 -3.386
258 HD21 ASN 37 1HD2 ASN 37 17.814 15.679 -4.523
259 HD22 ASN 37 2HD2 ASN 37 18.764 14.260 -4.788
260 H ASN 38 H ASN 38 15.143 15.182 0.864
261 HA ASN 38 HA ASN 38 13.480 16.523 1.742
262 HB2 ASN 38 1HB ASN 38 15.653 17.685 2.148
263 HB3 ASN 38 2HB ASN 38 15.373 18.635 0.692
264 HD21 ASN 38 1HD2 ASN 38 14.157 17.913 3.902
265 HD22 ASN 38 2HD2 ASN 38 13.300 19.397 4.115
266 H THR 39 H THR 39 12.585 15.703 -0.701
267 HA THR 39 HA THR 39 11.523 18.133 -1.976
268 HB THR 39 HB THR 39 12.759 16.434 -3.399
269 HG1 THR 39 1HG THR 39 10.875 16.449 -4.978
270 HG21 THR 39 1HG2 THR 39 11.670 14.404 -4.017
271 HG22 THR 39 2HG2 THR 39 10.216 14.839 -3.118
272 HG23 THR 39 3HG2 THR 39 11.705 14.453 -2.255
273 HA PRO 40 HA PRO 40 7.544 17.293 -0.272
274 HB2 PRO 40 1HB PRO 40 6.046 18.736 -2.017
275 HB3 PRO 40 2HB PRO 40 7.045 19.481 -0.764
276 HG2 PRO 40 1HG PRO 40 7.630 19.098 -3.675
277 HG3 PRO 40 2HG PRO 40 7.922 20.517 -2.652
278 HD2 PRO 40 1HD PRO 40 9.879 18.762 -3.303
279 HD3 PRO 40 2HD PRO 40 9.851 19.629 -1.754
280 H ILE 41 H ILE 41 6.073 15.711 -0.498
281 HA ILE 41 HA ILE 41 5.935 14.333 -3.086
282 HB ILE 41 HB ILE 41 4.939 13.290 -0.439
283 HG12 ILE 41 1HG1 ILE 41 7.638 12.874 -1.743
284 HG13 ILE 41 2HG1 ILE 41 7.335 13.762 -0.253
285 HG21 ILE 41 1HG2 ILE 41 5.819 11.680 -2.807
286 HG22 ILE 41 2HG2 ILE 41 4.762 11.214 -1.475
287 HG23 ILE 41 3HG2 ILE 41 4.184 12.335 -2.707
288 HD11 ILE 41 1HD1 ILE 41 7.177 11.891 0.979
289 HD12 ILE 41 2HD1 ILE 41 6.372 10.984 -0.302
290 HD13 ILE 41 3HD1 ILE 41 8.122 11.200 -0.340
291 H HIS 42 H HIS 42 4.028 13.992 -4.141
292 HA HIS 42 HA HIS 42 1.888 15.787 -3.619
293 HB2 HIS 42 1HB HIS 42 2.371 13.587 -5.594
294 HB3 HIS 42 2HB HIS 42 0.754 14.267 -5.433
295 HD1 HIS 42 1HD HIS 42 2.394 14.575 -8.037
296 HD2 HIS 42 2HD HIS 42 2.263 17.395 -4.988
297 HE1 HIS 42 1HE HIS 42 3.002 16.763 -9.118
298 HE2 HIS 42 2HE HIS 42 3.000 18.439 -7.237
299 H GLY 43 H GLY 43 2.274 12.280 -3.238
300 HA2 GLY 43 1HA GLY 43 0.508 12.180 -1.020
301 HA3 GLY 43 2HA GLY 43 -0.315 11.627 -2.471
302 H PHE 44 H PHE 44 -0.530 9.501 -1.903
303 HA PHE 44 HA PHE 44 1.894 7.906 -2.080
304 HB2 PHE 44 1HB PHE 44 0.085 7.929 0.328
305 HB3 PHE 44 2HB PHE 44 1.073 6.528 -0.071
306 HD1 PHE 44 2HD PHE 44 3.622 7.186 -0.608
307 HD2 PHE 44 1HD PHE 44 0.945 9.400 1.850
308 HE1 PHE 44 2HE PHE 44 5.536 8.206 0.552
309 HE2 PHE 44 1HE PHE 44 2.855 10.425 3.014
310 HZ PHE 44 HZ PHE 44 5.155 9.827 2.366
311 H TYR 45 H TYR 45 1.534 6.295 -3.445
312 HA TYR 45 HA TYR 45 -1.231 5.525 -4.026
313 HB2 TYR 45 1HB TYR 45 1.340 5.417 -5.540
314 HB3 TYR 45 2HB TYR 45 0.091 4.239 -5.931
315 HD1 TYR 45 2HD TYR 45 -2.375 5.746 -5.706
316 HD2 TYR 45 1HD TYR 45 1.394 6.970 -7.256
317 HE1 TYR 45 2HE TYR 45 -3.504 7.410 -7.123
318 HE2 TYR 45 1HE TYR 45 0.275 8.638 -8.676
319 HH TYR 45 HH TYR 45 -3.175 9.259 -8.409
320 H ILE 46 H ILE 46 -2.013 3.509 -3.700
321 HA ILE 46 HA ILE 46 -0.158 1.492 -2.616
322 HB ILE 46 HB ILE 46 -2.988 2.013 -1.698
323 HG12 ILE 46 1HG1 ILE 46 -0.598 2.154 0.087
324 HG13 ILE 46 2HG1 ILE 46 -0.918 3.509 -0.989
325 HG21 ILE 46 1HG2 ILE 46 -2.724 0.219 -0.166
326 HG22 ILE 46 2HG2 ILE 46 -2.251 -0.390 -1.751
327 HG23 ILE 46 3HG2 ILE 46 -1.016 0.041 -0.568
328 HD11 ILE 46 1HD1 ILE 46 -2.681 2.429 1.187
329 HD12 ILE 46 2HD1 ILE 46 -1.918 4.017 1.088
330 HD13 ILE 46 3HD1 ILE 46 -3.228 3.597 -0.016
331 H TYR 47 H TYR 47 -0.084 -0.274 -3.822
332 HA TYR 47 HA TYR 47 -2.356 -0.885 -5.582
333 HB2 TYR 47 1HB TYR 47 0.503 -1.860 -5.744
334 HB3 TYR 47 2HB TYR 47 -0.771 -2.198 -6.910
335 HD1 TYR 47 2HD TYR 47 0.793 0.781 -5.270
336 HD2 TYR 47 1HD TYR 47 -0.758 -0.941 -8.838
337 HE1 TYR 47 2HE TYR 47 1.395 2.819 -6.508
338 HE2 TYR 47 1HE TYR 47 -0.159 1.092 -10.086
339 HH TYR 47 HH TYR 47 0.694 3.136 -9.977
340 H TYR 48 H TYR 48 -3.414 -2.798 -5.473
341 HA TYR 48 HA TYR 48 -2.362 -4.950 -3.816
342 HB2 TYR 48 1HB TYR 48 -4.619 -5.116 -2.646
343 HB3 TYR 48 2HB TYR 48 -3.572 -3.795 -2.140
344 HD1 TYR 48 1HD TYR 48 -6.655 -4.678 -3.916
345 HD2 TYR 48 2HD TYR 48 -4.149 -1.493 -2.623
346 HE1 TYR 48 1HE TYR 48 -8.463 -3.077 -4.378
347 HE2 TYR 48 2HE TYR 48 -5.951 0.118 -3.080
348 HH TYR 48 HH TYR 48 -8.673 -0.637 -4.897
349 H ARG 49 H ARG 49 -3.215 -6.975 -4.296
350 HA ARG 49 HA ARG 49 -5.443 -7.315 -6.057
351 HB2 ARG 49 1HB ARG 49 -4.302 -8.175 -7.980
352 HB3 ARG 49 2HB ARG 49 -3.637 -6.586 -7.628
353 HG2 ARG 49 1HG ARG 49 -1.704 -7.710 -7.990
354 HG3 ARG 49 2HG ARG 49 -1.886 -8.034 -6.265
355 HD2 ARG 49 1HD ARG 49 -3.140 -10.141 -6.969
356 HD3 ARG 49 2HD ARG 49 -2.502 -9.841 -8.585
357 HE ARG 49 HE ARG 49 -1.089 -10.928 -6.370
358 HH11 ARG 49 1HH1 ARG 49 -0.721 -8.908 -9.181
359 HH12 ARG 49 2HH1 ARG 49 0.966 -9.253 -9.370
360 HH21 ARG 49 1HH2 ARG 49 1.132 -11.391 -6.608
361 HH22 ARG 49 2HH2 ARG 49 2.019 -10.667 -7.906
362 HA PRO 50 HA PRO 50 -5.403 -11.193 -3.971
363 HB2 PRO 50 1HB PRO 50 -7.099 -12.562 -5.590
364 HB3 PRO 50 2HB PRO 50 -7.644 -11.310 -4.468
365 HG2 PRO 50 1HG PRO 50 -7.134 -11.122 -7.412
366 HG3 PRO 50 2HG PRO 50 -8.476 -10.454 -6.463
367 HD2 PRO 50 1HD PRO 50 -6.369 -8.954 -7.265
368 HD3 PRO 50 2HD PRO 50 -7.235 -8.650 -5.745
369 H THR 51 H THR 51 -4.350 -13.131 -4.047
370 HA THR 51 HA THR 51 -2.280 -13.554 -5.827
371 HB THR 51 HB THR 51 -2.800 -14.698 -3.539
372 HG1 THR 51 1HG THR 51 -1.388 -16.452 -4.221
373 HG21 THR 51 1HG2 THR 51 -4.850 -15.830 -4.809
374 HG22 THR 51 2HG2 THR 51 -3.988 -16.647 -3.505
375 HG23 THR 51 3HG2 THR 51 -3.617 -17.032 -5.185
376 H ASP 52 H ASP 52 -5.629 -14.524 -6.060
377 HA ASP 52 HA ASP 52 -5.336 -16.432 -8.127
378 HB2 ASP 52 1HB ASP 52 -7.373 -15.917 -6.578
379 HB3 ASP 52 2HB ASP 52 -7.803 -14.751 -7.827
380 H SER 53 H SER 53 -5.346 -12.979 -8.093
381 HA SER 53 HA SER 53 -6.228 -12.240 -10.567
382 HB2 SER 53 1HB SER 53 -3.892 -11.229 -8.951
383 HB3 SER 53 2HB SER 53 -4.359 -10.479 -10.477
384 HG SER 53 HG SER 53 -5.538 -9.374 -9.058
385 H ASP 54 H ASP 54 -4.746 -11.466 -12.425
386 HA ASP 54 HA ASP 54 -3.347 -13.816 -13.397
387 HB2 ASP 54 1HB ASP 54 -5.016 -12.234 -14.690
388 HB3 ASP 54 2HB ASP 54 -3.559 -11.287 -14.978
389 H ASN 55 H ASN 55 -2.569 -10.340 -13.571
390 HA ASN 55 HA ASN 55 0.106 -10.876 -12.555
391 HB2 ASN 55 1HB ASN 55 -0.297 -9.518 -15.228
392 HB3 ASN 55 2HB ASN 55 1.240 -9.863 -14.441
393 HD21 ASN 55 1HD2 ASN 55 -0.927 -10.897 -16.712
394 HD22 ASN 55 2HD2 ASN 55 -0.411 -12.539 -16.861
395 H ASP 56 H ASP 56 1.361 -8.585 -12.812
396 HA ASP 56 HA ASP 56 0.287 -6.881 -10.938
397 HB2 ASP 56 1HB ASP 56 2.507 -6.428 -11.267
398 HB3 ASP 56 2HB ASP 56 2.398 -6.620 -13.015
399 H SER 57 H SER 57 -0.445 -7.112 -14.308
400 HA SER 57 HA SER 57 -1.422 -4.594 -14.899
401 HB2 SER 57 1HB SER 57 -1.221 -6.692 -16.402
402 HB3 SER 57 2HB SER 57 -2.843 -7.078 -15.830
403 HG SER 57 HG SER 57 -3.545 -5.706 -17.241
404 H ASP 58 H ASP 58 -2.584 -6.816 -12.614
405 HA ASP 58 HA ASP 58 -5.287 -5.718 -12.598
406 HB2 ASP 58 1HB ASP 58 -4.632 -8.216 -12.237
407 HB3 ASP 58 2HB ASP 58 -4.255 -7.701 -10.596
408 H TYR 59 H TYR 59 -2.358 -5.752 -10.647
409 HA TYR 59 HA TYR 59 -3.004 -4.792 -8.250
410 HB2 TYR 59 1HB TYR 59 -0.790 -4.101 -10.108
411 HB3 TYR 59 2HB TYR 59 -0.997 -3.074 -8.693
412 HD1 TYR 59 1HD TYR 59 -1.831 -4.996 -6.643
413 HD2 TYR 59 2HD TYR 59 1.114 -5.368 -9.691
414 HE1 TYR 59 1HE TYR 59 -0.626 -6.641 -5.269
415 HE2 TYR 59 2HE TYR 59 2.327 -7.015 -8.326
416 HH TYR 59 HH TYR 59 1.140 -8.690 -5.978
417 H LYS 60 H LYS 60 -4.318 -3.287 -7.489
418 HA LYS 60 HA LYS 60 -5.376 -1.226 -9.188
419 HB2 LYS 60 1HB LYS 60 -5.822 -2.041 -6.332
420 HB3 LYS 60 2HB LYS 60 -6.489 -0.535 -6.947
421 HG2 LYS 60 1HG LYS 60 -8.257 -1.885 -7.355
422 HG3 LYS 60 2HG LYS 60 -7.371 -2.155 -8.858
423 HD2 LYS 60 1HD LYS 60 -6.243 -4.093 -7.568
424 HD3 LYS 60 2HD LYS 60 -7.602 -3.930 -6.453
425 HE2 LYS 60 1HE LYS 60 -9.029 -4.025 -8.637
426 HE3 LYS 60 2HE LYS 60 -7.585 -4.769 -9.321
427 HZ1 LYS 60 1HZ LYS 60 -8.750 -6.579 -8.561
428 HZ2 LYS 60 2HZ LYS 60 -9.364 -5.774 -7.207
429 HZ3 LYS 60 3HZ LYS 60 -7.747 -6.269 -7.234
430 H LYS 61 H LYS 61 -5.674 0.983 -7.720
431 HA LYS 61 HA LYS 61 -3.092 1.803 -6.655
432 HB2 LYS 61 1HB LYS 61 -3.027 2.203 -9.132
433 HB3 LYS 61 2HB LYS 61 -4.377 3.314 -8.935
434 HG2 LYS 61 1HG LYS 61 -3.096 4.888 -7.836
435 HG3 LYS 61 2HG LYS 61 -1.880 3.707 -7.346
436 HD2 LYS 61 1HD LYS 61 -0.808 4.891 -9.034
437 HD3 LYS 61 2HD LYS 61 -1.426 3.470 -9.880
438 HE2 LYS 61 1HE LYS 61 -3.368 4.778 -10.622
439 HE3 LYS 61 2HE LYS 61 -2.717 6.196 -9.800
440 HZ1 LYS 61 1HZ LYS 61 -1.969 5.028 -12.330
441 HZ2 LYS 61 2HZ LYS 61 -0.654 5.435 -11.347
442 HZ3 LYS 61 3HZ LYS 61 -1.787 6.616 -11.774
443 H ASP 62 H ASP 62 -3.777 2.456 -4.707
444 HA ASP 62 HA ASP 62 -6.103 4.255 -4.580
445 HB2 ASP 62 1HB ASP 62 -4.999 2.217 -2.694
446 HB3 ASP 62 2HB ASP 62 -5.845 3.611 -2.027
447 H MET 63 H MET 63 -5.408 6.300 -4.657
448 HA MET 63 HA MET 63 -2.865 7.136 -3.681
449 HB2 MET 63 1HB MET 63 -4.435 8.175 -5.520
450 HB3 MET 63 2HB MET 63 -5.098 9.068 -4.158
451 HG2 MET 63 1HG MET 63 -2.155 9.019 -4.692
452 HG3 MET 63 2HG MET 63 -3.223 10.139 -5.535
453 HE1 MET 63 1HE MET 63 -4.191 12.752 -3.176
454 HE2 MET 63 2HE MET 63 -4.487 11.870 -4.674
455 HE3 MET 63 3HE MET 63 -5.297 11.378 -3.186
456 H VAL 64 H VAL 64 -2.446 8.607 -1.954
457 HA VAL 64 HA VAL 64 -4.530 8.927 0.064
458 HB VAL 64 HB VAL 64 -1.853 7.755 0.811
459 HG11 VAL 64 1HG1 VAL 64 -4.404 7.933 2.404
460 HG12 VAL 64 2HG1 VAL 64 -2.811 7.434 2.977
461 HG13 VAL 64 3HG1 VAL 64 -3.095 9.110 2.505
462 HG21 VAL 64 1HG2 VAL 64 -4.444 6.428 0.130
463 HG22 VAL 64 2HG2 VAL 64 -2.802 5.976 -0.327
464 HG23 VAL 64 3HG2 VAL 64 -3.364 5.704 1.322
465 H GLU 65 H GLU 65 -4.256 10.698 1.382
466 HA GLU 65 HA GLU 65 -2.998 12.931 0.499
467 HB2 GLU 65 1HB GLU 65 -3.046 12.480 3.454
468 HB3 GLU 65 2HB GLU 65 -3.467 13.920 2.539
469 HG2 GLU 65 1HG GLU 65 -5.093 11.455 3.011
470 HG3 GLU 65 2HG GLU 65 -5.498 13.136 3.354
471 H GLY 66 H GLY 66 -1.026 13.933 0.717
472 HA2 GLY 66 1HA GLY 66 1.255 12.279 0.939
473 HA3 GLY 66 2HA GLY 66 1.264 14.035 0.857
474 H ASP 67 H ASP 67 -0.460 14.226 3.267
475 HA ASP 67 HA ASP 67 1.688 14.090 5.209
476 HB2 ASP 67 1HB ASP 67 -1.060 15.307 5.189
477 HB3 ASP 67 2HB ASP 67 -0.162 15.140 6.695
478 H ARG 68 H ARG 68 -0.782 12.073 4.186
479 HA ARG 68 HA ARG 68 -1.187 10.826 6.793
480 HB2 ARG 68 1HB ARG 68 -3.036 11.253 5.037
481 HB3 ARG 68 2HB ARG 68 -2.362 9.860 4.200
482 HG2 ARG 68 1HG ARG 68 -3.982 8.840 5.431
483 HG3 ARG 68 2HG ARG 68 -2.632 8.732 6.562
484 HD2 ARG 68 1HD ARG 68 -4.475 11.089 6.618
485 HD3 ARG 68 2HD ARG 68 -4.937 9.578 7.400
486 HE ARG 68 HE ARG 68 -2.359 10.272 8.247
487 HH11 ARG 68 1HH1 ARG 68 -5.648 11.374 8.544
488 HH12 ARG 68 2HH1 ARG 68 -5.404 12.093 10.102
489 HH21 ARG 68 1HH2 ARG 68 -2.025 11.214 10.297
490 HH22 ARG 68 2HH2 ARG 68 -3.343 12.002 11.097
491 H TYR 69 H TYR 69 -0.185 9.024 7.432
492 HA TYR 69 HA TYR 69 1.482 7.610 5.458
493 HB2 TYR 69 1HB TYR 69 1.896 8.319 8.324
494 HB3 TYR 69 2HB TYR 69 2.598 6.815 7.738
495 HD1 TYR 69 2HD TYR 69 2.228 9.781 5.600
496 HD2 TYR 69 1HD TYR 69 4.880 7.523 8.043
497 HE1 TYR 69 2HE TYR 69 4.134 11.035 4.680
498 HE2 TYR 69 1HE TYR 69 6.793 8.771 7.131
499 HH TYR 69 HH TYR 69 6.755 11.499 5.825
500 H TRP 70 H TRP 70 -1.414 7.275 6.624
501 HA TRP 70 HA TRP 70 -1.197 4.357 6.852
502 HB2 TRP 70 1HB TRP 70 -2.663 4.242 8.717
503 HB3 TRP 70 2HB TRP 70 -1.465 5.467 9.123
504 HD1 TRP 70 HD TRP 70 -2.325 7.883 9.607
505 HE1 TRP 70 1HE TRP 70 -4.660 8.959 9.728
506 HE3 TRP 70 3HE TRP 70 -5.076 4.082 7.577
507 HZ2 TRP 70 2HZ TRP 70 -7.317 8.285 9.053
508 HZ3 TRP 70 3HZ TRP 70 -7.508 4.377 7.350
509 HH2 TRP 70 HH TRP 70 -8.603 6.436 8.074
510 H HIS 71 H HIS 71 -2.901 3.198 5.983
511 HA HIS 71 HA HIS 71 -5.228 4.597 4.960
512 HB2 HIS 71 1HB HIS 71 -3.580 4.892 3.160
513 HB3 HIS 71 2HB HIS 71 -3.330 3.150 3.100
514 HD1 HIS 71 1HD HIS 71 -6.119 5.667 2.548
515 HD2 HIS 71 2HD HIS 71 -4.973 1.851 1.370
516 HE1 HIS 71 1HE HIS 71 -7.775 4.982 0.783
517 HE2 HIS 71 2HE HIS 71 -7.112 2.637 0.147
518 H SER 72 H SER 72 -6.884 3.142 4.166
519 HA SER 72 HA SER 72 -6.527 0.362 5.071
520 HB2 SER 72 1HB SER 72 -8.860 0.394 5.895
521 HB3 SER 72 2HB SER 72 -7.847 1.562 6.742
522 HG SER 72 HG SER 72 -9.128 3.069 6.063
523 H ILE 73 H ILE 73 -6.636 -0.901 3.342
524 HA ILE 73 HA ILE 73 -7.979 -0.107 0.936
525 HB ILE 73 HB ILE 73 -6.891 -2.846 1.576
526 HG12 ILE 73 1HG1 ILE 73 -5.365 -0.663 0.171
527 HG13 ILE 73 2HG1 ILE 73 -5.282 -0.861 1.918
528 HG21 ILE 73 1HG2 ILE 73 -7.510 -1.388 -0.982
529 HG22 ILE 73 2HG2 ILE 73 -6.533 -2.854 -0.919
530 HG23 ILE 73 3HG2 ILE 73 -8.214 -2.892 -0.389
531 HD11 ILE 73 1HD1 ILE 73 -3.418 -1.938 0.744
532 HD12 ILE 73 2HD1 ILE 73 -4.396 -3.090 1.655
533 HD13 ILE 73 3HD1 ILE 73 -4.568 -2.978 -0.096
534 H SER 74 H SER 74 -9.710 -1.222 -0.088
535 HA SER 74 HA SER 74 -11.326 -2.986 1.590
536 HB2 SER 74 1HB SER 74 -12.579 -0.604 0.222
537 HB3 SER 74 2HB SER 74 -13.315 -1.693 1.398
538 HG SER 74 HG SER 74 -12.517 0.455 2.148
539 H HIS 75 H HIS 75 -13.398 -3.600 0.222
540 HA HIS 75 HA HIS 75 -14.230 -4.714 -1.579
541 HB2 HIS 75 1HB HIS 75 -12.319 -3.096 -3.266
542 HB3 HIS 75 2HB HIS 75 -13.835 -3.836 -3.771
543 HD1 HIS 75 1HD HIS 75 -13.135 -0.761 -4.022
544 HD2 HIS 75 2HD HIS 75 -15.464 -2.502 -1.055
545 HE1 HIS 75 1HE HIS 75 -14.603 1.085 -3.150
546 HE2 HIS 75 2HE HIS 75 -15.943 0.028 -1.298
547 H LEU 76 H LEU 76 -12.330 -6.060 -0.180
548 HA LEU 76 HA LEU 76 -10.708 -7.370 -2.261
549 HB2 LEU 76 1HB LEU 76 -10.214 -7.439 0.707
550 HB3 LEU 76 2HB LEU 76 -9.145 -8.012 -0.572
551 HG LEU 76 HG LEU 76 -9.867 -5.120 -0.494
552 HD11 LEU 76 1HD1 LEU 76 -9.006 -4.793 1.522
553 HD12 LEU 76 2HD1 LEU 76 -7.465 -5.406 0.923
554 HD13 LEU 76 3HD1 LEU 76 -8.616 -6.506 1.682
555 HD21 LEU 76 1HD2 LEU 76 -8.540 -6.175 -2.334
556 HD22 LEU 76 2HD2 LEU 76 -7.283 -6.525 -1.148
557 HD23 LEU 76 3HD2 LEU 76 -7.721 -4.853 -1.501
558 H GLN 77 H GLN 77 -10.080 -9.715 -1.192
559 HA GLN 77 HA GLN 77 -12.678 -11.047 -0.944
560 HB2 GLN 77 1HB GLN 77 -9.962 -12.205 -1.594
561 HB3 GLN 77 2HB GLN 77 -11.480 -13.092 -1.588
562 HG2 GLN 77 1HG GLN 77 -12.216 -12.123 -3.530
563 HG3 GLN 77 2HG GLN 77 -11.220 -10.685 -3.318
564 HE21 GLN 77 1HE2 GLN 77 -10.525 -10.923 -5.483
565 HE22 GLN 77 2HE2 GLN 77 -9.320 -12.085 -5.906
566 HA PRO 78 HA PRO 78 -12.016 -12.011 3.298
567 HB2 PRO 78 1HB PRO 78 -13.609 -14.200 3.499
568 HB3 PRO 78 2HB PRO 78 -14.246 -12.556 3.367
569 HG2 PRO 78 1HG PRO 78 -13.936 -14.644 1.244
570 HG3 PRO 78 2HG PRO 78 -15.296 -13.546 1.543
571 HD2 PRO 78 1HD PRO 78 -13.452 -13.089 -0.386
572 HD3 PRO 78 2HD PRO 78 -14.261 -11.775 0.492
573 H GLU 79 H GLU 79 -10.850 -13.394 4.618
574 HA GLU 79 HA GLU 79 -8.961 -14.696 4.927
575 HB2 GLU 79 1HB GLU 79 -9.701 -17.188 4.353
576 HB3 GLU 79 2HB GLU 79 -10.357 -16.313 5.729
577 HG2 GLU 79 1HG GLU 79 -12.373 -15.851 4.609
578 HG3 GLU 79 2HG GLU 79 -11.703 -16.321 3.048
579 H THR 80 H THR 80 -8.611 -13.395 2.544
580 HA THR 80 HA THR 80 -7.507 -15.487 0.784
581 HB THR 80 HB THR 80 -8.192 -12.688 -0.104
582 HG1 THR 80 1HG THR 80 -10.146 -13.576 0.474
583 HG21 THR 80 1HG2 THR 80 -7.094 -13.383 -1.924
584 HG22 THR 80 2HG2 THR 80 -8.444 -14.483 -2.207
585 HG23 THR 80 3HG2 THR 80 -7.018 -15.041 -1.332
586 H SER 81 H SER 81 -5.391 -15.653 1.155
587 HA SER 81 HA SER 81 -3.824 -13.423 2.084
588 HB2 SER 81 1HB SER 81 -3.567 -16.006 2.583
589 HB3 SER 81 2HB SER 81 -2.570 -15.966 1.129
590 HG SER 81 HG SER 81 -1.172 -15.515 2.729
591 H TYR 82 H TYR 82 -3.245 -11.876 0.712
592 HA TYR 82 HA TYR 82 -2.072 -12.665 -1.862
593 HB2 TYR 82 1HB TYR 82 -3.152 -10.528 -2.797
594 HB3 TYR 82 2HB TYR 82 -4.189 -11.930 -2.566
595 HD1 TYR 82 1HD TYR 82 -3.089 -8.824 -0.812
596 HD2 TYR 82 2HD TYR 82 -6.185 -11.681 -1.412
597 HE1 TYR 82 1HE TYR 82 -4.602 -7.468 0.575
598 HE2 TYR 82 2HE TYR 82 -7.706 -10.332 -0.028
599 HH TYR 82 HH TYR 82 -6.677 -7.222 1.337
600 H ASP 83 H ASP 83 -0.546 -11.167 -2.728
601 HA ASP 83 HA ASP 83 1.063 -9.925 -0.728
602 HB2 ASP 83 1HB ASP 83 1.244 -9.926 -3.745
603 HB3 ASP 83 2HB ASP 83 2.451 -9.193 -2.692
604 H ILE 84 H ILE 84 1.568 -7.732 -0.472
605 HA ILE 84 HA ILE 84 -0.178 -5.808 -1.835
606 HB ILE 84 HB ILE 84 0.242 -5.913 1.154
607 HG12 ILE 84 1HG1 ILE 84 -2.423 -5.986 -0.209
608 HG13 ILE 84 2HG1 ILE 84 -1.469 -7.463 -0.112
609 HG21 ILE 84 1HG2 ILE 84 0.234 -3.626 0.453
610 HG22 ILE 84 2HG2 ILE 84 -1.168 -3.895 -0.581
611 HG23 ILE 84 3HG2 ILE 84 -1.336 -3.982 1.172
612 HD11 ILE 84 1HD1 ILE 84 -3.051 -6.144 1.911
613 HD12 ILE 84 2HD1 ILE 84 -2.401 -7.783 1.871
614 HD13 ILE 84 3HD1 ILE 84 -1.404 -6.454 2.460
615 H LYS 85 H LYS 85 0.785 -3.924 -2.362
616 HA LYS 85 HA LYS 85 3.263 -3.127 -1.060
617 HB2 LYS 85 1HB LYS 85 4.575 -3.041 -3.044
618 HB3 LYS 85 2HB LYS 85 3.863 -4.648 -2.981
619 HG2 LYS 85 1HG LYS 85 2.296 -4.125 -4.669
620 HG3 LYS 85 2HG LYS 85 2.661 -2.401 -4.572
621 HD2 LYS 85 1HD LYS 85 4.738 -2.666 -5.620
622 HD3 LYS 85 2HD LYS 85 4.766 -4.406 -5.321
623 HE2 LYS 85 1HE LYS 85 2.596 -4.351 -6.814
624 HE3 LYS 85 2HE LYS 85 3.311 -2.851 -7.404
625 HZ1 LYS 85 1HZ LYS 85 4.110 -5.578 -7.877
626 HZ2 LYS 85 2HZ LYS 85 5.395 -4.558 -7.467
627 HZ3 LYS 85 3HZ LYS 85 4.412 -4.188 -8.793
628 H MET 86 H MET 86 4.016 -0.965 -1.897
629 HA MET 86 HA MET 86 1.947 0.651 -3.148
630 HB2 MET 86 1HB MET 86 2.020 2.340 -1.332
631 HB3 MET 86 2HB MET 86 1.322 0.809 -0.819
632 HG2 MET 86 1HG MET 86 3.279 0.214 0.373
633 HG3 MET 86 2HG MET 86 4.195 1.539 -0.342
634 HE1 MET 86 1HE MET 86 3.065 4.644 1.150
635 HE2 MET 86 2HE MET 86 3.036 3.817 -0.408
636 HE3 MET 86 3HE MET 86 1.531 4.106 0.466
637 H GLN 87 H GLN 87 2.807 3.061 -3.162
638 HA GLN 87 HA GLN 87 5.634 3.412 -3.204
639 HB2 GLN 87 1HB GLN 87 5.565 2.146 -5.233
640 HB3 GLN 87 2HB GLN 87 4.187 3.062 -5.828
641 HG2 GLN 87 1HG GLN 87 5.888 5.074 -5.566
642 HG3 GLN 87 2HG GLN 87 7.061 3.774 -5.768
643 HE21 GLN 87 1HE2 GLN 87 4.220 5.270 -7.222
644 HE22 GLN 87 2HE2 GLN 87 4.616 4.863 -8.853
645 H CYS 88 H CYS 88 6.192 5.549 -3.260
646 HA CYS 88 HA CYS 88 3.973 7.439 -3.187
647 HB2 CYS 88 1HB CYS 88 5.416 8.914 -2.038
648 HB3 CYS 88 2HB CYS 88 5.800 7.318 -1.405
649 HG CYS 88 HG CYS 88 7.651 9.182 -3.588
650 H PHE 89 H PHE 89 4.207 9.554 -4.240
651 HA PHE 89 HA PHE 89 5.987 9.661 -6.537
652 HB2 PHE 89 1HB PHE 89 4.280 9.902 -8.180
653 HB3 PHE 89 2HB PHE 89 3.871 8.464 -7.250
654 HD1 PHE 89 1HD PHE 89 2.191 8.781 -5.317
655 HD2 PHE 89 2HD PHE 89 2.706 11.563 -8.496
656 HE1 PHE 89 1HE PHE 89 -0.041 9.711 -4.859
657 HE2 PHE 89 2HE PHE 89 0.476 12.499 -8.043
658 HZ PHE 89 HZ PHE 89 -0.900 11.573 -6.222
659 H ASN 90 H ASN 90 5.855 11.783 -7.657
660 HA ASN 90 HA ASN 90 4.531 13.963 -6.355
661 HB2 ASN 90 1HB ASN 90 6.299 15.034 -5.302
662 HB3 ASN 90 2HB ASN 90 6.652 13.345 -4.950
663 HD21 ASN 90 1HD2 ASN 90 8.521 15.470 -4.945
664 HD22 ASN 90 2HD2 ASN 90 9.690 15.144 -6.175
665 H GLU 91 H GLU 91 5.351 16.113 -7.304
666 HA GLU 91 HA GLU 91 4.911 16.287 -9.954
667 HB2 GLU 91 1HB GLU 91 6.130 18.404 -9.974
668 HB3 GLU 91 2HB GLU 91 5.182 18.243 -8.502
669 HG2 GLU 91 1HG GLU 91 7.361 17.353 -7.459
670 HG3 GLU 91 2HG GLU 91 8.145 18.084 -8.858
671 H GLY 92 H GLY 92 7.985 15.465 -8.444
672 HA2 GLY 92 1HA GLY 92 9.555 15.562 -10.803
673 HA3 GLY 92 2HA GLY 92 9.969 14.708 -9.324
674 H GLY 93 H GLY 93 7.903 12.877 -9.159
675 HA2 GLY 93 1HA GLY 93 7.047 11.453 -11.286
676 HA3 GLY 93 2HA GLY 93 8.742 10.997 -11.193
677 H GLU 94 H GLU 94 7.493 8.867 -10.933
678 HA GLU 94 HA GLU 94 6.489 8.412 -8.246
679 HB2 GLU 94 1HB GLU 94 6.663 6.728 -10.731
680 HB3 GLU 94 2HB GLU 94 6.272 6.011 -9.174
681 HG2 GLU 94 1HG GLU 94 4.248 7.120 -9.023
682 HG3 GLU 94 2HG GLU 94 4.726 8.359 -10.183
683 H SER 95 H SER 95 7.475 7.211 -6.679
684 HA SER 95 HA SER 95 10.334 6.921 -6.890
685 HB2 SER 95 1HB SER 95 10.298 6.435 -4.549
686 HB3 SER 95 2HB SER 95 9.112 7.712 -4.816
687 HG SER 95 HG SER 95 8.752 5.213 -3.846
688 H GLU 96 H GLU 96 11.085 4.763 -5.572
689 HA GLU 96 HA GLU 96 10.719 2.659 -7.434
690 HB2 GLU 96 1HB GLU 96 11.923 2.556 -4.663
691 HB3 GLU 96 2HB GLU 96 12.108 1.332 -5.911
692 HG2 GLU 96 1HG GLU 96 13.292 2.924 -7.319
693 HG3 GLU 96 2HG GLU 96 13.083 4.174 -6.094
694 H PHE 97 H PHE 97 10.012 0.450 -6.852
695 HA PHE 97 HA PHE 97 7.388 0.538 -5.698
696 HB2 PHE 97 1HB PHE 97 9.048 -1.515 -7.088
697 HB3 PHE 97 2HB PHE 97 7.693 -2.067 -6.109
698 HD1 PHE 97 1HD PHE 97 8.269 0.736 -8.510
699 HD2 PHE 97 2HD PHE 97 5.836 -2.558 -7.349
700 HE1 PHE 97 1HE PHE 97 6.736 1.217 -10.373
701 HE2 PHE 97 2HE PHE 97 4.299 -2.083 -9.211
702 HZ PHE 97 HZ PHE 97 4.748 -0.194 -10.726
703 H SER 98 H SER 98 7.044 0.489 -3.585
704 HA SER 98 HA SER 98 8.888 -0.107 -1.612
705 HB2 SER 98 1HB SER 98 7.136 0.081 -0.073
706 HB3 SER 98 2HB SER 98 6.547 1.014 -1.449
707 HG SER 98 HG SER 98 5.216 -0.807 -0.332
708 H ASN 99 H ASN 99 8.714 -1.892 0.027
709 HA ASN 99 HA ASN 99 9.267 -4.358 -1.142
710 HB2 ASN 99 1HB ASN 99 8.835 -5.228 1.265
711 HB3 ASN 99 2HB ASN 99 10.142 -4.076 1.005
712 HD21 ASN 99 1HD2 ASN 99 7.936 -4.823 3.144
713 HD22 ASN 99 2HD2 ASN 99 7.494 -3.265 3.747
714 H VAL 100 H VAL 100 8.051 -6.432 -0.348
715 HA VAL 100 HA VAL 100 5.215 -6.075 -1.058
716 HB VAL 100 HB VAL 100 6.908 -8.557 -1.376
717 HG11 VAL 100 1HG1 VAL 100 5.034 -9.430 -2.652
718 HG12 VAL 100 2HG1 VAL 100 4.516 -8.998 -1.021
719 HG13 VAL 100 3HG1 VAL 100 4.130 -7.940 -2.378
720 HG21 VAL 100 1HG2 VAL 100 7.763 -7.197 -3.019
721 HG22 VAL 100 2HG2 VAL 100 6.412 -7.938 -3.876
722 HG23 VAL 100 3HG2 VAL 100 6.254 -6.308 -3.222
723 H MET 101 H MET 101 3.928 -6.188 0.657
724 HA MET 101 HA MET 101 4.646 -8.013 2.850
725 HB2 MET 101 1HB MET 101 2.748 -5.659 2.876
726 HB3 MET 101 2HB MET 101 3.175 -6.654 4.262
727 HG2 MET 101 1HG MET 101 5.221 -5.115 2.699
728 HG3 MET 101 2HG MET 101 4.330 -4.412 4.047
729 HE1 MET 101 1HE MET 101 4.220 -5.789 6.459
730 HE2 MET 101 2HE MET 101 5.842 -5.850 7.149
731 HE3 MET 101 3HE MET 101 5.277 -4.381 6.352
732 H ILE 102 H ILE 102 3.389 -9.713 3.309
733 HA ILE 102 HA ILE 102 0.948 -10.069 1.722
734 HB ILE 102 HB ILE 102 2.642 -12.076 3.209
735 HG12 ILE 102 1HG1 ILE 102 2.072 -11.842 0.251
736 HG13 ILE 102 2HG1 ILE 102 3.494 -11.149 1.023
737 HG21 ILE 102 1HG2 ILE 102 0.869 -13.409 3.281
738 HG22 ILE 102 2HG2 ILE 102 -0.114 -12.211 2.441
739 HG23 ILE 102 3HG2 ILE 102 0.823 -13.386 1.518
740 HD11 ILE 102 1HD1 ILE 102 4.550 -13.083 0.890
741 HD12 ILE 102 2HD1 ILE 102 3.249 -13.900 1.756
742 HD13 ILE 102 3HD1 ILE 102 3.173 -13.735 0.002
743 H CYS 103 H CYS 103 -0.705 -9.158 2.822
744 HA CYS 103 HA CYS 103 -1.037 -9.881 5.654
745 HB2 CYS 103 1HB CYS 103 -0.923 -7.434 5.030
746 HB3 CYS 103 2HB CYS 103 -2.444 -7.655 4.174
747 HG CYS 103 HG CYS 103 -2.690 -6.397 6.776
748 H GLU 104 H GLU 104 -2.369 -11.532 5.959
749 HA GLU 104 HA GLU 104 -4.335 -12.275 3.991
750 HB2 GLU 104 1HB GLU 104 -2.924 -13.828 5.517
751 HB3 GLU 104 2HB GLU 104 -4.137 -13.472 6.739
752 HG2 GLU 104 1HG GLU 104 -5.790 -14.173 4.812
753 HG3 GLU 104 2HG GLU 104 -4.371 -15.043 4.232
754 H THR 105 H THR 105 -6.405 -11.702 3.941
755 HA THR 105 HA THR 105 -7.470 -9.808 5.750
756 HB THR 105 HB THR 105 -9.661 -10.300 4.572
757 HG1 THR 105 1HG THR 105 -9.043 -11.544 2.490
758 HG21 THR 105 1HG2 THR 105 -8.080 -8.533 3.850
759 HG22 THR 105 2HG2 THR 105 -8.980 -9.235 2.505
760 HG23 THR 105 3HG2 THR 105 -7.302 -9.702 2.784
761 H LYS 106 H LYS 106 -9.857 -10.300 6.579
762 HA LYS 106 HA LYS 106 -9.546 -12.492 8.476
763 HB2 LYS 106 1HB LYS 106 -11.393 -10.120 8.322
764 HB3 LYS 106 2HB LYS 106 -11.668 -11.430 9.463
765 HG2 LYS 106 1HG LYS 106 -9.135 -10.940 10.064
766 HG3 LYS 106 2HG LYS 106 -9.559 -9.348 9.430
767 HD2 LYS 106 1HD LYS 106 -11.635 -9.584 10.986
768 HD3 LYS 106 2HD LYS 106 -10.652 -10.799 11.808
769 HE2 LYS 106 1HE LYS 106 -8.827 -8.927 11.751
770 HE3 LYS 106 2HE LYS 106 -10.212 -7.856 11.542
771 HZ1 LYS 106 1HZ LYS 106 -10.634 -7.994 13.696
772 HZ2 LYS 106 2HZ LYS 106 -9.243 -8.932 13.910
773 HZ3 LYS 106 3HZ LYS 106 -10.733 -9.681 13.626
774 H ALA 107 H ALA 107 -11.230 -14.017 8.877
775 HA ALA 107 HA ALA 107 -12.379 -15.088 6.515
776 HB1 ALA 107 1HB ALA 107 -13.531 -16.059 9.013
777 HB2 ALA 107 2HB ALA 107 -12.668 -16.931 7.746
778 HB3 ALA 107 3HB ALA 107 -11.768 -16.075 8.997
779 H ARG 108 H ARG 108 -14.402 -14.962 5.697
780 HA ARG 108 HA ARG 108 -16.096 -12.835 6.613
781 HB2 ARG 108 1HB ARG 108 -17.575 -13.575 4.732
782 HB3 ARG 108 2HB ARG 108 -15.930 -13.183 4.250
783 HG2 ARG 108 1HG ARG 108 -15.414 -15.345 3.737
784 HG3 ARG 108 2HG ARG 108 -16.566 -16.011 4.897
785 HD2 ARG 108 1HD ARG 108 -18.384 -15.081 3.373
786 HD3 ARG 108 2HD ARG 108 -17.108 -14.853 2.178
787 HE ARG 108 HE ARG 108 -16.805 -17.435 2.848
788 HH11 ARG 108 1HH1 ARG 108 -19.599 -15.567 1.939
789 HH12 ARG 108 2HH1 ARG 108 -20.422 -16.909 1.215
790 HH21 ARG 108 1HH2 ARG 108 -17.878 -19.209 1.898
791 HH22 ARG 108 2HH2 ARG 108 -19.443 -18.980 1.192
792 H SER 109 H SER 109 -15.636 -15.688 7.954
793 HA SER 109 HA SER 109 -17.998 -17.066 8.154
794 HB2 SER 109 1HB SER 109 -15.725 -17.546 9.269
795 HB3 SER 109 2HB SER 109 -16.306 -16.531 10.589
796 HG SER 109 HG SER 109 -18.212 -17.992 10.536
797 H GLY 110 H GLY 110 -19.987 -16.430 8.634
798 HA2 GLY 110 1HA GLY 110 -21.431 -15.652 10.478
799 HA3 GLY 110 2HA GLY 110 -20.318 -14.303 10.660
800 HA PRO 111 HA PRO 111 -23.902 -13.446 7.610
801 HB2 PRO 111 1HB PRO 111 -25.563 -12.070 9.259
802 HB3 PRO 111 2HB PRO 111 -25.678 -13.818 9.020
803 HG2 PRO 111 1HG PRO 111 -24.394 -12.292 11.252
804 HG3 PRO 111 2HG PRO 111 -25.413 -13.741 11.329
805 HD2 PRO 111 1HD PRO 111 -22.713 -13.846 11.512
806 HD3 PRO 111 2HD PRO 111 -23.672 -15.147 10.776
807 H SER 112 H SER 112 -24.940 -11.090 7.404
808 HA SER 112 HA SER 112 -22.695 -9.308 7.206
809 HB2 SER 112 1HB SER 112 -24.410 -7.729 6.244
810 HB3 SER 112 2HB SER 112 -24.287 -9.277 5.408
811 HG SER 112 HG SER 112 -26.300 -9.605 5.866
812 H SER 113 H SER 113 -25.866 -9.069 8.824
813 HA SER 113 HA SER 113 -24.805 -8.025 11.222
814 HB2 SER 113 1HB SER 113 -24.613 -6.090 9.443
815 HB3 SER 113 2HB SER 113 -26.335 -5.898 9.772
816 HG SER 113 HG SER 113 -25.812 -4.942 11.555
817 H GLY 114 H GLY 114 -26.586 -7.144 12.660
818 HA2 GLY 114 1HA GLY 114 -28.879 -8.896 12.390
819 HA3 GLY 114 2HA GLY 114 -28.493 -7.884 13.774
Start of MODEL 16
1 H1 GLY 1 H GLY 1 26.516 19.300 -11.982
2 HA2 GLY 1 1HA GLY 1 26.810 17.035 -10.391
3 HA3 GLY 1 2HA GLY 1 25.264 17.754 -9.966
4 H SER 2 H SER 2 23.581 16.988 -11.040
5 HA SER 2 HA SER 2 23.979 16.061 -13.806
6 HB2 SER 2 1HB SER 2 22.465 14.186 -13.391
7 HB3 SER 2 2HB SER 2 23.833 14.120 -12.281
8 HG SER 2 HG SER 2 21.559 15.491 -11.436
9 H SER 3 H SER 3 22.393 16.562 -15.250
10 HA SER 3 HA SER 3 20.286 18.356 -14.268
11 HB2 SER 3 1HB SER 3 21.786 18.126 -16.842
12 HB3 SER 3 2HB SER 3 20.148 18.779 -16.882
13 HG SER 3 HG SER 3 22.367 20.036 -16.221
14 H GLY 4 H GLY 4 18.185 17.848 -14.436
15 HA2 GLY 4 1HA GLY 4 16.710 16.582 -16.236
16 HA3 GLY 4 2HA GLY 4 17.516 15.209 -15.490
17 H SER 5 H SER 5 14.914 15.069 -15.336
18 HA SER 5 HA SER 5 13.513 16.427 -13.381
19 HB2 SER 5 1HB SER 5 13.305 13.629 -14.455
20 HB3 SER 5 2HB SER 5 12.249 14.161 -13.146
21 HG SER 5 HG SER 5 11.083 15.017 -14.659
22 H SER 6 H SER 6 13.386 16.371 -11.206
23 HA SER 6 HA SER 6 15.112 14.439 -9.799
24 HB2 SER 6 1HB SER 6 15.588 16.158 -8.134
25 HB3 SER 6 2HB SER 6 16.021 16.745 -9.740
26 HG SER 6 HG SER 6 14.245 17.753 -7.979
27 H GLY 7 H GLY 7 13.827 12.989 -8.856
28 HA2 GLY 7 1HA GLY 7 11.609 13.995 -7.204
29 HA3 GLY 7 2HA GLY 7 11.311 12.693 -8.347
30 HA PRO 8 HA PRO 8 12.683 11.046 -4.144
31 HB2 PRO 8 1HB PRO 8 10.370 9.763 -3.531
32 HB3 PRO 8 2HB PRO 8 10.683 11.445 -3.085
33 HG2 PRO 8 1HG PRO 8 9.101 10.358 -5.381
34 HG3 PRO 8 2HG PRO 8 8.716 11.706 -4.296
35 HD2 PRO 8 1HD PRO 8 9.722 12.078 -6.783
36 HD3 PRO 8 2HD PRO 8 10.080 13.175 -5.434
37 H VAL 9 H VAL 9 13.425 8.979 -3.853
38 HA VAL 9 HA VAL 9 12.582 6.937 -5.796
39 HB VAL 9 HB VAL 9 14.975 6.162 -5.884
40 HG11 VAL 9 1HG1 VAL 9 15.300 8.752 -7.083
41 HG12 VAL 9 2HG1 VAL 9 15.028 7.189 -7.854
42 HG13 VAL 9 3HG1 VAL 9 13.656 8.166 -7.331
43 HG21 VAL 9 1HG2 VAL 9 16.012 7.160 -4.046
44 HG22 VAL 9 2HG2 VAL 9 16.637 8.065 -5.424
45 HG23 VAL 9 3HG2 VAL 9 15.358 8.754 -4.423
46 H ALA 10 H ALA 10 14.170 7.647 -2.720
47 HA ALA 10 HA ALA 10 14.653 5.200 -1.661
48 HB1 ALA 10 1HB ALA 10 13.219 7.213 0.026
49 HB2 ALA 10 2HB ALA 10 14.569 6.158 0.447
50 HB3 ALA 10 3HB ALA 10 14.833 7.554 -0.599
51 H GLY 11 H GLY 11 11.497 6.702 -2.091
52 HA2 GLY 11 1HA GLY 11 9.372 5.852 -1.934
53 HA3 GLY 11 2HA GLY 11 10.106 4.279 -2.214
54 HA PRO 12 HA PRO 12 8.597 4.991 2.300
55 HB2 PRO 12 1HB PRO 12 6.041 4.090 2.134
56 HB3 PRO 12 2HB PRO 12 6.475 5.791 1.931
57 HG2 PRO 12 1HG PRO 12 5.914 3.717 -0.154
58 HG3 PRO 12 2HG PRO 12 5.382 5.408 -0.086
59 HD2 PRO 12 1HD PRO 12 7.461 4.595 -1.618
60 HD3 PRO 12 2HD PRO 12 7.397 6.204 -0.872
61 H TYR 13 H TYR 13 8.387 3.296 3.794
62 HA TYR 13 HA TYR 13 8.484 0.586 2.639
63 HB2 TYR 13 1HB TYR 13 10.666 0.821 3.356
64 HB3 TYR 13 2HB TYR 13 10.230 1.896 4.679
65 HD1 TYR 13 1HD TYR 13 9.095 -1.548 3.770
66 HD2 TYR 13 2HD TYR 13 10.948 0.960 6.665
67 HE1 TYR 13 1HE TYR 13 9.200 -3.442 5.335
68 HE2 TYR 13 2HE TYR 13 11.058 -0.928 8.238
69 HH TYR 13 HH TYR 13 10.090 -4.180 7.277
70 H ILE 14 H ILE 14 6.888 -0.678 3.299
71 HA ILE 14 HA ILE 14 5.064 0.113 5.334
72 HB ILE 14 HB ILE 14 5.312 -2.607 4.049
73 HG12 ILE 14 1HG1 ILE 14 3.376 -0.499 3.159
74 HG13 ILE 14 2HG1 ILE 14 5.030 -0.466 2.558
75 HG21 ILE 14 1HG2 ILE 14 3.762 -3.078 5.600
76 HG22 ILE 14 2HG2 ILE 14 3.425 -1.378 5.922
77 HG23 ILE 14 3HG2 ILE 14 2.671 -2.181 4.545
78 HD11 ILE 14 1HD1 ILE 14 3.568 -3.033 2.387
79 HD12 ILE 14 2HD1 ILE 14 3.087 -1.734 1.293
80 HD13 ILE 14 3HD1 ILE 14 4.750 -2.321 1.289
81 H THR 15 H THR 15 5.213 -0.177 7.450
82 HA THR 15 HA THR 15 6.944 -2.342 8.457
83 HB THR 15 HB THR 15 7.576 -0.991 10.333
84 HG1 THR 15 1HG THR 15 6.717 1.084 10.639
85 HG21 THR 15 1HG2 THR 15 9.162 -0.159 9.005
86 HG22 THR 15 2HG2 THR 15 8.116 1.231 8.712
87 HG23 THR 15 3HG2 THR 15 8.069 -0.154 7.622
88 H PHE 16 H PHE 16 3.851 -1.622 8.046
89 HA PHE 16 HA PHE 16 3.014 -3.231 10.304
90 HB2 PHE 16 1HB PHE 16 2.984 -0.666 10.884
91 HB3 PHE 16 2HB PHE 16 1.511 -0.670 9.920
92 HD1 PHE 16 1HD PHE 16 3.117 -1.978 12.957
93 HD2 PHE 16 2HD PHE 16 -0.500 -1.647 10.738
94 HE1 PHE 16 1HE PHE 16 1.849 -2.769 14.912
95 HE2 PHE 16 2HE PHE 16 -1.774 -2.436 12.689
96 HZ PHE 16 HZ PHE 16 -0.600 -2.998 14.780
97 H THR 17 H THR 17 1.531 -4.636 9.643
98 HA THR 17 HA THR 17 -0.373 -3.884 7.561
99 HB THR 17 HB THR 17 0.131 -6.327 6.627
100 HG1 THR 17 1HG THR 17 1.991 -7.069 7.285
101 HG21 THR 17 1HG2 THR 17 0.703 -5.192 4.785
102 HG22 THR 17 2HG2 THR 17 2.140 -4.519 5.556
103 HG23 THR 17 3HG2 THR 17 0.575 -3.733 5.767
104 H ASP 18 H ASP 18 -2.259 -4.243 8.533
105 HA ASP 18 HA ASP 18 -2.729 -6.877 9.727
106 HB2 ASP 18 1HB ASP 18 -3.006 -4.228 11.070
107 HB3 ASP 18 2HB ASP 18 -4.202 -5.470 11.432
108 H ALA 19 H ALA 19 -4.887 -7.586 9.654
109 HA ALA 19 HA ALA 19 -6.450 -6.320 7.548
110 HB1 ALA 19 1HB ALA 19 -6.619 -8.989 8.918
111 HB2 ALA 19 2HB ALA 19 -7.868 -8.412 7.814
112 HB3 ALA 19 3HB ALA 19 -6.217 -8.639 7.236
113 H VAL 20 H VAL 20 -7.988 -4.906 8.021
114 HA VAL 20 HA VAL 20 -8.961 -4.563 10.698
115 HB VAL 20 HB VAL 20 -10.016 -3.262 8.188
116 HG11 VAL 20 1HG1 VAL 20 -10.433 -2.881 11.090
117 HG12 VAL 20 2HG1 VAL 20 -10.286 -1.420 10.110
118 HG13 VAL 20 3HG1 VAL 20 -11.533 -2.612 9.739
119 HG21 VAL 20 1HG2 VAL 20 -8.391 -1.611 8.326
120 HG22 VAL 20 2HG2 VAL 20 -7.973 -2.019 9.990
121 HG23 VAL 20 3HG2 VAL 20 -7.479 -3.081 8.672
122 H ASN 21 H ASN 21 -10.031 -6.223 7.853
123 HA ASN 21 HA ASN 21 -12.113 -7.545 9.280
124 HB2 ASN 21 1HB ASN 21 -12.800 -5.292 7.447
125 HB3 ASN 21 2HB ASN 21 -13.838 -6.714 7.441
126 HD21 ASN 21 1HD2 ASN 21 -14.576 -4.096 8.250
127 HD22 ASN 21 2HD2 ASN 21 -15.008 -4.170 9.921
128 H GLU 22 H GLU 22 -13.614 -8.654 7.400
129 HA GLU 22 HA GLU 22 -11.813 -10.405 6.058
130 HB2 GLU 22 1HB GLU 22 -13.823 -11.495 5.196
131 HB3 GLU 22 2HB GLU 22 -13.971 -11.181 6.919
132 HG2 GLU 22 1HG GLU 22 -15.059 -9.180 5.010
133 HG3 GLU 22 2HG GLU 22 -15.943 -10.684 5.263
134 H THR 23 H THR 23 -13.373 -7.468 5.203
135 HA THR 23 HA THR 23 -12.449 -7.797 2.425
136 HB THR 23 HB THR 23 -14.323 -6.223 1.778
137 HG1 THR 23 1HG THR 23 -15.537 -5.492 3.340
138 HG21 THR 23 1HG2 THR 23 -15.900 -8.437 2.692
139 HG22 THR 23 2HG2 THR 23 -14.319 -9.013 2.165
140 HG23 THR 23 3HG2 THR 23 -15.329 -8.077 1.064
141 H THR 24 H THR 24 -11.509 -6.437 5.063
142 HA THR 24 HA THR 24 -10.656 -3.962 3.742
143 HB THR 24 HB THR 24 -11.416 -3.929 6.652
144 HG1 THR 24 1HG THR 24 -13.354 -4.361 5.692
145 HG21 THR 24 1HG2 THR 24 -11.197 -1.739 4.583
146 HG22 THR 24 2HG2 THR 24 -9.958 -2.141 5.772
147 HG23 THR 24 3HG2 THR 24 -11.523 -1.527 6.303
148 H ILE 25 H ILE 25 -8.620 -3.223 4.324
149 HA ILE 25 HA ILE 25 -7.129 -4.735 6.336
150 HB ILE 25 HB ILE 25 -6.380 -4.526 3.431
151 HG12 ILE 25 1HG1 ILE 25 -6.511 -6.805 5.416
152 HG13 ILE 25 2HG1 ILE 25 -7.609 -6.517 4.071
153 HG21 ILE 25 1HG2 ILE 25 -4.336 -3.919 4.201
154 HG22 ILE 25 2HG2 ILE 25 -4.615 -4.599 5.803
155 HG23 ILE 25 3HG2 ILE 25 -4.192 -5.658 4.458
156 HD11 ILE 25 1HD1 ILE 25 -5.371 -6.677 2.682
157 HD12 ILE 25 2HD1 ILE 25 -4.865 -7.626 4.080
158 HD13 ILE 25 3HD1 ILE 25 -6.284 -8.110 3.152
159 H MET 26 H MET 26 -5.717 -3.520 7.464
160 HA MET 26 HA MET 26 -5.333 -0.740 6.573
161 HB2 MET 26 1HB MET 26 -6.446 -0.557 8.597
162 HB3 MET 26 2HB MET 26 -5.666 -1.980 9.274
163 HG2 MET 26 1HG MET 26 -3.732 -0.824 9.811
164 HG3 MET 26 2HG MET 26 -4.078 0.478 8.675
165 HE1 MET 26 1HE MET 26 -5.893 2.910 9.936
166 HE2 MET 26 2HE MET 26 -4.429 2.977 10.917
167 HE3 MET 26 3HE MET 26 -4.351 2.393 9.254
168 H LEU 27 H LEU 27 -3.331 -0.021 6.187
169 HA LEU 27 HA LEU 27 -1.045 -1.488 7.284
170 HB2 LEU 27 1HB LEU 27 -0.007 -1.834 5.254
171 HB3 LEU 27 2HB LEU 27 -1.696 -2.171 4.881
172 HG LEU 27 HG LEU 27 -0.517 0.533 4.350
173 HD11 LEU 27 1HD1 LEU 27 0.312 -1.909 3.128
174 HD12 LEU 27 2HD1 LEU 27 0.821 -0.259 2.772
175 HD13 LEU 27 3HD1 LEU 27 -0.582 -0.945 1.953
176 HD21 LEU 27 1HD2 LEU 27 -2.599 -0.879 2.739
177 HD22 LEU 27 2HD2 LEU 27 -2.345 0.850 2.979
178 HD23 LEU 27 3HD2 LEU 27 -3.035 -0.129 4.275
179 H LYS 28 H LYS 28 0.732 -0.247 7.736
180 HA LYS 28 HA LYS 28 0.515 2.630 7.135
181 HB2 LYS 28 1HB LYS 28 1.666 1.409 9.649
182 HB3 LYS 28 2HB LYS 28 1.493 3.125 9.303
183 HG2 LYS 28 1HG LYS 28 -0.774 3.110 9.658
184 HG3 LYS 28 2HG LYS 28 -0.930 1.392 9.285
185 HD2 LYS 28 1HD LYS 28 0.210 0.844 11.390
186 HD3 LYS 28 2HD LYS 28 0.336 2.565 11.762
187 HE2 LYS 28 1HE LYS 28 -2.247 2.542 11.438
188 HE3 LYS 28 2HE LYS 28 -2.083 0.806 11.697
189 HZ1 LYS 28 1HZ LYS 28 -0.630 1.815 13.718
190 HZ2 LYS 28 2HZ LYS 28 -2.254 1.358 13.844
191 HZ3 LYS 28 3HZ LYS 28 -1.850 2.980 13.582
192 H TRP 29 H TRP 29 2.279 3.611 6.315
193 HA TRP 29 HA TRP 29 4.714 1.974 6.042
194 HB2 TRP 29 1HB TRP 29 5.180 3.363 4.013
195 HB3 TRP 29 2HB TRP 29 3.725 2.379 3.884
196 HD1 TRP 29 HD TRP 29 4.865 6.018 4.156
197 HE1 TRP 29 1HE TRP 29 2.894 7.548 3.526
198 HE3 TRP 29 3HE TRP 29 1.172 2.497 3.843
199 HZ2 TRP 29 2HZ TRP 29 0.137 7.296 2.971
200 HZ3 TRP 29 3HZ TRP 29 -1.105 3.224 3.258
201 HH2 TRP 29 HH TRP 29 -1.609 5.575 2.832
202 H MET 30 H MET 30 6.735 3.337 5.731
203 HA MET 30 HA MET 30 6.653 5.683 7.512
204 HB2 MET 30 1HB MET 30 8.629 5.026 8.592
205 HB3 MET 30 2HB MET 30 7.695 3.541 8.466
206 HG2 MET 30 1HG MET 30 9.018 2.800 6.608
207 HG3 MET 30 2HG MET 30 9.874 4.339 6.554
208 HE1 MET 30 1HE MET 30 11.752 4.269 10.000
209 HE2 MET 30 2HE MET 30 10.850 5.283 8.874
210 HE3 MET 30 3HE MET 30 9.999 4.406 10.147
211 H TYR 31 H TYR 31 8.571 7.135 7.226
212 HA TYR 31 HA TYR 31 9.424 7.193 4.406
213 HB2 TYR 31 1HB TYR 31 7.714 8.930 4.974
214 HB3 TYR 31 2HB TYR 31 8.850 9.605 6.137
215 HD1 TYR 31 1HD TYR 31 8.776 8.605 2.532
216 HD2 TYR 31 2HD TYR 31 10.121 11.398 5.446
217 HE1 TYR 31 1HE TYR 31 9.778 9.972 0.750
218 HE2 TYR 31 2HE TYR 31 11.126 12.773 3.672
219 HH TYR 31 HH TYR 31 11.945 12.518 1.387
220 H ILE 32 H ILE 32 11.509 7.927 3.965
221 HA ILE 32 HA ILE 32 13.274 8.192 6.311
222 HB ILE 32 HB ILE 32 13.981 6.870 3.690
223 HG12 ILE 32 1HG1 ILE 32 12.388 5.559 5.092
224 HG13 ILE 32 2HG1 ILE 32 13.949 4.771 4.889
225 HG21 ILE 32 1HG2 ILE 32 15.868 6.112 5.492
226 HG22 ILE 32 2HG2 ILE 32 16.048 7.443 4.349
227 HG23 ILE 32 3HG2 ILE 32 15.538 7.767 6.006
228 HD11 ILE 32 1HD1 ILE 32 13.280 4.505 7.150
229 HD12 ILE 32 2HD1 ILE 32 14.599 5.676 7.122
230 HD13 ILE 32 3HD1 ILE 32 12.934 6.226 7.314
231 HA PRO 33 HA PRO 33 13.845 12.086 4.038
232 HB2 PRO 33 1HB PRO 33 14.753 13.451 6.202
233 HB3 PRO 33 2HB PRO 33 13.034 13.196 5.879
234 HG2 PRO 33 1HG PRO 33 14.852 11.713 7.738
235 HG3 PRO 33 2HG PRO 33 13.189 12.267 8.005
236 HD2 PRO 33 1HD PRO 33 13.786 9.703 7.372
237 HD3 PRO 33 2HD PRO 33 12.278 10.486 6.859
238 H ALA 34 H ALA 34 15.948 9.894 5.514
239 HA ALA 34 HA ALA 34 18.382 11.367 5.330
240 HB1 ALA 34 1HB ALA 34 18.369 9.559 6.842
241 HB2 ALA 34 2HB ALA 34 17.778 8.436 5.616
242 HB3 ALA 34 3HB ALA 34 19.423 9.063 5.517
243 H SER 35 H SER 35 17.564 8.412 3.523
244 HA SER 35 HA SER 35 19.290 9.181 1.360
245 HB2 SER 35 1HB SER 35 17.596 6.805 2.003
246 HB3 SER 35 2HB SER 35 18.102 7.047 0.331
247 HG SER 35 HG SER 35 19.502 5.846 2.037
248 H ASN 36 H ASN 36 17.546 11.195 1.526
249 HA ASN 36 HA ASN 36 15.773 10.785 -0.790
250 HB2 ASN 36 1HB ASN 36 14.421 11.051 1.220
251 HB3 ASN 36 2HB ASN 36 15.280 12.533 1.629
252 HD21 ASN 36 1HD2 ASN 36 13.638 11.169 -1.210
253 HD22 ASN 36 2HD2 ASN 36 12.727 12.592 -1.575
254 H ASN 37 H ASN 37 15.428 12.659 -2.135
255 HA ASN 37 HA ASN 37 17.844 14.252 -2.373
256 HB2 ASN 37 1HB ASN 37 15.515 13.635 -4.138
257 HB3 ASN 37 2HB ASN 37 16.430 15.108 -4.448
258 HD21 ASN 37 1HD2 ASN 37 16.872 14.011 -6.491
259 HD22 ASN 37 2HD2 ASN 37 18.201 12.910 -6.570
260 H ASN 38 H ASN 38 15.468 14.612 -0.375
261 HA ASN 38 HA ASN 38 14.505 16.349 0.731
262 HB2 ASN 38 1HB ASN 38 16.874 17.226 0.565
263 HB3 ASN 38 2HB ASN 38 16.352 18.151 -0.840
264 HD21 ASN 38 1HD2 ASN 38 16.584 20.158 -0.011
265 HD22 ASN 38 2HD2 ASN 38 15.665 20.767 1.319
266 H THR 39 H THR 39 12.974 15.478 -1.247
267 HA THR 39 HA THR 39 11.918 17.937 -2.482
268 HB THR 39 HB THR 39 12.984 16.204 -4.073
269 HG1 THR 39 1HG THR 39 10.294 16.775 -4.720
270 HG21 THR 39 1HG2 THR 39 11.639 14.336 -4.716
271 HG22 THR 39 2HG2 THR 39 10.323 14.846 -3.659
272 HG23 THR 39 3HG2 THR 39 11.836 14.263 -2.965
273 HA PRO 40 HA PRO 40 8.182 17.002 -0.336
274 HB2 PRO 40 1HB PRO 40 6.476 18.503 -1.820
275 HB3 PRO 40 2HB PRO 40 7.621 19.205 -0.672
276 HG2 PRO 40 1HG PRO 40 7.841 18.943 -3.646
277 HG3 PRO 40 2HG PRO 40 8.255 20.321 -2.610
278 HD2 PRO 40 1HD PRO 40 10.119 18.608 -3.571
279 HD3 PRO 40 2HD PRO 40 10.282 19.411 -1.996
280 H ILE 41 H ILE 41 6.374 15.700 -0.502
281 HA ILE 41 HA ILE 41 6.105 14.239 -3.042
282 HB ILE 41 HB ILE 41 5.104 13.313 -0.355
283 HG12 ILE 41 1HG1 ILE 41 7.737 12.627 -1.680
284 HG13 ILE 41 2HG1 ILE 41 7.557 13.680 -0.281
285 HG21 ILE 41 1HG2 ILE 41 4.841 11.208 -1.353
286 HG22 ILE 41 2HG2 ILE 41 4.233 12.349 -2.551
287 HG23 ILE 41 3HG2 ILE 41 5.838 11.645 -2.740
288 HD11 ILE 41 1HD1 ILE 41 6.511 10.888 -0.191
289 HD12 ILE 41 2HD1 ILE 41 8.229 11.209 0.053
290 HD13 ILE 41 3HD1 ILE 41 7.035 11.935 1.128
291 H HIS 42 H HIS 42 4.133 13.982 -4.011
292 HA HIS 42 HA HIS 42 2.123 15.926 -3.381
293 HB2 HIS 42 1HB HIS 42 2.526 13.881 -5.518
294 HB3 HIS 42 2HB HIS 42 0.903 14.517 -5.267
295 HD1 HIS 42 1HD HIS 42 0.832 15.811 -7.464
296 HD2 HIS 42 2HD HIS 42 4.022 16.872 -5.023
297 HE1 HIS 42 1HE HIS 42 1.797 17.896 -8.487
298 HE2 HIS 42 2HE HIS 42 3.778 18.470 -7.042
299 H GLY 43 H GLY 43 2.401 12.409 -3.132
300 HA2 GLY 43 1HA GLY 43 0.557 12.296 -0.968
301 HA3 GLY 43 2HA GLY 43 -0.202 11.751 -2.456
302 H PHE 44 H PHE 44 -0.448 9.631 -1.798
303 HA PHE 44 HA PHE 44 1.984 8.033 -1.933
304 HB2 PHE 44 1HB PHE 44 0.140 8.130 0.436
305 HB3 PHE 44 2HB PHE 44 1.028 6.658 0.056
306 HD1 PHE 44 2HD PHE 44 3.632 7.333 -0.624
307 HD2 PHE 44 1HD PHE 44 1.079 9.339 2.129
308 HE1 PHE 44 2HE PHE 44 5.603 8.219 0.553
309 HE2 PHE 44 1HE PHE 44 3.046 10.230 3.309
310 HZ PHE 44 HZ PHE 44 5.311 9.669 2.522
311 H TYR 45 H TYR 45 1.661 6.434 -3.320
312 HA TYR 45 HA TYR 45 -1.079 5.669 -3.994
313 HB2 TYR 45 1HB TYR 45 1.542 5.571 -5.394
314 HB3 TYR 45 2HB TYR 45 0.371 4.320 -5.795
315 HD1 TYR 45 2HD TYR 45 -2.170 5.762 -5.681
316 HD2 TYR 45 1HD TYR 45 1.596 7.011 -7.216
317 HE1 TYR 45 2HE TYR 45 -3.314 7.316 -7.206
318 HE2 TYR 45 1HE TYR 45 0.464 8.569 -8.745
319 HH TYR 45 HH TYR 45 -2.408 9.687 -8.434
320 H ILE 46 H ILE 46 -1.842 3.584 -3.871
321 HA ILE 46 HA ILE 46 -0.083 1.583 -2.625
322 HB ILE 46 HB ILE 46 -2.948 2.090 -1.813
323 HG12 ILE 46 1HG1 ILE 46 -0.638 2.385 0.053
324 HG13 ILE 46 2HG1 ILE 46 -0.951 3.684 -1.092
325 HG21 ILE 46 1HG2 ILE 46 -2.263 -0.269 -1.713
326 HG22 ILE 46 2HG2 ILE 46 -0.908 0.182 -0.678
327 HG23 ILE 46 3HG2 ILE 46 -2.563 0.406 -0.111
328 HD11 ILE 46 1HD1 ILE 46 -2.005 4.101 1.062
329 HD12 ILE 46 2HD1 ILE 46 -3.206 3.923 -0.218
330 HD13 ILE 46 3HD1 ILE 46 -2.917 2.599 0.910
331 H TYR 47 H TYR 47 -0.091 -0.306 -3.650
332 HA TYR 47 HA TYR 47 -2.279 -0.851 -5.543
333 HB2 TYR 47 1HB TYR 47 0.569 -1.871 -5.591
334 HB3 TYR 47 2HB TYR 47 -0.672 -2.234 -6.785
335 HD1 TYR 47 2HD TYR 47 0.885 0.773 -5.191
336 HD2 TYR 47 1HD TYR 47 -0.609 -1.028 -8.745
337 HE1 TYR 47 2HE TYR 47 1.541 2.768 -6.470
338 HE2 TYR 47 1HE TYR 47 0.044 0.962 -10.034
339 HH TYR 47 HH TYR 47 0.958 2.980 -9.970
340 H TYR 48 H TYR 48 -3.248 -2.858 -5.585
341 HA TYR 48 HA TYR 48 -2.341 -4.960 -3.812
342 HB2 TYR 48 1HB TYR 48 -4.627 -5.089 -2.713
343 HB3 TYR 48 2HB TYR 48 -3.599 -3.757 -2.199
344 HD1 TYR 48 2HD TYR 48 -4.094 -1.454 -2.936
345 HD2 TYR 48 1HD TYR 48 -6.688 -4.694 -3.870
346 HE1 TYR 48 2HE TYR 48 -5.881 0.144 -3.487
347 HE2 TYR 48 1HE TYR 48 -8.482 -3.106 -4.425
348 HH TYR 48 HH TYR 48 -8.708 -0.186 -3.491
349 H ARG 49 H ARG 49 -3.285 -6.979 -4.248
350 HA ARG 49 HA ARG 49 -5.430 -7.320 -6.083
351 HB2 ARG 49 1HB ARG 49 -4.283 -8.132 -8.001
352 HB3 ARG 49 2HB ARG 49 -3.550 -6.585 -7.598
353 HG2 ARG 49 1HG ARG 49 -1.670 -7.797 -7.968
354 HG3 ARG 49 2HG ARG 49 -1.887 -8.137 -6.249
355 HD2 ARG 49 1HD ARG 49 -3.349 -10.125 -7.192
356 HD3 ARG 49 2HD ARG 49 -2.330 -9.891 -8.612
357 HE ARG 49 HE ARG 49 -0.881 -10.101 -6.129
358 HH11 ARG 49 1HH1 ARG 49 -2.257 -11.824 -8.823
359 HH12 ARG 49 2HH1 ARG 49 -1.220 -13.199 -8.642
360 HH21 ARG 49 1HH2 ARG 49 0.491 -11.906 -5.880
361 HH22 ARG 49 2HH2 ARG 49 0.343 -13.246 -6.967
362 HA PRO 50 HA PRO 50 -5.390 -11.167 -3.925
363 HB2 PRO 50 1HB PRO 50 -7.202 -12.489 -5.455
364 HB3 PRO 50 2HB PRO 50 -7.655 -11.223 -4.309
365 HG2 PRO 50 1HG PRO 50 -7.290 -11.051 -7.275
366 HG3 PRO 50 2HG PRO 50 -8.563 -10.346 -6.262
367 HD2 PRO 50 1HD PRO 50 -6.460 -8.904 -7.171
368 HD3 PRO 50 2HD PRO 50 -7.239 -8.575 -5.610
369 H THR 51 H THR 51 -4.413 -13.145 -4.055
370 HA THR 51 HA THR 51 -2.463 -13.614 -5.980
371 HB THR 51 HB THR 51 -2.802 -14.682 -3.620
372 HG1 THR 51 1HG THR 51 -1.839 -16.479 -5.573
373 HG21 THR 51 1HG2 THR 51 -4.157 -16.703 -5.410
374 HG22 THR 51 2HG2 THR 51 -4.898 -15.816 -4.078
375 HG23 THR 51 3HG2 THR 51 -3.637 -17.005 -3.753
376 H ASP 52 H ASP 52 -5.835 -14.240 -6.082
377 HA ASP 52 HA ASP 52 -5.806 -16.361 -7.981
378 HB2 ASP 52 1HB ASP 52 -7.731 -15.734 -6.455
379 HB3 ASP 52 2HB ASP 52 -8.045 -14.384 -7.541
380 H SER 53 H SER 53 -5.364 -12.968 -8.199
381 HA SER 53 HA SER 53 -6.303 -12.352 -10.727
382 HB2 SER 53 1HB SER 53 -4.074 -11.314 -9.030
383 HB3 SER 53 2HB SER 53 -4.158 -10.789 -10.712
384 HG SER 53 HG SER 53 -6.424 -10.680 -9.038
385 H ASP 54 H ASP 54 -4.616 -11.708 -12.554
386 HA ASP 54 HA ASP 54 -3.284 -14.218 -13.279
387 HB2 ASP 54 1HB ASP 54 -5.066 -12.951 -14.738
388 HB3 ASP 54 2HB ASP 54 -3.687 -11.958 -15.202
389 H ASN 55 H ASN 55 -2.734 -10.702 -13.398
390 HA ASN 55 HA ASN 55 0.035 -11.062 -12.696
391 HB2 ASN 55 1HB ASN 55 0.617 -9.580 -14.823
392 HB3 ASN 55 2HB ASN 55 0.596 -11.339 -14.905
393 HD21 ASN 55 1HD2 ASN 55 -1.168 -12.377 -15.887
394 HD22 ASN 55 2HD2 ASN 55 -2.200 -11.541 -16.992
395 H ASP 56 H ASP 56 1.170 -8.790 -12.892
396 HA ASP 56 HA ASP 56 0.044 -7.071 -11.085
397 HB2 ASP 56 1HB ASP 56 1.981 -6.510 -13.330
398 HB3 ASP 56 2HB ASP 56 1.548 -5.300 -12.126
399 H SER 57 H SER 57 -0.819 -7.489 -14.373
400 HA SER 57 HA SER 57 -1.825 -5.014 -15.097
401 HB2 SER 57 1HB SER 57 -2.916 -7.760 -15.756
402 HB3 SER 57 2HB SER 57 -3.377 -6.273 -16.583
403 HG SER 57 HG SER 57 -0.712 -7.227 -16.403
404 H ASP 58 H ASP 58 -2.868 -7.068 -12.607
405 HA ASP 58 HA ASP 58 -5.562 -5.940 -12.534
406 HB2 ASP 58 1HB ASP 58 -4.199 -8.236 -11.190
407 HB3 ASP 58 2HB ASP 58 -5.601 -7.509 -10.408
408 H TYR 59 H TYR 59 -2.523 -5.877 -10.784
409 HA TYR 59 HA TYR 59 -3.073 -4.811 -8.381
410 HB2 TYR 59 1HB TYR 59 -0.897 -4.300 -10.342
411 HB3 TYR 59 2HB TYR 59 -1.020 -3.198 -8.975
412 HD1 TYR 59 1HD TYR 59 -1.820 -4.939 -6.784
413 HD2 TYR 59 2HD TYR 59 0.938 -5.660 -9.943
414 HE1 TYR 59 1HE TYR 59 -0.629 -6.559 -5.367
415 HE2 TYR 59 2HE TYR 59 2.135 -7.283 -8.535
416 HH TYR 59 HH TYR 59 1.783 -8.666 -6.613
417 H LYS 60 H LYS 60 -4.284 -3.206 -7.652
418 HA LYS 60 HA LYS 60 -5.203 -1.134 -9.464
419 HB2 LYS 60 1HB LYS 60 -6.001 -2.139 -6.781
420 HB3 LYS 60 2HB LYS 60 -6.374 -0.462 -7.155
421 HG2 LYS 60 1HG LYS 60 -7.766 -1.057 -8.948
422 HG3 LYS 60 2HG LYS 60 -7.145 -2.709 -8.988
423 HD2 LYS 60 1HD LYS 60 -8.083 -2.684 -6.491
424 HD3 LYS 60 2HD LYS 60 -9.155 -1.470 -7.193
425 HE2 LYS 60 1HE LYS 60 -10.377 -3.332 -7.656
426 HE3 LYS 60 2HE LYS 60 -9.361 -3.308 -9.097
427 HZ1 LYS 60 1HZ LYS 60 -9.638 -5.434 -7.523
428 HZ2 LYS 60 2HZ LYS 60 -8.275 -4.729 -6.812
429 HZ3 LYS 60 3HZ LYS 60 -8.255 -5.140 -8.453
430 H LYS 61 H LYS 61 -5.537 1.073 -8.034
431 HA LYS 61 HA LYS 61 -3.050 1.769 -6.688
432 HB2 LYS 61 1HB LYS 61 -2.705 2.170 -9.144
433 HB3 LYS 61 2HB LYS 61 -4.011 3.348 -9.079
434 HG2 LYS 61 1HG LYS 61 -2.775 4.794 -7.690
435 HG3 LYS 61 2HG LYS 61 -1.572 3.550 -7.338
436 HD2 LYS 61 1HD LYS 61 -0.565 5.011 -8.901
437 HD3 LYS 61 2HD LYS 61 -1.024 3.569 -9.810
438 HE2 LYS 61 1HE LYS 61 -3.031 4.703 -10.608
439 HE3 LYS 61 2HE LYS 61 -2.605 6.136 -9.674
440 HZ1 LYS 61 1HZ LYS 61 -2.014 6.093 -12.140
441 HZ2 LYS 61 2HZ LYS 61 -0.766 5.037 -11.706
442 HZ3 LYS 61 3HZ LYS 61 -0.816 6.599 -11.058
443 H ASP 62 H ASP 62 -3.595 2.830 -4.911
444 HA ASP 62 HA ASP 62 -5.951 4.598 -4.991
445 HB2 ASP 62 1HB ASP 62 -5.142 2.533 -2.997
446 HB3 ASP 62 2HB ASP 62 -5.925 3.994 -2.401
447 H MET 63 H MET 63 -5.210 6.620 -4.977
448 HA MET 63 HA MET 63 -2.698 7.365 -3.860
449 HB2 MET 63 1HB MET 63 -4.104 8.470 -5.775
450 HB3 MET 63 2HB MET 63 -4.857 9.355 -4.455
451 HG2 MET 63 1HG MET 63 -1.882 9.270 -4.792
452 HG3 MET 63 2HG MET 63 -2.884 10.435 -5.656
453 HE1 MET 63 1HE MET 63 -4.211 12.168 -4.763
454 HE2 MET 63 2HE MET 63 -5.109 11.503 -3.399
455 HE3 MET 63 3HE MET 63 -4.068 12.908 -3.169
456 H VAL 64 H VAL 64 -2.305 8.765 -2.085
457 HA VAL 64 HA VAL 64 -4.489 9.115 -0.169
458 HB VAL 64 HB VAL 64 -1.839 7.956 0.686
459 HG11 VAL 64 1HG1 VAL 64 -4.285 7.687 2.316
460 HG12 VAL 64 2HG1 VAL 64 -2.620 8.002 2.807
461 HG13 VAL 64 3HG1 VAL 64 -3.617 9.313 2.174
462 HG21 VAL 64 1HG2 VAL 64 -2.578 6.057 -0.264
463 HG22 VAL 64 2HG2 VAL 64 -3.645 5.978 1.138
464 HG23 VAL 64 3HG2 VAL 64 -4.237 6.642 -0.384
465 H GLU 65 H GLU 65 -4.265 10.872 1.185
466 HA GLU 65 HA GLU 65 -2.996 13.121 0.362
467 HB2 GLU 65 1HB GLU 65 -3.116 12.657 3.309
468 HB3 GLU 65 2HB GLU 65 -3.550 14.088 2.385
469 HG2 GLU 65 1HG GLU 65 -5.125 11.565 2.757
470 HG3 GLU 65 2HG GLU 65 -5.565 13.212 3.205
471 H GLY 66 H GLY 66 -1.050 14.166 0.717
472 HA2 GLY 66 1HA GLY 66 1.247 12.533 0.934
473 HA3 GLY 66 2HA GLY 66 1.233 14.291 0.937
474 H ASP 67 H ASP 67 -0.601 14.283 3.302
475 HA ASP 67 HA ASP 67 1.497 14.086 5.305
476 HB2 ASP 67 1HB ASP 67 -1.309 15.203 5.393
477 HB3 ASP 67 2HB ASP 67 -0.237 15.158 6.790
478 H ARG 68 H ARG 68 -0.851 12.079 4.075
479 HA ARG 68 HA ARG 68 -1.465 10.752 6.595
480 HB2 ARG 68 1HB ARG 68 -3.106 11.147 4.619
481 HB3 ARG 68 2HB ARG 68 -2.304 9.764 3.887
482 HG2 ARG 68 1HG ARG 68 -4.161 8.851 4.946
483 HG3 ARG 68 2HG ARG 68 -2.834 8.535 6.066
484 HD2 ARG 68 1HD ARG 68 -4.440 9.345 7.498
485 HD3 ARG 68 2HD ARG 68 -3.559 10.821 7.105
486 HE ARG 68 HE ARG 68 -6.242 10.099 6.230
487 HH11 ARG 68 1HH1 ARG 68 -3.550 12.299 6.047
488 HH12 ARG 68 2HH1 ARG 68 -4.484 13.592 5.372
489 HH21 ARG 68 1HH2 ARG 68 -7.483 11.794 5.342
490 HH22 ARG 68 2HH2 ARG 68 -6.721 13.305 4.972
491 H TYR 69 H TYR 69 -0.516 8.938 7.298
492 HA TYR 69 HA TYR 69 1.397 7.608 5.493
493 HB2 TYR 69 1HB TYR 69 1.561 8.355 8.376
494 HB3 TYR 69 2HB TYR 69 2.368 6.879 7.856
495 HD1 TYR 69 2HD TYR 69 1.983 10.181 6.158
496 HD2 TYR 69 1HD TYR 69 4.643 7.320 7.843
497 HE1 TYR 69 2HE TYR 69 3.899 11.510 5.376
498 HE2 TYR 69 1HE TYR 69 6.567 8.642 7.067
499 HH TYR 69 HH TYR 69 6.966 11.146 6.491
500 H TRP 70 H TRP 70 -1.566 7.178 6.443
501 HA TRP 70 HA TRP 70 -1.281 4.272 6.642
502 HB2 TRP 70 1HB TRP 70 -2.685 4.040 8.512
503 HB3 TRP 70 2HB TRP 70 -1.621 5.377 8.941
504 HD1 TRP 70 HD TRP 70 -2.725 7.698 9.412
505 HE1 TRP 70 1HE TRP 70 -5.159 8.527 9.521
506 HE3 TRP 70 3HE TRP 70 -5.058 3.634 7.369
507 HZ2 TRP 70 2HZ TRP 70 -7.729 7.583 8.832
508 HZ3 TRP 70 3HZ TRP 70 -7.507 3.677 7.130
509 HH2 TRP 70 HH TRP 70 -8.813 5.611 7.847
510 H HIS 71 H HIS 71 -3.027 3.093 5.812
511 HA HIS 71 HA HIS 71 -5.314 4.520 4.734
512 HB2 HIS 71 1HB HIS 71 -3.572 4.697 2.968
513 HB3 HIS 71 2HB HIS 71 -3.486 2.939 2.914
514 HD1 HIS 71 1HD HIS 71 -6.234 5.560 2.568
515 HD2 HIS 71 2HD HIS 71 -5.017 1.938 0.936
516 HE1 HIS 71 1HE HIS 71 -7.878 5.065 0.731
517 HE2 HIS 71 2HE HIS 71 -7.172 2.827 -0.185
518 H SER 72 H SER 72 -7.082 3.196 4.299
519 HA SER 72 HA SER 72 -6.775 0.398 5.174
520 HB2 SER 72 1HB SER 72 -9.051 0.506 6.044
521 HB3 SER 72 2HB SER 72 -8.082 1.800 6.748
522 HG SER 72 HG SER 72 -9.790 2.113 4.504
523 H ILE 73 H ILE 73 -6.717 -0.780 3.356
524 HA ILE 73 HA ILE 73 -8.142 -0.089 0.983
525 HB ILE 73 HB ILE 73 -6.956 -2.784 1.634
526 HG12 ILE 73 1HG1 ILE 73 -5.515 -0.545 0.224
527 HG13 ILE 73 2HG1 ILE 73 -5.406 -0.760 1.968
528 HG21 ILE 73 1HG2 ILE 73 -6.805 -3.083 -0.725
529 HG22 ILE 73 2HG2 ILE 73 -8.446 -2.549 -0.364
530 HG23 ILE 73 3HG2 ILE 73 -7.274 -1.409 -1.026
531 HD11 ILE 73 1HD1 ILE 73 -4.576 -2.745 -0.134
532 HD12 ILE 73 2HD1 ILE 73 -3.512 -1.775 0.884
533 HD13 ILE 73 3HD1 ILE 73 -4.525 -3.024 1.606
534 H SER 74 H SER 74 -9.940 -1.067 0.064
535 HA SER 74 HA SER 74 -11.453 -2.938 1.748
536 HB2 SER 74 1HB SER 74 -12.795 -0.628 0.346
537 HB3 SER 74 2HB SER 74 -13.468 -1.697 1.576
538 HG SER 74 HG SER 74 -12.641 -0.470 3.065
539 H HIS 75 H HIS 75 -13.570 -3.533 0.367
540 HA HIS 75 HA HIS 75 -14.375 -4.719 -1.399
541 HB2 HIS 75 1HB HIS 75 -12.541 -2.882 -2.951
542 HB3 HIS 75 2HB HIS 75 -13.754 -3.932 -3.677
543 HD1 HIS 75 1HD HIS 75 -15.212 -2.078 -4.613
544 HD2 HIS 75 2HD HIS 75 -14.557 -1.737 -0.525
545 HE1 HIS 75 1HE HIS 75 -16.796 -0.291 -3.826
546 HE2 HIS 75 2HE HIS 75 -16.322 -0.042 -1.365
547 H LEU 76 H LEU 76 -12.428 -6.001 0.011
548 HA LEU 76 HA LEU 76 -10.790 -7.307 -2.059
549 HB2 LEU 76 1HB LEU 76 -10.298 -7.417 0.903
550 HB3 LEU 76 2HB LEU 76 -9.201 -7.874 -0.398
551 HG LEU 76 HG LEU 76 -10.080 -5.032 -0.185
552 HD11 LEU 76 1HD1 LEU 76 -9.285 -4.834 1.883
553 HD12 LEU 76 2HD1 LEU 76 -7.689 -5.147 1.200
554 HD13 LEU 76 3HD1 LEU 76 -8.636 -6.475 1.872
555 HD21 LEU 76 1HD2 LEU 76 -7.309 -5.914 -0.761
556 HD22 LEU 76 2HD2 LEU 76 -8.251 -4.600 -1.464
557 HD23 LEU 76 3HD2 LEU 76 -8.544 -6.265 -1.970
558 H GLN 77 H GLN 77 -10.166 -9.650 -1.142
559 HA GLN 77 HA GLN 77 -12.733 -11.012 -0.833
560 HB2 GLN 77 1HB GLN 77 -10.015 -12.162 -1.485
561 HB3 GLN 77 2HB GLN 77 -11.546 -13.026 -1.533
562 HG2 GLN 77 1HG GLN 77 -12.298 -11.780 -3.394
563 HG3 GLN 77 2HG GLN 77 -10.983 -10.618 -3.235
564 HE21 GLN 77 1HE2 GLN 77 -10.378 -10.984 -5.387
565 HE22 GLN 77 2HE2 GLN 77 -9.527 -12.412 -5.857
566 HA PRO 78 HA PRO 78 -12.030 -12.009 3.394
567 HB2 PRO 78 1HB PRO 78 -13.594 -14.221 3.585
568 HB3 PRO 78 2HB PRO 78 -14.254 -12.584 3.473
569 HG2 PRO 78 1HG PRO 78 -13.930 -14.647 1.327
570 HG3 PRO 78 2HG PRO 78 -15.302 -13.570 1.646
571 HD2 PRO 78 1HD PRO 78 -13.477 -13.071 -0.291
572 HD3 PRO 78 2HD PRO 78 -14.297 -11.776 0.606
573 H GLU 79 H GLU 79 -10.875 -13.422 4.710
574 HA GLU 79 HA GLU 79 -8.958 -14.695 4.991
575 HB2 GLU 79 1HB GLU 79 -9.620 -17.179 4.481
576 HB3 GLU 79 2HB GLU 79 -10.429 -16.293 5.765
577 HG2 GLU 79 1HG GLU 79 -12.366 -15.983 4.487
578 HG3 GLU 79 2HG GLU 79 -11.546 -16.413 2.987
579 H THR 80 H THR 80 -8.718 -13.363 2.568
580 HA THR 80 HA THR 80 -7.615 -15.415 0.766
581 HB THR 80 HB THR 80 -8.343 -12.559 0.086
582 HG1 THR 80 1HG THR 80 -10.261 -13.588 0.331
583 HG21 THR 80 1HG2 THR 80 -7.899 -13.108 -2.168
584 HG22 THR 80 2HG2 THR 80 -7.793 -14.832 -1.809
585 HG23 THR 80 3HG2 THR 80 -6.526 -13.737 -1.256
586 H SER 81 H SER 81 -5.507 -15.676 1.117
587 HA SER 81 HA SER 81 -3.858 -13.527 2.114
588 HB2 SER 81 1HB SER 81 -3.702 -16.102 2.616
589 HB3 SER 81 2HB SER 81 -2.736 -16.131 1.140
590 HG SER 81 HG SER 81 -2.135 -14.186 3.048
591 H TYR 82 H TYR 82 -3.343 -11.970 0.708
592 HA TYR 82 HA TYR 82 -2.105 -12.781 -1.832
593 HB2 TYR 82 1HB TYR 82 -3.155 -10.689 -2.835
594 HB3 TYR 82 2HB TYR 82 -4.245 -12.034 -2.520
595 HD1 TYR 82 1HD TYR 82 -3.086 -8.778 -1.165
596 HD2 TYR 82 2HD TYR 82 -6.121 -11.760 -1.129
597 HE1 TYR 82 1HE TYR 82 -4.521 -7.292 0.170
598 HE2 TYR 82 2HE TYR 82 -7.565 -10.282 0.204
599 HH TYR 82 HH TYR 82 -6.577 -6.978 1.002
600 H ASP 83 H ASP 83 -0.635 -11.191 -2.731
601 HA ASP 83 HA ASP 83 0.973 -9.975 -0.687
602 HB2 ASP 83 1HB ASP 83 1.199 -10.223 -3.675
603 HB3 ASP 83 2HB ASP 83 2.294 -9.180 -2.772
604 H ILE 84 H ILE 84 1.537 -7.765 -0.527
605 HA ILE 84 HA ILE 84 -0.172 -5.858 -1.945
606 HB ILE 84 HB ILE 84 0.113 -5.931 1.061
607 HG12 ILE 84 1HG1 ILE 84 -2.495 -5.985 -0.400
608 HG13 ILE 84 2HG1 ILE 84 -1.559 -7.471 -0.287
609 HG21 ILE 84 1HG2 ILE 84 0.056 -3.675 0.658
610 HG22 ILE 84 2HG2 ILE 84 -0.875 -3.853 -0.828
611 HG23 ILE 84 3HG2 ILE 84 -1.670 -4.029 0.736
612 HD11 ILE 84 1HD1 ILE 84 -3.033 -5.993 1.791
613 HD12 ILE 84 2HD1 ILE 84 -2.780 -7.726 1.586
614 HD13 ILE 84 3HD1 ILE 84 -1.505 -6.724 2.279
615 H LYS 85 H LYS 85 0.698 -3.804 -2.176
616 HA LYS 85 HA LYS 85 3.180 -3.102 -0.876
617 HB2 LYS 85 1HB LYS 85 4.469 -2.839 -2.931
618 HB3 LYS 85 2HB LYS 85 3.971 -4.513 -2.725
619 HG2 LYS 85 1HG LYS 85 2.328 -4.336 -4.408
620 HG3 LYS 85 2HG LYS 85 2.450 -2.576 -4.443
621 HD2 LYS 85 1HD LYS 85 4.375 -2.597 -5.675
622 HD3 LYS 85 2HD LYS 85 4.903 -4.150 -5.023
623 HE2 LYS 85 1HE LYS 85 2.463 -4.096 -6.720
624 HE3 LYS 85 2HE LYS 85 4.026 -3.894 -7.511
625 HZ1 LYS 85 1HZ LYS 85 4.752 -5.971 -6.474
626 HZ2 LYS 85 2HZ LYS 85 3.402 -6.208 -7.465
627 HZ3 LYS 85 3HZ LYS 85 3.220 -6.172 -5.784
628 H MET 86 H MET 86 3.981 -0.926 -1.738
629 HA MET 86 HA MET 86 1.925 0.725 -2.949
630 HB2 MET 86 1HB MET 86 1.811 2.320 -1.136
631 HB3 MET 86 2HB MET 86 1.371 0.728 -0.532
632 HG2 MET 86 1HG MET 86 3.330 0.500 0.676
633 HG3 MET 86 2HG MET 86 4.180 1.709 -0.284
634 HE1 MET 86 1HE MET 86 2.830 5.010 0.789
635 HE2 MET 86 2HE MET 86 2.910 3.958 -0.624
636 HE3 MET 86 3HE MET 86 1.378 4.184 0.223
637 H GLN 87 H GLN 87 2.725 3.011 -3.237
638 HA GLN 87 HA GLN 87 5.582 3.404 -3.124
639 HB2 GLN 87 1HB GLN 87 5.533 2.161 -5.161
640 HB3 GLN 87 2HB GLN 87 4.143 3.061 -5.752
641 HG2 GLN 87 1HG GLN 87 5.766 5.105 -5.538
642 HG3 GLN 87 2HG GLN 87 7.007 3.856 -5.629
643 HE21 GLN 87 1HE2 GLN 87 4.295 5.319 -7.293
644 HE22 GLN 87 2HE2 GLN 87 4.741 4.799 -8.879
645 H CYS 88 H CYS 88 6.190 5.556 -3.352
646 HA CYS 88 HA CYS 88 3.964 7.452 -3.211
647 HB2 CYS 88 1HB CYS 88 5.389 8.903 -2.033
648 HB3 CYS 88 2HB CYS 88 5.815 7.305 -1.434
649 HG CYS 88 HG CYS 88 7.589 8.968 -3.842
650 H PHE 89 H PHE 89 4.327 9.621 -4.210
651 HA PHE 89 HA PHE 89 6.106 9.748 -6.477
652 HB2 PHE 89 1HB PHE 89 4.426 9.948 -8.185
653 HB3 PHE 89 2HB PHE 89 4.141 8.442 -7.320
654 HD1 PHE 89 1HD PHE 89 2.493 8.733 -5.232
655 HD2 PHE 89 2HD PHE 89 2.599 11.235 -8.673
656 HE1 PHE 89 1HE PHE 89 0.169 9.418 -4.802
657 HE2 PHE 89 2HE PHE 89 0.276 11.925 -8.248
658 HZ PHE 89 HZ PHE 89 -0.942 11.017 -6.310
659 H ASN 90 H ASN 90 5.827 11.851 -7.670
660 HA ASN 90 HA ASN 90 4.382 13.965 -6.391
661 HB2 ASN 90 1HB ASN 90 6.086 15.153 -5.356
662 HB3 ASN 90 2HB ASN 90 6.533 13.491 -4.978
663 HD21 ASN 90 1HD2 ASN 90 8.217 15.832 -5.094
664 HD22 ASN 90 2HD2 ASN 90 9.428 15.510 -6.284
665 H GLU 91 H GLU 91 5.317 16.177 -7.316
666 HA GLU 91 HA GLU 91 4.771 16.329 -9.973
667 HB2 GLU 91 1HB GLU 91 4.985 18.326 -8.651
668 HB3 GLU 91 2HB GLU 91 6.693 18.018 -8.370
669 HG2 GLU 91 1HG GLU 91 6.434 19.765 -10.001
670 HG3 GLU 91 2HG GLU 91 7.129 18.336 -10.765
671 H GLY 92 H GLY 92 7.873 15.540 -8.505
672 HA2 GLY 92 1HA GLY 92 9.410 15.654 -10.886
673 HA3 GLY 92 2HA GLY 92 9.854 14.809 -9.411
674 H GLY 93 H GLY 93 8.321 12.777 -9.069
675 HA2 GLY 93 1HA GLY 93 7.303 11.386 -11.268
676 HA3 GLY 93 2HA GLY 93 9.001 10.958 -11.120
677 H GLU 94 H GLU 94 7.537 8.864 -10.886
678 HA GLU 94 HA GLU 94 6.563 8.434 -8.203
679 HB2 GLU 94 1HB GLU 94 6.737 6.761 -10.685
680 HB3 GLU 94 2HB GLU 94 6.403 6.002 -9.135
681 HG2 GLU 94 1HG GLU 94 4.352 7.027 -8.920
682 HG3 GLU 94 2HG GLU 94 4.775 8.338 -10.020
683 H SER 95 H SER 95 7.466 7.126 -6.636
684 HA SER 95 HA SER 95 10.345 6.837 -6.789
685 HB2 SER 95 1HB SER 95 10.271 6.405 -4.432
686 HB3 SER 95 2HB SER 95 9.141 7.720 -4.752
687 HG SER 95 HG SER 95 7.460 6.143 -4.734
688 H GLU 96 H GLU 96 11.011 4.697 -5.373
689 HA GLU 96 HA GLU 96 10.642 2.550 -7.184
690 HB2 GLU 96 1HB GLU 96 11.829 2.630 -4.407
691 HB3 GLU 96 2HB GLU 96 11.875 1.218 -5.454
692 HG2 GLU 96 1HG GLU 96 13.005 3.873 -6.276
693 HG3 GLU 96 2HG GLU 96 13.944 2.665 -5.400
694 H PHE 97 H PHE 97 9.851 0.383 -6.572
695 HA PHE 97 HA PHE 97 7.222 0.596 -5.404
696 HB2 PHE 97 1HB PHE 97 8.736 -1.555 -6.843
697 HB3 PHE 97 2HB PHE 97 7.276 -1.962 -5.948
698 HD1 PHE 97 1HD PHE 97 8.063 1.055 -7.973
699 HD2 PHE 97 2HD PHE 97 5.684 -2.449 -7.555
700 HE1 PHE 97 1HE PHE 97 6.696 1.758 -9.894
701 HE2 PHE 97 2HE PHE 97 4.313 -1.752 -9.475
702 HZ PHE 97 HZ PHE 97 4.819 0.354 -10.648
703 H SER 98 H SER 98 7.000 0.559 -3.268
704 HA SER 98 HA SER 98 8.789 -0.180 -1.352
705 HB2 SER 98 1HB SER 98 6.639 0.961 -0.894
706 HB3 SER 98 2HB SER 98 5.790 -0.560 -1.165
707 HG SER 98 HG SER 98 6.454 -1.284 0.720
708 H ASN 99 H ASN 99 8.601 -2.046 0.222
709 HA ASN 99 HA ASN 99 9.151 -4.457 -1.124
710 HB2 ASN 99 1HB ASN 99 9.702 -5.313 0.941
711 HB3 ASN 99 2HB ASN 99 9.801 -3.590 1.290
712 HD21 ASN 99 1HD2 ASN 99 7.591 -2.644 1.950
713 HD22 ASN 99 2HD2 ASN 99 6.726 -3.555 3.136
714 H VAL 100 H VAL 100 8.028 -6.568 -0.464
715 HA VAL 100 HA VAL 100 5.163 -6.230 -0.987
716 HB VAL 100 HB VAL 100 6.863 -8.720 -1.196
717 HG11 VAL 100 1HG1 VAL 100 4.861 -9.506 -2.552
718 HG12 VAL 100 2HG1 VAL 100 4.648 -9.416 -0.802
719 HG13 VAL 100 3HG1 VAL 100 3.982 -8.154 -1.839
720 HG21 VAL 100 1HG2 VAL 100 7.432 -8.112 -3.260
721 HG22 VAL 100 2HG2 VAL 100 5.767 -7.702 -3.669
722 HG23 VAL 100 3HG2 VAL 100 6.802 -6.508 -2.885
723 H MET 101 H MET 101 3.805 -6.380 0.662
724 HA MET 101 HA MET 101 4.582 -8.014 2.986
725 HB2 MET 101 1HB MET 101 2.624 -5.713 2.906
726 HB3 MET 101 2HB MET 101 3.148 -6.589 4.338
727 HG2 MET 101 1HG MET 101 5.057 -5.078 2.584
728 HG3 MET 101 2HG MET 101 4.199 -4.327 3.928
729 HE1 MET 101 1HE MET 101 5.570 -6.104 7.035
730 HE2 MET 101 2HE MET 101 5.113 -4.493 6.484
731 HE3 MET 101 3HE MET 101 4.030 -5.859 6.212
732 H ILE 102 H ILE 102 3.482 -9.830 3.277
733 HA ILE 102 HA ILE 102 1.011 -10.268 1.800
734 HB ILE 102 HB ILE 102 2.642 -12.175 3.481
735 HG12 ILE 102 1HG1 ILE 102 2.356 -12.143 0.480
736 HG13 ILE 102 2HG1 ILE 102 3.636 -11.262 1.306
737 HG21 ILE 102 1HG2 ILE 102 0.013 -12.442 2.914
738 HG22 ILE 102 2HG2 ILE 102 0.733 -13.215 1.503
739 HG23 ILE 102 3HG2 ILE 102 1.123 -13.796 3.121
740 HD11 ILE 102 1HD1 ILE 102 4.693 -13.221 0.783
741 HD12 ILE 102 2HD1 ILE 102 4.110 -13.578 2.409
742 HD13 ILE 102 3HD1 ILE 102 3.239 -14.194 1.005
743 H CYS 103 H CYS 103 -0.696 -9.357 2.801
744 HA CYS 103 HA CYS 103 -1.070 -9.924 5.666
745 HB2 CYS 103 1HB CYS 103 -0.952 -7.493 4.803
746 HB3 CYS 103 2HB CYS 103 -2.553 -7.796 4.140
747 HG CYS 103 HG CYS 103 -3.768 -8.265 6.582
748 H GLU 104 H GLU 104 -2.442 -11.523 6.046
749 HA GLU 104 HA GLU 104 -4.380 -12.330 4.058
750 HB2 GLU 104 1HB GLU 104 -2.953 -13.833 5.655
751 HB3 GLU 104 2HB GLU 104 -4.235 -13.502 6.811
752 HG2 GLU 104 1HG GLU 104 -5.761 -14.249 4.789
753 HG3 GLU 104 2HG GLU 104 -4.293 -15.103 4.317
754 H THR 105 H THR 105 -6.441 -11.732 3.992
755 HA THR 105 HA THR 105 -7.508 -9.824 5.782
756 HB THR 105 HB THR 105 -9.725 -10.463 4.607
757 HG1 THR 105 1HG THR 105 -8.940 -11.471 2.449
758 HG21 THR 105 1HG2 THR 105 -9.234 -9.019 2.839
759 HG22 THR 105 2HG2 THR 105 -7.567 -9.582 2.716
760 HG23 THR 105 3HG2 THR 105 -8.058 -8.565 4.071
761 H LYS 106 H LYS 106 -9.928 -10.334 6.570
762 HA LYS 106 HA LYS 106 -9.603 -12.429 8.561
763 HB2 LYS 106 1HB LYS 106 -11.764 -10.342 8.211
764 HB3 LYS 106 2HB LYS 106 -11.650 -11.460 9.564
765 HG2 LYS 106 1HG LYS 106 -9.299 -9.746 8.979
766 HG3 LYS 106 2HG LYS 106 -10.721 -8.993 9.703
767 HD2 LYS 106 1HD LYS 106 -10.507 -10.155 11.662
768 HD3 LYS 106 2HD LYS 106 -9.731 -11.536 10.884
769 HE2 LYS 106 1HE LYS 106 -8.276 -8.944 10.918
770 HE3 LYS 106 2HE LYS 106 -8.385 -9.851 12.426
771 HZ1 LYS 106 1HZ LYS 106 -6.461 -10.245 10.677
772 HZ2 LYS 106 2HZ LYS 106 -7.591 -11.329 10.039
773 HZ3 LYS 106 3HZ LYS 106 -7.069 -11.497 11.639
774 H ALA 107 H ALA 107 -11.173 -14.055 8.949
775 HA ALA 107 HA ALA 107 -12.205 -15.246 6.573
776 HB1 ALA 107 1HB ALA 107 -13.029 -17.005 8.046
777 HB2 ALA 107 2HB ALA 107 -11.359 -16.588 8.433
778 HB3 ALA 107 3HB ALA 107 -12.672 -16.005 9.455
779 H ARG 108 H ARG 108 -14.249 -15.329 5.788
780 HA ARG 108 HA ARG 108 -16.139 -13.397 6.825
781 HB2 ARG 108 1HB ARG 108 -17.479 -14.029 4.819
782 HB3 ARG 108 2HB ARG 108 -15.855 -13.471 4.439
783 HG2 ARG 108 1HG ARG 108 -15.153 -15.540 3.752
784 HG3 ARG 108 2HG ARG 108 -16.332 -16.391 4.753
785 HD2 ARG 108 1HD ARG 108 -18.118 -15.477 3.239
786 HD3 ARG 108 2HD ARG 108 -16.829 -14.903 2.182
787 HE ARG 108 HE ARG 108 -16.310 -17.567 2.558
788 HH11 ARG 108 1HH1 ARG 108 -18.985 -15.691 1.355
789 HH12 ARG 108 2HH1 ARG 108 -19.531 -16.925 0.268
790 HH21 ARG 108 1HH2 ARG 108 -17.019 -19.199 1.130
791 HH22 ARG 108 2HH2 ARG 108 -18.412 -18.920 0.141
792 H SER 109 H SER 109 -15.595 -15.707 8.473
793 HA SER 109 HA SER 109 -18.262 -16.963 8.469
794 HB2 SER 109 1HB SER 109 -15.565 -18.118 9.159
795 HB3 SER 109 2HB SER 109 -17.060 -18.853 9.735
796 HG SER 109 HG SER 109 -17.323 -18.368 7.137
797 H GLY 110 H GLY 110 -18.755 -17.893 10.754
798 HA2 GLY 110 1HA GLY 110 -18.241 -15.709 12.665
799 HA3 GLY 110 2HA GLY 110 -19.656 -16.751 12.678
800 HA PRO 111 HA PRO 111 -16.192 -18.259 15.576
801 HB2 PRO 111 1HB PRO 111 -17.291 -17.493 17.937
802 HB3 PRO 111 2HB PRO 111 -16.184 -16.468 17.016
803 HG2 PRO 111 1HG PRO 111 -19.173 -16.390 17.144
804 HG3 PRO 111 2HG PRO 111 -18.017 -15.046 17.172
805 HD2 PRO 111 1HD PRO 111 -19.373 -15.755 14.938
806 HD3 PRO 111 2HD PRO 111 -17.733 -15.078 14.884
807 H SER 112 H SER 112 -19.515 -18.598 15.052
808 HA SER 112 HA SER 112 -20.575 -20.232 16.903
809 HB2 SER 112 1HB SER 112 -20.672 -20.714 13.915
810 HB3 SER 112 2HB SER 112 -21.788 -21.406 15.093
811 HG SER 112 HG SER 112 -21.447 -18.635 15.083
812 H SER 113 H SER 113 -20.517 -22.385 17.500
813 HA SER 113 HA SER 113 -18.144 -23.684 17.729
814 HB2 SER 113 1HB SER 113 -19.324 -25.560 18.471
815 HB3 SER 113 2HB SER 113 -20.482 -24.255 18.723
816 HG SER 113 HG SER 113 -21.737 -25.475 17.555
817 H GLY 114 H GLY 114 -16.828 -24.895 16.497
818 HA2 GLY 114 1HA GLY 114 -17.082 -26.684 14.613
819 HA3 GLY 114 2HA GLY 114 -17.605 -25.280 13.695
Start of MODEL 17
1 H1 GLY 1 H GLY 1 20.526 14.560 -12.788
2 HA2 GLY 1 1HA GLY 1 21.125 16.381 -11.484
3 HA3 GLY 1 2HA GLY 1 19.475 16.454 -10.884
4 H SER 2 H SER 2 22.237 16.488 -9.598
5 HA SER 2 HA SER 2 22.673 14.179 -8.109
6 HB2 SER 2 1HB SER 2 23.819 15.705 -6.473
7 HB3 SER 2 2HB SER 2 24.335 15.923 -8.145
8 HG SER 2 HG SER 2 23.351 17.742 -6.504
9 H SER 3 H SER 3 21.045 17.143 -6.964
10 HA SER 3 HA SER 3 19.816 15.629 -4.804
11 HB2 SER 3 1HB SER 3 20.849 17.996 -4.602
12 HB3 SER 3 2HB SER 3 19.351 18.553 -5.346
13 HG SER 3 HG SER 3 18.278 18.086 -3.573
14 H GLY 4 H GLY 4 18.221 14.374 -5.680
15 HA2 GLY 4 1HA GLY 4 15.837 14.303 -5.973
16 HA3 GLY 4 2HA GLY 4 15.934 15.848 -6.804
17 H SER 5 H SER 5 17.431 12.628 -7.161
18 HA SER 5 HA SER 5 17.636 12.824 -9.978
19 HB2 SER 5 1HB SER 5 17.772 10.459 -8.101
20 HB3 SER 5 2HB SER 5 18.053 10.329 -9.837
21 HG SER 5 HG SER 5 19.719 11.953 -9.524
22 H SER 6 H SER 6 15.648 13.352 -10.858
23 HA SER 6 HA SER 6 13.581 13.010 -11.746
24 HB2 SER 6 1HB SER 6 14.531 10.167 -11.417
25 HB3 SER 6 2HB SER 6 12.971 10.552 -12.143
26 HG SER 6 HG SER 6 14.430 12.061 -13.477
27 H GLY 7 H GLY 7 13.644 13.580 -9.007
28 HA2 GLY 7 1HA GLY 7 11.908 13.797 -7.453
29 HA3 GLY 7 2HA GLY 7 11.079 12.454 -8.226
30 HA PRO 8 HA PRO 8 12.816 10.982 -4.181
31 HB2 PRO 8 1HB PRO 8 10.530 9.764 -3.370
32 HB3 PRO 8 2HB PRO 8 10.866 11.473 -3.070
33 HG2 PRO 8 1HG PRO 8 9.181 10.220 -5.204
34 HG3 PRO 8 2HG PRO 8 8.847 11.651 -4.211
35 HD2 PRO 8 1HD PRO 8 9.744 11.823 -6.760
36 HD3 PRO 8 2HD PRO 8 10.163 13.019 -5.517
37 H VAL 9 H VAL 9 13.734 9.020 -3.937
38 HA VAL 9 HA VAL 9 12.764 6.820 -5.643
39 HB VAL 9 HB VAL 9 15.117 6.033 -5.796
40 HG11 VAL 9 1HG1 VAL 9 14.377 7.117 -7.718
41 HG12 VAL 9 2HG1 VAL 9 14.307 8.690 -6.921
42 HG13 VAL 9 3HG1 VAL 9 15.868 7.971 -7.320
43 HG21 VAL 9 1HG2 VAL 9 16.882 7.787 -5.328
44 HG22 VAL 9 2HG2 VAL 9 15.652 8.646 -4.401
45 HG23 VAL 9 3HG2 VAL 9 16.151 7.026 -3.914
46 H ALA 10 H ALA 10 14.435 7.707 -2.655
47 HA ALA 10 HA ALA 10 14.997 5.421 -1.402
48 HB1 ALA 10 1HB ALA 10 13.409 6.911 0.454
49 HB2 ALA 10 2HB ALA 10 15.164 6.761 0.358
50 HB3 ALA 10 3HB ALA 10 14.335 8.021 -0.557
51 H GLY 11 H GLY 11 11.740 6.560 -2.083
52 HA2 GLY 11 1HA GLY 11 9.704 5.506 -1.975
53 HA3 GLY 11 2HA GLY 11 10.606 4.002 -2.092
54 HA PRO 12 HA PRO 12 8.818 4.927 2.290
55 HB2 PRO 12 1HB PRO 12 6.309 3.910 2.080
56 HB3 PRO 12 2HB PRO 12 6.683 5.613 1.788
57 HG2 PRO 12 1HG PRO 12 6.293 3.394 -0.183
58 HG3 PRO 12 2HG PRO 12 5.692 5.061 -0.242
59 HD2 PRO 12 1HD PRO 12 7.865 4.245 -1.637
60 HD3 PRO 12 2HD PRO 12 7.705 5.893 -0.997
61 H TYR 13 H TYR 13 8.289 3.269 3.870
62 HA TYR 13 HA TYR 13 8.650 0.519 2.894
63 HB2 TYR 13 1HB TYR 13 10.803 1.001 3.692
64 HB3 TYR 13 2HB TYR 13 10.192 1.945 5.046
65 HD1 TYR 13 1HD TYR 13 10.003 -1.554 3.733
66 HD2 TYR 13 2HD TYR 13 10.295 0.982 7.137
67 HE1 TYR 13 1HE TYR 13 10.182 -3.532 5.183
68 HE2 TYR 13 2HE TYR 13 10.476 -0.989 8.597
69 HH TYR 13 HH TYR 13 10.148 -4.263 7.313
70 H ILE 14 H ILE 14 7.108 -0.794 3.595
71 HA ILE 14 HA ILE 14 5.185 0.089 5.532
72 HB ILE 14 HB ILE 14 5.438 -2.643 4.272
73 HG12 ILE 14 1HG1 ILE 14 3.611 -0.434 3.351
74 HG13 ILE 14 2HG1 ILE 14 5.239 -0.607 2.705
75 HG21 ILE 14 1HG2 ILE 14 2.941 -2.640 4.721
76 HG22 ILE 14 2HG2 ILE 14 3.995 -2.798 6.125
77 HG23 ILE 14 3HG2 ILE 14 3.235 -1.248 5.763
78 HD11 ILE 14 1HD1 ILE 14 2.829 -2.226 2.234
79 HD12 ILE 14 2HD1 ILE 14 4.175 -1.842 1.160
80 HD13 ILE 14 3HD1 ILE 14 4.346 -3.113 2.370
81 H THR 15 H THR 15 5.208 -0.245 7.651
82 HA THR 15 HA THR 15 6.914 -2.398 8.719
83 HB THR 15 HB THR 15 7.747 -1.071 10.413
84 HG1 THR 15 1HG THR 15 5.843 0.984 10.010
85 HG21 THR 15 1HG2 THR 15 8.913 0.439 9.237
86 HG22 THR 15 2HG2 THR 15 7.463 1.351 8.816
87 HG23 THR 15 3HG2 THR 15 7.934 -0.051 7.856
88 H PHE 16 H PHE 16 3.851 -1.683 8.208
89 HA PHE 16 HA PHE 16 2.935 -3.234 10.475
90 HB2 PHE 16 1HB PHE 16 2.894 -0.754 11.130
91 HB3 PHE 16 2HB PHE 16 1.591 -0.587 9.958
92 HD1 PHE 16 2HD PHE 16 -0.576 -1.609 10.351
93 HD2 PHE 16 1HD PHE 16 2.565 -1.921 13.206
94 HE1 PHE 16 2HE PHE 16 -2.199 -2.336 12.052
95 HE2 PHE 16 1HE PHE 16 0.948 -2.650 14.911
96 HZ PHE 16 HZ PHE 16 -1.438 -2.857 14.335
97 H THR 17 H THR 17 1.585 -4.705 9.706
98 HA THR 17 HA THR 17 -0.311 -3.974 7.601
99 HB THR 17 HB THR 17 0.261 -6.406 6.677
100 HG1 THR 17 1HG THR 17 2.669 -5.473 7.876
101 HG21 THR 17 1HG2 THR 17 2.256 -4.490 5.712
102 HG22 THR 17 2HG2 THR 17 0.618 -3.840 5.791
103 HG23 THR 17 3HG2 THR 17 0.946 -5.294 4.848
104 H ASP 18 H ASP 18 -2.227 -4.400 8.471
105 HA ASP 18 HA ASP 18 -2.682 -7.037 9.652
106 HB2 ASP 18 1HB ASP 18 -3.223 -4.399 11.001
107 HB3 ASP 18 2HB ASP 18 -4.110 -5.858 11.435
108 H ALA 19 H ALA 19 -4.936 -7.647 9.726
109 HA ALA 19 HA ALA 19 -6.428 -6.451 7.519
110 HB1 ALA 19 1HB ALA 19 -7.917 -8.510 7.936
111 HB2 ALA 19 2HB ALA 19 -6.313 -8.758 7.244
112 HB3 ALA 19 3HB ALA 19 -6.593 -9.074 8.956
113 H VAL 20 H VAL 20 -7.866 -4.926 7.965
114 HA VAL 20 HA VAL 20 -8.889 -4.509 10.610
115 HB VAL 20 HB VAL 20 -9.810 -3.195 8.052
116 HG11 VAL 20 1HG1 VAL 20 -9.927 -1.412 10.191
117 HG12 VAL 20 2HG1 VAL 20 -11.285 -2.210 9.395
118 HG13 VAL 20 3HG1 VAL 20 -10.552 -2.933 10.827
119 HG21 VAL 20 1HG2 VAL 20 -7.314 -3.079 8.527
120 HG22 VAL 20 2HG2 VAL 20 -8.155 -1.542 8.325
121 HG23 VAL 20 3HG2 VAL 20 -7.738 -2.112 9.941
122 H ASN 21 H ASN 21 -9.983 -6.135 7.748
123 HA ASN 21 HA ASN 21 -12.168 -7.325 9.157
124 HB2 ASN 21 1HB ASN 21 -12.667 -5.095 7.244
125 HB3 ASN 21 2HB ASN 21 -13.766 -6.470 7.204
126 HD21 ASN 21 1HD2 ASN 21 -14.668 -3.982 7.866
127 HD22 ASN 21 2HD2 ASN 21 -15.096 -3.941 9.539
128 H GLU 22 H GLU 22 -13.597 -8.566 7.413
129 HA GLU 22 HA GLU 22 -11.873 -10.415 6.172
130 HB2 GLU 22 1HB GLU 22 -13.941 -11.353 5.175
131 HB3 GLU 22 2HB GLU 22 -14.071 -11.091 6.909
132 HG2 GLU 22 1HG GLU 22 -15.010 -8.941 5.090
133 HG3 GLU 22 2HG GLU 22 -15.992 -10.396 5.248
134 H THR 23 H THR 23 -13.309 -7.469 5.069
135 HA THR 23 HA THR 23 -12.171 -7.947 2.393
136 HB THR 23 HB THR 23 -13.960 -6.403 1.512
137 HG1 THR 23 1HG THR 23 -14.461 -5.902 3.949
138 HG21 THR 23 1HG2 THR 23 -14.963 -8.282 0.859
139 HG22 THR 23 2HG2 THR 23 -15.656 -8.511 2.465
140 HG23 THR 23 3HG2 THR 23 -14.057 -9.156 2.093
141 H THR 24 H THR 24 -11.359 -6.494 5.001
142 HA THR 24 HA THR 24 -10.459 -4.048 3.645
143 HB THR 24 HB THR 24 -11.135 -3.923 6.558
144 HG1 THR 24 1HG THR 24 -13.243 -3.439 6.096
145 HG21 THR 24 1HG2 THR 24 -11.270 -1.595 6.184
146 HG22 THR 24 2HG2 THR 24 -11.376 -1.803 4.436
147 HG23 THR 24 3HG2 THR 24 -9.860 -2.133 5.273
148 H ILE 25 H ILE 25 -8.439 -3.268 4.287
149 HA ILE 25 HA ILE 25 -6.956 -4.763 6.306
150 HB ILE 25 HB ILE 25 -6.178 -4.626 3.403
151 HG12 ILE 25 1HG1 ILE 25 -6.377 -6.874 5.417
152 HG13 ILE 25 2HG1 ILE 25 -7.466 -6.578 4.066
153 HG21 ILE 25 1HG2 ILE 25 -4.023 -5.773 4.436
154 HG22 ILE 25 2HG2 ILE 25 -4.144 -4.026 4.229
155 HG23 ILE 25 3HG2 ILE 25 -4.447 -4.750 5.809
156 HD11 ILE 25 1HD1 ILE 25 -6.211 -8.098 3.019
157 HD12 ILE 25 2HD1 ILE 25 -5.074 -6.767 2.798
158 HD13 ILE 25 3HD1 ILE 25 -4.860 -7.898 4.134
159 H MET 26 H MET 26 -5.582 -3.510 7.428
160 HA MET 26 HA MET 26 -5.162 -0.764 6.456
161 HB2 MET 26 1HB MET 26 -6.276 -0.519 8.471
162 HB3 MET 26 2HB MET 26 -5.514 -1.933 9.186
163 HG2 MET 26 1HG MET 26 -3.615 -0.788 9.772
164 HG3 MET 26 2HG MET 26 -3.839 0.435 8.524
165 HE1 MET 26 1HE MET 26 -4.093 3.077 10.607
166 HE2 MET 26 2HE MET 26 -3.980 2.396 8.984
167 HE3 MET 26 3HE MET 26 -5.505 3.080 9.549
168 H LEU 27 H LEU 27 -3.154 -0.054 6.076
169 HA LEU 27 HA LEU 27 -0.879 -1.514 7.205
170 HB2 LEU 27 1HB LEU 27 0.135 -1.956 5.201
171 HB3 LEU 27 2HB LEU 27 -1.561 -2.190 4.781
172 HG LEU 27 HG LEU 27 -0.171 0.423 4.276
173 HD11 LEU 27 1HD1 LEU 27 0.295 -2.124 2.960
174 HD12 LEU 27 2HD1 LEU 27 1.168 -0.599 2.820
175 HD13 LEU 27 3HD1 LEU 27 -0.278 -0.879 1.850
176 HD21 LEU 27 1HD2 LEU 27 -2.067 1.007 3.254
177 HD22 LEU 27 2HD2 LEU 27 -2.797 -0.376 4.071
178 HD23 LEU 27 3HD2 LEU 27 -2.196 -0.542 2.420
179 H LYS 28 H LYS 28 0.761 -0.235 7.843
180 HA LYS 28 HA LYS 28 0.589 2.624 7.151
181 HB2 LYS 28 1HB LYS 28 1.817 1.426 9.638
182 HB3 LYS 28 2HB LYS 28 1.557 3.133 9.304
183 HG2 LYS 28 1HG LYS 28 -0.681 3.023 9.746
184 HG3 LYS 28 2HG LYS 28 -0.797 1.318 9.305
185 HD2 LYS 28 1HD LYS 28 0.306 0.671 11.354
186 HD3 LYS 28 2HD LYS 28 0.587 2.361 11.776
187 HE2 LYS 28 1HE LYS 28 -2.145 1.142 11.406
188 HE3 LYS 28 2HE LYS 28 -1.337 1.295 12.965
189 HZ1 LYS 28 1HZ LYS 28 -2.291 3.456 11.184
190 HZ2 LYS 28 2HZ LYS 28 -1.188 3.746 12.432
191 HZ3 LYS 28 3HZ LYS 28 -2.730 3.151 12.788
192 H TRP 29 H TRP 29 2.349 3.636 6.344
193 HA TRP 29 HA TRP 29 4.789 2.015 6.028
194 HB2 TRP 29 1HB TRP 29 5.214 3.414 3.989
195 HB3 TRP 29 2HB TRP 29 3.788 2.386 3.878
196 HD1 TRP 29 HD TRP 29 4.805 6.067 4.183
197 HE1 TRP 29 1HE TRP 29 2.789 7.531 3.538
198 HE3 TRP 29 3HE TRP 29 1.252 2.415 3.769
199 HZ2 TRP 29 2HZ TRP 29 0.054 7.183 2.933
200 HZ3 TRP 29 3HZ TRP 29 -1.040 3.064 3.154
201 HH2 TRP 29 HH TRP 29 -1.625 5.399 2.746
202 H MET 30 H MET 30 6.823 3.207 5.950
203 HA MET 30 HA MET 30 6.722 5.653 7.590
204 HB2 MET 30 1HB MET 30 8.691 5.000 8.712
205 HB3 MET 30 2HB MET 30 7.695 3.552 8.654
206 HG2 MET 30 1HG MET 30 9.687 2.663 8.038
207 HG3 MET 30 2HG MET 30 9.066 3.111 6.450
208 HE1 MET 30 1HE MET 30 11.506 5.703 9.089
209 HE2 MET 30 2HE MET 30 10.865 4.105 9.469
210 HE3 MET 30 3HE MET 30 12.501 4.270 8.832
211 H TYR 31 H TYR 31 8.784 6.989 7.355
212 HA TYR 31 HA TYR 31 9.776 6.936 4.590
213 HB2 TYR 31 1HB TYR 31 7.972 8.608 4.735
214 HB3 TYR 31 2HB TYR 31 8.823 9.407 6.052
215 HD1 TYR 31 2HD TYR 31 10.984 10.558 5.604
216 HD2 TYR 31 1HD TYR 31 8.586 8.977 2.464
217 HE1 TYR 31 2HE TYR 31 12.212 11.937 3.979
218 HE2 TYR 31 1HE TYR 31 9.809 10.351 0.831
219 HH TYR 31 HH TYR 31 11.148 12.513 0.879
220 H ILE 32 H ILE 32 11.910 7.274 4.385
221 HA ILE 32 HA ILE 32 13.449 7.710 6.824
222 HB ILE 32 HB ILE 32 14.569 7.092 4.098
223 HG12 ILE 32 1HG1 ILE 32 12.774 5.448 4.959
224 HG13 ILE 32 2HG1 ILE 32 14.326 4.787 4.458
225 HG21 ILE 32 1HG2 ILE 32 16.221 7.828 5.656
226 HG22 ILE 32 2HG2 ILE 32 15.595 6.758 6.909
227 HG23 ILE 32 3HG2 ILE 32 16.386 6.081 5.486
228 HD11 ILE 32 1HD1 ILE 32 13.552 5.379 7.304
229 HD12 ILE 32 2HD1 ILE 32 13.472 3.792 6.537
230 HD13 ILE 32 3HD1 ILE 32 15.029 4.592 6.750
231 HA PRO 33 HA PRO 33 13.968 11.991 5.667
232 HB2 PRO 33 1HB PRO 33 15.493 12.657 7.813
233 HB3 PRO 33 2HB PRO 33 13.738 12.466 7.904
234 HG2 PRO 33 1HG PRO 33 15.895 10.537 8.670
235 HG3 PRO 33 2HG PRO 33 14.397 10.939 9.529
236 HD2 PRO 33 1HD PRO 33 14.657 8.706 8.020
237 HD3 PRO 33 2HD PRO 33 13.115 9.567 8.191
238 H ALA 34 H ALA 34 16.690 10.017 6.840
239 HA ALA 34 HA ALA 34 18.809 11.525 5.941
240 HB1 ALA 34 1HB ALA 34 19.791 9.065 5.508
241 HB2 ALA 34 2HB ALA 34 19.603 9.767 7.116
242 HB3 ALA 34 3HB ALA 34 18.384 8.657 6.491
243 H SER 35 H SER 35 17.623 8.672 4.160
244 HA SER 35 HA SER 35 18.819 9.585 1.721
245 HB2 SER 35 1HB SER 35 17.926 7.558 0.738
246 HB3 SER 35 2HB SER 35 18.593 7.172 2.324
247 HG SER 35 HG SER 35 16.242 7.632 2.975
248 H ASN 36 H ASN 36 17.243 11.618 2.439
249 HA ASN 36 HA ASN 36 14.832 11.386 0.766
250 HB2 ASN 36 1HB ASN 36 14.311 12.000 3.055
251 HB3 ASN 36 2HB ASN 36 15.477 13.318 3.002
252 HD21 ASN 36 1HD2 ASN 36 13.398 14.376 3.749
253 HD22 ASN 36 2HD2 ASN 36 12.403 15.063 2.515
254 H ASN 37 H ASN 37 14.610 12.625 -1.005
255 HA ASN 37 HA ASN 37 16.886 14.197 -1.856
256 HB2 ASN 37 1HB ASN 37 14.288 13.509 -3.245
257 HB3 ASN 37 2HB ASN 37 15.609 14.406 -3.989
258 HD21 ASN 37 1HD2 ASN 37 14.420 11.843 -4.723
259 HD22 ASN 37 2HD2 ASN 37 15.716 10.700 -4.719
260 H ASN 38 H ASN 38 15.143 15.125 0.363
261 HA ASN 38 HA ASN 38 13.965 16.973 1.051
262 HB2 ASN 38 1HB ASN 38 16.289 17.915 -0.564
263 HB3 ASN 38 2HB ASN 38 15.116 19.116 -0.031
264 HD21 ASN 38 1HD2 ASN 38 14.634 19.168 2.285
265 HD22 ASN 38 2HD2 ASN 38 15.904 18.810 3.400
266 H THR 39 H THR 39 12.708 15.679 -1.144
267 HA THR 39 HA THR 39 11.581 17.969 -2.616
268 HB THR 39 HB THR 39 12.716 16.003 -3.886
269 HG1 THR 39 1HG THR 39 11.454 17.627 -4.901
270 HG21 THR 39 1HG2 THR 39 11.397 14.084 -4.316
271 HG22 THR 39 2HG2 THR 39 9.987 14.783 -3.521
272 HG23 THR 39 3HG2 THR 39 11.385 14.292 -2.565
273 HA PRO 40 HA PRO 40 7.822 17.277 -0.396
274 HB2 PRO 40 1HB PRO 40 6.188 18.755 -1.982
275 HB3 PRO 40 2HB PRO 40 7.339 19.477 -0.851
276 HG2 PRO 40 1HG PRO 40 7.595 19.058 -3.804
277 HG3 PRO 40 2HG PRO 40 8.038 20.474 -2.832
278 HD2 PRO 40 1HD PRO 40 9.860 18.656 -3.674
279 HD3 PRO 40 2HD PRO 40 10.025 19.532 -2.138
280 H ILE 41 H ILE 41 6.311 15.722 -0.445
281 HA ILE 41 HA ILE 41 5.909 14.271 -2.951
282 HB ILE 41 HB ILE 41 4.890 13.435 -0.245
283 HG12 ILE 41 1HG1 ILE 41 7.609 12.938 -1.472
284 HG13 ILE 41 2HG1 ILE 41 7.265 13.786 0.031
285 HG21 ILE 41 1HG2 ILE 41 4.563 11.352 -1.167
286 HG22 ILE 41 2HG2 ILE 41 4.198 12.397 -2.539
287 HG23 ILE 41 3HG2 ILE 41 5.769 11.603 -2.429
288 HD11 ILE 41 1HD1 ILE 41 8.011 11.199 -0.135
289 HD12 ILE 41 2HD1 ILE 41 7.089 11.887 1.203
290 HD13 ILE 41 3HD1 ILE 41 6.256 11.037 -0.098
291 H HIS 42 H HIS 42 3.999 14.154 -3.995
292 HA HIS 42 HA HIS 42 1.967 16.051 -3.370
293 HB2 HIS 42 1HB HIS 42 2.307 13.932 -5.465
294 HB3 HIS 42 2HB HIS 42 0.748 14.726 -5.265
295 HD1 HIS 42 1HD HIS 42 1.625 15.358 -7.868
296 HD2 HIS 42 2HD HIS 42 3.284 17.384 -4.642
297 HE1 HIS 42 1HE HIS 42 2.604 17.466 -8.829
298 HE2 HIS 42 2HE HIS 42 3.676 18.635 -6.872
299 H GLY 43 H GLY 43 2.239 12.536 -3.091
300 HA2 GLY 43 1HA GLY 43 0.366 12.449 -0.946
301 HA3 GLY 43 2HA GLY 43 -0.366 11.876 -2.438
302 H PHE 44 H PHE 44 -0.568 9.741 -2.025
303 HA PHE 44 HA PHE 44 1.852 8.164 -2.025
304 HB2 PHE 44 1HB PHE 44 0.048 8.324 0.362
305 HB3 PHE 44 2HB PHE 44 0.855 6.805 -0.016
306 HD1 PHE 44 2HD PHE 44 3.477 7.381 -0.779
307 HD2 PHE 44 1HD PHE 44 1.076 9.461 2.054
308 HE1 PHE 44 2HE PHE 44 5.510 8.181 0.352
309 HE2 PHE 44 1HE PHE 44 3.106 10.265 3.189
310 HZ PHE 44 HZ PHE 44 5.326 9.624 2.339
311 H TYR 45 H TYR 45 1.541 6.498 -3.340
312 HA TYR 45 HA TYR 45 -1.209 5.712 -3.982
313 HB2 TYR 45 1HB TYR 45 1.402 5.529 -5.445
314 HB3 TYR 45 2HB TYR 45 0.078 4.454 -5.881
315 HD1 TYR 45 2HD TYR 45 -2.278 6.112 -5.694
316 HD2 TYR 45 1HD TYR 45 1.606 7.128 -7.103
317 HE1 TYR 45 2HE TYR 45 -3.256 7.880 -7.096
318 HE2 TYR 45 1HE TYR 45 0.639 8.899 -8.509
319 HH TYR 45 HH TYR 45 -1.517 10.332 -8.441
320 H ILE 46 H ILE 46 -1.930 3.624 -3.806
321 HA ILE 46 HA ILE 46 -0.088 1.676 -2.588
322 HB ILE 46 HB ILE 46 -2.954 2.199 -1.794
323 HG12 ILE 46 1HG1 ILE 46 -0.650 2.161 0.105
324 HG13 ILE 46 2HG1 ILE 46 -0.854 3.571 -0.929
325 HG21 ILE 46 1HG2 ILE 46 -1.102 0.078 -0.721
326 HG22 ILE 46 2HG2 ILE 46 -2.790 0.345 -0.287
327 HG23 ILE 46 3HG2 ILE 46 -2.375 -0.221 -1.905
328 HD11 ILE 46 1HD1 ILE 46 -2.873 2.475 1.013
329 HD12 ILE 46 2HD1 ILE 46 -1.905 3.937 1.208
330 HD13 ILE 46 3HD1 ILE 46 -3.130 3.852 -0.058
331 H TYR 47 H TYR 47 -0.006 -0.219 -3.601
332 HA TYR 47 HA TYR 47 -2.092 -0.822 -5.586
333 HB2 TYR 47 1HB TYR 47 0.805 -1.660 -5.423
334 HB3 TYR 47 2HB TYR 47 -0.337 -2.353 -6.570
335 HD1 TYR 47 2HD TYR 47 0.437 1.127 -5.426
336 HD2 TYR 47 1HD TYR 47 0.007 -1.556 -8.700
337 HE1 TYR 47 2HE TYR 47 0.898 2.969 -6.989
338 HE2 TYR 47 1HE TYR 47 0.468 0.279 -10.272
339 HH TYR 47 HH TYR 47 1.753 2.556 -10.116
340 H TYR 48 H TYR 48 -3.028 -2.853 -5.678
341 HA TYR 48 HA TYR 48 -2.245 -4.931 -3.836
342 HB2 TYR 48 1HB TYR 48 -4.651 -4.998 -2.894
343 HB3 TYR 48 2HB TYR 48 -3.533 -3.808 -2.237
344 HD1 TYR 48 2HD TYR 48 -3.710 -1.422 -2.985
345 HD2 TYR 48 1HD TYR 48 -6.645 -4.335 -3.989
346 HE1 TYR 48 2HE TYR 48 -5.301 0.375 -3.522
347 HE2 TYR 48 1HE TYR 48 -8.244 -2.546 -4.530
348 HH TYR 48 HH TYR 48 -8.137 0.375 -3.549
349 H ARG 49 H ARG 49 -3.235 -6.938 -4.274
350 HA ARG 49 HA ARG 49 -5.310 -7.265 -6.180
351 HB2 ARG 49 1HB ARG 49 -4.049 -8.209 -8.023
352 HB3 ARG 49 2HB ARG 49 -3.499 -6.568 -7.712
353 HG2 ARG 49 1HG ARG 49 -1.490 -7.594 -7.951
354 HG3 ARG 49 2HG ARG 49 -1.722 -7.830 -6.217
355 HD2 ARG 49 1HD ARG 49 -2.946 -10.025 -7.069
356 HD3 ARG 49 2HD ARG 49 -1.871 -9.787 -8.447
357 HE ARG 49 HE ARG 49 -0.467 -9.613 -5.976
358 HH11 ARG 49 1HH1 ARG 49 -1.849 -11.861 -8.248
359 HH12 ARG 49 2HH1 ARG 49 -0.774 -13.152 -7.823
360 HH21 ARG 49 1HH2 ARG 49 0.953 -11.305 -5.408
361 HH22 ARG 49 2HH2 ARG 49 0.819 -12.835 -6.207
362 HA PRO 50 HA PRO 50 -5.397 -11.132 -4.075
363 HB2 PRO 50 1HB PRO 50 -7.046 -12.486 -5.754
364 HB3 PRO 50 2HB PRO 50 -7.618 -11.224 -4.657
365 HG2 PRO 50 1HG PRO 50 -6.994 -11.053 -7.580
366 HG3 PRO 50 2HG PRO 50 -8.363 -10.366 -6.686
367 HD2 PRO 50 1HD PRO 50 -6.209 -8.893 -7.410
368 HD3 PRO 50 2HD PRO 50 -7.129 -8.573 -5.926
369 H THR 51 H THR 51 -4.451 -13.146 -4.135
370 HA THR 51 HA THR 51 -2.304 -13.576 -5.865
371 HB THR 51 HB THR 51 -2.890 -14.660 -3.542
372 HG1 THR 51 1HG THR 51 -1.617 -16.318 -5.462
373 HG21 THR 51 1HG2 THR 51 -4.845 -15.885 -4.889
374 HG22 THR 51 2HG2 THR 51 -4.032 -16.632 -3.513
375 HG23 THR 51 3HG2 THR 51 -3.556 -17.058 -5.157
376 H ASP 52 H ASP 52 -5.652 -14.282 -6.246
377 HA ASP 52 HA ASP 52 -5.345 -16.338 -8.218
378 HB2 ASP 52 1HB ASP 52 -7.619 -14.761 -7.105
379 HB3 ASP 52 2HB ASP 52 -7.845 -15.557 -8.660
380 H SER 53 H SER 53 -4.767 -13.071 -8.279
381 HA SER 53 HA SER 53 -5.828 -12.206 -10.710
382 HB2 SER 53 1HB SER 53 -3.524 -11.382 -9.006
383 HB3 SER 53 2HB SER 53 -3.592 -10.756 -10.653
384 HG SER 53 HG SER 53 -5.330 -10.318 -8.501
385 H ASP 54 H ASP 54 -4.110 -11.475 -12.514
386 HA ASP 54 HA ASP 54 -2.758 -13.951 -13.364
387 HB2 ASP 54 1HB ASP 54 -4.798 -13.072 -14.683
388 HB3 ASP 54 2HB ASP 54 -3.708 -11.813 -15.255
389 H ASN 55 H ASN 55 -2.623 -10.406 -13.648
390 HA ASN 55 HA ASN 55 0.224 -10.424 -13.244
391 HB2 ASN 55 1HB ASN 55 0.808 -9.348 -15.371
392 HB3 ASN 55 2HB ASN 55 0.120 -10.946 -15.642
393 HD21 ASN 55 1HD2 ASN 55 -2.175 -11.030 -16.202
394 HD22 ASN 55 2HD2 ASN 55 -2.840 -9.753 -17.157
395 H ASP 56 H ASP 56 0.997 -7.990 -13.884
396 HA ASP 56 HA ASP 56 0.018 -6.306 -11.964
397 HB2 ASP 56 1HB ASP 56 1.099 -4.473 -13.161
398 HB3 ASP 56 2HB ASP 56 2.110 -5.914 -13.209
399 H SER 57 H SER 57 -1.394 -7.062 -15.013
400 HA SER 57 HA SER 57 -2.936 -4.834 -15.563
401 HB2 SER 57 1HB SER 57 -2.867 -6.655 -17.130
402 HB3 SER 57 2HB SER 57 -3.565 -7.767 -15.952
403 HG SER 57 HG SER 57 -5.093 -6.959 -17.498
404 H ASP 58 H ASP 58 -3.108 -6.900 -12.876
405 HA ASP 58 HA ASP 58 -5.882 -6.190 -12.276
406 HB2 ASP 58 1HB ASP 58 -3.937 -8.123 -11.018
407 HB3 ASP 58 2HB ASP 58 -5.482 -7.721 -10.274
408 H TYR 59 H TYR 59 -2.657 -5.987 -10.788
409 HA TYR 59 HA TYR 59 -3.041 -4.769 -8.451
410 HB2 TYR 59 1HB TYR 59 -1.019 -4.323 -10.586
411 HB3 TYR 59 2HB TYR 59 -1.063 -3.161 -9.265
412 HD1 TYR 59 1HD TYR 59 -1.664 -4.795 -6.940
413 HD2 TYR 59 2HD TYR 59 0.850 -5.653 -10.263
414 HE1 TYR 59 1HE TYR 59 -0.350 -6.332 -5.540
415 HE2 TYR 59 2HE TYR 59 2.171 -7.193 -8.873
416 HH TYR 59 HH TYR 59 2.476 -8.044 -6.847
417 H LYS 60 H LYS 60 -4.031 -3.035 -7.654
418 HA LYS 60 HA LYS 60 -5.051 -1.029 -9.537
419 HB2 LYS 60 1HB LYS 60 -5.922 -1.940 -6.811
420 HB3 LYS 60 2HB LYS 60 -6.444 -0.384 -7.442
421 HG2 LYS 60 1HG LYS 60 -7.752 -1.327 -9.074
422 HG3 LYS 60 2HG LYS 60 -6.816 -2.822 -9.112
423 HD2 LYS 60 1HD LYS 60 -8.349 -2.085 -6.653
424 HD3 LYS 60 2HD LYS 60 -9.188 -2.801 -8.031
425 HE2 LYS 60 1HE LYS 60 -7.692 -4.721 -7.959
426 HE3 LYS 60 2HE LYS 60 -6.805 -3.997 -6.618
427 HZ1 LYS 60 1HZ LYS 60 -9.694 -4.404 -6.331
428 HZ2 LYS 60 2HZ LYS 60 -8.481 -4.432 -5.153
429 HZ3 LYS 60 3HZ LYS 60 -8.677 -5.749 -6.197
430 H LYS 61 H LYS 61 -5.470 1.143 -8.074
431 HA LYS 61 HA LYS 61 -3.055 1.822 -6.596
432 HB2 LYS 61 1HB LYS 61 -2.682 2.276 -9.078
433 HB3 LYS 61 2HB LYS 61 -3.905 3.531 -8.931
434 HG2 LYS 61 1HG LYS 61 -2.559 4.705 -7.305
435 HG3 LYS 61 2HG LYS 61 -1.356 3.414 -7.331
436 HD2 LYS 61 1HD LYS 61 -0.520 5.156 -8.711
437 HD3 LYS 61 2HD LYS 61 -1.077 3.877 -9.792
438 HE2 LYS 61 1HE LYS 61 -3.073 5.078 -10.302
439 HE3 LYS 61 2HE LYS 61 -2.754 6.262 -9.036
440 HZ1 LYS 61 1HZ LYS 61 -2.211 6.829 -11.484
441 HZ2 LYS 61 2HZ LYS 61 -0.817 5.909 -11.221
442 HZ3 LYS 61 3HZ LYS 61 -1.120 7.275 -10.271
443 H ASP 62 H ASP 62 -3.600 2.965 -4.865
444 HA ASP 62 HA ASP 62 -6.074 4.565 -4.965
445 HB2 ASP 62 1HB ASP 62 -5.023 2.694 -2.895
446 HB3 ASP 62 2HB ASP 62 -5.904 4.118 -2.349
447 H MET 63 H MET 63 -5.621 6.659 -4.955
448 HA MET 63 HA MET 63 -3.104 7.685 -4.068
449 HB2 MET 63 1HB MET 63 -4.766 8.574 -5.903
450 HB3 MET 63 2HB MET 63 -5.474 9.446 -4.549
451 HG2 MET 63 1HG MET 63 -2.957 10.132 -4.140
452 HG3 MET 63 2HG MET 63 -2.839 9.790 -5.864
453 HE1 MET 63 1HE MET 63 -4.776 11.624 -3.120
454 HE2 MET 63 2HE MET 63 -3.391 12.672 -3.428
455 HE3 MET 63 3HE MET 63 -5.021 13.229 -3.810
456 H VAL 64 H VAL 64 -2.564 8.624 -2.179
457 HA VAL 64 HA VAL 64 -4.695 9.119 -0.211
458 HB VAL 64 HB VAL 64 -2.030 7.875 0.470
459 HG11 VAL 64 1HG1 VAL 64 -3.099 7.469 2.656
460 HG12 VAL 64 2HG1 VAL 64 -2.966 9.187 2.276
461 HG13 VAL 64 3HG1 VAL 64 -4.516 8.363 2.106
462 HG21 VAL 64 1HG2 VAL 64 -4.413 6.668 -0.582
463 HG22 VAL 64 2HG2 VAL 64 -2.867 5.921 -0.182
464 HG23 VAL 64 3HG2 VAL 64 -4.111 6.090 1.056
465 H GLU 65 H GLU 65 -4.273 10.754 1.317
466 HA GLU 65 HA GLU 65 -3.053 13.042 0.426
467 HB2 GLU 65 1HB GLU 65 -3.029 12.513 3.363
468 HB3 GLU 65 2HB GLU 65 -3.499 13.966 2.492
469 HG2 GLU 65 1HG GLU 65 -5.075 11.450 2.903
470 HG3 GLU 65 2HG GLU 65 -5.478 13.094 3.396
471 H GLY 66 H GLY 66 -1.093 14.109 0.873
472 HA2 GLY 66 1HA GLY 66 1.192 12.401 0.901
473 HA3 GLY 66 2HA GLY 66 1.209 14.158 0.909
474 H ASP 67 H ASP 67 -0.441 14.322 3.330
475 HA ASP 67 HA ASP 67 1.709 14.053 5.242
476 HB2 ASP 67 1HB ASP 67 0.286 16.067 5.220
477 HB3 ASP 67 2HB ASP 67 -1.115 15.074 5.615
478 H ARG 68 H ARG 68 -0.799 12.102 4.164
479 HA ARG 68 HA ARG 68 -1.238 10.754 6.701
480 HB2 ARG 68 1HB ARG 68 -2.998 11.169 4.844
481 HB3 ARG 68 2HB ARG 68 -2.250 9.795 4.040
482 HG2 ARG 68 1HG ARG 68 -3.964 8.786 5.181
483 HG3 ARG 68 2HG ARG 68 -2.629 8.602 6.321
484 HD2 ARG 68 1HD ARG 68 -4.817 10.674 6.391
485 HD3 ARG 68 2HD ARG 68 -4.577 9.340 7.518
486 HE ARG 68 HE ARG 68 -2.799 10.504 8.493
487 HH11 ARG 68 1HH1 ARG 68 -4.182 12.247 5.815
488 HH12 ARG 68 2HH1 ARG 68 -3.428 13.750 6.234
489 HH21 ARG 68 1HH2 ARG 68 -1.801 12.477 9.056
490 HH22 ARG 68 2HH2 ARG 68 -2.073 13.879 8.077
491 H TYR 69 H TYR 69 -0.230 8.957 7.352
492 HA TYR 69 HA TYR 69 1.556 7.615 5.431
493 HB2 TYR 69 1HB TYR 69 1.876 8.359 8.295
494 HB3 TYR 69 2HB TYR 69 2.609 6.849 7.764
495 HD1 TYR 69 2HD TYR 69 2.267 9.868 5.663
496 HD2 TYR 69 1HD TYR 69 4.890 7.480 8.012
497 HE1 TYR 69 2HE TYR 69 4.190 11.118 4.775
498 HE2 TYR 69 1HE TYR 69 6.821 8.724 7.132
499 HH TYR 69 HH TYR 69 6.921 11.409 6.009
500 H TRP 70 H TRP 70 -1.357 7.169 6.389
501 HA TRP 70 HA TRP 70 -1.083 4.269 6.589
502 HB2 TRP 70 1HB TRP 70 -2.444 4.028 8.500
503 HB3 TRP 70 2HB TRP 70 -1.321 5.320 8.914
504 HD1 TRP 70 HD TRP 70 -2.333 7.642 9.524
505 HE1 TRP 70 1HE TRP 70 -4.731 8.555 9.726
506 HE3 TRP 70 3HE TRP 70 -4.866 3.755 7.377
507 HZ2 TRP 70 2HZ TRP 70 -7.349 7.736 9.063
508 HZ3 TRP 70 3HZ TRP 70 -7.316 3.898 7.200
509 HH2 TRP 70 HH TRP 70 -8.530 5.848 8.027
510 H HIS 71 H HIS 71 -2.851 3.111 5.793
511 HA HIS 71 HA HIS 71 -5.165 4.573 4.811
512 HB2 HIS 71 1HB HIS 71 -3.500 4.726 2.981
513 HB3 HIS 71 2HB HIS 71 -3.411 2.967 2.940
514 HD1 HIS 71 1HD HIS 71 -6.105 5.636 2.578
515 HD2 HIS 71 2HD HIS 71 -5.076 1.889 1.109
516 HE1 HIS 71 1HE HIS 71 -7.827 5.106 0.823
517 HE2 HIS 71 2HE HIS 71 -7.233 2.798 0.009
518 H SER 72 H SER 72 -6.926 3.206 4.207
519 HA SER 72 HA SER 72 -6.655 0.432 5.164
520 HB2 SER 72 1HB SER 72 -8.962 0.587 6.024
521 HB3 SER 72 2HB SER 72 -7.905 1.772 6.792
522 HG SER 72 HG SER 72 -9.295 2.547 4.497
523 H ILE 73 H ILE 73 -6.663 -0.756 3.354
524 HA ILE 73 HA ILE 73 -8.098 -0.042 0.999
525 HB ILE 73 HB ILE 73 -7.005 -2.774 1.658
526 HG12 ILE 73 1HG1 ILE 73 -5.527 -0.510 0.307
527 HG13 ILE 73 2HG1 ILE 73 -5.332 -0.921 2.008
528 HG21 ILE 73 1HG2 ILE 73 -6.671 -2.795 -0.848
529 HG22 ILE 73 2HG2 ILE 73 -8.341 -2.854 -0.288
530 HG23 ILE 73 3HG2 ILE 73 -7.670 -1.343 -0.901
531 HD11 ILE 73 1HD1 ILE 73 -3.543 -1.882 0.729
532 HD12 ILE 73 2HD1 ILE 73 -4.582 -3.171 1.335
533 HD13 ILE 73 3HD1 ILE 73 -4.691 -2.671 -0.352
534 H SER 74 H SER 74 -9.788 -1.307 -0.010
535 HA SER 74 HA SER 74 -11.384 -3.008 1.732
536 HB2 SER 74 1HB SER 74 -12.713 -0.669 0.370
537 HB3 SER 74 2HB SER 74 -13.371 -1.726 1.618
538 HG SER 74 HG SER 74 -12.668 0.372 2.374
539 H HIS 75 H HIS 75 -13.515 -3.581 0.390
540 HA HIS 75 HA HIS 75 -14.361 -4.745 -1.372
541 HB2 HIS 75 1HB HIS 75 -12.627 -2.766 -2.848
542 HB3 HIS 75 2HB HIS 75 -13.658 -3.928 -3.679
543 HD1 HIS 75 1HD HIS 75 -16.202 -3.522 -3.604
544 HD2 HIS 75 2HD HIS 75 -13.972 -0.647 -1.598
545 HE1 HIS 75 1HE HIS 75 -17.797 -1.632 -3.148
546 HE2 HIS 75 2HE HIS 75 -16.404 0.132 -2.009
547 H LEU 76 H LEU 76 -12.386 -6.054 -0.042
548 HA LEU 76 HA LEU 76 -10.777 -7.300 -2.171
549 HB2 LEU 76 1HB LEU 76 -10.264 -7.469 0.788
550 HB3 LEU 76 2HB LEU 76 -9.186 -7.945 -0.523
551 HG LEU 76 HG LEU 76 -10.006 -5.084 -0.260
552 HD11 LEU 76 1HD1 LEU 76 -8.672 -6.546 1.788
553 HD12 LEU 76 2HD1 LEU 76 -9.034 -4.822 1.712
554 HD13 LEU 76 3HD1 LEU 76 -7.525 -5.436 1.039
555 HD21 LEU 76 1HD2 LEU 76 -7.254 -5.856 -0.907
556 HD22 LEU 76 2HD2 LEU 76 -8.330 -4.708 -1.702
557 HD23 LEU 76 3HD2 LEU 76 -8.466 -6.432 -2.052
558 H GLN 77 H GLN 77 -10.109 -9.663 -1.180
559 HA GLN 77 HA GLN 77 -12.680 -11.048 -0.977
560 HB2 GLN 77 1HB GLN 77 -9.940 -12.169 -1.585
561 HB3 GLN 77 2HB GLN 77 -11.461 -13.047 -1.671
562 HG2 GLN 77 1HG GLN 77 -12.169 -11.869 -3.559
563 HG3 GLN 77 2HG GLN 77 -10.970 -10.598 -3.324
564 HE21 GLN 77 1HE2 GLN 77 -10.443 -10.981 -5.562
565 HE22 GLN 77 2HE2 GLN 77 -9.374 -12.273 -5.979
566 HA PRO 78 HA PRO 78 -12.056 -12.070 3.258
567 HB2 PRO 78 1HB PRO 78 -13.642 -14.269 3.404
568 HB3 PRO 78 2HB PRO 78 -14.285 -12.626 3.295
569 HG2 PRO 78 1HG PRO 78 -13.945 -14.674 1.138
570 HG3 PRO 78 2HG PRO 78 -15.312 -13.587 1.443
571 HD2 PRO 78 1HD PRO 78 -13.451 -13.088 -0.459
572 HD3 PRO 78 2HD PRO 78 -14.274 -11.793 0.435
573 H GLU 79 H GLU 79 -10.898 -13.473 4.565
574 HA GLU 79 HA GLU 79 -9.012 -14.777 4.875
575 HB2 GLU 79 1HB GLU 79 -9.699 -17.254 4.284
576 HB3 GLU 79 2HB GLU 79 -10.467 -16.392 5.610
577 HG2 GLU 79 1HG GLU 79 -12.385 -15.903 4.267
578 HG3 GLU 79 2HG GLU 79 -11.601 -16.558 2.830
579 H THR 80 H THR 80 -8.711 -13.419 2.477
580 HA THR 80 HA THR 80 -7.577 -15.459 0.680
581 HB THR 80 HB THR 80 -8.219 -12.602 -0.057
582 HG1 THR 80 1HG THR 80 -9.843 -14.845 0.133
583 HG21 THR 80 1HG2 THR 80 -7.853 -15.010 -1.834
584 HG22 THR 80 2HG2 THR 80 -6.543 -13.905 -1.420
585 HG23 THR 80 3HG2 THR 80 -7.945 -13.316 -2.312
586 H SER 81 H SER 81 -5.470 -15.702 1.041
587 HA SER 81 HA SER 81 -3.856 -13.544 2.081
588 HB2 SER 81 1HB SER 81 -3.690 -16.127 2.565
589 HB3 SER 81 2HB SER 81 -2.687 -16.127 1.114
590 HG SER 81 HG SER 81 -2.270 -14.707 3.527
591 H TYR 82 H TYR 82 -3.432 -11.969 0.645
592 HA TYR 82 HA TYR 82 -2.111 -12.760 -1.863
593 HB2 TYR 82 1HB TYR 82 -3.179 -10.692 -2.883
594 HB3 TYR 82 2HB TYR 82 -4.260 -12.046 -2.570
595 HD1 TYR 82 1HD TYR 82 -3.064 -8.866 -1.030
596 HD2 TYR 82 2HD TYR 82 -6.229 -11.686 -1.392
597 HE1 TYR 82 1HE TYR 82 -4.525 -7.386 0.284
598 HE2 TYR 82 2HE TYR 82 -7.699 -10.213 -0.080
599 HH TYR 82 HH TYR 82 -6.509 -7.146 1.254
600 H ASP 83 H ASP 83 -0.573 -11.252 -2.687
601 HA ASP 83 HA ASP 83 0.989 -10.014 -0.657
602 HB2 ASP 83 1HB ASP 83 1.193 -9.970 -3.672
603 HB3 ASP 83 2HB ASP 83 2.373 -9.212 -2.607
604 H ILE 84 H ILE 84 1.527 -7.801 -0.430
605 HA ILE 84 HA ILE 84 -0.251 -5.878 -1.742
606 HB ILE 84 HB ILE 84 0.159 -5.994 1.249
607 HG12 ILE 84 1HG1 ILE 84 -2.500 -6.181 -0.116
608 HG13 ILE 84 2HG1 ILE 84 -1.486 -7.617 -0.012
609 HG21 ILE 84 1HG2 ILE 84 -0.928 -3.934 -0.582
610 HG22 ILE 84 2HG2 ILE 84 -1.777 -4.193 0.942
611 HG23 ILE 84 3HG2 ILE 84 -0.069 -3.754 0.947
612 HD11 ILE 84 1HD1 ILE 84 -2.312 -7.976 2.004
613 HD12 ILE 84 2HD1 ILE 84 -1.513 -6.503 2.556
614 HD13 ILE 84 3HD1 ILE 84 -3.175 -6.438 1.970
615 H LYS 85 H LYS 85 0.705 -3.985 -2.240
616 HA LYS 85 HA LYS 85 3.133 -3.148 -0.884
617 HB2 LYS 85 1HB LYS 85 4.578 -3.227 -2.702
618 HB3 LYS 85 2HB LYS 85 3.683 -4.732 -2.867
619 HG2 LYS 85 1HG LYS 85 2.293 -3.778 -4.581
620 HG3 LYS 85 2HG LYS 85 3.035 -2.192 -4.349
621 HD2 LYS 85 1HD LYS 85 4.227 -2.930 -6.159
622 HD3 LYS 85 2HD LYS 85 5.249 -3.536 -4.854
623 HE2 LYS 85 1HE LYS 85 3.775 -5.666 -5.042
624 HE3 LYS 85 2HE LYS 85 3.355 -5.026 -6.630
625 HZ1 LYS 85 1HZ LYS 85 5.283 -5.719 -7.435
626 HZ2 LYS 85 2HZ LYS 85 5.592 -6.498 -5.966
627 HZ3 LYS 85 3HZ LYS 85 6.158 -4.925 -6.224
628 H MET 86 H MET 86 3.876 -0.988 -1.690
629 HA MET 86 HA MET 86 1.852 0.574 -3.080
630 HB2 MET 86 1HB MET 86 1.485 2.146 -1.360
631 HB3 MET 86 2HB MET 86 1.336 0.575 -0.584
632 HG2 MET 86 1HG MET 86 2.640 1.611 0.947
633 HG3 MET 86 2HG MET 86 3.902 0.971 -0.103
634 HE1 MET 86 1HE MET 86 2.096 5.007 -0.856
635 HE2 MET 86 2HE MET 86 1.354 3.636 -0.030
636 HE3 MET 86 3HE MET 86 2.280 4.823 0.889
637 H GLN 87 H GLN 87 2.647 2.945 -3.235
638 HA GLN 87 HA GLN 87 5.501 3.312 -3.131
639 HB2 GLN 87 1HB GLN 87 5.499 2.134 -5.188
640 HB3 GLN 87 2HB GLN 87 4.066 2.979 -5.758
641 HG2 GLN 87 1HG GLN 87 5.496 5.092 -5.669
642 HG3 GLN 87 2HG GLN 87 6.872 3.999 -5.529
643 HE21 GLN 87 1HE2 GLN 87 4.204 4.994 -7.564
644 HE22 GLN 87 2HE2 GLN 87 4.861 4.398 -9.047
645 H CYS 88 H CYS 88 6.142 5.479 -3.485
646 HA CYS 88 HA CYS 88 3.926 7.380 -3.220
647 HB2 CYS 88 1HB CYS 88 5.332 8.758 -1.998
648 HB3 CYS 88 2HB CYS 88 5.933 7.165 -1.554
649 HG CYS 88 HG CYS 88 7.516 8.284 -4.228
650 H PHE 89 H PHE 89 4.393 9.605 -4.164
651 HA PHE 89 HA PHE 89 6.027 9.667 -6.538
652 HB2 PHE 89 1HB PHE 89 4.286 9.964 -8.145
653 HB3 PHE 89 2HB PHE 89 3.898 8.503 -7.241
654 HD1 PHE 89 1HD PHE 89 2.434 9.055 -5.032
655 HD2 PHE 89 2HD PHE 89 2.531 11.346 -8.617
656 HE1 PHE 89 1HE PHE 89 0.213 9.971 -4.501
657 HE2 PHE 89 2HE PHE 89 0.311 12.267 -8.092
658 HZ PHE 89 HZ PHE 89 -0.851 11.581 -6.032
659 H ASN 90 H ASN 90 5.983 11.796 -7.593
660 HA ASN 90 HA ASN 90 4.744 13.968 -6.126
661 HB2 ASN 90 1HB ASN 90 6.723 13.769 -4.808
662 HB3 ASN 90 2HB ASN 90 7.737 13.586 -6.236
663 HD21 ASN 90 1HD2 ASN 90 9.010 15.294 -6.314
664 HD22 ASN 90 2HD2 ASN 90 8.505 16.939 -6.164
665 H GLU 91 H GLU 91 5.235 16.105 -7.177
666 HA GLU 91 HA GLU 91 4.448 16.301 -9.723
667 HB2 GLU 91 1HB GLU 91 4.959 18.220 -8.211
668 HB3 GLU 91 2HB GLU 91 6.663 18.022 -8.597
669 HG2 GLU 91 1HG GLU 91 6.349 18.679 -10.826
670 HG3 GLU 91 2HG GLU 91 4.599 18.489 -10.721
671 H GLY 92 H GLY 92 7.743 15.569 -8.705
672 HA2 GLY 92 1HA GLY 92 8.909 15.708 -11.293
673 HA3 GLY 92 2HA GLY 92 9.598 14.904 -9.890
674 H GLY 93 H GLY 93 8.191 12.832 -9.297
675 HA2 GLY 93 1HA GLY 93 6.918 11.371 -11.311
676 HA3 GLY 93 2HA GLY 93 8.633 10.995 -11.393
677 H GLU 94 H GLU 94 6.938 8.965 -10.887
678 HA GLU 94 HA GLU 94 6.386 8.514 -8.150
679 HB2 GLU 94 1HB GLU 94 6.608 6.699 -10.540
680 HB3 GLU 94 2HB GLU 94 6.299 6.062 -8.931
681 HG2 GLU 94 1HG GLU 94 4.214 7.076 -8.791
682 HG3 GLU 94 2HG GLU 94 4.580 8.224 -10.078
683 H SER 95 H SER 95 7.410 7.032 -6.702
684 HA SER 95 HA SER 95 10.320 7.050 -6.994
685 HB2 SER 95 1HB SER 95 9.493 7.981 -4.919
686 HB3 SER 95 2HB SER 95 8.544 6.530 -4.599
687 HG SER 95 HG SER 95 10.290 5.517 -3.948
688 H GLU 96 H GLU 96 11.206 5.018 -5.538
689 HA GLU 96 HA GLU 96 10.930 2.787 -7.228
690 HB2 GLU 96 1HB GLU 96 11.993 2.823 -4.399
691 HB3 GLU 96 2HB GLU 96 12.320 1.605 -5.625
692 HG2 GLU 96 1HG GLU 96 13.547 3.190 -6.948
693 HG3 GLU 96 2HG GLU 96 13.114 4.498 -5.849
694 H PHE 97 H PHE 97 10.268 0.592 -6.523
695 HA PHE 97 HA PHE 97 7.606 0.703 -5.415
696 HB2 PHE 97 1HB PHE 97 9.260 -1.359 -6.802
697 HB3 PHE 97 2HB PHE 97 7.898 -1.900 -5.826
698 HD1 PHE 97 1HD PHE 97 8.552 0.830 -8.291
699 HD2 PHE 97 2HD PHE 97 5.992 -2.321 -7.012
700 HE1 PHE 97 1HE PHE 97 7.027 1.314 -10.161
701 HE2 PHE 97 2HE PHE 97 4.464 -1.842 -8.881
702 HZ PHE 97 HZ PHE 97 4.981 -0.023 -10.458
703 H SER 98 H SER 98 7.006 0.194 -3.407
704 HA SER 98 HA SER 98 8.918 -0.209 -1.369
705 HB2 SER 98 1HB SER 98 7.122 -0.158 0.134
706 HB3 SER 98 2HB SER 98 6.530 0.799 -1.223
707 HG SER 98 HG SER 98 5.728 -1.451 -1.920
708 H ASN 99 H ASN 99 8.284 -2.082 0.325
709 HA ASN 99 HA ASN 99 9.119 -4.501 -0.949
710 HB2 ASN 99 1HB ASN 99 8.725 -5.424 1.442
711 HB3 ASN 99 2HB ASN 99 10.004 -4.238 1.198
712 HD21 ASN 99 1HD2 ASN 99 7.316 -5.045 2.993
713 HD22 ASN 99 2HD2 ASN 99 7.042 -3.523 3.762
714 H VAL 100 H VAL 100 7.950 -6.612 -0.199
715 HA VAL 100 HA VAL 100 5.109 -6.300 -0.907
716 HB VAL 100 HB VAL 100 6.841 -8.759 -1.193
717 HG11 VAL 100 1HG1 VAL 100 4.057 -8.178 -2.199
718 HG12 VAL 100 2HG1 VAL 100 4.986 -9.647 -2.507
719 HG13 VAL 100 3HG1 VAL 100 4.469 -9.256 -0.866
720 HG21 VAL 100 1HG2 VAL 100 7.475 -6.867 -2.689
721 HG22 VAL 100 2HG2 VAL 100 6.917 -8.304 -3.545
722 HG23 VAL 100 3HG2 VAL 100 5.845 -6.916 -3.361
723 H MET 101 H MET 101 3.867 -6.345 0.853
724 HA MET 101 HA MET 101 4.563 -8.191 3.031
725 HB2 MET 101 1HB MET 101 2.747 -5.775 3.024
726 HB3 MET 101 2HB MET 101 3.026 -6.817 4.413
727 HG2 MET 101 1HG MET 101 5.221 -5.327 3.004
728 HG3 MET 101 2HG MET 101 4.324 -4.673 4.372
729 HE1 MET 101 1HE MET 101 4.702 -6.862 7.112
730 HE2 MET 101 2HE MET 101 5.825 -5.507 7.222
731 HE3 MET 101 3HE MET 101 4.252 -5.290 6.452
732 H ILE 102 H ILE 102 3.294 -9.881 3.498
733 HA ILE 102 HA ILE 102 0.875 -10.251 1.889
734 HB ILE 102 HB ILE 102 2.459 -12.235 3.525
735 HG12 ILE 102 1HG1 ILE 102 2.110 -12.117 0.529
736 HG13 ILE 102 2HG1 ILE 102 3.455 -11.342 1.359
737 HG21 ILE 102 1HG2 ILE 102 0.817 -13.724 3.312
738 HG22 ILE 102 2HG2 ILE 102 -0.220 -12.374 2.854
739 HG23 ILE 102 3HG2 ILE 102 0.581 -13.332 1.609
740 HD11 ILE 102 1HD1 ILE 102 3.512 -13.896 2.356
741 HD12 ILE 102 2HD1 ILE 102 3.042 -14.131 0.672
742 HD13 ILE 102 3HD1 ILE 102 4.527 -13.263 1.060
743 H CYS 103 H CYS 103 -0.780 -9.252 2.917
744 HA CYS 103 HA CYS 103 -1.196 -9.850 5.765
745 HB2 CYS 103 1HB CYS 103 -1.074 -7.433 4.932
746 HB3 CYS 103 2HB CYS 103 -2.636 -7.730 4.178
747 HG CYS 103 HG CYS 103 -2.598 -8.599 7.391
748 H GLU 104 H GLU 104 -2.375 -11.662 5.927
749 HA GLU 104 HA GLU 104 -4.362 -12.411 4.015
750 HB2 GLU 104 1HB GLU 104 -2.926 -13.908 5.591
751 HB3 GLU 104 2HB GLU 104 -4.189 -13.583 6.770
752 HG2 GLU 104 1HG GLU 104 -5.757 -14.346 4.801
753 HG3 GLU 104 2HG GLU 104 -4.294 -15.168 4.262
754 H THR 105 H THR 105 -6.415 -11.801 3.923
755 HA THR 105 HA THR 105 -7.526 -9.950 5.750
756 HB THR 105 HB THR 105 -9.718 -10.580 4.503
757 HG1 THR 105 1HG THR 105 -8.883 -11.472 2.325
758 HG21 THR 105 1HG2 THR 105 -8.075 -8.625 4.101
759 HG22 THR 105 2HG2 THR 105 -9.216 -9.041 2.822
760 HG23 THR 105 3HG2 THR 105 -7.536 -9.566 2.711
761 H LYS 106 H LYS 106 -9.938 -10.472 6.501
762 HA LYS 106 HA LYS 106 -9.661 -12.691 8.370
763 HB2 LYS 106 1HB LYS 106 -11.532 -10.339 8.190
764 HB3 LYS 106 2HB LYS 106 -11.834 -11.671 9.297
765 HG2 LYS 106 1HG LYS 106 -9.329 -11.166 9.998
766 HG3 LYS 106 2HG LYS 106 -9.749 -9.568 9.377
767 HD2 LYS 106 1HD LYS 106 -11.881 -9.868 10.854
768 HD3 LYS 106 2HD LYS 106 -10.896 -11.068 11.694
769 HE2 LYS 106 1HE LYS 106 -9.124 -9.101 11.651
770 HE3 LYS 106 2HE LYS 106 -10.580 -8.115 11.530
771 HZ1 LYS 106 1HZ LYS 106 -10.501 -10.200 13.582
772 HZ2 LYS 106 2HZ LYS 106 -11.253 -8.685 13.611
773 HZ3 LYS 106 3HZ LYS 106 -9.582 -8.804 13.842
774 H ALA 107 H ALA 107 -11.340 -14.242 8.698
775 HA ALA 107 HA ALA 107 -12.410 -15.275 6.274
776 HB1 ALA 107 1HB ALA 107 -12.275 -17.113 7.510
777 HB2 ALA 107 2HB ALA 107 -12.085 -16.168 8.987
778 HB3 ALA 107 3HB ALA 107 -13.698 -16.563 8.395
779 H ARG 108 H ARG 108 -14.364 -15.034 5.372
780 HA ARG 108 HA ARG 108 -16.106 -12.987 6.227
781 HB2 ARG 108 1HB ARG 108 -17.655 -13.959 4.474
782 HB3 ARG 108 2HB ARG 108 -16.060 -13.481 3.909
783 HG2 ARG 108 1HG ARG 108 -15.402 -15.626 3.508
784 HG3 ARG 108 2HG ARG 108 -16.454 -16.298 4.756
785 HD2 ARG 108 1HD ARG 108 -17.511 -16.987 2.824
786 HD3 ARG 108 2HD ARG 108 -18.371 -15.493 3.194
787 HE ARG 108 HE ARG 108 -17.603 -14.648 1.226
788 HH11 ARG 108 1HH1 ARG 108 -15.487 -17.230 2.214
789 HH12 ARG 108 2HH1 ARG 108 -14.521 -17.163 0.778
790 HH21 ARG 108 1HH2 ARG 108 -16.339 -14.550 -0.670
791 HH22 ARG 108 2HH2 ARG 108 -15.005 -15.638 -0.862
792 H SER 109 H SER 109 -17.013 -13.227 8.205
793 HA SER 109 HA SER 109 -18.313 -15.750 8.892
794 HB2 SER 109 1HB SER 109 -16.793 -14.379 10.481
795 HB3 SER 109 2HB SER 109 -18.197 -13.329 10.676
796 HG SER 109 HG SER 109 -19.227 -14.871 11.735
797 H GLY 110 H GLY 110 -20.501 -15.892 9.490
798 HA2 GLY 110 1HA GLY 110 -22.250 -13.621 9.291
799 HA3 GLY 110 2HA GLY 110 -22.364 -14.688 7.899
800 HA PRO 111 HA PRO 111 -24.861 -16.176 11.714
801 HB2 PRO 111 1HB PRO 111 -27.297 -15.136 11.117
802 HB3 PRO 111 2HB PRO 111 -26.114 -14.295 12.126
803 HG2 PRO 111 1HG PRO 111 -26.738 -13.915 9.223
804 HG3 PRO 111 2HG PRO 111 -26.451 -12.693 10.474
805 HD2 PRO 111 1HD PRO 111 -24.550 -13.426 8.691
806 HD3 PRO 111 2HD PRO 111 -24.160 -12.919 10.347
807 H SER 112 H SER 112 -25.064 -16.134 8.305
808 HA SER 112 HA SER 112 -27.227 -17.664 7.644
809 HB2 SER 112 1HB SER 112 -24.424 -17.804 6.516
810 HB3 SER 112 2HB SER 112 -25.823 -18.575 5.769
811 HG SER 112 HG SER 112 -26.702 -16.258 6.016
812 H SER 113 H SER 113 -27.755 -19.822 7.598
813 HA SER 113 HA SER 113 -26.055 -21.575 9.245
814 HB2 SER 113 1HB SER 113 -28.191 -21.208 10.304
815 HB3 SER 113 2HB SER 113 -29.050 -21.590 8.812
816 HG SER 113 HG SER 113 -27.481 -23.367 10.375
817 H GLY 114 H GLY 114 -28.212 -21.540 6.422
818 HA2 GLY 114 1HA GLY 114 -26.808 -23.953 5.451
819 HA3 GLY 114 2HA GLY 114 -28.497 -23.610 5.110
Start of MODEL 18
1 H1 GLY 1 H GLY 1 18.356 14.635 -23.580
2 HA2 GLY 1 1HA GLY 1 17.164 12.638 -22.668
3 HA3 GLY 1 2HA GLY 1 18.627 11.740 -23.044
4 H SER 2 H SER 2 17.815 14.768 -21.337
5 HA SER 2 HA SER 2 19.936 14.856 -19.602
6 HB2 SER 2 1HB SER 2 17.912 16.483 -19.922
7 HB3 SER 2 2HB SER 2 17.198 15.565 -18.597
8 HG SER 2 HG SER 2 18.553 16.457 -17.248
9 H SER 3 H SER 3 20.684 13.135 -18.524
10 HA SER 3 HA SER 3 18.906 11.206 -17.320
11 HB2 SER 3 1HB SER 3 21.923 11.453 -17.253
12 HB3 SER 3 2HB SER 3 21.010 10.097 -16.591
13 HG SER 3 HG SER 3 21.025 10.937 -19.304
14 H GLY 4 H GLY 4 19.121 10.570 -15.033
15 HA2 GLY 4 1HA GLY 4 20.329 11.947 -13.004
16 HA3 GLY 4 2HA GLY 4 18.879 12.880 -13.343
17 H SER 5 H SER 5 17.366 12.451 -11.891
18 HA SER 5 HA SER 5 16.650 9.675 -11.367
19 HB2 SER 5 1HB SER 5 16.766 9.844 -8.992
20 HB3 SER 5 2HB SER 5 18.310 10.442 -9.599
21 HG SER 5 HG SER 5 16.422 11.728 -8.149
22 H SER 6 H SER 6 14.504 9.374 -10.913
23 HA SER 6 HA SER 6 12.759 11.595 -11.507
24 HB2 SER 6 1HB SER 6 12.115 8.715 -10.824
25 HB3 SER 6 2HB SER 6 10.958 9.909 -11.411
26 HG SER 6 HG SER 6 12.694 8.389 -12.806
27 H GLY 7 H GLY 7 12.965 12.984 -9.740
28 HA2 GLY 7 1HA GLY 7 12.689 13.733 -7.569
29 HA3 GLY 7 2HA GLY 7 11.135 12.931 -7.749
30 HA PRO 8 HA PRO 8 12.723 10.810 -4.119
31 HB2 PRO 8 1HB PRO 8 10.335 9.715 -3.436
32 HB3 PRO 8 2HB PRO 8 10.764 11.390 -3.069
33 HG2 PRO 8 1HG PRO 8 9.092 10.309 -5.304
34 HG3 PRO 8 2HG PRO 8 8.808 11.728 -4.280
35 HD2 PRO 8 1HD PRO 8 9.815 11.919 -6.786
36 HD3 PRO 8 2HD PRO 8 10.258 13.049 -5.490
37 H VAL 9 H VAL 9 13.561 8.813 -3.961
38 HA VAL 9 HA VAL 9 12.500 6.717 -5.743
39 HB VAL 9 HB VAL 9 14.785 5.809 -5.914
40 HG11 VAL 9 1HG1 VAL 9 15.552 7.313 -7.558
41 HG12 VAL 9 2HG1 VAL 9 13.796 7.488 -7.544
42 HG13 VAL 9 3HG1 VAL 9 14.810 8.696 -6.754
43 HG21 VAL 9 1HG2 VAL 9 15.815 6.574 -3.920
44 HG22 VAL 9 2HG2 VAL 9 16.672 7.348 -5.252
45 HG23 VAL 9 3HG2 VAL 9 15.490 8.261 -4.316
46 H ALA 10 H ALA 10 14.196 7.389 -2.706
47 HA ALA 10 HA ALA 10 14.508 4.975 -1.558
48 HB1 ALA 10 1HB ALA 10 14.680 7.436 -0.599
49 HB2 ALA 10 2HB ALA 10 13.146 6.988 0.147
50 HB3 ALA 10 3HB ALA 10 14.591 6.028 0.461
51 H GLY 11 H GLY 11 11.427 6.654 -1.966
52 HA2 GLY 11 1HA GLY 11 9.260 5.921 -1.781
53 HA3 GLY 11 2HA GLY 11 9.900 4.317 -2.105
54 HA PRO 12 HA PRO 12 8.443 4.966 2.420
55 HB2 PRO 12 1HB PRO 12 5.909 4.010 2.243
56 HB3 PRO 12 2HB PRO 12 6.306 5.721 2.047
57 HG2 PRO 12 1HG PRO 12 5.797 3.642 -0.046
58 HG3 PRO 12 2HG PRO 12 5.228 5.320 0.025
59 HD2 PRO 12 1HD PRO 12 7.329 4.558 -1.503
60 HD3 PRO 12 2HD PRO 12 7.227 6.164 -0.752
61 H TYR 13 H TYR 13 8.044 3.234 3.914
62 HA TYR 13 HA TYR 13 8.271 0.540 2.750
63 HB2 TYR 13 1HB TYR 13 10.455 0.836 3.471
64 HB3 TYR 13 2HB TYR 13 9.981 1.848 4.830
65 HD1 TYR 13 1HD TYR 13 8.733 -1.529 3.879
66 HD2 TYR 13 2HD TYR 13 10.924 0.798 6.688
67 HE1 TYR 13 1HE TYR 13 8.877 -3.478 5.372
68 HE2 TYR 13 2HE TYR 13 11.075 -1.145 8.188
69 HH TYR 13 HH TYR 13 10.892 -3.483 8.199
70 H ILE 14 H ILE 14 6.608 -0.662 3.350
71 HA ILE 14 HA ILE 14 4.801 0.080 5.399
72 HB ILE 14 HB ILE 14 5.067 -2.637 4.110
73 HG12 ILE 14 1HG1 ILE 14 3.193 -0.459 3.217
74 HG13 ILE 14 2HG1 ILE 14 4.827 -0.570 2.571
75 HG21 ILE 14 1HG2 ILE 14 3.603 -2.946 5.860
76 HG22 ILE 14 2HG2 ILE 14 2.982 -1.299 5.772
77 HG23 ILE 14 3HG2 ILE 14 2.500 -2.489 4.563
78 HD11 ILE 14 1HD1 ILE 14 3.289 -3.067 2.506
79 HD12 ILE 14 2HD1 ILE 14 2.675 -1.768 1.484
80 HD13 ILE 14 3HD1 ILE 14 4.332 -2.336 1.286
81 H THR 15 H THR 15 5.207 -0.028 7.500
82 HA THR 15 HA THR 15 6.876 -2.233 8.512
83 HB THR 15 HB THR 15 7.609 -0.887 10.275
84 HG1 THR 15 1HG THR 15 5.410 0.823 9.672
85 HG21 THR 15 1HG2 THR 15 8.862 0.490 9.043
86 HG22 THR 15 2HG2 THR 15 7.468 1.495 8.646
87 HG23 THR 15 3HG2 THR 15 7.843 0.079 7.665
88 H PHE 16 H PHE 16 3.781 -1.705 8.060
89 HA PHE 16 HA PHE 16 2.983 -3.331 10.305
90 HB2 PHE 16 1HB PHE 16 2.887 -0.856 11.035
91 HB3 PHE 16 2HB PHE 16 1.505 -0.734 9.952
92 HD1 PHE 16 1HD PHE 16 2.799 -2.591 12.889
93 HD2 PHE 16 2HD PHE 16 -0.618 -1.386 10.655
94 HE1 PHE 16 1HE PHE 16 1.336 -3.452 14.670
95 HE2 PHE 16 2HE PHE 16 -2.087 -2.244 12.433
96 HZ PHE 16 HZ PHE 16 -1.110 -3.278 14.444
97 H THR 17 H THR 17 1.573 -4.778 9.588
98 HA THR 17 HA THR 17 -0.332 -4.031 7.493
99 HB THR 17 HB THR 17 0.156 -6.439 6.548
100 HG1 THR 17 1HG THR 17 2.096 -7.229 7.015
101 HG21 THR 17 1HG2 THR 17 0.853 -3.845 5.799
102 HG22 THR 17 2HG2 THR 17 0.867 -5.281 4.776
103 HG23 THR 17 3HG2 THR 17 2.335 -4.782 5.616
104 H ASP 18 H ASP 18 -2.240 -4.375 8.424
105 HA ASP 18 HA ASP 18 -2.733 -6.985 9.664
106 HB2 ASP 18 1HB ASP 18 -3.109 -4.297 10.919
107 HB3 ASP 18 2HB ASP 18 -4.251 -5.582 11.304
108 H ALA 19 H ALA 19 -5.010 -7.557 9.768
109 HA ALA 19 HA ALA 19 -6.485 -6.395 7.517
110 HB1 ALA 19 1HB ALA 19 -6.593 -9.057 8.890
111 HB2 ALA 19 2HB ALA 19 -7.913 -8.506 7.857
112 HB3 ALA 19 3HB ALA 19 -6.291 -8.693 7.191
113 H VAL 20 H VAL 20 -7.742 -4.754 8.165
114 HA VAL 20 HA VAL 20 -8.857 -4.488 10.747
115 HB VAL 20 HB VAL 20 -9.816 -3.147 8.218
116 HG11 VAL 20 1HG1 VAL 20 -10.029 -2.378 11.126
117 HG12 VAL 20 2HG1 VAL 20 -10.507 -1.354 9.770
118 HG13 VAL 20 3HG1 VAL 20 -11.348 -2.876 10.067
119 HG21 VAL 20 1HG2 VAL 20 -7.330 -2.969 8.691
120 HG22 VAL 20 2HG2 VAL 20 -8.211 -1.448 8.544
121 HG23 VAL 20 3HG2 VAL 20 -7.772 -2.062 10.138
122 H ASN 21 H ASN 21 -9.930 -6.094 7.869
123 HA ASN 21 HA ASN 21 -12.077 -7.358 9.268
124 HB2 ASN 21 1HB ASN 21 -12.642 -5.098 7.412
125 HB3 ASN 21 2HB ASN 21 -13.705 -6.500 7.333
126 HD21 ASN 21 1HD2 ASN 21 -14.507 -3.928 8.113
127 HD22 ASN 21 2HD2 ASN 21 -14.998 -3.995 9.768
128 H GLU 22 H GLU 22 -13.501 -8.579 7.490
129 HA GLU 22 HA GLU 22 -11.748 -10.378 6.215
130 HB2 GLU 22 1HB GLU 22 -13.784 -11.349 5.220
131 HB3 GLU 22 2HB GLU 22 -13.959 -11.069 6.947
132 HG2 GLU 22 1HG GLU 22 -14.884 -8.949 5.088
133 HG3 GLU 22 2HG GLU 22 -15.847 -10.419 5.227
134 H THR 23 H THR 23 -13.380 -7.499 5.117
135 HA THR 23 HA THR 23 -12.188 -7.887 2.448
136 HB THR 23 HB THR 23 -13.996 -6.365 1.595
137 HG1 THR 23 1HG THR 23 -14.921 -6.744 4.254
138 HG21 THR 23 1HG2 THR 23 -15.177 -8.183 1.021
139 HG22 THR 23 2HG2 THR 23 -15.572 -8.561 2.698
140 HG23 THR 23 3HG2 THR 23 -14.032 -9.083 2.015
141 H THR 24 H THR 24 -11.297 -6.505 5.036
142 HA THR 24 HA THR 24 -10.449 -4.021 3.726
143 HB THR 24 HB THR 24 -11.078 -3.907 6.644
144 HG1 THR 24 1HG THR 24 -13.217 -3.451 6.222
145 HG21 THR 24 1HG2 THR 24 -11.299 -1.588 6.254
146 HG22 THR 24 2HG2 THR 24 -11.456 -1.817 4.512
147 HG23 THR 24 3HG2 THR 24 -9.903 -2.090 5.302
148 H ILE 25 H ILE 25 -8.456 -3.182 4.460
149 HA ILE 25 HA ILE 25 -6.949 -4.732 6.413
150 HB ILE 25 HB ILE 25 -6.178 -4.507 3.514
151 HG12 ILE 25 1HG1 ILE 25 -6.123 -6.851 5.424
152 HG13 ILE 25 2HG1 ILE 25 -7.463 -6.492 4.341
153 HG21 ILE 25 1HG2 ILE 25 -4.098 -4.026 4.178
154 HG22 ILE 25 2HG2 ILE 25 -4.448 -4.415 5.861
155 HG23 ILE 25 3HG2 ILE 25 -4.033 -5.701 4.727
156 HD11 ILE 25 1HD1 ILE 25 -5.851 -6.686 2.439
157 HD12 ILE 25 2HD1 ILE 25 -4.662 -7.280 3.599
158 HD13 ILE 25 3HD1 ILE 25 -6.154 -8.180 3.325
159 H MET 26 H MET 26 -5.578 -3.501 7.566
160 HA MET 26 HA MET 26 -5.207 -0.717 6.686
161 HB2 MET 26 1HB MET 26 -6.274 -0.493 8.707
162 HB3 MET 26 2HB MET 26 -5.597 -1.982 9.354
163 HG2 MET 26 1HG MET 26 -3.642 -0.970 10.014
164 HG3 MET 26 2HG MET 26 -3.805 0.343 8.850
165 HE1 MET 26 1HE MET 26 -4.225 2.983 10.875
166 HE2 MET 26 2HE MET 26 -4.168 2.297 9.251
167 HE3 MET 26 3HE MET 26 -5.702 2.860 9.917
168 H LEU 27 H LEU 27 -3.246 -0.202 5.997
169 HA LEU 27 HA LEU 27 -0.927 -1.589 7.167
170 HB2 LEU 27 1HB LEU 27 0.049 -1.956 5.129
171 HB3 LEU 27 2HB LEU 27 -1.654 -2.184 4.736
172 HG LEU 27 HG LEU 27 -0.312 0.462 4.300
173 HD11 LEU 27 1HD1 LEU 27 -0.541 -1.448 2.046
174 HD12 LEU 27 2HD1 LEU 27 0.791 -1.676 3.179
175 HD13 LEU 27 3HD1 LEU 27 0.617 -0.146 2.319
176 HD21 LEU 27 1HD2 LEU 27 -2.784 0.269 4.215
177 HD22 LEU 27 2HD2 LEU 27 -2.613 -0.893 2.899
178 HD23 LEU 27 3HD2 LEU 27 -2.065 0.770 2.685
179 H LYS 28 H LYS 28 0.772 -0.340 7.747
180 HA LYS 28 HA LYS 28 0.571 2.543 7.166
181 HB2 LYS 28 1HB LYS 28 1.856 1.321 9.608
182 HB3 LYS 28 2HB LYS 28 1.500 3.019 9.322
183 HG2 LYS 28 1HG LYS 28 -0.756 2.754 9.721
184 HG3 LYS 28 2HG LYS 28 -0.720 1.024 9.370
185 HD2 LYS 28 1HD LYS 28 0.649 0.716 11.440
186 HD3 LYS 28 2HD LYS 28 0.375 2.420 11.809
187 HE2 LYS 28 1HE LYS 28 -2.080 1.960 11.721
188 HE3 LYS 28 2HE LYS 28 -1.699 0.246 11.561
189 HZ1 LYS 28 1HZ LYS 28 -2.184 1.208 13.881
190 HZ2 LYS 28 2HZ LYS 28 -0.604 1.805 13.808
191 HZ3 LYS 28 3HZ LYS 28 -0.884 0.140 13.703
192 H TRP 29 H TRP 29 2.359 3.602 6.451
193 HA TRP 29 HA TRP 29 4.798 1.986 6.089
194 HB2 TRP 29 1HB TRP 29 5.201 3.388 4.039
195 HB3 TRP 29 2HB TRP 29 3.805 2.318 3.933
196 HD1 TRP 29 HD TRP 29 4.725 6.025 4.174
197 HE1 TRP 29 1HE TRP 29 2.665 7.426 3.526
198 HE3 TRP 29 3HE TRP 29 1.258 2.280 3.869
199 HZ2 TRP 29 2HZ TRP 29 -0.067 7.000 2.961
200 HZ3 TRP 29 3HZ TRP 29 -1.056 2.861 3.269
201 HH2 TRP 29 HH TRP 29 -1.703 5.173 2.825
202 H MET 30 H MET 30 6.813 3.233 5.956
203 HA MET 30 HA MET 30 6.679 5.683 7.590
204 HB2 MET 30 1HB MET 30 8.658 5.069 8.715
205 HB3 MET 30 2HB MET 30 7.687 3.604 8.670
206 HG2 MET 30 1HG MET 30 8.998 2.758 6.819
207 HG3 MET 30 2HG MET 30 9.936 4.249 6.779
208 HE1 MET 30 1HE MET 30 11.169 5.167 8.664
209 HE2 MET 30 2HE MET 30 10.562 4.622 10.228
210 HE3 MET 30 3HE MET 30 12.195 4.192 9.718
211 H TYR 31 H TYR 31 8.541 7.164 7.283
212 HA TYR 31 HA TYR 31 9.497 7.108 4.495
213 HB2 TYR 31 1HB TYR 31 7.737 8.850 5.008
214 HB3 TYR 31 2HB TYR 31 8.905 9.606 6.086
215 HD1 TYR 31 1HD TYR 31 8.425 8.557 2.546
216 HD2 TYR 31 2HD TYR 31 10.446 11.147 5.249
217 HE1 TYR 31 1HE TYR 31 9.367 9.798 0.643
218 HE2 TYR 31 2HE TYR 31 11.393 12.396 3.354
219 HH TYR 31 HH TYR 31 10.335 11.876 0.098
220 H ILE 32 H ILE 32 11.625 7.381 4.161
221 HA ILE 32 HA ILE 32 13.313 7.793 6.528
222 HB ILE 32 HB ILE 32 14.130 6.708 3.832
223 HG12 ILE 32 1HG1 ILE 32 12.674 5.071 4.666
224 HG13 ILE 32 2HG1 ILE 32 14.257 4.525 5.209
225 HG21 ILE 32 1HG2 ILE 32 15.660 6.150 6.300
226 HG22 ILE 32 2HG2 ILE 32 16.223 6.422 4.652
227 HG23 ILE 32 3HG2 ILE 32 15.751 7.790 5.659
228 HD11 ILE 32 1HD1 ILE 32 12.628 4.277 6.970
229 HD12 ILE 32 2HD1 ILE 32 13.813 5.506 7.413
230 HD13 ILE 32 3HD1 ILE 32 12.210 5.987 6.859
231 HA PRO 33 HA PRO 33 13.867 11.856 4.572
232 HB2 PRO 33 1HB PRO 33 14.736 13.058 6.846
233 HB3 PRO 33 2HB PRO 33 13.024 12.808 6.485
234 HG2 PRO 33 1HG PRO 33 14.842 11.206 8.242
235 HG3 PRO 33 2HG PRO 33 13.170 11.717 8.534
236 HD2 PRO 33 1HD PRO 33 13.806 9.218 7.708
237 HD3 PRO 33 2HD PRO 33 12.293 10.021 7.242
238 H ALA 34 H ALA 34 16.064 9.922 6.503
239 HA ALA 34 HA ALA 34 18.425 11.356 6.209
240 HB1 ALA 34 1HB ALA 34 18.451 9.542 7.699
241 HB2 ALA 34 2HB ALA 34 17.899 8.410 6.464
242 HB3 ALA 34 3HB ALA 34 19.532 9.072 6.387
243 H SER 35 H SER 35 17.533 8.499 4.263
244 HA SER 35 HA SER 35 19.376 9.320 2.183
245 HB2 SER 35 1HB SER 35 17.806 6.868 2.804
246 HB3 SER 35 2HB SER 35 18.224 7.154 1.114
247 HG SER 35 HG SER 35 20.058 6.290 1.677
248 H ASN 36 H ASN 36 17.254 11.126 2.576
249 HA ASN 36 HA ASN 36 15.637 10.729 0.146
250 HB2 ASN 36 1HB ASN 36 14.295 10.911 2.192
251 HB3 ASN 36 2HB ASN 36 15.056 12.456 2.563
252 HD21 ASN 36 1HD2 ASN 36 13.138 13.582 2.536
253 HD22 ASN 36 2HD2 ASN 36 12.262 13.902 1.081
254 H ASN 37 H ASN 37 15.094 12.724 -1.055
255 HA ASN 37 HA ASN 37 17.453 14.455 -1.214
256 HB2 ASN 37 1HB ASN 37 15.243 13.854 -3.184
257 HB3 ASN 37 2HB ASN 37 16.460 15.098 -3.453
258 HD21 ASN 37 1HD2 ASN 37 15.686 11.852 -3.791
259 HD22 ASN 37 2HD2 ASN 37 17.243 11.265 -4.255
260 H ASN 38 H ASN 38 15.272 14.744 0.777
261 HA ASN 38 HA ASN 38 13.837 16.315 1.629
262 HB2 ASN 38 1HB ASN 38 15.818 18.239 0.399
263 HB3 ASN 38 2HB ASN 38 14.822 18.499 1.828
264 HD21 ASN 38 1HD2 ASN 38 15.786 18.221 3.698
265 HD22 ASN 38 2HD2 ASN 38 17.194 17.262 3.986
266 H THR 39 H THR 39 12.805 15.416 -0.721
267 HA THR 39 HA THR 39 11.869 17.851 -2.091
268 HB THR 39 HB THR 39 13.039 16.082 -3.483
269 HG1 THR 39 1HG THR 39 10.381 16.385 -4.374
270 HG21 THR 39 1HG2 THR 39 11.865 14.080 -4.058
271 HG22 THR 39 2HG2 THR 39 10.449 14.577 -3.132
272 HG23 THR 39 3HG2 THR 39 11.945 14.157 -2.298
273 HA PRO 40 HA PRO 40 7.872 17.188 -0.353
274 HB2 PRO 40 1HB PRO 40 6.417 18.647 -2.121
275 HB3 PRO 40 2HB PRO 40 7.448 19.382 -0.888
276 HG2 PRO 40 1HG PRO 40 8.006 18.919 -3.792
277 HG3 PRO 40 2HG PRO 40 8.353 20.347 -2.801
278 HD2 PRO 40 1HD PRO 40 10.243 18.511 -3.423
279 HD3 PRO 40 2HD PRO 40 10.252 19.410 -1.892
280 H ILE 41 H ILE 41 6.269 15.721 -0.561
281 HA ILE 41 HA ILE 41 6.098 14.268 -3.111
282 HB ILE 41 HB ILE 41 5.044 13.320 -0.452
283 HG12 ILE 41 1HG1 ILE 41 7.741 12.744 -1.700
284 HG13 ILE 41 2HG1 ILE 41 7.468 13.741 -0.275
285 HG21 ILE 41 1HG2 ILE 41 4.909 11.191 -1.455
286 HG22 ILE 41 2HG2 ILE 41 4.240 12.316 -2.636
287 HG23 ILE 41 3HG2 ILE 41 5.878 11.695 -2.839
288 HD11 ILE 41 1HD1 ILE 41 6.278 11.133 0.030
289 HD12 ILE 41 2HD1 ILE 41 8.000 11.026 -0.336
290 HD13 ILE 41 3HD1 ILE 41 7.450 11.969 1.049
291 H HIS 42 H HIS 42 4.169 13.965 -4.146
292 HA HIS 42 HA HIS 42 2.096 15.857 -3.622
293 HB2 HIS 42 1HB HIS 42 2.620 13.764 -5.671
294 HB3 HIS 42 2HB HIS 42 0.954 14.296 -5.464
295 HD1 HIS 42 1HD HIS 42 1.208 15.256 -7.934
296 HD2 HIS 42 2HD HIS 42 3.524 17.116 -5.030
297 HE1 HIS 42 1HE HIS 42 1.950 17.430 -8.957
298 HE2 HIS 42 2HE HIS 42 3.420 18.499 -7.214
299 H GLY 43 H GLY 43 2.409 12.347 -3.259
300 HA2 GLY 43 1HA GLY 43 0.585 12.263 -1.090
301 HA3 GLY 43 2HA GLY 43 -0.209 11.726 -2.563
302 H PHE 44 H PHE 44 -0.479 9.632 -1.724
303 HA PHE 44 HA PHE 44 1.939 7.994 -1.925
304 HB2 PHE 44 1HB PHE 44 0.047 8.080 0.412
305 HB3 PHE 44 2HB PHE 44 0.983 6.633 0.054
306 HD1 PHE 44 2HD PHE 44 3.582 7.339 -0.541
307 HD2 PHE 44 1HD PHE 44 0.915 9.352 2.096
308 HE1 PHE 44 2HE PHE 44 5.501 8.279 0.678
309 HE2 PHE 44 1HE PHE 44 2.830 10.296 3.319
310 HZ PHE 44 HZ PHE 44 5.127 9.759 2.611
311 H TYR 45 H TYR 45 1.623 6.355 -3.271
312 HA TYR 45 HA TYR 45 -1.127 5.615 -3.962
313 HB2 TYR 45 1HB TYR 45 1.489 5.510 -5.390
314 HB3 TYR 45 2HB TYR 45 0.265 4.319 -5.817
315 HD1 TYR 45 2HD TYR 45 -2.222 5.789 -5.698
316 HD2 TYR 45 1HD TYR 45 1.587 7.071 -7.094
317 HE1 TYR 45 2HE TYR 45 -3.318 7.435 -7.159
318 HE2 TYR 45 1HE TYR 45 0.501 8.722 -8.559
319 HH TYR 45 HH TYR 45 -1.482 9.357 -9.466
320 H ILE 46 H ILE 46 -1.888 3.542 -3.808
321 HA ILE 46 HA ILE 46 -0.088 1.518 -2.665
322 HB ILE 46 HB ILE 46 -2.893 2.090 -1.702
323 HG12 ILE 46 1HG1 ILE 46 -0.457 2.179 0.031
324 HG13 ILE 46 2HG1 ILE 46 -0.807 3.554 -1.011
325 HG21 ILE 46 1HG2 ILE 46 -2.317 -0.311 -1.748
326 HG22 ILE 46 2HG2 ILE 46 -0.921 0.030 -0.727
327 HG23 ILE 46 3HG2 ILE 46 -2.551 0.305 -0.112
328 HD11 ILE 46 1HD1 ILE 46 -2.694 2.411 1.033
329 HD12 ILE 46 2HD1 ILE 46 -1.681 3.837 1.259
330 HD13 ILE 46 3HD1 ILE 46 -2.958 3.846 0.043
331 H TYR 47 H TYR 47 -0.107 -0.297 -3.805
332 HA TYR 47 HA TYR 47 -2.399 -0.821 -5.572
333 HB2 TYR 47 1HB TYR 47 0.436 -1.861 -5.757
334 HB3 TYR 47 2HB TYR 47 -0.857 -2.195 -6.903
335 HD1 TYR 47 2HD TYR 47 0.743 0.794 -5.316
336 HD2 TYR 47 1HD TYR 47 -0.821 -0.976 -8.854
337 HE1 TYR 47 2HE TYR 47 1.360 2.807 -6.588
338 HE2 TYR 47 1HE TYR 47 -0.207 1.031 -10.137
339 HH TYR 47 HH TYR 47 1.195 3.869 -8.547
340 H TYR 48 H TYR 48 -3.242 -2.931 -5.738
341 HA TYR 48 HA TYR 48 -2.330 -4.992 -3.930
342 HB2 TYR 48 1HB TYR 48 -4.745 -5.167 -2.988
343 HB3 TYR 48 2HB TYR 48 -3.648 -3.974 -2.301
344 HD1 TYR 48 2HD TYR 48 -3.800 -1.574 -3.241
345 HD2 TYR 48 1HD TYR 48 -6.831 -4.508 -3.790
346 HE1 TYR 48 2HE TYR 48 -5.428 0.206 -3.720
347 HE2 TYR 48 1HE TYR 48 -8.468 -2.737 -4.271
348 HH TYR 48 HH TYR 48 -8.582 -0.473 -4.956
349 H ARG 49 H ARG 49 -3.300 -7.038 -4.330
350 HA ARG 49 HA ARG 49 -5.353 -7.445 -6.232
351 HB2 ARG 49 1HB ARG 49 -4.127 -8.251 -8.119
352 HB3 ARG 49 2HB ARG 49 -3.502 -6.654 -7.730
353 HG2 ARG 49 1HG ARG 49 -1.540 -7.746 -8.039
354 HG3 ARG 49 2HG ARG 49 -1.772 -8.078 -6.321
355 HD2 ARG 49 1HD ARG 49 -3.005 -10.194 -7.123
356 HD3 ARG 49 2HD ARG 49 -2.217 -9.887 -8.670
357 HE ARG 49 HE ARG 49 -0.998 -10.895 -6.277
358 HH11 ARG 49 1HH1 ARG 49 -0.444 -9.160 -9.244
359 HH12 ARG 49 2HH1 ARG 49 1.238 -9.568 -9.321
360 HH21 ARG 49 1HH2 ARG 49 1.216 -11.438 -6.367
361 HH22 ARG 49 2HH2 ARG 49 2.181 -10.864 -7.685
362 HA PRO 50 HA PRO 50 -5.261 -11.319 -4.139
363 HB2 PRO 50 1HB PRO 50 -6.869 -12.734 -5.807
364 HB3 PRO 50 2HB PRO 50 -7.482 -11.500 -4.699
365 HG2 PRO 50 1HG PRO 50 -6.895 -11.294 -7.628
366 HG3 PRO 50 2HG PRO 50 -8.282 -10.666 -6.718
367 HD2 PRO 50 1HD PRO 50 -6.197 -9.105 -7.459
368 HD3 PRO 50 2HD PRO 50 -7.114 -8.827 -5.964
369 H THR 51 H THR 51 -4.139 -13.216 -4.182
370 HA THR 51 HA THR 51 -2.027 -13.573 -5.943
371 HB THR 51 HB THR 51 -2.407 -14.661 -3.642
372 HG1 THR 51 1HG THR 51 -0.564 -15.130 -4.858
373 HG21 THR 51 1HG2 THR 51 -3.557 -16.652 -3.465
374 HG22 THR 51 2HG2 THR 51 -3.420 -17.008 -5.187
375 HG23 THR 51 3HG2 THR 51 -4.563 -15.788 -4.627
376 H ASP 52 H ASP 52 -5.323 -14.737 -6.132
377 HA ASP 52 HA ASP 52 -4.896 -16.634 -8.203
378 HB2 ASP 52 1HB ASP 52 -6.942 -16.245 -6.568
379 HB3 ASP 52 2HB ASP 52 -7.526 -15.252 -7.900
380 H SER 53 H SER 53 -4.484 -13.392 -8.262
381 HA SER 53 HA SER 53 -5.782 -12.544 -10.601
382 HB2 SER 53 1HB SER 53 -3.368 -11.600 -9.091
383 HB3 SER 53 2HB SER 53 -3.750 -10.889 -10.659
384 HG SER 53 HG SER 53 -4.742 -10.150 -8.413
385 H ASP 54 H ASP 54 -4.095 -11.611 -12.418
386 HA ASP 54 HA ASP 54 -2.666 -13.990 -13.412
387 HB2 ASP 54 1HB ASP 54 -4.858 -13.099 -14.585
388 HB3 ASP 54 2HB ASP 54 -3.746 -11.929 -15.291
389 H ASN 55 H ASN 55 -2.819 -10.444 -13.757
390 HA ASN 55 HA ASN 55 0.058 -10.276 -13.485
391 HB2 ASN 55 1HB ASN 55 0.024 -8.774 -15.653
392 HB3 ASN 55 2HB ASN 55 0.228 -10.519 -15.773
393 HD21 ASN 55 1HD2 ASN 55 -1.546 -7.868 -16.781
394 HD22 ASN 55 2HD2 ASN 55 -2.856 -8.704 -17.536
395 H ASP 56 H ASP 56 0.594 -7.758 -14.100
396 HA ASP 56 HA ASP 56 -0.369 -6.238 -12.017
397 HB2 ASP 56 1HB ASP 56 0.318 -4.247 -13.574
398 HB3 ASP 56 2HB ASP 56 1.546 -5.365 -12.987
399 H SER 57 H SER 57 -1.782 -6.779 -15.153
400 HA SER 57 HA SER 57 -3.477 -4.707 -15.556
401 HB2 SER 57 1HB SER 57 -3.392 -6.663 -17.031
402 HB3 SER 57 2HB SER 57 -4.196 -7.639 -15.802
403 HG SER 57 HG SER 57 -5.870 -5.834 -16.007
404 H ASP 58 H ASP 58 -3.561 -6.932 -12.924
405 HA ASP 58 HA ASP 58 -6.253 -6.156 -12.127
406 HB2 ASP 58 1HB ASP 58 -4.269 -8.033 -10.826
407 HB3 ASP 58 2HB ASP 58 -5.922 -7.766 -10.278
408 H TYR 59 H TYR 59 -2.952 -6.006 -10.807
409 HA TYR 59 HA TYR 59 -3.219 -4.807 -8.439
410 HB2 TYR 59 1HB TYR 59 -1.270 -4.403 -10.645
411 HB3 TYR 59 2HB TYR 59 -1.238 -3.236 -9.328
412 HD1 TYR 59 1HD TYR 59 -1.840 -4.911 -6.997
413 HD2 TYR 59 2HD TYR 59 0.631 -5.713 -10.367
414 HE1 TYR 59 1HE TYR 59 -0.509 -6.473 -5.642
415 HE2 TYR 59 2HE TYR 59 1.969 -7.278 -9.021
416 HH TYR 59 HH TYR 59 2.286 -8.181 -7.022
417 H LYS 60 H LYS 60 -4.359 -3.176 -7.657
418 HA LYS 60 HA LYS 60 -5.347 -1.107 -9.462
419 HB2 LYS 60 1HB LYS 60 -6.142 -2.154 -6.793
420 HB3 LYS 60 2HB LYS 60 -6.505 -0.468 -7.137
421 HG2 LYS 60 1HG LYS 60 -7.858 -1.051 -8.999
422 HG3 LYS 60 2HG LYS 60 -7.319 -2.731 -8.942
423 HD2 LYS 60 1HD LYS 60 -8.304 -2.616 -6.503
424 HD3 LYS 60 2HD LYS 60 -9.246 -1.287 -7.184
425 HE2 LYS 60 1HE LYS 60 -9.816 -2.926 -9.074
426 HE3 LYS 60 2HE LYS 60 -9.214 -4.179 -7.990
427 HZ1 LYS 60 1HZ LYS 60 -11.658 -3.784 -7.889
428 HZ2 LYS 60 2HZ LYS 60 -11.342 -2.256 -7.236
429 HZ3 LYS 60 3HZ LYS 60 -10.868 -3.648 -6.399
430 H LYS 61 H LYS 61 -5.658 1.080 -8.005
431 HA LYS 61 HA LYS 61 -3.139 1.734 -6.685
432 HB2 LYS 61 1HB LYS 61 -2.930 2.222 -9.162
433 HB3 LYS 61 2HB LYS 61 -4.185 3.436 -8.949
434 HG2 LYS 61 1HG LYS 61 -2.809 4.731 -7.514
435 HG3 LYS 61 2HG LYS 61 -1.609 3.441 -7.398
436 HD2 LYS 61 1HD LYS 61 -0.803 5.139 -8.908
437 HD3 LYS 61 2HD LYS 61 -1.184 3.682 -9.829
438 HE2 LYS 61 1HE LYS 61 -3.217 4.626 -10.630
439 HE3 LYS 61 2HE LYS 61 -3.096 5.987 -9.516
440 HZ1 LYS 61 1HZ LYS 61 -0.878 5.627 -11.364
441 HZ2 LYS 61 2HZ LYS 61 -1.621 7.048 -10.829
442 HZ3 LYS 61 3HZ LYS 61 -2.344 6.124 -12.048
443 H ASP 62 H ASP 62 -3.657 2.682 -4.838
444 HA ASP 62 HA ASP 62 -6.077 4.361 -4.745
445 HB2 ASP 62 1HB ASP 62 -4.903 2.435 -2.783
446 HB3 ASP 62 2HB ASP 62 -5.799 3.824 -2.175
447 H MET 63 H MET 63 -5.472 6.427 -4.860
448 HA MET 63 HA MET 63 -2.933 7.361 -3.938
449 HB2 MET 63 1HB MET 63 -4.561 8.281 -5.813
450 HB3 MET 63 2HB MET 63 -5.187 9.241 -4.479
451 HG2 MET 63 1HG MET 63 -2.656 9.799 -4.101
452 HG3 MET 63 2HG MET 63 -2.522 9.329 -5.794
453 HE1 MET 63 1HE MET 63 -3.302 11.796 -3.246
454 HE2 MET 63 2HE MET 63 -4.085 13.163 -4.039
455 HE3 MET 63 3HE MET 63 -5.037 11.757 -3.559
456 H VAL 64 H VAL 64 -2.481 8.728 -2.200
457 HA VAL 64 HA VAL 64 -4.601 9.195 -0.240
458 HB VAL 64 HB VAL 64 -1.970 7.996 0.611
459 HG11 VAL 64 1HG1 VAL 64 -4.561 8.071 2.127
460 HG12 VAL 64 2HG1 VAL 64 -2.931 7.797 2.743
461 HG13 VAL 64 3HG1 VAL 64 -3.406 9.402 2.185
462 HG21 VAL 64 1HG2 VAL 64 -4.488 6.678 -0.266
463 HG22 VAL 64 2HG2 VAL 64 -2.814 6.164 -0.471
464 HG23 VAL 64 3HG2 VAL 64 -3.606 5.983 1.094
465 H GLU 65 H GLU 65 -4.259 10.956 1.102
466 HA GLU 65 HA GLU 65 -2.927 13.141 0.162
467 HB2 GLU 65 1HB GLU 65 -3.057 12.772 3.125
468 HB3 GLU 65 2HB GLU 65 -3.417 14.198 2.162
469 HG2 GLU 65 1HG GLU 65 -5.125 11.814 2.716
470 HG3 GLU 65 2HG GLU 65 -5.496 13.526 2.909
471 H GLY 66 H GLY 66 -0.955 14.168 0.571
472 HA2 GLY 66 1HA GLY 66 1.287 12.441 0.797
473 HA3 GLY 66 2HA GLY 66 1.337 14.197 0.746
474 H ASP 67 H ASP 67 -0.542 14.221 3.127
475 HA ASP 67 HA ASP 67 1.565 14.093 5.128
476 HB2 ASP 67 1HB ASP 67 -1.186 15.294 5.040
477 HB3 ASP 67 2HB ASP 67 -0.360 15.072 6.580
478 H ARG 68 H ARG 68 -0.821 12.069 3.956
479 HA ARG 68 HA ARG 68 -1.396 10.773 6.495
480 HB2 ARG 68 1HB ARG 68 -3.035 11.116 4.500
481 HB3 ARG 68 2HB ARG 68 -2.230 9.710 3.817
482 HG2 ARG 68 1HG ARG 68 -4.140 8.895 4.916
483 HG3 ARG 68 2HG ARG 68 -2.778 8.509 5.970
484 HD2 ARG 68 1HD ARG 68 -4.276 9.365 7.486
485 HD3 ARG 68 2HD ARG 68 -3.360 10.812 7.064
486 HE ARG 68 HE ARG 68 -6.111 10.207 6.336
487 HH11 ARG 68 1HH1 ARG 68 -3.339 12.279 5.964
488 HH12 ARG 68 2HH1 ARG 68 -4.253 13.607 5.328
489 HH21 ARG 68 1HH2 ARG 68 -7.326 11.947 5.500
490 HH22 ARG 68 2HH2 ARG 68 -6.521 13.417 5.066
491 H TYR 69 H TYR 69 -0.468 8.949 7.218
492 HA TYR 69 HA TYR 69 1.467 7.611 5.442
493 HB2 TYR 69 1HB TYR 69 1.633 8.431 8.300
494 HB3 TYR 69 2HB TYR 69 2.424 6.929 7.835
495 HD1 TYR 69 2HD TYR 69 2.086 10.094 5.903
496 HD2 TYR 69 1HD TYR 69 4.702 7.423 7.933
497 HE1 TYR 69 2HE TYR 69 4.019 11.374 5.082
498 HE2 TYR 69 1HE TYR 69 6.643 8.696 7.118
499 HH TYR 69 HH TYR 69 6.234 11.499 4.977
500 H TRP 70 H TRP 70 -1.492 7.173 6.370
501 HA TRP 70 HA TRP 70 -1.208 4.277 6.570
502 HB2 TRP 70 1HB TRP 70 -2.535 4.021 8.498
503 HB3 TRP 70 2HB TRP 70 -1.428 5.331 8.901
504 HD1 TRP 70 HD TRP 70 -2.461 7.763 9.215
505 HE1 TRP 70 1HE TRP 70 -4.874 8.590 9.561
506 HE3 TRP 70 3HE TRP 70 -4.975 3.534 7.824
507 HZ2 TRP 70 2HZ TRP 70 -7.496 7.582 9.282
508 HZ3 TRP 70 3HZ TRP 70 -7.435 3.548 7.893
509 HH2 TRP 70 HH TRP 70 -8.667 5.531 8.607
510 H HIS 71 H HIS 71 -2.919 3.127 5.704
511 HA HIS 71 HA HIS 71 -5.300 4.541 4.827
512 HB2 HIS 71 1HB HIS 71 -3.676 4.879 2.988
513 HB3 HIS 71 2HB HIS 71 -3.500 3.132 2.844
514 HD1 HIS 71 1HD HIS 71 -6.158 5.809 2.458
515 HD2 HIS 71 2HD HIS 71 -5.306 1.947 1.184
516 HE1 HIS 71 1HE HIS 71 -7.919 5.261 0.748
517 HE2 HIS 71 2HE HIS 71 -7.434 2.889 0.054
518 H SER 72 H SER 72 -7.063 3.217 4.533
519 HA SER 72 HA SER 72 -6.632 0.372 5.171
520 HB2 SER 72 1HB SER 72 -8.787 0.352 6.252
521 HB3 SER 72 2HB SER 72 -7.870 1.717 6.891
522 HG SER 72 HG SER 72 -9.032 3.064 5.448
523 H ILE 73 H ILE 73 -6.738 -0.761 3.340
524 HA ILE 73 HA ILE 73 -8.269 0.052 1.073
525 HB ILE 73 HB ILE 73 -7.098 -2.683 1.571
526 HG12 ILE 73 1HG1 ILE 73 -5.702 -0.477 0.081
527 HG13 ILE 73 2HG1 ILE 73 -5.527 -0.631 1.825
528 HG21 ILE 73 1HG2 ILE 73 -6.886 -2.558 -0.972
529 HG22 ILE 73 2HG2 ILE 73 -8.499 -2.789 -0.301
530 HG23 ILE 73 3HG2 ILE 73 -8.003 -1.197 -0.873
531 HD11 ILE 73 1HD1 ILE 73 -3.695 -1.766 0.971
532 HD12 ILE 73 2HD1 ILE 73 -4.845 -3.053 1.335
533 HD13 ILE 73 3HD1 ILE 73 -4.634 -2.503 -0.327
534 H SER 74 H SER 74 -10.021 -1.106 0.101
535 HA SER 74 HA SER 74 -11.532 -2.892 1.858
536 HB2 SER 74 1HB SER 74 -12.858 -0.534 0.514
537 HB3 SER 74 2HB SER 74 -13.561 -1.640 1.693
538 HG SER 74 HG SER 74 -12.861 -0.334 3.166
539 H HIS 75 H HIS 75 -13.630 -3.584 0.585
540 HA HIS 75 HA HIS 75 -14.492 -4.765 -1.157
541 HB2 HIS 75 1HB HIS 75 -12.883 -2.698 -2.642
542 HB3 HIS 75 2HB HIS 75 -13.793 -3.942 -3.494
543 HD1 HIS 75 1HD HIS 75 -16.106 -3.304 -4.078
544 HD2 HIS 75 2HD HIS 75 -14.690 -1.154 -0.817
545 HE1 HIS 75 1HE HIS 75 -17.931 -1.670 -3.506
546 HE2 HIS 75 2HE HIS 75 -17.016 -0.323 -1.584
547 H LEU 76 H LEU 76 -12.354 -5.924 0.153
548 HA LEU 76 HA LEU 76 -10.771 -7.150 -2.002
549 HB2 LEU 76 1HB LEU 76 -10.247 -7.292 0.958
550 HB3 LEU 76 2HB LEU 76 -9.165 -7.776 -0.347
551 HG LEU 76 HG LEU 76 -10.014 -4.925 -0.187
552 HD11 LEU 76 1HD1 LEU 76 -8.631 -6.327 1.929
553 HD12 LEU 76 2HD1 LEU 76 -9.231 -4.670 1.877
554 HD13 LEU 76 3HD1 LEU 76 -7.634 -5.050 1.231
555 HD21 LEU 76 1HD2 LEU 76 -8.696 -5.439 -2.058
556 HD22 LEU 76 2HD2 LEU 76 -7.604 -6.456 -1.118
557 HD23 LEU 76 3HD2 LEU 76 -7.580 -4.705 -0.907
558 H GLN 77 H GLN 77 -10.039 -9.502 -1.111
559 HA GLN 77 HA GLN 77 -12.562 -10.962 -0.854
560 HB2 GLN 77 1HB GLN 77 -9.814 -12.015 -1.541
561 HB3 GLN 77 2HB GLN 77 -11.328 -12.904 -1.640
562 HG2 GLN 77 1HG GLN 77 -11.083 -12.331 -3.820
563 HG3 GLN 77 2HG GLN 77 -11.985 -10.927 -3.251
564 HE21 GLN 77 1HE2 GLN 77 -10.689 -10.518 -5.477
565 HE22 GLN 77 2HE2 GLN 77 -9.243 -9.603 -5.242
566 HA PRO 78 HA PRO 78 -11.758 -11.962 3.365
567 HB2 PRO 78 1HB PRO 78 -13.440 -14.081 3.588
568 HB3 PRO 78 2HB PRO 78 -14.006 -12.408 3.521
569 HG2 PRO 78 1HG PRO 78 -13.885 -14.456 1.341
570 HG3 PRO 78 2HG PRO 78 -15.179 -13.305 1.725
571 HD2 PRO 78 1HD PRO 78 -13.402 -12.885 -0.274
572 HD3 PRO 78 2HD PRO 78 -14.111 -11.558 0.668
573 H GLU 79 H GLU 79 -10.724 -13.527 4.650
574 HA GLU 79 HA GLU 79 -8.901 -14.930 4.895
575 HB2 GLU 79 1HB GLU 79 -9.720 -17.333 4.088
576 HB3 GLU 79 2HB GLU 79 -10.374 -16.555 5.522
577 HG2 GLU 79 1HG GLU 79 -12.318 -15.843 4.337
578 HG3 GLU 79 2HG GLU 79 -11.638 -16.374 2.801
579 H THR 80 H THR 80 -8.701 -13.451 2.467
580 HA THR 80 HA THR 80 -7.514 -15.431 0.639
581 HB THR 80 HB THR 80 -8.298 -12.580 0.009
582 HG1 THR 80 1HG THR 80 -10.197 -13.654 0.228
583 HG21 THR 80 1HG2 THR 80 -6.449 -13.733 -1.335
584 HG22 THR 80 2HG2 THR 80 -7.805 -13.060 -2.239
585 HG23 THR 80 3HG2 THR 80 -7.720 -14.796 -1.939
586 H SER 81 H SER 81 -5.411 -15.653 1.075
587 HA SER 81 HA SER 81 -3.835 -13.449 2.079
588 HB2 SER 81 1HB SER 81 -3.653 -16.024 2.627
589 HB3 SER 81 2HB SER 81 -2.611 -16.036 1.205
590 HG SER 81 HG SER 81 -1.108 -15.218 2.404
591 H TYR 82 H TYR 82 -3.360 -11.914 0.625
592 HA TYR 82 HA TYR 82 -2.019 -12.766 -1.850
593 HB2 TYR 82 1HB TYR 82 -3.079 -10.755 -2.958
594 HB3 TYR 82 2HB TYR 82 -4.181 -12.074 -2.575
595 HD1 TYR 82 1HD TYR 82 -3.066 -8.708 -1.524
596 HD2 TYR 82 2HD TYR 82 -6.003 -11.755 -1.087
597 HE1 TYR 82 1HE TYR 82 -4.500 -7.140 -0.285
598 HE2 TYR 82 2HE TYR 82 -7.445 -10.196 0.153
599 HH TYR 82 HH TYR 82 -7.102 -8.087 1.549
600 H ASP 83 H ASP 83 -0.479 -11.269 -2.698
601 HA ASP 83 HA ASP 83 1.044 -9.965 -0.673
602 HB2 ASP 83 1HB ASP 83 1.339 -9.943 -3.684
603 HB3 ASP 83 2HB ASP 83 2.524 -9.295 -2.553
604 H ILE 84 H ILE 84 1.580 -7.744 -0.524
605 HA ILE 84 HA ILE 84 -0.161 -5.874 -1.955
606 HB ILE 84 HB ILE 84 0.141 -5.930 1.050
607 HG12 ILE 84 1HG1 ILE 84 -2.482 -5.977 -0.376
608 HG13 ILE 84 2HG1 ILE 84 -1.540 -7.462 -0.318
609 HG21 ILE 84 1HG2 ILE 84 -1.232 -3.951 1.103
610 HG22 ILE 84 2HG2 ILE 84 0.183 -3.648 0.097
611 HG23 ILE 84 3HG2 ILE 84 -1.381 -3.964 -0.654
612 HD11 ILE 84 1HD1 ILE 84 -3.245 -6.379 1.652
613 HD12 ILE 84 2HD1 ILE 84 -2.293 -7.862 1.717
614 HD13 ILE 84 3HD1 ILE 84 -1.601 -6.344 2.289
615 H LYS 85 H LYS 85 0.807 -3.996 -2.491
616 HA LYS 85 HA LYS 85 3.283 -3.217 -1.147
617 HB2 LYS 85 1HB LYS 85 4.526 -2.992 -3.185
618 HB3 LYS 85 2HB LYS 85 3.883 -4.628 -3.124
619 HG2 LYS 85 1HG LYS 85 2.375 -4.244 -4.823
620 HG3 LYS 85 2HG LYS 85 2.370 -2.498 -4.566
621 HD2 LYS 85 1HD LYS 85 4.282 -2.176 -5.778
622 HD3 LYS 85 2HD LYS 85 4.921 -3.778 -5.399
623 HE2 LYS 85 1HE LYS 85 2.465 -3.602 -7.065
624 HE3 LYS 85 2HE LYS 85 4.004 -3.167 -7.808
625 HZ1 LYS 85 1HZ LYS 85 3.262 -5.575 -7.975
626 HZ2 LYS 85 2HZ LYS 85 3.660 -5.708 -6.337
627 HZ3 LYS 85 3HZ LYS 85 4.851 -5.297 -7.466
628 H MET 86 H MET 86 4.037 -1.022 -1.990
629 HA MET 86 HA MET 86 1.983 0.657 -3.132
630 HB2 MET 86 1HB MET 86 1.809 2.182 -1.255
631 HB3 MET 86 2HB MET 86 1.344 0.565 -0.745
632 HG2 MET 86 1HG MET 86 3.287 0.262 0.495
633 HG3 MET 86 2HG MET 86 4.132 1.565 -0.337
634 HE1 MET 86 1HE MET 86 1.480 4.113 0.258
635 HE2 MET 86 2HE MET 86 2.956 4.730 0.999
636 HE3 MET 86 3HE MET 86 3.041 3.816 -0.507
637 H GLN 87 H GLN 87 2.796 3.047 -3.051
638 HA GLN 87 HA GLN 87 5.598 3.492 -2.867
639 HB2 GLN 87 1HB GLN 87 6.016 2.431 -4.861
640 HB3 GLN 87 2HB GLN 87 4.422 2.789 -5.511
641 HG2 GLN 87 1HG GLN 87 6.337 5.024 -5.072
642 HG3 GLN 87 2HG GLN 87 6.558 3.958 -6.459
643 HE21 GLN 87 1HE2 GLN 87 4.757 3.738 -7.939
644 HE22 GLN 87 2HE2 GLN 87 3.683 5.071 -8.169
645 H CYS 88 H CYS 88 6.153 5.670 -3.116
646 HA CYS 88 HA CYS 88 3.843 7.478 -3.190
647 HB2 CYS 88 1HB CYS 88 4.990 8.914 -1.779
648 HB3 CYS 88 2HB CYS 88 5.580 7.348 -1.236
649 HG CYS 88 HG CYS 88 7.305 9.229 -3.505
650 H PHE 89 H PHE 89 4.086 9.564 -4.250
651 HA PHE 89 HA PHE 89 6.138 9.717 -6.317
652 HB2 PHE 89 1HB PHE 89 4.520 10.089 -8.102
653 HB3 PHE 89 2HB PHE 89 4.248 8.516 -7.360
654 HD1 PHE 89 1HD PHE 89 2.492 8.537 -5.385
655 HD2 PHE 89 2HD PHE 89 2.707 11.436 -8.495
656 HE1 PHE 89 1HE PHE 89 0.137 9.130 -4.991
657 HE2 PHE 89 2HE PHE 89 0.352 12.033 -8.105
658 HZ PHE 89 HZ PHE 89 -0.936 10.881 -6.350
659 H ASN 90 H ASN 90 6.008 11.846 -7.501
660 HA ASN 90 HA ASN 90 4.630 13.992 -6.148
661 HB2 ASN 90 1HB ASN 90 6.446 15.120 -5.237
662 HB3 ASN 90 2HB ASN 90 6.857 13.441 -4.896
663 HD21 ASN 90 1HD2 ASN 90 8.586 15.765 -5.163
664 HD22 ASN 90 2HD2 ASN 90 9.708 15.387 -6.422
665 H GLU 91 H GLU 91 5.300 16.161 -7.155
666 HA GLU 91 HA GLU 91 4.662 16.330 -9.758
667 HB2 GLU 91 1HB GLU 91 4.943 18.327 -8.459
668 HB3 GLU 91 2HB GLU 91 6.663 18.024 -8.263
669 HG2 GLU 91 1HG GLU 91 6.671 19.635 -9.887
670 HG3 GLU 91 2HG GLU 91 6.706 18.166 -10.860
671 H GLY 92 H GLY 92 7.836 15.504 -8.496
672 HA2 GLY 92 1HA GLY 92 9.222 15.654 -10.974
673 HA3 GLY 92 2HA GLY 92 9.766 14.806 -9.534
674 H GLY 93 H GLY 93 7.844 12.903 -9.178
675 HA2 GLY 93 1HA GLY 93 6.786 11.467 -11.205
676 HA3 GLY 93 2HA GLY 93 8.495 11.076 -11.324
677 H GLU 94 H GLU 94 6.664 9.093 -10.859
678 HA GLU 94 HA GLU 94 6.158 8.509 -8.161
679 HB2 GLU 94 1HB GLU 94 6.485 6.691 -10.551
680 HB3 GLU 94 2HB GLU 94 5.957 6.132 -8.970
681 HG2 GLU 94 1HG GLU 94 3.918 7.176 -9.126
682 HG3 GLU 94 2HG GLU 94 4.500 8.374 -10.281
683 H SER 95 H SER 95 7.193 7.083 -6.714
684 HA SER 95 HA SER 95 10.098 7.044 -7.031
685 HB2 SER 95 1HB SER 95 10.198 6.657 -4.644
686 HB3 SER 95 2HB SER 95 9.075 7.982 -4.950
687 HG SER 95 HG SER 95 8.241 6.450 -3.456
688 H GLU 96 H GLU 96 10.998 5.010 -5.624
689 HA GLU 96 HA GLU 96 10.685 2.782 -7.290
690 HB2 GLU 96 1HB GLU 96 11.815 3.019 -4.501
691 HB3 GLU 96 2HB GLU 96 11.905 1.549 -5.460
692 HG2 GLU 96 1HG GLU 96 12.976 3.163 -7.234
693 HG3 GLU 96 2HG GLU 96 13.331 4.132 -5.805
694 H PHE 97 H PHE 97 10.087 0.554 -6.435
695 HA PHE 97 HA PHE 97 7.382 0.718 -5.385
696 HB2 PHE 97 1HB PHE 97 8.986 -1.506 -6.638
697 HB3 PHE 97 2HB PHE 97 7.405 -1.782 -5.914
698 HD1 PHE 97 1HD PHE 97 8.992 0.612 -8.300
699 HD2 PHE 97 2HD PHE 97 5.622 -1.806 -7.345
700 HE1 PHE 97 1HE PHE 97 7.916 1.285 -10.409
701 HE2 PHE 97 2HE PHE 97 4.541 -1.138 -9.452
702 HZ PHE 97 HZ PHE 97 5.688 0.409 -10.987
703 H SER 98 H SER 98 6.927 0.437 -3.313
704 HA SER 98 HA SER 98 8.801 -0.105 -1.332
705 HB2 SER 98 1HB SER 98 7.015 -0.087 0.196
706 HB3 SER 98 2HB SER 98 6.432 0.915 -1.133
707 HG SER 98 HG SER 98 5.432 -1.404 -0.171
708 H ASN 99 H ASN 99 8.399 -1.974 0.325
709 HA ASN 99 HA ASN 99 9.103 -4.391 -1.006
710 HB2 ASN 99 1HB ASN 99 9.637 -5.211 1.080
711 HB3 ASN 99 2HB ASN 99 9.722 -3.481 1.397
712 HD21 ASN 99 1HD2 ASN 99 7.410 -2.576 1.926
713 HD22 ASN 99 2HD2 ASN 99 6.575 -3.454 3.158
714 H VAL 100 H VAL 100 8.007 -6.503 -0.410
715 HA VAL 100 HA VAL 100 5.142 -6.211 -0.933
716 HB VAL 100 HB VAL 100 6.887 -8.672 -1.112
717 HG11 VAL 100 1HG1 VAL 100 3.992 -8.174 -1.732
718 HG12 VAL 100 2HG1 VAL 100 4.893 -9.495 -2.477
719 HG13 VAL 100 3HG1 VAL 100 4.703 -9.434 -0.724
720 HG21 VAL 100 1HG2 VAL 100 6.649 -8.372 -3.550
721 HG22 VAL 100 2HG2 VAL 100 5.830 -6.837 -3.262
722 HG23 VAL 100 3HG2 VAL 100 7.516 -7.040 -2.786
723 H MET 101 H MET 101 3.787 -6.336 0.721
724 HA MET 101 HA MET 101 4.550 -7.967 3.051
725 HB2 MET 101 1HB MET 101 2.738 -5.556 2.870
726 HB3 MET 101 2HB MET 101 2.937 -6.533 4.319
727 HG2 MET 101 1HG MET 101 5.148 -5.041 2.928
728 HG3 MET 101 2HG MET 101 4.275 -4.472 4.349
729 HE1 MET 101 1HE MET 101 5.772 -6.227 7.263
730 HE2 MET 101 2HE MET 101 4.944 -4.819 6.600
731 HE3 MET 101 3HE MET 101 4.142 -6.391 6.610
732 H ILE 102 H ILE 102 3.441 -9.775 3.351
733 HA ILE 102 HA ILE 102 1.004 -10.243 1.840
734 HB ILE 102 HB ILE 102 2.584 -12.085 3.638
735 HG12 ILE 102 1HG1 ILE 102 2.342 -12.110 0.627
736 HG13 ILE 102 2HG1 ILE 102 3.663 -11.322 1.483
737 HG21 ILE 102 1HG2 ILE 102 -0.062 -12.334 2.931
738 HG22 ILE 102 2HG2 ILE 102 0.770 -13.302 1.715
739 HG23 ILE 102 3HG2 ILE 102 1.003 -13.648 3.429
740 HD11 ILE 102 1HD1 ILE 102 4.708 -13.274 1.247
741 HD12 ILE 102 2HD1 ILE 102 3.685 -13.818 2.577
742 HD13 ILE 102 3HD1 ILE 102 3.212 -14.143 0.909
743 H CYS 103 H CYS 103 -0.658 -9.156 2.789
744 HA CYS 103 HA CYS 103 -1.134 -9.596 5.653
745 HB2 CYS 103 1HB CYS 103 -1.068 -7.241 4.564
746 HB3 CYS 103 2HB CYS 103 -2.665 -7.651 3.948
747 HG CYS 103 HG CYS 103 -2.068 -6.207 6.684
748 H GLU 104 H GLU 104 -2.261 -11.432 5.910
749 HA GLU 104 HA GLU 104 -4.248 -12.292 4.021
750 HB2 GLU 104 1HB GLU 104 -2.720 -13.756 5.506
751 HB3 GLU 104 2HB GLU 104 -3.891 -13.436 6.777
752 HG2 GLU 104 1HG GLU 104 -5.603 -14.248 4.962
753 HG3 GLU 104 2HG GLU 104 -4.178 -15.040 4.292
754 H THR 105 H THR 105 -6.330 -11.775 4.002
755 HA THR 105 HA THR 105 -7.442 -9.962 5.875
756 HB THR 105 HB THR 105 -9.637 -10.574 4.687
757 HG1 THR 105 1HG THR 105 -8.846 -11.552 2.500
758 HG21 THR 105 1HG2 THR 105 -9.141 -9.155 2.869
759 HG22 THR 105 2HG2 THR 105 -7.449 -9.654 2.837
760 HG23 THR 105 3HG2 THR 105 -8.048 -8.650 4.157
761 H LYS 106 H LYS 106 -9.735 -10.503 6.792
762 HA LYS 106 HA LYS 106 -9.362 -12.762 8.581
763 HB2 LYS 106 1HB LYS 106 -11.322 -10.474 8.505
764 HB3 LYS 106 2HB LYS 106 -11.492 -11.813 9.632
765 HG2 LYS 106 1HG LYS 106 -8.976 -11.188 10.175
766 HG3 LYS 106 2HG LYS 106 -9.507 -9.614 9.577
767 HD2 LYS 106 1HD LYS 106 -11.530 -10.013 11.184
768 HD3 LYS 106 2HD LYS 106 -10.431 -11.150 11.968
769 HE2 LYS 106 1HE LYS 106 -8.772 -9.099 11.809
770 HE3 LYS 106 2HE LYS 106 -10.278 -8.185 11.756
771 HZ1 LYS 106 1HZ LYS 106 -10.409 -8.386 13.942
772 HZ2 LYS 106 2HZ LYS 106 -9.002 -9.323 13.984
773 HZ3 LYS 106 3HZ LYS 106 -10.508 -10.069 13.796
774 H ALA 107 H ALA 107 -10.968 -14.370 8.940
775 HA ALA 107 HA ALA 107 -12.100 -15.412 6.559
776 HB1 ALA 107 1HB ALA 107 -13.052 -16.393 9.192
777 HB2 ALA 107 2HB ALA 107 -12.540 -17.292 7.764
778 HB3 ALA 107 3HB ALA 107 -11.335 -16.560 8.824
779 H ARG 108 H ARG 108 -14.123 -15.317 5.749
780 HA ARG 108 HA ARG 108 -15.958 -13.417 6.975
781 HB2 ARG 108 1HB ARG 108 -17.198 -13.581 4.852
782 HB3 ARG 108 2HB ARG 108 -15.507 -13.169 4.598
783 HG2 ARG 108 1HG ARG 108 -15.726 -14.749 2.992
784 HG3 ARG 108 2HG ARG 108 -15.302 -15.803 4.343
785 HD2 ARG 108 1HD ARG 108 -17.692 -16.205 4.756
786 HD3 ARG 108 2HD ARG 108 -18.091 -15.182 3.376
787 HE ARG 108 HE ARG 108 -17.284 -17.905 3.298
788 HH11 ARG 108 1HH1 ARG 108 -17.047 -14.890 1.573
789 HH12 ARG 108 2HH1 ARG 108 -16.824 -15.641 0.028
790 HH21 ARG 108 1HH2 ARG 108 -16.991 -18.906 1.269
791 HH22 ARG 108 2HH2 ARG 108 -16.793 -17.926 -0.144
792 H SER 109 H SER 109 -15.400 -16.475 7.589
793 HA SER 109 HA SER 109 -17.932 -17.731 7.242
794 HB2 SER 109 1HB SER 109 -15.601 -18.404 9.051
795 HB3 SER 109 2HB SER 109 -17.017 -19.433 8.835
796 HG SER 109 HG SER 109 -15.039 -18.731 6.944
797 H GLY 110 H GLY 110 -19.296 -18.493 9.052
798 HA2 GLY 110 1HA GLY 110 -19.988 -18.214 11.362
799 HA3 GLY 110 2HA GLY 110 -19.336 -16.583 11.300
800 HA PRO 111 HA PRO 111 -23.984 -16.730 10.355
801 HB2 PRO 111 1HB PRO 111 -24.860 -15.596 12.661
802 HB3 PRO 111 2HB PRO 111 -24.676 -17.343 12.459
803 HG2 PRO 111 1HG PRO 111 -22.836 -15.384 13.778
804 HG3 PRO 111 2HG PRO 111 -23.317 -17.004 14.315
805 HD2 PRO 111 1HD PRO 111 -20.947 -16.517 13.100
806 HD3 PRO 111 2HD PRO 111 -21.819 -18.052 12.912
807 H SER 112 H SER 112 -21.961 -14.331 11.995
808 HA SER 112 HA SER 112 -23.471 -12.155 10.762
809 HB2 SER 112 1HB SER 112 -21.293 -12.214 12.853
810 HB3 SER 112 2HB SER 112 -21.893 -10.715 12.145
811 HG SER 112 HG SER 112 -23.799 -10.993 13.120
812 H SER 113 H SER 113 -22.153 -10.319 9.846
813 HA SER 113 HA SER 113 -20.472 -11.364 7.764
814 HB2 SER 113 1HB SER 113 -20.455 -9.093 6.898
815 HB3 SER 113 2HB SER 113 -22.097 -9.517 7.382
816 HG SER 113 HG SER 113 -21.405 -8.467 9.475
817 H GLY 114 H GLY 114 -20.019 -9.313 10.614
818 HA2 GLY 114 1HA GLY 114 -17.172 -9.055 10.088
819 HA3 GLY 114 2HA GLY 114 -18.055 -8.346 11.432
Start of MODEL 19
1 H1 GLY 1 H GLY 1 27.421 6.461 -14.752
2 HA2 GLY 1 1HA GLY 1 26.209 6.807 -12.525
3 HA3 GLY 1 2HA GLY 1 26.172 8.172 -13.632
4 H SER 2 H SER 2 24.235 8.073 -11.792
5 HA SER 2 HA SER 2 21.880 6.988 -13.187
6 HB2 SER 2 1HB SER 2 22.305 6.183 -10.847
7 HB3 SER 2 2HB SER 2 22.068 7.838 -10.289
8 HG SER 2 HG SER 2 20.120 6.545 -11.864
9 H SER 3 H SER 3 20.406 8.338 -13.996
10 HA SER 3 HA SER 3 20.776 11.209 -13.537
11 HB2 SER 3 1HB SER 3 20.628 10.002 -15.884
12 HB3 SER 3 2HB SER 3 18.893 10.138 -15.600
13 HG SER 3 HG SER 3 19.640 12.470 -15.042
14 H GLY 4 H GLY 4 19.665 11.752 -11.732
15 HA2 GLY 4 1HA GLY 4 16.933 12.175 -11.789
16 HA3 GLY 4 2HA GLY 4 17.155 10.614 -11.013
17 H SER 5 H SER 5 17.959 14.042 -10.812
18 HA SER 5 HA SER 5 18.980 13.773 -8.118
19 HB2 SER 5 1HB SER 5 18.520 16.161 -9.913
20 HB3 SER 5 2HB SER 5 19.119 16.301 -8.261
21 HG SER 5 HG SER 5 20.537 15.866 -10.404
22 H SER 6 H SER 6 16.275 15.546 -9.625
23 HA SER 6 HA SER 6 15.042 16.053 -7.078
24 HB2 SER 6 1HB SER 6 13.366 17.235 -8.302
25 HB3 SER 6 2HB SER 6 14.899 17.575 -9.103
26 HG SER 6 HG SER 6 12.876 16.831 -10.351
27 H GLY 7 H GLY 7 12.781 15.423 -6.620
28 HA2 GLY 7 1HA GLY 7 11.012 13.913 -6.598
29 HA3 GLY 7 2HA GLY 7 11.765 13.053 -7.933
30 HA PRO 8 HA PRO 8 12.709 11.211 -3.556
31 HB2 PRO 8 1HB PRO 8 10.447 9.825 -2.977
32 HB3 PRO 8 2HB PRO 8 10.722 11.485 -2.434
33 HG2 PRO 8 1HG PRO 8 9.121 10.494 -4.762
34 HG3 PRO 8 2HG PRO 8 8.722 11.761 -3.588
35 HD2 PRO 8 1HD PRO 8 9.663 12.315 -6.066
36 HD3 PRO 8 2HD PRO 8 10.019 13.337 -4.659
37 H VAL 9 H VAL 9 13.403 9.089 -3.326
38 HA VAL 9 HA VAL 9 12.657 7.203 -5.456
39 HB VAL 9 HB VAL 9 15.043 6.430 -5.502
40 HG11 VAL 9 1HG1 VAL 9 14.125 7.824 -7.276
41 HG12 VAL 9 2HG1 VAL 9 14.534 9.277 -6.362
42 HG13 VAL 9 3HG1 VAL 9 15.814 8.229 -6.974
43 HG21 VAL 9 1HG2 VAL 9 15.887 7.294 -3.453
44 HG22 VAL 9 2HG2 VAL 9 16.738 8.129 -4.753
45 HG23 VAL 9 3HG2 VAL 9 15.434 8.942 -3.887
46 H ALA 10 H ALA 10 14.026 7.693 -2.243
47 HA ALA 10 HA ALA 10 14.399 5.095 -1.409
48 HB1 ALA 10 1HB ALA 10 13.862 5.968 0.894
49 HB2 ALA 10 2HB ALA 10 15.099 6.860 0.008
50 HB3 ALA 10 3HB ALA 10 13.462 7.506 0.129
51 H GLY 11 H GLY 11 11.398 6.895 -1.725
52 HA2 GLY 11 1HA GLY 11 9.203 6.237 -1.595
53 HA3 GLY 11 2HA GLY 11 9.789 4.623 -1.968
54 HA PRO 12 HA PRO 12 8.221 5.111 2.523
55 HB2 PRO 12 1HB PRO 12 5.733 4.064 2.233
56 HB3 PRO 12 2HB PRO 12 6.071 5.792 2.084
57 HG2 PRO 12 1HG PRO 12 5.720 3.738 -0.065
58 HG3 PRO 12 2HG PRO 12 5.085 5.391 0.016
59 HD2 PRO 12 1HD PRO 12 7.269 4.739 -1.446
60 HD3 PRO 12 2HD PRO 12 7.078 6.324 -0.669
61 H TYR 13 H TYR 13 7.898 3.346 3.973
62 HA TYR 13 HA TYR 13 8.220 0.679 2.771
63 HB2 TYR 13 1HB TYR 13 10.401 1.199 3.526
64 HB3 TYR 13 2HB TYR 13 9.801 1.927 5.012
65 HD1 TYR 13 1HD TYR 13 8.537 -1.280 3.733
66 HD2 TYR 13 2HD TYR 13 11.191 0.610 6.470
67 HE1 TYR 13 1HE TYR 13 8.848 -3.422 4.902
68 HE2 TYR 13 2HE TYR 13 11.509 -1.527 7.646
69 HH TYR 13 HH TYR 13 9.646 -4.390 6.790
70 H ILE 14 H ILE 14 6.729 -0.713 3.426
71 HA ILE 14 HA ILE 14 4.873 -0.017 5.500
72 HB ILE 14 HB ILE 14 5.122 -2.618 3.987
73 HG12 ILE 14 1HG1 ILE 14 3.118 -0.462 3.398
74 HG13 ILE 14 2HG1 ILE 14 4.732 -0.382 2.700
75 HG21 ILE 14 1HG2 ILE 14 3.803 -3.034 5.880
76 HG22 ILE 14 2HG2 ILE 14 3.000 -1.469 5.770
77 HG23 ILE 14 3HG2 ILE 14 2.645 -2.727 4.586
78 HD11 ILE 14 1HD1 ILE 14 4.370 -2.151 1.319
79 HD12 ILE 14 2HD1 ILE 14 3.210 -2.911 2.410
80 HD13 ILE 14 3HD1 ILE 14 2.727 -1.522 1.437
81 H THR 15 H THR 15 5.461 -0.182 7.565
82 HA THR 15 HA THR 15 7.090 -2.486 8.396
83 HB THR 15 HB THR 15 7.844 -1.247 10.261
84 HG1 THR 15 1HG THR 15 5.503 0.155 9.861
85 HG21 THR 15 1HG2 THR 15 7.902 0.031 7.637
86 HG22 THR 15 2HG2 THR 15 9.209 -0.251 8.787
87 HG23 THR 15 3HG2 THR 15 8.167 1.159 8.966
88 H PHE 16 H PHE 16 3.980 -1.841 8.112
89 HA PHE 16 HA PHE 16 3.238 -3.600 10.278
90 HB2 PHE 16 1HB PHE 16 3.230 -1.235 11.226
91 HB3 PHE 16 2HB PHE 16 1.882 -0.909 10.143
92 HD1 PHE 16 1HD PHE 16 2.986 -3.044 12.955
93 HD2 PHE 16 2HD PHE 16 -0.302 -1.543 10.707
94 HE1 PHE 16 1HE PHE 16 1.430 -3.956 14.629
95 HE2 PHE 16 2HE PHE 16 -1.863 -2.451 12.378
96 HZ PHE 16 HZ PHE 16 -0.998 -3.659 14.342
97 H THR 17 H THR 17 1.658 -4.916 9.631
98 HA THR 17 HA THR 17 -0.252 -4.009 7.609
99 HB THR 17 HB THR 17 0.110 -6.460 6.625
100 HG1 THR 17 1HG THR 17 2.614 -5.716 7.754
101 HG21 THR 17 1HG2 THR 17 2.185 -4.640 5.623
102 HG22 THR 17 2HG2 THR 17 0.579 -3.922 5.749
103 HG23 THR 17 3HG2 THR 17 0.821 -5.377 4.783
104 H ASP 18 H ASP 18 -2.172 -4.335 8.506
105 HA ASP 18 HA ASP 18 -2.713 -6.927 9.770
106 HB2 ASP 18 1HB ASP 18 -2.253 -5.094 11.483
107 HB3 ASP 18 2HB ASP 18 -3.749 -4.344 10.933
108 H ALA 19 H ALA 19 -4.954 -7.530 9.790
109 HA ALA 19 HA ALA 19 -6.417 -6.352 7.542
110 HB1 ALA 19 1HB ALA 19 -7.839 -8.461 7.837
111 HB2 ALA 19 2HB ALA 19 -6.196 -8.655 7.225
112 HB3 ALA 19 3HB ALA 19 -6.556 -9.016 8.913
113 H VAL 20 H VAL 20 -7.711 -4.733 8.159
114 HA VAL 20 HA VAL 20 -8.826 -4.423 10.727
115 HB VAL 20 HB VAL 20 -9.833 -3.203 8.154
116 HG11 VAL 20 1HG1 VAL 20 -10.148 -1.370 10.173
117 HG12 VAL 20 2HG1 VAL 20 -11.417 -2.407 9.519
118 HG13 VAL 20 3HG1 VAL 20 -10.537 -2.895 10.968
119 HG21 VAL 20 1HG2 VAL 20 -8.274 -1.482 8.374
120 HG22 VAL 20 2HG2 VAL 20 -7.896 -1.907 10.043
121 HG23 VAL 20 3HG2 VAL 20 -7.339 -2.936 8.723
122 H ASN 21 H ASN 21 -9.962 -6.028 7.839
123 HA ASN 21 HA ASN 21 -11.996 -7.402 9.315
124 HB2 ASN 21 1HB ASN 21 -12.711 -5.131 7.525
125 HB3 ASN 21 2HB ASN 21 -13.733 -6.564 7.472
126 HD21 ASN 21 1HD2 ASN 21 -14.670 -4.103 8.302
127 HD22 ASN 21 2HD2 ASN 21 -15.047 -4.181 9.986
128 H GLU 22 H GLU 22 -13.499 -8.554 7.493
129 HA GLU 22 HA GLU 22 -11.707 -10.272 6.105
130 HB2 GLU 22 1HB GLU 22 -13.575 -11.557 5.560
131 HB3 GLU 22 2HB GLU 22 -14.039 -10.802 7.078
132 HG2 GLU 22 1HG GLU 22 -15.102 -8.991 5.556
133 HG3 GLU 22 2HG GLU 22 -15.006 -10.236 4.313
134 H THR 23 H THR 23 -13.272 -7.339 5.293
135 HA THR 23 HA THR 23 -12.443 -7.676 2.486
136 HB THR 23 HB THR 23 -14.331 -6.040 1.941
137 HG1 THR 23 1HG THR 23 -15.326 -5.348 3.680
138 HG21 THR 23 1HG2 THR 23 -16.032 -8.117 2.474
139 HG22 THR 23 2HG2 THR 23 -14.458 -8.912 2.501
140 HG23 THR 23 3HG2 THR 23 -14.968 -8.013 1.073
141 H THR 24 H THR 24 -11.480 -6.288 5.134
142 HA THR 24 HA THR 24 -10.594 -3.849 3.768
143 HB THR 24 HB THR 24 -11.394 -3.771 6.670
144 HG1 THR 24 1HG THR 24 -13.412 -3.588 6.080
145 HG21 THR 24 1HG2 THR 24 -9.853 -2.054 5.408
146 HG22 THR 24 2HG2 THR 24 -11.091 -1.492 6.532
147 HG23 THR 24 3HG2 THR 24 -11.392 -1.450 4.795
148 H ILE 25 H ILE 25 -8.540 -3.160 4.293
149 HA ILE 25 HA ILE 25 -7.073 -4.670 6.335
150 HB ILE 25 HB ILE 25 -6.314 -4.413 3.438
151 HG12 ILE 25 1HG1 ILE 25 -6.284 -6.749 5.361
152 HG13 ILE 25 2HG1 ILE 25 -7.561 -6.417 4.195
153 HG21 ILE 25 1HG2 ILE 25 -4.258 -3.842 4.157
154 HG22 ILE 25 2HG2 ILE 25 -4.556 -4.418 5.796
155 HG23 ILE 25 3HG2 ILE 25 -4.127 -5.562 4.524
156 HD11 ILE 25 1HD1 ILE 25 -6.243 -8.065 3.203
157 HD12 ILE 25 2HD1 ILE 25 -5.741 -6.565 2.422
158 HD13 ILE 25 3HD1 ILE 25 -4.739 -7.280 3.685
159 H MET 26 H MET 26 -5.578 -3.506 7.442
160 HA MET 26 HA MET 26 -5.203 -0.704 6.610
161 HB2 MET 26 1HB MET 26 -6.409 -0.600 8.614
162 HB3 MET 26 2HB MET 26 -5.532 -1.950 9.322
163 HG2 MET 26 1HG MET 26 -3.745 -0.657 9.925
164 HG3 MET 26 2HG MET 26 -4.038 0.532 8.658
165 HE1 MET 26 1HE MET 26 -5.976 3.050 9.635
166 HE2 MET 26 2HE MET 26 -4.524 3.187 10.627
167 HE3 MET 26 3HE MET 26 -4.427 2.478 9.015
168 H LEU 27 H LEU 27 -3.200 -0.122 6.105
169 HA LEU 27 HA LEU 27 -0.949 -1.580 7.307
170 HB2 LEU 27 1HB LEU 27 0.114 -1.938 5.296
171 HB3 LEU 27 2HB LEU 27 -1.574 -2.231 4.884
172 HG LEU 27 HG LEU 27 -0.360 0.464 4.411
173 HD11 LEU 27 1HD1 LEU 27 0.744 -0.135 2.532
174 HD12 LEU 27 2HD1 LEU 27 -0.345 -1.478 2.184
175 HD13 LEU 27 3HD1 LEU 27 0.916 -1.659 3.404
176 HD21 LEU 27 1HD2 LEU 27 -2.129 -0.508 2.392
177 HD22 LEU 27 2HD2 LEU 27 -2.337 0.859 3.487
178 HD23 LEU 27 3HD2 LEU 27 -2.869 -0.750 3.975
179 H LYS 28 H LYS 28 0.783 -0.357 7.880
180 HA LYS 28 HA LYS 28 0.587 2.535 7.344
181 HB2 LYS 28 1HB LYS 28 1.712 1.087 9.747
182 HB3 LYS 28 2HB LYS 28 1.860 2.820 9.481
183 HG2 LYS 28 1HG LYS 28 -0.337 3.222 9.943
184 HG3 LYS 28 2HG LYS 28 -0.856 1.618 9.421
185 HD2 LYS 28 1HD LYS 28 -0.087 0.617 11.426
186 HD3 LYS 28 2HD LYS 28 0.802 2.069 11.893
187 HE2 LYS 28 1HE LYS 28 -1.355 3.271 12.082
188 HE3 LYS 28 2HE LYS 28 -2.194 1.762 11.726
189 HZ1 LYS 28 1HZ LYS 28 -1.632 0.867 13.746
190 HZ2 LYS 28 2HZ LYS 28 -1.824 2.493 14.171
191 HZ3 LYS 28 3HZ LYS 28 -0.273 1.854 13.949
192 H TRP 29 H TRP 29 2.307 3.574 6.496
193 HA TRP 29 HA TRP 29 4.740 1.977 6.029
194 HB2 TRP 29 1HB TRP 29 5.069 3.398 4.000
195 HB3 TRP 29 2HB TRP 29 3.621 2.397 3.936
196 HD1 TRP 29 HD TRP 29 4.699 6.062 4.366
197 HE1 TRP 29 1HE TRP 29 2.690 7.570 3.806
198 HE3 TRP 29 3HE TRP 29 1.113 2.461 3.809
199 HZ2 TRP 29 2HZ TRP 29 -0.053 7.272 3.207
200 HZ3 TRP 29 3HZ TRP 29 -1.179 3.157 3.243
201 HH2 TRP 29 HH TRP 29 -1.747 5.513 2.949
202 H MET 30 H MET 30 6.759 3.187 5.897
203 HA MET 30 HA MET 30 6.709 5.578 7.619
204 HB2 MET 30 1HB MET 30 8.867 4.939 8.478
205 HB3 MET 30 2HB MET 30 7.772 3.572 8.639
206 HG2 MET 30 1HG MET 30 8.771 2.443 6.812
207 HG3 MET 30 2HG MET 30 9.692 3.873 6.351
208 HE1 MET 30 1HE MET 30 11.125 5.095 8.163
209 HE2 MET 30 2HE MET 30 12.373 4.202 9.031
210 HE3 MET 30 3HE MET 30 12.330 4.169 7.268
211 H TYR 31 H TYR 31 8.727 6.967 7.314
212 HA TYR 31 HA TYR 31 9.530 7.055 4.487
213 HB2 TYR 31 1HB TYR 31 7.754 8.701 4.782
214 HB3 TYR 31 2HB TYR 31 8.606 9.408 6.151
215 HD1 TYR 31 2HD TYR 31 10.608 10.767 5.803
216 HD2 TYR 31 1HD TYR 31 8.454 9.143 2.512
217 HE1 TYR 31 2HE TYR 31 11.783 12.303 4.283
218 HE2 TYR 31 1HE TYR 31 9.625 10.674 0.983
219 HH TYR 31 HH TYR 31 11.020 13.305 1.726
220 H ILE 32 H ILE 32 11.648 7.336 4.175
221 HA ILE 32 HA ILE 32 13.336 7.772 6.519
222 HB ILE 32 HB ILE 32 14.061 6.892 3.722
223 HG12 ILE 32 1HG1 ILE 32 14.666 4.774 5.156
224 HG13 ILE 32 2HG1 ILE 32 13.507 5.456 6.292
225 HG21 ILE 32 1HG2 ILE 32 16.221 7.118 4.217
226 HG22 ILE 32 2HG2 ILE 32 15.703 8.107 5.581
227 HG23 ILE 32 3HG2 ILE 32 16.012 6.386 5.807
228 HD11 ILE 32 1HD1 ILE 32 12.413 3.847 4.890
229 HD12 ILE 32 2HD1 ILE 32 11.815 5.459 4.495
230 HD13 ILE 32 3HD1 ILE 32 12.983 4.667 3.437
231 HA PRO 33 HA PRO 33 14.025 11.993 5.345
232 HB2 PRO 33 1HB PRO 33 16.016 12.494 7.121
233 HB3 PRO 33 2HB PRO 33 14.314 12.399 7.588
234 HG2 PRO 33 1HG PRO 33 16.460 10.325 7.820
235 HG3 PRO 33 2HG PRO 33 15.211 10.778 8.994
236 HD2 PRO 33 1HD PRO 33 14.998 8.591 7.412
237 HD3 PRO 33 2HD PRO 33 13.586 9.531 7.936
238 H ALA 34 H ALA 34 16.707 9.704 5.710
239 HA ALA 34 HA ALA 34 18.862 10.902 4.704
240 HB1 ALA 34 1HB ALA 34 19.564 8.822 3.709
241 HB2 ALA 34 2HB ALA 34 18.700 8.487 5.210
242 HB3 ALA 34 3HB ALA 34 17.898 8.244 3.658
243 H SER 35 H SER 35 16.866 9.142 2.346
244 HA SER 35 HA SER 35 17.705 11.001 0.276
245 HB2 SER 35 1HB SER 35 16.442 8.302 0.333
246 HB3 SER 35 2HB SER 35 16.140 9.316 -1.077
247 HG SER 35 HG SER 35 18.163 7.830 -0.827
248 H ASN 36 H ASN 36 16.262 12.483 1.882
249 HA ASN 36 HA ASN 36 13.526 12.545 0.809
250 HB2 ASN 36 1HB ASN 36 13.513 12.459 3.201
251 HB3 ASN 36 2HB ASN 36 14.725 13.731 3.315
252 HD21 ASN 36 1HD2 ASN 36 12.857 14.395 4.812
253 HD22 ASN 36 2HD2 ASN 36 11.696 15.469 4.116
254 H ASN 37 H ASN 37 16.405 14.512 1.350
255 HA ASN 37 HA ASN 37 17.055 16.543 0.544
256 HB2 ASN 37 1HB ASN 37 16.663 14.980 -1.558
257 HB3 ASN 37 2HB ASN 37 15.377 16.135 -1.894
258 HD21 ASN 37 1HD2 ASN 37 16.912 16.297 -3.814
259 HD22 ASN 37 2HD2 ASN 37 18.119 17.529 -3.715
260 H ASN 38 H ASN 38 14.469 16.356 2.026
261 HA ASN 38 HA ASN 38 12.685 17.656 2.592
262 HB2 ASN 38 1HB ASN 38 14.400 19.847 1.402
263 HB3 ASN 38 2HB ASN 38 13.078 20.067 2.543
264 HD21 ASN 38 1HD2 ASN 38 15.937 20.748 2.719
265 HD22 ASN 38 2HD2 ASN 38 16.505 19.984 4.160
266 H THR 39 H THR 39 12.669 16.451 -0.074
267 HA THR 39 HA THR 39 11.369 18.393 -1.789
268 HB THR 39 HB THR 39 12.891 16.441 -2.556
269 HG1 THR 39 1HG THR 39 12.078 17.162 -4.363
270 HG21 THR 39 1HG2 THR 39 11.422 14.775 -1.261
271 HG22 THR 39 2HG2 THR 39 11.924 14.332 -2.893
272 HG23 THR 39 3HG2 THR 39 10.292 14.935 -2.606
273 HA PRO 40 HA PRO 40 7.328 17.554 -0.168
274 HB2 PRO 40 1HB PRO 40 5.934 18.900 -2.069
275 HB3 PRO 40 2HB PRO 40 6.817 19.712 -0.770
276 HG2 PRO 40 1HG PRO 40 7.633 19.250 -3.613
277 HG3 PRO 40 2HG PRO 40 7.812 20.708 -2.621
278 HD2 PRO 40 1HD PRO 40 9.854 18.985 -3.061
279 HD3 PRO 40 2HD PRO 40 9.686 19.900 -1.549
280 H ILE 41 H ILE 41 5.932 15.916 -0.445
281 HA ILE 41 HA ILE 41 6.029 14.447 -2.983
282 HB ILE 41 HB ILE 41 4.787 13.465 -0.423
283 HG12 ILE 41 1HG1 ILE 41 7.634 13.017 -1.342
284 HG13 ILE 41 2HG1 ILE 41 7.166 14.115 -0.049
285 HG21 ILE 41 1HG2 ILE 41 4.105 12.111 -2.194
286 HG22 ILE 41 2HG2 ILE 41 5.673 12.204 -2.993
287 HG23 ILE 41 3HG2 ILE 41 5.490 11.251 -1.521
288 HD11 ILE 41 1HD1 ILE 41 7.142 12.462 1.418
289 HD12 ILE 41 2HD1 ILE 41 6.064 11.503 0.402
290 HD13 ILE 41 3HD1 ILE 41 7.809 11.416 0.165
291 H HIS 42 H HIS 42 4.220 14.005 -4.173
292 HA HIS 42 HA HIS 42 2.017 15.782 -3.926
293 HB2 HIS 42 1HB HIS 42 2.745 13.531 -5.749
294 HB3 HIS 42 2HB HIS 42 1.075 14.091 -5.733
295 HD1 HIS 42 1HD HIS 42 1.888 14.670 -8.312
296 HD2 HIS 42 2HD HIS 42 3.301 17.088 -5.244
297 HE1 HIS 42 1HE HIS 42 2.661 16.788 -9.427
298 HE2 HIS 42 2HE HIS 42 3.591 18.201 -7.561
299 H GLY 43 H GLY 43 2.483 12.349 -3.217
300 HA2 GLY 43 1HA GLY 43 0.546 12.303 -1.179
301 HA3 GLY 43 2HA GLY 43 -0.187 11.694 -2.656
302 H PHE 44 H PHE 44 -0.453 9.611 -1.871
303 HA PHE 44 HA PHE 44 1.978 8.002 -1.903
304 HB2 PHE 44 1HB PHE 44 0.066 8.171 0.414
305 HB3 PHE 44 2HB PHE 44 1.025 6.722 0.127
306 HD1 PHE 44 2HD PHE 44 3.618 7.458 -0.495
307 HD2 PHE 44 1HD PHE 44 0.904 9.507 2.064
308 HE1 PHE 44 2HE PHE 44 5.515 8.477 0.695
309 HE2 PHE 44 1HE PHE 44 2.796 10.530 3.258
310 HZ PHE 44 HZ PHE 44 5.106 10.014 2.575
311 H TYR 45 H TYR 45 1.654 6.433 -3.319
312 HA TYR 45 HA TYR 45 -1.074 5.592 -3.939
313 HB2 TYR 45 1HB TYR 45 1.566 5.332 -5.346
314 HB3 TYR 45 2HB TYR 45 0.213 4.302 -5.798
315 HD1 TYR 45 2HD TYR 45 -2.097 5.927 -5.815
316 HD2 TYR 45 1HD TYR 45 1.875 7.025 -6.873
317 HE1 TYR 45 2HE TYR 45 -2.981 7.716 -7.254
318 HE2 TYR 45 1HE TYR 45 1.002 8.817 -8.314
319 HH TYR 45 HH TYR 45 -0.913 9.548 -9.388
320 H ILE 46 H ILE 46 -1.687 3.391 -4.010
321 HA ILE 46 HA ILE 46 0.085 1.498 -2.640
322 HB ILE 46 HB ILE 46 -2.811 1.923 -1.894
323 HG12 ILE 46 1HG1 ILE 46 -0.549 2.233 0.029
324 HG13 ILE 46 2HG1 ILE 46 -0.854 3.540 -1.110
325 HG21 ILE 46 1HG2 ILE 46 -2.407 0.237 -0.177
326 HG22 ILE 46 2HG2 ILE 46 -2.130 -0.420 -1.789
327 HG23 ILE 46 3HG2 ILE 46 -0.760 0.019 -0.769
328 HD11 ILE 46 1HD1 ILE 46 -1.977 3.969 0.977
329 HD12 ILE 46 2HD1 ILE 46 -3.166 3.677 -0.293
330 HD13 ILE 46 3HD1 ILE 46 -2.805 2.415 0.884
331 H TYR 47 H TYR 47 0.197 -0.372 -3.687
332 HA TYR 47 HA TYR 47 -1.893 -0.995 -5.659
333 HB2 TYR 47 1HB TYR 47 0.999 -1.855 -5.491
334 HB3 TYR 47 2HB TYR 47 -0.145 -2.501 -6.662
335 HD1 TYR 47 2HD TYR 47 0.708 0.931 -5.432
336 HD2 TYR 47 1HD TYR 47 0.200 -1.655 -8.772
337 HE1 TYR 47 2HE TYR 47 1.212 2.800 -6.948
338 HE2 TYR 47 1HE TYR 47 0.703 0.207 -10.298
339 HH TYR 47 HH TYR 47 0.916 2.468 -10.437
340 H TYR 48 H TYR 48 -2.907 -2.962 -5.678
341 HA TYR 48 HA TYR 48 -2.089 -5.072 -3.879
342 HB2 TYR 48 1HB TYR 48 -4.341 -5.148 -2.762
343 HB3 TYR 48 2HB TYR 48 -3.345 -3.770 -2.309
344 HD1 TYR 48 2HD TYR 48 -3.931 -1.514 -3.040
345 HD2 TYR 48 1HD TYR 48 -6.375 -4.851 -4.039
346 HE1 TYR 48 2HE TYR 48 -5.757 0.014 -3.658
347 HE2 TYR 48 1HE TYR 48 -8.206 -3.332 -4.660
348 HH TYR 48 HH TYR 48 -7.919 0.168 -4.219
349 H ARG 49 H ARG 49 -3.264 -7.050 -4.212
350 HA ARG 49 HA ARG 49 -5.336 -7.341 -6.097
351 HB2 ARG 49 1HB ARG 49 -4.217 -8.182 -8.015
352 HB3 ARG 49 2HB ARG 49 -3.422 -6.667 -7.607
353 HG2 ARG 49 1HG ARG 49 -1.586 -7.941 -7.965
354 HG3 ARG 49 2HG ARG 49 -1.833 -8.304 -6.256
355 HD2 ARG 49 1HD ARG 49 -3.126 -10.312 -6.920
356 HD3 ARG 49 2HD ARG 49 -2.737 -9.966 -8.604
357 HE ARG 49 HE ARG 49 -1.057 -11.234 -6.701
358 HH11 ARG 49 1HH1 ARG 49 -1.009 -9.051 -9.413
359 HH12 ARG 49 2HH1 ARG 49 0.612 -9.452 -9.874
360 HH21 ARG 49 1HH2 ARG 49 1.078 -11.771 -7.298
361 HH22 ARG 49 2HH2 ARG 49 1.798 -11.000 -8.671
362 HA PRO 50 HA PRO 50 -5.421 -11.189 -3.946
363 HB2 PRO 50 1HB PRO 50 -7.231 -12.477 -5.506
364 HB3 PRO 50 2HB PRO 50 -7.678 -11.196 -4.372
365 HG2 PRO 50 1HG PRO 50 -7.253 -11.043 -7.331
366 HG3 PRO 50 2HG PRO 50 -8.530 -10.307 -6.345
367 HD2 PRO 50 1HD PRO 50 -6.378 -8.914 -7.218
368 HD3 PRO 50 2HD PRO 50 -7.180 -8.563 -5.673
369 H THR 51 H THR 51 -4.501 -13.199 -4.055
370 HA THR 51 HA THR 51 -2.522 -13.713 -5.946
371 HB THR 51 HB THR 51 -2.949 -14.764 -3.578
372 HG1 THR 51 1HG THR 51 -1.069 -15.204 -4.703
373 HG21 THR 51 1HG2 THR 51 -4.253 -16.595 -3.413
374 HG22 THR 51 2HG2 THR 51 -3.766 -17.204 -4.995
375 HG23 THR 51 3HG2 THR 51 -5.019 -15.970 -4.873
376 H ASP 52 H ASP 52 -5.908 -14.299 -6.076
377 HA ASP 52 HA ASP 52 -5.859 -16.407 -7.999
378 HB2 ASP 52 1HB ASP 52 -7.940 -14.618 -6.835
379 HB3 ASP 52 2HB ASP 52 -8.309 -15.431 -8.354
380 H SER 53 H SER 53 -5.335 -13.054 -8.170
381 HA SER 53 HA SER 53 -6.349 -12.297 -10.617
382 HB2 SER 53 1HB SER 53 -3.988 -11.472 -9.002
383 HB3 SER 53 2HB SER 53 -4.053 -10.927 -10.678
384 HG SER 53 HG SER 53 -5.827 -10.380 -8.561
385 H ASP 54 H ASP 54 -4.779 -11.739 -12.548
386 HA ASP 54 HA ASP 54 -3.655 -14.306 -13.409
387 HB2 ASP 54 1HB ASP 54 -5.454 -12.861 -14.704
388 HB3 ASP 54 2HB ASP 54 -4.025 -12.009 -15.283
389 H ASN 55 H ASN 55 -2.880 -10.861 -13.207
390 HA ASN 55 HA ASN 55 -0.122 -11.368 -12.777
391 HB2 ASN 55 1HB ASN 55 0.454 -9.944 -14.952
392 HB3 ASN 55 2HB ASN 55 0.342 -11.702 -14.998
393 HD21 ASN 55 1HD2 ASN 55 -0.223 -11.804 -17.137
394 HD22 ASN 55 2HD2 ASN 55 -1.755 -11.271 -17.733
395 H ASP 56 H ASP 56 1.097 -9.087 -13.289
396 HA ASP 56 HA ASP 56 0.299 -7.307 -11.371
397 HB2 ASP 56 1HB ASP 56 1.663 -6.430 -13.917
398 HB3 ASP 56 2HB ASP 56 1.827 -5.734 -12.307
399 H SER 57 H SER 57 -0.705 -7.427 -14.742
400 HA SER 57 HA SER 57 -1.900 -5.047 -15.187
401 HB2 SER 57 1HB SER 57 -2.923 -7.810 -15.850
402 HB3 SER 57 2HB SER 57 -3.691 -6.342 -16.453
403 HG SER 57 HG SER 57 -1.824 -5.832 -17.549
404 H ASP 58 H ASP 58 -2.872 -7.414 -12.858
405 HA ASP 58 HA ASP 58 -5.498 -6.324 -12.422
406 HB2 ASP 58 1HB ASP 58 -3.820 -8.368 -10.979
407 HB3 ASP 58 2HB ASP 58 -5.364 -7.817 -10.335
408 H TYR 59 H TYR 59 -2.373 -6.183 -10.755
409 HA TYR 59 HA TYR 59 -2.834 -4.955 -8.437
410 HB2 TYR 59 1HB TYR 59 -0.740 -4.481 -10.507
411 HB3 TYR 59 2HB TYR 59 -0.814 -3.377 -9.138
412 HD1 TYR 59 1HD TYR 59 -1.465 -5.065 -6.890
413 HD2 TYR 59 2HD TYR 59 1.074 -5.883 -10.205
414 HE1 TYR 59 1HE TYR 59 -0.206 -6.675 -5.521
415 HE2 TYR 59 2HE TYR 59 2.339 -7.495 -8.846
416 HH TYR 59 HH TYR 59 1.268 -8.469 -5.678
417 H LYS 60 H LYS 60 -3.791 -3.184 -7.668
418 HA LYS 60 HA LYS 60 -4.791 -1.212 -9.594
419 HB2 LYS 60 1HB LYS 60 -5.709 -2.205 -6.946
420 HB3 LYS 60 2HB LYS 60 -6.055 -0.525 -7.336
421 HG2 LYS 60 1HG LYS 60 -7.415 -1.094 -9.134
422 HG3 LYS 60 2HG LYS 60 -6.744 -2.722 -9.249
423 HD2 LYS 60 1HD LYS 60 -7.736 -2.867 -6.779
424 HD3 LYS 60 2HD LYS 60 -8.826 -1.642 -7.432
425 HE2 LYS 60 1HE LYS 60 -9.988 -3.505 -8.028
426 HE3 LYS 60 2HE LYS 60 -8.946 -3.368 -9.444
427 HZ1 LYS 60 1HZ LYS 60 -8.330 -5.440 -8.992
428 HZ2 LYS 60 2HZ LYS 60 -9.049 -5.423 -7.461
429 HZ3 LYS 60 3HZ LYS 60 -7.479 -4.827 -7.664
430 H LYS 61 H LYS 61 -5.181 1.000 -8.177
431 HA LYS 61 HA LYS 61 -2.745 1.695 -6.740
432 HB2 LYS 61 1HB LYS 61 -2.428 2.085 -9.256
433 HB3 LYS 61 2HB LYS 61 -3.600 3.385 -9.082
434 HG2 LYS 61 1HG LYS 61 -2.167 4.531 -7.521
435 HG3 LYS 61 2HG LYS 61 -1.020 3.189 -7.542
436 HD2 LYS 61 1HD LYS 61 -0.157 4.899 -8.967
437 HD3 LYS 61 2HD LYS 61 -0.733 3.588 -9.998
438 HE2 LYS 61 1HE LYS 61 -2.730 4.797 -10.527
439 HE3 LYS 61 2HE LYS 61 -2.356 6.038 -9.333
440 HZ1 LYS 61 1HZ LYS 61 -1.789 6.254 -11.927
441 HZ2 LYS 61 2HZ LYS 61 -0.331 5.608 -11.363
442 HZ3 LYS 61 3HZ LYS 61 -0.923 7.052 -10.712
443 H ASP 62 H ASP 62 -3.567 2.491 -4.918
444 HA ASP 62 HA ASP 62 -5.940 4.217 -5.061
445 HB2 ASP 62 1HB ASP 62 -4.820 2.404 -2.978
446 HB3 ASP 62 2HB ASP 62 -5.709 3.826 -2.437
447 H MET 63 H MET 63 -5.581 6.327 -5.033
448 HA MET 63 HA MET 63 -3.056 7.422 -4.222
449 HB2 MET 63 1HB MET 63 -4.559 8.279 -6.099
450 HB3 MET 63 2HB MET 63 -5.559 8.985 -4.836
451 HG2 MET 63 1HG MET 63 -3.213 9.976 -4.080
452 HG3 MET 63 2HG MET 63 -2.876 9.770 -5.798
453 HE1 MET 63 1HE MET 63 -3.729 12.491 -3.453
454 HE2 MET 63 2HE MET 63 -5.402 12.934 -3.790
455 HE3 MET 63 3HE MET 63 -5.031 11.358 -3.089
456 H VAL 64 H VAL 64 -2.553 8.554 -2.404
457 HA VAL 64 HA VAL 64 -4.671 8.964 -0.406
458 HB VAL 64 HB VAL 64 -1.930 7.963 0.344
459 HG11 VAL 64 1HG1 VAL 64 -2.944 9.035 2.173
460 HG12 VAL 64 2HG1 VAL 64 -4.526 8.344 1.808
461 HG13 VAL 64 3HG1 VAL 64 -3.235 7.315 2.431
462 HG21 VAL 64 1HG2 VAL 64 -2.479 5.886 -0.212
463 HG22 VAL 64 2HG2 VAL 64 -3.945 5.989 0.763
464 HG23 VAL 64 3HG2 VAL 64 -3.975 6.485 -0.929
465 H GLU 65 H GLU 65 -4.049 10.499 1.307
466 HA GLU 65 HA GLU 65 -3.069 12.896 0.258
467 HB2 GLU 65 1HB GLU 65 -3.185 12.125 3.178
468 HB3 GLU 65 2HB GLU 65 -3.163 13.756 2.523
469 HG2 GLU 65 1HG GLU 65 -5.354 11.763 2.003
470 HG3 GLU 65 2HG GLU 65 -5.396 12.973 3.283
471 H GLY 66 H GLY 66 -1.173 14.120 0.859
472 HA2 GLY 66 1HA GLY 66 1.202 12.478 0.788
473 HA3 GLY 66 2HA GLY 66 1.140 14.232 0.703
474 H ASP 67 H ASP 67 -0.651 13.945 3.240
475 HA ASP 67 HA ASP 67 1.621 13.998 5.095
476 HB2 ASP 67 1HB ASP 67 0.276 16.017 5.089
477 HB3 ASP 67 2HB ASP 67 -1.190 15.080 5.364
478 H ARG 68 H ARG 68 -0.943 12.032 4.140
479 HA ARG 68 HA ARG 68 -1.327 10.770 6.726
480 HB2 ARG 68 1HB ARG 68 -3.130 11.122 4.915
481 HB3 ARG 68 2HB ARG 68 -2.391 9.747 4.106
482 HG2 ARG 68 1HG ARG 68 -3.987 8.656 5.289
483 HG3 ARG 68 2HG ARG 68 -2.697 8.647 6.494
484 HD2 ARG 68 1HD ARG 68 -4.610 10.936 6.408
485 HD3 ARG 68 2HD ARG 68 -5.120 9.413 7.134
486 HE ARG 68 HE ARG 68 -2.709 9.960 8.297
487 HH11 ARG 68 1HH1 ARG 68 -5.738 11.646 7.980
488 HH12 ARG 68 2HH1 ARG 68 -5.569 12.500 9.478
489 HH21 ARG 68 1HH2 ARG 68 -2.475 11.078 10.271
490 HH22 ARG 68 2HH2 ARG 68 -3.712 12.177 10.780
491 H TYR 69 H TYR 69 -0.315 8.994 7.424
492 HA TYR 69 HA TYR 69 1.460 7.598 5.534
493 HB2 TYR 69 1HB TYR 69 1.752 8.369 8.395
494 HB3 TYR 69 2HB TYR 69 2.490 6.856 7.881
495 HD1 TYR 69 2HD TYR 69 2.157 9.976 5.897
496 HD2 TYR 69 1HD TYR 69 4.779 7.373 8.007
497 HE1 TYR 69 2HE TYR 69 4.089 11.222 5.021
498 HE2 TYR 69 1HE TYR 69 6.718 8.612 7.137
499 HH TYR 69 HH TYR 69 6.367 11.612 5.431
500 H TRP 70 H TRP 70 -1.469 7.203 6.570
501 HA TRP 70 HA TRP 70 -1.220 4.296 6.756
502 HB2 TRP 70 1HB TRP 70 -2.599 4.085 8.671
503 HB3 TRP 70 2HB TRP 70 -1.417 5.327 9.078
504 HD1 TRP 70 HD TRP 70 -2.320 7.695 9.693
505 HE1 TRP 70 1HE TRP 70 -4.674 8.706 9.933
506 HE3 TRP 70 3HE TRP 70 -5.045 3.911 7.598
507 HZ2 TRP 70 2HZ TRP 70 -7.335 7.993 9.317
508 HZ3 TRP 70 3HZ TRP 70 -7.490 4.154 7.461
509 HH2 TRP 70 HH TRP 70 -8.609 6.153 8.304
510 H HIS 71 H HIS 71 -2.907 3.167 5.848
511 HA HIS 71 HA HIS 71 -5.280 4.603 4.966
512 HB2 HIS 71 1HB HIS 71 -3.663 4.901 3.126
513 HB3 HIS 71 2HB HIS 71 -3.475 3.154 3.017
514 HD1 HIS 71 1HD HIS 71 -6.056 5.854 2.449
515 HD2 HIS 71 2HD HIS 71 -5.353 1.876 1.479
516 HE1 HIS 71 1HE HIS 71 -7.825 5.249 0.766
517 HE2 HIS 71 2HE HIS 71 -7.431 2.814 0.258
518 H SER 72 H SER 72 -7.029 3.243 4.413
519 HA SER 72 HA SER 72 -6.660 0.422 5.187
520 HB2 SER 72 1HB SER 72 -8.994 0.499 6.062
521 HB3 SER 72 2HB SER 72 -7.896 1.573 6.929
522 HG SER 72 HG SER 72 -9.557 2.422 4.794
523 H ILE 73 H ILE 73 -6.701 -0.685 3.330
524 HA ILE 73 HA ILE 73 -8.214 0.118 1.049
525 HB ILE 73 HB ILE 73 -7.016 -2.606 1.540
526 HG12 ILE 73 1HG1 ILE 73 -5.603 -0.397 0.080
527 HG13 ILE 73 2HG1 ILE 73 -5.488 -0.506 1.833
528 HG21 ILE 73 1HG2 ILE 73 -6.865 -2.679 -0.904
529 HG22 ILE 73 2HG2 ILE 73 -8.529 -2.473 -0.360
530 HG23 ILE 73 3HG2 ILE 73 -7.632 -1.094 -0.995
531 HD11 ILE 73 1HD1 ILE 73 -3.601 -1.611 0.972
532 HD12 ILE 73 2HD1 ILE 73 -4.705 -2.881 1.502
533 HD13 ILE 73 3HD1 ILE 73 -4.563 -2.494 -0.213
534 H SER 74 H SER 74 -10.025 -0.874 0.128
535 HA SER 74 HA SER 74 -11.497 -2.774 1.810
536 HB2 SER 74 1HB SER 74 -12.906 -0.449 0.512
537 HB3 SER 74 2HB SER 74 -13.497 -1.523 1.780
538 HG SER 74 HG SER 74 -12.888 0.154 2.950
539 H HIS 75 H HIS 75 -13.569 -3.479 0.537
540 HA HIS 75 HA HIS 75 -14.460 -4.564 -1.254
541 HB2 HIS 75 1HB HIS 75 -12.650 -2.924 -3.024
542 HB3 HIS 75 2HB HIS 75 -14.207 -3.639 -3.431
543 HD1 HIS 75 1HD HIS 75 -13.198 -0.504 -3.420
544 HD2 HIS 75 2HD HIS 75 -15.916 -2.372 -0.893
545 HE1 HIS 75 1HE HIS 75 -14.650 1.339 -2.513
546 HE2 HIS 75 2HE HIS 75 -16.231 0.195 -0.921
547 H LEU 76 H LEU 76 -12.420 -5.833 0.072
548 HA LEU 76 HA LEU 76 -10.837 -7.079 -2.076
549 HB2 LEU 76 1HB LEU 76 -10.305 -7.294 0.875
550 HB3 LEU 76 2HB LEU 76 -9.225 -7.703 -0.456
551 HG LEU 76 HG LEU 76 -10.114 -4.872 -0.085
552 HD11 LEU 76 1HD1 LEU 76 -7.567 -5.447 1.163
553 HD12 LEU 76 2HD1 LEU 76 -8.897 -6.275 1.970
554 HD13 LEU 76 3HD1 LEU 76 -8.941 -4.523 1.771
555 HD21 LEU 76 1HD2 LEU 76 -8.061 -6.362 -1.566
556 HD22 LEU 76 2HD2 LEU 76 -7.501 -4.870 -0.810
557 HD23 LEU 76 3HD2 LEU 76 -8.852 -4.832 -1.944
558 H GLN 77 H GLN 77 -10.157 -9.446 -1.115
559 HA GLN 77 HA GLN 77 -12.723 -10.839 -0.889
560 HB2 GLN 77 1HB GLN 77 -10.012 -12.017 -1.507
561 HB3 GLN 77 2HB GLN 77 -11.576 -12.800 -1.692
562 HG2 GLN 77 1HG GLN 77 -11.034 -12.203 -3.853
563 HG3 GLN 77 2HG GLN 77 -12.093 -10.891 -3.338
564 HE21 GLN 77 1HE2 GLN 77 -11.005 -9.825 -5.175
565 HE22 GLN 77 2HE2 GLN 77 -9.519 -8.998 -4.871
566 HA PRO 78 HA PRO 78 -12.008 -11.892 3.327
567 HB2 PRO 78 1HB PRO 78 -13.627 -14.065 3.494
568 HB3 PRO 78 2HB PRO 78 -14.245 -12.410 3.416
569 HG2 PRO 78 1HG PRO 78 -13.994 -14.444 1.233
570 HG3 PRO 78 2HG PRO 78 -15.335 -13.337 1.583
571 HD2 PRO 78 1HD PRO 78 -13.515 -12.851 -0.362
572 HD3 PRO 78 2HD PRO 78 -14.293 -11.551 0.564
573 H GLU 79 H GLU 79 -10.864 -13.344 4.601
574 HA GLU 79 HA GLU 79 -8.981 -14.673 4.842
575 HB2 GLU 79 1HB GLU 79 -9.751 -17.136 4.231
576 HB3 GLU 79 2HB GLU 79 -10.410 -16.280 5.618
577 HG2 GLU 79 1HG GLU 79 -12.421 -15.807 4.514
578 HG3 GLU 79 2HG GLU 79 -11.745 -16.207 2.936
579 H THR 80 H THR 80 -8.665 -13.310 2.480
580 HA THR 80 HA THR 80 -7.635 -15.365 0.635
581 HB THR 80 HB THR 80 -8.339 -12.506 -0.050
582 HG1 THR 80 1HG THR 80 -10.254 -13.570 0.323
583 HG21 THR 80 1HG2 THR 80 -6.610 -14.049 -1.376
584 HG22 THR 80 2HG2 THR 80 -7.708 -12.939 -2.197
585 HG23 THR 80 3HG2 THR 80 -8.108 -14.653 -2.084
586 H SER 81 H SER 81 -5.544 -15.640 1.163
587 HA SER 81 HA SER 81 -3.882 -13.486 2.071
588 HB2 SER 81 1HB SER 81 -3.744 -16.077 2.564
589 HB3 SER 81 2HB SER 81 -2.738 -16.081 1.115
590 HG SER 81 HG SER 81 -2.191 -14.135 3.026
591 H TYR 82 H TYR 82 -3.295 -11.948 0.682
592 HA TYR 82 HA TYR 82 -2.076 -12.777 -1.858
593 HB2 TYR 82 1HB TYR 82 -3.113 -10.688 -2.879
594 HB3 TYR 82 2HB TYR 82 -4.210 -12.027 -2.562
595 HD1 TYR 82 1HD TYR 82 -2.975 -8.852 -1.048
596 HD2 TYR 82 2HD TYR 82 -6.162 -11.653 -1.355
597 HE1 TYR 82 1HE TYR 82 -4.411 -7.352 0.270
598 HE2 TYR 82 2HE TYR 82 -7.608 -10.161 -0.039
599 HH TYR 82 HH TYR 82 -7.418 -7.277 0.340
600 H ASP 83 H ASP 83 -0.592 -11.204 -2.758
601 HA ASP 83 HA ASP 83 1.023 -9.994 -0.724
602 HB2 ASP 83 1HB ASP 83 1.228 -10.397 -3.669
603 HB3 ASP 83 2HB ASP 83 2.209 -9.124 -2.947
604 H ILE 84 H ILE 84 1.645 -7.772 -0.622
605 HA ILE 84 HA ILE 84 -0.123 -5.865 -1.964
606 HB ILE 84 HB ILE 84 0.301 -5.915 1.026
607 HG12 ILE 84 1HG1 ILE 84 -2.370 -6.010 -0.319
608 HG13 ILE 84 2HG1 ILE 84 -1.417 -7.486 -0.211
609 HG21 ILE 84 1HG2 ILE 84 -1.154 -3.958 1.083
610 HG22 ILE 84 2HG2 ILE 84 0.297 -3.642 0.132
611 HG23 ILE 84 3HG2 ILE 84 -1.237 -3.960 -0.679
612 HD11 ILE 84 1HD1 ILE 84 -2.112 -7.794 1.861
613 HD12 ILE 84 2HD1 ILE 84 -1.443 -6.234 2.340
614 HD13 ILE 84 3HD1 ILE 84 -3.096 -6.336 1.736
615 H LYS 85 H LYS 85 0.700 -3.741 -2.091
616 HA LYS 85 HA LYS 85 3.295 -3.128 -0.984
617 HB2 LYS 85 1HB LYS 85 4.526 -2.964 -2.972
618 HB3 LYS 85 2HB LYS 85 3.662 -4.488 -3.133
619 HG2 LYS 85 1HG LYS 85 2.146 -3.592 -4.682
620 HG3 LYS 85 2HG LYS 85 2.603 -1.932 -4.294
621 HD2 LYS 85 1HD LYS 85 3.774 -2.192 -6.234
622 HD3 LYS 85 2HD LYS 85 4.979 -2.795 -5.095
623 HE2 LYS 85 1HE LYS 85 4.726 -4.264 -7.050
624 HE3 LYS 85 2HE LYS 85 4.304 -5.078 -5.545
625 HZ1 LYS 85 1HZ LYS 85 2.187 -3.782 -7.115
626 HZ2 LYS 85 2HZ LYS 85 2.090 -5.113 -6.076
627 HZ3 LYS 85 3HZ LYS 85 2.774 -5.289 -7.614
628 H MET 86 H MET 86 4.053 -0.924 -2.051
629 HA MET 86 HA MET 86 1.963 0.809 -2.951
630 HB2 MET 86 1HB MET 86 1.774 2.240 -1.050
631 HB3 MET 86 2HB MET 86 1.488 0.597 -0.491
632 HG2 MET 86 1HG MET 86 3.450 0.505 0.686
633 HG3 MET 86 2HG MET 86 4.240 1.711 -0.326
634 HE1 MET 86 1HE MET 86 3.051 3.992 -0.625
635 HE2 MET 86 2HE MET 86 1.453 4.095 0.114
636 HE3 MET 86 3HE MET 86 2.797 5.020 0.786
637 H GLN 87 H GLN 87 2.770 3.149 -2.982
638 HA GLN 87 HA GLN 87 5.577 3.616 -2.823
639 HB2 GLN 87 1HB GLN 87 5.984 2.559 -4.815
640 HB3 GLN 87 2HB GLN 87 4.365 2.860 -5.431
641 HG2 GLN 87 1HG GLN 87 6.207 5.165 -5.074
642 HG3 GLN 87 2HG GLN 87 6.457 4.076 -6.437
643 HE21 GLN 87 1HE2 GLN 87 4.846 3.904 -8.023
644 HE22 GLN 87 2HE2 GLN 87 3.644 5.128 -8.225
645 H CYS 88 H CYS 88 6.102 5.789 -3.029
646 HA CYS 88 HA CYS 88 3.800 7.587 -3.014
647 HB2 CYS 88 1HB CYS 88 5.153 9.141 -1.865
648 HB3 CYS 88 2HB CYS 88 5.599 7.576 -1.194
649 HG CYS 88 HG CYS 88 7.529 8.353 -3.770
650 H PHE 89 H PHE 89 4.008 9.707 -4.092
651 HA PHE 89 HA PHE 89 5.792 9.770 -6.397
652 HB2 PHE 89 1HB PHE 89 4.049 10.064 -8.013
653 HB3 PHE 89 2HB PHE 89 3.672 8.608 -7.099
654 HD1 PHE 89 1HD PHE 89 2.032 8.873 -5.126
655 HD2 PHE 89 2HD PHE 89 2.458 11.723 -8.259
656 HE1 PHE 89 1HE PHE 89 -0.195 9.779 -4.601
657 HE2 PHE 89 2HE PHE 89 0.233 12.634 -7.738
658 HZ PHE 89 HZ PHE 89 -1.096 11.662 -5.907
659 H ASN 90 H ASN 90 6.015 11.852 -7.341
660 HA ASN 90 HA ASN 90 4.633 14.099 -6.160
661 HB2 ASN 90 1HB ASN 90 6.365 15.067 -4.991
662 HB3 ASN 90 2HB ASN 90 6.721 13.366 -4.709
663 HD21 ASN 90 1HD2 ASN 90 8.556 15.546 -4.602
664 HD22 ASN 90 2HD2 ASN 90 9.758 15.264 -5.809
665 H GLU 91 H GLU 91 5.363 16.183 -7.146
666 HA GLU 91 HA GLU 91 5.128 16.309 -9.811
667 HB2 GLU 91 1HB GLU 91 5.197 18.343 -8.582
668 HB3 GLU 91 2HB GLU 91 6.836 18.035 -8.026
669 HG2 GLU 91 1HG GLU 91 7.092 19.659 -9.663
670 HG3 GLU 91 2HG GLU 91 7.502 18.156 -10.490
671 H GLY 92 H GLY 92 8.063 15.467 -8.089
672 HA2 GLY 92 1HA GLY 92 9.822 15.616 -10.317
673 HA3 GLY 92 2HA GLY 92 10.122 14.747 -8.819
674 H GLY 93 H GLY 93 7.981 12.943 -8.880
675 HA2 GLY 93 1HA GLY 93 7.231 11.499 -10.953
676 HA3 GLY 93 2HA GLY 93 8.952 11.144 -10.972
677 H GLU 94 H GLU 94 6.821 9.261 -10.606
678 HA GLU 94 HA GLU 94 6.310 8.551 -7.972
679 HB2 GLU 94 1HB GLU 94 6.641 6.807 -10.416
680 HB3 GLU 94 2HB GLU 94 6.038 6.219 -8.872
681 HG2 GLU 94 1HG GLU 94 4.035 7.281 -9.086
682 HG3 GLU 94 2HG GLU 94 4.700 8.573 -10.084
683 H SER 95 H SER 95 7.327 7.280 -6.461
684 HA SER 95 HA SER 95 10.209 7.086 -6.733
685 HB2 SER 95 1HB SER 95 10.145 6.438 -4.336
686 HB3 SER 95 2HB SER 95 9.316 7.964 -4.644
687 HG SER 95 HG SER 95 8.303 5.524 -3.821
688 H GLU 96 H GLU 96 11.008 4.973 -5.361
689 HA GLU 96 HA GLU 96 10.703 2.822 -7.140
690 HB2 GLU 96 1HB GLU 96 11.785 2.926 -4.323
691 HB3 GLU 96 2HB GLU 96 11.871 1.497 -5.343
692 HG2 GLU 96 1HG GLU 96 12.954 4.077 -6.362
693 HG3 GLU 96 2HG GLU 96 13.883 3.149 -5.185
694 H PHE 97 H PHE 97 9.976 0.609 -6.509
695 HA PHE 97 HA PHE 97 7.280 0.769 -5.473
696 HB2 PHE 97 1HB PHE 97 8.893 -1.379 -6.824
697 HB3 PHE 97 2HB PHE 97 7.356 -1.757 -6.053
698 HD1 PHE 97 1HD PHE 97 8.819 0.667 -8.478
699 HD2 PHE 97 2HD PHE 97 5.440 -1.646 -7.316
700 HE1 PHE 97 1HE PHE 97 7.630 1.390 -10.508
701 HE2 PHE 97 2HE PHE 97 4.247 -0.929 -9.344
702 HZ PHE 97 HZ PHE 97 5.342 0.590 -10.944
703 H SER 98 H SER 98 6.936 0.663 -3.360
704 HA SER 98 HA SER 98 8.712 -0.097 -1.398
705 HB2 SER 98 1HB SER 98 6.558 1.127 -1.035
706 HB3 SER 98 2HB SER 98 5.706 -0.406 -1.220
707 HG SER 98 HG SER 98 6.025 -0.186 0.934
708 H ASN 99 H ASN 99 8.660 -1.957 0.069
709 HA ASN 99 HA ASN 99 9.053 -4.374 -1.244
710 HB2 ASN 99 1HB ASN 99 8.582 -5.261 1.242
711 HB3 ASN 99 2HB ASN 99 10.073 -4.434 0.798
712 HD21 ASN 99 1HD2 ASN 99 7.031 -4.177 2.450
713 HD22 ASN 99 2HD2 ASN 99 7.392 -2.725 3.314
714 H VAL 100 H VAL 100 7.820 -6.447 -0.331
715 HA VAL 100 HA VAL 100 4.969 -6.003 -0.928
716 HB VAL 100 HB VAL 100 6.595 -8.517 -1.336
717 HG11 VAL 100 1HG1 VAL 100 4.019 -8.561 -0.819
718 HG12 VAL 100 2HG1 VAL 100 3.893 -8.075 -2.511
719 HG13 VAL 100 3HG1 VAL 100 4.706 -9.581 -2.083
720 HG21 VAL 100 1HG2 VAL 100 5.928 -7.908 -3.795
721 HG22 VAL 100 2HG2 VAL 100 5.818 -6.273 -3.142
722 HG23 VAL 100 3HG2 VAL 100 7.337 -7.163 -3.041
723 H MET 101 H MET 101 3.673 -6.185 0.767
724 HA MET 101 HA MET 101 4.481 -7.943 2.984
725 HB2 MET 101 1HB MET 101 2.508 -5.652 3.015
726 HB3 MET 101 2HB MET 101 3.025 -6.595 4.406
727 HG2 MET 101 1HG MET 101 4.932 -4.994 2.731
728 HG3 MET 101 2HG MET 101 4.082 -4.324 4.121
729 HE1 MET 101 1HE MET 101 5.674 -4.586 6.762
730 HE2 MET 101 2HE MET 101 4.065 -5.117 6.272
731 HE3 MET 101 3HE MET 101 5.166 -6.250 7.058
732 H ILE 102 H ILE 102 3.360 -9.742 3.329
733 HA ILE 102 HA ILE 102 0.914 -10.198 1.812
734 HB ILE 102 HB ILE 102 2.565 -12.090 3.489
735 HG12 ILE 102 1HG1 ILE 102 2.229 -12.084 0.493
736 HG13 ILE 102 2HG1 ILE 102 3.511 -11.178 1.290
737 HG21 ILE 102 1HG2 ILE 102 -0.096 -12.349 2.851
738 HG22 ILE 102 2HG2 ILE 102 0.710 -13.251 1.569
739 HG23 ILE 102 3HG2 ILE 102 1.002 -13.668 3.257
740 HD11 ILE 102 1HD1 ILE 102 3.244 -14.056 0.813
741 HD12 ILE 102 2HD1 ILE 102 4.687 -13.053 0.971
742 HD13 ILE 102 3HD1 ILE 102 3.839 -13.613 2.413
743 H CYS 103 H CYS 103 -0.776 -9.240 2.822
744 HA CYS 103 HA CYS 103 -1.181 -9.832 5.675
745 HB2 CYS 103 1HB CYS 103 -1.078 -7.406 4.838
746 HB3 CYS 103 2HB CYS 103 -2.648 -7.718 4.109
747 HG CYS 103 HG CYS 103 -4.089 -7.736 6.310
748 H GLU 104 H GLU 104 -2.471 -11.521 5.979
749 HA GLU 104 HA GLU 104 -4.410 -12.323 4.004
750 HB2 GLU 104 1HB GLU 104 -2.971 -13.817 5.588
751 HB3 GLU 104 2HB GLU 104 -4.244 -13.498 6.757
752 HG2 GLU 104 1HG GLU 104 -5.777 -14.254 4.735
753 HG3 GLU 104 2HG GLU 104 -4.306 -15.108 4.272
754 H THR 105 H THR 105 -6.435 -11.640 3.896
755 HA THR 105 HA THR 105 -7.549 -9.808 5.721
756 HB THR 105 HB THR 105 -9.743 -10.410 4.492
757 HG1 THR 105 1HG THR 105 -8.891 -11.380 2.323
758 HG21 THR 105 1HG2 THR 105 -9.205 -8.957 2.734
759 HG22 THR 105 2HG2 THR 105 -7.529 -9.503 2.675
760 HG23 THR 105 3HG2 THR 105 -8.085 -8.504 4.018
761 H LYS 106 H LYS 106 -9.842 -10.225 6.643
762 HA LYS 106 HA LYS 106 -9.590 -12.405 8.518
763 HB2 LYS 106 1HB LYS 106 -11.784 -10.347 8.202
764 HB3 LYS 106 2HB LYS 106 -11.601 -11.451 9.559
765 HG2 LYS 106 1HG LYS 106 -9.319 -9.672 8.898
766 HG3 LYS 106 2HG LYS 106 -10.743 -8.958 9.659
767 HD2 LYS 106 1HD LYS 106 -10.454 -10.128 11.612
768 HD3 LYS 106 2HD LYS 106 -9.611 -11.459 10.816
769 HE2 LYS 106 1HE LYS 106 -7.703 -9.850 10.427
770 HE3 LYS 106 2HE LYS 106 -8.536 -8.733 11.508
771 HZ1 LYS 106 1HZ LYS 106 -8.242 -11.388 12.580
772 HZ2 LYS 106 2HZ LYS 106 -7.913 -9.891 13.295
773 HZ3 LYS 106 3HZ LYS 106 -6.766 -10.615 12.285
774 H ALA 107 H ALA 107 -11.348 -13.913 8.953
775 HA ALA 107 HA ALA 107 -12.300 -15.117 6.525
776 HB1 ALA 107 1HB ALA 107 -13.505 -16.381 8.730
777 HB2 ALA 107 2HB ALA 107 -12.113 -16.927 7.794
778 HB3 ALA 107 3HB ALA 107 -11.875 -15.935 9.233
779 H ARG 108 H ARG 108 -14.275 -15.008 5.639
780 HA ARG 108 HA ARG 108 -16.149 -13.082 6.641
781 HB2 ARG 108 1HB ARG 108 -17.514 -13.799 4.661
782 HB3 ARG 108 2HB ARG 108 -15.895 -13.235 4.269
783 HG2 ARG 108 1HG ARG 108 -15.153 -15.342 3.698
784 HG3 ARG 108 2HG ARG 108 -16.394 -16.151 4.658
785 HD2 ARG 108 1HD ARG 108 -17.266 -14.454 2.379
786 HD3 ARG 108 2HD ARG 108 -16.529 -16.014 2.015
787 HE ARG 108 HE ARG 108 -19.154 -15.596 2.913
788 HH11 ARG 108 1HH1 ARG 108 -16.426 -17.680 3.493
789 HH12 ARG 108 2HH1 ARG 108 -17.395 -19.025 3.998
790 HH21 ARG 108 1HH2 ARG 108 -20.440 -17.359 3.576
791 HH22 ARG 108 2HH2 ARG 108 -19.678 -18.841 4.044
792 H SER 109 H SER 109 -15.950 -14.833 8.639
793 HA SER 109 HA SER 109 -18.585 -16.101 8.646
794 HB2 SER 109 1HB SER 109 -16.576 -17.731 8.132
795 HB3 SER 109 2HB SER 109 -16.320 -17.624 9.873
796 HG SER 109 HG SER 109 -18.671 -18.471 8.531
797 H GLY 110 H GLY 110 -18.814 -17.118 11.047
798 HA2 GLY 110 1HA GLY 110 -17.690 -15.258 13.010
799 HA3 GLY 110 2HA GLY 110 -19.439 -15.302 12.839
800 HA PRO 111 HA PRO 111 -18.113 -18.409 16.053
801 HB2 PRO 111 1HB PRO 111 -19.808 -17.523 17.979
802 HB3 PRO 111 2HB PRO 111 -18.185 -16.861 17.751
803 HG2 PRO 111 1HG PRO 111 -20.819 -15.779 16.828
804 HG3 PRO 111 2HG PRO 111 -19.447 -14.918 17.549
805 HD2 PRO 111 1HD PRO 111 -19.924 -14.923 14.884
806 HD3 PRO 111 2HD PRO 111 -18.285 -14.845 15.560
807 H SER 112 H SER 112 -21.235 -17.223 14.948
808 HA SER 112 HA SER 112 -23.056 -18.957 15.896
809 HB2 SER 112 1HB SER 112 -22.701 -17.899 13.100
810 HB3 SER 112 2HB SER 112 -24.065 -18.938 13.511
811 HG SER 112 HG SER 112 -24.958 -17.165 14.183
812 H SER 113 H SER 113 -23.580 -21.070 15.764
813 HA SER 113 HA SER 113 -22.507 -22.794 13.726
814 HB2 SER 113 1HB SER 113 -21.356 -22.751 16.481
815 HB3 SER 113 2HB SER 113 -21.557 -24.313 15.688
816 HG SER 113 HG SER 113 -20.475 -23.010 13.844
817 H GLY 114 H GLY 114 -23.129 -25.149 14.225
818 HA2 GLY 114 1HA GLY 114 -24.639 -26.702 15.147
819 HA3 GLY 114 2HA GLY 114 -25.474 -25.380 15.950
Start of MODEL 20
1 H1 GLY 1 H GLY 1 22.163 20.750 -16.672
2 HA2 GLY 1 1HA GLY 1 24.352 19.015 -16.482
3 HA3 GLY 1 2HA GLY 1 24.026 20.355 -15.392
4 H SER 2 H SER 2 24.102 16.976 -15.761
5 HA SER 2 HA SER 2 23.498 15.218 -14.424
6 HB2 SER 2 1HB SER 2 24.475 17.295 -12.465
7 HB3 SER 2 2HB SER 2 24.056 15.656 -11.965
8 HG SER 2 HG SER 2 25.836 14.941 -12.836
9 H SER 3 H SER 3 21.235 16.407 -15.248
10 HA SER 3 HA SER 3 19.568 16.773 -12.858
11 HB2 SER 3 1HB SER 3 19.446 18.567 -14.538
12 HB3 SER 3 2HB SER 3 18.951 17.394 -15.758
13 HG SER 3 HG SER 3 17.158 18.478 -14.850
14 H GLY 4 H GLY 4 17.620 15.618 -12.608
15 HA2 GLY 4 1HA GLY 4 17.572 13.076 -14.108
16 HA3 GLY 4 2HA GLY 4 17.027 13.263 -12.448
17 H SER 5 H SER 5 15.414 12.044 -14.296
18 HA SER 5 HA SER 5 13.347 14.079 -14.818
19 HB2 SER 5 1HB SER 5 12.524 12.185 -16.461
20 HB3 SER 5 2HB SER 5 13.807 13.295 -16.945
21 HG SER 5 HG SER 5 14.307 10.787 -15.726
22 H SER 6 H SER 6 13.438 13.116 -12.300
23 HA SER 6 HA SER 6 10.880 11.877 -12.025
24 HB2 SER 6 1HB SER 6 13.359 10.268 -11.421
25 HB3 SER 6 2HB SER 6 11.807 9.920 -10.661
26 HG SER 6 HG SER 6 11.153 9.039 -12.451
27 H GLY 7 H GLY 7 10.393 11.443 -9.651
28 HA2 GLY 7 1HA GLY 7 11.562 13.646 -8.099
29 HA3 GLY 7 2HA GLY 7 10.010 12.882 -7.790
30 HA PRO 8 HA PRO 8 12.230 10.907 -4.485
31 HB2 PRO 8 1HB PRO 8 10.128 9.465 -3.552
32 HB3 PRO 8 2HB PRO 8 10.321 11.194 -3.239
33 HG2 PRO 8 1HG PRO 8 8.622 9.818 -5.284
34 HG3 PRO 8 2HG PRO 8 8.223 11.196 -4.242
35 HD2 PRO 8 1HD PRO 8 8.927 11.490 -6.840
36 HD3 PRO 8 2HD PRO 8 9.315 12.702 -5.603
37 H VAL 9 H VAL 9 13.301 9.008 -4.286
38 HA VAL 9 HA VAL 9 12.477 6.787 -6.043
39 HB VAL 9 HB VAL 9 14.874 6.186 -6.241
40 HG11 VAL 9 1HG1 VAL 9 15.272 7.598 -8.020
41 HG12 VAL 9 2HG1 VAL 9 13.529 7.778 -7.810
42 HG13 VAL 9 3HG1 VAL 9 14.626 9.009 -7.183
43 HG21 VAL 9 1HG2 VAL 9 16.287 8.447 -5.710
44 HG22 VAL 9 2HG2 VAL 9 15.130 8.441 -4.379
45 HG23 VAL 9 3HG2 VAL 9 16.187 7.052 -4.635
46 H ALA 10 H ALA 10 13.995 7.729 -3.003
47 HA ALA 10 HA ALA 10 14.690 5.344 -1.885
48 HB1 ALA 10 1HB ALA 10 13.279 7.616 -0.491
49 HB2 ALA 10 2HB ALA 10 14.194 6.334 0.303
50 HB3 ALA 10 3HB ALA 10 15.017 7.475 -0.761
51 H GLY 11 H GLY 11 11.434 6.642 -2.260
52 HA2 GLY 11 1HA GLY 11 9.373 5.654 -2.053
53 HA3 GLY 11 2HA GLY 11 10.204 4.121 -2.275
54 HA PRO 12 HA PRO 12 8.721 4.943 2.230
55 HB2 PRO 12 1HB PRO 12 6.223 3.883 2.151
56 HB3 PRO 12 2HB PRO 12 6.549 5.597 1.865
57 HG2 PRO 12 1HG PRO 12 6.083 3.401 -0.116
58 HG3 PRO 12 2HG PRO 12 5.450 5.057 -0.112
59 HD2 PRO 12 1HD PRO 12 7.550 4.303 -1.646
60 HD3 PRO 12 2HD PRO 12 7.400 5.938 -0.969
61 H TYR 13 H TYR 13 8.354 3.259 3.812
62 HA TYR 13 HA TYR 13 8.723 0.532 2.767
63 HB2 TYR 13 1HB TYR 13 10.888 1.096 3.508
64 HB3 TYR 13 2HB TYR 13 10.277 1.944 4.924
65 HD1 TYR 13 1HD TYR 13 10.585 -1.445 3.423
66 HD2 TYR 13 2HD TYR 13 10.101 0.839 6.980
67 HE1 TYR 13 1HE TYR 13 10.895 -3.482 4.766
68 HE2 TYR 13 2HE TYR 13 10.411 -1.191 8.333
69 HH TYR 13 HH TYR 13 11.664 -4.029 7.130
70 H ILE 14 H ILE 14 6.958 -0.567 3.296
71 HA ILE 14 HA ILE 14 5.160 0.134 5.340
72 HB ILE 14 HB ILE 14 5.492 -2.580 4.059
73 HG12 ILE 14 1HG1 ILE 14 3.454 -0.567 3.198
74 HG13 ILE 14 2HG1 ILE 14 5.105 -0.411 2.609
75 HG21 ILE 14 1HG2 ILE 14 3.237 -1.302 5.585
76 HG22 ILE 14 2HG2 ILE 14 3.036 -2.739 4.585
77 HG23 ILE 14 3HG2 ILE 14 4.115 -2.779 5.980
78 HD11 ILE 14 1HD1 ILE 14 4.975 -2.305 1.342
79 HD12 ILE 14 2HD1 ILE 14 3.748 -3.044 2.373
80 HD13 ILE 14 3HD1 ILE 14 3.304 -1.747 1.263
81 H THR 15 H THR 15 5.059 -0.345 7.447
82 HA THR 15 HA THR 15 6.848 -2.424 8.509
83 HB THR 15 HB THR 15 7.684 -1.091 10.222
84 HG1 THR 15 1HG THR 15 5.715 -0.175 10.917
85 HG21 THR 15 1HG2 THR 15 8.983 0.169 8.922
86 HG22 THR 15 2HG2 THR 15 7.660 1.301 8.637
87 HG23 THR 15 3HG2 THR 15 7.859 -0.105 7.591
88 H PHE 16 H PHE 16 3.775 -1.575 8.085
89 HA PHE 16 HA PHE 16 2.886 -3.110 10.386
90 HB2 PHE 16 1HB PHE 16 2.889 -0.561 10.904
91 HB3 PHE 16 2HB PHE 16 1.485 -0.510 9.842
92 HD1 PHE 16 2HD PHE 16 -0.571 -1.720 10.451
93 HD2 PHE 16 1HD PHE 16 2.755 -1.470 13.095
94 HE1 PHE 16 2HE PHE 16 -2.014 -2.398 12.325
95 HE2 PHE 16 1HE PHE 16 1.318 -2.148 14.973
96 HZ PHE 16 HZ PHE 16 -1.070 -2.612 14.590
97 H THR 17 H THR 17 1.544 -4.602 9.646
98 HA THR 17 HA THR 17 -0.405 -3.896 7.580
99 HB THR 17 HB THR 17 0.156 -6.342 6.676
100 HG1 THR 17 1HG THR 17 1.905 -6.622 8.164
101 HG21 THR 17 1HG2 THR 17 2.121 -4.555 5.542
102 HG22 THR 17 2HG2 THR 17 0.589 -3.723 5.810
103 HG23 THR 17 3HG2 THR 17 0.638 -5.187 4.829
104 H ASP 18 H ASP 18 -2.318 -4.360 8.427
105 HA ASP 18 HA ASP 18 -2.741 -6.973 9.653
106 HB2 ASP 18 1HB ASP 18 -2.211 -5.183 11.433
107 HB3 ASP 18 2HB ASP 18 -3.797 -4.522 11.044
108 H ALA 19 H ALA 19 -4.905 -7.680 9.608
109 HA ALA 19 HA ALA 19 -6.492 -6.393 7.535
110 HB1 ALA 19 1HB ALA 19 -6.626 -9.072 8.883
111 HB2 ALA 19 2HB ALA 19 -7.923 -8.486 7.841
112 HB3 ALA 19 3HB ALA 19 -6.299 -8.701 7.189
113 H VAL 20 H VAL 20 -8.050 -5.003 8.014
114 HA VAL 20 HA VAL 20 -8.997 -4.701 10.720
115 HB VAL 20 HB VAL 20 -9.993 -3.275 8.253
116 HG11 VAL 20 1HG1 VAL 20 -11.445 -2.400 9.696
117 HG12 VAL 20 2HG1 VAL 20 -10.630 -3.145 11.072
118 HG13 VAL 20 3HG1 VAL 20 -10.078 -1.587 10.456
119 HG21 VAL 20 1HG2 VAL 20 -7.917 -2.188 10.122
120 HG22 VAL 20 2HG2 VAL 20 -7.463 -3.177 8.734
121 HG23 VAL 20 3HG2 VAL 20 -8.329 -1.660 8.490
122 H ASN 21 H ASN 21 -10.075 -6.239 7.815
123 HA ASN 21 HA ASN 21 -12.228 -7.524 9.180
124 HB2 ASN 21 1HB ASN 21 -12.790 -5.203 7.403
125 HB3 ASN 21 2HB ASN 21 -13.852 -6.601 7.264
126 HD21 ASN 21 1HD2 ASN 21 -14.634 -4.045 8.150
127 HD22 ASN 21 2HD2 ASN 21 -15.143 -4.184 9.795
128 H GLU 22 H GLU 22 -13.711 -8.569 7.253
129 HA GLU 22 HA GLU 22 -11.940 -10.366 5.942
130 HB2 GLU 22 1HB GLU 22 -13.865 -11.503 5.198
131 HB3 GLU 22 2HB GLU 22 -14.302 -10.847 6.769
132 HG2 GLU 22 1HG GLU 22 -15.216 -8.852 5.354
133 HG3 GLU 22 2HG GLU 22 -15.228 -10.045 4.057
134 H THR 23 H THR 23 -13.395 -7.373 5.058
135 HA THR 23 HA THR 23 -12.336 -7.687 2.326
136 HB THR 23 HB THR 23 -14.156 -6.145 1.555
137 HG1 THR 23 1HG THR 23 -14.590 -5.601 3.942
138 HG21 THR 23 1HG2 THR 23 -14.406 -8.934 2.346
139 HG22 THR 23 2HG2 THR 23 -14.906 -8.134 0.856
140 HG23 THR 23 3HG2 THR 23 -15.964 -8.113 2.266
141 H THR 24 H THR 24 -11.474 -6.383 4.994
142 HA THR 24 HA THR 24 -10.600 -3.868 3.760
143 HB THR 24 HB THR 24 -11.352 -3.906 6.667
144 HG1 THR 24 1HG THR 24 -13.418 -3.388 6.170
145 HG21 THR 24 1HG2 THR 24 -9.960 -2.068 5.745
146 HG22 THR 24 2HG2 THR 24 -11.515 -1.512 6.366
147 HG23 THR 24 3HG2 THR 24 -11.268 -1.680 4.628
148 H ILE 25 H ILE 25 -8.579 -3.129 4.415
149 HA ILE 25 HA ILE 25 -7.107 -4.690 6.396
150 HB ILE 25 HB ILE 25 -6.347 -4.471 3.497
151 HG12 ILE 25 1HG1 ILE 25 -6.452 -6.750 5.484
152 HG13 ILE 25 2HG1 ILE 25 -7.565 -6.469 4.150
153 HG21 ILE 25 1HG2 ILE 25 -4.323 -3.810 4.318
154 HG22 ILE 25 2HG2 ILE 25 -4.571 -4.598 5.875
155 HG23 ILE 25 3HG2 ILE 25 -4.140 -5.558 4.460
156 HD11 ILE 25 1HD1 ILE 25 -4.747 -7.443 4.087
157 HD12 ILE 25 2HD1 ILE 25 -6.188 -8.120 3.328
158 HD13 ILE 25 3HD1 ILE 25 -5.451 -6.657 2.674
159 H MET 26 H MET 26 -5.677 -3.503 7.537
160 HA MET 26 HA MET 26 -5.291 -0.709 6.694
161 HB2 MET 26 1HB MET 26 -6.318 -0.462 8.723
162 HB3 MET 26 2HB MET 26 -5.717 -1.997 9.337
163 HG2 MET 26 1HG MET 26 -3.702 -1.096 10.003
164 HG3 MET 26 2HG MET 26 -3.829 0.269 8.897
165 HE1 MET 26 1HE MET 26 -4.317 2.898 11.095
166 HE2 MET 26 2HE MET 26 -3.967 2.228 9.502
167 HE3 MET 26 3HE MET 26 -5.609 2.729 9.906
168 H LEU 27 H LEU 27 -3.302 -0.051 6.202
169 HA LEU 27 HA LEU 27 -1.001 -1.506 7.295
170 HB2 LEU 27 1HB LEU 27 -0.014 -1.895 5.261
171 HB3 LEU 27 2HB LEU 27 -1.715 -2.158 4.883
172 HG LEU 27 HG LEU 27 -0.423 0.501 4.380
173 HD11 LEU 27 1HD1 LEU 27 0.712 -0.196 2.596
174 HD12 LEU 27 2HD1 LEU 27 -0.612 -1.225 2.052
175 HD13 LEU 27 3HD1 LEU 27 0.535 -1.824 3.249
176 HD21 LEU 27 1HD2 LEU 27 -2.274 0.962 3.149
177 HD22 LEU 27 2HD2 LEU 27 -2.990 -0.198 4.267
178 HD23 LEU 27 3HD2 LEU 27 -2.501 -0.716 2.653
179 H LYS 28 H LYS 28 0.803 -0.274 7.690
180 HA LYS 28 HA LYS 28 0.550 2.612 7.147
181 HB2 LYS 28 1HB LYS 28 1.977 1.434 9.527
182 HB3 LYS 28 2HB LYS 28 1.522 3.112 9.260
183 HG2 LYS 28 1HG LYS 28 -0.706 2.722 9.752
184 HG3 LYS 28 2HG LYS 28 -0.576 0.990 9.439
185 HD2 LYS 28 1HD LYS 28 0.958 0.874 11.447
186 HD3 LYS 28 2HD LYS 28 0.470 2.533 11.805
187 HE2 LYS 28 1HE LYS 28 -1.562 0.366 11.388
188 HE3 LYS 28 2HE LYS 28 -0.789 0.602 12.955
189 HZ1 LYS 28 1HZ LYS 28 -3.017 1.835 12.250
190 HZ2 LYS 28 2HZ LYS 28 -1.901 2.973 11.683
191 HZ3 LYS 28 3HZ LYS 28 -1.894 2.521 13.313
192 H TRP 29 H TRP 29 2.390 3.733 6.544
193 HA TRP 29 HA TRP 29 4.782 2.097 6.013
194 HB2 TRP 29 1HB TRP 29 5.121 3.458 3.951
195 HB3 TRP 29 2HB TRP 29 3.666 2.467 3.904
196 HD1 TRP 29 HD TRP 29 4.754 6.138 4.307
197 HE1 TRP 29 1HE TRP 29 2.765 7.644 3.676
198 HE3 TRP 29 3HE TRP 29 1.179 2.538 3.679
199 HZ2 TRP 29 2HZ TRP 29 0.040 7.346 3.002
200 HZ3 TRP 29 3HZ TRP 29 -1.094 3.232 3.041
201 HH2 TRP 29 HH TRP 29 -1.650 5.587 2.711
202 H MET 30 H MET 30 6.798 3.186 6.083
203 HA MET 30 HA MET 30 6.723 5.640 7.701
204 HB2 MET 30 1HB MET 30 8.777 5.008 8.666
205 HB3 MET 30 2HB MET 30 7.835 3.524 8.596
206 HG2 MET 30 1HG MET 30 9.055 2.769 6.678
207 HG3 MET 30 2HG MET 30 9.900 4.311 6.557
208 HE1 MET 30 1HE MET 30 12.454 4.641 8.375
209 HE2 MET 30 2HE MET 30 10.851 5.321 8.654
210 HE3 MET 30 3HE MET 30 11.676 4.448 9.946
211 H TYR 31 H TYR 31 8.600 7.135 7.368
212 HA TYR 31 HA TYR 31 9.426 7.218 4.544
213 HB2 TYR 31 1HB TYR 31 7.601 8.827 4.926
214 HB3 TYR 31 2HB TYR 31 8.532 9.576 6.217
215 HD1 TYR 31 1HD TYR 31 8.972 8.650 2.618
216 HD2 TYR 31 2HD TYR 31 9.673 11.506 5.693
217 HE1 TYR 31 1HE TYR 31 10.029 10.148 0.978
218 HE2 TYR 31 2HE TYR 31 10.731 13.012 4.061
219 HH TYR 31 HH TYR 31 11.563 13.167 1.968
220 H ILE 32 H ILE 32 11.532 7.573 4.202
221 HA ILE 32 HA ILE 32 13.172 8.428 6.497
222 HB ILE 32 HB ILE 32 14.176 6.679 4.264
223 HG12 ILE 32 1HG1 ILE 32 13.973 4.929 6.274
224 HG13 ILE 32 2HG1 ILE 32 12.616 5.966 6.698
225 HG21 ILE 32 1HG2 ILE 32 15.459 6.270 6.766
226 HG22 ILE 32 2HG2 ILE 32 16.133 6.928 5.277
227 HG23 ILE 32 3HG2 ILE 32 15.384 8.004 6.457
228 HD11 ILE 32 1HD1 ILE 32 11.977 4.026 5.325
229 HD12 ILE 32 2HD1 ILE 32 11.591 5.568 4.560
230 HD13 ILE 32 3HD1 ILE 32 12.993 4.643 4.023
231 HA PRO 33 HA PRO 33 13.841 11.724 3.435
232 HB2 PRO 33 1HB PRO 33 14.613 13.559 5.280
233 HB3 PRO 33 2HB PRO 33 12.917 13.205 4.929
234 HG2 PRO 33 1HG PRO 33 14.634 12.215 7.173
235 HG3 PRO 33 2HG PRO 33 12.954 12.783 7.215
236 HD2 PRO 33 1HD PRO 33 13.603 10.154 7.214
237 HD3 PRO 33 2HD PRO 33 12.123 10.773 6.454
238 H ALA 34 H ALA 34 15.919 10.430 5.935
239 HA ALA 34 HA ALA 34 18.306 11.683 5.562
240 HB1 ALA 34 1HB ALA 34 19.348 9.834 6.496
241 HB2 ALA 34 2HB ALA 34 17.686 9.672 7.064
242 HB3 ALA 34 3HB ALA 34 18.254 8.694 5.711
243 H SER 35 H SER 35 17.641 8.603 3.896
244 HA SER 35 HA SER 35 19.530 9.321 1.815
245 HB2 SER 35 1HB SER 35 18.135 6.834 2.669
246 HB3 SER 35 2HB SER 35 18.616 6.950 0.976
247 HG SER 35 HG SER 35 20.374 7.422 3.150
248 H ASN 36 H ASN 36 17.516 11.094 1.686
249 HA ASN 36 HA ASN 36 16.018 10.246 -0.705
250 HB2 ASN 36 1HB ASN 36 14.480 10.450 1.183
251 HB3 ASN 36 2HB ASN 36 15.063 12.080 1.504
252 HD21 ASN 36 1HD2 ASN 36 13.520 13.449 0.990
253 HD22 ASN 36 2HD2 ASN 36 12.579 13.423 -0.459
254 H ASN 37 H ASN 37 15.232 12.205 -1.984
255 HA ASN 37 HA ASN 37 17.527 13.949 -2.397
256 HB2 ASN 37 1HB ASN 37 16.106 12.655 -4.211
257 HB3 ASN 37 2HB ASN 37 15.073 14.077 -4.100
258 HD21 ASN 37 1HD2 ASN 37 18.397 13.044 -4.656
259 HD22 ASN 37 2HD2 ASN 37 18.823 14.363 -5.688
260 H ASN 38 H ASN 38 15.592 14.251 -0.126
261 HA ASN 38 HA ASN 38 14.381 15.866 0.948
262 HB2 ASN 38 1HB ASN 38 15.378 18.207 0.597
263 HB3 ASN 38 2HB ASN 38 16.455 16.953 1.205
264 HD21 ASN 38 1HD2 ASN 38 15.751 19.111 -1.364
265 HD22 ASN 38 2HD2 ASN 38 17.135 18.758 -2.336
266 H THR 39 H THR 39 13.252 15.013 -1.551
267 HA THR 39 HA THR 39 12.100 17.473 -2.652
268 HB THR 39 HB THR 39 13.034 15.513 -4.094
269 HG1 THR 39 1HG THR 39 11.238 15.959 -5.623
270 HG21 THR 39 1HG2 THR 39 11.493 13.768 -4.628
271 HG22 THR 39 2HG2 THR 39 10.229 14.502 -3.641
272 HG23 THR 39 3HG2 THR 39 11.654 13.802 -2.873
273 HA PRO 40 HA PRO 40 8.344 16.931 -0.408
274 HB2 PRO 40 1HB PRO 40 6.708 18.412 -1.989
275 HB3 PRO 40 2HB PRO 40 7.909 19.131 -0.910
276 HG2 PRO 40 1HG PRO 40 8.070 18.627 -3.856
277 HG3 PRO 40 2HG PRO 40 8.580 20.055 -2.936
278 HD2 PRO 40 1HD PRO 40 10.326 18.164 -3.777
279 HD3 PRO 40 2HD PRO 40 10.558 19.075 -2.272
280 H ILE 41 H ILE 41 6.463 15.727 -0.454
281 HA ILE 41 HA ILE 41 6.043 14.129 -2.891
282 HB ILE 41 HB ILE 41 5.010 13.319 -0.197
283 HG12 ILE 41 1HG1 ILE 41 7.810 12.936 -1.264
284 HG13 ILE 41 2HG1 ILE 41 7.335 13.706 0.246
285 HG21 ILE 41 1HG2 ILE 41 4.198 12.096 -2.118
286 HG22 ILE 41 2HG2 ILE 41 5.849 11.797 -2.660
287 HG23 ILE 41 3HG2 ILE 41 5.266 11.065 -1.165
288 HD11 ILE 41 1HD1 ILE 41 7.895 11.720 1.118
289 HD12 ILE 41 2HD1 ILE 41 6.276 11.255 0.596
290 HD13 ILE 41 3HD1 ILE 41 7.672 10.866 -0.408
291 H HIS 42 H HIS 42 4.062 14.014 -3.818
292 HA HIS 42 HA HIS 42 2.104 15.975 -3.000
293 HB2 HIS 42 1HB HIS 42 2.487 14.202 -5.373
294 HB3 HIS 42 2HB HIS 42 0.878 14.843 -5.054
295 HD1 HIS 42 1HD HIS 42 1.292 16.105 -7.393
296 HD2 HIS 42 2HD HIS 42 3.615 17.364 -4.188
297 HE1 HIS 42 1HE HIS 42 2.206 18.349 -8.066
298 HE2 HIS 42 2HE HIS 42 3.677 19.052 -6.146
299 H GLY 43 H GLY 43 2.477 12.493 -2.949
300 HA2 GLY 43 1HA GLY 43 0.521 12.158 -0.935
301 HA3 GLY 43 2HA GLY 43 -0.162 11.716 -2.492
302 H PHE 44 H PHE 44 -0.383 9.581 -1.521
303 HA PHE 44 HA PHE 44 2.047 8.007 -1.953
304 HB2 PHE 44 1HB PHE 44 0.376 8.050 0.542
305 HB3 PHE 44 2HB PHE 44 1.245 6.591 0.078
306 HD1 PHE 44 2HD PHE 44 3.785 6.933 -0.462
307 HD2 PHE 44 1HD PHE 44 1.429 9.604 1.868
308 HE1 PHE 44 2HE PHE 44 5.829 7.818 0.584
309 HE2 PHE 44 1HE PHE 44 3.469 10.494 2.917
310 HZ PHE 44 HZ PHE 44 5.673 9.600 2.276
311 H TYR 45 H TYR 45 1.652 6.408 -3.322
312 HA TYR 45 HA TYR 45 -1.117 5.642 -3.850
313 HB2 TYR 45 1HB TYR 45 1.461 5.356 -5.355
314 HB3 TYR 45 2HB TYR 45 0.089 4.331 -5.760
315 HD1 TYR 45 2HD TYR 45 -2.192 6.101 -5.525
316 HD2 TYR 45 1HD TYR 45 1.696 6.915 -7.049
317 HE1 TYR 45 2HE TYR 45 -3.123 7.897 -6.925
318 HE2 TYR 45 1HE TYR 45 0.776 8.714 -8.452
319 HH TYR 45 HH TYR 45 -1.244 10.225 -8.417
320 H ILE 46 H ILE 46 -1.800 3.469 -3.901
321 HA ILE 46 HA ILE 46 -0.028 1.512 -2.621
322 HB ILE 46 HB ILE 46 -2.884 2.008 -1.772
323 HG12 ILE 46 1HG1 ILE 46 -0.551 2.223 0.077
324 HG13 ILE 46 2HG1 ILE 46 -0.853 3.554 -1.035
325 HG21 ILE 46 1HG2 ILE 46 -2.280 -0.355 -1.717
326 HG22 ILE 46 2HG2 ILE 46 -0.855 0.025 -0.752
327 HG23 ILE 46 3HG2 ILE 46 -2.466 0.290 -0.086
328 HD11 ILE 46 1HD1 ILE 46 -3.211 3.594 -0.136
329 HD12 ILE 46 2HD1 ILE 46 -2.643 2.503 1.129
330 HD13 ILE 46 3HD1 ILE 46 -1.939 4.112 0.970
331 H TYR 47 H TYR 47 0.025 -0.319 -3.733
332 HA TYR 47 HA TYR 47 -2.165 -0.885 -5.610
333 HB2 TYR 47 1HB TYR 47 0.704 -1.840 -5.594
334 HB3 TYR 47 2HB TYR 47 -0.511 -2.354 -6.759
335 HD1 TYR 47 2HD TYR 47 0.644 0.921 -5.356
336 HD2 TYR 47 1HD TYR 47 -0.278 -1.369 -8.822
337 HE1 TYR 47 2HE TYR 47 1.194 2.855 -6.773
338 HE2 TYR 47 1HE TYR 47 0.271 0.559 -10.248
339 HH TYR 47 HH TYR 47 1.490 2.597 -10.200
340 H TYR 48 H TYR 48 -3.175 -2.864 -5.645
341 HA TYR 48 HA TYR 48 -2.315 -4.981 -3.865
342 HB2 TYR 48 1HB TYR 48 -4.651 -5.069 -2.826
343 HB3 TYR 48 2HB TYR 48 -3.573 -3.801 -2.254
344 HD1 TYR 48 2HD TYR 48 -3.955 -1.460 -2.900
345 HD2 TYR 48 1HD TYR 48 -6.651 -4.543 -4.054
346 HE1 TYR 48 2HE TYR 48 -5.652 0.235 -3.445
347 HE2 TYR 48 1HE TYR 48 -8.354 -2.857 -4.603
348 HH TYR 48 HH TYR 48 -7.695 0.614 -4.213
349 H ARG 49 H ARG 49 -3.364 -6.983 -4.260
350 HA ARG 49 HA ARG 49 -5.480 -7.337 -6.081
351 HB2 ARG 49 1HB ARG 49 -4.363 -8.099 -8.053
352 HB3 ARG 49 2HB ARG 49 -3.715 -6.512 -7.660
353 HG2 ARG 49 1HG ARG 49 -1.773 -7.591 -8.099
354 HG3 ARG 49 2HG ARG 49 -1.914 -7.977 -6.383
355 HD2 ARG 49 1HD ARG 49 -3.149 -10.079 -7.133
356 HD3 ARG 49 2HD ARG 49 -2.552 -9.713 -8.751
357 HE ARG 49 HE ARG 49 -1.057 -10.800 -6.567
358 HH11 ARG 49 1HH1 ARG 49 -0.844 -8.874 -9.459
359 HH12 ARG 49 2HH1 ARG 49 0.830 -9.231 -9.730
360 HH21 ARG 49 1HH2 ARG 49 1.146 -11.279 -6.914
361 HH22 ARG 49 2HH2 ARG 49 1.960 -10.600 -8.282
362 HA PRO 50 HA PRO 50 -5.275 -11.254 -4.074
363 HB2 PRO 50 1HB PRO 50 -7.027 -12.609 -5.645
364 HB3 PRO 50 2HB PRO 50 -7.535 -11.397 -4.463
365 HG2 PRO 50 1HG PRO 50 -7.175 -11.124 -7.423
366 HG3 PRO 50 2HG PRO 50 -8.479 -10.504 -6.392
367 HD2 PRO 50 1HD PRO 50 -6.438 -8.947 -7.255
368 HD3 PRO 50 2HD PRO 50 -7.233 -8.698 -5.687
369 H THR 51 H THR 51 -4.273 -13.228 -4.276
370 HA THR 51 HA THR 51 -2.262 -13.552 -6.166
371 HB THR 51 HB THR 51 -2.472 -14.728 -3.921
372 HG1 THR 51 1HG THR 51 -1.858 -16.510 -6.042
373 HG21 THR 51 1HG2 THR 51 -3.822 -16.540 -3.620
374 HG22 THR 51 2HG2 THR 51 -3.769 -16.999 -5.322
375 HG23 THR 51 3HG2 THR 51 -4.808 -15.675 -4.798
376 H ASP 52 H ASP 52 -5.618 -14.391 -6.322
377 HA ASP 52 HA ASP 52 -5.454 -16.337 -8.381
378 HB2 ASP 52 1HB ASP 52 -7.747 -16.371 -8.322
379 HB3 ASP 52 2HB ASP 52 -7.432 -15.631 -6.755
380 H SER 53 H SER 53 -5.199 -12.919 -8.357
381 HA SER 53 HA SER 53 -6.171 -12.056 -10.745
382 HB2 SER 53 1HB SER 53 -3.780 -11.312 -9.132
383 HB3 SER 53 2HB SER 53 -3.891 -10.663 -10.768
384 HG SER 53 HG SER 53 -6.041 -10.493 -8.942
385 H ASP 54 H ASP 54 -4.861 -11.480 -12.752
386 HA ASP 54 HA ASP 54 -3.622 -13.940 -13.731
387 HB2 ASP 54 1HB ASP 54 -5.543 -12.643 -14.913
388 HB3 ASP 54 2HB ASP 54 -4.260 -11.558 -15.444
389 H ASN 55 H ASN 55 -3.011 -10.436 -13.698
390 HA ASN 55 HA ASN 55 -0.190 -10.866 -13.368
391 HB2 ASN 55 1HB ASN 55 0.377 -9.494 -15.440
392 HB3 ASN 55 2HB ASN 55 -0.145 -11.152 -15.722
393 HD21 ASN 55 1HD2 ASN 55 -0.575 -10.345 -17.885
394 HD22 ASN 55 2HD2 ASN 55 -2.085 -9.569 -18.205
395 H ASP 56 H ASP 56 0.906 -8.523 -13.800
396 HA ASP 56 HA ASP 56 0.103 -6.883 -11.741
397 HB2 ASP 56 1HB ASP 56 1.540 -5.169 -12.696
398 HB3 ASP 56 2HB ASP 56 2.301 -6.748 -12.871
399 H SER 57 H SER 57 -1.278 -7.202 -14.862
400 HA SER 57 HA SER 57 -2.411 -4.687 -15.265
401 HB2 SER 57 1HB SER 57 -2.379 -6.676 -16.865
402 HB3 SER 57 2HB SER 57 -3.782 -7.279 -15.982
403 HG SER 57 HG SER 57 -3.814 -4.638 -16.906
404 H ASP 58 H ASP 58 -3.065 -6.991 -12.860
405 HA ASP 58 HA ASP 58 -5.785 -6.089 -12.372
406 HB2 ASP 58 1HB ASP 58 -4.027 -8.078 -10.922
407 HB3 ASP 58 2HB ASP 58 -5.685 -7.702 -10.460
408 H TYR 59 H TYR 59 -2.604 -5.910 -10.827
409 HA TYR 59 HA TYR 59 -3.083 -4.782 -8.432
410 HB2 TYR 59 1HB TYR 59 -0.958 -4.340 -10.464
411 HB3 TYR 59 2HB TYR 59 -1.035 -3.201 -9.124
412 HD1 TYR 59 1HD TYR 59 -1.804 -4.896 -6.874
413 HD2 TYR 59 2HD TYR 59 0.893 -5.684 -10.069
414 HE1 TYR 59 1HE TYR 59 -0.587 -6.488 -5.447
415 HE2 TYR 59 2HE TYR 59 2.117 -7.278 -8.651
416 HH TYR 59 HH TYR 59 2.115 -8.393 -6.710
417 H LYS 60 H LYS 60 -4.215 -3.123 -7.693
418 HA LYS 60 HA LYS 60 -5.115 -1.062 -9.551
419 HB2 LYS 60 1HB LYS 60 -5.958 -1.875 -6.778
420 HB3 LYS 60 2HB LYS 60 -6.512 -0.373 -7.505
421 HG2 LYS 60 1HG LYS 60 -7.850 -1.431 -9.015
422 HG3 LYS 60 2HG LYS 60 -6.842 -2.879 -9.062
423 HD2 LYS 60 1HD LYS 60 -8.286 -2.193 -6.542
424 HD3 LYS 60 2HD LYS 60 -9.187 -2.910 -7.880
425 HE2 LYS 60 1HE LYS 60 -7.157 -4.602 -7.867
426 HE3 LYS 60 2HE LYS 60 -7.033 -4.074 -6.190
427 HZ1 LYS 60 1HZ LYS 60 -9.251 -4.786 -5.775
428 HZ2 LYS 60 2HZ LYS 60 -8.444 -6.066 -6.530
429 HZ3 LYS 60 3HZ LYS 60 -9.529 -5.113 -7.411
430 H LYS 61 H LYS 61 -5.481 1.135 -8.122
431 HA LYS 61 HA LYS 61 -3.048 1.792 -6.664
432 HB2 LYS 61 1HB LYS 61 -2.672 2.204 -9.150
433 HB3 LYS 61 2HB LYS 61 -3.881 3.475 -9.024
434 HG2 LYS 61 1HG LYS 61 -2.534 4.744 -7.556
435 HG3 LYS 61 2HG LYS 61 -1.422 3.398 -7.300
436 HD2 LYS 61 1HD LYS 61 -0.262 4.734 -8.798
437 HD3 LYS 61 2HD LYS 61 -1.036 3.555 -9.859
438 HE2 LYS 61 1HE LYS 61 -2.848 5.163 -10.288
439 HE3 LYS 61 2HE LYS 61 -2.030 6.341 -9.262
440 HZ1 LYS 61 1HZ LYS 61 -0.855 5.154 -11.717
441 HZ2 LYS 61 2HZ LYS 61 -0.191 6.391 -10.775
442 HZ3 LYS 61 3HZ LYS 61 -1.610 6.667 -11.653
443 H ASP 62 H ASP 62 -3.635 2.870 -4.911
444 HA ASP 62 HA ASP 62 -6.046 4.561 -5.039
445 HB2 ASP 62 1HB ASP 62 -5.081 2.634 -2.989
446 HB3 ASP 62 2HB ASP 62 -5.872 4.097 -2.411
447 H MET 63 H MET 63 -5.626 6.655 -4.903
448 HA MET 63 HA MET 63 -3.068 7.654 -4.138
449 HB2 MET 63 1HB MET 63 -4.756 8.659 -5.810
450 HB3 MET 63 2HB MET 63 -5.550 9.334 -4.393
451 HG2 MET 63 1HG MET 63 -3.128 10.199 -3.857
452 HG3 MET 63 2HG MET 63 -2.919 10.003 -5.595
453 HE1 MET 63 1HE MET 63 -4.539 11.467 -2.720
454 HE2 MET 63 2HE MET 63 -4.031 13.093 -3.175
455 HE3 MET 63 3HE MET 63 -5.732 12.638 -3.281
456 H VAL 64 H VAL 64 -2.424 8.680 -2.291
457 HA VAL 64 HA VAL 64 -4.376 8.927 -0.108
458 HB VAL 64 HB VAL 64 -1.595 7.833 0.305
459 HG11 VAL 64 1HG1 VAL 64 -2.184 7.504 2.528
460 HG12 VAL 64 2HG1 VAL 64 -2.918 9.064 2.151
461 HG13 VAL 64 3HG1 VAL 64 -3.911 7.607 2.189
462 HG21 VAL 64 1HG2 VAL 64 -3.669 5.929 0.842
463 HG22 VAL 64 2HG2 VAL 64 -3.794 6.495 -0.824
464 HG23 VAL 64 3HG2 VAL 64 -2.285 5.792 -0.242
465 H GLU 65 H GLU 65 -3.957 10.557 1.394
466 HA GLU 65 HA GLU 65 -2.905 12.923 0.515
467 HB2 GLU 65 1HB GLU 65 -2.987 11.962 3.381
468 HB3 GLU 65 2HB GLU 65 -2.830 13.637 2.870
469 HG2 GLU 65 1HG GLU 65 -5.189 11.848 2.331
470 HG3 GLU 65 2HG GLU 65 -5.106 13.113 3.556
471 H GLY 66 H GLY 66 -0.986 14.121 1.060
472 HA2 GLY 66 1HA GLY 66 1.385 12.491 0.839
473 HA3 GLY 66 2HA GLY 66 1.317 14.247 0.821
474 H ASP 67 H ASP 67 -0.393 13.717 3.430
475 HA ASP 67 HA ASP 67 1.965 13.678 5.191
476 HB2 ASP 67 1HB ASP 67 -0.704 15.054 5.426
477 HB3 ASP 67 2HB ASP 67 0.341 14.820 6.825
478 H ARG 68 H ARG 68 -0.924 12.049 4.370
479 HA ARG 68 HA ARG 68 -1.275 10.721 6.901
480 HB2 ARG 68 1HB ARG 68 -3.150 11.193 5.312
481 HB3 ARG 68 2HB ARG 68 -2.461 10.004 4.216
482 HG2 ARG 68 1HG ARG 68 -3.158 8.247 5.457
483 HG3 ARG 68 2HG ARG 68 -2.978 9.113 6.984
484 HD2 ARG 68 1HD ARG 68 -5.067 10.024 6.872
485 HD3 ARG 68 2HD ARG 68 -5.081 10.044 5.109
486 HE ARG 68 HE ARG 68 -5.897 7.867 6.840
487 HH11 ARG 68 1HH1 ARG 68 -5.053 8.892 3.622
488 HH12 ARG 68 2HH1 ARG 68 -5.856 7.566 2.849
489 HH21 ARG 68 1HH2 ARG 68 -6.957 6.116 5.834
490 HH22 ARG 68 2HH2 ARG 68 -6.939 5.988 4.108
491 H TYR 69 H TYR 69 -0.137 9.042 7.588
492 HA TYR 69 HA TYR 69 1.365 7.456 5.619
493 HB2 TYR 69 1HB TYR 69 1.871 8.185 8.479
494 HB3 TYR 69 2HB TYR 69 2.587 6.719 7.820
495 HD1 TYR 69 2HD TYR 69 2.055 9.704 5.755
496 HD2 TYR 69 1HD TYR 69 4.857 7.509 8.086
497 HE1 TYR 69 2HE TYR 69 3.888 11.035 4.795
498 HE2 TYR 69 1HE TYR 69 6.697 8.835 7.134
499 HH TYR 69 HH TYR 69 6.122 11.207 4.582
500 H TRP 70 H TRP 70 -1.450 7.050 6.237
501 HA TRP 70 HA TRP 70 -1.319 4.217 6.788
502 HB2 TRP 70 1HB TRP 70 -2.806 4.179 8.656
503 HB3 TRP 70 2HB TRP 70 -1.534 5.334 9.044
504 HD1 TRP 70 HD TRP 70 -2.218 7.971 8.952
505 HE1 TRP 70 1HE TRP 70 -4.495 9.116 9.309
506 HE3 TRP 70 3HE TRP 70 -5.271 3.918 8.329
507 HZ2 TRP 70 2HZ TRP 70 -7.225 8.396 9.326
508 HZ3 TRP 70 3HZ TRP 70 -7.703 4.231 8.532
509 HH2 TRP 70 HH TRP 70 -8.658 6.425 9.021
510 H HIS 71 H HIS 71 -2.885 3.111 5.734
511 HA HIS 71 HA HIS 71 -5.251 4.531 4.776
512 HB2 HIS 71 1HB HIS 71 -3.525 4.731 2.997
513 HB3 HIS 71 2HB HIS 71 -3.438 2.974 2.921
514 HD1 HIS 71 1HD HIS 71 -6.024 5.720 2.445
515 HD2 HIS 71 2HD HIS 71 -5.155 1.874 1.135
516 HE1 HIS 71 1HE HIS 71 -7.727 5.214 0.665
517 HE2 HIS 71 2HE HIS 71 -7.235 2.851 -0.052
518 H SER 72 H SER 72 -7.020 3.208 4.347
519 HA SER 72 HA SER 72 -6.691 0.391 5.153
520 HB2 SER 72 1HB SER 72 -8.912 0.471 6.134
521 HB3 SER 72 2HB SER 72 -7.936 1.775 6.809
522 HG SER 72 HG SER 72 -9.696 2.115 4.614
523 H ILE 73 H ILE 73 -6.727 -0.752 3.316
524 HA ILE 73 HA ILE 73 -8.198 0.015 1.001
525 HB ILE 73 HB ILE 73 -7.090 -2.728 1.585
526 HG12 ILE 73 1HG1 ILE 73 -5.616 -0.517 0.164
527 HG13 ILE 73 2HG1 ILE 73 -5.461 -0.768 1.899
528 HG21 ILE 73 1HG2 ILE 73 -6.833 -2.762 -0.903
529 HG22 ILE 73 2HG2 ILE 73 -8.502 -2.719 -0.336
530 HG23 ILE 73 3HG2 ILE 73 -7.744 -1.253 -0.957
531 HD11 ILE 73 1HD1 ILE 73 -4.714 -2.681 -0.295
532 HD12 ILE 73 2HD1 ILE 73 -3.635 -1.844 0.822
533 HD13 ILE 73 3HD1 ILE 73 -4.723 -3.097 1.419
534 H SER 74 H SER 74 -9.976 -1.060 0.038
535 HA SER 74 HA SER 74 -11.546 -2.813 1.783
536 HB2 SER 74 1HB SER 74 -12.859 -0.518 0.336
537 HB3 SER 74 2HB SER 74 -13.521 -1.524 1.625
538 HG SER 74 HG SER 74 -11.516 -0.528 2.777
539 H HIS 75 H HIS 75 -13.620 -3.504 0.478
540 HA HIS 75 HA HIS 75 -14.441 -4.744 -1.244
541 HB2 HIS 75 1HB HIS 75 -12.752 -2.951 -2.998
542 HB3 HIS 75 2HB HIS 75 -14.156 -3.892 -3.493
543 HD1 HIS 75 1HD HIS 75 -16.480 -2.952 -2.905
544 HD2 HIS 75 2HD HIS 75 -13.325 -0.569 -1.628
545 HE1 HIS 75 1HE HIS 75 -17.518 -0.758 -2.248
546 HE2 HIS 75 2HE HIS 75 -15.580 0.697 -1.559
547 H LEU 76 H LEU 76 -12.421 -5.973 0.048
548 HA LEU 76 HA LEU 76 -10.740 -7.120 -2.079
549 HB2 LEU 76 1HB LEU 76 -10.280 -7.339 0.885
550 HB3 LEU 76 2HB LEU 76 -9.159 -7.743 -0.413
551 HG LEU 76 HG LEU 76 -10.082 -4.922 -0.167
552 HD11 LEU 76 1HD1 LEU 76 -8.458 -4.398 1.502
553 HD12 LEU 76 2HD1 LEU 76 -7.879 -6.064 1.540
554 HD13 LEU 76 3HD1 LEU 76 -9.493 -5.678 2.137
555 HD21 LEU 76 1HD2 LEU 76 -8.346 -6.236 -1.814
556 HD22 LEU 76 2HD2 LEU 76 -7.262 -5.573 -0.591
557 HD23 LEU 76 3HD2 LEU 76 -8.331 -4.501 -1.497
558 H GLN 77 H GLN 77 -10.013 -9.482 -1.200
559 HA GLN 77 HA GLN 77 -12.519 -10.974 -1.099
560 HB2 GLN 77 1HB GLN 77 -9.721 -12.036 -1.506
561 HB3 GLN 77 2HB GLN 77 -11.231 -12.888 -1.802
562 HG2 GLN 77 1HG GLN 77 -10.576 -12.274 -3.921
563 HG3 GLN 77 2HG GLN 77 -11.704 -10.991 -3.485
564 HE21 GLN 77 1HE2 GLN 77 -10.521 -9.904 -5.252
565 HE22 GLN 77 2HE2 GLN 77 -9.084 -9.033 -4.851
566 HA PRO 78 HA PRO 78 -12.076 -11.954 3.176
567 HB2 PRO 78 1HB PRO 78 -13.708 -14.122 3.256
568 HB3 PRO 78 2HB PRO 78 -14.315 -12.467 3.128
569 HG2 PRO 78 1HG PRO 78 -13.934 -14.516 0.979
570 HG3 PRO 78 2HG PRO 78 -15.291 -13.403 1.236
571 HD2 PRO 78 1HD PRO 78 -13.351 -12.936 -0.594
572 HD3 PRO 78 2HD PRO 78 -14.182 -11.628 0.273
573 H GLU 79 H GLU 79 -10.848 -13.262 4.458
574 HA GLU 79 HA GLU 79 -9.030 -14.625 4.832
575 HB2 GLU 79 1HB GLU 79 -9.696 -17.084 4.400
576 HB3 GLU 79 2HB GLU 79 -10.642 -16.148 5.548
577 HG2 GLU 79 1HG GLU 79 -12.362 -15.783 3.892
578 HG3 GLU 79 2HG GLU 79 -11.400 -16.619 2.675
579 H THR 80 H THR 80 -8.691 -13.314 2.408
580 HA THR 80 HA THR 80 -7.562 -15.401 0.663
581 HB THR 80 HB THR 80 -8.218 -12.551 -0.100
582 HG1 THR 80 1HG THR 80 -9.919 -14.449 0.359
583 HG21 THR 80 1HG2 THR 80 -7.790 -13.204 -2.338
584 HG22 THR 80 2HG2 THR 80 -7.704 -14.910 -1.901
585 HG23 THR 80 3HG2 THR 80 -6.430 -13.803 -1.390
586 H SER 81 H SER 81 -5.452 -15.657 0.967
587 HA SER 81 HA SER 81 -3.821 -13.507 2.015
588 HB2 SER 81 1HB SER 81 -3.705 -16.110 2.508
589 HB3 SER 81 2HB SER 81 -2.639 -16.095 1.104
590 HG SER 81 HG SER 81 -1.652 -14.207 2.372
591 H TYR 82 H TYR 82 -3.334 -11.966 0.568
592 HA TYR 82 HA TYR 82 -1.995 -12.818 -1.907
593 HB2 TYR 82 1HB TYR 82 -3.055 -10.752 -2.979
594 HB3 TYR 82 2HB TYR 82 -4.109 -12.135 -2.704
595 HD1 TYR 82 1HD TYR 82 -3.036 -8.957 -1.063
596 HD2 TYR 82 2HD TYR 82 -6.147 -11.799 -1.656
597 HE1 TYR 82 1HE TYR 82 -4.583 -7.519 0.198
598 HE2 TYR 82 2HE TYR 82 -7.702 -10.368 -0.398
599 HH TYR 82 HH TYR 82 -6.646 -7.673 1.434
600 H ASP 83 H ASP 83 -0.485 -11.280 -2.772
601 HA ASP 83 HA ASP 83 1.068 -10.011 -0.753
602 HB2 ASP 83 1HB ASP 83 1.251 -10.073 -3.762
603 HB3 ASP 83 2HB ASP 83 2.382 -9.153 -2.774
604 H ILE 84 H ILE 84 1.546 -7.802 -0.495
605 HA ILE 84 HA ILE 84 -0.236 -5.898 -1.832
606 HB ILE 84 HB ILE 84 0.108 -6.093 1.161
607 HG12 ILE 84 1HG1 ILE 84 -2.525 -6.059 -0.251
608 HG13 ILE 84 2HG1 ILE 84 -1.591 -7.551 -0.249
609 HG21 ILE 84 1HG2 ILE 84 -0.997 -3.935 -0.590
610 HG22 ILE 84 2HG2 ILE 84 -1.618 -4.168 1.043
611 HG23 ILE 84 3HG2 ILE 84 0.089 -3.805 0.792
612 HD11 ILE 84 1HD1 ILE 84 -2.275 -8.019 1.797
613 HD12 ILE 84 2HD1 ILE 84 -1.687 -6.468 2.396
614 HD13 ILE 84 3HD1 ILE 84 -3.317 -6.598 1.735
615 H LYS 85 H LYS 85 0.787 -4.108 -2.460
616 HA LYS 85 HA LYS 85 3.217 -3.267 -1.057
617 HB2 LYS 85 1HB LYS 85 4.541 -3.152 -2.995
618 HB3 LYS 85 2HB LYS 85 3.738 -4.713 -3.105
619 HG2 LYS 85 1HG LYS 85 2.069 -3.701 -4.624
620 HG3 LYS 85 2HG LYS 85 2.987 -2.194 -4.574
621 HD2 LYS 85 1HD LYS 85 3.888 -3.115 -6.457
622 HD3 LYS 85 2HD LYS 85 4.972 -3.814 -5.253
623 HE2 LYS 85 1HE LYS 85 3.312 -5.770 -5.187
624 HE3 LYS 85 2HE LYS 85 2.671 -5.102 -6.688
625 HZ1 LYS 85 1HZ LYS 85 4.644 -6.873 -6.602
626 HZ2 LYS 85 2HZ LYS 85 5.554 -5.448 -6.571
627 HZ3 LYS 85 3HZ LYS 85 4.479 -5.736 -7.845
628 H MET 86 H MET 86 3.958 -1.070 -1.910
629 HA MET 86 HA MET 86 1.820 0.570 -3.000
630 HB2 MET 86 1HB MET 86 1.862 2.173 -1.167
631 HB3 MET 86 2HB MET 86 1.393 0.584 -0.577
632 HG2 MET 86 1HG MET 86 3.419 0.250 0.509
633 HG3 MET 86 2HG MET 86 4.237 1.494 -0.433
634 HE1 MET 86 1HE MET 86 1.514 3.895 0.192
635 HE2 MET 86 2HE MET 86 2.858 4.766 0.931
636 HE3 MET 86 3HE MET 86 3.113 3.842 -0.550
637 H GLN 87 H GLN 87 2.629 2.942 -3.128
638 HA GLN 87 HA GLN 87 5.477 3.293 -3.293
639 HB2 GLN 87 1HB GLN 87 5.256 2.154 -5.372
640 HB3 GLN 87 2HB GLN 87 3.813 3.065 -5.797
641 HG2 GLN 87 1HG GLN 87 5.389 5.120 -5.687
642 HG3 GLN 87 2HG GLN 87 6.670 3.920 -5.845
643 HE21 GLN 87 1HE2 GLN 87 3.908 5.386 -7.382
644 HE22 GLN 87 2HE2 GLN 87 4.265 4.850 -8.985
645 H CYS 88 H CYS 88 6.080 5.442 -3.420
646 HA CYS 88 HA CYS 88 3.898 7.345 -3.014
647 HB2 CYS 88 1HB CYS 88 5.470 8.759 -1.947
648 HB3 CYS 88 2HB CYS 88 5.853 7.132 -1.397
649 HG CYS 88 HG CYS 88 8.067 9.039 -2.122
650 H PHE 89 H PHE 89 4.088 9.511 -3.980
651 HA PHE 89 HA PHE 89 5.630 9.661 -6.449
652 HB2 PHE 89 1HB PHE 89 3.707 10.206 -7.824
653 HB3 PHE 89 2HB PHE 89 3.456 8.634 -7.071
654 HD1 PHE 89 1HD PHE 89 1.831 8.369 -5.261
655 HD2 PHE 89 2HD PHE 89 2.320 12.076 -7.295
656 HE1 PHE 89 1HE PHE 89 -0.324 9.145 -4.360
657 HE2 PHE 89 2HE PHE 89 0.167 12.858 -6.397
658 HZ PHE 89 HZ PHE 89 -1.157 11.392 -4.926
659 H ASN 90 H ASN 90 5.434 11.856 -7.464
660 HA ASN 90 HA ASN 90 4.483 14.010 -5.812
661 HB2 ASN 90 1HB ASN 90 6.466 14.907 -5.058
662 HB3 ASN 90 2HB ASN 90 6.856 13.192 -4.978
663 HD21 ASN 90 1HD2 ASN 90 8.669 15.402 -5.220
664 HD22 ASN 90 2HD2 ASN 90 9.537 15.181 -6.697
665 H GLU 91 H GLU 91 5.203 16.180 -6.805
666 HA GLU 91 HA GLU 91 4.228 16.495 -9.311
667 HB2 GLU 91 1HB GLU 91 4.740 18.398 -7.913
668 HB3 GLU 91 2HB GLU 91 6.463 18.061 -8.015
669 HG2 GLU 91 1HG GLU 91 6.275 18.444 -10.495
670 HG3 GLU 91 2HG GLU 91 4.644 19.040 -10.195
671 H GLY 92 H GLY 92 7.497 15.528 -8.453
672 HA2 GLY 92 1HA GLY 92 8.608 15.769 -11.057
673 HA3 GLY 92 2HA GLY 92 9.275 14.827 -9.732
674 H GLY 93 H GLY 93 7.742 12.815 -9.243
675 HA2 GLY 93 1HA GLY 93 6.337 11.587 -11.329
676 HA3 GLY 93 2HA GLY 93 8.020 11.097 -11.461
677 H GLU 94 H GLU 94 6.783 8.979 -11.122
678 HA GLU 94 HA GLU 94 5.976 8.417 -8.412
679 HB2 GLU 94 1HB GLU 94 6.245 6.732 -10.894
680 HB3 GLU 94 2HB GLU 94 5.853 6.029 -9.331
681 HG2 GLU 94 1HG GLU 94 3.786 7.079 -9.232
682 HG3 GLU 94 2HG GLU 94 4.233 8.285 -10.438
683 H SER 95 H SER 95 6.984 6.935 -6.997
684 HA SER 95 HA SER 95 9.892 6.883 -7.287
685 HB2 SER 95 1HB SER 95 10.000 6.534 -4.932
686 HB3 SER 95 2HB SER 95 8.747 7.749 -5.187
687 HG SER 95 HG SER 95 8.528 5.112 -4.325
688 H GLU 96 H GLU 96 10.809 4.818 -6.000
689 HA GLU 96 HA GLU 96 10.371 2.623 -7.710
690 HB2 GLU 96 1HB GLU 96 11.721 2.731 -5.007
691 HB3 GLU 96 2HB GLU 96 11.807 1.371 -6.119
692 HG2 GLU 96 1HG GLU 96 12.737 4.144 -6.811
693 HG3 GLU 96 2HG GLU 96 13.785 2.897 -6.136
694 H PHE 97 H PHE 97 9.660 0.461 -7.086
695 HA PHE 97 HA PHE 97 7.119 0.562 -5.765
696 HB2 PHE 97 1HB PHE 97 8.684 -1.502 -7.243
697 HB3 PHE 97 2HB PHE 97 7.402 -2.051 -6.169
698 HD1 PHE 97 1HD PHE 97 7.590 0.942 -8.372
699 HD2 PHE 97 2HD PHE 97 5.677 -2.765 -7.526
700 HE1 PHE 97 1HE PHE 97 5.929 1.403 -10.127
701 HE2 PHE 97 2HE PHE 97 4.013 -2.311 -9.281
702 HZ PHE 97 HZ PHE 97 4.138 -0.226 -10.585
703 H SER 98 H SER 98 6.841 0.443 -3.647
704 HA SER 98 HA SER 98 8.808 -0.082 -1.767
705 HB2 SER 98 1HB SER 98 6.655 1.057 -1.282
706 HB3 SER 98 2HB SER 98 5.830 -0.496 -1.411
707 HG SER 98 HG SER 98 6.238 -0.453 0.683
708 H ASN 99 H ASN 99 8.529 -1.881 -0.036
709 HA ASN 99 HA ASN 99 9.161 -4.341 -1.268
710 HB2 ASN 99 1HB ASN 99 8.867 -5.193 1.179
711 HB3 ASN 99 2HB ASN 99 10.167 -4.063 0.813
712 HD21 ASN 99 1HD2 ASN 99 7.897 -4.751 3.004
713 HD22 ASN 99 2HD2 ASN 99 7.595 -3.177 3.649
714 H VAL 100 H VAL 100 8.028 -6.428 -0.385
715 HA VAL 100 HA VAL 100 5.163 -6.134 -0.983
716 HB VAL 100 HB VAL 100 6.922 -8.577 -1.236
717 HG11 VAL 100 1HG1 VAL 100 4.805 -9.427 -0.787
718 HG12 VAL 100 2HG1 VAL 100 3.990 -8.128 -1.661
719 HG13 VAL 100 3HG1 VAL 100 4.855 -9.383 -2.549
720 HG21 VAL 100 1HG2 VAL 100 6.636 -8.277 -3.644
721 HG22 VAL 100 2HG2 VAL 100 5.707 -6.806 -3.356
722 HG23 VAL 100 3HG2 VAL 100 7.414 -6.872 -2.917
723 H MET 101 H MET 101 3.786 -6.385 0.639
724 HA MET 101 HA MET 101 4.639 -7.964 2.975
725 HB2 MET 101 1HB MET 101 2.640 -5.698 2.876
726 HB3 MET 101 2HB MET 101 3.123 -6.585 4.316
727 HG2 MET 101 1HG MET 101 5.014 -4.972 2.624
728 HG3 MET 101 2HG MET 101 4.190 -4.353 4.053
729 HE1 MET 101 1HE MET 101 5.669 -6.190 6.977
730 HE2 MET 101 2HE MET 101 5.596 -4.491 6.510
731 HE3 MET 101 3HE MET 101 4.199 -5.537 6.251
732 H ILE 102 H ILE 102 3.492 -9.717 3.491
733 HA ILE 102 HA ILE 102 1.087 -10.301 1.936
734 HB ILE 102 HB ILE 102 2.782 -12.076 3.695
735 HG12 ILE 102 1HG1 ILE 102 2.372 -12.189 0.705
736 HG13 ILE 102 2HG1 ILE 102 3.701 -11.312 1.456
737 HG21 ILE 102 1HG2 ILE 102 1.181 -13.616 3.683
738 HG22 ILE 102 2HG2 ILE 102 0.091 -12.397 3.023
739 HG23 ILE 102 3HG2 ILE 102 0.977 -13.467 1.937
740 HD11 ILE 102 1HD1 ILE 102 4.745 -13.276 1.040
741 HD12 ILE 102 2HD1 ILE 102 4.079 -13.656 2.629
742 HD13 ILE 102 3HD1 ILE 102 3.263 -14.223 1.172
743 H CYS 103 H CYS 103 -0.656 -9.384 2.869
744 HA CYS 103 HA CYS 103 -1.100 -9.914 5.734
745 HB2 CYS 103 1HB CYS 103 -0.878 -7.471 4.827
746 HB3 CYS 103 2HB CYS 103 -2.520 -7.728 4.250
747 HG CYS 103 HG CYS 103 -3.319 -8.507 6.966
748 H GLU 104 H GLU 104 -2.413 -11.616 5.899
749 HA GLU 104 HA GLU 104 -4.364 -12.259 3.896
750 HB2 GLU 104 1HB GLU 104 -3.024 -13.829 5.523
751 HB3 GLU 104 2HB GLU 104 -4.361 -13.504 6.617
752 HG2 GLU 104 1HG GLU 104 -5.811 -14.179 4.539
753 HG3 GLU 104 2HG GLU 104 -4.331 -15.003 4.051
754 H THR 105 H THR 105 -6.484 -11.808 3.857
755 HA THR 105 HA THR 105 -7.534 -9.836 5.628
756 HB THR 105 HB THR 105 -9.742 -10.494 4.383
757 HG1 THR 105 1HG THR 105 -8.092 -11.387 2.336
758 HG21 THR 105 1HG2 THR 105 -9.256 -8.920 2.730
759 HG22 THR 105 2HG2 THR 105 -7.564 -9.407 2.629
760 HG23 THR 105 3HG2 THR 105 -8.139 -8.500 4.028
761 H LYS 106 H LYS 106 -10.019 -10.365 6.288
762 HA LYS 106 HA LYS 106 -9.761 -12.495 8.262
763 HB2 LYS 106 1HB LYS 106 -11.947 -10.431 7.941
764 HB3 LYS 106 2HB LYS 106 -11.720 -11.503 9.317
765 HG2 LYS 106 1HG LYS 106 -9.462 -9.731 8.580
766 HG3 LYS 106 2HG LYS 106 -10.883 -8.989 9.318
767 HD2 LYS 106 1HD LYS 106 -10.709 -10.476 11.223
768 HD3 LYS 106 2HD LYS 106 -9.355 -11.323 10.471
769 HE2 LYS 106 1HE LYS 106 -8.380 -9.849 12.022
770 HE3 LYS 106 2HE LYS 106 -8.162 -9.080 10.450
771 HZ1 LYS 106 1HZ LYS 106 -10.403 -8.430 12.279
772 HZ2 LYS 106 2HZ LYS 106 -9.926 -7.586 10.893
773 HZ3 LYS 106 3HZ LYS 106 -8.940 -7.580 12.268
774 H ALA 107 H ALA 107 -11.389 -14.087 8.582
775 HA ALA 107 HA ALA 107 -12.395 -15.190 6.149
776 HB1 ALA 107 1HB ALA 107 -11.971 -16.077 8.833
777 HB2 ALA 107 2HB ALA 107 -13.607 -16.501 8.326
778 HB3 ALA 107 3HB ALA 107 -12.222 -17.032 7.371
779 H ARG 108 H ARG 108 -14.311 -14.899 5.211
780 HA ARG 108 HA ARG 108 -16.141 -12.967 6.042
781 HB2 ARG 108 1HB ARG 108 -17.706 -14.242 4.400
782 HB3 ARG 108 2HB ARG 108 -16.260 -13.459 3.778
783 HG2 ARG 108 1HG ARG 108 -15.218 -15.430 3.315
784 HG3 ARG 108 2HG ARG 108 -16.051 -16.300 4.605
785 HD2 ARG 108 1HD ARG 108 -17.965 -16.613 3.329
786 HD3 ARG 108 2HD ARG 108 -17.576 -15.281 2.242
787 HE ARG 108 HE ARG 108 -15.665 -17.396 2.085
788 HH11 ARG 108 1HH1 ARG 108 -18.818 -16.372 1.021
789 HH12 ARG 108 2HH1 ARG 108 -18.786 -17.330 -0.422
790 HH21 ARG 108 1HH2 ARG 108 -15.611 -18.661 0.188
791 HH22 ARG 108 2HH2 ARG 108 -16.961 -18.632 -0.895
792 H SER 109 H SER 109 -17.084 -13.106 7.996
793 HA SER 109 HA SER 109 -18.368 -15.639 8.754
794 HB2 SER 109 1HB SER 109 -18.346 -14.808 11.043
795 HB3 SER 109 2HB SER 109 -16.725 -14.690 10.357
796 HG SER 109 HG SER 109 -16.960 -12.722 11.154
797 H GLY 110 H GLY 110 -20.496 -15.588 9.689
798 HA2 GLY 110 1HA GLY 110 -22.080 -13.180 9.416
799 HA3 GLY 110 2HA GLY 110 -22.466 -14.438 8.251
800 HA PRO 111 HA PRO 111 -24.838 -15.029 12.280
801 HB2 PRO 111 1HB PRO 111 -27.321 -14.697 11.233
802 HB3 PRO 111 2HB PRO 111 -26.362 -13.358 11.875
803 HG2 PRO 111 1HG PRO 111 -26.749 -14.220 9.034
804 HG3 PRO 111 2HG PRO 111 -26.748 -12.583 9.717
805 HD2 PRO 111 1HD PRO 111 -24.604 -13.629 8.435
806 HD3 PRO 111 2HD PRO 111 -24.446 -12.473 9.773
807 H SER 112 H SER 112 -24.325 -16.489 9.364
808 HA SER 112 HA SER 112 -26.149 -18.353 8.792
809 HB2 SER 112 1HB SER 112 -24.362 -19.902 8.198
810 HB3 SER 112 2HB SER 112 -23.889 -18.256 7.775
811 HG SER 112 HG SER 112 -22.503 -19.898 9.190
812 H SER 113 H SER 113 -24.091 -18.404 11.656
813 HA SER 113 HA SER 113 -24.763 -20.946 12.609
814 HB2 SER 113 1HB SER 113 -23.876 -18.428 14.013
815 HB3 SER 113 2HB SER 113 -24.166 -19.933 14.885
816 HG SER 113 HG SER 113 -22.196 -19.332 12.971
817 H GLY 114 H GLY 114 -26.698 -21.715 13.119
818 HA2 GLY 114 1HA GLY 114 -28.603 -21.772 14.541
819 HA3 GLY 114 2HA GLY 114 -28.531 -20.019 14.659
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