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 |
|
|
637770 |
6ivs   |
36220 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 SER 0 H1 SER 0 -0.555 -11.010 -1.236
2 H2 SER 0 H2 SER 0 0.187 -11.832 -2.537
3 H3 SER 0 H3 SER 0 -1.503 -11.621 -2.508
4 HA SER 0 HA SER 0 0.369 -9.401 -2.415
5 HB2 SER 0 HB2 SER 0 -0.738 -10.719 -4.903
6 HB3 SER 0 HB3 SER 0 0.147 -9.193 -4.860
7 HG SER 0 HG SER 0 1.844 -10.366 -3.825
8 H MET 1 H MET 1 -1.345 -8.656 -0.925
9 HA MET 1 HA MET 1 -3.859 -8.020 -2.205
10 HB2 MET 1 HB2 MET 1 -3.677 -8.469 0.268
11 HB3 MET 1 HB3 MET 1 -2.747 -6.972 0.388
12 HG2 MET 1 HG2 MET 1 -5.099 -6.686 1.055
13 HG3 MET 1 HG3 MET 1 -4.637 -5.672 -0.311
14 HE1 MET 1 HE1 MET 1 -8.376 -6.425 -1.092
15 HE2 MET 1 HE2 MET 1 -7.143 -5.176 -0.932
16 HE3 MET 1 HE3 MET 1 -7.637 -6.112 0.476
17 H ASN 2 H ASN 2 -3.511 -6.702 -3.851
18 HA ASN 2 HA ASN 2 -1.464 -4.732 -3.727
19 HB2 ASN 2 HB2 ASN 2 -3.353 -5.539 -5.910
20 HB3 ASN 2 HB3 ASN 2 -2.318 -4.122 -6.054
21 HD21 ASN 2 HD21 ASN 2 -0.032 -5.252 -4.669
22 HD22 ASN 2 HD22 ASN 2 0.599 -6.478 -5.711
23 H ARG 3 H ARG 3 -1.526 -2.777 -3.374
24 HA ARG 3 HA ARG 3 -4.072 -1.311 -3.262
25 HB2 ARG 3 HB2 ARG 3 -2.832 -1.866 -1.006
26 HB3 ARG 3 HB3 ARG 3 -1.673 -0.679 -1.580
27 HG2 ARG 3 HG2 ARG 3 -3.119 0.451 -0.089
28 HG3 ARG 3 HG3 ARG 3 -3.554 0.976 -1.719
29 HD2 ARG 3 HD2 ARG 3 -5.040 -1.371 -0.932
30 HD3 ARG 3 HD3 ARG 3 -5.253 -0.070 0.235
31 HE ARG 3 HE ARG 3 -6.073 1.314 -1.533
32 HH11 ARG 3 HH11 ARG 3 -5.806 -2.150 -2.393
33 HH12 ARG 3 HH12 ARG 3 -7.024 -2.072 -3.562
34 HH21 ARG 3 HH21 ARG 3 -7.707 1.375 -3.149
35 HH22 ARG 3 HH22 ARG 3 -8.132 -0.025 -4.031
36 H LEU 4 H LEU 4 -3.782 0.941 -3.904
37 HA LEU 4 HA LEU 4 -1.418 1.329 -5.636
38 HB2 LEU 4 HB2 LEU 4 -4.234 2.360 -5.981
39 HB3 LEU 4 HB3 LEU 4 -2.882 2.735 -7.022
40 HG LEU 4 HG LEU 4 -4.078 -0.010 -6.665
41 HD11 LEU 4 HD11 LEU 4 -5.609 1.561 -7.768
42 HD12 LEU 4 HD12 LEU 4 -5.029 0.308 -8.864
43 HD13 LEU 4 HD13 LEU 4 -4.353 1.936 -8.949
44 HD21 LEU 4 HD21 LEU 4 -1.987 1.049 -8.567
45 HD22 LEU 4 HD22 LEU 4 -2.738 -0.546 -8.662
46 HD23 LEU 4 HD23 LEU 4 -1.743 -0.127 -7.275
47 H GLY 5 H GLY 5 -0.220 3.043 -5.161
48 HA2 GLY 5 HA2 GLY 5 -1.509 5.369 -4.071
49 HA3 GLY 5 HA3 GLY 5 -0.347 4.595 -2.987
50 H ILE 6 H ILE 6 -0.244 7.151 -3.965
51 HA ILE 6 HA ILE 6 1.809 7.191 -6.037
52 HB ILE 6 HB ILE 6 0.415 9.468 -4.599
53 HG12 ILE 6 HG12 ILE 6 -0.194 8.484 -7.387
54 HG13 ILE 6 HG13 ILE 6 -1.059 7.881 -5.980
55 HG21 ILE 6 HG21 ILE 6 2.025 9.439 -7.157
56 HG22 ILE 6 HG22 ILE 6 2.572 10.073 -5.607
57 HG23 ILE 6 HG23 ILE 6 1.229 10.844 -6.448
58 HD11 ILE 6 HD11 ILE 6 -1.804 10.169 -5.491
59 HD12 ILE 6 HD12 ILE 6 -2.320 9.608 -7.078
60 HD13 ILE 6 HD13 ILE 6 -0.961 10.727 -6.940
61 H ILE 7 H ILE 7 3.858 7.353 -5.539
62 HA ILE 7 HA ILE 7 4.743 7.411 -2.845
63 HB ILE 7 HB ILE 7 6.368 7.958 -5.344
64 HG12 ILE 7 HG12 ILE 7 5.247 5.745 -5.424
65 HG13 ILE 7 HG13 ILE 7 6.990 5.596 -5.278
66 HG21 ILE 7 HG21 ILE 7 7.281 7.039 -2.613
67 HG22 ILE 7 HG22 ILE 7 7.404 8.692 -3.204
68 HG23 ILE 7 HG23 ILE 7 8.310 7.403 -4.001
69 HD11 ILE 7 HD11 ILE 7 5.102 5.397 -2.949
70 HD12 ILE 7 HD12 ILE 7 6.819 5.004 -2.976
71 HD13 ILE 7 HD13 ILE 7 5.668 4.022 -3.884
72 H TYR 8 H TYR 8 4.318 9.023 -1.720
73 HA TYR 8 HA TYR 8 4.214 11.726 -2.721
74 HB2 TYR 8 HB2 TYR 8 2.538 10.645 -1.179
75 HB3 TYR 8 HB3 TYR 8 3.777 10.658 0.061
76 HD1 TYR 8 HD1 TYR 8 4.267 12.642 1.268
77 HD2 TYR 8 HD2 TYR 8 1.590 12.748 -2.021
78 HE1 TYR 8 HE1 TYR 8 3.530 14.875 1.958
79 HE2 TYR 8 HE2 TYR 8 0.842 15.000 -1.345
80 HH TYR 8 HH TYR 8 0.773 16.352 0.604
81 H GLU 9 H GLU 9 6.201 9.703 -0.640
82 HA GLU 9 HA GLU 9 8.366 11.558 -0.694
83 HB2 GLU 9 HB2 GLU 9 6.693 12.361 1.116
84 HB3 GLU 9 HB3 GLU 9 7.214 10.950 2.021
85 HG2 GLU 9 HG2 GLU 9 9.483 11.765 2.041
86 HG3 GLU 9 HG3 GLU 9 9.014 13.143 1.045
87 H ILE 10 H ILE 10 10.248 10.608 0.533
88 HA ILE 10 HA ILE 10 10.052 7.695 0.822
89 HB ILE 10 HB ILE 10 12.254 9.335 -0.473
90 HG12 ILE 10 HG12 ILE 10 10.340 8.789 -1.930
91 HG13 ILE 10 HG13 ILE 10 11.835 8.043 -2.483
92 HG21 ILE 10 HG21 ILE 10 13.479 7.207 -0.822
93 HG22 ILE 10 HG22 ILE 10 12.320 6.414 0.246
94 HG23 ILE 10 HG23 ILE 10 13.358 7.693 0.869
95 HD11 ILE 10 HD11 ILE 10 10.030 6.497 -2.737
96 HD12 ILE 10 HD12 ILE 10 9.542 6.712 -1.057
97 HD13 ILE 10 HD13 ILE 10 11.075 5.923 -1.437
98 H GLN 11 H GLN 11 10.986 6.928 2.647
99 HA GLN 11 HA GLN 11 12.701 8.726 4.206
100 HB2 GLN 11 HB2 GLN 11 10.319 7.165 5.072
101 HB3 GLN 11 HB3 GLN 11 11.715 7.065 6.134
102 HG2 GLN 11 HG2 GLN 11 10.750 8.859 7.083
103 HG3 GLN 11 HG3 GLN 11 11.580 9.726 5.799
104 HE21 GLN 11 HE21 GLN 11 10.382 10.352 3.984
105 HE22 GLN 11 HE22 GLN 11 8.675 10.623 4.108
106 H GLY 12 H GLY 12 14.299 7.666 2.874
107 HA2 GLY 12 HA2 GLY 12 15.971 6.156 2.526
108 HA3 GLY 12 HA3 GLY 12 15.617 5.534 4.130
109 H MET 13 H MET 13 14.594 3.658 4.332
110 HA MET 13 HA MET 13 14.040 2.167 1.894
111 HB2 MET 13 HB2 MET 13 14.453 1.272 4.741
112 HB3 MET 13 HB3 MET 13 13.981 0.184 3.448
113 HG2 MET 13 HG2 MET 13 16.422 1.852 3.110
114 HG3 MET 13 HG3 MET 13 16.488 0.445 4.162
115 HE1 MET 13 HE1 MET 13 16.320 0.522 -0.418
116 HE2 MET 13 HE2 MET 13 16.485 1.895 0.680
117 HE3 MET 13 HE3 MET 13 14.903 1.165 0.401
118 H LYS 14 H LYS 14 12.336 4.126 3.676
119 HA LYS 14 HA LYS 14 9.880 2.506 3.510
120 HB2 LYS 14 HB2 LYS 14 10.309 5.054 5.058
121 HB3 LYS 14 HB3 LYS 14 8.868 4.068 5.046
122 HG2 LYS 14 HG2 LYS 14 10.130 2.256 6.149
123 HG3 LYS 14 HG3 LYS 14 11.531 3.332 6.236
124 HD2 LYS 14 HD2 LYS 14 10.247 4.933 7.541
125 HD3 LYS 14 HD3 LYS 14 8.816 3.915 7.395
126 HE2 LYS 14 HE2 LYS 14 9.957 2.145 8.632
127 HE3 LYS 14 HE3 LYS 14 11.378 3.180 8.787
128 HZ1 LYS 14 HZ1 LYS 14 9.959 3.258 10.777
129 HZ2 LYS 14 HZ2 LYS 14 8.687 3.871 9.861
130 HZ3 LYS 14 HZ3 LYS 14 10.099 4.746 10.030
131 H ALA 15 H ALA 15 8.084 3.580 2.632
132 HA ALA 15 HA ALA 15 8.614 6.074 1.206
133 HB1 ALA 15 HB1 ALA 15 7.249 3.664 -0.004
134 HB2 ALA 15 HB2 ALA 15 8.873 4.231 -0.396
135 HB3 ALA 15 HB3 ALA 15 7.475 5.237 -0.772
136 H VAL 16 H VAL 16 6.917 7.415 1.118
137 HA VAL 16 HA VAL 16 4.564 6.706 2.718
138 HB VAL 16 HB VAL 16 5.436 9.416 1.637
139 HG11 VAL 16 HG11 VAL 16 3.223 8.736 3.582
140 HG12 VAL 16 HG12 VAL 16 3.006 9.243 1.912
141 HG13 VAL 16 HG13 VAL 16 3.705 10.360 3.089
142 HG21 VAL 16 HG21 VAL 16 6.917 8.544 3.423
143 HG22 VAL 16 HG22 VAL 16 5.489 8.425 4.472
144 HG23 VAL 16 HG23 VAL 16 6.024 9.995 3.894
145 H VAL 17 H VAL 17 2.901 6.004 1.601
146 HA VAL 17 HA VAL 17 2.638 6.930 -1.158
147 HB VAL 17 HB VAL 17 0.993 4.951 -1.357
148 HG11 VAL 17 HG11 VAL 17 3.036 5.037 -2.585
149 HG12 VAL 17 HG12 VAL 17 2.832 3.416 -1.922
150 HG13 VAL 17 HG13 VAL 17 3.957 4.540 -1.165
151 HG21 VAL 17 HG21 VAL 17 0.869 4.358 0.977
152 HG22 VAL 17 HG22 VAL 17 2.605 4.056 1.026
153 HG23 VAL 17 HG23 VAL 17 1.555 3.017 0.060
154 H LEU 18 H LEU 18 1.091 8.150 -1.654
155 HA LEU 18 HA LEU 18 -1.169 8.507 0.143
156 HB2 LEU 18 HB2 LEU 18 -0.082 10.515 -0.668
157 HB3 LEU 18 HB3 LEU 18 -0.173 9.954 -2.319
158 HG LEU 18 HG LEU 18 -2.626 10.199 -2.248
159 HD11 LEU 18 HD11 LEU 18 -3.004 9.900 0.133
160 HD12 LEU 18 HD12 LEU 18 -3.653 11.452 -0.410
161 HD13 LEU 18 HD13 LEU 18 -2.128 11.394 0.471
162 HD21 LEU 18 HD21 LEU 18 -1.047 12.648 -1.504
163 HD22 LEU 18 HD22 LEU 18 -2.646 12.654 -2.247
164 HD23 LEU 18 HD23 LEU 18 -1.266 11.991 -3.127
165 H THR 19 H THR 19 -2.559 6.921 -0.183
166 HA THR 19 HA THR 19 -2.586 5.352 -2.534
167 HB THR 19 HB THR 19 -4.519 4.217 -1.419
168 HG1 THR 19 HG1 THR 19 -4.792 4.866 0.788
169 HG21 THR 19 HG21 THR 19 -2.188 3.503 -1.102
170 HG22 THR 19 HG22 THR 19 -3.113 3.293 0.388
171 HG23 THR 19 HG23 THR 19 -2.014 4.663 0.212
172 H SER 20 H SER 20 -4.771 4.686 -3.526
173 HA SER 20 HA SER 20 -5.960 6.838 -4.861
174 HB2 SER 20 HB2 SER 20 -7.581 4.892 -5.484
175 HB3 SER 20 HB3 SER 20 -5.891 4.794 -6.001
176 HG SER 20 HG SER 20 -7.157 3.439 -3.829
177 H GLU 21 H GLU 21 -6.478 5.434 -1.831
178 HA GLU 21 HA GLU 21 -9.196 6.246 -1.489
179 HB2 GLU 21 HB2 GLU 21 -7.125 5.048 0.304
180 HB3 GLU 21 HB3 GLU 21 -8.733 5.494 0.861
181 HG2 GLU 21 HG2 GLU 21 -8.896 3.238 0.380
182 HG3 GLU 21 HG3 GLU 21 -9.609 4.050 -0.999
183 H GLY 22 H GLY 22 -6.131 7.688 -1.332
184 HA2 GLY 22 HA2 GLY 22 -5.588 9.858 -0.789
185 HA3 GLY 22 HA3 GLY 22 -7.203 10.067 -0.114
186 H GLU 23 H GLU 23 -5.109 7.449 0.804
187 HA GLU 23 HA GLU 23 -4.931 8.611 3.494
188 HB2 GLU 23 HB2 GLU 23 -4.688 5.740 2.587
189 HB3 GLU 23 HB3 GLU 23 -4.736 6.314 4.245
190 HG2 GLU 23 HG2 GLU 23 -7.033 6.908 2.451
191 HG3 GLU 23 HG3 GLU 23 -6.850 5.280 3.096
192 H PHE 24 H PHE 24 -2.840 8.616 4.462
193 HA PHE 24 HA PHE 24 -0.679 8.052 2.588
194 HB2 PHE 24 HB2 PHE 24 -0.490 9.597 5.226
195 HB3 PHE 24 HB3 PHE 24 0.795 9.305 4.092
196 HD1 PHE 24 HD1 PHE 24 1.178 10.669 2.248
197 HD2 PHE 24 HD2 PHE 24 -2.418 11.109 4.472
198 HE1 PHE 24 HE1 PHE 24 0.701 12.768 1.067
199 HE2 PHE 24 HE2 PHE 24 -2.902 13.206 3.295
200 HZ PHE 24 HZ PHE 24 -1.339 14.039 1.584
201 H LEU 25 H LEU 25 0.173 6.153 2.769
202 HA LEU 25 HA LEU 25 0.302 4.902 5.425
203 HB2 LEU 25 HB2 LEU 25 -0.078 3.659 2.708
204 HB3 LEU 25 HB3 LEU 25 0.526 2.726 4.058
205 HG LEU 25 HG LEU 25 -1.645 3.437 5.265
206 HD11 LEU 25 HD11 LEU 25 -3.532 3.919 3.823
207 HD12 LEU 25 HD12 LEU 25 -2.464 3.976 2.421
208 HD13 LEU 25 HD13 LEU 25 -2.306 5.180 3.698
209 HD21 LEU 25 HD21 LEU 25 -1.731 1.581 2.897
210 HD22 LEU 25 HD22 LEU 25 -2.902 1.616 4.214
211 HD23 LEU 25 HD23 LEU 25 -1.220 1.183 4.538
212 H ILE 26 H ILE 26 2.191 3.758 5.947
213 HA ILE 26 HA ILE 26 4.540 4.653 4.454
214 HB ILE 26 HB ILE 26 4.383 3.405 7.218
215 HG12 ILE 26 HG12 ILE 26 3.285 5.609 7.214
216 HG13 ILE 26 HG13 ILE 26 4.776 5.640 8.143
217 HG21 ILE 26 HG21 ILE 26 6.691 4.178 7.481
218 HG22 ILE 26 HG22 ILE 26 6.668 4.795 5.830
219 HG23 ILE 26 HG23 ILE 26 6.524 3.062 6.124
220 HD11 ILE 26 HD11 ILE 26 4.363 6.719 5.364
221 HD12 ILE 26 HD12 ILE 26 5.899 6.713 6.231
222 HD13 ILE 26 HD13 ILE 26 4.547 7.663 6.845
223 H ILE 27 H ILE 27 5.384 3.206 3.144
224 HA ILE 27 HA ILE 27 4.979 0.362 3.765
225 HB ILE 27 HB ILE 27 4.894 -0.140 1.374
226 HG12 ILE 27 HG12 ILE 27 4.828 2.838 0.853
227 HG13 ILE 27 HG13 ILE 27 6.288 1.869 0.709
228 HG21 ILE 27 HG21 ILE 27 2.904 2.001 2.101
229 HG22 ILE 27 HG22 ILE 27 2.798 0.310 2.566
230 HG23 ILE 27 HG23 ILE 27 2.701 0.763 0.862
231 HD11 ILE 27 HD11 ILE 27 5.192 0.511 -1.018
232 HD12 ILE 27 HD12 ILE 27 5.280 2.217 -1.460
233 HD13 ILE 27 HD13 ILE 27 3.760 1.532 -0.890
234 H ARG 28 H ARG 28 6.556 -1.012 2.809
235 HA ARG 28 HA ARG 28 9.267 -0.275 3.126
236 HB2 ARG 28 HB2 ARG 28 8.236 -2.478 1.339
237 HB3 ARG 28 HB3 ARG 28 9.826 -2.363 2.063
238 HG2 ARG 28 HG2 ARG 28 8.842 -2.749 4.263
239 HG3 ARG 28 HG3 ARG 28 7.236 -2.845 3.528
240 HD2 ARG 28 HD2 ARG 28 8.198 -4.655 2.032
241 HD3 ARG 28 HD3 ARG 28 9.580 -4.667 3.119
242 HE ARG 28 HE ARG 28 7.082 -5.000 4.470
243 HH11 ARG 28 HH11 ARG 28 9.653 -6.658 2.690
244 HH12 ARG 28 HH12 ARG 28 9.303 -8.203 3.296
245 HH21 ARG 28 HH21 ARG 28 6.575 -7.130 5.313
246 HH22 ARG 28 HH22 ARG 28 7.484 -8.487 4.852
247 H ARG 29 H ARG 29 10.628 0.649 1.700
248 HA ARG 29 HA ARG 29 9.533 1.367 -0.880
249 HB2 ARG 29 HB2 ARG 29 10.795 3.055 0.473
250 HB3 ARG 29 HB3 ARG 29 12.253 2.095 0.211
251 HG2 ARG 29 HG2 ARG 29 11.486 2.305 -2.300
252 HG3 ARG 29 HG3 ARG 29 10.701 3.757 -1.692
253 HD2 ARG 29 HD2 ARG 29 12.872 4.529 -0.837
254 HD3 ARG 29 HD3 ARG 29 13.611 3.052 -1.477
255 HE ARG 29 HE ARG 29 12.326 4.123 -3.621
256 HH11 ARG 29 HH11 ARG 29 14.871 5.360 -1.465
257 HH12 ARG 29 HH12 ARG 29 15.535 6.366 -2.672
258 HH21 ARG 29 HH21 ARG 29 13.264 5.515 -5.228
259 HH22 ARG 29 HH22 ARG 29 14.639 6.432 -4.843
260 H ARG 30 H ARG 30 9.868 0.217 -2.590
261 HA ARG 30 HA ARG 30 12.066 -1.716 -2.669
262 HB2 ARG 30 HB2 ARG 30 9.762 -1.301 -4.590
263 HB3 ARG 30 HB3 ARG 30 10.914 -2.616 -4.650
264 HG2 ARG 30 HG2 ARG 30 10.007 -3.438 -2.488
265 HG3 ARG 30 HG3 ARG 30 8.796 -2.148 -2.558
266 HD2 ARG 30 HD2 ARG 30 8.108 -3.016 -4.794
267 HD3 ARG 30 HD3 ARG 30 9.215 -4.360 -4.536
268 HE ARG 30 HE ARG 30 7.248 -4.043 -2.454
269 HH11 ARG 30 HH11 ARG 30 8.014 -5.617 -5.533
270 HH12 ARG 30 HH12 ARG 30 6.804 -6.799 -5.391
271 HH21 ARG 30 HH21 ARG 30 5.585 -5.542 -2.291
272 HH22 ARG 30 HH22 ARG 30 5.335 -6.779 -3.416
273 H LYS 31 H LYS 31 12.969 -1.788 -5.081
274 HA LYS 31 HA LYS 31 14.128 0.782 -5.536
275 HB2 LYS 31 HB2 LYS 31 14.252 -1.697 -7.268
276 HB3 LYS 31 HB3 LYS 31 15.281 -0.285 -7.426
277 HG2 LYS 31 HG2 LYS 31 16.271 -0.692 -5.270
278 HG3 LYS 31 HG3 LYS 31 15.167 -2.033 -4.980
279 HD2 LYS 31 HD2 LYS 31 16.137 -3.143 -7.009
280 HD3 LYS 31 HD3 LYS 31 17.350 -1.862 -7.053
281 HE2 LYS 31 HE2 LYS 31 18.090 -2.474 -4.809
282 HE3 LYS 31 HE3 LYS 31 16.854 -3.726 -4.734
283 HZ1 LYS 31 HZ1 LYS 31 19.193 -3.659 -6.569
284 HZ2 LYS 31 HZ2 LYS 31 17.965 -4.798 -6.654
285 HZ3 LYS 31 HZ3 LYS 31 18.931 -4.706 -5.285
286 H ASP 32 H ASP 32 11.264 -0.634 -6.515
287 HA ASP 32 HA ASP 32 10.834 0.611 -9.059
288 HB2 ASP 32 HB2 ASP 32 8.778 -0.410 -7.095
289 HB3 ASP 32 HB3 ASP 32 8.553 -0.119 -8.812
290 H MET 33 H MET 33 10.737 1.709 -5.835
291 HA MET 33 HA MET 33 8.521 3.483 -6.210
292 HB2 MET 33 HB2 MET 33 10.344 2.869 -3.944
293 HB3 MET 33 HB3 MET 33 9.365 4.325 -3.895
294 HG2 MET 33 HG2 MET 33 8.219 2.589 -2.708
295 HG3 MET 33 HG3 MET 33 7.350 2.905 -4.206
296 HE1 MET 33 HE1 MET 33 6.851 0.281 -2.442
297 HE2 MET 33 HE2 MET 33 6.745 -0.915 -3.733
298 HE3 MET 33 HE3 MET 33 6.000 0.670 -3.937
299 H LYS 34 H LYS 34 8.783 5.115 -7.506
300 HA LYS 34 HA LYS 34 11.048 6.918 -7.147
301 HB2 LYS 34 HB2 LYS 34 9.125 6.493 -9.436
302 HB3 LYS 34 HB3 LYS 34 10.351 7.744 -9.370
303 HG2 LYS 34 HG2 LYS 34 12.101 6.076 -9.402
304 HG3 LYS 34 HG3 LYS 34 10.899 4.783 -9.333
305 HD2 LYS 34 HD2 LYS 34 9.983 5.547 -11.484
306 HD3 LYS 34 HD3 LYS 34 11.230 6.791 -11.563
307 HE2 LYS 34 HE2 LYS 34 12.953 5.046 -11.526
308 HE3 LYS 34 HE3 LYS 34 11.694 3.812 -11.495
309 HZ1 LYS 34 HZ1 LYS 34 10.935 4.577 -13.634
310 HZ2 LYS 34 HZ2 LYS 34 12.556 4.146 -13.698
311 HZ3 LYS 34 HZ3 LYS 34 12.125 5.783 -13.676
312 H VAL 35 H VAL 35 10.502 9.002 -6.574
313 HA VAL 35 HA VAL 35 8.010 9.410 -5.281
314 HB VAL 35 HB VAL 35 9.934 11.616 -6.045
315 HG11 VAL 35 HG11 VAL 35 7.781 12.299 -5.075
316 HG12 VAL 35 HG12 VAL 35 9.135 12.691 -4.013
317 HG13 VAL 35 HG13 VAL 35 8.112 11.303 -3.656
318 HG21 VAL 35 HG21 VAL 35 11.288 9.891 -5.039
319 HG22 VAL 35 HG22 VAL 35 10.119 9.702 -3.735
320 HG23 VAL 35 HG23 VAL 35 11.062 11.190 -3.861
321 H GLY 36 H GLY 36 6.144 10.111 -6.090
322 HA2 GLY 36 HA2 GLY 36 5.016 11.817 -7.369
323 HA3 GLY 36 HA3 GLY 36 6.234 11.602 -8.614
324 H GLN 37 H GLN 37 6.028 8.595 -8.293
325 HA GLN 37 HA GLN 37 3.734 8.457 -10.082
326 HB2 GLN 37 HB2 GLN 37 4.597 6.355 -10.930
327 HB3 GLN 37 HB3 GLN 37 5.830 7.598 -10.996
328 HG2 GLN 37 HG2 GLN 37 6.892 6.642 -9.017
329 HG3 GLN 37 HG3 GLN 37 5.633 5.413 -8.940
330 HE21 GLN 37 HE21 GLN 37 7.134 3.723 -9.195
331 HE22 GLN 37 HE22 GLN 37 7.915 3.410 -10.676
332 H GLN 38 H GLN 38 2.189 6.882 -10.035
333 HA GLN 38 HA GLN 38 1.437 5.943 -7.392
334 HB2 GLN 38 HB2 GLN 38 -0.212 7.000 -8.936
335 HB3 GLN 38 HB3 GLN 38 0.052 5.685 -10.066
336 HG2 GLN 38 HG2 GLN 38 -0.894 4.104 -8.509
337 HG3 GLN 38 HG3 GLN 38 -1.040 5.361 -7.282
338 HE21 GLN 38 HE21 GLN 38 -3.290 4.996 -7.167
339 HE22 GLN 38 HE22 GLN 38 -4.359 5.557 -8.392
340 H VAL 39 H VAL 39 2.051 4.054 -6.695
341 HA VAL 39 HA VAL 39 2.966 2.082 -8.663
342 HB VAL 39 HB VAL 39 4.503 1.208 -6.941
343 HG11 VAL 39 HG11 VAL 39 6.062 3.068 -6.789
344 HG12 VAL 39 HG12 VAL 39 4.797 4.160 -7.343
345 HG13 VAL 39 HG13 VAL 39 5.390 2.883 -8.412
346 HG21 VAL 39 HG21 VAL 39 4.842 2.341 -4.819
347 HG22 VAL 39 HG22 VAL 39 3.176 1.788 -4.961
348 HG23 VAL 39 HG23 VAL 39 3.561 3.491 -5.205
349 H SER 40 H SER 40 2.496 -0.107 -8.277
350 HA SER 40 HA SER 40 0.229 -0.593 -6.564
351 HB2 SER 40 HB2 SER 40 0.511 -2.855 -7.879
352 HB3 SER 40 HB3 SER 40 -0.174 -1.446 -8.696
353 HG SER 40 HG SER 40 2.329 -2.639 -8.944
354 H PHE 41 H PHE 41 0.706 -1.302 -4.597
355 HA PHE 41 HA PHE 41 3.068 -3.004 -4.255
356 HB2 PHE 41 HB2 PHE 41 3.270 -2.065 -1.930
357 HB3 PHE 41 HB3 PHE 41 3.630 -0.917 -3.203
358 HD1 PHE 41 HD1 PHE 41 1.916 0.856 -3.745
359 HD2 PHE 41 HD2 PHE 41 1.553 -1.692 -0.363
360 HE1 PHE 41 HE1 PHE 41 0.320 2.424 -2.741
361 HE2 PHE 41 HE2 PHE 41 -0.053 -0.126 0.644
362 HZ PHE 41 HZ PHE 41 -0.669 1.932 -0.543
363 H GLU 42 H GLU 42 2.797 -4.120 -1.956
364 HA GLU 42 HA GLU 42 0.115 -5.283 -2.028
365 HB2 GLU 42 HB2 GLU 42 2.718 -6.432 -1.005
366 HB3 GLU 42 HB3 GLU 42 1.163 -7.254 -0.995
367 HG2 GLU 42 HG2 GLU 42 1.092 -7.400 -3.307
368 HG3 GLU 42 HG3 GLU 42 2.413 -6.261 -3.530
369 H ASN 43 H ASN 43 -0.553 -6.101 0.213
370 HA ASN 43 HA ASN 43 -0.310 -3.866 2.020
371 HB2 ASN 43 HB2 ASN 43 -1.901 -6.422 2.125
372 HB3 ASN 43 HB3 ASN 43 -1.711 -5.438 3.569
373 HD21 ASN 43 HD21 ASN 43 -1.982 -4.138 0.322
374 HD22 ASN 43 HD22 ASN 43 -3.524 -3.400 0.564
375 H GLU 44 H GLU 44 0.954 -6.947 1.538
376 HA GLU 44 HA GLU 44 2.292 -7.455 3.870
377 HB2 GLU 44 HB2 GLU 44 3.005 -8.045 1.000
378 HB3 GLU 44 HB3 GLU 44 3.663 -8.872 2.408
379 HG2 GLU 44 HG2 GLU 44 2.045 -10.348 1.894
380 HG3 GLU 44 HG3 GLU 44 1.090 -9.289 2.907
381 H ASP 45 H ASP 45 2.889 -5.040 1.396
382 HA ASP 45 HA ASP 45 5.656 -4.521 2.173
383 HB2 ASP 45 HB2 ASP 45 3.789 -3.067 0.290
384 HB3 ASP 45 HB3 ASP 45 5.415 -2.519 0.662
385 H ILE 46 H ILE 46 2.622 -3.718 3.345
386 HA ILE 46 HA ILE 46 3.263 -1.003 3.966
387 HB ILE 46 HB ILE 46 0.859 -2.607 4.909
388 HG12 ILE 46 HG12 ILE 46 1.063 -0.737 2.545
389 HG13 ILE 46 HG13 ILE 46 1.062 -2.489 2.417
390 HG21 ILE 46 HG21 ILE 46 1.339 -0.571 6.185
391 HG22 ILE 46 HG22 ILE 46 -0.160 -0.446 5.273
392 HG23 ILE 46 HG23 ILE 46 1.295 0.378 4.693
393 HD11 ILE 46 HD11 ILE 46 -1.198 -2.493 3.451
394 HD12 ILE 46 HD12 ILE 46 -1.134 -1.628 1.918
395 HD13 ILE 46 HD13 ILE 46 -1.166 -0.731 3.439
396 H TYR 47 H TYR 47 4.141 -0.284 5.677
397 HA TYR 47 HA TYR 47 5.076 -2.084 7.709
398 HB2 TYR 47 HB2 TYR 47 5.510 0.726 6.920
399 HB3 TYR 47 HB3 TYR 47 5.870 0.337 8.620
400 HD1 TYR 47 HD1 TYR 47 7.503 1.217 5.983
401 HD2 TYR 47 HD2 TYR 47 7.071 -2.391 8.199
402 HE1 TYR 47 HE1 TYR 47 9.707 0.479 5.201
403 HE2 TYR 47 HE2 TYR 47 9.283 -3.128 7.410
404 HH TYR 47 HH TYR 47 11.472 -1.043 5.983
405 H ASN 48 H ASN 48 2.562 0.194 7.266
406 HA ASN 48 HA ASN 48 1.739 0.474 9.998
407 HB2 ASN 48 HB2 ASN 48 0.132 0.818 7.449
408 HB3 ASN 48 HB3 ASN 48 -0.500 1.149 9.050
409 HD21 ASN 48 HD21 ASN 48 0.266 2.936 10.173
410 HD22 ASN 48 HD22 ASN 48 1.096 4.218 9.378
411 H VAL 49 H VAL 49 0.302 -1.371 7.353
412 HA VAL 49 HA VAL 49 -1.033 -3.067 9.294
413 HB VAL 49 HB VAL 49 -1.346 -3.161 6.282
414 HG11 VAL 49 HG11 VAL 49 -2.139 -5.119 7.544
415 HG12 VAL 49 HG12 VAL 49 -3.451 -4.251 6.756
416 HG13 VAL 49 HG13 VAL 49 -3.194 -4.069 8.492
417 HG21 VAL 49 HG21 VAL 49 -3.348 -1.766 6.535
418 HG22 VAL 49 HG22 VAL 49 -1.895 -0.899 7.040
419 HG23 VAL 49 HG23 VAL 49 -2.990 -1.568 8.251
420 H ARG 50 H ARG 50 0.999 -3.930 9.895
421 HA ARG 50 HA ARG 50 2.365 -5.644 7.993
422 HB2 ARG 50 HB2 ARG 50 3.773 -4.430 9.507
423 HB3 ARG 50 HB3 ARG 50 2.835 -4.962 10.894
424 HG2 ARG 50 HG2 ARG 50 3.592 -7.292 10.416
425 HG3 ARG 50 HG3 ARG 50 4.653 -6.623 9.176
426 HD2 ARG 50 HD2 ARG 50 4.700 -5.925 12.109
427 HD3 ARG 50 HD3 ARG 50 5.830 -7.002 11.293
428 HE ARG 50 HE ARG 50 6.614 -5.115 10.030
429 HH11 ARG 50 HH11 ARG 50 4.641 -4.313 12.901
430 HH12 ARG 50 HH12 ARG 50 5.356 -2.794 13.119
431 HH21 ARG 50 HH21 ARG 50 7.571 -3.010 10.362
432 HH22 ARG 50 HH22 ARG 50 7.069 -2.019 11.648
433 H GLY 51 H GLY 51 0.412 -5.829 10.891
434 HA2 GLY 51 HA2 GLY 51 -1.062 -7.777 11.169
435 HA3 GLY 51 HA3 GLY 51 0.282 -8.759 10.590
436 H LYS 52 H LYS 52 1.664 -6.370 12.236
437 HA LYS 52 HA LYS 52 1.379 -7.300 14.915
438 HB2 LYS 52 HB2 LYS 52 3.072 -8.874 14.126
439 HB3 LYS 52 HB3 LYS 52 3.979 -7.581 13.364
440 HG2 LYS 52 HG2 LYS 52 5.056 -8.332 15.427
441 HG3 LYS 52 HG3 LYS 52 4.533 -6.656 15.561
442 HD2 LYS 52 HD2 LYS 52 2.536 -7.394 16.805
443 HD3 LYS 52 HD3 LYS 52 3.092 -9.064 16.681
444 HE2 LYS 52 HE2 LYS 52 3.640 -8.126 18.860
445 HE3 LYS 52 HE3 LYS 52 5.106 -8.481 17.950
446 HZ1 LYS 52 HZ1 LYS 52 5.247 -6.343 19.048
447 HZ2 LYS 52 HZ2 LYS 52 3.865 -5.801 18.282
448 HZ3 LYS 52 HZ3 LYS 52 5.259 -6.121 17.385
Start of MODEL 2
1 H1 SER 0 H1 SER 0 0.925 -9.478 -3.613
2 H2 SER 0 H2 SER 0 1.275 -11.027 -3.009
3 H3 SER 0 H3 SER 0 0.441 -9.928 -2.046
4 HA SER 0 HA SER 0 -0.492 -11.046 -4.589
5 HB2 SER 0 HB2 SER 0 -2.187 -12.075 -2.818
6 HB3 SER 0 HB3 SER 0 -0.670 -12.884 -3.218
7 HG SER 0 HG SER 0 0.041 -12.507 -1.277
8 H MET 1 H MET 1 -1.484 -9.292 -1.606
9 HA MET 1 HA MET 1 -3.759 -8.300 -3.130
10 HB2 MET 1 HB2 MET 1 -4.480 -7.279 -0.943
11 HB3 MET 1 HB3 MET 1 -4.490 -9.038 -0.994
12 HG2 MET 1 HG2 MET 1 -2.334 -9.018 0.213
13 HG3 MET 1 HG3 MET 1 -2.425 -7.262 0.284
14 HE1 MET 1 HE1 MET 1 -4.860 -6.143 1.267
15 HE2 MET 1 HE2 MET 1 -5.885 -7.005 2.414
16 HE3 MET 1 HE3 MET 1 -5.920 -7.444 0.708
17 H ASN 2 H ASN 2 -3.475 -6.669 -4.294
18 HA ASN 2 HA ASN 2 -1.324 -4.804 -3.769
19 HB2 ASN 2 HB2 ASN 2 -2.816 -5.627 -6.189
20 HB3 ASN 2 HB3 ASN 2 -2.188 -3.985 -6.149
21 HD21 ASN 2 HD21 ASN 2 0.173 -4.441 -4.713
22 HD22 ASN 2 HD22 ASN 2 1.224 -5.419 -5.653
23 H ARG 3 H ARG 3 -1.501 -2.878 -3.189
24 HA ARG 3 HA ARG 3 -4.069 -1.458 -3.138
25 HB2 ARG 3 HB2 ARG 3 -2.586 -1.986 -1.003
26 HB3 ARG 3 HB3 ARG 3 -1.605 -0.676 -1.636
27 HG2 ARG 3 HG2 ARG 3 -2.933 0.476 -0.182
28 HG3 ARG 3 HG3 ARG 3 -3.889 0.609 -1.662
29 HD2 ARG 3 HD2 ARG 3 -5.235 -1.259 -1.009
30 HD3 ARG 3 HD3 ARG 3 -4.237 -1.539 0.404
31 HE ARG 3 HE ARG 3 -5.814 0.957 0.127
32 HH11 ARG 3 HH11 ARG 3 -4.876 -1.896 2.058
33 HH12 ARG 3 HH12 ARG 3 -5.805 -1.418 3.399
34 HH21 ARG 3 HH21 ARG 3 -7.069 1.538 1.933
35 HH22 ARG 3 HH22 ARG 3 -7.076 0.567 3.342
36 H LEU 4 H LEU 4 -3.889 0.775 -3.888
37 HA LEU 4 HA LEU 4 -1.523 1.265 -5.600
38 HB2 LEU 4 HB2 LEU 4 -4.367 2.204 -5.949
39 HB3 LEU 4 HB3 LEU 4 -3.019 2.641 -6.976
40 HG LEU 4 HG LEU 4 -4.164 -0.141 -6.672
41 HD11 LEU 4 HD11 LEU 4 -4.961 0.176 -8.956
42 HD12 LEU 4 HD12 LEU 4 -4.369 1.835 -8.933
43 HD13 LEU 4 HD13 LEU 4 -5.675 1.350 -7.851
44 HD21 LEU 4 HD21 LEU 4 -2.724 -0.644 -8.640
45 HD22 LEU 4 HD22 LEU 4 -1.819 -0.285 -7.172
46 HD23 LEU 4 HD23 LEU 4 -1.960 0.935 -8.439
47 H GLY 5 H GLY 5 -0.311 2.952 -5.086
48 HA2 GLY 5 HA2 GLY 5 -1.561 5.281 -3.892
49 HA3 GLY 5 HA3 GLY 5 -0.351 4.465 -2.911
50 H ILE 6 H ILE 6 -0.253 7.048 -3.834
51 HA ILE 6 HA ILE 6 1.750 7.015 -5.976
52 HB ILE 6 HB ILE 6 0.413 9.406 -4.673
53 HG12 ILE 6 HG12 ILE 6 -0.339 8.107 -7.300
54 HG13 ILE 6 HG13 ILE 6 -1.207 7.833 -5.797
55 HG21 ILE 6 HG21 ILE 6 1.942 9.116 -7.266
56 HG22 ILE 6 HG22 ILE 6 2.512 9.921 -5.806
57 HG23 ILE 6 HG23 ILE 6 1.143 10.584 -6.705
58 HD11 ILE 6 HD11 ILE 6 -2.337 9.463 -7.186
59 HD12 ILE 6 HD12 ILE 6 -0.886 10.466 -7.207
60 HD13 ILE 6 HD13 ILE 6 -1.762 10.208 -5.693
61 H ILE 7 H ILE 7 3.820 7.295 -5.526
62 HA ILE 7 HA ILE 7 4.740 7.406 -2.848
63 HB ILE 7 HB ILE 7 6.306 8.105 -5.352
64 HG12 ILE 7 HG12 ILE 7 5.323 5.825 -5.461
65 HG13 ILE 7 HG13 ILE 7 7.082 5.819 -5.379
66 HG21 ILE 7 HG21 ILE 7 7.330 8.858 -3.222
67 HG22 ILE 7 HG22 ILE 7 8.295 7.632 -4.041
68 HG23 ILE 7 HG23 ILE 7 7.308 7.192 -2.648
69 HD11 ILE 7 HD11 ILE 7 5.273 5.362 -3.022
70 HD12 ILE 7 HD12 ILE 7 7.023 5.161 -3.079
71 HD13 ILE 7 HD13 ILE 7 5.977 4.080 -4.001
72 H TYR 8 H TYR 8 4.242 9.038 -1.717
73 HA TYR 8 HA TYR 8 4.064 11.709 -2.775
74 HB2 TYR 8 HB2 TYR 8 2.411 10.697 -1.176
75 HB3 TYR 8 HB3 TYR 8 3.678 10.678 0.034
76 HD1 TYR 8 HD1 TYR 8 1.370 12.770 -1.862
77 HD2 TYR 8 HD2 TYR 8 4.409 12.722 1.097
78 HE1 TYR 8 HE1 TYR 8 0.731 15.055 -1.170
79 HE2 TYR 8 HE2 TYR 8 3.792 14.985 1.793
80 HH TYR 8 HH TYR 8 0.925 16.420 0.957
81 H GLU 9 H GLU 9 6.082 9.757 -0.650
82 HA GLU 9 HA GLU 9 8.212 11.655 -0.788
83 HB2 GLU 9 HB2 GLU 9 6.509 12.384 1.063
84 HB3 GLU 9 HB3 GLU 9 7.174 11.030 1.962
85 HG2 GLU 9 HG2 GLU 9 9.383 12.044 1.873
86 HG3 GLU 9 HG3 GLU 9 8.735 13.385 0.922
87 H ILE 10 H ILE 10 10.087 10.749 0.457
88 HA ILE 10 HA ILE 10 9.954 7.837 0.681
89 HB ILE 10 HB ILE 10 12.172 9.605 -0.395
90 HG12 ILE 10 HG12 ILE 10 10.337 8.974 -1.911
91 HG13 ILE 10 HG13 ILE 10 11.913 8.399 -2.472
92 HG21 ILE 10 HG21 ILE 10 13.228 7.960 1.016
93 HG22 ILE 10 HG22 ILE 10 13.531 7.562 -0.675
94 HG23 ILE 10 HG23 ILE 10 12.323 6.662 0.242
95 HD11 ILE 10 HD11 ILE 10 9.706 6.796 -1.173
96 HD12 ILE 10 HD12 ILE 10 11.297 6.157 -1.579
97 HD13 ILE 10 HD13 ILE 10 10.223 6.724 -2.858
98 H GLN 11 H GLN 11 10.909 7.010 2.478
99 HA GLN 11 HA GLN 11 12.143 8.915 4.314
100 HB2 GLN 11 HB2 GLN 11 9.645 7.748 4.667
101 HB3 GLN 11 HB3 GLN 11 10.723 6.705 5.582
102 HG2 GLN 11 HG2 GLN 11 9.826 8.402 7.011
103 HG3 GLN 11 HG3 GLN 11 11.560 8.630 6.805
104 HE21 GLN 11 HE21 GLN 11 9.058 9.563 4.475
105 HE22 GLN 11 HE22 GLN 11 9.319 11.257 4.599
106 H GLY 12 H GLY 12 14.039 8.021 3.221
107 HA2 GLY 12 HA2 GLY 12 15.897 6.694 3.213
108 HA3 GLY 12 HA3 GLY 12 15.290 5.967 4.696
109 H MET 13 H MET 13 14.449 3.984 4.636
110 HA MET 13 HA MET 13 14.345 2.699 2.022
111 HB2 MET 13 HB2 MET 13 14.878 1.628 4.767
112 HB3 MET 13 HB3 MET 13 14.289 0.561 3.504
113 HG2 MET 13 HG2 MET 13 16.716 2.260 3.073
114 HG3 MET 13 HG3 MET 13 16.821 0.731 3.934
115 HE1 MET 13 HE1 MET 13 16.347 1.389 -0.565
116 HE2 MET 13 HE2 MET 13 16.459 2.621 0.696
117 HE3 MET 13 HE3 MET 13 14.920 1.824 0.359
118 H LYS 14 H LYS 14 12.294 4.281 3.738
119 HA LYS 14 HA LYS 14 10.097 2.409 3.240
120 HB2 LYS 14 HB2 LYS 14 10.172 4.770 5.118
121 HB3 LYS 14 HB3 LYS 14 8.821 3.674 4.872
122 HG2 LYS 14 HG2 LYS 14 10.299 1.836 5.715
123 HG3 LYS 14 HG3 LYS 14 11.471 3.084 6.140
124 HD2 LYS 14 HD2 LYS 14 9.843 4.150 7.588
125 HD3 LYS 14 HD3 LYS 14 8.632 2.955 7.127
126 HE2 LYS 14 HE2 LYS 14 9.473 2.236 9.202
127 HE3 LYS 14 HE3 LYS 14 10.202 1.203 7.984
128 HZ1 LYS 14 HZ1 LYS 14 11.794 1.975 9.660
129 HZ2 LYS 14 HZ2 LYS 14 11.531 3.564 9.177
130 HZ3 LYS 14 HZ3 LYS 14 12.223 2.466 8.106
131 H ALA 15 H ALA 15 8.168 3.464 2.436
132 HA ALA 15 HA ALA 15 8.691 6.033 1.151
133 HB1 ALA 15 HB1 ALA 15 7.298 3.694 -0.163
134 HB2 ALA 15 HB2 ALA 15 8.931 4.254 -0.531
135 HB3 ALA 15 HB3 ALA 15 7.548 5.299 -0.855
136 H VAL 16 H VAL 16 7.003 7.383 1.073
137 HA VAL 16 HA VAL 16 4.678 6.666 2.702
138 HB VAL 16 HB VAL 16 5.566 9.395 1.687
139 HG11 VAL 16 HG11 VAL 16 3.902 10.318 3.222
140 HG12 VAL 16 HG12 VAL 16 3.421 8.691 3.691
141 HG13 VAL 16 HG13 VAL 16 3.148 9.248 2.040
142 HG21 VAL 16 HG21 VAL 16 7.130 8.550 3.353
143 HG22 VAL 16 HG22 VAL 16 5.776 8.209 4.441
144 HG23 VAL 16 HG23 VAL 16 6.159 9.874 4.015
145 H VAL 17 H VAL 17 3.053 5.953 1.556
146 HA VAL 17 HA VAL 17 2.735 6.965 -1.167
147 HB VAL 17 HB VAL 17 1.140 4.917 -1.373
148 HG11 VAL 17 HG11 VAL 17 4.125 4.591 -1.320
149 HG12 VAL 17 HG12 VAL 17 3.157 5.199 -2.665
150 HG13 VAL 17 HG13 VAL 17 2.985 3.524 -2.139
151 HG21 VAL 17 HG21 VAL 17 1.183 4.224 0.959
152 HG22 VAL 17 HG22 VAL 17 2.931 4.014 0.878
153 HG23 VAL 17 HG23 VAL 17 1.874 2.967 -0.070
154 H LEU 18 H LEU 18 1.119 8.142 -1.612
155 HA LEU 18 HA LEU 18 -1.051 8.423 0.290
156 HB2 LEU 18 HB2 LEU 18 -0.083 10.465 -0.597
157 HB3 LEU 18 HB3 LEU 18 -0.292 9.908 -2.240
158 HG LEU 18 HG LEU 18 -2.772 10.023 -1.877
159 HD11 LEU 18 HD11 LEU 18 -3.590 11.325 0.021
160 HD12 LEU 18 HD12 LEU 18 -1.958 11.372 0.687
161 HD13 LEU 18 HD13 LEU 18 -2.808 9.833 0.536
162 HD21 LEU 18 HD21 LEU 18 -1.586 11.818 -3.014
163 HD22 LEU 18 HD22 LEU 18 -1.220 12.575 -1.464
164 HD23 LEU 18 HD23 LEU 18 -2.891 12.467 -2.021
165 H THR 19 H THR 19 -2.425 6.811 0.057
166 HA THR 19 HA THR 19 -2.628 5.229 -2.266
167 HB THR 19 HB THR 19 -4.630 4.252 -1.091
168 HG1 THR 19 HG1 THR 19 -4.806 4.929 1.136
169 HG21 THR 19 HG21 THR 19 -2.409 3.320 -0.818
170 HG22 THR 19 HG22 THR 19 -3.277 3.256 0.723
171 HG23 THR 19 HG23 THR 19 -2.046 4.495 0.443
172 H SER 20 H SER 20 -4.699 4.833 -3.457
173 HA SER 20 HA SER 20 -5.715 7.243 -4.482
174 HB2 SER 20 HB2 SER 20 -7.415 5.619 -5.582
175 HB3 SER 20 HB3 SER 20 -5.713 5.497 -6.029
176 HG SER 20 HG SER 20 -6.240 3.911 -3.881
177 H GLU 21 H GLU 21 -6.394 5.804 -1.645
178 HA GLU 21 HA GLU 21 -9.174 6.602 -1.404
179 HB2 GLU 21 HB2 GLU 21 -7.246 5.477 0.615
180 HB3 GLU 21 HB3 GLU 21 -8.979 5.665 0.827
181 HG2 GLU 21 HG2 GLU 21 -9.475 3.900 -0.557
182 HG3 GLU 21 HG3 GLU 21 -7.958 4.046 -1.447
183 H GLY 22 H GLY 22 -6.087 8.005 -1.124
184 HA2 GLY 22 HA2 GLY 22 -5.609 10.178 -0.568
185 HA3 GLY 22 HA3 GLY 22 -7.191 10.323 0.183
186 H GLU 23 H GLU 23 -5.003 7.704 0.981
187 HA GLU 23 HA GLU 23 -4.636 8.945 3.613
188 HB2 GLU 23 HB2 GLU 23 -4.952 6.050 2.834
189 HB3 GLU 23 HB3 GLU 23 -4.411 6.569 4.421
190 HG2 GLU 23 HG2 GLU 23 -7.057 7.273 3.175
191 HG3 GLU 23 HG3 GLU 23 -6.789 6.005 4.370
192 H PHE 24 H PHE 24 -2.581 8.831 4.527
193 HA PHE 24 HA PHE 24 -0.451 8.166 2.638
194 HB2 PHE 24 HB2 PHE 24 -0.208 9.613 5.308
195 HB3 PHE 24 HB3 PHE 24 1.057 9.338 4.126
196 HD1 PHE 24 HD1 PHE 24 -2.108 11.151 4.689
197 HD2 PHE 24 HD2 PHE 24 1.414 10.769 2.336
198 HE1 PHE 24 HE1 PHE 24 -2.602 13.301 3.608
199 HE2 PHE 24 HE2 PHE 24 0.918 12.910 1.249
200 HZ PHE 24 HZ PHE 24 -1.088 14.179 1.882
201 H LEU 25 H LEU 25 0.303 6.228 2.763
202 HA LEU 25 HA LEU 25 0.429 4.917 5.383
203 HB2 LEU 25 HB2 LEU 25 -0.120 3.831 2.648
204 HB3 LEU 25 HB3 LEU 25 0.626 2.798 3.849
205 HG LEU 25 HG LEU 25 -1.386 3.302 5.334
206 HD11 LEU 25 HD11 LEU 25 -2.209 5.267 4.159
207 HD12 LEU 25 HD12 LEU 25 -3.431 3.996 4.236
208 HD13 LEU 25 HD13 LEU 25 -2.546 4.280 2.738
209 HD21 LEU 25 HD21 LEU 25 -1.787 1.827 2.744
210 HD22 LEU 25 HD22 LEU 25 -2.788 1.658 4.187
211 HD23 LEU 25 HD23 LEU 25 -1.085 1.195 4.232
212 H ILE 26 H ILE 26 2.272 3.587 5.776
213 HA ILE 26 HA ILE 26 4.652 4.547 4.365
214 HB ILE 26 HB ILE 26 4.464 3.293 7.121
215 HG12 ILE 26 HG12 ILE 26 3.294 5.463 7.088
216 HG13 ILE 26 HG13 ILE 26 4.740 5.521 8.083
217 HG21 ILE 26 HG21 ILE 26 6.624 3.017 6.063
218 HG22 ILE 26 HG22 ILE 26 6.741 4.140 7.418
219 HG23 ILE 26 HG23 ILE 26 6.722 4.752 5.763
220 HD11 ILE 26 HD11 ILE 26 5.913 6.645 6.216
221 HD12 ILE 26 HD12 ILE 26 4.523 7.553 6.811
222 HD13 ILE 26 HD13 ILE 26 4.402 6.640 5.304
223 H ILE 27 H ILE 27 5.483 3.085 3.069
224 HA ILE 27 HA ILE 27 5.056 0.238 3.700
225 HB ILE 27 HB ILE 27 4.990 -0.253 1.295
226 HG12 ILE 27 HG12 ILE 27 4.886 2.737 0.833
227 HG13 ILE 27 HG13 ILE 27 6.360 1.797 0.665
228 HG21 ILE 27 HG21 ILE 27 2.801 0.915 0.791
229 HG22 ILE 27 HG22 ILE 27 2.998 1.730 2.345
230 HG23 ILE 27 HG23 ILE 27 2.876 -0.030 2.275
231 HD11 ILE 27 HD11 ILE 27 3.834 1.421 -0.926
232 HD12 ILE 27 HD12 ILE 27 5.324 0.488 -1.106
233 HD13 ILE 27 HD13 ILE 27 5.310 2.214 -1.474
234 H ARG 28 H ARG 28 6.629 -1.157 2.736
235 HA ARG 28 HA ARG 28 9.332 -0.447 3.101
236 HB2 ARG 28 HB2 ARG 28 8.158 -2.682 1.432
237 HB3 ARG 28 HB3 ARG 28 9.835 -2.564 1.930
238 HG2 ARG 28 HG2 ARG 28 9.201 -2.859 4.244
239 HG3 ARG 28 HG3 ARG 28 7.493 -2.846 3.798
240 HD2 ARG 28 HD2 ARG 28 7.800 -4.845 2.465
241 HD3 ARG 28 HD3 ARG 28 9.525 -4.843 2.835
242 HE ARG 28 HE ARG 28 7.966 -4.904 5.204
243 HH11 ARG 28 HH11 ARG 28 8.939 -6.987 2.519
244 HH12 ARG 28 HH12 ARG 28 8.965 -8.415 3.443
245 HH21 ARG 28 HH21 ARG 28 7.978 -6.834 6.469
246 HH22 ARG 28 HH22 ARG 28 8.379 -8.332 5.765
247 H ARG 29 H ARG 29 10.627 0.716 1.776
248 HA ARG 29 HA ARG 29 9.662 1.396 -0.849
249 HB2 ARG 29 HB2 ARG 29 10.872 3.086 0.527
250 HB3 ARG 29 HB3 ARG 29 12.330 2.104 0.397
251 HG2 ARG 29 HG2 ARG 29 11.878 2.309 -2.164
252 HG3 ARG 29 HG3 ARG 29 10.930 3.709 -1.679
253 HD2 ARG 29 HD2 ARG 29 12.908 4.637 -0.564
254 HD3 ARG 29 HD3 ARG 29 13.842 3.231 -1.091
255 HE ARG 29 HE ARG 29 12.794 4.161 -3.394
256 HH11 ARG 29 HH11 ARG 29 14.936 5.581 -0.958
257 HH12 ARG 29 HH12 ARG 29 15.514 6.786 -2.019
258 HH21 ARG 29 HH21 ARG 29 13.558 5.796 -4.789
259 HH22 ARG 29 HH22 ARG 29 14.709 6.929 -4.260
260 H ARG 30 H ARG 30 10.195 0.458 -2.646
261 HA ARG 30 HA ARG 30 12.290 -1.544 -2.592
262 HB2 ARG 30 HB2 ARG 30 9.898 -1.217 -4.418
263 HB3 ARG 30 HB3 ARG 30 11.126 -2.465 -4.594
264 HG2 ARG 30 HG2 ARG 30 10.536 -3.397 -2.432
265 HG3 ARG 30 HG3 ARG 30 9.341 -2.123 -2.198
266 HD2 ARG 30 HD2 ARG 30 8.057 -2.926 -4.066
267 HD3 ARG 30 HD3 ARG 30 9.292 -4.125 -4.449
268 HE ARG 30 HE ARG 30 7.724 -4.141 -1.938
269 HH11 ARG 30 HH11 ARG 30 9.329 -5.915 -4.528
270 HH12 ARG 30 HH12 ARG 30 8.716 -7.431 -4.043
271 HH21 ARG 30 HH21 ARG 30 6.868 -6.164 -1.303
272 HH22 ARG 30 HH22 ARG 30 7.264 -7.585 -2.149
273 H LYS 31 H LYS 31 13.038 -1.693 -5.150
274 HA LYS 31 HA LYS 31 14.616 0.679 -5.235
275 HB2 LYS 31 HB2 LYS 31 14.637 -1.698 -7.073
276 HB3 LYS 31 HB3 LYS 31 15.842 -0.421 -7.037
277 HG2 LYS 31 HG2 LYS 31 15.207 -2.211 -4.701
278 HG3 LYS 31 HG3 LYS 31 16.521 -2.489 -5.844
279 HD2 LYS 31 HD2 LYS 31 17.575 -0.397 -5.196
280 HD3 LYS 31 HD3 LYS 31 16.219 -0.005 -4.148
281 HE2 LYS 31 HE2 LYS 31 18.348 -0.969 -3.068
282 HE3 LYS 31 HE3 LYS 31 16.799 -1.632 -2.573
283 HZ1 LYS 31 HZ1 LYS 31 17.145 -3.521 -3.951
284 HZ2 LYS 31 HZ2 LYS 31 18.526 -3.329 -3.013
285 HZ3 LYS 31 HZ3 LYS 31 18.542 -2.872 -4.642
286 H ASP 32 H ASP 32 11.740 -0.189 -6.866
287 HA ASP 32 HA ASP 32 12.339 1.569 -9.098
288 HB2 ASP 32 HB2 ASP 32 11.072 -0.505 -9.527
289 HB3 ASP 32 HB3 ASP 32 9.774 0.067 -8.493
290 H MET 33 H MET 33 11.264 2.064 -6.015
291 HA MET 33 HA MET 33 9.055 3.777 -6.312
292 HB2 MET 33 HB2 MET 33 10.934 3.153 -4.126
293 HB3 MET 33 HB3 MET 33 10.060 4.668 -3.997
294 HG2 MET 33 HG2 MET 33 8.816 3.066 -2.816
295 HG3 MET 33 HG3 MET 33 7.952 3.360 -4.323
296 HE1 MET 33 HE1 MET 33 7.200 -0.420 -3.678
297 HE2 MET 33 HE2 MET 33 6.502 1.151 -4.068
298 HE3 MET 33 HE3 MET 33 7.279 0.897 -2.506
299 H LYS 34 H LYS 34 9.084 5.538 -7.551
300 HA LYS 34 HA LYS 34 11.170 7.539 -7.164
301 HB2 LYS 34 HB2 LYS 34 9.209 7.158 -9.426
302 HB3 LYS 34 HB3 LYS 34 10.506 8.331 -9.340
303 HG2 LYS 34 HG2 LYS 34 12.163 6.634 -9.574
304 HG3 LYS 34 HG3 LYS 34 10.963 5.363 -9.340
305 HD2 LYS 34 HD2 LYS 34 9.828 6.310 -11.431
306 HD3 LYS 34 HD3 LYS 34 11.341 7.175 -11.710
307 HE2 LYS 34 HE2 LYS 34 11.370 5.109 -12.943
308 HE3 LYS 34 HE3 LYS 34 12.529 5.002 -11.607
309 HZ1 LYS 34 HZ1 LYS 34 11.335 2.971 -11.690
310 HZ2 LYS 34 HZ2 LYS 34 9.861 3.737 -11.815
311 HZ3 LYS 34 HZ3 LYS 34 10.723 3.806 -10.368
312 H VAL 35 H VAL 35 10.434 9.525 -6.464
313 HA VAL 35 HA VAL 35 7.864 9.656 -5.259
314 HB VAL 35 HB VAL 35 9.758 11.968 -5.785
315 HG11 VAL 35 HG11 VAL 35 7.505 12.679 -5.178
316 HG12 VAL 35 HG12 VAL 35 8.640 13.021 -3.868
317 HG13 VAL 35 HG13 VAL 35 7.553 11.638 -3.758
318 HG21 VAL 35 HG21 VAL 35 9.563 10.179 -3.376
319 HG22 VAL 35 HG22 VAL 35 10.606 11.594 -3.526
320 HG23 VAL 35 HG23 VAL 35 10.881 10.182 -4.546
321 H GLY 36 H GLY 36 5.982 10.190 -6.119
322 HA2 GLY 36 HA2 GLY 36 4.722 11.835 -7.361
323 HA3 GLY 36 HA3 GLY 36 5.987 11.793 -8.580
324 H GLN 37 H GLN 37 6.022 8.735 -8.176
325 HA GLN 37 HA GLN 37 3.927 8.359 -10.169
326 HB2 GLN 37 HB2 GLN 37 5.030 6.341 -10.850
327 HB3 GLN 37 HB3 GLN 37 6.259 7.580 -10.679
328 HG2 GLN 37 HG2 GLN 37 6.928 6.635 -8.526
329 HG3 GLN 37 HG3 GLN 37 5.663 5.421 -8.659
330 HE21 GLN 37 HE21 GLN 37 7.163 3.724 -8.576
331 HE22 GLN 37 HE22 GLN 37 8.162 3.305 -9.876
332 H GLN 38 H GLN 38 2.450 6.674 -10.119
333 HA GLN 38 HA GLN 38 1.625 5.895 -7.440
334 HB2 GLN 38 HB2 GLN 38 -0.056 6.774 -9.064
335 HB3 GLN 38 HB3 GLN 38 0.310 5.409 -10.115
336 HG2 GLN 38 HG2 GLN 38 -0.394 3.923 -8.207
337 HG3 GLN 38 HG3 GLN 38 -1.006 5.376 -7.420
338 HE21 GLN 38 HE21 GLN 38 -3.123 4.712 -7.496
339 HE22 GLN 38 HE22 GLN 38 -4.018 4.623 -8.962
340 H VAL 39 H VAL 39 1.968 3.965 -6.674
341 HA VAL 39 HA VAL 39 3.202 2.054 -8.493
342 HB VAL 39 HB VAL 39 4.621 1.278 -6.675
343 HG11 VAL 39 HG11 VAL 39 6.047 3.246 -6.369
344 HG12 VAL 39 HG12 VAL 39 4.749 4.254 -7.015
345 HG13 VAL 39 HG13 VAL 39 5.506 3.036 -8.039
346 HG21 VAL 39 HG21 VAL 39 4.730 2.440 -4.513
347 HG22 VAL 39 HG22 VAL 39 3.152 1.704 -4.781
348 HG23 VAL 39 HG23 VAL 39 3.356 3.444 -4.987
349 H SER 40 H SER 40 2.627 -0.033 -8.264
350 HA SER 40 HA SER 40 0.304 -0.604 -6.637
351 HB2 SER 40 HB2 SER 40 1.872 -2.458 -8.450
352 HB3 SER 40 HB3 SER 40 0.231 -2.690 -7.849
353 HG SER 40 HG SER 40 0.995 -0.516 -9.497
354 H PHE 41 H PHE 41 0.712 -1.174 -4.609
355 HA PHE 41 HA PHE 41 3.109 -2.769 -4.131
356 HB2 PHE 41 HB2 PHE 41 3.283 -1.771 -1.880
357 HB3 PHE 41 HB3 PHE 41 3.549 -0.598 -3.147
358 HD1 PHE 41 HD1 PHE 41 1.654 1.039 -3.655
359 HD2 PHE 41 HD2 PHE 41 1.623 -1.501 -0.239
360 HE1 PHE 41 HE1 PHE 41 -0.007 2.481 -2.595
361 HE2 PHE 41 HE2 PHE 41 -0.041 -0.054 0.818
362 HZ PHE 41 HZ PHE 41 -0.862 1.938 -0.351
363 H GLU 42 H GLU 42 2.854 -3.944 -2.101
364 HA GLU 42 HA GLU 42 0.113 -4.967 -2.104
365 HB2 GLU 42 HB2 GLU 42 2.600 -6.341 -1.107
366 HB3 GLU 42 HB3 GLU 42 0.973 -6.969 -1.018
367 HG2 GLU 42 HG2 GLU 42 1.856 -8.072 -2.843
368 HG3 GLU 42 HG3 GLU 42 0.874 -6.786 -3.537
369 H ASN 43 H ASN 43 -0.756 -5.641 -0.130
370 HA ASN 43 HA ASN 43 -0.475 -3.596 1.898
371 HB2 ASN 43 HB2 ASN 43 -2.183 -6.103 1.833
372 HB3 ASN 43 HB3 ASN 43 -2.144 -5.026 3.210
373 HD21 ASN 43 HD21 ASN 43 -2.796 -5.065 -0.266
374 HD22 ASN 43 HD22 ASN 43 -4.045 -3.877 -0.210
375 H GLU 44 H GLU 44 0.895 -6.500 1.244
376 HA GLU 44 HA GLU 44 1.725 -7.406 3.787
377 HB2 GLU 44 HB2 GLU 44 2.798 -7.930 1.024
378 HB3 GLU 44 HB3 GLU 44 3.042 -8.937 2.445
379 HG2 GLU 44 HG2 GLU 44 0.971 -9.842 2.335
380 HG3 GLU 44 HG3 GLU 44 0.240 -8.367 1.720
381 H ASP 45 H ASP 45 2.799 -4.984 1.551
382 HA ASP 45 HA ASP 45 5.475 -4.851 2.721
383 HB2 ASP 45 HB2 ASP 45 4.215 -3.561 0.318
384 HB3 ASP 45 HB3 ASP 45 5.616 -2.839 1.066
385 H ILE 46 H ILE 46 2.483 -3.658 3.367
386 HA ILE 46 HA ILE 46 3.144 -0.983 4.087
387 HB ILE 46 HB ILE 46 0.800 -2.705 4.968
388 HG12 ILE 46 HG12 ILE 46 0.914 -0.512 2.902
389 HG13 ILE 46 HG13 ILE 46 0.989 -2.226 2.517
390 HG21 ILE 46 HG21 ILE 46 1.140 -0.907 6.562
391 HG22 ILE 46 HG22 ILE 46 -0.284 -0.569 5.572
392 HG23 ILE 46 HG23 ILE 46 1.231 0.272 5.249
393 HD11 ILE 46 HD11 ILE 46 -1.254 -2.499 3.503
394 HD12 ILE 46 HD12 ILE 46 -1.233 -1.362 2.154
395 HD13 ILE 46 HD13 ILE 46 -1.309 -0.765 3.811
396 H TYR 47 H TYR 47 4.212 -0.273 5.736
397 HA TYR 47 HA TYR 47 5.185 -2.040 7.794
398 HB2 TYR 47 HB2 TYR 47 5.786 0.666 6.805
399 HB3 TYR 47 HB3 TYR 47 6.084 0.429 8.529
400 HD1 TYR 47 HD1 TYR 47 7.215 -2.231 8.680
401 HD2 TYR 47 HD2 TYR 47 7.763 0.731 5.682
402 HE1 TYR 47 HE1 TYR 47 9.405 -3.210 8.121
403 HE2 TYR 47 HE2 TYR 47 9.948 -0.240 5.118
404 HH TYR 47 HH TYR 47 11.702 -1.644 6.230
405 H ASN 48 H ASN 48 2.561 0.043 7.403
406 HA ASN 48 HA ASN 48 2.146 0.734 10.168
407 HB2 ASN 48 HB2 ASN 48 0.151 0.721 7.878
408 HB3 ASN 48 HB3 ASN 48 -0.124 1.422 9.462
409 HD21 ASN 48 HD21 ASN 48 0.699 3.446 9.889
410 HD22 ASN 48 HD22 ASN 48 1.451 4.424 8.692
411 H VAL 49 H VAL 49 2.467 -1.471 10.962
412 HA VAL 49 HA VAL 49 0.497 -3.455 10.351
413 HB VAL 49 HB VAL 49 2.425 -3.462 12.694
414 HG11 VAL 49 HG11 VAL 49 0.663 -5.100 12.932
415 HG12 VAL 49 HG12 VAL 49 2.173 -5.926 12.533
416 HG13 VAL 49 HG13 VAL 49 0.947 -5.687 11.294
417 HG21 VAL 49 HG21 VAL 49 3.950 -4.752 11.287
418 HG22 VAL 49 HG22 VAL 49 3.629 -3.174 10.564
419 HG23 VAL 49 HG23 VAL 49 2.832 -4.612 9.929
420 H ARG 50 H ARG 50 -1.461 -2.787 10.824
421 HA ARG 50 HA ARG 50 -2.400 -2.831 13.508
422 HB2 ARG 50 HB2 ARG 50 -1.469 -0.472 13.311
423 HB3 ARG 50 HB3 ARG 50 -2.721 -0.163 12.117
424 HG2 ARG 50 HG2 ARG 50 -4.432 -0.697 13.797
425 HG3 ARG 50 HG3 ARG 50 -3.158 -0.950 14.991
426 HD2 ARG 50 HD2 ARG 50 -3.988 1.227 15.326
427 HD3 ARG 50 HD3 ARG 50 -2.420 1.406 14.537
428 HE ARG 50 HE ARG 50 -4.680 1.379 12.740
429 HH11 ARG 50 HH11 ARG 50 -2.736 3.508 14.815
430 HH12 ARG 50 HH12 ARG 50 -3.067 4.889 13.857
431 HH21 ARG 50 HH21 ARG 50 -5.065 3.247 11.476
432 HH22 ARG 50 HH22 ARG 50 -4.390 4.750 11.949
433 H GLY 51 H GLY 51 -2.901 -2.266 10.083
434 HA2 GLY 51 HA2 GLY 51 -4.579 -3.428 8.903
435 HA3 GLY 51 HA3 GLY 51 -5.557 -3.439 10.370
436 H LYS 52 H LYS 52 -6.329 -1.404 11.136
437 HA LYS 52 HA LYS 52 -6.784 0.468 8.944
438 HB2 LYS 52 HB2 LYS 52 -8.824 -0.749 9.760
439 HB3 LYS 52 HB3 LYS 52 -8.558 -0.038 11.346
440 HG2 LYS 52 HG2 LYS 52 -8.812 2.193 10.384
441 HG3 LYS 52 HG3 LYS 52 -9.106 1.469 8.803
442 HD2 LYS 52 HD2 LYS 52 -11.072 0.340 9.679
443 HD3 LYS 52 HD3 LYS 52 -10.775 1.028 11.273
444 HE2 LYS 52 HE2 LYS 52 -11.357 2.597 8.758
445 HE3 LYS 52 HE3 LYS 52 -12.504 2.291 10.057
446 HZ1 LYS 52 HZ1 LYS 52 -10.985 3.533 11.559
447 HZ2 LYS 52 HZ2 LYS 52 -11.599 4.451 10.303
448 HZ3 LYS 52 HZ3 LYS 52 -10.019 3.915 10.219
Start of MODEL 3
1 H1 SER 0 H1 SER 0 -1.756 -11.588 -1.010
2 H2 SER 0 H2 SER 0 -0.606 -12.269 -2.073
3 H3 SER 0 H3 SER 0 -2.174 -11.954 -2.604
4 HA SER 0 HA SER 0 -0.285 -9.910 -1.707
5 HB2 SER 0 HB2 SER 0 -1.015 -10.608 -4.549
6 HB3 SER 0 HB3 SER 0 0.263 -9.531 -3.999
7 HG SER 0 HG SER 0 1.477 -11.197 -4.130
8 H MET 1 H MET 1 -1.990 -8.805 -0.646
9 HA MET 1 HA MET 1 -4.295 -7.986 -2.221
10 HB2 MET 1 HB2 MET 1 -3.380 -7.059 0.517
11 HB3 MET 1 HB3 MET 1 -4.901 -6.638 -0.247
12 HG2 MET 1 HG2 MET 1 -5.560 -9.013 -0.174
13 HG3 MET 1 HG3 MET 1 -4.033 -9.367 0.641
14 HE1 MET 1 HE1 MET 1 -7.433 -6.818 2.457
15 HE2 MET 1 HE2 MET 1 -7.452 -7.509 0.835
16 HE3 MET 1 HE3 MET 1 -6.366 -6.171 1.213
17 H ASN 2 H ASN 2 -3.608 -6.695 -3.872
18 HA ASN 2 HA ASN 2 -1.548 -4.767 -3.421
19 HB2 ASN 2 HB2 ASN 2 -3.151 -5.495 -5.855
20 HB3 ASN 2 HB3 ASN 2 -2.107 -4.083 -5.839
21 HD21 ASN 2 HD21 ASN 2 0.141 -4.380 -5.733
22 HD22 ASN 2 HD22 ASN 2 0.893 -5.892 -6.048
23 H ARG 3 H ARG 3 -1.647 -2.662 -3.454
24 HA ARG 3 HA ARG 3 -4.233 -1.284 -3.322
25 HB2 ARG 3 HB2 ARG 3 -2.964 -1.770 -1.075
26 HB3 ARG 3 HB3 ARG 3 -1.807 -0.604 -1.701
27 HG2 ARG 3 HG2 ARG 3 -3.107 0.701 -0.346
28 HG3 ARG 3 HG3 ARG 3 -3.847 0.954 -1.928
29 HD2 ARG 3 HD2 ARG 3 -5.420 -0.888 -1.357
30 HD3 ARG 3 HD3 ARG 3 -4.801 -0.841 0.290
31 HE ARG 3 HE ARG 3 -6.245 1.346 -1.057
32 HH11 ARG 3 HH11 ARG 3 -5.264 -0.216 2.014
33 HH12 ARG 3 HH12 ARG 3 -6.019 0.958 2.965
34 HH21 ARG 3 HH21 ARG 3 -7.235 2.847 0.232
35 HH22 ARG 3 HH22 ARG 3 -7.173 2.845 1.937
36 H LEU 4 H LEU 4 -3.927 1.028 -4.012
37 HA LEU 4 HA LEU 4 -1.512 1.380 -5.661
38 HB2 LEU 4 HB2 LEU 4 -4.314 2.408 -6.121
39 HB3 LEU 4 HB3 LEU 4 -2.918 2.862 -7.070
40 HG LEU 4 HG LEU 4 -4.041 0.060 -6.902
41 HD11 LEU 4 HD11 LEU 4 -5.556 1.650 -8.000
42 HD12 LEU 4 HD12 LEU 4 -4.916 0.445 -9.112
43 HD13 LEU 4 HD13 LEU 4 -4.261 2.087 -9.114
44 HD21 LEU 4 HD21 LEU 4 -2.585 -0.328 -8.862
45 HD22 LEU 4 HD22 LEU 4 -1.678 0.049 -7.400
46 HD23 LEU 4 HD23 LEU 4 -1.899 1.283 -8.643
47 H GLY 5 H GLY 5 -0.302 3.090 -5.195
48 HA2 GLY 5 HA2 GLY 5 -1.531 5.453 -4.098
49 HA3 GLY 5 HA3 GLY 5 -0.401 4.631 -3.018
50 H ILE 6 H ILE 6 -0.200 7.189 -4.008
51 HA ILE 6 HA ILE 6 1.873 7.118 -6.069
52 HB ILE 6 HB ILE 6 0.596 9.484 -4.672
53 HG12 ILE 6 HG12 ILE 6 -0.078 8.423 -7.416
54 HG13 ILE 6 HG13 ILE 6 -1.017 8.040 -5.979
55 HG21 ILE 6 HG21 ILE 6 2.759 9.994 -5.673
56 HG22 ILE 6 HG22 ILE 6 1.460 10.780 -6.574
57 HG23 ILE 6 HG23 ILE 6 2.221 9.326 -7.213
58 HD11 ILE 6 HD11 ILE 6 -0.536 10.793 -7.066
59 HD12 ILE 6 HD12 ILE 6 -1.565 10.377 -5.691
60 HD13 ILE 6 HD13 ILE 6 -1.992 9.838 -7.317
61 H ILE 7 H ILE 7 3.948 7.303 -5.545
62 HA ILE 7 HA ILE 7 4.812 7.357 -2.851
63 HB ILE 7 HB ILE 7 6.440 8.066 -5.307
64 HG12 ILE 7 HG12 ILE 7 5.445 5.831 -5.586
65 HG13 ILE 7 HG13 ILE 7 7.176 5.712 -5.325
66 HG21 ILE 7 HG21 ILE 7 7.351 7.033 -2.616
67 HG22 ILE 7 HG22 ILE 7 7.440 8.711 -3.138
68 HG23 ILE 7 HG23 ILE 7 8.387 7.480 -3.977
69 HD11 ILE 7 HD11 ILE 7 6.604 5.223 -2.884
70 HD12 ILE 7 HD12 ILE 7 6.174 3.998 -4.078
71 HD13 ILE 7 HD13 ILE 7 4.942 5.078 -3.448
72 H TYR 8 H TYR 8 4.277 8.995 -1.716
73 HA TYR 8 HA TYR 8 4.112 11.690 -2.706
74 HB2 TYR 8 HB2 TYR 8 2.482 10.602 -1.151
75 HB3 TYR 8 HB3 TYR 8 3.738 10.571 0.072
76 HD1 TYR 8 HD1 TYR 8 4.176 12.481 1.400
77 HD2 TYR 8 HD2 TYR 8 1.588 12.777 -1.951
78 HE1 TYR 8 HE1 TYR 8 3.431 14.689 2.182
79 HE2 TYR 8 HE2 TYR 8 0.839 14.988 -1.188
80 HH TYR 8 HH TYR 8 0.706 16.161 1.121
81 H GLU 9 H GLU 9 6.157 9.719 -0.639
82 HA GLU 9 HA GLU 9 8.298 11.612 -0.723
83 HB2 GLU 9 HB2 GLU 9 6.657 12.442 1.071
84 HB3 GLU 9 HB3 GLU 9 7.091 11.009 1.980
85 HG2 GLU 9 HG2 GLU 9 9.380 11.754 2.130
86 HG3 GLU 9 HG3 GLU 9 9.020 13.139 1.103
87 H ILE 10 H ILE 10 10.188 10.703 0.528
88 HA ILE 10 HA ILE 10 10.061 7.779 0.820
89 HB ILE 10 HB ILE 10 12.256 9.495 -0.383
90 HG12 ILE 10 HG12 ILE 10 10.387 8.893 -1.921
91 HG13 ILE 10 HG13 ILE 10 11.944 8.248 -2.427
92 HG21 ILE 10 HG21 ILE 10 13.561 7.431 -0.670
93 HG22 ILE 10 HG22 ILE 10 12.334 6.550 0.243
94 HG23 ILE 10 HG23 ILE 10 13.275 7.814 1.030
95 HD11 ILE 10 HD11 ILE 10 10.210 6.618 -2.773
96 HD12 ILE 10 HD12 ILE 10 9.704 6.733 -1.091
97 HD13 ILE 10 HD13 ILE 10 11.285 6.059 -1.491
98 H GLN 11 H GLN 11 10.975 7.027 2.680
99 HA GLN 11 HA GLN 11 12.548 8.887 4.296
100 HB2 GLN 11 HB2 GLN 11 10.099 7.452 5.032
101 HB3 GLN 11 HB3 GLN 11 11.433 7.156 6.140
102 HG2 GLN 11 HG2 GLN 11 10.613 8.981 7.141
103 HG3 GLN 11 HG3 GLN 11 11.605 9.817 5.955
104 HE21 GLN 11 HE21 GLN 11 10.574 10.694 4.098
105 HE22 GLN 11 HE22 GLN 11 8.896 11.116 4.186
106 H GLY 12 H GLY 12 14.293 7.870 3.200
107 HA2 GLY 12 HA2 GLY 12 16.060 6.406 3.125
108 HA3 GLY 12 HA3 GLY 12 15.471 5.749 4.648
109 H MET 13 H MET 13 14.540 3.808 4.656
110 HA MET 13 HA MET 13 14.263 2.443 2.085
111 HB2 MET 13 HB2 MET 13 14.599 1.383 4.889
112 HB3 MET 13 HB3 MET 13 14.139 0.352 3.549
113 HG2 MET 13 HG2 MET 13 16.622 2.018 3.403
114 HG3 MET 13 HG3 MET 13 16.621 0.492 4.275
115 HE1 MET 13 HE1 MET 13 16.662 1.122 -0.253
116 HE2 MET 13 HE2 MET 13 16.776 2.350 1.009
117 HE3 MET 13 HE3 MET 13 15.209 1.684 0.550
118 H LYS 14 H LYS 14 12.397 4.186 3.954
119 HA LYS 14 HA LYS 14 10.012 2.501 3.594
120 HB2 LYS 14 HB2 LYS 14 10.268 5.011 5.262
121 HB3 LYS 14 HB3 LYS 14 8.931 3.879 5.250
122 HG2 LYS 14 HG2 LYS 14 10.356 2.177 6.267
123 HG3 LYS 14 HG3 LYS 14 11.713 3.303 6.255
124 HD2 LYS 14 HD2 LYS 14 10.390 4.839 7.682
125 HD3 LYS 14 HD3 LYS 14 9.114 3.623 7.749
126 HE2 LYS 14 HE2 LYS 14 10.657 2.050 8.804
127 HE3 LYS 14 HE3 LYS 14 11.947 3.245 8.706
128 HZ1 LYS 14 HZ1 LYS 14 11.035 3.295 10.895
129 HZ2 LYS 14 HZ2 LYS 14 9.466 3.424 10.303
130 HZ3 LYS 14 HZ3 LYS 14 10.535 4.706 10.112
131 H ALA 15 H ALA 15 8.146 3.601 2.718
132 HA ALA 15 HA ALA 15 8.702 6.106 1.324
133 HB1 ALA 15 HB1 ALA 15 7.434 3.658 0.081
134 HB2 ALA 15 HB2 ALA 15 9.021 4.316 -0.314
135 HB3 ALA 15 HB3 ALA 15 7.566 5.242 -0.679
136 H VAL 16 H VAL 16 6.944 7.420 1.146
137 HA VAL 16 HA VAL 16 4.604 6.630 2.725
138 HB VAL 16 HB VAL 16 5.474 9.391 1.779
139 HG11 VAL 16 HG11 VAL 16 3.216 8.610 3.626
140 HG12 VAL 16 HG12 VAL 16 3.042 9.190 1.971
141 HG13 VAL 16 HG13 VAL 16 3.691 10.260 3.215
142 HG21 VAL 16 HG21 VAL 16 5.967 9.878 4.091
143 HG22 VAL 16 HG22 VAL 16 6.915 8.473 3.573
144 HG23 VAL 16 HG23 VAL 16 5.460 8.263 4.562
145 H VAL 17 H VAL 17 3.011 5.895 1.524
146 HA VAL 17 HA VAL 17 2.758 6.986 -1.172
147 HB VAL 17 HB VAL 17 1.132 5.055 -1.536
148 HG11 VAL 17 HG11 VAL 17 4.107 4.737 -1.417
149 HG12 VAL 17 HG12 VAL 17 3.031 5.023 -2.789
150 HG13 VAL 17 HG13 VAL 17 3.033 3.462 -1.986
151 HG21 VAL 17 HG21 VAL 17 2.504 4.061 0.964
152 HG22 VAL 17 HG22 VAL 17 1.758 2.994 -0.223
153 HG23 VAL 17 HG23 VAL 17 0.783 4.202 0.603
154 H LEU 18 H LEU 18 1.173 8.162 -1.674
155 HA LEU 18 HA LEU 18 -1.033 8.493 0.185
156 HB2 LEU 18 HB2 LEU 18 0.041 10.519 -0.604
157 HB3 LEU 18 HB3 LEU 18 -0.108 10.004 -2.266
158 HG LEU 18 HG LEU 18 -2.553 10.236 -2.128
159 HD11 LEU 18 HD11 LEU 18 -2.891 9.795 0.223
160 HD12 LEU 18 HD12 LEU 18 -3.563 11.372 -0.199
161 HD13 LEU 18 HD13 LEU 18 -2.023 11.269 0.650
162 HD21 LEU 18 HD21 LEU 18 -0.976 12.667 -1.301
163 HD22 LEU 18 HD22 LEU 18 -2.603 12.698 -1.976
164 HD23 LEU 18 HD23 LEU 18 -1.259 12.095 -2.949
165 H THR 19 H THR 19 -2.447 6.939 -0.161
166 HA THR 19 HA THR 19 -2.649 5.516 -2.577
167 HB THR 19 HB THR 19 -4.784 4.589 -1.563
168 HG1 THR 19 HG1 THR 19 -3.918 5.910 0.769
169 HG21 THR 19 HG21 THR 19 -3.568 3.392 0.242
170 HG22 THR 19 HG22 THR 19 -2.230 4.530 0.042
171 HG23 THR 19 HG23 THR 19 -2.670 3.446 -1.277
172 H SER 20 H SER 20 -4.622 5.327 -3.899
173 HA SER 20 HA SER 20 -5.362 7.745 -5.030
174 HB2 SER 20 HB2 SER 20 -7.055 6.105 -6.129
175 HB3 SER 20 HB3 SER 20 -5.321 5.835 -6.367
176 HG SER 20 HG SER 20 -6.619 3.982 -5.701
177 H GLU 21 H GLU 21 -6.500 6.152 -2.293
178 HA GLU 21 HA GLU 21 -9.155 7.366 -2.272
179 HB2 GLU 21 HB2 GLU 21 -7.861 5.438 -0.346
180 HB3 GLU 21 HB3 GLU 21 -9.549 5.921 -0.351
181 HG2 GLU 21 HG2 GLU 21 -10.043 4.688 -2.235
182 HG3 GLU 21 HG3 GLU 21 -8.374 4.701 -2.800
183 H GLY 22 H GLY 22 -6.151 8.392 -1.541
184 HA2 GLY 22 HA2 GLY 22 -5.514 10.305 -0.461
185 HA3 GLY 22 HA3 GLY 22 -7.152 10.484 0.131
186 H GLU 23 H GLU 23 -5.202 7.623 0.725
187 HA GLU 23 HA GLU 23 -4.964 8.476 3.543
188 HB2 GLU 23 HB2 GLU 23 -4.964 5.622 2.524
189 HB3 GLU 23 HB3 GLU 23 -5.051 6.152 4.193
190 HG2 GLU 23 HG2 GLU 23 -7.274 7.169 3.671
191 HG3 GLU 23 HG3 GLU 23 -7.176 6.414 2.082
192 H PHE 24 H PHE 24 -2.881 8.535 4.399
193 HA PHE 24 HA PHE 24 -0.730 7.897 2.538
194 HB2 PHE 24 HB2 PHE 24 -0.550 9.291 5.243
195 HB3 PHE 24 HB3 PHE 24 0.751 9.028 4.117
196 HD1 PHE 24 HD1 PHE 24 1.141 10.445 2.281
197 HD2 PHE 24 HD2 PHE 24 -2.366 10.932 4.643
198 HE1 PHE 24 HE1 PHE 24 0.729 12.622 1.227
199 HE2 PHE 24 HE2 PHE 24 -2.778 13.110 3.589
200 HZ PHE 24 HZ PHE 24 -1.228 13.956 1.875
201 H LEU 25 H LEU 25 0.282 6.075 2.676
202 HA LEU 25 HA LEU 25 0.252 4.585 5.220
203 HB2 LEU 25 HB2 LEU 25 0.053 3.660 2.371
204 HB3 LEU 25 HB3 LEU 25 0.714 2.600 3.589
205 HG LEU 25 HG LEU 25 -1.486 2.761 4.805
206 HD11 LEU 25 HD11 LEU 25 -2.256 4.875 3.788
207 HD12 LEU 25 HD12 LEU 25 -3.427 3.568 3.627
208 HD13 LEU 25 HD13 LEU 25 -2.433 4.040 2.244
209 HD21 LEU 25 HD21 LEU 25 -1.291 1.691 2.025
210 HD22 LEU 25 HD22 LEU 25 -2.671 1.348 3.080
211 HD23 LEU 25 HD23 LEU 25 -1.045 0.831 3.544
212 H ILE 26 H ILE 26 2.213 3.651 5.860
213 HA ILE 26 HA ILE 26 4.564 4.623 4.425
214 HB ILE 26 HB ILE 26 4.516 3.271 7.138
215 HG12 ILE 26 HG12 ILE 26 3.109 5.315 7.252
216 HG13 ILE 26 HG13 ILE 26 4.575 5.478 8.205
217 HG21 ILE 26 HG21 ILE 26 6.670 3.275 6.058
218 HG22 ILE 26 HG22 ILE 26 6.701 4.384 7.427
219 HG23 ILE 26 HG23 ILE 26 6.568 5.014 5.787
220 HD11 ILE 26 HD11 ILE 26 4.079 6.673 5.485
221 HD12 ILE 26 HD12 ILE 26 5.569 6.825 6.416
222 HD13 ILE 26 HD13 ILE 26 4.075 7.532 7.025
223 H ILE 27 H ILE 27 5.378 3.223 3.072
224 HA ILE 27 HA ILE 27 5.024 0.375 3.678
225 HB ILE 27 HB ILE 27 4.928 -0.096 1.280
226 HG12 ILE 27 HG12 ILE 27 4.678 2.872 0.797
227 HG13 ILE 27 HG13 ILE 27 6.210 2.014 0.649
228 HG21 ILE 27 HG21 ILE 27 2.876 1.892 2.233
229 HG22 ILE 27 HG22 ILE 27 2.825 0.139 2.426
230 HG23 ILE 27 HG23 ILE 27 2.684 0.853 0.823
231 HD11 ILE 27 HD11 ILE 27 5.263 0.615 -1.094
232 HD12 ILE 27 HD12 ILE 27 5.131 2.329 -1.494
233 HD13 ILE 27 HD13 ILE 27 3.716 1.445 -0.923
234 H ARG 28 H ARG 28 6.540 -0.952 2.499
235 HA ARG 28 HA ARG 28 9.240 -0.248 2.964
236 HB2 ARG 28 HB2 ARG 28 8.127 -2.401 1.187
237 HB3 ARG 28 HB3 ARG 28 9.771 -2.319 1.795
238 HG2 ARG 28 HG2 ARG 28 8.928 -2.657 4.067
239 HG3 ARG 28 HG3 ARG 28 7.281 -2.733 3.435
240 HD2 ARG 28 HD2 ARG 28 9.546 -4.647 2.979
241 HD3 ARG 28 HD3 ARG 28 7.949 -4.976 3.649
242 HE ARG 28 HE ARG 28 7.475 -4.070 1.113
243 HH11 ARG 28 HH11 ARG 28 9.395 -6.704 2.430
244 HH12 ARG 28 HH12 ARG 28 9.142 -7.748 1.099
245 HH21 ARG 28 HH21 ARG 28 7.189 -5.374 -0.699
246 HH22 ARG 28 HH22 ARG 28 7.866 -6.953 -0.759
247 H ARG 29 H ARG 29 10.539 0.846 1.689
248 HA ARG 29 HA ARG 29 9.613 1.646 -0.904
249 HB2 ARG 29 HB2 ARG 29 10.785 3.248 0.499
250 HB3 ARG 29 HB3 ARG 29 12.179 2.186 0.569
251 HG2 ARG 29 HG2 ARG 29 11.992 2.427 -2.067
252 HG3 ARG 29 HG3 ARG 29 11.266 3.967 -1.599
253 HD2 ARG 29 HD2 ARG 29 13.184 4.406 -0.174
254 HD3 ARG 29 HD3 ARG 29 13.875 2.862 -0.714
255 HE ARG 29 HE ARG 29 13.542 4.096 -3.028
256 HH11 ARG 29 HH11 ARG 29 15.061 5.221 -0.010
257 HH12 ARG 29 HH12 ARG 29 16.051 6.360 -0.772
258 HH21 ARG 29 HH21 ARG 29 14.930 5.641 -4.079
259 HH22 ARG 29 HH22 ARG 29 15.982 6.607 -3.155
260 H ARG 30 H ARG 30 9.967 0.550 -2.593
261 HA ARG 30 HA ARG 30 11.909 -1.600 -2.633
262 HB2 ARG 30 HB2 ARG 30 9.888 -0.764 -4.757
263 HB3 ARG 30 HB3 ARG 30 10.863 -2.225 -4.780
264 HG2 ARG 30 HG2 ARG 30 9.641 -3.089 -2.839
265 HG3 ARG 30 HG3 ARG 30 8.691 -1.603 -2.772
266 HD2 ARG 30 HD2 ARG 30 7.854 -2.068 -5.050
267 HD3 ARG 30 HD3 ARG 30 8.748 -3.581 -5.054
268 HE ARG 30 HE ARG 30 6.994 -3.512 -2.818
269 HH11 ARG 30 HH11 ARG 30 6.920 -3.871 -6.355
270 HH12 ARG 30 HH12 ARG 30 5.478 -4.771 -6.376
271 HH21 ARG 30 HH21 ARG 30 4.978 -4.724 -2.859
272 HH22 ARG 30 HH22 ARG 30 4.311 -5.260 -4.302
273 H LYS 31 H LYS 31 13.050 -1.579 -5.016
274 HA LYS 31 HA LYS 31 14.585 0.823 -4.736
275 HB2 LYS 31 HB2 LYS 31 14.994 -1.579 -6.484
276 HB3 LYS 31 HB3 LYS 31 16.108 -0.211 -6.415
277 HG2 LYS 31 HG2 LYS 31 16.573 -0.606 -4.123
278 HG3 LYS 31 HG3 LYS 31 15.271 -1.786 -4.008
279 HD2 LYS 31 HD2 LYS 31 16.547 -3.121 -5.752
280 HD3 LYS 31 HD3 LYS 31 17.899 -2.032 -5.428
281 HE2 LYS 31 HE2 LYS 31 18.160 -3.965 -4.050
282 HE3 LYS 31 HE3 LYS 31 17.715 -2.608 -3.027
283 HZ1 LYS 31 HZ1 LYS 31 15.819 -4.681 -4.000
284 HZ2 LYS 31 HZ2 LYS 31 15.430 -3.428 -2.950
285 HZ3 LYS 31 HZ3 LYS 31 16.505 -4.645 -2.473
286 H ASP 32 H ASP 32 12.087 -0.129 -6.805
287 HA ASP 32 HA ASP 32 12.845 1.840 -8.829
288 HB2 ASP 32 HB2 ASP 32 11.692 -0.503 -9.237
289 HB3 ASP 32 HB3 ASP 32 10.220 0.410 -8.920
290 H MET 33 H MET 33 11.735 2.257 -5.947
291 HA MET 33 HA MET 33 9.311 3.701 -6.264
292 HB2 MET 33 HB2 MET 33 11.140 3.062 -4.101
293 HB3 MET 33 HB3 MET 33 10.496 4.692 -3.973
294 HG2 MET 33 HG2 MET 33 9.125 3.158 -2.728
295 HG3 MET 33 HG3 MET 33 8.231 3.780 -4.114
296 HE1 MET 33 HE1 MET 33 6.860 0.124 -3.711
297 HE2 MET 33 HE2 MET 33 6.448 1.838 -3.749
298 HE3 MET 33 HE3 MET 33 7.380 1.184 -2.403
299 H LYS 34 H LYS 34 9.267 5.416 -7.550
300 HA LYS 34 HA LYS 34 11.238 7.500 -7.051
301 HB2 LYS 34 HB2 LYS 34 9.788 6.652 -9.529
302 HB3 LYS 34 HB3 LYS 34 10.287 8.318 -9.342
303 HG2 LYS 34 HG2 LYS 34 12.167 7.614 -10.368
304 HG3 LYS 34 HG3 LYS 34 12.614 7.066 -8.758
305 HD2 LYS 34 HD2 LYS 34 13.037 5.262 -10.267
306 HD3 LYS 34 HD3 LYS 34 11.593 4.836 -9.347
307 HE2 LYS 34 HE2 LYS 34 10.176 5.481 -11.200
308 HE3 LYS 34 HE3 LYS 34 11.564 6.078 -12.100
309 HZ1 LYS 34 HZ1 LYS 34 10.915 3.942 -12.902
310 HZ2 LYS 34 HZ2 LYS 34 10.994 3.224 -11.404
311 HZ3 LYS 34 HZ3 LYS 34 12.408 3.780 -12.158
312 H VAL 35 H VAL 35 10.453 9.475 -6.559
313 HA VAL 35 HA VAL 35 7.921 9.551 -5.303
314 HB VAL 35 HB VAL 35 9.648 11.952 -5.974
315 HG11 VAL 35 HG11 VAL 35 7.402 12.453 -5.118
316 HG12 VAL 35 HG12 VAL 35 8.667 12.924 -3.978
317 HG13 VAL 35 HG13 VAL 35 7.733 11.464 -3.691
318 HG21 VAL 35 HG21 VAL 35 9.858 10.121 -3.586
319 HG22 VAL 35 HG22 VAL 35 10.746 11.627 -3.800
320 HG23 VAL 35 HG23 VAL 35 11.046 10.262 -4.880
321 H GLY 36 H GLY 36 6.001 10.162 -6.056
322 HA2 GLY 36 HA2 GLY 36 4.633 11.640 -7.337
323 HA3 GLY 36 HA3 GLY 36 5.902 11.707 -8.543
324 H GLN 37 H GLN 37 5.988 8.598 -8.076
325 HA GLN 37 HA GLN 37 4.007 8.183 -10.158
326 HB2 GLN 37 HB2 GLN 37 5.155 6.219 -10.820
327 HB3 GLN 37 HB3 GLN 37 6.379 7.431 -10.498
328 HG2 GLN 37 HG2 GLN 37 6.720 6.386 -8.260
329 HG3 GLN 37 HG3 GLN 37 5.614 5.110 -8.759
330 HE21 GLN 37 HE21 GLN 37 7.205 3.541 -8.599
331 HE22 GLN 37 HE22 GLN 37 8.512 3.414 -9.706
332 H GLN 38 H GLN 38 2.460 6.607 -10.133
333 HA GLN 38 HA GLN 38 1.513 5.851 -7.495
334 HB2 GLN 38 HB2 GLN 38 -0.031 6.790 -9.254
335 HB3 GLN 38 HB3 GLN 38 0.269 5.348 -10.208
336 HG2 GLN 38 HG2 GLN 38 -0.601 4.015 -8.256
337 HG3 GLN 38 HG3 GLN 38 -1.131 5.546 -7.559
338 HE21 GLN 38 HE21 GLN 38 -2.850 6.653 -8.526
339 HE22 GLN 38 HE22 GLN 38 -3.858 5.913 -9.690
340 H VAL 39 H VAL 39 2.041 3.992 -6.673
341 HA VAL 39 HA VAL 39 3.084 1.914 -8.463
342 HB VAL 39 HB VAL 39 4.433 1.105 -6.552
343 HG11 VAL 39 HG11 VAL 39 6.022 2.978 -6.388
344 HG12 VAL 39 HG12 VAL 39 4.833 4.004 -7.183
345 HG13 VAL 39 HG13 VAL 39 5.520 2.625 -8.043
346 HG21 VAL 39 HG21 VAL 39 2.984 1.838 -4.735
347 HG22 VAL 39 HG22 VAL 39 3.371 3.522 -5.090
348 HG23 VAL 39 HG23 VAL 39 4.628 2.432 -4.504
349 H SER 40 H SER 40 2.540 -0.239 -7.981
350 HA SER 40 HA SER 40 0.209 -0.518 -6.275
351 HB2 SER 40 HB2 SER 40 0.151 -1.265 -8.733
352 HB3 SER 40 HB3 SER 40 1.261 -2.550 -8.255
353 HG SER 40 HG SER 40 -1.370 -2.062 -7.368
354 H PHE 41 H PHE 41 0.648 -1.238 -4.373
355 HA PHE 41 HA PHE 41 2.968 -2.995 -3.992
356 HB2 PHE 41 HB2 PHE 41 3.101 -2.064 -1.685
357 HB3 PHE 41 HB3 PHE 41 3.514 -0.905 -2.928
358 HD1 PHE 41 HD1 PHE 41 1.763 0.857 -3.527
359 HD2 PHE 41 HD2 PHE 41 1.364 -1.674 -0.121
360 HE1 PHE 41 HE1 PHE 41 0.122 2.408 -2.560
361 HE2 PHE 41 HE2 PHE 41 -0.271 -0.133 0.835
362 HZ PHE 41 HZ PHE 41 -0.899 1.914 -0.382
363 H GLU 42 H GLU 42 2.648 -4.229 -1.940
364 HA GLU 42 HA GLU 42 -0.143 -5.107 -1.929
365 HB2 GLU 42 HB2 GLU 42 2.369 -6.554 -1.127
366 HB3 GLU 42 HB3 GLU 42 0.751 -7.166 -0.833
367 HG2 GLU 42 HG2 GLU 42 1.204 -8.249 -2.698
368 HG3 GLU 42 HG3 GLU 42 0.546 -6.789 -3.452
369 H ASN 43 H ASN 43 -0.828 -5.970 0.179
370 HA ASN 43 HA ASN 43 -0.403 -4.064 2.238
371 HB2 ASN 43 HB2 ASN 43 -1.939 -6.642 2.081
372 HB3 ASN 43 HB3 ASN 43 -1.632 -5.935 3.663
373 HD21 ASN 43 HD21 ASN 43 -2.592 -4.612 0.445
374 HD22 ASN 43 HD22 ASN 43 -3.951 -3.767 1.050
375 H GLU 44 H GLU 44 1.257 -6.730 1.202
376 HA GLU 44 HA GLU 44 2.622 -7.465 3.606
377 HB2 GLU 44 HB2 GLU 44 3.402 -7.981 0.729
378 HB3 GLU 44 HB3 GLU 44 3.978 -8.845 2.148
379 HG2 GLU 44 HG2 GLU 44 1.719 -9.696 2.540
380 HG3 GLU 44 HG3 GLU 44 1.153 -8.844 1.106
381 H ASP 45 H ASP 45 2.823 -4.867 1.395
382 HA ASP 45 HA ASP 45 5.656 -4.365 1.900
383 HB2 ASP 45 HB2 ASP 45 3.639 -2.930 0.182
384 HB3 ASP 45 HB3 ASP 45 5.250 -2.306 0.490
385 H ILE 46 H ILE 46 2.772 -3.703 3.413
386 HA ILE 46 HA ILE 46 3.376 -0.976 4.035
387 HB ILE 46 HB ILE 46 1.235 -2.706 5.324
388 HG12 ILE 46 HG12 ILE 46 0.950 -0.898 2.918
389 HG13 ILE 46 HG13 ILE 46 1.114 -2.644 2.806
390 HG21 ILE 46 HG21 ILE 46 0.142 -0.522 5.696
391 HG22 ILE 46 HG22 ILE 46 1.531 0.288 4.972
392 HG23 ILE 46 HG23 ILE 46 1.717 -0.601 6.485
393 HD11 ILE 46 HD11 ILE 46 -1.113 -1.178 4.207
394 HD12 ILE 46 HD12 ILE 46 -0.971 -2.926 4.010
395 HD13 ILE 46 HD13 ILE 46 -1.187 -1.893 2.594
396 H TYR 47 H TYR 47 4.481 -0.234 5.660
397 HA TYR 47 HA TYR 47 6.096 -1.985 7.213
398 HB2 TYR 47 HB2 TYR 47 5.977 0.818 6.617
399 HB3 TYR 47 HB3 TYR 47 6.206 0.581 8.352
400 HD1 TYR 47 HD1 TYR 47 7.716 0.488 5.104
401 HD2 TYR 47 HD2 TYR 47 8.167 -0.791 9.123
402 HE1 TYR 47 HE1 TYR 47 10.121 0.067 4.701
403 HE2 TYR 47 HE2 TYR 47 10.557 -1.211 8.731
404 HH TYR 47 HH TYR 47 11.936 -1.791 6.621
405 H ASN 48 H ASN 48 3.151 -0.307 7.769
406 HA ASN 48 HA ASN 48 3.169 -1.373 10.500
407 HB2 ASN 48 HB2 ASN 48 1.636 1.068 9.556
408 HB3 ASN 48 HB3 ASN 48 1.589 0.380 11.168
409 HD21 ASN 48 HD21 ASN 48 3.418 2.116 8.906
410 HD22 ASN 48 HD22 ASN 48 4.625 2.767 9.970
411 H VAL 49 H VAL 49 2.045 -3.001 10.564
412 HA VAL 49 HA VAL 49 0.066 -3.610 8.568
413 HB VAL 49 HB VAL 49 0.667 -5.283 11.028
414 HG11 VAL 49 HG11 VAL 49 -0.150 -7.147 9.626
415 HG12 VAL 49 HG12 VAL 49 -0.542 -5.991 8.352
416 HG13 VAL 49 HG13 VAL 49 -1.385 -5.919 9.898
417 HG21 VAL 49 HG21 VAL 49 1.964 -5.437 8.302
418 HG22 VAL 49 HG22 VAL 49 2.250 -6.540 9.648
419 HG23 VAL 49 HG23 VAL 49 2.737 -4.851 9.773
420 H ARG 50 H ARG 50 -1.317 -1.966 8.928
421 HA ARG 50 HA ARG 50 -2.806 -1.453 11.271
422 HB2 ARG 50 HB2 ARG 50 -2.497 0.040 9.275
423 HB3 ARG 50 HB3 ARG 50 -3.633 -0.976 8.409
424 HG2 ARG 50 HG2 ARG 50 -5.366 -0.378 10.073
425 HG3 ARG 50 HG3 ARG 50 -4.203 0.715 10.837
426 HD2 ARG 50 HD2 ARG 50 -3.951 1.911 8.718
427 HD3 ARG 50 HD3 ARG 50 -5.145 0.849 7.983
428 HE ARG 50 HE ARG 50 -5.724 2.666 10.218
429 HH11 ARG 50 HH11 ARG 50 -6.796 0.989 7.272
430 HH12 ARG 50 HH12 ARG 50 -8.117 2.024 7.012
431 HH21 ARG 50 HH21 ARG 50 -7.631 4.045 9.862
432 HH22 ARG 50 HH22 ARG 50 -8.596 3.762 8.485
433 H GLY 51 H GLY 51 -3.052 -3.861 8.822
434 HA2 GLY 51 HA2 GLY 51 -4.243 -5.885 9.198
435 HA3 GLY 51 HA3 GLY 51 -5.402 -4.986 10.171
436 H LYS 52 H LYS 52 -5.619 -2.824 8.278
437 HA LYS 52 HA LYS 52 -6.579 -3.853 5.817
438 HB2 LYS 52 HB2 LYS 52 -8.401 -4.449 7.428
439 HB3 LYS 52 HB3 LYS 52 -8.505 -2.757 7.875
440 HG2 LYS 52 HG2 LYS 52 -9.255 -2.190 5.641
441 HG3 LYS 52 HG3 LYS 52 -9.067 -3.870 5.136
442 HD2 LYS 52 HD2 LYS 52 -11.394 -3.441 5.613
443 HD3 LYS 52 HD3 LYS 52 -10.745 -4.530 6.840
444 HE2 LYS 52 HE2 LYS 52 -10.465 -2.589 8.362
445 HE3 LYS 52 HE3 LYS 52 -11.180 -1.557 7.120
446 HZ1 LYS 52 HZ1 LYS 52 -12.505 -3.803 8.521
447 HZ2 LYS 52 HZ2 LYS 52 -13.205 -2.878 7.290
448 HZ3 LYS 52 HZ3 LYS 52 -12.792 -2.157 8.758
Start of MODEL 4
1 H1 SER 0 H1 SER 0 -1.326 -10.525 0.458
2 H2 SER 0 H2 SER 0 -0.658 -9.495 -0.706
3 H3 SER 0 H3 SER 0 0.017 -11.000 -0.474
4 HA SER 0 HA SER 0 -1.318 -10.985 -2.444
5 HB2 SER 0 HB2 SER 0 -1.474 -12.936 -0.661
6 HB3 SER 0 HB3 SER 0 -3.107 -12.328 -0.411
7 HG SER 0 HG SER 0 -2.084 -13.043 -2.959
8 H MET 1 H MET 1 -1.753 -8.454 -1.804
9 HA MET 1 HA MET 1 -4.382 -7.889 -2.575
10 HB2 MET 1 HB2 MET 1 -4.877 -8.360 -0.183
11 HB3 MET 1 HB3 MET 1 -3.640 -7.187 0.258
12 HG2 MET 1 HG2 MET 1 -5.900 -6.311 0.494
13 HG3 MET 1 HG3 MET 1 -4.889 -5.399 -0.616
14 HE1 MET 1 HE1 MET 1 -8.589 -5.134 -2.089
15 HE2 MET 1 HE2 MET 1 -7.234 -4.217 -1.434
16 HE3 MET 1 HE3 MET 1 -8.172 -5.278 -0.383
17 H ASN 2 H ASN 2 -2.947 -6.908 -4.089
18 HA ASN 2 HA ASN 2 -1.273 -4.745 -3.395
19 HB2 ASN 2 HB2 ASN 2 -2.502 -5.531 -6.037
20 HB3 ASN 2 HB3 ASN 2 -1.482 -4.117 -5.855
21 HD21 ASN 2 HD21 ASN 2 0.745 -4.408 -5.437
22 HD22 ASN 2 HD22 ASN 2 1.507 -5.928 -5.729
23 H ARG 3 H ARG 3 -1.651 -2.792 -2.984
24 HA ARG 3 HA ARG 3 -4.259 -1.538 -3.539
25 HB2 ARG 3 HB2 ARG 3 -3.477 -1.867 -1.091
26 HB3 ARG 3 HB3 ARG 3 -2.218 -0.710 -1.487
27 HG2 ARG 3 HG2 ARG 3 -3.807 0.602 -0.442
28 HG3 ARG 3 HG3 ARG 3 -4.143 0.860 -2.153
29 HD2 ARG 3 HD2 ARG 3 -5.544 -1.357 -0.796
30 HD3 ARG 3 HD3 ARG 3 -6.043 0.291 -0.379
31 HE ARG 3 HE ARG 3 -5.949 -0.043 -3.195
32 HH11 ARG 3 HH11 ARG 3 -7.990 -0.924 -0.415
33 HH12 ARG 3 HH12 ARG 3 -9.389 -1.081 -1.380
34 HH21 ARG 3 HH21 ARG 3 -7.884 -0.267 -4.441
35 HH22 ARG 3 HH22 ARG 3 -9.334 -0.709 -3.669
36 H LEU 4 H LEU 4 -3.980 0.825 -4.123
37 HA LEU 4 HA LEU 4 -1.444 1.254 -5.574
38 HB2 LEU 4 HB2 LEU 4 -4.136 2.509 -6.083
39 HB3 LEU 4 HB3 LEU 4 -2.695 2.687 -7.054
40 HG LEU 4 HG LEU 4 -4.292 0.151 -6.730
41 HD11 LEU 4 HD11 LEU 4 -4.068 2.050 -9.052
42 HD12 LEU 4 HD12 LEU 4 -5.478 1.817 -8.017
43 HD13 LEU 4 HD13 LEU 4 -4.919 0.506 -9.056
44 HD21 LEU 4 HD21 LEU 4 -1.873 0.772 -8.418
45 HD22 LEU 4 HD22 LEU 4 -2.878 -0.670 -8.586
46 HD23 LEU 4 HD23 LEU 4 -1.983 -0.389 -7.093
47 H GLY 5 H GLY 5 -0.280 3.019 -5.141
48 HA2 GLY 5 HA2 GLY 5 -1.524 5.307 -3.907
49 HA3 GLY 5 HA3 GLY 5 -0.332 4.479 -2.903
50 H ILE 6 H ILE 6 -0.215 7.081 -3.844
51 HA ILE 6 HA ILE 6 1.795 7.077 -5.975
52 HB ILE 6 HB ILE 6 0.444 9.420 -4.611
53 HG12 ILE 6 HG12 ILE 6 -0.307 8.279 -7.298
54 HG13 ILE 6 HG13 ILE 6 -1.087 7.747 -5.814
55 HG21 ILE 6 HG21 ILE 6 1.939 9.202 -7.235
56 HG22 ILE 6 HG22 ILE 6 2.540 9.959 -5.760
57 HG23 ILE 6 HG23 ILE 6 1.164 10.660 -6.608
58 HD11 ILE 6 HD11 ILE 6 -1.061 10.529 -6.931
59 HD12 ILE 6 HD12 ILE 6 -1.825 10.036 -5.403
60 HD13 ILE 6 HD13 ILE 6 -2.413 9.393 -6.936
61 H ILE 7 H ILE 7 3.832 7.193 -5.516
62 HA ILE 7 HA ILE 7 4.789 7.325 -2.852
63 HB ILE 7 HB ILE 7 6.361 7.880 -5.386
64 HG12 ILE 7 HG12 ILE 7 5.257 5.640 -5.458
65 HG13 ILE 7 HG13 ILE 7 7.005 5.530 -5.378
66 HG21 ILE 7 HG21 ILE 7 7.330 6.973 -2.669
67 HG22 ILE 7 HG22 ILE 7 7.461 8.611 -3.296
68 HG23 ILE 7 HG23 ILE 7 8.333 7.294 -4.087
69 HD11 ILE 7 HD11 ILE 7 5.127 5.175 -3.064
70 HD12 ILE 7 HD12 ILE 7 6.882 5.014 -3.009
71 HD13 ILE 7 HD13 ILE 7 5.917 3.882 -3.961
72 H TYR 8 H TYR 8 4.471 8.966 -1.724
73 HA TYR 8 HA TYR 8 4.341 11.646 -2.793
74 HB2 TYR 8 HB2 TYR 8 2.736 10.559 -1.109
75 HB3 TYR 8 HB3 TYR 8 4.023 10.798 0.065
76 HD1 TYR 8 HD1 TYR 8 4.412 12.935 1.020
77 HD2 TYR 8 HD2 TYR 8 1.709 12.499 -2.223
78 HE1 TYR 8 HE1 TYR 8 3.612 15.210 1.403
79 HE2 TYR 8 HE2 TYR 8 0.890 14.780 -1.856
80 HH TYR 8 HH TYR 8 2.477 16.922 0.353
81 H GLU 9 H GLU 9 6.330 9.647 -0.719
82 HA GLU 9 HA GLU 9 8.523 11.464 -0.869
83 HB2 GLU 9 HB2 GLU 9 6.903 12.428 0.865
84 HB3 GLU 9 HB3 GLU 9 7.314 11.052 1.868
85 HG2 GLU 9 HG2 GLU 9 9.645 11.767 1.899
86 HG3 GLU 9 HG3 GLU 9 9.241 13.126 0.849
87 H ILE 10 H ILE 10 10.390 10.564 0.394
88 HA ILE 10 HA ILE 10 10.154 7.664 0.799
89 HB ILE 10 HB ILE 10 12.417 9.249 -0.441
90 HG12 ILE 10 HG12 ILE 10 10.535 8.686 -1.942
91 HG13 ILE 10 HG13 ILE 10 12.054 7.941 -2.441
92 HG21 ILE 10 HG21 ILE 10 12.401 6.359 0.354
93 HG22 ILE 10 HG22 ILE 10 13.444 7.635 0.978
94 HG23 ILE 10 HG23 ILE 10 13.613 7.096 -0.694
95 HD11 ILE 10 HD11 ILE 10 9.737 6.600 -1.055
96 HD12 ILE 10 HD12 ILE 10 11.274 5.823 -1.425
97 HD13 ILE 10 HD13 ILE 10 10.239 6.395 -2.734
98 H GLN 11 H GLN 11 10.984 6.923 2.677
99 HA GLN 11 HA GLN 11 12.617 8.734 4.289
100 HB2 GLN 11 HB2 GLN 11 10.059 7.513 4.954
101 HB3 GLN 11 HB3 GLN 11 11.314 7.025 6.080
102 HG2 GLN 11 HG2 GLN 11 10.619 8.890 7.134
103 HG3 GLN 11 HG3 GLN 11 11.797 9.646 6.063
104 HE21 GLN 11 HE21 GLN 11 11.016 10.754 4.210
105 HE22 GLN 11 HE22 GLN 11 9.390 11.365 4.196
106 H GLY 12 H GLY 12 14.312 7.515 3.147
107 HA2 GLY 12 HA2 GLY 12 16.058 6.027 3.306
108 HA3 GLY 12 HA3 GLY 12 15.338 5.438 4.797
109 H MET 13 H MET 13 14.223 3.587 4.808
110 HA MET 13 HA MET 13 14.062 2.125 2.273
111 HB2 MET 13 HB2 MET 13 14.346 1.254 5.117
112 HB3 MET 13 HB3 MET 13 13.569 0.178 3.970
113 HG2 MET 13 HG2 MET 13 16.248 1.336 3.347
114 HG3 MET 13 HG3 MET 13 16.109 -0.028 4.447
115 HE1 MET 13 HE1 MET 13 16.242 1.276 0.963
116 HE2 MET 13 HE2 MET 13 14.524 0.918 0.727
117 HE3 MET 13 HE3 MET 13 15.746 -0.042 -0.092
118 H LYS 14 H LYS 14 12.230 4.068 3.962
119 HA LYS 14 HA LYS 14 9.796 2.483 3.566
120 HB2 LYS 14 HB2 LYS 14 10.157 4.939 5.278
121 HB3 LYS 14 HB3 LYS 14 8.723 3.931 5.171
122 HG2 LYS 14 HG2 LYS 14 9.949 2.067 6.147
123 HG3 LYS 14 HG3 LYS 14 11.393 3.073 6.249
124 HD2 LYS 14 HD2 LYS 14 10.244 4.592 7.761
125 HD3 LYS 14 HD3 LYS 14 8.772 3.625 7.629
126 HE2 LYS 14 HE2 LYS 14 9.853 2.974 9.658
127 HE3 LYS 14 HE3 LYS 14 10.081 1.683 8.490
128 HZ1 LYS 14 HZ1 LYS 14 12.071 3.719 9.303
129 HZ2 LYS 14 HZ2 LYS 14 12.315 2.621 8.035
130 HZ3 LYS 14 HZ3 LYS 14 12.095 2.066 9.605
131 H ALA 15 H ALA 15 8.026 3.597 2.672
132 HA ALA 15 HA ALA 15 8.650 6.072 1.249
133 HB1 ALA 15 HB1 ALA 15 7.326 3.637 0.049
134 HB2 ALA 15 HB2 ALA 15 8.930 4.252 -0.353
135 HB3 ALA 15 HB3 ALA 15 7.497 5.205 -0.739
136 H VAL 16 H VAL 16 6.959 7.439 1.092
137 HA VAL 16 HA VAL 16 4.577 6.774 2.670
138 HB VAL 16 HB VAL 16 5.459 9.460 1.544
139 HG11 VAL 16 HG11 VAL 16 3.776 10.435 3.022
140 HG12 VAL 16 HG12 VAL 16 3.299 8.823 3.551
141 HG13 VAL 16 HG13 VAL 16 3.045 9.312 1.875
142 HG21 VAL 16 HG21 VAL 16 7.025 8.740 3.256
143 HG22 VAL 16 HG22 VAL 16 5.675 8.399 4.349
144 HG23 VAL 16 HG23 VAL 16 6.007 10.056 3.856
145 H VAL 17 H VAL 17 2.827 6.202 1.580
146 HA VAL 17 HA VAL 17 2.636 7.100 -1.202
147 HB VAL 17 HB VAL 17 1.012 5.121 -1.460
148 HG11 VAL 17 HG11 VAL 17 3.083 5.269 -2.639
149 HG12 VAL 17 HG12 VAL 17 2.857 3.619 -2.059
150 HG13 VAL 17 HG13 VAL 17 3.973 4.707 -1.223
151 HG21 VAL 17 HG21 VAL 17 0.870 4.474 0.872
152 HG22 VAL 17 HG22 VAL 17 2.604 4.159 0.913
153 HG23 VAL 17 HG23 VAL 17 1.551 3.157 -0.086
154 H LEU 18 H LEU 18 1.069 8.303 -1.721
155 HA LEU 18 HA LEU 18 -1.191 8.682 0.066
156 HB2 LEU 18 HB2 LEU 18 -0.238 10.668 -0.944
157 HB3 LEU 18 HB3 LEU 18 -0.334 9.973 -2.543
158 HG LEU 18 HG LEU 18 -2.824 10.084 -2.386
159 HD11 LEU 18 HD11 LEU 18 -2.268 11.578 0.171
160 HD12 LEU 18 HD12 LEU 18 -3.061 10.007 0.024
161 HD13 LEU 18 HD13 LEU 18 -3.833 11.448 -0.630
162 HD21 LEU 18 HD21 LEU 18 -2.978 12.509 -2.683
163 HD22 LEU 18 HD22 LEU 18 -1.557 11.853 -3.498
164 HD23 LEU 18 HD23 LEU 18 -1.382 12.699 -1.962
165 H THR 19 H THR 19 -2.518 7.037 -0.080
166 HA THR 19 HA THR 19 -2.577 5.262 -2.290
167 HB THR 19 HB THR 19 -4.430 4.172 -0.996
168 HG1 THR 19 HG1 THR 19 -3.715 5.874 1.114
169 HG21 THR 19 HG21 THR 19 -2.947 3.372 0.749
170 HG22 THR 19 HG22 THR 19 -1.935 4.806 0.581
171 HG23 THR 19 HG23 THR 19 -2.011 3.629 -0.728
172 H SER 20 H SER 20 -4.735 4.460 -3.152
173 HA SER 20 HA SER 20 -6.168 6.401 -4.547
174 HB2 SER 20 HB2 SER 20 -7.689 4.320 -4.841
175 HB3 SER 20 HB3 SER 20 -6.022 4.242 -5.431
176 HG SER 20 HG SER 20 -7.163 3.048 -3.131
177 H GLU 21 H GLU 21 -6.349 5.170 -1.404
178 HA GLU 21 HA GLU 21 -9.084 5.857 -0.817
179 HB2 GLU 21 HB2 GLU 21 -7.035 5.375 1.299
180 HB3 GLU 21 HB3 GLU 21 -8.714 4.868 1.239
181 HG2 GLU 21 HG2 GLU 21 -6.478 3.661 -0.387
182 HG3 GLU 21 HG3 GLU 21 -7.135 2.994 1.103
183 H GLY 22 H GLY 22 -6.151 7.555 -1.112
184 HA2 GLY 22 HA2 GLY 22 -5.731 9.790 -0.749
185 HA3 GLY 22 HA3 GLY 22 -7.289 9.924 0.060
186 H GLU 23 H GLU 23 -5.333 7.394 1.142
187 HA GLU 23 HA GLU 23 -4.771 8.863 3.621
188 HB2 GLU 23 HB2 GLU 23 -4.853 5.904 3.024
189 HB3 GLU 23 HB3 GLU 23 -4.474 6.596 4.588
190 HG2 GLU 23 HG2 GLU 23 -7.086 6.934 3.137
191 HG3 GLU 23 HG3 GLU 23 -6.777 5.765 4.424
192 H PHE 24 H PHE 24 -2.667 9.085 4.302
193 HA PHE 24 HA PHE 24 -0.609 8.253 2.429
194 HB2 PHE 24 HB2 PHE 24 -0.346 9.885 4.986
195 HB3 PHE 24 HB3 PHE 24 0.936 9.530 3.842
196 HD1 PHE 24 HD1 PHE 24 -2.287 11.315 4.210
197 HD2 PHE 24 HD2 PHE 24 1.330 10.894 2.012
198 HE1 PHE 24 HE1 PHE 24 -2.798 13.392 2.992
199 HE2 PHE 24 HE2 PHE 24 0.821 12.965 0.781
200 HZ PHE 24 HZ PHE 24 -1.239 14.217 1.273
201 H LEU 25 H LEU 25 0.172 6.346 2.654
202 HA LEU 25 HA LEU 25 0.255 5.087 5.325
203 HB2 LEU 25 HB2 LEU 25 -0.251 4.001 2.600
204 HB3 LEU 25 HB3 LEU 25 0.631 2.987 3.718
205 HG LEU 25 HG LEU 25 -1.328 3.185 5.298
206 HD11 LEU 25 HD11 LEU 25 -2.685 4.358 2.885
207 HD12 LEU 25 HD12 LEU 25 -2.314 5.216 4.379
208 HD13 LEU 25 HD13 LEU 25 -3.466 3.881 4.392
209 HD21 LEU 25 HD21 LEU 25 -1.825 1.970 2.584
210 HD22 LEU 25 HD22 LEU 25 -2.703 1.574 4.056
211 HD23 LEU 25 HD23 LEU 25 -0.984 1.207 3.931
212 H ILE 26 H ILE 26 2.145 4.034 5.964
213 HA ILE 26 HA ILE 26 4.530 4.770 4.462
214 HB ILE 26 HB ILE 26 4.287 3.524 7.223
215 HG12 ILE 26 HG12 ILE 26 3.306 5.775 7.221
216 HG13 ILE 26 HG13 ILE 26 4.793 5.744 8.155
217 HG21 ILE 26 HG21 ILE 26 6.424 3.061 6.178
218 HG22 ILE 26 HG22 ILE 26 6.628 4.198 7.515
219 HG23 ILE 26 HG23 ILE 26 6.659 4.779 5.852
220 HD11 ILE 26 HD11 ILE 26 4.664 7.768 6.853
221 HD12 ILE 26 HD12 ILE 26 4.437 6.835 5.371
222 HD13 ILE 26 HD13 ILE 26 5.973 6.757 6.236
223 H ILE 27 H ILE 27 5.320 3.284 3.160
224 HA ILE 27 HA ILE 27 4.820 0.458 3.791
225 HB ILE 27 HB ILE 27 4.754 -0.061 1.396
226 HG12 ILE 27 HG12 ILE 27 4.735 2.921 0.866
227 HG13 ILE 27 HG13 ILE 27 6.174 1.916 0.719
228 HG21 ILE 27 HG21 ILE 27 2.775 2.052 2.234
229 HG22 ILE 27 HG22 ILE 27 2.614 0.311 2.450
230 HG23 ILE 27 HG23 ILE 27 2.584 1.005 0.833
231 HD11 ILE 27 HD11 ILE 27 5.060 0.596 -1.010
232 HD12 ILE 27 HD12 ILE 27 5.141 2.303 -1.441
233 HD13 ILE 27 HD13 ILE 27 3.628 1.612 -0.853
234 H ARG 28 H ARG 28 6.377 -0.976 2.753
235 HA ARG 28 HA ARG 28 9.064 -0.193 3.194
236 HB2 ARG 28 HB2 ARG 28 7.629 -2.631 2.285
237 HB3 ARG 28 HB3 ARG 28 9.337 -2.501 1.881
238 HG2 ARG 28 HG2 ARG 28 9.997 -2.585 4.096
239 HG3 ARG 28 HG3 ARG 28 8.429 -2.039 4.686
240 HD2 ARG 28 HD2 ARG 28 8.564 -4.639 3.250
241 HD3 ARG 28 HD3 ARG 28 9.194 -4.553 4.895
242 HE ARG 28 HE ARG 28 6.594 -3.405 4.594
243 HH11 ARG 28 HH11 ARG 28 8.283 -6.500 5.033
244 HH12 ARG 28 HH12 ARG 28 7.027 -7.230 5.910
245 HH21 ARG 28 HH21 ARG 28 4.812 -4.457 5.852
246 HH22 ARG 28 HH22 ARG 28 5.022 -6.056 6.344
247 H ARG 29 H ARG 29 10.447 0.636 1.823
248 HA ARG 29 HA ARG 29 9.546 1.335 -0.832
249 HB2 ARG 29 HB2 ARG 29 10.610 3.028 0.556
250 HB3 ARG 29 HB3 ARG 29 12.042 2.029 0.701
251 HG2 ARG 29 HG2 ARG 29 11.996 2.192 -1.928
252 HG3 ARG 29 HG3 ARG 29 11.097 3.671 -1.576
253 HD2 ARG 29 HD2 ARG 29 12.917 4.335 -0.033
254 HD3 ARG 29 HD3 ARG 29 13.803 2.901 -0.546
255 HE ARG 29 HE ARG 29 13.155 4.342 -2.834
256 HH11 ARG 29 HH11 ARG 29 15.188 4.751 0.055
257 HH12 ARG 29 HH12 ARG 29 16.327 5.718 -0.763
258 HH21 ARG 29 HH21 ARG 29 14.736 5.745 -3.894
259 HH22 ARG 29 HH22 ARG 29 16.083 6.262 -2.987
260 H ARG 30 H ARG 30 10.164 0.395 -2.575
261 HA ARG 30 HA ARG 30 12.169 -1.723 -2.464
262 HB2 ARG 30 HB2 ARG 30 10.285 -1.086 -4.724
263 HB3 ARG 30 HB3 ARG 30 11.191 -2.566 -4.478
264 HG2 ARG 30 HG2 ARG 30 9.760 -3.149 -2.600
265 HG3 ARG 30 HG3 ARG 30 8.891 -1.618 -2.775
266 HD2 ARG 30 HD2 ARG 30 8.504 -2.365 -5.202
267 HD3 ARG 30 HD3 ARG 30 8.956 -3.965 -4.627
268 HE ARG 30 HE ARG 30 7.068 -3.425 -2.906
269 HH11 ARG 30 HH11 ARG 30 7.050 -2.596 -6.411
270 HH12 ARG 30 HH12 ARG 30 5.392 -2.903 -6.565
271 HH21 ARG 30 HH21 ARG 30 4.773 -3.840 -3.244
272 HH22 ARG 30 HH22 ARG 30 4.130 -3.620 -4.831
273 H LYS 31 H LYS 31 13.046 -1.818 -4.891
274 HA LYS 31 HA LYS 31 14.827 0.407 -5.246
275 HB2 LYS 31 HB2 LYS 31 14.227 -1.775 -7.247
276 HB3 LYS 31 HB3 LYS 31 15.671 -0.787 -7.171
277 HG2 LYS 31 HG2 LYS 31 16.512 -2.677 -6.253
278 HG3 LYS 31 HG3 LYS 31 15.852 -1.969 -4.785
279 HD2 LYS 31 HD2 LYS 31 15.215 -4.273 -4.821
280 HD3 LYS 31 HD3 LYS 31 13.754 -3.386 -5.166
281 HE2 LYS 31 HE2 LYS 31 15.461 -4.446 -7.395
282 HE3 LYS 31 HE3 LYS 31 14.353 -5.503 -6.534
283 HZ1 LYS 31 HZ1 LYS 31 13.117 -4.796 -8.311
284 HZ2 LYS 31 HZ2 LYS 31 13.734 -3.251 -8.344
285 HZ3 LYS 31 HZ3 LYS 31 12.588 -3.651 -7.199
286 H ASP 32 H ASP 32 11.825 -0.597 -6.477
287 HA ASP 32 HA ASP 32 11.796 0.919 -8.903
288 HB2 ASP 32 HB2 ASP 32 9.459 -0.475 -7.652
289 HB3 ASP 32 HB3 ASP 32 9.813 -0.226 -9.357
290 H MET 33 H MET 33 11.551 2.040 -5.914
291 HA MET 33 HA MET 33 9.008 3.422 -6.152
292 HB2 MET 33 HB2 MET 33 10.943 2.954 -3.985
293 HB3 MET 33 HB3 MET 33 10.128 4.508 -3.943
294 HG2 MET 33 HG2 MET 33 8.940 2.925 -2.585
295 HG3 MET 33 HG3 MET 33 7.971 3.357 -3.990
296 HE1 MET 33 HE1 MET 33 6.363 1.323 -3.647
297 HE2 MET 33 HE2 MET 33 7.252 0.854 -2.200
298 HE3 MET 33 HE3 MET 33 6.906 -0.342 -3.449
299 H LYS 34 H LYS 34 8.985 5.074 -7.534
300 HA LYS 34 HA LYS 34 11.099 7.060 -7.333
301 HB2 LYS 34 HB2 LYS 34 9.110 6.455 -9.518
302 HB3 LYS 34 HB3 LYS 34 10.253 7.780 -9.530
303 HG2 LYS 34 HG2 LYS 34 12.102 6.135 -9.506
304 HG3 LYS 34 HG3 LYS 34 10.906 4.840 -9.570
305 HD2 LYS 34 HD2 LYS 34 10.047 5.831 -11.687
306 HD3 LYS 34 HD3 LYS 34 11.385 6.978 -11.640
307 HE2 LYS 34 HE2 LYS 34 11.636 3.975 -11.754
308 HE3 LYS 34 HE3 LYS 34 11.868 5.075 -13.107
309 HZ1 LYS 34 HZ1 LYS 34 13.732 6.072 -11.906
310 HZ2 LYS 34 HZ2 LYS 34 13.959 4.432 -12.179
311 HZ3 LYS 34 HZ3 LYS 34 13.520 4.961 -10.644
312 H VAL 35 H VAL 35 10.446 9.057 -6.650
313 HA VAL 35 HA VAL 35 7.894 9.299 -5.418
314 HB VAL 35 HB VAL 35 9.875 11.538 -5.944
315 HG11 VAL 35 HG11 VAL 35 7.720 11.258 -3.848
316 HG12 VAL 35 HG12 VAL 35 7.648 12.317 -5.255
317 HG13 VAL 35 HG13 VAL 35 8.848 12.600 -3.991
318 HG21 VAL 35 HG21 VAL 35 10.933 9.660 -4.775
319 HG22 VAL 35 HG22 VAL 35 9.668 9.734 -3.547
320 HG23 VAL 35 HG23 VAL 35 10.789 11.085 -3.743
321 H GLY 36 H GLY 36 6.044 10.015 -6.209
322 HA2 GLY 36 HA2 GLY 36 4.920 11.771 -7.447
323 HA3 GLY 36 HA3 GLY 36 6.142 11.576 -8.695
324 H GLN 37 H GLN 37 5.949 8.601 -8.392
325 HA GLN 37 HA GLN 37 3.654 8.401 -10.173
326 HB2 GLN 37 HB2 GLN 37 4.581 6.331 -11.003
327 HB3 GLN 37 HB3 GLN 37 5.838 7.551 -11.000
328 HG2 GLN 37 HG2 GLN 37 6.692 6.596 -8.879
329 HG3 GLN 37 HG3 GLN 37 5.493 5.313 -9.028
330 HE21 GLN 37 HE21 GLN 37 7.046 3.699 -9.181
331 HE22 GLN 37 HE22 GLN 37 8.044 3.511 -10.572
332 H GLN 38 H GLN 38 2.116 6.826 -10.050
333 HA GLN 38 HA GLN 38 1.493 5.930 -7.360
334 HB2 GLN 38 HB2 GLN 38 -0.199 6.920 -9.022
335 HB3 GLN 38 HB3 GLN 38 -0.063 5.392 -9.882
336 HG2 GLN 38 HG2 GLN 38 -0.746 4.237 -7.780
337 HG3 GLN 38 HG3 GLN 38 -1.061 5.824 -7.079
338 HE21 GLN 38 HE21 GLN 38 -3.267 5.493 -6.850
339 HE22 GLN 38 HE22 GLN 38 -4.314 5.375 -8.220
340 H VAL 39 H VAL 39 1.978 4.023 -6.672
341 HA VAL 39 HA VAL 39 2.896 2.042 -8.626
342 HB VAL 39 HB VAL 39 4.429 1.166 -6.919
343 HG11 VAL 39 HG11 VAL 39 4.796 4.119 -7.306
344 HG12 VAL 39 HG12 VAL 39 5.326 2.838 -8.400
345 HG13 VAL 39 HG13 VAL 39 6.039 2.980 -6.791
346 HG21 VAL 39 HG21 VAL 39 4.798 2.277 -4.793
347 HG22 VAL 39 HG22 VAL 39 3.117 1.766 -4.921
348 HG23 VAL 39 HG23 VAL 39 3.545 3.461 -5.167
349 H SER 40 H SER 40 2.524 -0.143 -7.985
350 HA SER 40 HA SER 40 0.158 -0.452 -6.330
351 HB2 SER 40 HB2 SER 40 1.502 -2.556 -8.020
352 HB3 SER 40 HB3 SER 40 -0.184 -2.478 -7.491
353 HG SER 40 HG SER 40 0.107 -0.307 -8.831
354 H PHE 41 H PHE 41 0.518 -1.115 -4.310
355 HA PHE 41 HA PHE 41 2.963 -2.631 -3.816
356 HB2 PHE 41 HB2 PHE 41 3.000 -1.708 -1.531
357 HB3 PHE 41 HB3 PHE 41 3.302 -0.506 -2.764
358 HD1 PHE 41 HD1 PHE 41 1.513 1.193 -3.240
359 HD2 PHE 41 HD2 PHE 41 1.142 -1.624 -0.077
360 HE1 PHE 41 HE1 PHE 41 -0.282 2.541 -2.239
361 HE2 PHE 41 HE2 PHE 41 -0.648 -0.281 0.923
362 HZ PHE 41 HZ PHE 41 -1.366 1.797 -0.155
363 H GLU 42 H GLU 42 2.777 -4.003 -2.036
364 HA GLU 42 HA GLU 42 0.151 -5.273 -2.133
365 HB2 GLU 42 HB2 GLU 42 2.916 -6.235 -1.599
366 HB3 GLU 42 HB3 GLU 42 1.561 -6.945 -0.744
367 HG2 GLU 42 HG2 GLU 42 1.249 -6.680 -3.609
368 HG3 GLU 42 HG3 GLU 42 2.308 -7.965 -2.995
369 H ASN 43 H ASN 43 -0.362 -6.407 -0.128
370 HA ASN 43 HA ASN 43 -0.571 -4.483 2.032
371 HB2 ASN 43 HB2 ASN 43 -1.776 -7.112 1.447
372 HB3 ASN 43 HB3 ASN 43 -1.482 -6.834 3.171
373 HD21 ASN 43 HD21 ASN 43 -2.349 -4.434 0.716
374 HD22 ASN 43 HD22 ASN 43 -3.892 -4.085 1.419
375 H GLU 44 H GLU 44 1.346 -7.044 1.098
376 HA GLU 44 HA GLU 44 2.698 -7.569 3.548
377 HB2 GLU 44 HB2 GLU 44 3.499 -8.222 0.719
378 HB3 GLU 44 HB3 GLU 44 4.093 -8.995 2.184
379 HG2 GLU 44 HG2 GLU 44 1.925 -9.962 2.608
380 HG3 GLU 44 HG3 GLU 44 1.224 -9.071 1.261
381 H ASP 45 H ASP 45 2.812 -4.943 1.415
382 HA ASP 45 HA ASP 45 5.666 -4.404 1.845
383 HB2 ASP 45 HB2 ASP 45 3.558 -2.992 0.196
384 HB3 ASP 45 HB3 ASP 45 5.107 -2.249 0.541
385 H ILE 46 H ILE 46 2.551 -3.575 3.046
386 HA ILE 46 HA ILE 46 3.054 -0.935 3.874
387 HB ILE 46 HB ILE 46 0.953 -2.777 5.045
388 HG12 ILE 46 HG12 ILE 46 0.746 -1.136 2.510
389 HG13 ILE 46 HG13 ILE 46 0.899 -2.886 2.566
390 HG21 ILE 46 HG21 ILE 46 -0.336 -0.616 5.122
391 HG22 ILE 46 HG22 ILE 46 1.171 0.213 4.710
392 HG23 ILE 46 HG23 ILE 46 1.045 -0.719 6.204
393 HD11 ILE 46 HD11 ILE 46 -1.403 -2.222 2.177
394 HD12 ILE 46 HD12 ILE 46 -1.390 -1.263 3.657
395 HD13 ILE 46 HD13 ILE 46 -1.251 -3.017 3.747
396 H TYR 47 H TYR 47 3.809 -0.088 5.674
397 HA TYR 47 HA TYR 47 4.924 -1.817 7.750
398 HB2 TYR 47 HB2 TYR 47 5.398 0.889 6.751
399 HB3 TYR 47 HB3 TYR 47 5.376 0.809 8.511
400 HD1 TYR 47 HD1 TYR 47 7.425 0.685 5.730
401 HD2 TYR 47 HD2 TYR 47 6.789 -1.307 9.433
402 HE1 TYR 47 HE1 TYR 47 9.743 -0.109 5.694
403 HE2 TYR 47 HE2 TYR 47 9.114 -2.106 9.403
404 HH TYR 47 HH TYR 47 11.431 -0.850 7.315
405 H ASN 48 H ASN 48 2.331 0.251 7.069
406 HA ASN 48 HA ASN 48 1.449 0.574 9.812
407 HB2 ASN 48 HB2 ASN 48 0.252 1.390 7.152
408 HB3 ASN 48 HB3 ASN 48 -0.678 1.494 8.635
409 HD21 ASN 48 HD21 ASN 48 -0.119 3.070 10.159
410 HD22 ASN 48 HD22 ASN 48 0.935 4.380 9.776
411 H VAL 49 H VAL 49 1.534 -1.787 10.069
412 HA VAL 49 HA VAL 49 -0.511 -3.346 8.756
413 HB VAL 49 HB VAL 49 1.160 -4.182 11.140
414 HG11 VAL 49 HG11 VAL 49 0.812 -6.445 10.257
415 HG12 VAL 49 HG12 VAL 49 -0.210 -5.775 8.985
416 HG13 VAL 49 HG13 VAL 49 -0.705 -5.643 10.672
417 HG21 VAL 49 HG21 VAL 49 2.741 -5.184 9.516
418 HG22 VAL 49 HG22 VAL 49 2.698 -3.422 9.427
419 HG23 VAL 49 HG23 VAL 49 1.864 -4.384 8.208
420 H ARG 50 H ARG 50 -2.514 -2.956 9.336
421 HA ARG 50 HA ARG 50 -3.200 -2.967 12.230
422 HB2 ARG 50 HB2 ARG 50 -4.917 -1.243 11.896
423 HB3 ARG 50 HB3 ARG 50 -3.336 -0.638 11.435
424 HG2 ARG 50 HG2 ARG 50 -4.977 -1.809 9.265
425 HG3 ARG 50 HG3 ARG 50 -5.550 -0.289 9.947
426 HD2 ARG 50 HD2 ARG 50 -3.874 0.889 9.002
427 HD3 ARG 50 HD3 ARG 50 -2.677 -0.338 9.395
428 HE ARG 50 HE ARG 50 -3.072 -1.412 7.429
429 HH11 ARG 50 HH11 ARG 50 -5.190 1.434 7.715
430 HH12 ARG 50 HH12 ARG 50 -5.543 1.544 6.057
431 HH21 ARG 50 HH21 ARG 50 -3.559 -1.241 5.119
432 HH22 ARG 50 HH22 ARG 50 -4.627 -0.016 4.547
433 H GLY 51 H GLY 51 -3.271 -5.005 10.201
434 HA2 GLY 51 HA2 GLY 51 -5.026 -6.788 10.293
435 HA3 GLY 51 HA3 GLY 51 -6.176 -5.502 9.860
436 H LYS 52 H LYS 52 -4.516 -4.071 8.305
437 HA LYS 52 HA LYS 52 -3.739 -5.766 6.069
438 HB2 LYS 52 HB2 LYS 52 -4.647 -2.853 6.106
439 HB3 LYS 52 HB3 LYS 52 -3.986 -3.663 4.701
440 HG2 LYS 52 HG2 LYS 52 -6.224 -3.740 4.243
441 HG3 LYS 52 HG3 LYS 52 -6.016 -5.282 5.072
442 HD2 LYS 52 HD2 LYS 52 -6.754 -4.244 7.166
443 HD3 LYS 52 HD3 LYS 52 -6.983 -2.715 6.318
444 HE2 LYS 52 HE2 LYS 52 -8.664 -3.689 4.912
445 HE3 LYS 52 HE3 LYS 52 -8.372 -5.282 5.610
446 HZ1 LYS 52 HZ1 LYS 52 -9.120 -4.438 7.735
447 HZ2 LYS 52 HZ2 LYS 52 -10.314 -4.250 6.557
448 HZ3 LYS 52 HZ3 LYS 52 -9.416 -2.917 7.060
Start of MODEL 5
1 H1 SER 0 H1 SER 0 -0.914 -11.722 -1.555
2 H2 SER 0 H2 SER 0 0.007 -11.208 -0.204
3 H3 SER 0 H3 SER 0 -0.602 -10.085 -1.307
4 HA SER 0 HA SER 0 -2.409 -11.864 0.092
5 HB2 SER 0 HB2 SER 0 -1.108 -10.832 1.880
6 HB3 SER 0 HB3 SER 0 -1.261 -9.253 1.122
7 HG SER 0 HG SER 0 -2.893 -10.382 2.888
8 H MET 1 H MET 1 -2.103 -8.372 -0.570
9 HA MET 1 HA MET 1 -4.336 -8.342 -2.386
10 HB2 MET 1 HB2 MET 1 -4.551 -6.754 0.187
11 HB3 MET 1 HB3 MET 1 -5.741 -6.876 -1.089
12 HG2 MET 1 HG2 MET 1 -6.021 -9.296 -0.477
13 HG3 MET 1 HG3 MET 1 -4.951 -8.996 0.886
14 HE1 MET 1 HE1 MET 1 -7.062 -6.460 3.025
15 HE2 MET 1 HE2 MET 1 -5.956 -5.986 1.738
16 HE3 MET 1 HE3 MET 1 -5.514 -7.285 2.847
17 H ASN 2 H ASN 2 -3.440 -7.028 -3.869
18 HA ASN 2 HA ASN 2 -1.475 -5.092 -3.261
19 HB2 ASN 2 HB2 ASN 2 -2.987 -5.778 -5.754
20 HB3 ASN 2 HB3 ASN 2 -2.005 -4.322 -5.675
21 HD21 ASN 2 HD21 ASN 2 0.247 -4.563 -5.263
22 HD22 ASN 2 HD22 ASN 2 1.083 -6.009 -5.694
23 H ARG 3 H ARG 3 -1.523 -2.947 -3.556
24 HA ARG 3 HA ARG 3 -4.081 -1.519 -3.359
25 HB2 ARG 3 HB2 ARG 3 -2.737 -2.086 -1.106
26 HB3 ARG 3 HB3 ARG 3 -1.781 -0.715 -1.646
27 HG2 ARG 3 HG2 ARG 3 -3.380 0.110 -0.106
28 HG3 ARG 3 HG3 ARG 3 -3.902 0.621 -1.709
29 HD2 ARG 3 HD2 ARG 3 -5.465 -1.287 -1.789
30 HD3 ARG 3 HD3 ARG 3 -4.912 -1.767 -0.186
31 HE ARG 3 HE ARG 3 -5.895 0.896 -0.159
32 HH11 ARG 3 HH11 ARG 3 -6.980 -2.466 -0.181
33 HH12 ARG 3 HH12 ARG 3 -8.488 -2.138 0.526
34 HH21 ARG 3 HH21 ARG 3 -7.848 1.340 0.819
35 HH22 ARG 3 HH22 ARG 3 -9.015 0.127 1.165
36 H LEU 4 H LEU 4 -3.759 0.789 -3.948
37 HA LEU 4 HA LEU 4 -1.325 1.240 -5.566
38 HB2 LEU 4 HB2 LEU 4 -4.178 2.102 -6.004
39 HB3 LEU 4 HB3 LEU 4 -2.835 2.812 -6.862
40 HG LEU 4 HG LEU 4 -3.775 -0.053 -7.034
41 HD11 LEU 4 HD11 LEU 4 -3.884 2.233 -8.996
42 HD12 LEU 4 HD12 LEU 4 -5.252 1.504 -8.156
43 HD13 LEU 4 HD13 LEU 4 -4.344 0.569 -9.347
44 HD21 LEU 4 HD21 LEU 4 -2.132 -0.218 -8.895
45 HD22 LEU 4 HD22 LEU 4 -1.388 -0.033 -7.314
46 HD23 LEU 4 HD23 LEU 4 -1.477 1.349 -8.413
47 H GLY 5 H GLY 5 -0.241 3.101 -5.138
48 HA2 GLY 5 HA2 GLY 5 -1.600 5.356 -3.988
49 HA3 GLY 5 HA3 GLY 5 -0.448 4.589 -2.900
50 H ILE 6 H ILE 6 -0.327 7.185 -3.877
51 HA ILE 6 HA ILE 6 1.755 7.242 -5.943
52 HB ILE 6 HB ILE 6 0.349 9.539 -4.548
53 HG12 ILE 6 HG12 ILE 6 -0.245 8.481 -7.316
54 HG13 ILE 6 HG13 ILE 6 -1.141 7.969 -5.892
55 HG21 ILE 6 HG21 ILE 6 1.159 10.885 -6.438
56 HG22 ILE 6 HG22 ILE 6 2.009 9.473 -7.071
57 HG23 ILE 6 HG23 ILE 6 2.487 10.168 -5.523
58 HD11 ILE 6 HD11 ILE 6 -0.932 10.797 -6.906
59 HD12 ILE 6 HD12 ILE 6 -1.877 10.255 -5.515
60 HD13 ILE 6 HD13 ILE 6 -2.305 9.716 -7.136
61 H ILE 7 H ILE 7 3.829 7.558 -5.487
62 HA ILE 7 HA ILE 7 4.753 7.581 -2.802
63 HB ILE 7 HB ILE 7 6.308 8.327 -5.297
64 HG12 ILE 7 HG12 ILE 7 5.313 6.054 -5.378
65 HG13 ILE 7 HG13 ILE 7 7.072 6.036 -5.369
66 HG21 ILE 7 HG21 ILE 7 7.309 7.433 -2.584
67 HG22 ILE 7 HG22 ILE 7 7.358 9.085 -3.190
68 HG23 ILE 7 HG23 ILE 7 8.306 7.823 -3.984
69 HD11 ILE 7 HD11 ILE 7 5.338 5.544 -2.951
70 HD12 ILE 7 HD12 ILE 7 7.095 5.398 -3.047
71 HD13 ILE 7 HD13 ILE 7 6.069 4.290 -3.950
72 H TYR 8 H TYR 8 4.300 9.129 -1.595
73 HA TYR 8 HA TYR 8 4.116 11.882 -2.468
74 HB2 TYR 8 HB2 TYR 8 2.472 10.670 -0.954
75 HB3 TYR 8 HB3 TYR 8 3.723 10.744 0.281
76 HD1 TYR 8 HD1 TYR 8 3.949 12.633 1.618
77 HD2 TYR 8 HD2 TYR 8 1.619 12.855 -1.923
78 HE1 TYR 8 HE1 TYR 8 3.159 14.860 2.292
79 HE2 TYR 8 HE2 TYR 8 0.824 15.090 -1.264
80 HH TYR 8 HH TYR 8 0.570 16.407 0.764
81 H GLU 9 H GLU 9 6.177 9.796 -0.544
82 HA GLU 9 HA GLU 9 8.335 11.646 -0.573
83 HB2 GLU 9 HB2 GLU 9 6.778 12.488 1.308
84 HB3 GLU 9 HB3 GLU 9 7.225 11.036 2.182
85 HG2 GLU 9 HG2 GLU 9 9.581 11.750 2.125
86 HG3 GLU 9 HG3 GLU 9 9.097 13.212 1.267
87 H ILE 10 H ILE 10 10.232 10.691 0.557
88 HA ILE 10 HA ILE 10 10.080 7.757 0.833
89 HB ILE 10 HB ILE 10 12.265 9.428 -0.442
90 HG12 ILE 10 HG12 ILE 10 10.309 8.978 -1.897
91 HG13 ILE 10 HG13 ILE 10 11.797 8.272 -2.517
92 HG21 ILE 10 HG21 ILE 10 13.435 7.281 -0.922
93 HG22 ILE 10 HG22 ILE 10 12.275 6.477 0.144
94 HG23 ILE 10 HG23 ILE 10 13.358 7.702 0.791
95 HD11 ILE 10 HD11 ILE 10 9.546 6.838 -1.122
96 HD12 ILE 10 HD12 ILE 10 11.066 6.093 -1.610
97 HD13 ILE 10 HD13 ILE 10 9.971 6.740 -2.833
98 H GLN 11 H GLN 11 11.171 6.938 2.606
99 HA GLN 11 HA GLN 11 12.909 8.739 4.148
100 HB2 GLN 11 HB2 GLN 11 10.812 6.838 5.223
101 HB3 GLN 11 HB3 GLN 11 12.163 7.373 6.194
102 HG2 GLN 11 HG2 GLN 11 10.598 8.842 6.880
103 HG3 GLN 11 HG3 GLN 11 11.217 9.746 5.498
104 HE21 GLN 11 HE21 GLN 11 9.943 10.075 3.807
105 HE22 GLN 11 HE22 GLN 11 8.273 9.622 3.751
106 H GLY 12 H GLY 12 14.512 7.666 2.821
107 HA2 GLY 12 HA2 GLY 12 16.235 6.168 2.632
108 HA3 GLY 12 HA3 GLY 12 15.724 5.488 4.173
109 H MET 13 H MET 13 14.581 3.631 4.203
110 HA MET 13 HA MET 13 14.096 2.387 1.600
111 HB2 MET 13 HB2 MET 13 14.729 1.162 4.277
112 HB3 MET 13 HB3 MET 13 14.038 0.217 2.968
113 HG2 MET 13 HG2 MET 13 16.087 1.304 1.651
114 HG3 MET 13 HG3 MET 13 16.758 1.342 3.280
115 HE1 MET 13 HE1 MET 13 15.560 -2.444 0.930
116 HE2 MET 13 HE2 MET 13 15.626 -0.816 0.258
117 HE3 MET 13 HE3 MET 13 14.362 -1.245 1.413
118 H LYS 14 H LYS 14 12.397 4.167 3.454
119 HA LYS 14 HA LYS 14 9.985 2.494 3.197
120 HB2 LYS 14 HB2 LYS 14 10.398 4.888 4.982
121 HB3 LYS 14 HB3 LYS 14 8.917 3.970 4.829
122 HG2 LYS 14 HG2 LYS 14 10.109 1.989 5.719
123 HG3 LYS 14 HG3 LYS 14 11.507 3.026 6.014
124 HD2 LYS 14 HD2 LYS 14 10.050 4.500 7.393
125 HD3 LYS 14 HD3 LYS 14 8.751 3.325 7.193
126 HE2 LYS 14 HE2 LYS 14 10.078 1.625 8.283
127 HE3 LYS 14 HE3 LYS 14 11.442 2.738 8.379
128 HZ1 LYS 14 HZ1 LYS 14 10.057 4.163 9.836
129 HZ2 LYS 14 HZ2 LYS 14 10.326 2.631 10.473
130 HZ3 LYS 14 HZ3 LYS 14 8.843 2.981 9.799
131 H ALA 15 H ALA 15 8.144 3.597 2.447
132 HA ALA 15 HA ALA 15 8.634 6.141 1.098
133 HB1 ALA 15 HB1 ALA 15 7.478 5.342 -0.893
134 HB2 ALA 15 HB2 ALA 15 7.324 3.737 -0.176
135 HB3 ALA 15 HB3 ALA 15 8.919 4.378 -0.574
136 H VAL 16 H VAL 16 6.887 7.435 0.998
137 HA VAL 16 HA VAL 16 4.546 6.652 2.596
138 HB VAL 16 HB VAL 16 5.343 9.397 1.551
139 HG11 VAL 16 HG11 VAL 16 3.212 8.643 3.546
140 HG12 VAL 16 HG12 VAL 16 2.928 9.141 1.878
141 HG13 VAL 16 HG13 VAL 16 3.624 10.279 3.029
142 HG21 VAL 16 HG21 VAL 16 5.480 8.385 4.370
143 HG22 VAL 16 HG22 VAL 16 6.010 9.956 3.772
144 HG23 VAL 16 HG23 VAL 16 6.866 8.479 3.284
145 H VAL 17 H VAL 17 2.826 6.042 1.493
146 HA VAL 17 HA VAL 17 2.578 7.061 -1.231
147 HB VAL 17 HB VAL 17 1.113 5.094 -1.709
148 HG11 VAL 17 HG11 VAL 17 3.312 5.138 -2.571
149 HG12 VAL 17 HG12 VAL 17 2.994 3.504 -1.988
150 HG13 VAL 17 HG13 VAL 17 3.992 4.603 -1.036
151 HG21 VAL 17 HG21 VAL 17 2.194 4.063 0.932
152 HG22 VAL 17 HG22 VAL 17 1.416 3.071 -0.295
153 HG23 VAL 17 HG23 VAL 17 0.515 4.363 0.487
154 H LEU 18 H LEU 18 0.991 8.257 -1.665
155 HA LEU 18 HA LEU 18 -1.232 8.524 0.185
156 HB2 LEU 18 HB2 LEU 18 -0.279 10.561 -0.674
157 HB3 LEU 18 HB3 LEU 18 -0.388 9.999 -2.321
158 HG LEU 18 HG LEU 18 -2.900 10.103 -2.096
159 HD11 LEU 18 HD11 LEU 18 -3.069 9.952 0.312
160 HD12 LEU 18 HD12 LEU 18 -3.801 11.453 -0.260
161 HD13 LEU 18 HD13 LEU 18 -2.202 11.480 0.485
162 HD21 LEU 18 HD21 LEU 18 -1.367 12.652 -1.628
163 HD22 LEU 18 HD22 LEU 18 -3.012 12.545 -2.257
164 HD23 LEU 18 HD23 LEU 18 -1.666 11.885 -3.190
165 H THR 19 H THR 19 -2.602 6.895 -0.055
166 HA THR 19 HA THR 19 -2.742 5.288 -2.370
167 HB THR 19 HB THR 19 -4.615 4.173 -1.190
168 HG1 THR 19 HG1 THR 19 -5.183 4.882 0.823
169 HG21 THR 19 HG21 THR 19 -2.291 3.535 -0.755
170 HG22 THR 19 HG22 THR 19 -3.290 3.374 0.697
171 HG23 THR 19 HG23 THR 19 -2.200 4.754 0.518
172 H SER 20 H SER 20 -4.936 4.716 -3.340
173 HA SER 20 HA SER 20 -6.059 6.926 -4.649
174 HB2 SER 20 HB2 SER 20 -7.861 5.157 -5.229
175 HB3 SER 20 HB3 SER 20 -6.206 4.876 -5.774
176 HG SER 20 HG SER 20 -6.883 3.856 -3.238
177 H GLU 21 H GLU 21 -6.677 5.489 -1.646
178 HA GLU 21 HA GLU 21 -9.321 6.547 -1.255
179 HB2 GLU 21 HB2 GLU 21 -7.438 5.481 0.829
180 HB3 GLU 21 HB3 GLU 21 -9.187 5.639 0.941
181 HG2 GLU 21 HG2 GLU 21 -9.123 3.465 0.460
182 HG3 GLU 21 HG3 GLU 21 -9.033 4.060 -1.189
183 H GLY 22 H GLY 22 -6.218 7.837 -1.212
184 HA2 GLY 22 HA2 GLY 22 -5.565 9.964 -0.701
185 HA3 GLY 22 HA3 GLY 22 -7.150 10.253 0.005
186 H GLU 23 H GLU 23 -5.148 7.551 0.959
187 HA GLU 23 HA GLU 23 -4.791 8.853 3.564
188 HB2 GLU 23 HB2 GLU 23 -5.097 5.940 2.814
189 HB3 GLU 23 HB3 GLU 23 -4.623 6.483 4.415
190 HG2 GLU 23 HG2 GLU 23 -7.216 7.143 3.040
191 HG3 GLU 23 HG3 GLU 23 -6.994 5.921 4.292
192 H PHE 24 H PHE 24 -2.744 8.667 4.517
193 HA PHE 24 HA PHE 24 -0.640 8.062 2.583
194 HB2 PHE 24 HB2 PHE 24 -0.387 9.500 5.245
195 HB3 PHE 24 HB3 PHE 24 0.883 9.238 4.053
196 HD1 PHE 24 HD1 PHE 24 -2.209 11.063 4.757
197 HD2 PHE 24 HD2 PHE 24 1.106 10.590 2.155
198 HE1 PHE 24 HE1 PHE 24 -2.770 13.196 3.675
199 HE2 PHE 24 HE2 PHE 24 0.551 12.714 1.056
200 HZ PHE 24 HZ PHE 24 -1.383 14.023 1.811
201 H LEU 25 H LEU 25 0.095 6.180 2.637
202 HA LEU 25 HA LEU 25 0.257 4.716 5.174
203 HB2 LEU 25 HB2 LEU 25 -0.360 3.939 2.389
204 HB3 LEU 25 HB3 LEU 25 0.653 2.836 3.297
205 HG LEU 25 HG LEU 25 -1.113 2.539 4.956
206 HD11 LEU 25 HD11 LEU 25 -2.736 4.427 3.253
207 HD12 LEU 25 HD12 LEU 25 -2.114 4.753 4.873
208 HD13 LEU 25 HD13 LEU 25 -3.334 3.500 4.633
209 HD21 LEU 25 HD21 LEU 25 -0.985 1.311 2.726
210 HD22 LEU 25 HD22 LEU 25 -2.410 2.254 2.278
211 HD23 LEU 25 HD23 LEU 25 -2.467 1.170 3.671
212 H ILE 26 H ILE 26 2.183 3.698 5.646
213 HA ILE 26 HA ILE 26 4.484 4.676 4.104
214 HB ILE 26 HB ILE 26 4.561 3.415 6.860
215 HG12 ILE 26 HG12 ILE 26 3.160 5.459 6.949
216 HG13 ILE 26 HG13 ILE 26 4.657 5.650 7.846
217 HG21 ILE 26 HG21 ILE 26 6.668 3.379 5.689
218 HG22 ILE 26 HG22 ILE 26 6.749 4.528 7.024
219 HG23 ILE 26 HG23 ILE 26 6.556 5.109 5.372
220 HD11 ILE 26 HD11 ILE 26 4.065 7.652 6.577
221 HD12 ILE 26 HD12 ILE 26 4.106 6.716 5.085
222 HD13 ILE 26 HD13 ILE 26 5.586 6.952 6.019
223 H ILE 27 H ILE 27 5.428 3.220 2.869
224 HA ILE 27 HA ILE 27 4.961 0.375 3.471
225 HB ILE 27 HB ILE 27 4.917 -0.105 1.071
226 HG12 ILE 27 HG12 ILE 27 4.822 2.860 0.539
227 HG13 ILE 27 HG13 ILE 27 6.332 1.957 0.513
228 HG21 ILE 27 HG21 ILE 27 2.932 2.005 1.909
229 HG22 ILE 27 HG22 ILE 27 2.772 0.259 2.110
230 HG23 ILE 27 HG23 ILE 27 2.754 0.964 0.500
231 HD11 ILE 27 HD11 ILE 27 5.459 0.548 -1.271
232 HD12 ILE 27 HD12 ILE 27 5.433 2.255 -1.713
233 HD13 ILE 27 HD13 ILE 27 3.938 1.445 -1.233
234 H ARG 28 H ARG 28 6.515 -1.020 2.417
235 HA ARG 28 HA ARG 28 9.230 -0.318 2.848
236 HB2 ARG 28 HB2 ARG 28 8.032 -2.604 1.265
237 HB3 ARG 28 HB3 ARG 28 9.726 -2.486 1.720
238 HG2 ARG 28 HG2 ARG 28 8.939 -2.481 4.117
239 HG3 ARG 28 HG3 ARG 28 7.337 -2.876 3.494
240 HD2 ARG 28 HD2 ARG 28 9.854 -4.493 3.090
241 HD3 ARG 28 HD3 ARG 28 8.539 -4.878 4.196
242 HE ARG 28 HE ARG 28 7.348 -4.659 1.761
243 HH11 ARG 28 HH11 ARG 28 9.978 -6.662 3.027
244 HH12 ARG 28 HH12 ARG 28 9.635 -7.981 2.007
245 HH21 ARG 28 HH21 ARG 28 6.903 -6.450 0.375
246 HH22 ARG 28 HH22 ARG 28 7.867 -7.860 0.451
247 H ARG 29 H ARG 29 10.570 0.759 1.510
248 HA ARG 29 HA ARG 29 9.594 1.467 -1.111
249 HB2 ARG 29 HB2 ARG 29 10.752 3.147 0.367
250 HB3 ARG 29 HB3 ARG 29 12.240 2.232 0.131
251 HG2 ARG 29 HG2 ARG 29 11.557 2.532 -2.404
252 HG3 ARG 29 HG3 ARG 29 10.754 3.956 -1.760
253 HD2 ARG 29 HD2 ARG 29 12.917 4.680 -0.803
254 HD3 ARG 29 HD3 ARG 29 13.681 3.261 -1.530
255 HE ARG 29 HE ARG 29 12.221 4.735 -3.465
256 HH11 ARG 29 HH11 ARG 29 15.355 4.850 -1.790
257 HH12 ARG 29 HH12 ARG 29 16.106 5.696 -3.065
258 HH21 ARG 29 HH21 ARG 29 13.278 5.856 -5.145
259 HH22 ARG 29 HH22 ARG 29 14.918 6.260 -5.020
260 H ARG 30 H ARG 30 10.098 0.419 -2.880
261 HA ARG 30 HA ARG 30 12.358 -1.399 -2.879
262 HB2 ARG 30 HB2 ARG 30 10.102 -0.929 -4.848
263 HB3 ARG 30 HB3 ARG 30 11.452 -2.011 -5.160
264 HG2 ARG 30 HG2 ARG 30 10.824 -3.426 -3.348
265 HG3 ARG 30 HG3 ARG 30 9.584 -2.286 -2.829
266 HD2 ARG 30 HD2 ARG 30 8.273 -2.713 -4.780
267 HD3 ARG 30 HD3 ARG 30 9.581 -3.648 -5.519
268 HE ARG 30 HE ARG 30 9.258 -5.334 -3.950
269 HH11 ARG 30 HH11 ARG 30 6.539 -3.051 -4.119
270 HH12 ARG 30 HH12 ARG 30 5.571 -3.948 -3.013
271 HH21 ARG 30 HH21 ARG 30 7.903 -6.512 -2.452
272 HH22 ARG 30 HH22 ARG 30 6.360 -5.881 -2.022
273 H LYS 31 H LYS 31 13.666 -1.266 -4.959
274 HA LYS 31 HA LYS 31 14.928 1.258 -4.931
275 HB2 LYS 31 HB2 LYS 31 15.316 -1.142 -6.693
276 HB3 LYS 31 HB3 LYS 31 16.328 0.293 -6.793
277 HG2 LYS 31 HG2 LYS 31 17.095 -0.015 -4.555
278 HG3 LYS 31 HG3 LYS 31 15.939 -1.314 -4.280
279 HD2 LYS 31 HD2 LYS 31 17.088 -2.627 -6.054
280 HD3 LYS 31 HD3 LYS 31 18.291 -1.342 -6.169
281 HE2 LYS 31 HE2 LYS 31 18.845 -1.657 -3.802
282 HE3 LYS 31 HE3 LYS 31 17.644 -2.936 -3.695
283 HZ1 LYS 31 HZ1 LYS 31 20.052 -3.009 -5.444
284 HZ2 LYS 31 HZ2 LYS 31 18.950 -4.267 -5.227
285 HZ3 LYS 31 HZ3 LYS 31 19.907 -3.758 -3.960
286 H ASP 32 H ASP 32 12.423 0.050 -6.929
287 HA ASP 32 HA ASP 32 12.914 2.073 -8.981
288 HB2 ASP 32 HB2 ASP 32 10.891 -0.154 -8.819
289 HB3 ASP 32 HB3 ASP 32 10.818 1.084 -10.064
290 H MET 33 H MET 33 11.611 2.253 -6.072
291 HA MET 33 HA MET 33 9.138 3.623 -6.620
292 HB2 MET 33 HB2 MET 33 10.689 2.894 -4.249
293 HB3 MET 33 HB3 MET 33 9.856 4.436 -4.105
294 HG2 MET 33 HG2 MET 33 8.434 2.840 -3.183
295 HG3 MET 33 HG3 MET 33 7.766 3.197 -4.771
296 HE1 MET 33 HE1 MET 33 6.281 0.899 -4.463
297 HE2 MET 33 HE2 MET 33 7.081 0.708 -2.902
298 HE3 MET 33 HE3 MET 33 7.036 -0.639 -4.038
299 H LYS 34 H LYS 34 9.255 5.505 -7.716
300 HA LYS 34 HA LYS 34 11.226 7.470 -6.875
301 HB2 LYS 34 HB2 LYS 34 9.768 7.030 -9.477
302 HB3 LYS 34 HB3 LYS 34 10.801 8.409 -9.135
303 HG2 LYS 34 HG2 LYS 34 12.730 7.154 -9.212
304 HG3 LYS 34 HG3 LYS 34 11.881 5.668 -8.771
305 HD2 LYS 34 HD2 LYS 34 12.563 5.474 -11.062
306 HD3 LYS 34 HD3 LYS 34 10.815 5.705 -11.026
307 HE2 LYS 34 HE2 LYS 34 11.076 8.025 -11.578
308 HE3 LYS 34 HE3 LYS 34 12.839 7.879 -11.530
309 HZ1 LYS 34 HZ1 LYS 34 11.038 6.460 -13.410
310 HZ2 LYS 34 HZ2 LYS 34 12.718 6.351 -13.389
311 HZ3 LYS 34 HZ3 LYS 34 11.983 7.795 -13.793
312 H VAL 35 H VAL 35 10.442 9.571 -6.571
313 HA VAL 35 HA VAL 35 7.896 9.643 -5.294
314 HB VAL 35 HB VAL 35 9.596 12.065 -5.897
315 HG11 VAL 35 HG11 VAL 35 8.662 12.953 -3.844
316 HG12 VAL 35 HG12 VAL 35 7.823 11.441 -3.535
317 HG13 VAL 35 HG13 VAL 35 7.358 12.440 -4.917
318 HG21 VAL 35 HG21 VAL 35 9.969 10.071 -3.669
319 HG22 VAL 35 HG22 VAL 35 10.755 11.644 -3.740
320 HG23 VAL 35 HG23 VAL 35 11.112 10.425 -4.964
321 H GLY 36 H GLY 36 5.998 10.487 -5.952
322 HA2 GLY 36 HA2 GLY 36 4.727 12.059 -7.185
323 HA3 GLY 36 HA3 GLY 36 5.954 12.025 -8.441
324 H GLN 37 H GLN 37 5.985 9.014 -8.184
325 HA GLN 37 HA GLN 37 3.792 8.664 -10.065
326 HB2 GLN 37 HB2 GLN 37 4.972 6.847 -11.002
327 HB3 GLN 37 HB3 GLN 37 6.201 8.036 -10.615
328 HG2 GLN 37 HG2 GLN 37 6.497 6.707 -8.439
329 HG3 GLN 37 HG3 GLN 37 5.633 5.429 -9.296
330 HE21 GLN 37 HE21 GLN 37 7.401 4.085 -9.407
331 HE22 GLN 37 HE22 GLN 37 8.760 4.425 -10.409
332 H GLN 38 H GLN 38 2.396 6.846 -9.996
333 HA GLN 38 HA GLN 38 1.746 5.974 -7.304
334 HB2 GLN 38 HB2 GLN 38 -0.052 6.674 -8.867
335 HB3 GLN 38 HB3 GLN 38 0.407 5.366 -9.948
336 HG2 GLN 38 HG2 GLN 38 -0.153 3.742 -8.176
337 HG3 GLN 38 HG3 GLN 38 -0.674 5.076 -7.155
338 HE21 GLN 38 HE21 GLN 38 -2.592 6.096 -7.578
339 HE22 GLN 38 HE22 GLN 38 -3.742 5.461 -8.685
340 H VAL 39 H VAL 39 2.119 4.017 -6.515
341 HA VAL 39 HA VAL 39 3.466 2.134 -8.305
342 HB VAL 39 HB VAL 39 4.740 1.318 -6.326
343 HG11 VAL 39 HG11 VAL 39 5.131 4.245 -6.913
344 HG12 VAL 39 HG12 VAL 39 5.750 2.911 -7.875
345 HG13 VAL 39 HG13 VAL 39 6.334 3.154 -6.231
346 HG21 VAL 39 HG21 VAL 39 3.687 3.779 -4.929
347 HG22 VAL 39 HG22 VAL 39 4.814 2.584 -4.271
348 HG23 VAL 39 HG23 VAL 39 3.145 2.134 -4.611
349 H SER 40 H SER 40 3.098 -0.057 -7.929
350 HA SER 40 HA SER 40 0.547 -0.623 -6.651
351 HB2 SER 40 HB2 SER 40 1.025 -2.821 -7.961
352 HB3 SER 40 HB3 SER 40 0.617 -1.375 -8.896
353 HG SER 40 HG SER 40 3.199 -2.373 -8.329
354 H PHE 41 H PHE 41 0.745 -1.398 -4.621
355 HA PHE 41 HA PHE 41 3.088 -3.044 -4.026
356 HB2 PHE 41 HB2 PHE 41 3.170 -2.040 -1.751
357 HB3 PHE 41 HB3 PHE 41 3.571 -0.901 -3.019
358 HD1 PHE 41 HD1 PHE 41 1.891 0.845 -3.652
359 HD2 PHE 41 HD2 PHE 41 1.338 -1.697 -0.296
360 HE1 PHE 41 HE1 PHE 41 0.209 2.394 -2.761
361 HE2 PHE 41 HE2 PHE 41 -0.351 -0.155 0.595
362 HZ PHE 41 HZ PHE 41 -0.916 1.890 -0.632
363 H GLU 42 H GLU 42 2.673 -4.131 -1.873
364 HA GLU 42 HA GLU 42 -0.049 -5.232 -1.990
365 HB2 GLU 42 HB2 GLU 42 2.583 -6.377 -1.152
366 HB3 GLU 42 HB3 GLU 42 1.048 -6.944 -0.520
367 HG2 GLU 42 HG2 GLU 42 0.913 -6.771 -3.357
368 HG3 GLU 42 HG3 GLU 42 2.197 -7.858 -2.807
369 H ASN 43 H ASN 43 -0.765 -6.080 0.064
370 HA ASN 43 HA ASN 43 -0.806 -4.024 2.076
371 HB2 ASN 43 HB2 ASN 43 -2.210 -6.625 1.699
372 HB3 ASN 43 HB3 ASN 43 -1.965 -6.114 3.362
373 HD21 ASN 43 HD21 ASN 43 -3.196 -4.940 0.260
374 HD22 ASN 43 HD22 ASN 43 -4.459 -3.980 0.927
375 H GLU 44 H GLU 44 0.900 -6.893 1.481
376 HA GLU 44 HA GLU 44 2.098 -7.267 4.036
377 HB2 GLU 44 HB2 GLU 44 2.984 -8.148 1.294
378 HB3 GLU 44 HB3 GLU 44 3.645 -8.724 2.815
379 HG2 GLU 44 HG2 GLU 44 1.558 -9.775 3.373
380 HG3 GLU 44 HG3 GLU 44 0.792 -9.072 1.948
381 H ASP 45 H ASP 45 2.526 -4.945 1.582
382 HA ASP 45 HA ASP 45 5.374 -4.589 2.126
383 HB2 ASP 45 HB2 ASP 45 3.577 -3.176 0.146
384 HB3 ASP 45 HB3 ASP 45 5.276 -2.816 0.377
385 H ILE 46 H ILE 46 2.400 -3.450 3.249
386 HA ILE 46 HA ILE 46 3.231 -0.767 3.724
387 HB ILE 46 HB ILE 46 0.877 -2.107 5.048
388 HG12 ILE 46 HG12 ILE 46 0.758 -0.774 2.341
389 HG13 ILE 46 HG13 ILE 46 0.876 -2.520 2.522
390 HG21 ILE 46 HG21 ILE 46 -0.054 0.181 4.895
391 HG22 ILE 46 HG22 ILE 46 1.453 0.722 4.157
392 HG23 ILE 46 HG23 ILE 46 1.447 0.131 5.810
393 HD11 ILE 46 HD11 ILE 46 -1.245 -2.532 3.734
394 HD12 ILE 46 HD12 ILE 46 -1.428 -1.782 2.145
395 HD13 ILE 46 HD13 ILE 46 -1.340 -0.778 3.589
396 H TYR 47 H TYR 47 4.281 -0.084 5.359
397 HA TYR 47 HA TYR 47 5.035 -1.772 7.592
398 HB2 TYR 47 HB2 TYR 47 5.771 0.874 6.474
399 HB3 TYR 47 HB3 TYR 47 6.012 0.661 8.206
400 HD1 TYR 47 HD1 TYR 47 7.723 0.884 5.376
401 HD2 TYR 47 HD2 TYR 47 7.123 -1.989 8.449
402 HE1 TYR 47 HE1 TYR 47 9.908 -0.091 4.880
403 HE2 TYR 47 HE2 TYR 47 9.324 -2.983 7.947
404 HH TYR 47 HH TYR 47 10.910 -3.094 6.208
405 H ASN 48 H ASN 48 3.008 0.886 6.742
406 HA ASN 48 HA ASN 48 1.838 1.018 9.463
407 HB2 ASN 48 HB2 ASN 48 2.796 3.401 7.865
408 HB3 ASN 48 HB3 ASN 48 1.696 3.512 9.214
409 HD21 ASN 48 HD21 ASN 48 2.925 4.712 10.390
410 HD22 ASN 48 HD22 ASN 48 4.401 4.248 11.169
411 H VAL 49 H VAL 49 -0.138 0.352 8.966
412 HA VAL 49 HA VAL 49 -1.435 1.188 6.486
413 HB VAL 49 HB VAL 49 -2.610 -0.474 8.731
414 HG11 VAL 49 HG11 VAL 49 -4.172 -1.274 7.051
415 HG12 VAL 49 HG12 VAL 49 -3.409 -0.256 5.830
416 HG13 VAL 49 HG13 VAL 49 -4.255 0.481 7.192
417 HG21 VAL 49 HG21 VAL 49 -1.182 -1.424 6.244
418 HG22 VAL 49 HG22 VAL 49 -2.011 -2.458 7.409
419 HG23 VAL 49 HG23 VAL 49 -0.581 -1.550 7.898
420 H ARG 50 H ARG 50 -2.132 1.335 9.917
421 HA ARG 50 HA ARG 50 -3.625 3.838 9.510
422 HB2 ARG 50 HB2 ARG 50 -5.125 2.987 11.417
423 HB3 ARG 50 HB3 ARG 50 -5.333 2.208 9.849
424 HG2 ARG 50 HG2 ARG 50 -3.804 0.391 10.668
425 HG3 ARG 50 HG3 ARG 50 -3.894 1.131 12.263
426 HD2 ARG 50 HD2 ARG 50 -6.281 0.797 12.315
427 HD3 ARG 50 HD3 ARG 50 -6.253 0.153 10.669
428 HE ARG 50 HE ARG 50 -4.861 -1.121 12.919
429 HH11 ARG 50 HH11 ARG 50 -6.955 -1.409 10.079
430 HH12 ARG 50 HH12 ARG 50 -7.042 -3.100 10.135
431 HH21 ARG 50 HH21 ARG 50 -4.984 -3.457 13.007
432 HH22 ARG 50 HH22 ARG 50 -5.893 -4.295 11.851
433 H GLY 51 H GLY 51 -1.114 4.077 10.024
434 HA2 GLY 51 HA2 GLY 51 0.283 5.124 11.601
435 HA3 GLY 51 HA3 GLY 51 -0.850 4.654 12.877
436 H LYS 52 H LYS 52 -1.174 2.052 12.319
437 HA LYS 52 HA LYS 52 1.422 0.752 12.218
438 HB2 LYS 52 HB2 LYS 52 0.422 1.010 14.624
439 HB3 LYS 52 HB3 LYS 52 -0.814 -0.107 14.074
440 HG2 LYS 52 HG2 LYS 52 2.141 -0.748 14.105
441 HG3 LYS 52 HG3 LYS 52 1.028 -1.142 15.405
442 HD2 LYS 52 HD2 LYS 52 0.573 -2.104 12.588
443 HD3 LYS 52 HD3 LYS 52 1.606 -2.986 13.710
444 HE2 LYS 52 HE2 LYS 52 -0.522 -4.018 13.834
445 HE3 LYS 52 HE3 LYS 52 -0.379 -3.037 15.285
446 HZ1 LYS 52 HZ1 LYS 52 -1.659 -1.744 12.997
447 HZ2 LYS 52 HZ2 LYS 52 -2.079 -1.710 14.636
448 HZ3 LYS 52 HZ3 LYS 52 -2.495 -3.030 13.685
Start of MODEL 6
1 H1 SER 0 H1 SER 0 -2.468 -12.005 1.400
2 H2 SER 0 H2 SER 0 -3.025 -12.025 -0.215
3 H3 SER 0 H3 SER 0 -3.933 -11.251 0.970
4 HA SER 0 HA SER 0 -2.274 -9.602 1.233
5 HB2 SER 0 HB2 SER 0 -0.487 -11.401 0.390
6 HB3 SER 0 HB3 SER 0 -0.850 -10.669 -1.168
7 HG SER 0 HG SER 0 0.859 -9.859 0.449
8 H MET 1 H MET 1 -3.139 -7.839 0.288
9 HA MET 1 HA MET 1 -4.256 -8.170 -2.401
10 HB2 MET 1 HB2 MET 1 -5.118 -5.979 -0.542
11 HB3 MET 1 HB3 MET 1 -6.009 -6.736 -1.856
12 HG2 MET 1 HG2 MET 1 -6.203 -8.786 -0.441
13 HG3 MET 1 HG3 MET 1 -5.417 -7.867 0.846
14 HE1 MET 1 HE1 MET 1 -6.487 -5.761 2.043
15 HE2 MET 1 HE2 MET 1 -8.082 -5.109 1.663
16 HE3 MET 1 HE3 MET 1 -6.764 -4.944 0.504
17 H ASN 2 H ASN 2 -3.893 -6.488 -3.794
18 HA ASN 2 HA ASN 2 -1.535 -4.868 -3.236
19 HB2 ASN 2 HB2 ASN 2 -3.015 -5.503 -5.794
20 HB3 ASN 2 HB3 ASN 2 -1.753 -4.285 -5.703
21 HD21 ASN 2 HD21 ASN 2 0.367 -4.927 -5.541
22 HD22 ASN 2 HD22 ASN 2 0.873 -6.549 -5.704
23 H ARG 3 H ARG 3 -1.513 -2.692 -3.359
24 HA ARG 3 HA ARG 3 -4.077 -1.296 -3.647
25 HB2 ARG 3 HB2 ARG 3 -2.966 -1.682 -1.216
26 HB3 ARG 3 HB3 ARG 3 -2.082 -0.248 -1.704
27 HG2 ARG 3 HG2 ARG 3 -3.962 0.463 -0.429
28 HG3 ARG 3 HG3 ARG 3 -4.285 0.862 -2.123
29 HD2 ARG 3 HD2 ARG 3 -5.703 -1.056 -2.369
30 HD3 ARG 3 HD3 ARG 3 -5.210 -1.654 -0.794
31 HE ARG 3 HE ARG 3 -6.450 0.900 -0.575
32 HH11 ARG 3 HH11 ARG 3 -7.195 -2.540 -1.102
33 HH12 ARG 3 HH12 ARG 3 -8.718 -2.488 -0.367
34 HH21 ARG 3 HH21 ARG 3 -8.572 0.973 0.435
35 HH22 ARG 3 HH22 ARG 3 -9.517 -0.460 0.524
36 H LEU 4 H LEU 4 -3.722 1.004 -4.201
37 HA LEU 4 HA LEU 4 -1.225 1.368 -5.706
38 HB2 LEU 4 HB2 LEU 4 -4.024 2.256 -6.359
39 HB3 LEU 4 HB3 LEU 4 -2.606 2.739 -7.252
40 HG LEU 4 HG LEU 4 -3.618 -0.101 -7.015
41 HD11 LEU 4 HD11 LEU 4 -5.137 1.317 -8.283
42 HD12 LEU 4 HD12 LEU 4 -4.310 0.156 -9.326
43 HD13 LEU 4 HD13 LEU 4 -3.802 1.840 -9.310
44 HD21 LEU 4 HD21 LEU 4 -1.396 1.125 -8.648
45 HD22 LEU 4 HD22 LEU 4 -2.049 -0.496 -8.894
46 HD23 LEU 4 HD23 LEU 4 -1.253 -0.090 -7.373
47 H GLY 5 H GLY 5 -0.118 3.160 -5.200
48 HA2 GLY 5 HA2 GLY 5 -1.526 5.467 -4.193
49 HA3 GLY 5 HA3 GLY 5 -0.413 4.716 -3.042
50 H ILE 6 H ILE 6 -0.272 7.295 -3.983
51 HA ILE 6 HA ILE 6 1.833 7.390 -6.013
52 HB ILE 6 HB ILE 6 0.449 9.631 -4.518
53 HG12 ILE 6 HG12 ILE 6 -0.119 8.735 -7.346
54 HG13 ILE 6 HG13 ILE 6 -1.076 8.211 -5.964
55 HG21 ILE 6 HG21 ILE 6 2.154 9.685 -7.007
56 HG22 ILE 6 HG22 ILE 6 2.607 10.287 -5.413
57 HG23 ILE 6 HG23 ILE 6 1.308 11.071 -6.314
58 HD11 ILE 6 HD11 ILE 6 -1.647 10.543 -5.495
59 HD12 ILE 6 HD12 ILE 6 -2.146 10.049 -7.112
60 HD13 ILE 6 HD13 ILE 6 -0.707 11.050 -6.897
61 H ILE 7 H ILE 7 3.875 7.533 -5.447
62 HA ILE 7 HA ILE 7 4.743 7.571 -2.754
63 HB ILE 7 HB ILE 7 6.352 8.285 -5.224
64 HG12 ILE 7 HG12 ILE 7 5.330 6.014 -5.324
65 HG13 ILE 7 HG13 ILE 7 7.086 5.977 -5.279
66 HG21 ILE 7 HG21 ILE 7 7.382 9.034 -3.106
67 HG22 ILE 7 HG22 ILE 7 8.321 7.762 -3.890
68 HG23 ILE 7 HG23 ILE 7 7.305 7.378 -2.500
69 HD11 ILE 7 HD11 ILE 7 6.071 4.243 -3.885
70 HD12 ILE 7 HD12 ILE 7 5.284 5.492 -2.916
71 HD13 ILE 7 HD13 ILE 7 7.042 5.372 -2.946
72 H TYR 8 H TYR 8 4.296 9.128 -1.551
73 HA TYR 8 HA TYR 8 4.082 11.862 -2.443
74 HB2 TYR 8 HB2 TYR 8 2.515 10.610 -0.863
75 HB3 TYR 8 HB3 TYR 8 3.780 10.775 0.342
76 HD1 TYR 8 HD1 TYR 8 4.024 12.771 1.564
77 HD2 TYR 8 HD2 TYR 8 1.482 12.663 -1.839
78 HE1 TYR 8 HE1 TYR 8 3.120 14.958 2.185
79 HE2 TYR 8 HE2 TYR 8 0.567 14.858 -1.237
80 HH TYR 8 HH TYR 8 1.958 16.928 0.806
81 H GLU 9 H GLU 9 6.155 9.824 -0.469
82 HA GLU 9 HA GLU 9 8.310 11.691 -0.566
83 HB2 GLU 9 HB2 GLU 9 6.781 12.548 1.299
84 HB3 GLU 9 HB3 GLU 9 7.164 11.087 2.183
85 HG2 GLU 9 HG2 GLU 9 9.576 11.748 2.052
86 HG3 GLU 9 HG3 GLU 9 9.054 13.276 1.348
87 H ILE 10 H ILE 10 10.251 10.709 0.461
88 HA ILE 10 HA ILE 10 10.056 7.779 0.737
89 HB ILE 10 HB ILE 10 12.245 9.495 -0.476
90 HG12 ILE 10 HG12 ILE 10 10.319 8.927 -1.942
91 HG13 ILE 10 HG13 ILE 10 11.855 8.306 -2.538
92 HG21 ILE 10 HG21 ILE 10 13.393 7.837 0.805
93 HG22 ILE 10 HG22 ILE 10 13.512 7.387 -0.899
94 HG23 ILE 10 HG23 ILE 10 12.371 6.555 0.156
95 HD11 ILE 10 HD11 ILE 10 11.237 6.085 -1.648
96 HD12 ILE 10 HD12 ILE 10 10.120 6.681 -2.870
97 HD13 ILE 10 HD13 ILE 10 9.671 6.739 -1.166
98 H GLN 11 H GLN 11 11.042 6.891 2.527
99 HA GLN 11 HA GLN 11 12.701 8.641 4.199
100 HB2 GLN 11 HB2 GLN 11 10.550 6.714 5.048
101 HB3 GLN 11 HB3 GLN 11 11.887 7.083 6.125
102 HG2 GLN 11 HG2 GLN 11 10.423 8.600 6.879
103 HG3 GLN 11 HG3 GLN 11 11.064 9.554 5.542
104 HE21 GLN 11 HE21 GLN 11 9.820 9.947 3.819
105 HE22 GLN 11 HE22 GLN 11 8.136 9.586 3.755
106 H GLY 12 H GLY 12 14.400 7.699 2.896
107 HA2 GLY 12 HA2 GLY 12 16.155 6.257 2.654
108 HA3 GLY 12 HA3 GLY 12 15.628 5.493 4.145
109 H MET 13 H MET 13 14.577 3.624 4.080
110 HA MET 13 HA MET 13 14.181 2.455 1.441
111 HB2 MET 13 HB2 MET 13 14.861 1.237 4.085
112 HB3 MET 13 HB3 MET 13 14.060 0.267 2.858
113 HG2 MET 13 HG2 MET 13 16.502 1.796 2.116
114 HG3 MET 13 HG3 MET 13 16.667 0.324 3.066
115 HE1 MET 13 HE1 MET 13 15.855 1.966 -0.295
116 HE2 MET 13 HE2 MET 13 14.242 1.250 -0.133
117 HE3 MET 13 HE3 MET 13 15.356 0.644 -1.348
118 H LYS 14 H LYS 14 12.412 4.041 3.533
119 HA LYS 14 HA LYS 14 10.029 2.365 3.120
120 HB2 LYS 14 HB2 LYS 14 10.408 4.753 4.914
121 HB3 LYS 14 HB3 LYS 14 8.946 3.799 4.783
122 HG2 LYS 14 HG2 LYS 14 10.172 1.878 5.740
123 HG3 LYS 14 HG3 LYS 14 11.592 2.919 5.919
124 HD2 LYS 14 HD2 LYS 14 10.153 4.505 7.212
125 HD3 LYS 14 HD3 LYS 14 8.900 3.274 7.199
126 HE2 LYS 14 HE2 LYS 14 10.291 1.768 8.441
127 HE3 LYS 14 HE3 LYS 14 11.662 2.872 8.318
128 HZ1 LYS 14 HZ1 LYS 14 10.491 4.474 9.630
129 HZ2 LYS 14 HZ2 LYS 14 10.534 3.034 10.488
130 HZ3 LYS 14 HZ3 LYS 14 9.111 3.522 9.707
131 H ALA 15 H ALA 15 8.141 3.505 2.368
132 HA ALA 15 HA ALA 15 8.644 6.111 1.145
133 HB1 ALA 15 HB1 ALA 15 7.411 5.395 -0.858
134 HB2 ALA 15 HB2 ALA 15 7.361 3.749 -0.224
135 HB3 ALA 15 HB3 ALA 15 8.908 4.490 -0.643
136 H VAL 16 H VAL 16 6.883 7.436 1.085
137 HA VAL 16 HA VAL 16 4.538 6.599 2.640
138 HB VAL 16 HB VAL 16 5.402 9.359 1.679
139 HG11 VAL 16 HG11 VAL 16 3.088 8.621 3.486
140 HG12 VAL 16 HG12 VAL 16 2.953 9.144 1.809
141 HG13 VAL 16 HG13 VAL 16 3.582 10.254 3.026
142 HG21 VAL 16 HG21 VAL 16 5.929 9.867 3.920
143 HG22 VAL 16 HG22 VAL 16 6.725 8.327 3.540
144 HG23 VAL 16 HG23 VAL 16 5.238 8.355 4.491
145 H VAL 17 H VAL 17 2.843 5.966 1.488
146 HA VAL 17 HA VAL 17 2.604 7.015 -1.234
147 HB VAL 17 HB VAL 17 1.016 5.048 -1.588
148 HG11 VAL 17 HG11 VAL 17 3.158 5.186 -2.654
149 HG12 VAL 17 HG12 VAL 17 2.866 3.530 -2.128
150 HG13 VAL 17 HG13 VAL 17 3.959 4.567 -1.209
151 HG21 VAL 17 HG21 VAL 17 1.158 3.152 -0.189
152 HG22 VAL 17 HG22 VAL 17 0.970 4.528 0.901
153 HG23 VAL 17 HG23 VAL 17 2.557 3.803 0.667
154 H LEU 18 H LEU 18 1.016 8.218 -1.670
155 HA LEU 18 HA LEU 18 -1.240 8.447 0.156
156 HB2 LEU 18 HB2 LEU 18 -0.198 10.516 -0.586
157 HB3 LEU 18 HB3 LEU 18 -0.323 10.030 -2.253
158 HG LEU 18 HG LEU 18 -2.799 10.188 -2.092
159 HD11 LEU 18 HD11 LEU 18 -2.208 11.265 0.653
160 HD12 LEU 18 HD12 LEU 18 -3.118 9.806 0.255
161 HD13 LEU 18 HD13 LEU 18 -3.761 11.392 -0.172
162 HD21 LEU 18 HD21 LEU 18 -1.281 12.676 -1.328
163 HD22 LEU 18 HD22 LEU 18 -2.894 12.635 -2.039
164 HD23 LEU 18 HD23 LEU 18 -1.507 12.055 -2.963
165 H THR 19 H THR 19 -2.620 6.825 -0.245
166 HA THR 19 HA THR 19 -2.687 5.437 -2.705
167 HB THR 19 HB THR 19 -4.682 4.275 -1.812
168 HG1 THR 19 HG1 THR 19 -5.305 4.744 0.297
169 HG21 THR 19 HG21 THR 19 -2.473 3.448 -1.289
170 HG22 THR 19 HG22 THR 19 -3.525 3.236 0.116
171 HG23 THR 19 HG23 THR 19 -2.348 4.553 0.077
172 H SER 20 H SER 20 -4.800 5.013 -3.874
173 HA SER 20 HA SER 20 -5.755 7.338 -5.095
174 HB2 SER 20 HB2 SER 20 -7.462 5.663 -5.983
175 HB3 SER 20 HB3 SER 20 -5.758 5.285 -6.282
176 HG SER 20 HG SER 20 -7.602 4.095 -4.595
177 H GLU 21 H GLU 21 -6.537 5.780 -2.206
178 HA GLU 21 HA GLU 21 -9.267 6.718 -1.936
179 HB2 GLU 21 HB2 GLU 21 -7.552 5.544 0.219
180 HB3 GLU 21 HB3 GLU 21 -9.302 5.497 0.059
181 HG2 GLU 21 HG2 GLU 21 -9.222 3.828 -1.547
182 HG3 GLU 21 HG3 GLU 21 -7.521 4.132 -1.912
183 H GLY 22 H GLY 22 -6.163 7.980 -1.488
184 HA2 GLY 22 HA2 GLY 22 -5.602 10.072 -0.711
185 HA3 GLY 22 HA3 GLY 22 -7.207 10.231 -0.016
186 H GLU 23 H GLU 23 -5.241 7.417 0.666
187 HA GLU 23 HA GLU 23 -5.023 8.351 3.443
188 HB2 GLU 23 HB2 GLU 23 -4.743 5.542 2.367
189 HB3 GLU 23 HB3 GLU 23 -4.887 6.024 4.046
190 HG2 GLU 23 HG2 GLU 23 -7.042 6.433 2.002
191 HG3 GLU 23 HG3 GLU 23 -6.939 5.009 3.042
192 H PHE 24 H PHE 24 -2.965 8.266 4.420
193 HA PHE 24 HA PHE 24 -0.742 7.901 2.530
194 HB2 PHE 24 HB2 PHE 24 -0.685 9.280 5.251
195 HB3 PHE 24 HB3 PHE 24 0.655 9.100 4.136
196 HD1 PHE 24 HD1 PHE 24 0.979 10.572 2.319
197 HD2 PHE 24 HD2 PHE 24 -2.547 10.810 4.683
198 HE1 PHE 24 HE1 PHE 24 0.454 12.745 1.314
199 HE2 PHE 24 HE2 PHE 24 -3.077 12.990 3.677
200 HZ PHE 24 HZ PHE 24 -1.577 13.960 1.992
201 H LEU 25 H LEU 25 0.108 6.023 2.612
202 HA LEU 25 HA LEU 25 0.289 4.679 5.213
203 HB2 LEU 25 HB2 LEU 25 -0.115 3.488 2.466
204 HB3 LEU 25 HB3 LEU 25 0.451 2.537 3.819
205 HG LEU 25 HG LEU 25 -1.726 3.288 5.007
206 HD11 LEU 25 HD11 LEU 25 -2.511 3.818 2.157
207 HD12 LEU 25 HD12 LEU 25 -2.340 5.033 3.421
208 HD13 LEU 25 HD13 LEU 25 -3.590 3.791 3.551
209 HD21 LEU 25 HD21 LEU 25 -1.808 1.427 2.648
210 HD22 LEU 25 HD22 LEU 25 -3.004 1.489 3.944
211 HD23 LEU 25 HD23 LEU 25 -1.339 1.027 4.300
212 H ILE 26 H ILE 26 2.225 3.667 5.697
213 HA ILE 26 HA ILE 26 4.490 4.585 4.106
214 HB ILE 26 HB ILE 26 4.574 3.171 6.785
215 HG12 ILE 26 HG12 ILE 26 3.188 5.162 7.124
216 HG13 ILE 26 HG13 ILE 26 4.753 5.376 7.895
217 HG21 ILE 26 HG21 ILE 26 6.763 4.278 7.003
218 HG22 ILE 26 HG22 ILE 26 6.548 4.979 5.400
219 HG23 ILE 26 HG23 ILE 26 6.670 3.228 5.588
220 HD11 ILE 26 HD11 ILE 26 3.874 6.568 5.275
221 HD12 ILE 26 HD12 ILE 26 5.465 6.771 6.011
222 HD13 ILE 26 HD13 ILE 26 4.031 7.415 6.815
223 H ILE 27 H ILE 27 5.502 3.127 2.885
224 HA ILE 27 HA ILE 27 4.953 0.276 3.391
225 HB ILE 27 HB ILE 27 4.932 -0.131 0.956
226 HG12 ILE 27 HG12 ILE 27 4.634 2.835 0.531
227 HG13 ILE 27 HG13 ILE 27 6.214 2.070 0.514
228 HG21 ILE 27 HG21 ILE 27 2.854 1.797 1.964
229 HG22 ILE 27 HG22 ILE 27 2.805 0.032 2.032
230 HG23 ILE 27 HG23 ILE 27 2.700 0.857 0.482
231 HD11 ILE 27 HD11 ILE 27 5.507 0.645 -1.330
232 HD12 ILE 27 HD12 ILE 27 5.325 2.358 -1.721
233 HD13 ILE 27 HD13 ILE 27 3.912 1.395 -1.295
234 H ARG 28 H ARG 28 6.472 -1.119 2.337
235 HA ARG 28 HA ARG 28 9.218 -0.481 2.623
236 HB2 ARG 28 HB2 ARG 28 8.080 -2.568 0.761
237 HB3 ARG 28 HB3 ARG 28 9.694 -2.521 1.429
238 HG2 ARG 28 HG2 ARG 28 8.780 -3.019 3.648
239 HG3 ARG 28 HG3 ARG 28 7.151 -3.073 2.951
240 HD2 ARG 28 HD2 ARG 28 7.991 -4.797 1.342
241 HD3 ARG 28 HD3 ARG 28 9.488 -4.832 2.261
242 HE ARG 28 HE ARG 28 7.992 -5.498 4.179
243 HH11 ARG 28 HH11 ARG 28 7.002 -6.202 0.844
244 HH12 ARG 28 HH12 ARG 28 6.479 -7.788 1.157
245 HH21 ARG 28 HH21 ARG 28 7.192 -7.695 4.642
246 HH22 ARG 28 HH22 ARG 28 6.540 -8.638 3.389
247 H ARG 29 H ARG 29 10.454 0.718 1.272
248 HA ARG 29 HA ARG 29 9.384 1.459 -1.310
249 HB2 ARG 29 HB2 ARG 29 10.505 3.181 -0.003
250 HB3 ARG 29 HB3 ARG 29 11.951 2.193 0.090
251 HG2 ARG 29 HG2 ARG 29 11.814 2.313 -2.529
252 HG3 ARG 29 HG3 ARG 29 10.897 3.780 -2.196
253 HD2 ARG 29 HD2 ARG 29 12.744 4.605 -0.821
254 HD3 ARG 29 HD3 ARG 29 13.615 3.104 -1.143
255 HE ARG 29 HE ARG 29 13.038 4.179 -3.601
256 HH11 ARG 29 HH11 ARG 29 14.911 5.167 -0.736
257 HH12 ARG 29 HH12 ARG 29 16.033 6.074 -1.635
258 HH21 ARG 29 HH21 ARG 29 14.592 5.460 -4.816
259 HH22 ARG 29 HH22 ARG 29 15.862 6.236 -4.013
260 H ARG 30 H ARG 30 9.964 0.548 -3.140
261 HA ARG 30 HA ARG 30 11.999 -1.541 -3.050
262 HB2 ARG 30 HB2 ARG 30 9.945 -0.949 -5.203
263 HB3 ARG 30 HB3 ARG 30 10.998 -2.348 -5.135
264 HG2 ARG 30 HG2 ARG 30 9.867 -3.175 -3.172
265 HG3 ARG 30 HG3 ARG 30 8.879 -1.718 -3.088
266 HD2 ARG 30 HD2 ARG 30 7.943 -2.282 -5.318
267 HD3 ARG 30 HD3 ARG 30 8.848 -3.798 -5.273
268 HE ARG 30 HE ARG 30 7.438 -3.867 -2.983
269 HH11 ARG 30 HH11 ARG 30 6.463 -3.337 -6.356
270 HH12 ARG 30 HH12 ARG 30 4.891 -3.942 -6.125
271 HH21 ARG 30 HH21 ARG 30 5.203 -4.736 -2.718
272 HH22 ARG 30 HH22 ARG 30 4.214 -4.825 -4.067
273 H LYS 31 H LYS 31 13.279 -1.638 -5.220
274 HA LYS 31 HA LYS 31 14.765 0.793 -5.264
275 HB2 LYS 31 HB2 LYS 31 15.087 -1.515 -7.180
276 HB3 LYS 31 HB3 LYS 31 16.289 -0.311 -6.756
277 HG2 LYS 31 HG2 LYS 31 15.178 -2.406 -4.881
278 HG3 LYS 31 HG3 LYS 31 16.719 -2.497 -5.723
279 HD2 LYS 31 HD2 LYS 31 17.527 -0.552 -4.492
280 HD3 LYS 31 HD3 LYS 31 15.945 -0.369 -3.728
281 HE2 LYS 31 HE2 LYS 31 16.184 -2.526 -2.642
282 HE3 LYS 31 HE3 LYS 31 17.724 -2.790 -3.450
283 HZ1 LYS 31 HZ1 LYS 31 17.784 -1.981 -1.063
284 HZ2 LYS 31 HZ2 LYS 31 17.344 -0.456 -1.634
285 HZ3 LYS 31 HZ3 LYS 31 18.759 -1.184 -2.149
286 H ASP 32 H ASP 32 12.066 -0.150 -7.010
287 HA ASP 32 HA ASP 32 12.707 1.580 -9.287
288 HB2 ASP 32 HB2 ASP 32 11.779 -0.699 -9.713
289 HB3 ASP 32 HB3 ASP 32 10.316 -0.224 -8.863
290 H MET 33 H MET 33 11.576 2.115 -6.315
291 HA MET 33 HA MET 33 9.174 3.625 -6.860
292 HB2 MET 33 HB2 MET 33 10.691 2.862 -4.471
293 HB3 MET 33 HB3 MET 33 9.924 4.439 -4.382
294 HG2 MET 33 HG2 MET 33 8.444 2.859 -3.428
295 HG3 MET 33 HG3 MET 33 7.774 3.338 -4.985
296 HE1 MET 33 HE1 MET 33 6.972 0.763 -3.206
297 HE2 MET 33 HE2 MET 33 6.805 -0.491 -4.433
298 HE3 MET 33 HE3 MET 33 6.136 1.117 -4.721
299 H LYS 34 H LYS 34 9.195 5.560 -7.806
300 HA LYS 34 HA LYS 34 11.231 7.486 -6.968
301 HB2 LYS 34 HB2 LYS 34 9.849 7.021 -9.588
302 HB3 LYS 34 HB3 LYS 34 10.341 8.640 -9.161
303 HG2 LYS 34 HG2 LYS 34 12.148 7.889 -10.414
304 HG3 LYS 34 HG3 LYS 34 12.677 7.570 -8.764
305 HD2 LYS 34 HD2 LYS 34 13.210 5.632 -10.015
306 HD3 LYS 34 HD3 LYS 34 11.776 5.228 -9.069
307 HE2 LYS 34 HE2 LYS 34 10.387 5.776 -11.085
308 HE3 LYS 34 HE3 LYS 34 11.886 5.977 -11.988
309 HZ1 LYS 34 HZ1 LYS 34 10.837 3.792 -12.229
310 HZ2 LYS 34 HZ2 LYS 34 11.076 3.478 -10.614
311 HZ3 LYS 34 HZ3 LYS 34 12.404 3.679 -11.639
312 H VAL 35 H VAL 35 10.437 9.619 -6.585
313 HA VAL 35 HA VAL 35 7.939 9.646 -5.204
314 HB VAL 35 HB VAL 35 9.614 12.072 -5.901
315 HG11 VAL 35 HG11 VAL 35 7.845 11.539 -3.513
316 HG12 VAL 35 HG12 VAL 35 7.385 12.487 -4.920
317 HG13 VAL 35 HG13 VAL 35 8.703 13.036 -3.876
318 HG21 VAL 35 HG21 VAL 35 10.837 11.729 -3.809
319 HG22 VAL 35 HG22 VAL 35 11.083 10.378 -4.917
320 HG23 VAL 35 HG23 VAL 35 9.974 10.213 -3.556
321 H GLY 36 H GLY 36 5.968 10.372 -5.882
322 HA2 GLY 36 HA2 GLY 36 4.626 11.905 -7.119
323 HA3 GLY 36 HA3 GLY 36 5.863 11.930 -8.365
324 H GLN 37 H GLN 37 5.940 8.870 -8.050
325 HA GLN 37 HA GLN 37 3.836 8.521 -10.026
326 HB2 GLN 37 HB2 GLN 37 4.962 6.567 -10.778
327 HB3 GLN 37 HB3 GLN 37 6.183 7.802 -10.533
328 HG2 GLN 37 HG2 GLN 37 6.639 6.740 -8.295
329 HG3 GLN 37 HG3 GLN 37 5.591 5.422 -8.809
330 HE21 GLN 37 HE21 GLN 37 7.236 3.923 -8.752
331 HE22 GLN 37 HE22 GLN 37 8.494 3.901 -9.932
332 H GLN 38 H GLN 38 2.231 7.025 -9.918
333 HA GLN 38 HA GLN 38 1.492 6.005 -7.326
334 HB2 GLN 38 HB2 GLN 38 -0.221 6.854 -8.910
335 HB3 GLN 38 HB3 GLN 38 0.211 5.590 -10.048
336 HG2 GLN 38 HG2 GLN 38 -0.432 3.926 -8.265
337 HG3 GLN 38 HG3 GLN 38 -1.096 5.284 -7.359
338 HE21 GLN 38 HE21 GLN 38 -3.005 6.271 -8.089
339 HE22 GLN 38 HE22 GLN 38 -3.980 5.554 -9.300
340 H VAL 39 H VAL 39 2.175 4.177 -6.574
341 HA VAL 39 HA VAL 39 3.264 2.165 -8.425
342 HB VAL 39 HB VAL 39 4.601 1.338 -6.510
343 HG11 VAL 39 HG11 VAL 39 5.008 4.268 -7.062
344 HG12 VAL 39 HG12 VAL 39 5.615 2.934 -8.045
345 HG13 VAL 39 HG13 VAL 39 6.212 3.166 -6.402
346 HG21 VAL 39 HG21 VAL 39 3.519 3.751 -5.054
347 HG22 VAL 39 HG22 VAL 39 4.785 2.683 -4.454
348 HG23 VAL 39 HG23 VAL 39 3.149 2.069 -4.692
349 H SER 40 H SER 40 3.007 -0.074 -7.700
350 HA SER 40 HA SER 40 0.518 -0.480 -6.245
351 HB2 SER 40 HB2 SER 40 0.538 -2.712 -7.402
352 HB3 SER 40 HB3 SER 40 0.445 -1.356 -8.525
353 HG SER 40 HG SER 40 2.866 -2.550 -7.755
354 H PHE 41 H PHE 41 0.707 -1.405 -4.329
355 HA PHE 41 HA PHE 41 3.127 -2.940 -3.730
356 HB2 PHE 41 HB2 PHE 41 3.025 -1.988 -1.405
357 HB3 PHE 41 HB3 PHE 41 3.547 -0.858 -2.637
358 HD1 PHE 41 HD1 PHE 41 1.010 -1.682 -0.172
359 HD2 PHE 41 HD2 PHE 41 2.009 0.964 -3.347
360 HE1 PHE 41 HE1 PHE 41 -0.741 -0.128 0.573
361 HE2 PHE 41 HE2 PHE 41 0.261 2.520 -2.604
362 HZ PHE 41 HZ PHE 41 -1.113 1.972 -0.635
363 H GLU 42 H GLU 42 2.736 -4.200 -1.699
364 HA GLU 42 HA GLU 42 -0.011 -5.180 -1.842
365 HB2 GLU 42 HB2 GLU 42 2.490 -6.704 -1.072
366 HB3 GLU 42 HB3 GLU 42 0.831 -7.295 -0.976
367 HG2 GLU 42 HG2 GLU 42 1.620 -8.226 -2.889
368 HG3 GLU 42 HG3 GLU 42 0.679 -6.852 -3.470
369 H ASN 43 H ASN 43 -0.750 -6.210 0.152
370 HA ASN 43 HA ASN 43 -0.824 -4.388 2.280
371 HB2 ASN 43 HB2 ASN 43 -1.767 -7.222 1.969
372 HB3 ASN 43 HB3 ASN 43 -1.790 -6.479 3.570
373 HD21 ASN 43 HD21 ASN 43 -2.498 -3.857 2.675
374 HD22 ASN 43 HD22 ASN 43 -4.097 -3.957 2.078
375 H GLU 44 H GLU 44 1.246 -7.080 1.718
376 HA GLU 44 HA GLU 44 2.326 -7.259 4.336
377 HB2 GLU 44 HB2 GLU 44 3.410 -8.166 1.680
378 HB3 GLU 44 HB3 GLU 44 4.071 -8.612 3.250
379 HG2 GLU 44 HG2 GLU 44 2.077 -9.757 3.839
380 HG3 GLU 44 HG3 GLU 44 1.253 -9.169 2.405
381 H ASP 45 H ASP 45 2.949 -5.232 1.584
382 HA ASP 45 HA ASP 45 5.586 -4.427 2.423
383 HB2 ASP 45 HB2 ASP 45 3.707 -3.292 0.354
384 HB3 ASP 45 HB3 ASP 45 5.288 -2.610 0.704
385 H ILE 46 H ILE 46 2.460 -3.680 3.304
386 HA ILE 46 HA ILE 46 2.860 -0.908 3.838
387 HB ILE 46 HB ILE 46 0.637 -2.711 4.815
388 HG12 ILE 46 HG12 ILE 46 0.745 -0.853 2.426
389 HG13 ILE 46 HG13 ILE 46 0.804 -2.607 2.350
390 HG21 ILE 46 HG21 ILE 46 -0.576 -0.649 5.211
391 HG22 ILE 46 HG22 ILE 46 0.817 0.292 4.634
392 HG23 ILE 46 HG23 ILE 46 0.946 -0.659 6.109
393 HD11 ILE 46 HD11 ILE 46 -1.415 -2.017 1.822
394 HD12 ILE 46 HD12 ILE 46 -1.486 -0.835 3.121
395 HD13 ILE 46 HD13 ILE 46 -1.465 -2.553 3.509
396 H TYR 47 H TYR 47 3.985 -0.150 5.353
397 HA TYR 47 HA TYR 47 4.812 -1.725 7.614
398 HB2 TYR 47 HB2 TYR 47 5.623 0.826 6.364
399 HB3 TYR 47 HB3 TYR 47 5.972 0.654 8.093
400 HD1 TYR 47 HD1 TYR 47 6.643 -2.291 8.116
401 HD2 TYR 47 HD2 TYR 47 7.720 0.814 5.401
402 HE1 TYR 47 HE1 TYR 47 8.666 -3.513 7.523
403 HE2 TYR 47 HE2 TYR 47 9.755 -0.419 4.807
404 HH TYR 47 HH TYR 47 10.191 -3.642 5.626
405 H ASN 48 H ASN 48 2.287 0.268 6.929
406 HA ASN 48 HA ASN 48 1.788 1.264 9.560
407 HB2 ASN 48 HB2 ASN 48 -0.149 0.732 7.270
408 HB3 ASN 48 HB3 ASN 48 -0.633 1.446 8.796
409 HD21 ASN 48 HD21 ASN 48 -1.295 3.349 7.866
410 HD22 ASN 48 HD22 ASN 48 -0.222 4.510 7.196
411 H VAL 49 H VAL 49 0.919 -1.610 7.761
412 HA VAL 49 HA VAL 49 -0.517 -2.794 9.970
413 HB VAL 49 HB VAL 49 0.387 -4.051 7.356
414 HG11 VAL 49 HG11 VAL 49 -0.114 -5.721 9.048
415 HG12 VAL 49 HG12 VAL 49 -1.355 -5.727 7.792
416 HG13 VAL 49 HG13 VAL 49 -1.684 -4.974 9.350
417 HG21 VAL 49 HG21 VAL 49 -2.284 -2.833 8.056
418 HG22 VAL 49 HG22 VAL 49 -1.894 -3.681 6.560
419 HG23 VAL 49 HG23 VAL 49 -1.091 -2.160 6.944
420 H ARG 50 H ARG 50 2.529 -3.230 8.266
421 HA ARG 50 HA ARG 50 3.399 -5.185 10.234
422 HB2 ARG 50 HB2 ARG 50 4.667 -4.232 7.663
423 HB3 ARG 50 HB3 ARG 50 5.363 -5.452 8.715
424 HG2 ARG 50 HG2 ARG 50 2.624 -5.745 7.490
425 HG3 ARG 50 HG3 ARG 50 4.092 -6.280 6.675
426 HD2 ARG 50 HD2 ARG 50 3.118 -8.175 7.795
427 HD3 ARG 50 HD3 ARG 50 4.588 -7.713 8.642
428 HE ARG 50 HE ARG 50 1.932 -6.895 9.607
429 HH11 ARG 50 HH11 ARG 50 4.998 -8.590 10.186
430 HH12 ARG 50 HH12 ARG 50 4.784 -8.701 11.874
431 HH21 ARG 50 HH21 ARG 50 1.641 -7.070 11.978
432 HH22 ARG 50 HH22 ARG 50 2.855 -7.846 12.879
433 H GLY 51 H GLY 51 3.045 -2.700 11.295
434 HA2 GLY 51 HA2 GLY 51 5.678 -2.190 12.347
435 HA3 GLY 51 HA3 GLY 51 5.012 -0.854 11.413
436 H LYS 52 H LYS 52 3.326 -3.145 13.493
437 HA LYS 52 HA LYS 52 2.719 -0.974 15.328
438 HB2 LYS 52 HB2 LYS 52 0.802 -2.923 14.040
439 HB3 LYS 52 HB3 LYS 52 0.423 -2.137 15.567
440 HG2 LYS 52 HG2 LYS 52 0.557 0.038 14.516
441 HG3 LYS 52 HG3 LYS 52 1.044 -0.697 12.995
442 HD2 LYS 52 HD2 LYS 52 -1.117 -1.854 12.863
443 HD3 LYS 52 HD3 LYS 52 -1.596 -1.118 14.396
444 HE2 LYS 52 HE2 LYS 52 -1.423 1.107 13.407
445 HE3 LYS 52 HE3 LYS 52 -0.867 0.402 11.894
446 HZ1 LYS 52 HZ1 LYS 52 -3.001 -0.666 11.635
447 HZ2 LYS 52 HZ2 LYS 52 -3.202 0.985 11.796
448 HZ3 LYS 52 HZ3 LYS 52 -3.559 -0.023 13.093
Start of MODEL 7
1 H1 SER 0 H1 SER 0 -0.665 -12.614 -0.694
2 H2 SER 0 H2 SER 0 -2.009 -12.622 -1.707
3 H3 SER 0 H3 SER 0 -2.131 -11.966 -0.146
4 HA SER 0 HA SER 0 -0.616 -10.238 -0.732
5 HB2 SER 0 HB2 SER 0 -0.635 -11.583 -3.445
6 HB3 SER 0 HB3 SER 0 0.109 -10.026 -3.097
7 HG SER 0 HG SER 0 1.566 -11.013 -1.754
8 H MET 1 H MET 1 -2.005 -8.609 -0.599
9 HA MET 1 HA MET 1 -4.130 -8.368 -2.632
10 HB2 MET 1 HB2 MET 1 -3.982 -6.935 0.041
11 HB3 MET 1 HB3 MET 1 -5.327 -6.920 -1.077
12 HG2 MET 1 HG2 MET 1 -5.509 -9.418 -0.612
13 HG3 MET 1 HG3 MET 1 -4.408 -9.117 0.731
14 HE1 MET 1 HE1 MET 1 -6.572 -6.504 2.834
15 HE2 MET 1 HE2 MET 1 -5.544 -6.042 1.482
16 HE3 MET 1 HE3 MET 1 -4.979 -7.233 2.653
17 H ASN 2 H ASN 2 -3.931 -6.566 -3.900
18 HA ASN 2 HA ASN 2 -1.526 -4.986 -3.458
19 HB2 ASN 2 HB2 ASN 2 -3.173 -5.496 -5.896
20 HB3 ASN 2 HB3 ASN 2 -2.170 -4.051 -5.808
21 HD21 ASN 2 HD21 ASN 2 0.090 -4.477 -5.113
22 HD22 ASN 2 HD22 ASN 2 0.897 -5.862 -5.722
23 H ARG 3 H ARG 3 -1.436 -2.889 -3.195
24 HA ARG 3 HA ARG 3 -3.936 -1.385 -2.974
25 HB2 ARG 3 HB2 ARG 3 -2.383 -1.980 -0.883
26 HB3 ARG 3 HB3 ARG 3 -1.427 -0.674 -1.555
27 HG2 ARG 3 HG2 ARG 3 -2.716 0.411 0.015
28 HG3 ARG 3 HG3 ARG 3 -3.592 0.690 -1.496
29 HD2 ARG 3 HD2 ARG 3 -5.169 -0.969 -1.002
30 HD3 ARG 3 HD3 ARG 3 -4.211 -1.606 0.321
31 HE ARG 3 HE ARG 3 -5.450 1.089 0.466
32 HH11 ARG 3 HH11 ARG 3 -4.695 -2.055 2.021
33 HH12 ARG 3 HH12 ARG 3 -5.411 -1.643 3.480
34 HH21 ARG 3 HH21 ARG 3 -6.368 1.650 2.433
35 HH22 ARG 3 HH22 ARG 3 -6.408 0.593 3.783
36 H LEU 4 H LEU 4 -3.754 0.705 -3.828
37 HA LEU 4 HA LEU 4 -1.403 1.240 -5.540
38 HB2 LEU 4 HB2 LEU 4 -4.260 2.162 -5.790
39 HB3 LEU 4 HB3 LEU 4 -2.961 2.638 -6.853
40 HG LEU 4 HG LEU 4 -4.056 -0.164 -6.558
41 HD11 LEU 4 HD11 LEU 4 -5.622 1.356 -7.636
42 HD12 LEU 4 HD12 LEU 4 -4.978 0.177 -8.776
43 HD13 LEU 4 HD13 LEU 4 -4.373 1.835 -8.784
44 HD21 LEU 4 HD21 LEU 4 -1.976 0.968 -8.429
45 HD22 LEU 4 HD22 LEU 4 -2.697 -0.633 -8.567
46 HD23 LEU 4 HD23 LEU 4 -1.717 -0.229 -7.159
47 H GLY 5 H GLY 5 -0.255 3.019 -5.114
48 HA2 GLY 5 HA2 GLY 5 -1.551 5.275 -3.916
49 HA3 GLY 5 HA3 GLY 5 -0.350 4.507 -2.889
50 H ILE 6 H ILE 6 -0.257 7.113 -3.867
51 HA ILE 6 HA ILE 6 1.790 7.131 -5.979
52 HB ILE 6 HB ILE 6 0.434 9.446 -4.568
53 HG12 ILE 6 HG12 ILE 6 -0.175 8.464 -7.351
54 HG13 ILE 6 HG13 ILE 6 -1.077 7.922 -5.942
55 HG21 ILE 6 HG21 ILE 6 1.266 10.803 -6.433
56 HG22 ILE 6 HG22 ILE 6 2.072 9.385 -7.103
57 HG23 ILE 6 HG23 ILE 6 2.589 10.039 -5.546
58 HD11 ILE 6 HD11 ILE 6 -2.206 9.727 -7.139
59 HD12 ILE 6 HD12 ILE 6 -0.813 10.774 -6.858
60 HD13 ILE 6 HD13 ILE 6 -1.780 10.194 -5.492
61 H ILE 7 H ILE 7 3.860 7.358 -5.509
62 HA ILE 7 HA ILE 7 4.758 7.495 -2.819
63 HB ILE 7 HB ILE 7 6.378 8.061 -5.331
64 HG12 ILE 7 HG12 ILE 7 5.306 5.809 -5.334
65 HG13 ILE 7 HG13 ILE 7 7.059 5.733 -5.246
66 HG21 ILE 7 HG21 ILE 7 7.385 8.885 -3.227
67 HG22 ILE 7 HG22 ILE 7 8.324 7.592 -3.977
68 HG23 ILE 7 HG23 ILE 7 7.309 7.247 -2.578
69 HD11 ILE 7 HD11 ILE 7 5.244 5.487 -2.858
70 HD12 ILE 7 HD12 ILE 7 6.981 5.175 -2.932
71 HD13 ILE 7 HD13 ILE 7 5.854 4.123 -3.787
72 H TYR 8 H TYR 8 4.290 9.131 -1.705
73 HA TYR 8 HA TYR 8 4.179 11.800 -2.773
74 HB2 TYR 8 HB2 TYR 8 2.617 10.727 -1.043
75 HB3 TYR 8 HB3 TYR 8 3.920 10.987 0.106
76 HD1 TYR 8 HD1 TYR 8 4.248 13.100 1.092
77 HD2 TYR 8 HD2 TYR 8 1.607 12.693 -2.210
78 HE1 TYR 8 HE1 TYR 8 3.423 15.369 1.483
79 HE2 TYR 8 HE2 TYR 8 0.770 14.967 -1.833
80 HH TYR 8 HH TYR 8 2.338 17.146 0.233
81 H GLU 9 H GLU 9 6.182 9.843 -0.632
82 HA GLU 9 HA GLU 9 8.419 11.583 -0.896
83 HB2 GLU 9 HB2 GLU 9 6.910 12.674 0.859
84 HB3 GLU 9 HB3 GLU 9 7.211 11.275 1.867
85 HG2 GLU 9 HG2 GLU 9 9.593 11.780 1.875
86 HG3 GLU 9 HG3 GLU 9 9.298 13.156 0.814
87 H ILE 10 H ILE 10 10.262 10.632 0.342
88 HA ILE 10 HA ILE 10 9.924 7.739 0.746
89 HB ILE 10 HB ILE 10 12.268 9.285 -0.383
90 HG12 ILE 10 HG12 ILE 10 10.387 8.851 -1.911
91 HG13 ILE 10 HG13 ILE 10 11.891 8.104 -2.451
92 HG21 ILE 10 HG21 ILE 10 12.112 6.346 0.270
93 HG22 ILE 10 HG22 ILE 10 13.174 7.544 1.009
94 HG23 ILE 10 HG23 ILE 10 13.396 7.093 -0.683
95 HD11 ILE 10 HD11 ILE 10 9.516 6.757 -1.169
96 HD12 ILE 10 HD12 ILE 10 11.047 5.952 -1.518
97 HD13 ILE 10 HD13 ILE 10 10.069 6.592 -2.837
98 H GLN 11 H GLN 11 10.756 6.932 2.642
99 HA GLN 11 HA GLN 11 12.344 8.752 4.285
100 HB2 GLN 11 HB2 GLN 11 9.887 7.335 4.931
101 HB3 GLN 11 HB3 GLN 11 11.202 6.829 5.981
102 HG2 GLN 11 HG2 GLN 11 10.395 8.579 7.188
103 HG3 GLN 11 HG3 GLN 11 11.585 9.419 6.205
104 HE21 GLN 11 HE21 GLN 11 10.818 10.595 4.365
105 HE22 GLN 11 HE22 GLN 11 9.232 11.261 4.396
106 H GLY 12 H GLY 12 14.038 7.771 3.004
107 HA2 GLY 12 HA2 GLY 12 15.813 6.378 2.778
108 HA3 GLY 12 HA3 GLY 12 15.404 5.728 4.360
109 H MET 13 H MET 13 14.421 3.808 4.495
110 HA MET 13 HA MET 13 14.163 2.270 2.007
111 HB2 MET 13 HB2 MET 13 14.372 1.303 4.865
112 HB3 MET 13 HB3 MET 13 14.248 0.267 3.455
113 HG2 MET 13 HG2 MET 13 16.489 2.232 3.663
114 HG3 MET 13 HG3 MET 13 16.555 0.724 4.557
115 HE1 MET 13 HE1 MET 13 16.982 1.297 0.013
116 HE2 MET 13 HE2 MET 13 16.705 2.552 1.222
117 HE3 MET 13 HE3 MET 13 15.371 1.541 0.661
118 H LYS 14 H LYS 14 12.240 4.086 3.719
119 HA LYS 14 HA LYS 14 9.928 2.318 3.337
120 HB2 LYS 14 HB2 LYS 14 10.038 4.678 5.218
121 HB3 LYS 14 HB3 LYS 14 8.825 3.406 5.142
122 HG2 LYS 14 HG2 LYS 14 10.641 1.798 5.821
123 HG3 LYS 14 HG3 LYS 14 11.643 3.210 6.142
124 HD2 LYS 14 HD2 LYS 14 9.977 4.015 7.740
125 HD3 LYS 14 HD3 LYS 14 8.993 2.575 7.432
126 HE2 LYS 14 HE2 LYS 14 10.901 1.181 8.145
127 HE3 LYS 14 HE3 LYS 14 11.782 2.661 8.533
128 HZ1 LYS 14 HZ1 LYS 14 10.861 1.852 10.511
129 HZ2 LYS 14 HZ2 LYS 14 9.344 1.599 9.866
130 HZ3 LYS 14 HZ3 LYS 14 9.921 3.181 10.095
131 H ALA 15 H ALA 15 8.044 3.433 2.555
132 HA ALA 15 HA ALA 15 8.641 5.999 1.270
133 HB1 ALA 15 HB1 ALA 15 7.467 5.280 -0.740
134 HB2 ALA 15 HB2 ALA 15 7.201 3.690 -0.029
135 HB3 ALA 15 HB3 ALA 15 8.838 4.223 -0.404
136 H VAL 16 H VAL 16 6.957 7.398 1.119
137 HA VAL 16 HA VAL 16 4.601 6.767 2.741
138 HB VAL 16 HB VAL 16 5.524 9.452 1.642
139 HG11 VAL 16 HG11 VAL 16 3.872 10.433 3.157
140 HG12 VAL 16 HG12 VAL 16 3.365 8.819 3.653
141 HG13 VAL 16 HG13 VAL 16 3.111 9.351 1.990
142 HG21 VAL 16 HG21 VAL 16 5.733 8.348 4.433
143 HG22 VAL 16 HG22 VAL 16 6.104 10.003 3.958
144 HG23 VAL 16 HG23 VAL 16 7.085 8.667 3.335
145 H VAL 17 H VAL 17 2.952 6.054 1.610
146 HA VAL 17 HA VAL 17 2.677 7.002 -1.141
147 HB VAL 17 HB VAL 17 1.132 5.052 -1.488
148 HG11 VAL 17 HG11 VAL 17 3.288 5.003 -2.431
149 HG12 VAL 17 HG12 VAL 17 2.963 3.413 -1.744
150 HG13 VAL 17 HG13 VAL 17 4.022 4.546 -0.893
151 HG21 VAL 17 HG21 VAL 17 2.237 4.201 1.197
152 HG22 VAL 17 HG22 VAL 17 1.528 3.087 0.039
153 HG23 VAL 17 HG23 VAL 17 0.553 4.393 0.708
154 H LEU 18 H LEU 18 1.079 8.157 -1.680
155 HA LEU 18 HA LEU 18 -1.141 8.564 0.153
156 HB2 LEU 18 HB2 LEU 18 -0.158 10.535 -0.811
157 HB3 LEU 18 HB3 LEU 18 -0.269 9.878 -2.426
158 HG LEU 18 HG LEU 18 -2.762 10.024 -2.239
159 HD11 LEU 18 HD11 LEU 18 -2.118 11.518 0.291
160 HD12 LEU 18 HD12 LEU 18 -2.961 9.969 0.183
161 HD13 LEU 18 HD13 LEU 18 -3.701 11.427 -0.474
162 HD21 LEU 18 HD21 LEU 18 -1.471 11.748 -3.370
163 HD22 LEU 18 HD22 LEU 18 -1.236 12.580 -1.830
164 HD23 LEU 18 HD23 LEU 18 -2.853 12.443 -2.519
165 H THR 19 H THR 19 -2.494 6.917 -0.008
166 HA THR 19 HA THR 19 -2.667 5.299 -2.329
167 HB THR 19 HB THR 19 -4.462 4.092 -1.135
168 HG1 THR 19 HG1 THR 19 -5.077 4.753 0.897
169 HG21 THR 19 HG21 THR 19 -3.107 3.366 0.803
170 HG22 THR 19 HG22 THR 19 -2.064 4.766 0.570
171 HG23 THR 19 HG23 THR 19 -2.138 3.509 -0.667
172 H SER 20 H SER 20 -4.845 4.735 -3.289
173 HA SER 20 HA SER 20 -6.017 6.938 -4.515
174 HB2 SER 20 HB2 SER 20 -7.731 5.081 -5.111
175 HB3 SER 20 HB3 SER 20 -6.059 4.912 -5.665
176 HG SER 20 HG SER 20 -6.610 3.010 -4.735
177 H GLU 21 H GLU 21 -6.502 5.581 -1.473
178 HA GLU 21 HA GLU 21 -9.217 6.447 -1.023
179 HB2 GLU 21 HB2 GLU 21 -7.146 5.620 0.999
180 HB3 GLU 21 HB3 GLU 21 -8.891 5.635 1.206
181 HG2 GLU 21 HG2 GLU 21 -9.172 3.754 -0.151
182 HG3 GLU 21 HG3 GLU 21 -7.564 3.928 -0.857
183 H GLY 22 H GLY 22 -6.127 7.938 -1.041
184 HA2 GLY 22 HA2 GLY 22 -5.659 10.163 -0.652
185 HA3 GLY 22 HA3 GLY 22 -7.224 10.333 0.139
186 H GLU 23 H GLU 23 -5.088 7.757 1.032
187 HA GLU 23 HA GLU 23 -4.645 9.083 3.608
188 HB2 GLU 23 HB2 GLU 23 -4.664 6.141 2.944
189 HB3 GLU 23 HB3 GLU 23 -4.453 6.828 4.542
190 HG2 GLU 23 HG2 GLU 23 -6.930 6.980 2.838
191 HG3 GLU 23 HG3 GLU 23 -6.689 5.950 4.246
192 H PHE 24 H PHE 24 -2.564 8.940 4.495
193 HA PHE 24 HA PHE 24 -0.489 8.274 2.543
194 HB2 PHE 24 HB2 PHE 24 -0.259 9.936 5.088
195 HB3 PHE 24 HB3 PHE 24 1.038 9.582 3.955
196 HD1 PHE 24 HD1 PHE 24 1.446 10.936 2.119
197 HD2 PHE 24 HD2 PHE 24 -2.241 11.297 4.214
198 HE1 PHE 24 HE1 PHE 24 0.900 12.937 0.821
199 HE2 PHE 24 HE2 PHE 24 -2.787 13.308 2.911
200 HZ PHE 24 HZ PHE 24 -1.204 14.129 1.209
201 H LEU 25 H LEU 25 0.305 6.382 2.781
202 HA LEU 25 HA LEU 25 0.376 5.114 5.446
203 HB2 LEU 25 HB2 LEU 25 -0.100 4.015 2.710
204 HB3 LEU 25 HB3 LEU 25 0.650 2.996 3.913
205 HG LEU 25 HG LEU 25 -1.389 3.340 5.356
206 HD11 LEU 25 HD11 LEU 25 -2.536 4.525 2.838
207 HD12 LEU 25 HD12 LEU 25 -2.194 5.413 4.320
208 HD13 LEU 25 HD13 LEU 25 -3.423 4.147 4.314
209 HD21 LEU 25 HD21 LEU 25 -1.524 2.055 2.666
210 HD22 LEU 25 HD22 LEU 25 -2.839 1.910 3.838
211 HD23 LEU 25 HD23 LEU 25 -1.225 1.308 4.237
212 H ILE 26 H ILE 26 2.188 3.799 5.912
213 HA ILE 26 HA ILE 26 4.611 4.644 4.502
214 HB ILE 26 HB ILE 26 4.325 3.357 7.241
215 HG12 ILE 26 HG12 ILE 26 3.401 5.641 7.225
216 HG13 ILE 26 HG13 ILE 26 4.864 5.544 8.199
217 HG21 ILE 26 HG21 ILE 26 6.684 3.931 7.563
218 HG22 ILE 26 HG22 ILE 26 6.747 4.585 5.928
219 HG23 ILE 26 HG23 ILE 26 6.460 2.863 6.177
220 HD11 ILE 26 HD11 ILE 26 6.126 6.542 6.331
221 HD12 ILE 26 HD12 ILE 26 4.838 7.589 6.924
222 HD13 ILE 26 HD13 ILE 26 4.618 6.692 5.421
223 H ILE 27 H ILE 27 5.381 3.194 3.152
224 HA ILE 27 HA ILE 27 4.852 0.348 3.709
225 HB ILE 27 HB ILE 27 4.798 -0.115 1.319
226 HG12 ILE 27 HG12 ILE 27 4.820 2.847 0.768
227 HG13 ILE 27 HG13 ILE 27 6.298 1.892 0.773
228 HG21 ILE 27 HG21 ILE 27 2.890 2.096 2.057
229 HG22 ILE 27 HG22 ILE 27 2.685 0.378 2.403
230 HG23 ILE 27 HG23 ILE 27 2.685 0.944 0.735
231 HD11 ILE 27 HD11 ILE 27 3.913 1.427 -1.000
232 HD12 ILE 27 HD12 ILE 27 5.409 0.492 -1.006
233 HD13 ILE 27 HD13 ILE 27 5.427 2.194 -1.474
234 H ARG 28 H ARG 28 6.382 -1.087 2.718
235 HA ARG 28 HA ARG 28 9.109 -0.462 3.134
236 HB2 ARG 28 HB2 ARG 28 7.969 -2.676 1.403
237 HB3 ARG 28 HB3 ARG 28 9.586 -2.614 2.081
238 HG2 ARG 28 HG2 ARG 28 8.620 -2.795 4.335
239 HG3 ARG 28 HG3 ARG 28 7.013 -2.891 3.618
240 HD2 ARG 28 HD2 ARG 28 7.731 -4.906 2.383
241 HD3 ARG 28 HD3 ARG 28 9.286 -4.816 3.208
242 HE ARG 28 HE ARG 28 7.301 -4.823 5.151
243 HH11 ARG 28 HH11 ARG 28 8.490 -7.018 2.679
244 HH12 ARG 28 HH12 ARG 28 8.093 -8.444 3.527
245 HH21 ARG 28 HH21 ARG 28 6.767 -6.741 6.348
246 HH22 ARG 28 HH22 ARG 28 7.077 -8.284 5.671
247 H ARG 29 H ARG 29 10.471 0.590 1.805
248 HA ARG 29 HA ARG 29 9.436 1.324 -0.781
249 HB2 ARG 29 HB2 ARG 29 10.626 3.005 0.644
250 HB3 ARG 29 HB3 ARG 29 12.108 2.078 0.399
251 HG2 ARG 29 HG2 ARG 29 11.307 2.353 -2.134
252 HG3 ARG 29 HG3 ARG 29 10.641 3.833 -1.454
253 HD2 ARG 29 HD2 ARG 29 12.848 4.458 -0.648
254 HD3 ARG 29 HD3 ARG 29 13.517 2.942 -1.266
255 HE ARG 29 HE ARG 29 12.344 3.995 -3.432
256 HH11 ARG 29 HH11 ARG 29 14.766 5.300 -1.196
257 HH12 ARG 29 HH12 ARG 29 15.425 6.374 -2.329
258 HH21 ARG 29 HH21 ARG 29 13.212 5.501 -4.976
259 HH22 ARG 29 HH22 ARG 29 14.522 6.486 -4.546
260 H ARG 30 H ARG 30 9.814 0.208 -2.492
261 HA ARG 30 HA ARG 30 12.055 -1.646 -2.532
262 HB2 ARG 30 HB2 ARG 30 9.980 -1.194 -4.691
263 HB3 ARG 30 HB3 ARG 30 11.034 -2.583 -4.495
264 HG2 ARG 30 HG2 ARG 30 9.793 -3.271 -2.509
265 HG3 ARG 30 HG3 ARG 30 8.768 -1.840 -2.653
266 HD2 ARG 30 HD2 ARG 30 8.038 -2.605 -4.867
267 HD3 ARG 30 HD3 ARG 30 9.031 -4.046 -4.679
268 HE ARG 30 HE ARG 30 7.084 -3.684 -2.571
269 HH11 ARG 30 HH11 ARG 30 7.664 -5.037 -5.788
270 HH12 ARG 30 HH12 ARG 30 6.367 -6.137 -5.695
271 HH21 ARG 30 HH21 ARG 30 5.344 -5.217 -2.443
272 HH22 ARG 30 HH22 ARG 30 5.010 -6.269 -3.710
273 H LYS 31 H LYS 31 13.360 -1.538 -4.623
274 HA LYS 31 HA LYS 31 14.316 1.134 -4.880
275 HB2 LYS 31 HB2 LYS 31 15.076 -1.368 -6.378
276 HB3 LYS 31 HB3 LYS 31 15.922 0.168 -6.521
277 HG2 LYS 31 HG2 LYS 31 16.348 0.050 -4.046
278 HG3 LYS 31 HG3 LYS 31 15.703 -1.588 -4.083
279 HD2 LYS 31 HD2 LYS 31 18.018 -0.644 -5.769
280 HD3 LYS 31 HD3 LYS 31 18.206 -1.436 -4.208
281 HE2 LYS 31 HE2 LYS 31 17.146 -3.436 -5.045
282 HE3 LYS 31 HE3 LYS 31 16.779 -2.653 -6.576
283 HZ1 LYS 31 HZ1 LYS 31 18.705 -4.060 -6.770
284 HZ2 LYS 31 HZ2 LYS 31 19.493 -3.251 -5.528
285 HZ3 LYS 31 HZ3 LYS 31 19.177 -2.458 -6.978
286 H ASP 32 H ASP 32 11.836 -0.429 -6.327
287 HA ASP 32 HA ASP 32 11.917 0.768 -8.948
288 HB2 ASP 32 HB2 ASP 32 9.616 -0.539 -7.482
289 HB3 ASP 32 HB3 ASP 32 9.614 -0.091 -9.179
290 H MET 33 H MET 33 10.995 1.737 -5.839
291 HA MET 33 HA MET 33 8.814 3.442 -6.460
292 HB2 MET 33 HB2 MET 33 10.477 2.935 -4.056
293 HB3 MET 33 HB3 MET 33 9.537 4.413 -4.104
294 HG2 MET 33 HG2 MET 33 8.307 2.746 -2.943
295 HG3 MET 33 HG3 MET 33 7.512 3.052 -4.487
296 HE1 MET 33 HE1 MET 33 6.779 -0.739 -3.951
297 HE2 MET 33 HE2 MET 33 6.083 0.838 -4.316
298 HE3 MET 33 HE3 MET 33 6.813 0.536 -2.736
299 H LYS 34 H LYS 34 8.995 5.156 -7.655
300 HA LYS 34 HA LYS 34 11.195 7.028 -7.265
301 HB2 LYS 34 HB2 LYS 34 9.280 6.549 -9.549
302 HB3 LYS 34 HB3 LYS 34 10.424 7.875 -9.468
303 HG2 LYS 34 HG2 LYS 34 12.280 6.382 -9.637
304 HG3 LYS 34 HG3 LYS 34 11.236 4.989 -9.384
305 HD2 LYS 34 HD2 LYS 34 11.865 5.217 -11.739
306 HD3 LYS 34 HD3 LYS 34 10.129 5.386 -11.512
307 HE2 LYS 34 HE2 LYS 34 10.910 7.042 -13.099
308 HE3 LYS 34 HE3 LYS 34 10.372 7.838 -11.627
309 HZ1 LYS 34 HZ1 LYS 34 13.215 7.189 -12.133
310 HZ2 LYS 34 HZ2 LYS 34 12.573 8.269 -10.989
311 HZ3 LYS 34 HZ3 LYS 34 12.513 8.640 -12.623
312 H VAL 35 H VAL 35 10.583 9.088 -6.665
313 HA VAL 35 HA VAL 35 8.111 9.400 -5.347
314 HB VAL 35 HB VAL 35 10.030 11.621 -6.121
315 HG11 VAL 35 HG11 VAL 35 7.790 12.368 -5.350
316 HG12 VAL 35 HG12 VAL 35 9.088 12.848 -4.259
317 HG13 VAL 35 HG13 VAL 35 8.049 11.492 -3.839
318 HG21 VAL 35 HG21 VAL 35 9.960 9.957 -3.615
319 HG22 VAL 35 HG22 VAL 35 11.055 11.306 -3.934
320 HG23 VAL 35 HG23 VAL 35 11.170 9.831 -4.888
321 H GLY 36 H GLY 36 6.200 10.046 -6.004
322 HA2 GLY 36 HA2 GLY 36 4.819 11.601 -7.107
323 HA3 GLY 36 HA3 GLY 36 6.000 11.705 -8.403
324 H GLN 37 H GLN 37 6.014 8.570 -8.150
325 HA GLN 37 HA GLN 37 3.819 8.373 -10.054
326 HB2 GLN 37 HB2 GLN 37 4.811 6.407 -10.953
327 HB3 GLN 37 HB3 GLN 37 6.103 7.566 -10.723
328 HG2 GLN 37 HG2 GLN 37 6.680 6.361 -8.598
329 HG3 GLN 37 HG3 GLN 37 5.492 5.138 -9.060
330 HE21 GLN 37 HE21 GLN 37 7.040 3.493 -9.268
331 HE22 GLN 37 HE22 GLN 37 8.184 3.493 -10.551
332 H GLN 38 H GLN 38 2.209 6.872 -10.009
333 HA GLN 38 HA GLN 38 1.468 5.906 -7.392
334 HB2 GLN 38 HB2 GLN 38 -0.177 6.887 -9.036
335 HB3 GLN 38 HB3 GLN 38 0.095 5.482 -10.058
336 HG2 GLN 38 HG2 GLN 38 -0.842 4.032 -8.378
337 HG3 GLN 38 HG3 GLN 38 -0.965 5.372 -7.240
338 HE21 GLN 38 HE21 GLN 38 -3.178 5.140 -7.018
339 HE22 GLN 38 HE22 GLN 38 -4.296 5.543 -8.267
340 H VAL 39 H VAL 39 1.992 4.029 -6.665
341 HA VAL 39 HA VAL 39 3.120 2.099 -8.548
342 HB VAL 39 HB VAL 39 4.437 1.225 -6.577
343 HG11 VAL 39 HG11 VAL 39 6.156 2.903 -6.694
344 HG12 VAL 39 HG12 VAL 39 4.988 4.105 -7.237
345 HG13 VAL 39 HG13 VAL 39 5.401 2.745 -8.283
346 HG21 VAL 39 HG21 VAL 39 4.626 2.447 -4.573
347 HG22 VAL 39 HG22 VAL 39 2.886 2.377 -4.897
348 HG23 VAL 39 HG23 VAL 39 3.793 3.841 -5.256
349 H SER 40 H SER 40 2.769 -0.095 -8.133
350 HA SER 40 HA SER 40 0.362 -0.631 -6.558
351 HB2 SER 40 HB2 SER 40 1.606 -2.497 -8.568
352 HB3 SER 40 HB3 SER 40 -0.080 -2.382 -8.052
353 HG SER 40 HG SER 40 0.700 -0.060 -9.071
354 H PHE 41 H PHE 41 0.848 -1.478 -4.630
355 HA PHE 41 HA PHE 41 3.180 -3.232 -4.401
356 HB2 PHE 41 HB2 PHE 41 3.428 -2.292 -2.063
357 HB3 PHE 41 HB3 PHE 41 3.917 -1.203 -3.347
358 HD1 PHE 41 HD1 PHE 41 2.407 0.696 -3.949
359 HD2 PHE 41 HD2 PHE 41 1.670 -1.764 -0.572
360 HE1 PHE 41 HE1 PHE 41 0.892 2.402 -3.050
361 HE2 PHE 41 HE2 PHE 41 0.150 -0.066 0.335
362 HZ PHE 41 HZ PHE 41 -0.247 2.018 -0.902
363 H GLU 42 H GLU 42 2.913 -4.426 -2.239
364 HA GLU 42 HA GLU 42 0.123 -5.205 -2.267
365 HB2 GLU 42 HB2 GLU 42 2.543 -6.792 -1.372
366 HB3 GLU 42 HB3 GLU 42 0.855 -7.241 -1.125
367 HG2 GLU 42 HG2 GLU 42 1.477 -8.469 -2.943
368 HG3 GLU 42 HG3 GLU 42 0.563 -7.112 -3.623
369 H ASN 43 H ASN 43 -0.670 -5.983 -0.190
370 HA ASN 43 HA ASN 43 -0.437 -3.886 1.734
371 HB2 ASN 43 HB2 ASN 43 -2.024 -6.419 1.579
372 HB3 ASN 43 HB3 ASN 43 -1.954 -5.554 3.110
373 HD21 ASN 43 HD21 ASN 43 -2.866 -5.297 -0.277
374 HD22 ASN 43 HD22 ASN 43 -4.034 -4.066 -0.039
375 H GLU 44 H GLU 44 1.188 -6.698 1.181
376 HA GLU 44 HA GLU 44 2.177 -7.324 3.762
377 HB2 GLU 44 HB2 GLU 44 3.475 -7.841 1.074
378 HB3 GLU 44 HB3 GLU 44 3.724 -8.742 2.568
379 HG2 GLU 44 HG2 GLU 44 1.514 -9.653 2.479
380 HG3 GLU 44 HG3 GLU 44 1.074 -8.584 1.156
381 H ASP 45 H ASP 45 3.020 -5.092 1.191
382 HA ASP 45 HA ASP 45 5.597 -4.298 2.150
383 HB2 ASP 45 HB2 ASP 45 3.656 -2.937 0.274
384 HB3 ASP 45 HB3 ASP 45 5.240 -2.288 0.671
385 H ILE 46 H ILE 46 2.384 -3.537 2.985
386 HA ILE 46 HA ILE 46 2.904 -0.898 3.876
387 HB ILE 46 HB ILE 46 0.548 -2.673 4.571
388 HG12 ILE 46 HG12 ILE 46 0.810 -0.533 2.446
389 HG13 ILE 46 HG13 ILE 46 0.857 -2.261 2.126
390 HG21 ILE 46 HG21 ILE 46 0.923 -0.778 6.103
391 HG22 ILE 46 HG22 ILE 46 -0.575 -0.603 5.179
392 HG23 ILE 46 HG23 ILE 46 0.857 0.334 4.736
393 HD11 ILE 46 HD11 ILE 46 -1.457 -2.416 3.007
394 HD12 ILE 46 HD12 ILE 46 -1.308 -1.378 1.592
395 HD13 ILE 46 HD13 ILE 46 -1.464 -0.662 3.193
396 H TYR 47 H TYR 47 3.965 -0.304 5.494
397 HA TYR 47 HA TYR 47 4.848 -2.114 7.514
398 HB2 TYR 47 HB2 TYR 47 5.379 0.691 6.772
399 HB3 TYR 47 HB3 TYR 47 5.687 0.268 8.462
400 HD1 TYR 47 HD1 TYR 47 6.751 -2.486 8.132
401 HD2 TYR 47 HD2 TYR 47 7.431 1.026 5.837
402 HE1 TYR 47 HE1 TYR 47 8.924 -3.370 7.430
403 HE2 TYR 47 HE2 TYR 47 9.604 0.147 5.138
404 HH TYR 47 HH TYR 47 11.217 -1.406 5.822
405 H ASN 48 H ASN 48 2.302 0.085 7.136
406 HA ASN 48 HA ASN 48 1.665 0.589 9.837
407 HB2 ASN 48 HB2 ASN 48 -0.070 0.511 7.366
408 HB3 ASN 48 HB3 ASN 48 -0.695 0.927 8.955
409 HD21 ASN 48 HD21 ASN 48 -0.102 2.834 9.874
410 HD22 ASN 48 HD22 ASN 48 0.588 4.130 8.964
411 H VAL 49 H VAL 49 1.148 -2.108 7.769
412 HA VAL 49 HA VAL 49 -0.718 -3.385 9.572
413 HB VAL 49 HB VAL 49 0.680 -4.584 7.152
414 HG11 VAL 49 HG11 VAL 49 -1.818 -5.490 8.586
415 HG12 VAL 49 HG12 VAL 49 -0.234 -6.228 8.765
416 HG13 VAL 49 HG13 VAL 49 -1.058 -6.281 7.204
417 HG21 VAL 49 HG21 VAL 49 -1.383 -4.136 5.917
418 HG22 VAL 49 HG22 VAL 49 -0.680 -2.638 6.531
419 HG23 VAL 49 HG23 VAL 49 -2.070 -3.354 7.340
420 H ARG 50 H ARG 50 2.537 -4.126 8.386
421 HA ARG 50 HA ARG 50 3.106 -5.293 11.003
422 HB2 ARG 50 HB2 ARG 50 3.527 -6.653 8.349
423 HB3 ARG 50 HB3 ARG 50 4.427 -7.117 9.780
424 HG2 ARG 50 HG2 ARG 50 2.285 -7.593 10.927
425 HG3 ARG 50 HG3 ARG 50 1.442 -7.229 9.424
426 HD2 ARG 50 HD2 ARG 50 1.695 -9.602 9.631
427 HD3 ARG 50 HD3 ARG 50 2.735 -9.038 8.322
428 HE ARG 50 HE ARG 50 4.431 -9.036 10.344
429 HH11 ARG 50 HH11 ARG 50 2.108 -11.539 9.387
430 HH12 ARG 50 HH12 ARG 50 3.049 -12.827 10.000
431 HH21 ARG 50 HH21 ARG 50 5.702 -10.807 11.180
432 HH22 ARG 50 HH22 ARG 50 5.118 -12.401 11.055
433 H GLY 51 H GLY 51 5.265 -5.242 11.626
434 HA2 GLY 51 HA2 GLY 51 7.547 -4.820 11.324
435 HA3 GLY 51 HA3 GLY 51 7.184 -4.011 9.807
436 H LYS 52 H LYS 52 5.818 -2.026 10.074
437 HA LYS 52 HA LYS 52 5.730 0.131 10.628
438 HB2 LYS 52 HB2 LYS 52 5.998 -0.987 13.430
439 HB3 LYS 52 HB3 LYS 52 5.799 0.728 13.132
440 HG2 LYS 52 HG2 LYS 52 3.653 -0.038 13.677
441 HG3 LYS 52 HG3 LYS 52 3.631 0.068 11.916
442 HD2 LYS 52 HD2 LYS 52 3.896 -2.298 11.706
443 HD3 LYS 52 HD3 LYS 52 4.219 -2.484 13.422
444 HE2 LYS 52 HE2 LYS 52 1.615 -1.522 12.228
445 HE3 LYS 52 HE3 LYS 52 1.921 -3.164 12.789
446 HZ1 LYS 52 HZ1 LYS 52 1.885 -0.699 14.444
447 HZ2 LYS 52 HZ2 LYS 52 2.345 -2.208 15.018
448 HZ3 LYS 52 HZ3 LYS 52 0.778 -1.959 14.487
Start of MODEL 8
1 H1 SER 0 H1 SER 0 -1.602 -12.448 -2.374
2 H2 SER 0 H2 SER 0 -0.206 -12.581 -3.365
3 H3 SER 0 H3 SER 0 -1.628 -11.926 -3.983
4 HA SER 0 HA SER 0 -0.108 -10.725 -1.791
5 HB2 SER 0 HB2 SER 0 -0.245 -9.797 -4.644
6 HB3 SER 0 HB3 SER 0 0.912 -9.353 -3.390
7 HG SER 0 HG SER 0 2.112 -10.869 -4.118
8 H MET 1 H MET 1 -0.989 -8.657 -1.202
9 HA MET 1 HA MET 1 -3.683 -8.169 -2.288
10 HB2 MET 1 HB2 MET 1 -3.591 -8.692 0.151
11 HB3 MET 1 HB3 MET 1 -2.509 -7.313 0.342
12 HG2 MET 1 HG2 MET 1 -4.752 -6.758 1.052
13 HG3 MET 1 HG3 MET 1 -4.284 -5.812 -0.358
14 HE1 MET 1 HE1 MET 1 -6.790 -5.124 -0.814
15 HE2 MET 1 HE2 MET 1 -7.210 -5.993 0.663
16 HE3 MET 1 HE3 MET 1 -8.123 -6.281 -0.819
17 H ASN 2 H ASN 2 -3.081 -6.877 -3.992
18 HA ASN 2 HA ASN 2 -1.208 -4.770 -3.509
19 HB2 ASN 2 HB2 ASN 2 -2.582 -5.665 -6.018
20 HB3 ASN 2 HB3 ASN 2 -1.702 -4.140 -5.943
21 HD21 ASN 2 HD21 ASN 2 0.557 -4.290 -5.211
22 HD22 ASN 2 HD22 ASN 2 1.499 -5.656 -5.619
23 H ARG 3 H ARG 3 -1.476 -2.831 -3.160
24 HA ARG 3 HA ARG 3 -4.112 -1.547 -3.300
25 HB2 ARG 3 HB2 ARG 3 -2.958 -2.004 -1.009
26 HB3 ARG 3 HB3 ARG 3 -1.789 -0.803 -1.527
27 HG2 ARG 3 HG2 ARG 3 -3.299 0.315 -0.122
28 HG3 ARG 3 HG3 ARG 3 -3.723 0.798 -1.764
29 HD2 ARG 3 HD2 ARG 3 -5.507 -0.827 -1.794
30 HD3 ARG 3 HD3 ARG 3 -5.063 -1.375 -0.184
31 HE ARG 3 HE ARG 3 -5.852 1.443 -0.557
32 HH11 ARG 3 HH11 ARG 3 -6.772 -1.706 0.780
33 HH12 ARG 3 HH12 ARG 3 -7.756 -1.048 1.996
34 HH21 ARG 3 HH21 ARG 3 -7.144 2.304 1.034
35 HH22 ARG 3 HH22 ARG 3 -7.982 1.338 2.185
36 H LEU 4 H LEU 4 -3.834 0.831 -3.858
37 HA LEU 4 HA LEU 4 -1.470 1.271 -5.586
38 HB2 LEU 4 HB2 LEU 4 -4.303 2.198 -6.018
39 HB3 LEU 4 HB3 LEU 4 -2.943 2.520 -7.072
40 HG LEU 4 HG LEU 4 -4.005 -0.244 -6.495
41 HD11 LEU 4 HD11 LEU 4 -4.574 1.571 -8.815
42 HD12 LEU 4 HD12 LEU 4 -5.726 1.016 -7.595
43 HD13 LEU 4 HD13 LEU 4 -5.015 -0.132 -8.726
44 HD21 LEU 4 HD21 LEU 4 -1.707 -0.244 -7.207
45 HD22 LEU 4 HD22 LEU 4 -2.084 0.812 -8.566
46 HD23 LEU 4 HD23 LEU 4 -2.724 -0.832 -8.521
47 H GLY 5 H GLY 5 -0.369 3.134 -5.282
48 HA2 GLY 5 HA2 GLY 5 -1.636 5.430 -4.110
49 HA3 GLY 5 HA3 GLY 5 -0.481 4.626 -3.049
50 H ILE 6 H ILE 6 -0.325 7.213 -3.998
51 HA ILE 6 HA ILE 6 1.770 7.166 -6.038
52 HB ILE 6 HB ILE 6 0.434 9.534 -4.713
53 HG12 ILE 6 HG12 ILE 6 -0.232 8.387 -7.427
54 HG13 ILE 6 HG13 ILE 6 -1.150 8.015 -5.974
55 HG21 ILE 6 HG21 ILE 6 1.287 10.788 -6.630
56 HG22 ILE 6 HG22 ILE 6 2.035 9.323 -7.270
57 HG23 ILE 6 HG23 ILE 6 2.605 10.011 -5.750
58 HD11 ILE 6 HD11 ILE 6 -2.223 9.746 -7.269
59 HD12 ILE 6 HD12 ILE 6 -0.748 10.720 -7.188
60 HD13 ILE 6 HD13 ILE 6 -1.673 10.385 -5.716
61 H ILE 7 H ILE 7 3.817 7.448 -5.477
62 HA ILE 7 HA ILE 7 4.530 7.497 -2.732
63 HB ILE 7 HB ILE 7 6.283 8.031 -5.131
64 HG12 ILE 7 HG12 ILE 7 5.202 5.826 -5.251
65 HG13 ILE 7 HG13 ILE 7 6.924 5.689 -4.968
66 HG21 ILE 7 HG21 ILE 7 8.132 7.402 -3.622
67 HG22 ILE 7 HG22 ILE 7 6.982 7.229 -2.296
68 HG23 ILE 7 HG23 ILE 7 7.266 8.815 -3.009
69 HD11 ILE 7 HD11 ILE 7 4.825 5.471 -2.824
70 HD12 ILE 7 HD12 ILE 7 6.561 5.241 -2.634
71 HD13 ILE 7 HD13 ILE 7 5.630 4.113 -3.608
72 H TYR 8 H TYR 8 4.268 9.047 -1.547
73 HA TYR 8 HA TYR 8 4.189 11.791 -2.435
74 HB2 TYR 8 HB2 TYR 8 2.629 10.656 -0.751
75 HB3 TYR 8 HB3 TYR 8 3.967 10.755 0.383
76 HD1 TYR 8 HD1 TYR 8 4.396 12.751 1.554
77 HD2 TYR 8 HD2 TYR 8 1.720 12.753 -1.743
78 HE1 TYR 8 HE1 TYR 8 3.707 15.037 2.130
79 HE2 TYR 8 HE2 TYR 8 1.018 15.043 -1.186
80 HH TYR 8 HH TYR 8 1.035 16.564 0.485
81 H GLU 9 H GLU 9 6.194 9.648 -0.501
82 HA GLU 9 HA GLU 9 8.450 11.402 -0.708
83 HB2 GLU 9 HB2 GLU 9 7.176 12.383 1.199
84 HB3 GLU 9 HB3 GLU 9 7.266 10.842 2.031
85 HG2 GLU 9 HG2 GLU 9 8.932 12.390 2.910
86 HG3 GLU 9 HG3 GLU 9 9.694 11.029 2.116
87 H ILE 10 H ILE 10 10.349 10.383 0.335
88 HA ILE 10 HA ILE 10 10.139 7.460 0.630
89 HB ILE 10 HB ILE 10 12.199 9.037 -0.941
90 HG12 ILE 10 HG12 ILE 10 10.001 8.343 -1.879
91 HG13 ILE 10 HG13 ILE 10 11.419 7.918 -2.862
92 HG21 ILE 10 HG21 ILE 10 12.328 6.128 -0.144
93 HG22 ILE 10 HG22 ILE 10 13.439 7.408 0.345
94 HG23 ILE 10 HG23 ILE 10 13.374 6.890 -1.341
95 HD11 ILE 10 HD11 ILE 10 9.780 6.114 -2.851
96 HD12 ILE 10 HD12 ILE 10 9.765 6.113 -1.088
97 HD13 ILE 10 HD13 ILE 10 11.213 5.608 -1.956
98 H GLN 11 H GLN 11 11.206 6.712 2.358
99 HA GLN 11 HA GLN 11 13.047 8.501 3.741
100 HB2 GLN 11 HB2 GLN 11 10.634 7.155 4.964
101 HB3 GLN 11 HB3 GLN 11 11.912 7.910 5.908
102 HG2 GLN 11 HG2 GLN 11 11.355 10.056 5.154
103 HG3 GLN 11 HG3 GLN 11 10.449 9.415 3.791
104 HE21 GLN 11 HE21 GLN 11 8.621 10.489 4.211
105 HE22 GLN 11 HE22 GLN 11 7.617 10.177 5.594
106 H GLY 12 H GLY 12 14.646 7.184 2.979
107 HA2 GLY 12 HA2 GLY 12 16.174 5.504 3.146
108 HA3 GLY 12 HA3 GLY 12 15.311 4.944 4.579
109 H MET 13 H MET 13 14.527 2.997 4.401
110 HA MET 13 HA MET 13 13.977 1.930 1.750
111 HB2 MET 13 HB2 MET 13 14.291 0.578 4.425
112 HB3 MET 13 HB3 MET 13 13.705 -0.268 3.004
113 HG2 MET 13 HG2 MET 13 16.320 1.180 2.924
114 HG3 MET 13 HG3 MET 13 16.208 -0.406 3.668
115 HE1 MET 13 HE1 MET 13 16.181 1.745 0.591
116 HE2 MET 13 HE2 MET 13 14.631 1.073 0.063
117 HE3 MET 13 HE3 MET 13 16.113 0.641 -0.777
118 H LYS 14 H LYS 14 12.262 3.755 3.617
119 HA LYS 14 HA LYS 14 9.812 2.207 3.193
120 HB2 LYS 14 HB2 LYS 14 10.281 4.428 5.186
121 HB3 LYS 14 HB3 LYS 14 8.757 3.613 4.908
122 HG2 LYS 14 HG2 LYS 14 9.919 1.476 5.574
123 HG3 LYS 14 HG3 LYS 14 11.253 2.500 6.115
124 HD2 LYS 14 HD2 LYS 14 9.560 3.763 7.500
125 HD3 LYS 14 HD3 LYS 14 8.420 2.476 7.121
126 HE2 LYS 14 HE2 LYS 14 9.353 1.934 9.218
127 HE3 LYS 14 HE3 LYS 14 10.115 0.871 8.038
128 HZ1 LYS 14 HZ1 LYS 14 12.023 2.359 8.001
129 HZ2 LYS 14 HZ2 LYS 14 11.748 1.760 9.552
130 HZ3 LYS 14 HZ3 LYS 14 11.311 3.342 9.166
131 H ALA 15 H ALA 15 7.978 3.496 2.615
132 HA ALA 15 HA ALA 15 8.615 6.006 1.306
133 HB1 ALA 15 HB1 ALA 15 7.504 5.329 -0.708
134 HB2 ALA 15 HB2 ALA 15 7.143 3.745 -0.026
135 HB3 ALA 15 HB3 ALA 15 8.812 4.193 -0.375
136 H VAL 16 H VAL 16 6.825 7.243 1.002
137 HA VAL 16 HA VAL 16 4.500 6.522 2.672
138 HB VAL 16 HB VAL 16 5.374 9.265 1.707
139 HG11 VAL 16 HG11 VAL 16 2.901 8.940 1.998
140 HG12 VAL 16 HG12 VAL 16 3.610 10.186 3.016
141 HG13 VAL 16 HG13 VAL 16 3.207 8.610 3.707
142 HG21 VAL 16 HG21 VAL 16 5.431 8.100 4.475
143 HG22 VAL 16 HG22 VAL 16 5.925 9.724 3.998
144 HG23 VAL 16 HG23 VAL 16 6.843 8.321 3.435
145 H VAL 17 H VAL 17 2.764 5.968 1.591
146 HA VAL 17 HA VAL 17 2.530 6.918 -1.164
147 HB VAL 17 HB VAL 17 0.800 5.041 -1.386
148 HG11 VAL 17 HG11 VAL 17 2.947 5.003 -2.504
149 HG12 VAL 17 HG12 VAL 17 2.519 3.396 -1.923
150 HG13 VAL 17 HG13 VAL 17 3.704 4.364 -1.047
151 HG21 VAL 17 HG21 VAL 17 0.576 4.491 0.962
152 HG22 VAL 17 HG22 VAL 17 2.282 4.047 1.039
153 HG23 VAL 17 HG23 VAL 17 1.165 3.093 0.061
154 H LEU 18 H LEU 18 1.000 8.198 -1.654
155 HA LEU 18 HA LEU 18 -1.231 8.593 0.171
156 HB2 LEU 18 HB2 LEU 18 -0.124 10.590 -0.685
157 HB3 LEU 18 HB3 LEU 18 -0.294 10.033 -2.332
158 HG LEU 18 HG LEU 18 -2.774 10.262 -2.086
159 HD11 LEU 18 HD11 LEU 18 -3.635 11.586 -0.225
160 HD12 LEU 18 HD12 LEU 18 -2.037 11.574 0.521
161 HD13 LEU 18 HD13 LEU 18 -2.932 10.066 0.324
162 HD21 LEU 18 HD21 LEU 18 -2.790 12.701 -2.237
163 HD22 LEU 18 HD22 LEU 18 -1.443 12.013 -3.145
164 HD23 LEU 18 HD23 LEU 18 -1.158 12.758 -1.574
165 H THR 19 H THR 19 -2.626 6.997 -0.139
166 HA THR 19 HA THR 19 -2.687 5.489 -2.542
167 HB THR 19 HB THR 19 -4.507 4.216 -1.536
168 HG1 THR 19 HG1 THR 19 -5.507 4.798 0.212
169 HG21 THR 19 HG21 THR 19 -2.215 3.700 -0.884
170 HG22 THR 19 HG22 THR 19 -3.323 3.412 0.458
171 HG23 THR 19 HG23 THR 19 -2.315 4.864 0.437
172 H SER 20 H SER 20 -4.890 4.931 -3.566
173 HA SER 20 HA SER 20 -5.912 7.201 -4.791
174 HB2 SER 20 HB2 SER 20 -7.670 5.423 -5.546
175 HB3 SER 20 HB3 SER 20 -5.985 5.257 -6.051
176 HG SER 20 HG SER 20 -7.207 3.928 -3.826
177 H GLU 21 H GLU 21 -6.608 5.810 -1.816
178 HA GLU 21 HA GLU 21 -9.287 6.823 -1.552
179 HB2 GLU 21 HB2 GLU 21 -7.438 5.620 0.486
180 HB3 GLU 21 HB3 GLU 21 -9.136 6.002 0.745
181 HG2 GLU 21 HG2 GLU 21 -9.246 3.786 0.290
182 HG3 GLU 21 HG3 GLU 21 -9.519 4.471 -1.299
183 H GLY 22 H GLY 22 -6.197 8.147 -1.404
184 HA2 GLY 22 HA2 GLY 22 -5.573 10.282 -0.830
185 HA3 GLY 22 HA3 GLY 22 -7.178 10.542 -0.155
186 H GLU 23 H GLU 23 -5.134 7.854 0.733
187 HA GLU 23 HA GLU 23 -4.855 9.044 3.393
188 HB2 GLU 23 HB2 GLU 23 -5.206 6.178 2.519
189 HB3 GLU 23 HB3 GLU 23 -4.702 6.634 4.142
190 HG2 GLU 23 HG2 GLU 23 -7.282 7.468 2.839
191 HG3 GLU 23 HG3 GLU 23 -7.100 6.139 3.989
192 H PHE 24 H PHE 24 -2.834 8.823 4.401
193 HA PHE 24 HA PHE 24 -0.657 8.179 2.548
194 HB2 PHE 24 HB2 PHE 24 -0.493 9.657 5.199
195 HB3 PHE 24 HB3 PHE 24 0.820 9.378 4.067
196 HD1 PHE 24 HD1 PHE 24 1.218 10.819 2.308
197 HD2 PHE 24 HD2 PHE 24 -2.365 11.155 4.554
198 HE1 PHE 24 HE1 PHE 24 0.748 12.995 1.240
199 HE2 PHE 24 HE2 PHE 24 -2.843 13.312 3.500
200 HZ PHE 24 HZ PHE 24 -1.289 14.240 1.842
201 H LEU 25 H LEU 25 0.091 6.247 2.773
202 HA LEU 25 HA LEU 25 0.137 5.028 5.449
203 HB2 LEU 25 HB2 LEU 25 -0.308 3.770 2.756
204 HB3 LEU 25 HB3 LEU 25 0.311 2.823 4.087
205 HG LEU 25 HG LEU 25 -1.795 3.537 5.371
206 HD11 LEU 25 HD11 LEU 25 -3.728 4.145 4.031
207 HD12 LEU 25 HD12 LEU 25 -2.715 4.242 2.593
208 HD13 LEU 25 HD13 LEU 25 -2.468 5.374 3.923
209 HD21 LEU 25 HD21 LEU 25 -2.001 1.775 2.937
210 HD22 LEU 25 HD22 LEU 25 -3.165 1.813 4.260
211 HD23 LEU 25 HD23 LEU 25 -1.507 1.296 4.563
212 H ILE 26 H ILE 26 1.986 4.017 6.130
213 HA ILE 26 HA ILE 26 4.418 4.728 4.687
214 HB ILE 26 HB ILE 26 4.206 3.285 7.349
215 HG12 ILE 26 HG12 ILE 26 3.066 5.459 7.575
216 HG13 ILE 26 HG13 ILE 26 4.577 5.450 8.471
217 HG21 ILE 26 HG21 ILE 26 6.359 3.059 6.267
218 HG22 ILE 26 HG22 ILE 26 6.499 4.069 7.702
219 HG23 ILE 26 HG23 ILE 26 6.483 4.812 6.104
220 HD11 ILE 26 HD11 ILE 26 5.636 6.709 6.634
221 HD12 ILE 26 HD12 ILE 26 4.275 7.568 7.356
222 HD13 ILE 26 HD13 ILE 26 4.080 6.762 5.802
223 H ILE 27 H ILE 27 5.231 3.304 3.319
224 HA ILE 27 HA ILE 27 4.745 0.485 3.866
225 HB ILE 27 HB ILE 27 4.529 0.018 1.478
226 HG12 ILE 27 HG12 ILE 27 4.316 2.945 0.868
227 HG13 ILE 27 HG13 ILE 27 5.894 2.182 0.858
228 HG21 ILE 27 HG21 ILE 27 2.612 2.214 2.228
229 HG22 ILE 27 HG22 ILE 27 2.519 0.571 2.829
230 HG23 ILE 27 HG23 ILE 27 2.327 0.886 1.100
231 HD11 ILE 27 HD11 ILE 27 3.520 1.428 -0.827
232 HD12 ILE 27 HD12 ILE 27 5.061 0.576 -0.816
233 HD13 ILE 27 HD13 ILE 27 4.981 2.250 -1.366
234 H ARG 28 H ARG 28 6.259 -0.826 2.609
235 HA ARG 28 HA ARG 28 8.942 0.131 2.988
236 HB2 ARG 28 HB2 ARG 28 8.190 -2.156 3.571
237 HB3 ARG 28 HB3 ARG 28 7.923 -2.475 1.868
238 HG2 ARG 28 HG2 ARG 28 10.286 -2.143 1.436
239 HG3 ARG 28 HG3 ARG 28 10.562 -1.804 3.140
240 HD2 ARG 28 HD2 ARG 28 11.056 -4.183 2.407
241 HD3 ARG 28 HD3 ARG 28 9.995 -3.990 3.804
242 HE ARG 28 HE ARG 28 8.546 -4.197 1.333
243 HH11 ARG 28 HH11 ARG 28 10.148 -6.150 3.806
244 HH12 ARG 28 HH12 ARG 28 9.159 -7.519 3.527
245 HH21 ARG 28 HH21 ARG 28 7.238 -5.944 1.017
246 HH22 ARG 28 HH22 ARG 28 7.420 -7.418 1.886
247 H ARG 29 H ARG 29 10.274 0.819 1.451
248 HA ARG 29 HA ARG 29 9.230 1.468 -1.156
249 HB2 ARG 29 HB2 ARG 29 10.727 2.993 0.045
250 HB3 ARG 29 HB3 ARG 29 12.019 1.793 -0.020
251 HG2 ARG 29 HG2 ARG 29 11.600 1.917 -2.587
252 HG3 ARG 29 HG3 ARG 29 10.848 3.462 -2.199
253 HD2 ARG 29 HD2 ARG 29 12.972 4.074 -1.008
254 HD3 ARG 29 HD3 ARG 29 13.683 2.602 -1.672
255 HE ARG 29 HE ARG 29 12.625 3.903 -3.827
256 HH11 ARG 29 HH11 ARG 29 15.111 4.622 -1.401
257 HH12 ARG 29 HH12 ARG 29 15.875 5.806 -2.364
258 HH21 ARG 29 HH21 ARG 29 13.716 5.470 -5.150
259 HH22 ARG 29 HH22 ARG 29 15.077 6.288 -4.549
260 H ARG 30 H ARG 30 9.505 0.518 -2.964
261 HA ARG 30 HA ARG 30 11.137 -1.908 -3.056
262 HB2 ARG 30 HB2 ARG 30 8.665 -1.031 -4.419
263 HB3 ARG 30 HB3 ARG 30 9.807 -1.894 -5.431
264 HG2 ARG 30 HG2 ARG 30 8.011 -3.305 -4.386
265 HG3 ARG 30 HG3 ARG 30 9.656 -3.846 -4.091
266 HD2 ARG 30 HD2 ARG 30 8.265 -2.093 -2.093
267 HD3 ARG 30 HD3 ARG 30 7.940 -3.826 -2.125
268 HE ARG 30 HE ARG 30 10.494 -2.520 -1.503
269 HH11 ARG 30 HH11 ARG 30 8.475 -5.407 -1.374
270 HH12 ARG 30 HH12 ARG 30 9.672 -6.405 -0.689
271 HH21 ARG 30 HH21 ARG 30 12.158 -3.865 -0.562
272 HH22 ARG 30 HH22 ARG 30 11.826 -5.493 -0.202
273 H LYS 31 H LYS 31 12.004 -2.193 -5.476
274 HA LYS 31 HA LYS 31 14.051 -0.250 -5.529
275 HB2 LYS 31 HB2 LYS 31 13.467 -2.552 -7.369
276 HB3 LYS 31 HB3 LYS 31 14.894 -1.533 -7.493
277 HG2 LYS 31 HG2 LYS 31 15.762 -2.275 -5.473
278 HG3 LYS 31 HG3 LYS 31 14.208 -2.896 -4.926
279 HD2 LYS 31 HD2 LYS 31 15.616 -4.748 -5.503
280 HD3 LYS 31 HD3 LYS 31 14.337 -4.622 -6.708
281 HE2 LYS 31 HE2 LYS 31 15.819 -3.608 -8.278
282 HE3 LYS 31 HE3 LYS 31 17.095 -3.466 -7.070
283 HZ1 LYS 31 HZ1 LYS 31 17.543 -5.701 -7.166
284 HZ2 LYS 31 HZ2 LYS 31 17.141 -5.383 -8.772
285 HZ3 LYS 31 HZ3 LYS 31 16.016 -6.113 -7.750
286 H ASP 32 H ASP 32 11.176 -0.648 -7.491
287 HA ASP 32 HA ASP 32 12.147 1.305 -9.445
288 HB2 ASP 32 HB2 ASP 32 10.738 -0.683 -10.143
289 HB3 ASP 32 HB3 ASP 32 9.398 0.061 -9.276
290 H MET 33 H MET 33 10.746 1.377 -6.502
291 HA MET 33 HA MET 33 8.680 3.266 -6.743
292 HB2 MET 33 HB2 MET 33 9.046 1.536 -5.007
293 HB3 MET 33 HB3 MET 33 10.367 2.502 -4.395
294 HG2 MET 33 HG2 MET 33 8.991 4.139 -3.614
295 HG3 MET 33 HG3 MET 33 7.629 3.642 -4.632
296 HE1 MET 33 HE1 MET 33 6.306 0.457 -2.849
297 HE2 MET 33 HE2 MET 33 7.439 0.478 -4.195
298 HE3 MET 33 HE3 MET 33 6.095 1.606 -4.169
299 H LYS 34 H LYS 34 9.115 5.226 -7.572
300 HA LYS 34 HA LYS 34 11.278 6.891 -6.505
301 HB2 LYS 34 HB2 LYS 34 9.622 7.277 -8.986
302 HB3 LYS 34 HB3 LYS 34 11.088 8.103 -8.525
303 HG2 LYS 34 HG2 LYS 34 12.409 6.192 -9.032
304 HG3 LYS 34 HG3 LYS 34 10.971 5.182 -9.225
305 HD2 LYS 34 HD2 LYS 34 10.353 7.002 -11.032
306 HD3 LYS 34 HD3 LYS 34 12.094 7.269 -11.040
307 HE2 LYS 34 HE2 LYS 34 11.422 5.673 -12.762
308 HE3 LYS 34 HE3 LYS 34 12.460 4.902 -11.565
309 HZ1 LYS 34 HZ1 LYS 34 9.496 4.756 -11.561
310 HZ2 LYS 34 HZ2 LYS 34 10.541 3.888 -10.563
311 HZ3 LYS 34 HZ3 LYS 34 10.492 3.557 -12.210
312 H VAL 35 H VAL 35 10.545 9.075 -6.016
313 HA VAL 35 HA VAL 35 7.889 9.254 -5.012
314 HB VAL 35 HB VAL 35 9.813 11.546 -5.512
315 HG11 VAL 35 HG11 VAL 35 7.529 12.292 -5.123
316 HG12 VAL 35 HG12 VAL 35 8.559 12.679 -3.740
317 HG13 VAL 35 HG13 VAL 35 7.450 11.317 -3.652
318 HG21 VAL 35 HG21 VAL 35 10.650 11.286 -3.342
319 HG22 VAL 35 HG22 VAL 35 10.644 9.655 -4.032
320 HG23 VAL 35 HG23 VAL 35 9.382 10.148 -2.908
321 H GLY 36 H GLY 36 6.080 10.208 -5.859
322 HA2 GLY 36 HA2 GLY 36 5.020 11.794 -7.236
323 HA3 GLY 36 HA3 GLY 36 6.351 11.682 -8.370
324 H GLN 37 H GLN 37 6.161 8.667 -8.129
325 HA GLN 37 HA GLN 37 4.070 8.482 -10.155
326 HB2 GLN 37 HB2 GLN 37 5.113 6.485 -10.952
327 HB3 GLN 37 HB3 GLN 37 6.399 7.645 -10.676
328 HG2 GLN 37 HG2 GLN 37 6.897 6.524 -8.526
329 HG3 GLN 37 HG3 GLN 37 5.647 5.339 -8.890
330 HE21 GLN 37 HE21 GLN 37 6.995 3.602 -8.962
331 HE22 GLN 37 HE22 GLN 37 8.172 3.313 -10.170
332 H GLN 38 H GLN 38 2.545 6.799 -10.185
333 HA GLN 38 HA GLN 38 1.684 5.999 -7.537
334 HB2 GLN 38 HB2 GLN 38 0.103 6.891 -9.316
335 HB3 GLN 38 HB3 GLN 38 0.358 5.376 -10.182
336 HG2 GLN 38 HG2 GLN 38 -0.435 4.216 -8.093
337 HG3 GLN 38 HG3 GLN 38 -0.908 5.804 -7.492
338 HE21 GLN 38 HE21 GLN 38 -2.528 6.938 -8.628
339 HE22 GLN 38 HE22 GLN 38 -3.673 6.114 -9.617
340 H VAL 39 H VAL 39 1.912 4.036 -6.779
341 HA VAL 39 HA VAL 39 3.157 2.090 -8.561
342 HB VAL 39 HB VAL 39 4.352 1.211 -6.542
343 HG11 VAL 39 HG11 VAL 39 6.096 2.906 -6.525
344 HG12 VAL 39 HG12 VAL 39 4.979 4.073 -7.234
345 HG13 VAL 39 HG13 VAL 39 5.487 2.663 -8.164
346 HG21 VAL 39 HG21 VAL 39 4.568 2.725 -4.582
347 HG22 VAL 39 HG22 VAL 39 2.932 2.121 -4.809
348 HG23 VAL 39 HG23 VAL 39 3.337 3.763 -5.297
349 H SER 40 H SER 40 2.677 -0.060 -8.174
350 HA SER 40 HA SER 40 0.276 -0.556 -6.627
351 HB2 SER 40 HB2 SER 40 1.798 -2.456 -8.428
352 HB3 SER 40 HB3 SER 40 0.118 -2.577 -7.906
353 HG SER 40 HG SER 40 -0.178 -1.726 -9.807
354 H PHE 41 H PHE 41 0.670 -1.167 -4.596
355 HA PHE 41 HA PHE 41 3.135 -2.664 -4.090
356 HB2 PHE 41 HB2 PHE 41 3.241 -1.615 -1.847
357 HB3 PHE 41 HB3 PHE 41 3.493 -0.472 -3.147
358 HD1 PHE 41 HD1 PHE 41 1.600 1.099 -3.741
359 HD2 PHE 41 HD2 PHE 41 1.504 -1.373 -0.290
360 HE1 PHE 41 HE1 PHE 41 -0.156 2.512 -2.781
361 HE2 PHE 41 HE2 PHE 41 -0.262 0.039 0.670
362 HZ PHE 41 HZ PHE 41 -1.092 1.976 -0.571
363 H GLU 42 H GLU 42 2.952 -3.786 -1.968
364 HA GLU 42 HA GLU 42 0.321 -5.063 -1.990
365 HB2 GLU 42 HB2 GLU 42 3.013 -6.124 -1.178
366 HB3 GLU 42 HB3 GLU 42 1.504 -6.977 -0.945
367 HG2 GLU 42 HG2 GLU 42 2.105 -7.931 -2.874
368 HG3 GLU 42 HG3 GLU 42 1.260 -6.534 -3.548
369 H ASN 43 H ASN 43 -0.273 -6.064 0.133
370 HA ASN 43 HA ASN 43 -0.170 -3.967 2.139
371 HB2 ASN 43 HB2 ASN 43 -1.721 -6.541 1.961
372 HB3 ASN 43 HB3 ASN 43 -1.535 -5.744 3.508
373 HD21 ASN 43 HD21 ASN 43 -2.019 -4.369 0.264
374 HD22 ASN 43 HD22 ASN 43 -3.473 -3.526 0.697
375 H GLU 44 H GLU 44 1.206 -6.938 1.417
376 HA GLU 44 HA GLU 44 2.493 -7.606 3.772
377 HB2 GLU 44 HB2 GLU 44 3.493 -7.959 0.958
378 HB3 GLU 44 HB3 GLU 44 3.909 -8.935 2.364
379 HG2 GLU 44 HG2 GLU 44 2.367 -10.306 1.503
380 HG3 GLU 44 HG3 GLU 44 1.268 -9.271 2.392
381 H ASP 45 H ASP 45 2.994 -5.013 1.546
382 HA ASP 45 HA ASP 45 5.724 -4.433 2.448
383 HB2 ASP 45 HB2 ASP 45 3.985 -3.237 0.297
384 HB3 ASP 45 HB3 ASP 45 5.461 -2.452 0.836
385 H ILE 46 H ILE 46 2.558 -3.688 3.297
386 HA ILE 46 HA ILE 46 3.086 -0.929 3.954
387 HB ILE 46 HB ILE 46 0.662 -2.574 4.744
388 HG12 ILE 46 HG12 ILE 46 0.960 -0.648 2.434
389 HG13 ILE 46 HG13 ILE 46 0.985 -2.393 2.266
390 HG21 ILE 46 HG21 ILE 46 -0.406 -0.373 5.024
391 HG22 ILE 46 HG22 ILE 46 1.147 0.414 4.703
392 HG23 ILE 46 HG23 ILE 46 0.946 -0.610 6.129
393 HD11 ILE 46 HD11 ILE 46 -1.333 -2.411 3.237
394 HD12 ILE 46 HD12 ILE 46 -1.187 -1.613 1.675
395 HD13 ILE 46 HD13 ILE 46 -1.306 -0.651 3.150
396 H TYR 47 H TYR 47 4.092 -0.294 5.623
397 HA TYR 47 HA TYR 47 4.803 -2.073 7.748
398 HB2 TYR 47 HB2 TYR 47 5.511 0.639 6.851
399 HB3 TYR 47 HB3 TYR 47 5.735 0.328 8.580
400 HD1 TYR 47 HD1 TYR 47 6.922 -2.117 8.936
401 HD2 TYR 47 HD2 TYR 47 7.336 0.393 5.528
402 HE1 TYR 47 HE1 TYR 47 9.070 -3.191 8.408
403 HE2 TYR 47 HE2 TYR 47 9.456 -0.651 4.999
404 HH TYR 47 HH TYR 47 10.469 -3.553 6.372
405 H ASN 48 H ASN 48 2.313 0.075 7.135
406 HA ASN 48 HA ASN 48 1.630 0.570 9.906
407 HB2 ASN 48 HB2 ASN 48 0.220 1.254 7.322
408 HB3 ASN 48 HB3 ASN 48 -0.526 1.527 8.886
409 HD21 ASN 48 HD21 ASN 48 2.080 2.261 10.110
410 HD22 ASN 48 HD22 ASN 48 2.407 3.853 9.566
411 H VAL 49 H VAL 49 1.226 -2.015 7.807
412 HA VAL 49 HA VAL 49 -1.133 -2.919 9.252
413 HB VAL 49 HB VAL 49 0.132 -4.061 6.717
414 HG11 VAL 49 HG11 VAL 49 -2.355 -4.944 8.196
415 HG12 VAL 49 HG12 VAL 49 -0.841 -5.837 8.097
416 HG13 VAL 49 HG13 VAL 49 -1.807 -5.575 6.643
417 HG21 VAL 49 HG21 VAL 49 -2.522 -2.684 7.133
418 HG22 VAL 49 HG22 VAL 49 -1.914 -3.328 5.607
419 HG23 VAL 49 HG23 VAL 49 -1.106 -1.961 6.374
420 H ARG 50 H ARG 50 -0.469 -3.717 11.069
421 HA ARG 50 HA ARG 50 1.985 -5.290 11.122
422 HB2 ARG 50 HB2 ARG 50 1.706 -3.345 12.670
423 HB3 ARG 50 HB3 ARG 50 0.417 -4.222 13.472
424 HG2 ARG 50 HG2 ARG 50 2.521 -4.390 14.702
425 HG3 ARG 50 HG3 ARG 50 1.995 -5.967 14.122
426 HD2 ARG 50 HD2 ARG 50 4.420 -5.583 13.813
427 HD3 ARG 50 HD3 ARG 50 3.579 -5.879 12.297
428 HE ARG 50 HE ARG 50 3.810 -3.095 12.939
429 HH11 ARG 50 HH11 ARG 50 5.518 -5.817 11.413
430 HH12 ARG 50 HH12 ARG 50 6.518 -4.830 10.475
431 HH21 ARG 50 HH21 ARG 50 5.149 -1.772 11.677
432 HH22 ARG 50 HH22 ARG 50 6.325 -2.396 10.652
433 H GLY 51 H GLY 51 -1.433 -5.540 11.489
434 HA2 GLY 51 HA2 GLY 51 -1.118 -8.330 12.357
435 HA3 GLY 51 HA3 GLY 51 -2.503 -7.325 12.770
436 H LYS 52 H LYS 52 -1.104 -9.421 10.522
437 HA LYS 52 HA LYS 52 -1.767 -10.443 8.668
438 HB2 LYS 52 HB2 LYS 52 -3.717 -11.130 9.905
439 HB3 LYS 52 HB3 LYS 52 -4.488 -9.580 9.659
440 HG2 LYS 52 HG2 LYS 52 -5.573 -11.258 8.305
441 HG3 LYS 52 HG3 LYS 52 -4.748 -10.112 7.263
442 HD2 LYS 52 HD2 LYS 52 -3.244 -12.559 8.027
443 HD3 LYS 52 HD3 LYS 52 -4.607 -12.772 6.935
444 HE2 LYS 52 HE2 LYS 52 -2.242 -10.935 6.501
445 HE3 LYS 52 HE3 LYS 52 -2.531 -12.461 5.670
446 HZ1 LYS 52 HZ1 LYS 52 -4.302 -10.066 5.494
447 HZ2 LYS 52 HZ2 LYS 52 -4.466 -11.495 4.611
448 HZ3 LYS 52 HZ3 LYS 52 -3.151 -10.496 4.363
Start of MODEL 9
1 H1 SER 0 H1 SER 0 -1.822 -12.539 -1.899
2 H2 SER 0 H2 SER 0 -2.941 -12.429 -0.642
3 H3 SER 0 H3 SER 0 -1.368 -13.019 -0.335
4 HA SER 0 HA SER 0 -1.385 -10.813 0.387
5 HB2 SER 0 HB2 SER 0 -0.045 -9.751 -1.613
6 HB3 SER 0 HB3 SER 0 0.621 -11.145 -0.757
7 HG SER 0 HG SER 0 -0.121 -10.869 -3.299
8 H MET 1 H MET 1 -1.813 -8.476 -0.287
9 HA MET 1 HA MET 1 -4.086 -8.322 -2.171
10 HB2 MET 1 HB2 MET 1 -3.930 -6.837 0.467
11 HB3 MET 1 HB3 MET 1 -5.206 -6.685 -0.719
12 HG2 MET 1 HG2 MET 1 -5.652 -9.162 -0.321
13 HG3 MET 1 HG3 MET 1 -4.594 -8.994 1.079
14 HE1 MET 1 HE1 MET 1 -5.093 -7.319 3.119
15 HE2 MET 1 HE2 MET 1 -6.545 -6.329 3.232
16 HE3 MET 1 HE3 MET 1 -5.328 -5.961 2.016
17 H ASN 2 H ASN 2 -3.882 -6.727 -3.633
18 HA ASN 2 HA ASN 2 -1.512 -5.050 -3.446
19 HB2 ASN 2 HB2 ASN 2 -3.297 -5.860 -5.702
20 HB3 ASN 2 HB3 ASN 2 -2.451 -4.325 -5.814
21 HD21 ASN 2 HD21 ASN 2 -0.261 -4.310 -6.123
22 HD22 ASN 2 HD22 ASN 2 0.653 -5.721 -6.460
23 H ARG 3 H ARG 3 -1.491 -2.921 -3.431
24 HA ARG 3 HA ARG 3 -4.025 -1.444 -3.238
25 HB2 ARG 3 HB2 ARG 3 -2.733 -1.961 -1.016
26 HB3 ARG 3 HB3 ARG 3 -1.570 -0.801 -1.620
27 HG2 ARG 3 HG2 ARG 3 -2.939 0.409 -0.154
28 HG3 ARG 3 HG3 ARG 3 -3.507 0.852 -1.767
29 HD2 ARG 3 HD2 ARG 3 -4.880 -1.474 -0.829
30 HD3 ARG 3 HD3 ARG 3 -5.015 -0.200 0.374
31 HE ARG 3 HE ARG 3 -6.022 1.197 -1.274
32 HH11 ARG 3 HH11 ARG 3 -5.785 -2.270 -2.210
33 HH12 ARG 3 HH12 ARG 3 -6.981 -2.148 -3.389
34 HH21 ARG 3 HH21 ARG 3 -7.648 1.299 -2.921
35 HH22 ARG 3 HH22 ARG 3 -8.079 -0.084 -3.829
36 H LEU 4 H LEU 4 -3.680 0.866 -3.873
37 HA LEU 4 HA LEU 4 -1.324 1.247 -5.608
38 HB2 LEU 4 HB2 LEU 4 -4.115 2.363 -5.914
39 HB3 LEU 4 HB3 LEU 4 -2.750 2.749 -6.931
40 HG LEU 4 HG LEU 4 -4.052 0.033 -6.732
41 HD11 LEU 4 HD11 LEU 4 -5.521 1.653 -7.762
42 HD12 LEU 4 HD12 LEU 4 -4.879 0.557 -8.992
43 HD13 LEU 4 HD13 LEU 4 -4.224 2.185 -8.830
44 HD21 LEU 4 HD21 LEU 4 -1.892 1.101 -8.554
45 HD22 LEU 4 HD22 LEU 4 -2.710 -0.450 -8.742
46 HD23 LEU 4 HD23 LEU 4 -1.712 -0.151 -7.322
47 H GLY 5 H GLY 5 -0.274 3.200 -5.383
48 HA2 GLY 5 HA2 GLY 5 -1.538 5.402 -4.105
49 HA3 GLY 5 HA3 GLY 5 -0.336 4.624 -3.071
50 H ILE 6 H ILE 6 -0.294 7.209 -4.024
51 HA ILE 6 HA ILE 6 1.783 7.282 -6.097
52 HB ILE 6 HB ILE 6 0.368 9.579 -4.699
53 HG12 ILE 6 HG12 ILE 6 -0.174 8.614 -7.504
54 HG13 ILE 6 HG13 ILE 6 -1.080 8.017 -6.116
55 HG21 ILE 6 HG21 ILE 6 1.220 10.940 -6.566
56 HG22 ILE 6 HG22 ILE 6 2.073 9.530 -7.195
57 HG23 ILE 6 HG23 ILE 6 2.531 10.211 -5.636
58 HD11 ILE 6 HD11 ILE 6 -0.901 10.894 -6.992
59 HD12 ILE 6 HD12 ILE 6 -1.857 10.273 -5.646
60 HD13 ILE 6 HD13 ILE 6 -2.256 9.806 -7.297
61 H ILE 7 H ILE 7 3.832 7.553 -5.591
62 HA ILE 7 HA ILE 7 4.652 7.557 -2.877
63 HB ILE 7 HB ILE 7 6.303 8.129 -5.351
64 HG12 ILE 7 HG12 ILE 7 5.192 5.904 -5.317
65 HG13 ILE 7 HG13 ILE 7 6.949 5.802 -5.285
66 HG21 ILE 7 HG21 ILE 7 7.352 8.949 -3.263
67 HG22 ILE 7 HG22 ILE 7 8.248 7.599 -3.957
68 HG23 ILE 7 HG23 ILE 7 7.200 7.338 -2.566
69 HD11 ILE 7 HD11 ILE 7 5.743 4.212 -3.780
70 HD12 ILE 7 HD12 ILE 7 5.229 5.603 -2.829
71 HD13 ILE 7 HD13 ILE 7 6.944 5.227 -2.989
72 H TYR 8 H TYR 8 4.262 9.135 -1.691
73 HA TYR 8 HA TYR 8 4.177 11.865 -2.618
74 HB2 TYR 8 HB2 TYR 8 2.508 10.712 -1.075
75 HB3 TYR 8 HB3 TYR 8 3.745 10.812 0.167
76 HD1 TYR 8 HD1 TYR 8 4.109 12.833 1.348
77 HD2 TYR 8 HD2 TYR 8 1.569 12.775 -2.055
78 HE1 TYR 8 HE1 TYR 8 3.308 15.077 1.923
79 HE2 TYR 8 HE2 TYR 8 0.758 15.028 -1.500
80 HH TYR 8 HH TYR 8 2.275 16.925 0.949
81 H GLU 9 H GLU 9 6.138 9.744 -0.598
82 HA GLU 9 HA GLU 9 8.315 11.573 -0.612
83 HB2 GLU 9 HB2 GLU 9 6.797 12.507 1.173
84 HB3 GLU 9 HB3 GLU 9 6.984 11.003 2.054
85 HG2 GLU 9 HG2 GLU 9 8.412 12.870 2.871
86 HG3 GLU 9 HG3 GLU 9 9.291 11.416 2.420
87 H ILE 10 H ILE 10 10.139 10.640 0.690
88 HA ILE 10 HA ILE 10 10.029 7.706 0.916
89 HB ILE 10 HB ILE 10 12.175 9.348 -0.473
90 HG12 ILE 10 HG12 ILE 10 10.153 8.859 -1.773
91 HG13 ILE 10 HG13 ILE 10 11.603 8.137 -2.489
92 HG21 ILE 10 HG21 ILE 10 13.280 7.631 0.808
93 HG22 ILE 10 HG22 ILE 10 13.359 7.223 -0.907
94 HG23 ILE 10 HG23 ILE 10 12.208 6.398 0.146
95 HD11 ILE 10 HD11 ILE 10 9.381 6.792 -0.969
96 HD12 ILE 10 HD12 ILE 10 10.887 5.983 -1.395
97 HD13 ILE 10 HD13 ILE 10 9.812 6.572 -2.664
98 H GLN 11 H GLN 11 11.167 6.901 2.623
99 HA GLN 11 HA GLN 11 12.927 8.669 4.128
100 HB2 GLN 11 HB2 GLN 11 10.460 7.305 5.132
101 HB3 GLN 11 HB3 GLN 11 11.831 7.517 6.213
102 HG2 GLN 11 HG2 GLN 11 11.636 9.788 6.242
103 HG3 GLN 11 HG3 GLN 11 10.829 9.830 4.672
104 HE21 GLN 11 HE21 GLN 11 8.671 9.533 4.556
105 HE22 GLN 11 HE22 GLN 11 7.637 9.528 5.940
106 H GLY 12 H GLY 12 14.526 7.472 3.170
107 HA2 GLY 12 HA2 GLY 12 16.106 5.855 3.156
108 HA3 GLY 12 HA3 GLY 12 15.299 5.100 4.535
109 H MET 13 H MET 13 14.605 3.153 4.092
110 HA MET 13 HA MET 13 13.801 2.597 1.349
111 HB2 MET 13 HB2 MET 13 14.568 0.726 3.588
112 HB3 MET 13 HB3 MET 13 13.843 0.174 2.087
113 HG2 MET 13 HG2 MET 13 15.716 1.270 0.864
114 HG3 MET 13 HG3 MET 13 16.484 1.571 2.415
115 HE1 MET 13 HE1 MET 13 15.876 -2.496 0.375
116 HE2 MET 13 HE2 MET 13 15.375 -0.923 -0.247
117 HE3 MET 13 HE3 MET 13 14.488 -1.675 1.082
118 H LYS 14 H LYS 14 12.235 4.073 3.354
119 HA LYS 14 HA LYS 14 9.843 2.396 3.166
120 HB2 LYS 14 HB2 LYS 14 10.274 4.703 5.061
121 HB3 LYS 14 HB3 LYS 14 8.918 3.597 5.033
122 HG2 LYS 14 HG2 LYS 14 10.318 1.764 5.735
123 HG3 LYS 14 HG3 LYS 14 11.742 2.799 5.675
124 HD2 LYS 14 HD2 LYS 14 10.649 4.242 7.399
125 HD3 LYS 14 HD3 LYS 14 9.388 3.012 7.540
126 HE2 LYS 14 HE2 LYS 14 11.073 1.351 8.120
127 HE3 LYS 14 HE3 LYS 14 12.325 2.581 7.950
128 HZ1 LYS 14 HZ1 LYS 14 11.729 2.231 10.252
129 HZ2 LYS 14 HZ2 LYS 14 10.135 2.593 9.952
130 HZ3 LYS 14 HZ3 LYS 14 11.307 3.792 9.800
131 H ALA 15 H ALA 15 8.047 3.451 2.431
132 HA ALA 15 HA ALA 15 8.546 6.052 1.167
133 HB1 ALA 15 HB1 ALA 15 8.726 4.311 -0.527
134 HB2 ALA 15 HB2 ALA 15 7.317 5.334 -0.793
135 HB3 ALA 15 HB3 ALA 15 7.118 3.718 -0.106
136 H VAL 16 H VAL 16 6.853 7.400 1.061
137 HA VAL 16 HA VAL 16 4.505 6.714 2.670
138 HB VAL 16 HB VAL 16 5.445 9.388 1.591
139 HG11 VAL 16 HG11 VAL 16 3.203 8.770 3.531
140 HG12 VAL 16 HG12 VAL 16 3.008 9.286 1.860
141 HG13 VAL 16 HG13 VAL 16 3.726 10.384 3.042
142 HG21 VAL 16 HG21 VAL 16 5.955 9.947 3.908
143 HG22 VAL 16 HG22 VAL 16 6.919 8.578 3.340
144 HG23 VAL 16 HG23 VAL 16 5.524 8.312 4.394
145 H VAL 17 H VAL 17 2.924 5.935 1.476
146 HA VAL 17 HA VAL 17 2.632 6.970 -1.243
147 HB VAL 17 HB VAL 17 0.936 4.983 -1.388
148 HG11 VAL 17 HG11 VAL 17 3.924 4.565 -1.544
149 HG12 VAL 17 HG12 VAL 17 2.871 5.197 -2.803
150 HG13 VAL 17 HG13 VAL 17 2.689 3.534 -2.262
151 HG21 VAL 17 HG21 VAL 17 1.081 4.307 0.932
152 HG22 VAL 17 HG22 VAL 17 2.812 4.015 0.758
153 HG23 VAL 17 HG23 VAL 17 1.654 3.012 -0.120
154 H LEU 18 H LEU 18 1.063 8.193 -1.690
155 HA LEU 18 HA LEU 18 -1.169 8.511 0.144
156 HB2 LEU 18 HB2 LEU 18 -0.187 10.529 -0.735
157 HB3 LEU 18 HB3 LEU 18 -0.239 9.917 -2.365
158 HG LEU 18 HG LEU 18 -2.775 9.973 -2.159
159 HD11 LEU 18 HD11 LEU 18 -2.945 10.101 0.246
160 HD12 LEU 18 HD12 LEU 18 -3.676 11.528 -0.491
161 HD13 LEU 18 HD13 LEU 18 -2.078 11.638 0.250
162 HD21 LEU 18 HD21 LEU 18 -1.440 11.599 -3.426
163 HD22 LEU 18 HD22 LEU 18 -1.300 12.591 -1.972
164 HD23 LEU 18 HD23 LEU 18 -2.879 12.312 -2.707
165 H THR 19 H THR 19 -2.521 6.851 -0.123
166 HA THR 19 HA THR 19 -2.518 5.231 -2.428
167 HB THR 19 HB THR 19 -4.372 4.020 -1.357
168 HG1 THR 19 HG1 THR 19 -5.192 4.705 0.539
169 HG21 THR 19 HG21 THR 19 -3.094 3.268 0.577
170 HG22 THR 19 HG22 THR 19 -2.133 4.753 0.521
171 HG23 THR 19 HG23 THR 19 -2.018 3.587 -0.791
172 H SER 20 H SER 20 -4.665 4.504 -3.424
173 HA SER 20 HA SER 20 -5.861 6.622 -4.814
174 HB2 SER 20 HB2 SER 20 -7.357 4.600 -5.503
175 HB3 SER 20 HB3 SER 20 -5.648 4.596 -5.951
176 HG SER 20 HG SER 20 -6.845 3.243 -3.727
177 H GLU 21 H GLU 21 -6.338 5.503 -1.740
178 HA GLU 21 HA GLU 21 -9.123 6.252 -1.536
179 HB2 GLU 21 HB2 GLU 21 -7.158 5.102 0.427
180 HB3 GLU 21 HB3 GLU 21 -8.814 5.538 0.835
181 HG2 GLU 21 HG2 GLU 21 -8.959 3.278 0.411
182 HG3 GLU 21 HG3 GLU 21 -9.488 4.039 -1.074
183 H GLY 22 H GLY 22 -6.106 7.673 -1.500
184 HA2 GLY 22 HA2 GLY 22 -5.510 9.832 -1.084
185 HA3 GLY 22 HA3 GLY 22 -7.096 10.103 -0.369
186 H GLU 23 H GLU 23 -5.120 7.469 0.737
187 HA GLU 23 HA GLU 23 -4.786 8.926 3.260
188 HB2 GLU 23 HB2 GLU 23 -5.062 5.971 2.722
189 HB3 GLU 23 HB3 GLU 23 -4.762 6.684 4.301
190 HG2 GLU 23 HG2 GLU 23 -7.179 7.247 2.604
191 HG3 GLU 23 HG3 GLU 23 -7.127 6.074 3.923
192 H PHE 24 H PHE 24 -2.780 8.816 4.301
193 HA PHE 24 HA PHE 24 -0.583 8.105 2.532
194 HB2 PHE 24 HB2 PHE 24 -0.456 9.572 5.193
195 HB3 PHE 24 HB3 PHE 24 0.850 9.330 4.044
196 HD1 PHE 24 HD1 PHE 24 -2.351 11.089 4.568
197 HD2 PHE 24 HD2 PHE 24 1.180 10.750 2.217
198 HE1 PHE 24 HE1 PHE 24 -2.880 13.222 3.470
199 HE2 PHE 24 HE2 PHE 24 0.647 12.876 1.113
200 HZ PHE 24 HZ PHE 24 -1.384 14.114 1.739
201 H LEU 25 H LEU 25 0.329 6.225 2.749
202 HA LEU 25 HA LEU 25 0.383 4.965 5.409
203 HB2 LEU 25 HB2 LEU 25 -0.127 3.733 2.715
204 HB3 LEU 25 HB3 LEU 25 0.543 2.773 4.011
205 HG LEU 25 HG LEU 25 -1.534 3.452 5.364
206 HD11 LEU 25 HD11 LEU 25 -2.282 5.277 3.946
207 HD12 LEU 25 HD12 LEU 25 -3.514 4.019 4.070
208 HD13 LEU 25 HD13 LEU 25 -2.528 4.151 2.614
209 HD21 LEU 25 HD21 LEU 25 -1.818 1.713 2.925
210 HD22 LEU 25 HD22 LEU 25 -2.880 1.688 4.330
211 HD23 LEU 25 HD23 LEU 25 -1.187 1.222 4.496
212 H ILE 26 H ILE 26 2.288 3.953 6.031
213 HA ILE 26 HA ILE 26 4.645 4.641 4.466
214 HB ILE 26 HB ILE 26 4.451 3.371 7.222
215 HG12 ILE 26 HG12 ILE 26 3.454 5.600 7.299
216 HG13 ILE 26 HG13 ILE 26 4.989 5.590 8.156
217 HG21 ILE 26 HG21 ILE 26 6.794 4.663 5.834
218 HG22 ILE 26 HG22 ILE 26 6.577 2.938 6.124
219 HG23 ILE 26 HG23 ILE 26 6.794 4.040 7.485
220 HD11 ILE 26 HD11 ILE 26 4.482 6.679 5.396
221 HD12 ILE 26 HD12 ILE 26 6.051 6.640 6.206
222 HD13 ILE 26 HD13 ILE 26 4.739 7.617 6.868
223 H ILE 27 H ILE 27 5.449 3.168 3.162
224 HA ILE 27 HA ILE 27 4.930 0.327 3.737
225 HB ILE 27 HB ILE 27 4.712 -0.130 1.352
226 HG12 ILE 27 HG12 ILE 27 4.754 2.854 0.849
227 HG13 ILE 27 HG13 ILE 27 6.177 1.835 0.666
228 HG21 ILE 27 HG21 ILE 27 2.859 2.109 2.148
229 HG22 ILE 27 HG22 ILE 27 2.685 0.438 2.658
230 HG23 ILE 27 HG23 ILE 27 2.539 0.857 0.951
231 HD11 ILE 27 HD11 ILE 27 5.141 2.222 -1.474
232 HD12 ILE 27 HD12 ILE 27 3.602 1.614 -0.870
233 HD13 ILE 27 HD13 ILE 27 4.978 0.523 -1.027
234 H ARG 28 H ARG 28 6.429 -1.094 2.682
235 HA ARG 28 HA ARG 28 9.171 -0.417 2.859
236 HB2 ARG 28 HB2 ARG 28 7.858 -2.624 1.267
237 HB3 ARG 28 HB3 ARG 28 9.564 -2.536 1.628
238 HG2 ARG 28 HG2 ARG 28 8.939 -2.705 4.061
239 HG3 ARG 28 HG3 ARG 28 7.290 -3.040 3.526
240 HD2 ARG 28 HD2 ARG 28 9.775 -4.678 3.061
241 HD3 ARG 28 HD3 ARG 28 8.271 -5.159 3.847
242 HE ARG 28 HE ARG 28 7.730 -4.439 1.190
243 HH11 ARG 28 HH11 ARG 28 9.250 -7.098 2.987
244 HH12 ARG 28 HH12 ARG 28 9.018 -8.216 1.708
245 HH21 ARG 28 HH21 ARG 28 7.408 -5.933 -0.436
246 HH22 ARG 28 HH22 ARG 28 7.917 -7.564 -0.279
247 H ARG 29 H ARG 29 10.408 0.614 1.419
248 HA ARG 29 HA ARG 29 9.221 1.300 -1.133
249 HB2 ARG 29 HB2 ARG 29 10.425 3.038 0.207
250 HB3 ARG 29 HB3 ARG 29 11.909 2.130 -0.029
251 HG2 ARG 29 HG2 ARG 29 11.121 2.326 -2.566
252 HG3 ARG 29 HG3 ARG 29 10.397 3.805 -1.934
253 HD2 ARG 29 HD2 ARG 29 12.607 4.448 -1.059
254 HD3 ARG 29 HD3 ARG 29 13.255 2.948 -1.761
255 HE ARG 29 HE ARG 29 12.062 4.172 -3.867
256 HH11 ARG 29 HH11 ARG 29 14.666 5.160 -1.674
257 HH12 ARG 29 HH12 ARG 29 15.336 6.275 -2.766
258 HH21 ARG 29 HH21 ARG 29 13.019 5.631 -5.371
259 HH22 ARG 29 HH22 ARG 29 14.402 6.528 -4.933
260 H ARG 30 H ARG 30 9.527 0.052 -2.770
261 HA ARG 30 HA ARG 30 11.785 -1.787 -2.844
262 HB2 ARG 30 HB2 ARG 30 9.524 -1.497 -4.862
263 HB3 ARG 30 HB3 ARG 30 10.671 -2.815 -4.749
264 HG2 ARG 30 HG2 ARG 30 9.622 -3.485 -2.584
265 HG3 ARG 30 HG3 ARG 30 8.427 -2.207 -2.820
266 HD2 ARG 30 HD2 ARG 30 7.801 -3.231 -4.981
267 HD3 ARG 30 HD3 ARG 30 8.928 -4.541 -4.670
268 HE ARG 30 HE ARG 30 7.071 -4.341 -2.538
269 HH11 ARG 30 HH11 ARG 30 7.254 -5.436 -5.920
270 HH12 ARG 30 HH12 ARG 30 5.928 -6.498 -5.800
271 HH21 ARG 30 HH21 ARG 30 5.265 -5.792 -2.393
272 HH22 ARG 30 HH22 ARG 30 4.758 -6.731 -3.701
273 H LYS 31 H LYS 31 12.532 -1.873 -5.428
274 HA LYS 31 HA LYS 31 13.763 0.707 -5.755
275 HB2 LYS 31 HB2 LYS 31 13.964 -1.717 -7.555
276 HB3 LYS 31 HB3 LYS 31 15.036 -0.328 -7.558
277 HG2 LYS 31 HG2 LYS 31 14.720 -2.273 -5.276
278 HG3 LYS 31 HG3 LYS 31 16.015 -2.308 -6.471
279 HD2 LYS 31 HD2 LYS 31 16.732 -0.068 -5.725
280 HD3 LYS 31 HD3 LYS 31 15.453 -0.081 -4.507
281 HE2 LYS 31 HE2 LYS 31 16.433 -1.954 -3.385
282 HE3 LYS 31 HE3 LYS 31 17.607 -2.176 -4.678
283 HZ1 LYS 31 HZ1 LYS 31 18.667 -0.136 -4.065
284 HZ2 LYS 31 HZ2 LYS 31 18.516 -1.075 -2.678
285 HZ3 LYS 31 HZ3 LYS 31 17.477 0.217 -2.931
286 H ASP 32 H ASP 32 10.941 -0.700 -6.753
287 HA ASP 32 HA ASP 32 10.612 0.635 -9.299
288 HB2 ASP 32 HB2 ASP 32 8.703 -0.898 -7.529
289 HB3 ASP 32 HB3 ASP 32 8.192 -0.101 -9.007
290 H MET 33 H MET 33 10.495 1.628 -6.126
291 HA MET 33 HA MET 33 8.247 3.408 -6.484
292 HB2 MET 33 HB2 MET 33 9.943 2.622 -4.171
293 HB3 MET 33 HB3 MET 33 9.015 4.107 -4.097
294 HG2 MET 33 HG2 MET 33 7.714 2.470 -3.034
295 HG3 MET 33 HG3 MET 33 6.986 2.710 -4.617
296 HE1 MET 33 HE1 MET 33 5.626 0.427 -4.124
297 HE2 MET 33 HE2 MET 33 6.492 0.258 -2.601
298 HE3 MET 33 HE3 MET 33 6.425 -1.099 -3.727
299 H LYS 34 H LYS 34 8.673 5.091 -7.681
300 HA LYS 34 HA LYS 34 10.991 6.731 -7.059
301 HB2 LYS 34 HB2 LYS 34 9.261 6.497 -9.520
302 HB3 LYS 34 HB3 LYS 34 10.504 7.712 -9.286
303 HG2 LYS 34 HG2 LYS 34 12.202 5.950 -9.185
304 HG3 LYS 34 HG3 LYS 34 10.940 4.733 -9.387
305 HD2 LYS 34 HD2 LYS 34 10.362 5.700 -11.557
306 HD3 LYS 34 HD3 LYS 34 11.628 6.908 -11.352
307 HE2 LYS 34 HE2 LYS 34 13.295 5.086 -11.228
308 HE3 LYS 34 HE3 LYS 34 11.998 3.927 -11.524
309 HZ1 LYS 34 HZ1 LYS 34 12.794 6.111 -13.352
310 HZ2 LYS 34 HZ2 LYS 34 11.587 4.985 -13.652
311 HZ3 LYS 34 HZ3 LYS 34 13.208 4.489 -13.540
312 H VAL 35 H VAL 35 10.504 8.915 -6.641
313 HA VAL 35 HA VAL 35 7.992 9.294 -5.379
314 HB VAL 35 HB VAL 35 9.861 11.568 -6.012
315 HG11 VAL 35 HG11 VAL 35 8.103 11.034 -3.613
316 HG12 VAL 35 HG12 VAL 35 7.692 12.096 -4.961
317 HG13 VAL 35 HG13 VAL 35 9.059 12.480 -3.912
318 HG21 VAL 35 HG21 VAL 35 11.236 9.759 -5.127
319 HG22 VAL 35 HG22 VAL 35 10.146 9.601 -3.751
320 HG23 VAL 35 HG23 VAL 35 11.094 11.076 -3.964
321 H GLY 36 H GLY 36 6.183 10.242 -6.014
322 HA2 GLY 36 HA2 GLY 36 4.994 11.869 -7.196
323 HA3 GLY 36 HA3 GLY 36 6.223 11.840 -8.448
324 H GLN 37 H GLN 37 6.067 8.792 -8.344
325 HA GLN 37 HA GLN 37 3.795 8.720 -10.165
326 HB2 GLN 37 HB2 GLN 37 4.697 6.738 -11.144
327 HB3 GLN 37 HB3 GLN 37 5.982 7.921 -11.009
328 HG2 GLN 37 HG2 GLN 37 6.859 6.739 -9.055
329 HG3 GLN 37 HG3 GLN 37 5.554 5.555 -9.201
330 HE21 GLN 37 HE21 GLN 37 6.967 3.836 -9.545
331 HE22 GLN 37 HE22 GLN 37 7.855 3.646 -10.990
332 H GLN 38 H GLN 38 2.374 6.906 -10.217
333 HA GLN 38 HA GLN 38 1.597 6.078 -7.547
334 HB2 GLN 38 HB2 GLN 38 0.022 6.950 -9.404
335 HB3 GLN 38 HB3 GLN 38 0.237 5.363 -10.125
336 HG2 GLN 38 HG2 GLN 38 -0.515 4.442 -7.866
337 HG3 GLN 38 HG3 GLN 38 -1.071 6.081 -7.529
338 HE21 GLN 38 HE21 GLN 38 -3.217 5.683 -7.542
339 HE22 GLN 38 HE22 GLN 38 -4.090 5.167 -8.933
340 H VAL 39 H VAL 39 1.974 4.116 -6.804
341 HA VAL 39 HA VAL 39 3.068 2.124 -8.662
342 HB VAL 39 HB VAL 39 4.534 1.325 -6.866
343 HG11 VAL 39 HG11 VAL 39 5.989 3.404 -6.595
344 HG12 VAL 39 HG12 VAL 39 4.784 4.211 -7.605
345 HG13 VAL 39 HG13 VAL 39 5.679 2.824 -8.233
346 HG21 VAL 39 HG21 VAL 39 3.139 1.993 -4.955
347 HG22 VAL 39 HG22 VAL 39 3.566 3.679 -5.240
348 HG23 VAL 39 HG23 VAL 39 4.809 2.522 -4.765
349 H SER 40 H SER 40 2.723 -0.077 -7.927
350 HA SER 40 HA SER 40 0.477 -0.276 -6.107
351 HB2 SER 40 HB2 SER 40 0.139 -1.140 -8.499
352 HB3 SER 40 HB3 SER 40 1.300 -2.409 -8.083
353 HG SER 40 HG SER 40 -0.891 -1.864 -6.414
354 H PHE 41 H PHE 41 0.755 -1.375 -4.384
355 HA PHE 41 HA PHE 41 3.166 -2.957 -4.033
356 HB2 PHE 41 HB2 PHE 41 3.257 -2.036 -1.685
357 HB3 PHE 41 HB3 PHE 41 3.711 -0.895 -2.935
358 HD1 PHE 41 HD1 PHE 41 2.021 0.878 -3.611
359 HD2 PHE 41 HD2 PHE 41 1.481 -1.611 -0.207
360 HE1 PHE 41 HE1 PHE 41 0.369 2.457 -2.727
361 HE2 PHE 41 HE2 PHE 41 -0.179 -0.026 0.680
362 HZ PHE 41 HZ PHE 41 -0.735 1.998 -0.576
363 H GLU 42 H GLU 42 2.803 -4.166 -1.911
364 HA GLU 42 HA GLU 42 0.038 -5.045 -1.969
365 HB2 GLU 42 HB2 GLU 42 2.570 -6.553 -1.357
366 HB3 GLU 42 HB3 GLU 42 0.958 -7.172 -1.017
367 HG2 GLU 42 HG2 GLU 42 0.374 -7.382 -3.142
368 HG3 GLU 42 HG3 GLU 42 1.504 -6.177 -3.757
369 H ASN 43 H ASN 43 -0.602 -6.011 0.107
370 HA ASN 43 HA ASN 43 -0.438 -3.922 2.074
371 HB2 ASN 43 HB2 ASN 43 -1.966 -6.483 1.836
372 HB3 ASN 43 HB3 ASN 43 -1.821 -5.733 3.423
373 HD21 ASN 43 HD21 ASN 43 -2.750 -5.035 0.087
374 HD22 ASN 43 HD22 ASN 43 -3.989 -3.906 0.483
375 H GLU 44 H GLU 44 0.971 -6.921 1.490
376 HA GLU 44 HA GLU 44 2.176 -7.527 3.870
377 HB2 GLU 44 HB2 GLU 44 2.774 -8.046 0.998
378 HB3 GLU 44 HB3 GLU 44 3.696 -8.760 2.316
379 HG2 GLU 44 HG2 GLU 44 2.094 -10.302 1.612
380 HG3 GLU 44 HG3 GLU 44 1.619 -9.750 3.203
381 H ASP 45 H ASP 45 2.878 -5.188 1.359
382 HA ASP 45 HA ASP 45 5.608 -4.663 2.223
383 HB2 ASP 45 HB2 ASP 45 3.850 -3.312 0.167
384 HB3 ASP 45 HB3 ASP 45 5.455 -2.735 0.587
385 H ILE 46 H ILE 46 2.525 -3.733 3.139
386 HA ILE 46 HA ILE 46 3.164 -1.029 3.820
387 HB ILE 46 HB ILE 46 0.795 -2.695 4.745
388 HG12 ILE 46 HG12 ILE 46 0.980 -0.746 2.444
389 HG13 ILE 46 HG13 ILE 46 0.939 -2.493 2.270
390 HG21 ILE 46 HG21 ILE 46 -0.267 -0.522 5.153
391 HG22 ILE 46 HG22 ILE 46 1.230 0.300 4.691
392 HG23 ILE 46 HG23 ILE 46 1.184 -0.730 6.126
393 HD11 ILE 46 HD11 ILE 46 -1.243 -1.619 1.815
394 HD12 ILE 46 HD12 ILE 46 -1.235 -0.694 3.316
395 HD13 ILE 46 HD13 ILE 46 -1.315 -2.451 3.371
396 H TYR 47 H TYR 47 4.047 -0.294 5.522
397 HA TYR 47 HA TYR 47 4.952 -2.075 7.609
398 HB2 TYR 47 HB2 TYR 47 5.460 0.717 6.765
399 HB3 TYR 47 HB3 TYR 47 5.768 0.342 8.473
400 HD1 TYR 47 HD1 TYR 47 7.314 0.877 5.532
401 HD2 TYR 47 HD2 TYR 47 7.078 -2.168 8.482
402 HE1 TYR 47 HE1 TYR 47 9.511 0.041 4.836
403 HE2 TYR 47 HE2 TYR 47 9.282 -3.008 7.790
404 HH TYR 47 HH TYR 47 10.774 -2.954 6.056
405 H ASN 48 H ASN 48 2.491 0.186 7.024
406 HA ASN 48 HA ASN 48 1.683 0.369 9.829
407 HB2 ASN 48 HB2 ASN 48 0.542 1.652 7.341
408 HB3 ASN 48 HB3 ASN 48 -0.133 1.848 8.946
409 HD21 ASN 48 HD21 ASN 48 2.362 2.125 10.358
410 HD22 ASN 48 HD22 ASN 48 2.991 3.653 9.871
411 H VAL 49 H VAL 49 1.205 -1.976 9.862
412 HA VAL 49 HA VAL 49 -1.114 -2.747 8.300
413 HB VAL 49 HB VAL 49 0.459 -4.393 10.312
414 HG11 VAL 49 HG11 VAL 49 -1.678 -5.236 8.352
415 HG12 VAL 49 HG12 VAL 49 -1.833 -5.200 10.108
416 HG13 VAL 49 HG13 VAL 49 -0.709 -6.325 9.345
417 HG21 VAL 49 HG21 VAL 49 0.497 -4.436 7.297
418 HG22 VAL 49 HG22 VAL 49 1.395 -5.520 8.363
419 HG23 VAL 49 HG23 VAL 49 1.767 -3.792 8.339
420 H ARG 50 H ARG 50 -2.894 -1.873 9.005
421 HA ARG 50 HA ARG 50 -3.566 -2.265 11.820
422 HB2 ARG 50 HB2 ARG 50 -3.382 0.162 11.049
423 HB3 ARG 50 HB3 ARG 50 -4.750 -0.160 9.998
424 HG2 ARG 50 HG2 ARG 50 -6.177 -0.595 11.866
425 HG3 ARG 50 HG3 ARG 50 -4.819 -0.509 12.984
426 HD2 ARG 50 HD2 ARG 50 -5.861 1.747 11.279
427 HD3 ARG 50 HD3 ARG 50 -6.151 1.551 13.009
428 HE ARG 50 HE ARG 50 -3.393 1.538 12.535
429 HH11 ARG 50 HH11 ARG 50 -6.119 3.840 12.523
430 HH12 ARG 50 HH12 ARG 50 -5.142 5.193 12.804
431 HH21 ARG 50 HH21 ARG 50 -2.072 3.457 12.868
432 HH22 ARG 50 HH22 ARG 50 -2.808 4.987 12.966
433 H GLY 51 H GLY 51 -4.234 -4.287 11.348
434 HA2 GLY 51 HA2 GLY 51 -6.621 -4.509 9.641
435 HA3 GLY 51 HA3 GLY 51 -5.464 -5.816 9.920
436 H LYS 52 H LYS 52 -5.071 -6.232 12.283
437 HA LYS 52 HA LYS 52 -7.202 -5.640 14.063
438 HB2 LYS 52 HB2 LYS 52 -7.757 -7.881 12.708
439 HB3 LYS 52 HB3 LYS 52 -6.559 -8.573 13.795
440 HG2 LYS 52 HG2 LYS 52 -9.115 -7.179 14.634
441 HG3 LYS 52 HG3 LYS 52 -8.818 -8.918 14.661
442 HD2 LYS 52 HD2 LYS 52 -7.227 -8.716 16.411
443 HD3 LYS 52 HD3 LYS 52 -7.078 -6.988 16.147
444 HE2 LYS 52 HE2 LYS 52 -9.497 -6.809 16.897
445 HE3 LYS 52 HE3 LYS 52 -9.338 -8.482 17.434
446 HZ1 LYS 52 HZ1 LYS 52 -7.451 -7.808 18.805
447 HZ2 LYS 52 HZ2 LYS 52 -8.841 -6.980 19.257
448 HZ3 LYS 52 HZ3 LYS 52 -7.652 -6.209 18.338
Start of MODEL 10
1 H1 SER 0 H1 SER 0 0.597 -10.035 -3.493
2 H2 SER 0 H2 SER 0 1.074 -11.516 -2.848
3 H3 SER 0 H3 SER 0 0.730 -10.262 -1.810
4 HA SER 0 HA SER 0 -1.047 -11.908 -3.443
5 HB2 SER 0 HB2 SER 0 -1.019 -11.309 -0.497
6 HB3 SER 0 HB3 SER 0 -1.933 -12.577 -1.324
7 HG SER 0 HG SER 0 0.111 -13.199 -0.272
8 H MET 1 H MET 1 -1.022 -8.895 -1.382
9 HA MET 1 HA MET 1 -3.591 -8.283 -2.684
10 HB2 MET 1 HB2 MET 1 -2.724 -8.006 0.138
11 HB3 MET 1 HB3 MET 1 -3.787 -6.772 -0.510
12 HG2 MET 1 HG2 MET 1 -4.314 -9.722 -0.437
13 HG3 MET 1 HG3 MET 1 -5.035 -8.502 0.619
14 HE1 MET 1 HE1 MET 1 -6.674 -6.614 -0.220
15 HE2 MET 1 HE2 MET 1 -7.300 -6.484 -1.862
16 HE3 MET 1 HE3 MET 1 -5.610 -6.099 -1.534
17 H ASN 2 H ASN 2 -3.294 -6.762 -4.149
18 HA ASN 2 HA ASN 2 -1.152 -4.822 -3.763
19 HB2 ASN 2 HB2 ASN 2 -2.808 -5.557 -6.167
20 HB3 ASN 2 HB3 ASN 2 -1.922 -4.047 -6.113
21 HD21 ASN 2 HD21 ASN 2 0.414 -4.963 -4.792
22 HD22 ASN 2 HD22 ASN 2 1.209 -6.059 -5.866
23 H ARG 3 H ARG 3 -1.402 -2.713 -3.594
24 HA ARG 3 HA ARG 3 -4.074 -1.509 -3.490
25 HB2 ARG 3 HB2 ARG 3 -2.901 -1.953 -1.224
26 HB3 ARG 3 HB3 ARG 3 -1.709 -0.783 -1.783
27 HG2 ARG 3 HG2 ARG 3 -3.128 0.428 -0.396
28 HG3 ARG 3 HG3 ARG 3 -3.630 0.838 -2.037
29 HD2 ARG 3 HD2 ARG 3 -5.354 -0.922 -1.849
30 HD3 ARG 3 HD3 ARG 3 -4.938 -1.095 -0.146
31 HE ARG 3 HE ARG 3 -6.379 1.076 -1.373
32 HH11 ARG 3 HH11 ARG 3 -4.686 -0.042 1.541
33 HH12 ARG 3 HH12 ARG 3 -5.278 1.211 2.526
34 HH21 ARG 3 HH21 ARG 3 -7.207 2.759 -0.016
35 HH22 ARG 3 HH22 ARG 3 -6.763 2.889 1.615
36 H LEU 4 H LEU 4 -3.887 0.859 -4.036
37 HA LEU 4 HA LEU 4 -1.553 1.400 -5.778
38 HB2 LEU 4 HB2 LEU 4 -4.428 2.249 -6.097
39 HB3 LEU 4 HB3 LEU 4 -3.118 2.831 -7.094
40 HG LEU 4 HG LEU 4 -4.093 -0.025 -6.948
41 HD11 LEU 4 HD11 LEU 4 -4.928 0.360 -9.198
42 HD12 LEU 4 HD12 LEU 4 -4.374 2.029 -9.136
43 HD13 LEU 4 HD13 LEU 4 -5.661 1.487 -8.058
44 HD21 LEU 4 HD21 LEU 4 -2.610 -0.364 -8.906
45 HD22 LEU 4 HD22 LEU 4 -1.731 0.001 -7.428
46 HD23 LEU 4 HD23 LEU 4 -1.954 1.254 -8.654
47 H GLY 5 H GLY 5 -0.334 3.019 -5.140
48 HA2 GLY 5 HA2 GLY 5 -1.611 5.365 -4.010
49 HA3 GLY 5 HA3 GLY 5 -0.435 4.540 -2.985
50 H ILE 6 H ILE 6 -0.303 7.122 -3.887
51 HA ILE 6 HA ILE 6 1.738 7.192 -5.990
52 HB ILE 6 HB ILE 6 0.392 9.455 -4.486
53 HG12 ILE 6 HG12 ILE 6 -0.161 8.566 -7.318
54 HG13 ILE 6 HG13 ILE 6 -1.130 8.042 -5.945
55 HG21 ILE 6 HG21 ILE 6 1.268 10.891 -6.274
56 HG22 ILE 6 HG22 ILE 6 2.098 9.504 -6.978
57 HG23 ILE 6 HG23 ILE 6 2.567 10.095 -5.386
58 HD11 ILE 6 HD11 ILE 6 -1.795 10.310 -5.496
59 HD12 ILE 6 HD12 ILE 6 -2.119 9.928 -7.190
60 HD13 ILE 6 HD13 ILE 6 -0.720 10.906 -6.758
61 H ILE 7 H ILE 7 3.815 7.381 -5.491
62 HA ILE 7 HA ILE 7 4.689 7.398 -2.768
63 HB ILE 7 HB ILE 7 6.331 7.908 -5.256
64 HG12 ILE 7 HG12 ILE 7 5.137 5.723 -5.214
65 HG13 ILE 7 HG13 ILE 7 6.888 5.571 -5.223
66 HG21 ILE 7 HG21 ILE 7 7.380 8.687 -3.150
67 HG22 ILE 7 HG22 ILE 7 8.253 7.334 -3.875
68 HG23 ILE 7 HG23 ILE 7 7.206 7.064 -2.486
69 HD11 ILE 7 HD11 ILE 7 5.172 5.362 -2.763
70 HD12 ILE 7 HD12 ILE 7 6.902 5.046 -2.884
71 HD13 ILE 7 HD13 ILE 7 5.753 3.991 -3.705
72 H TYR 8 H TYR 8 4.249 8.977 -1.641
73 HA TYR 8 HA TYR 8 4.233 11.694 -2.536
74 HB2 TYR 8 HB2 TYR 8 2.647 10.610 -0.874
75 HB3 TYR 8 HB3 TYR 8 3.986 10.594 0.260
76 HD1 TYR 8 HD1 TYR 8 1.640 12.697 -1.584
77 HD2 TYR 8 HD2 TYR 8 4.669 12.600 1.382
78 HE1 TYR 8 HE1 TYR 8 1.007 14.970 -0.877
79 HE2 TYR 8 HE2 TYR 8 4.058 14.857 2.102
80 HH TYR 8 HH TYR 8 1.206 16.368 1.195
81 H GLU 9 H GLU 9 6.209 9.582 -0.487
82 HA GLU 9 HA GLU 9 8.468 11.316 -0.771
83 HB2 GLU 9 HB2 GLU 9 7.036 12.377 1.012
84 HB3 GLU 9 HB3 GLU 9 7.299 10.954 1.994
85 HG2 GLU 9 HG2 GLU 9 9.677 11.412 2.069
86 HG3 GLU 9 HG3 GLU 9 9.470 12.774 0.971
87 H ILE 10 H ILE 10 10.379 10.274 -0.186
88 HA ILE 10 HA ILE 10 10.144 7.458 0.619
89 HB ILE 10 HB ILE 10 12.255 8.897 -1.018
90 HG12 ILE 10 HG12 ILE 10 10.126 8.282 -2.162
91 HG13 ILE 10 HG13 ILE 10 11.565 7.549 -2.882
92 HG21 ILE 10 HG21 ILE 10 12.242 6.011 -0.160
93 HG22 ILE 10 HG22 ILE 10 13.337 7.260 0.426
94 HG23 ILE 10 HG23 ILE 10 13.407 6.746 -1.262
95 HD11 ILE 10 HD11 ILE 10 9.388 6.290 -1.253
96 HD12 ILE 10 HD12 ILE 10 10.955 5.523 -1.463
97 HD13 ILE 10 HD13 ILE 10 9.946 5.860 -2.877
98 H GLN 11 H GLN 11 11.175 6.877 2.454
99 HA GLN 11 HA GLN 11 13.030 8.803 3.706
100 HB2 GLN 11 HB2 GLN 11 11.204 6.850 5.152
101 HB3 GLN 11 HB3 GLN 11 12.372 7.896 5.916
102 HG2 GLN 11 HG2 GLN 11 10.350 8.927 6.332
103 HG3 GLN 11 HG3 GLN 11 10.944 9.810 4.931
104 HE21 GLN 11 HE21 GLN 11 9.757 9.875 3.211
105 HE22 GLN 11 HE22 GLN 11 8.296 8.985 2.936
106 H GLY 12 H GLY 12 14.572 7.563 2.364
107 HA2 GLY 12 HA2 GLY 12 16.310 6.055 2.332
108 HA3 GLY 12 HA3 GLY 12 15.762 5.486 3.908
109 H MET 13 H MET 13 14.612 3.659 4.059
110 HA MET 13 HA MET 13 13.967 2.312 1.538
111 HB2 MET 13 HB2 MET 13 14.621 1.104 4.229
112 HB3 MET 13 HB3 MET 13 14.028 0.187 2.857
113 HG2 MET 13 HG2 MET 13 16.061 1.148 1.607
114 HG3 MET 13 HG3 MET 13 16.660 1.556 3.211
115 HE1 MET 13 HE1 MET 13 16.029 -1.166 0.581
116 HE2 MET 13 HE2 MET 13 14.693 -1.535 1.668
117 HE3 MET 13 HE3 MET 13 16.030 -2.669 1.498
118 H LYS 14 H LYS 14 12.420 4.145 3.575
119 HA LYS 14 HA LYS 14 9.975 2.487 3.532
120 HB2 LYS 14 HB2 LYS 14 10.421 5.022 5.123
121 HB3 LYS 14 HB3 LYS 14 9.038 3.966 5.201
122 HG2 LYS 14 HG2 LYS 14 10.427 2.205 6.189
123 HG3 LYS 14 HG3 LYS 14 11.822 3.291 6.134
124 HD2 LYS 14 HD2 LYS 14 10.474 4.923 7.491
125 HD3 LYS 14 HD3 LYS 14 9.269 3.650 7.691
126 HE2 LYS 14 HE2 LYS 14 10.891 2.252 8.814
127 HE3 LYS 14 HE3 LYS 14 12.163 3.437 8.519
128 HZ1 LYS 14 HZ1 LYS 14 9.751 3.852 10.191
129 HZ2 LYS 14 HZ2 LYS 14 10.927 5.014 9.897
130 HZ3 LYS 14 HZ3 LYS 14 11.319 3.612 10.765
131 H ALA 15 H ALA 15 8.055 3.580 2.819
132 HA ALA 15 HA ALA 15 8.513 6.058 1.342
133 HB1 ALA 15 HB1 ALA 15 7.117 3.639 0.190
134 HB2 ALA 15 HB2 ALA 15 8.728 4.196 -0.253
135 HB3 ALA 15 HB3 ALA 15 7.322 5.204 -0.589
136 H VAL 16 H VAL 16 6.809 7.363 1.231
137 HA VAL 16 HA VAL 16 4.441 6.707 2.852
138 HB VAL 16 HB VAL 16 5.420 9.380 1.755
139 HG11 VAL 16 HG11 VAL 16 3.667 10.433 3.023
140 HG12 VAL 16 HG12 VAL 16 3.100 8.870 3.616
141 HG13 VAL 16 HG13 VAL 16 2.959 9.269 1.900
142 HG21 VAL 16 HG21 VAL 16 5.964 9.996 3.987
143 HG22 VAL 16 HG22 VAL 16 6.721 8.429 3.671
144 HG23 VAL 16 HG23 VAL 16 5.243 8.524 4.628
145 H VAL 17 H VAL 17 2.857 5.895 1.633
146 HA VAL 17 HA VAL 17 2.621 6.928 -1.089
147 HB VAL 17 HB VAL 17 1.028 4.921 -1.419
148 HG11 VAL 17 HG11 VAL 17 3.186 5.143 -2.524
149 HG12 VAL 17 HG12 VAL 17 2.875 3.471 -2.072
150 HG13 VAL 17 HG13 VAL 17 3.984 4.443 -1.122
151 HG21 VAL 17 HG21 VAL 17 0.862 4.253 0.903
152 HG22 VAL 17 HG22 VAL 17 2.595 3.934 0.961
153 HG23 VAL 17 HG23 VAL 17 1.543 2.952 -0.068
154 H LEU 18 H LEU 18 1.052 8.113 -1.605
155 HA LEU 18 HA LEU 18 -1.188 8.469 0.213
156 HB2 LEU 18 HB2 LEU 18 -0.073 10.476 -0.594
157 HB3 LEU 18 HB3 LEU 18 -0.239 9.946 -2.251
158 HG LEU 18 HG LEU 18 -2.698 10.213 -2.053
159 HD11 LEU 18 HD11 LEU 18 -2.912 9.881 0.344
160 HD12 LEU 18 HD12 LEU 18 -3.601 11.431 -0.134
161 HD13 LEU 18 HD13 LEU 18 -2.019 11.372 0.639
162 HD21 LEU 18 HD21 LEU 18 -2.690 12.648 -2.100
163 HD22 LEU 18 HD22 LEU 18 -1.297 12.004 -2.961
164 HD23 LEU 18 HD23 LEU 18 -1.100 12.668 -1.337
165 H THR 19 H THR 19 -2.698 6.977 -0.133
166 HA THR 19 HA THR 19 -2.823 5.441 -2.490
167 HB THR 19 HB THR 19 -4.966 4.557 -1.547
168 HG1 THR 19 HG1 THR 19 -5.337 5.215 0.679
169 HG21 THR 19 HG21 THR 19 -2.854 3.489 -1.058
170 HG22 THR 19 HG22 THR 19 -3.846 3.471 0.399
171 HG23 THR 19 HG23 THR 19 -2.528 4.638 0.231
172 H SER 20 H SER 20 -4.787 5.131 -3.806
173 HA SER 20 HA SER 20 -5.468 7.448 -5.157
174 HB2 SER 20 HB2 SER 20 -7.242 5.836 -6.155
175 HB3 SER 20 HB3 SER 20 -5.530 5.463 -6.372
176 HG SER 20 HG SER 20 -7.388 3.991 -5.224
177 H GLU 21 H GLU 21 -6.799 6.155 -2.287
178 HA GLU 21 HA GLU 21 -9.311 7.603 -2.554
179 HB2 GLU 21 HB2 GLU 21 -8.208 5.943 -0.303
180 HB3 GLU 21 HB3 GLU 21 -9.797 6.694 -0.316
181 HG2 GLU 21 HG2 GLU 21 -10.663 5.136 -1.652
182 HG3 GLU 21 HG3 GLU 21 -9.208 5.028 -2.643
183 H GLY 22 H GLY 22 -6.162 8.096 -1.264
184 HA2 GLY 22 HA2 GLY 22 -5.511 10.308 -0.649
185 HA3 GLY 22 HA3 GLY 22 -7.139 10.593 -0.061
186 H GLU 23 H GLU 23 -5.202 7.722 0.739
187 HA GLU 23 HA GLU 23 -5.032 8.711 3.514
188 HB2 GLU 23 HB2 GLU 23 -4.815 5.872 2.496
189 HB3 GLU 23 HB3 GLU 23 -4.822 6.379 4.171
190 HG2 GLU 23 HG2 GLU 23 -7.135 7.025 4.003
191 HG3 GLU 23 HG3 GLU 23 -7.142 6.648 2.275
192 H PHE 24 H PHE 24 -2.944 8.557 4.517
193 HA PHE 24 HA PHE 24 -0.782 8.068 2.607
194 HB2 PHE 24 HB2 PHE 24 -0.667 9.510 5.279
195 HB3 PHE 24 HB3 PHE 24 0.672 9.266 4.170
196 HD1 PHE 24 HD1 PHE 24 -2.575 11.003 4.577
197 HD2 PHE 24 HD2 PHE 24 1.086 10.777 2.395
198 HE1 PHE 24 HE1 PHE 24 -3.070 13.153 3.514
199 HE2 PHE 24 HE2 PHE 24 0.584 12.916 1.337
200 HZ PHE 24 HZ PHE 24 -1.493 14.114 1.894
201 H LEU 25 H LEU 25 0.130 6.183 2.764
202 HA LEU 25 HA LEU 25 0.167 4.817 5.382
203 HB2 LEU 25 HB2 LEU 25 -0.161 3.717 2.606
204 HB3 LEU 25 HB3 LEU 25 0.491 2.721 3.887
205 HG LEU 25 HG LEU 25 -1.676 3.198 5.155
206 HD11 LEU 25 HD11 LEU 25 -3.612 3.811 3.825
207 HD12 LEU 25 HD12 LEU 25 -2.580 4.062 2.418
208 HD13 LEU 25 HD13 LEU 25 -2.417 5.109 3.829
209 HD21 LEU 25 HD21 LEU 25 -1.782 1.658 2.572
210 HD22 LEU 25 HD22 LEU 25 -2.889 1.471 3.934
211 HD23 LEU 25 HD23 LEU 25 -1.181 1.067 4.120
212 H ILE 26 H ILE 26 2.079 3.916 6.041
213 HA ILE 26 HA ILE 26 4.438 4.667 4.492
214 HB ILE 26 HB ILE 26 4.378 3.415 7.254
215 HG12 ILE 26 HG12 ILE 26 3.174 5.582 7.308
216 HG13 ILE 26 HG13 ILE 26 4.682 5.647 8.212
217 HG21 ILE 26 HG21 ILE 26 6.554 4.892 5.763
218 HG22 ILE 26 HG22 ILE 26 6.513 3.172 6.140
219 HG23 ILE 26 HG23 ILE 26 6.671 4.352 7.435
220 HD11 ILE 26 HD11 ILE 26 5.728 6.766 6.262
221 HD12 ILE 26 HD12 ILE 26 4.406 7.680 6.985
222 HD13 ILE 26 HD13 ILE 26 4.145 6.789 5.482
223 H ILE 27 H ILE 27 5.316 3.212 3.257
224 HA ILE 27 HA ILE 27 4.881 0.376 3.892
225 HB ILE 27 HB ILE 27 4.829 -0.150 1.500
226 HG12 ILE 27 HG12 ILE 27 4.683 2.823 0.936
227 HG13 ILE 27 HG13 ILE 27 6.170 1.895 0.824
228 HG21 ILE 27 HG21 ILE 27 2.792 1.883 2.375
229 HG22 ILE 27 HG22 ILE 27 2.697 0.123 2.530
230 HG23 ILE 27 HG23 ILE 27 2.622 0.873 0.942
231 HD11 ILE 27 HD11 ILE 27 5.156 2.189 -1.352
232 HD12 ILE 27 HD12 ILE 27 3.672 1.434 -0.781
233 HD13 ILE 27 HD13 ILE 27 5.156 0.488 -0.891
234 H ARG 28 H ARG 28 6.466 -0.977 2.747
235 HA ARG 28 HA ARG 28 9.156 -0.111 3.189
236 HB2 ARG 28 HB2 ARG 28 8.160 -2.483 1.623
237 HB3 ARG 28 HB3 ARG 28 9.783 -2.259 2.233
238 HG2 ARG 28 HG2 ARG 28 8.918 -2.464 4.527
239 HG3 ARG 28 HG3 ARG 28 7.297 -2.705 3.866
240 HD2 ARG 28 HD2 ARG 28 9.704 -4.476 3.607
241 HD3 ARG 28 HD3 ARG 28 8.105 -4.889 4.240
242 HE ARG 28 HE ARG 28 7.491 -4.288 1.731
243 HH11 ARG 28 HH11 ARG 28 10.148 -6.324 2.903
244 HH12 ARG 28 HH12 ARG 28 10.219 -7.249 1.472
245 HH21 ARG 28 HH21 ARG 28 7.617 -5.462 -0.151
246 HH22 ARG 28 HH22 ARG 28 8.725 -6.759 -0.347
247 H ARG 29 H ARG 29 10.376 0.926 1.730
248 HA ARG 29 HA ARG 29 9.353 1.422 -0.917
249 HB2 ARG 29 HB2 ARG 29 10.586 3.184 0.201
250 HB3 ARG 29 HB3 ARG 29 11.971 2.124 0.405
251 HG2 ARG 29 HG2 ARG 29 11.685 1.973 -2.252
252 HG3 ARG 29 HG3 ARG 29 11.081 3.603 -1.993
253 HD2 ARG 29 HD2 ARG 29 13.134 4.115 -0.729
254 HD3 ARG 29 HD3 ARG 29 13.699 2.477 -1.064
255 HE ARG 29 HE ARG 29 13.198 3.448 -3.513
256 HH11 ARG 29 HH11 ARG 29 15.140 4.675 -0.801
257 HH12 ARG 29 HH12 ARG 29 16.252 5.488 -1.797
258 HH21 ARG 29 HH21 ARG 29 14.793 4.583 -4.887
259 HH22 ARG 29 HH22 ARG 29 16.054 5.431 -4.143
260 H ARG 30 H ARG 30 9.677 0.226 -2.517
261 HA ARG 30 HA ARG 30 11.559 -1.964 -2.372
262 HB2 ARG 30 HB2 ARG 30 9.591 -1.190 -4.546
263 HB3 ARG 30 HB3 ARG 30 10.619 -2.617 -4.595
264 HG2 ARG 30 HG2 ARG 30 9.523 -3.456 -2.543
265 HG3 ARG 30 HG3 ARG 30 8.464 -2.048 -2.559
266 HD2 ARG 30 HD2 ARG 30 7.588 -2.741 -4.741
267 HD3 ARG 30 HD3 ARG 30 8.662 -4.140 -4.719
268 HE ARG 30 HE ARG 30 6.747 -3.846 -2.520
269 HH11 ARG 30 HH11 ARG 30 7.651 -5.626 -5.467
270 HH12 ARG 30 HH12 ARG 30 6.518 -6.865 -5.183
271 HH21 ARG 30 HH21 ARG 30 5.244 -5.460 -2.209
272 HH22 ARG 30 HH22 ARG 30 5.107 -6.822 -3.232
273 H LYS 31 H LYS 31 13.010 -2.285 -4.364
274 HA LYS 31 HA LYS 31 14.664 0.023 -4.309
275 HB2 LYS 31 HB2 LYS 31 15.094 -2.533 -5.845
276 HB3 LYS 31 HB3 LYS 31 16.323 -1.348 -5.420
277 HG2 LYS 31 HG2 LYS 31 16.045 -1.811 -3.066
278 HG3 LYS 31 HG3 LYS 31 14.704 -2.896 -3.405
279 HD2 LYS 31 HD2 LYS 31 16.448 -4.378 -3.087
280 HD3 LYS 31 HD3 LYS 31 16.463 -4.184 -4.839
281 HE2 LYS 31 HE2 LYS 31 18.281 -2.662 -4.730
282 HE3 LYS 31 HE3 LYS 31 18.185 -2.558 -2.974
283 HZ1 LYS 31 HZ1 LYS 31 19.965 -4.015 -3.481
284 HZ2 LYS 31 HZ2 LYS 31 19.069 -4.868 -4.607
285 HZ3 LYS 31 HZ3 LYS 31 18.705 -5.010 -2.982
286 H ASP 32 H ASP 32 12.240 -0.915 -6.463
287 HA ASP 32 HA ASP 32 13.315 0.880 -8.549
288 HB2 ASP 32 HB2 ASP 32 12.718 -1.552 -9.116
289 HB3 ASP 32 HB3 ASP 32 11.043 -1.087 -8.887
290 H MET 33 H MET 33 11.625 1.201 -5.957
291 HA MET 33 HA MET 33 9.134 2.429 -6.811
292 HB2 MET 33 HB2 MET 33 9.563 1.146 -4.684
293 HB3 MET 33 HB3 MET 33 10.531 2.505 -4.152
294 HG2 MET 33 HG2 MET 33 8.684 3.898 -3.996
295 HG3 MET 33 HG3 MET 33 7.678 2.815 -4.967
296 HE1 MET 33 HE1 MET 33 7.776 0.031 -3.992
297 HE2 MET 33 HE2 MET 33 6.255 0.930 -4.048
298 HE3 MET 33 HE3 MET 33 6.684 0.004 -2.609
299 H LYS 34 H LYS 34 9.021 4.422 -7.643
300 HA LYS 34 HA LYS 34 11.154 6.327 -7.052
301 HB2 LYS 34 HB2 LYS 34 9.340 5.988 -9.415
302 HB3 LYS 34 HB3 LYS 34 10.514 7.273 -9.228
303 HG2 LYS 34 HG2 LYS 34 12.324 5.686 -9.287
304 HG3 LYS 34 HG3 LYS 34 11.176 4.343 -9.284
305 HD2 LYS 34 HD2 LYS 34 10.267 5.248 -11.433
306 HD3 LYS 34 HD3 LYS 34 11.620 6.380 -11.452
307 HE2 LYS 34 HE2 LYS 34 11.874 3.383 -11.333
308 HE3 LYS 34 HE3 LYS 34 12.019 4.346 -12.799
309 HZ1 LYS 34 HZ1 LYS 34 13.818 4.529 -10.419
310 HZ2 LYS 34 HZ2 LYS 34 13.932 5.481 -11.807
311 HZ3 LYS 34 HZ3 LYS 34 14.189 3.836 -11.904
312 H VAL 35 H VAL 35 10.514 8.526 -6.809
313 HA VAL 35 HA VAL 35 8.092 8.898 -5.312
314 HB VAL 35 HB VAL 35 9.965 11.091 -6.219
315 HG11 VAL 35 HG11 VAL 35 8.303 10.844 -3.707
316 HG12 VAL 35 HG12 VAL 35 7.843 11.758 -5.141
317 HG13 VAL 35 HG13 VAL 35 9.265 12.235 -4.208
318 HG21 VAL 35 HG21 VAL 35 11.347 9.365 -5.240
319 HG22 VAL 35 HG22 VAL 35 10.250 9.266 -3.864
320 HG23 VAL 35 HG23 VAL 35 11.212 10.727 -4.115
321 H GLY 36 H GLY 36 6.257 10.044 -5.877
322 HA2 GLY 36 HA2 GLY 36 5.101 11.680 -7.104
323 HA3 GLY 36 HA3 GLY 36 6.282 11.512 -8.392
324 H GLN 37 H GLN 37 6.013 8.563 -8.252
325 HA GLN 37 HA GLN 37 3.753 8.504 -10.079
326 HB2 GLN 37 HB2 GLN 37 4.661 6.405 -10.910
327 HB3 GLN 37 HB3 GLN 37 5.899 7.649 -10.905
328 HG2 GLN 37 HG2 GLN 37 6.796 6.682 -8.808
329 HG3 GLN 37 HG3 GLN 37 5.596 5.396 -8.929
330 HE21 GLN 37 HE21 GLN 37 7.114 3.791 -9.121
331 HE22 GLN 37 HE22 GLN 37 8.073 3.590 -10.544
332 H GLN 38 H GLN 38 2.271 6.752 -10.082
333 HA GLN 38 HA GLN 38 1.492 5.912 -7.413
334 HB2 GLN 38 HB2 GLN 38 -0.228 6.868 -8.931
335 HB3 GLN 38 HB3 GLN 38 0.097 5.588 -10.084
336 HG2 GLN 38 HG2 GLN 38 -0.623 3.944 -8.363
337 HG3 GLN 38 HG3 GLN 38 -1.104 5.299 -7.343
338 HE21 GLN 38 HE21 GLN 38 -2.955 6.475 -7.884
339 HE22 GLN 38 HE22 GLN 38 -4.050 5.932 -9.086
340 H VAL 39 H VAL 39 2.027 4.033 -6.686
341 HA VAL 39 HA VAL 39 3.047 2.066 -8.588
342 HB VAL 39 HB VAL 39 4.482 1.204 -6.806
343 HG11 VAL 39 HG11 VAL 39 4.830 4.158 -7.235
344 HG12 VAL 39 HG12 VAL 39 5.443 2.861 -8.271
345 HG13 VAL 39 HG13 VAL 39 6.070 3.060 -6.634
346 HG21 VAL 39 HG21 VAL 39 3.485 3.518 -5.136
347 HG22 VAL 39 HG22 VAL 39 4.771 2.397 -4.685
348 HG23 VAL 39 HG23 VAL 39 3.115 1.815 -4.871
349 H SER 40 H SER 40 2.561 -0.073 -8.211
350 HA SER 40 HA SER 40 0.247 -0.536 -6.552
351 HB2 SER 40 HB2 SER 40 1.697 -2.510 -8.304
352 HB3 SER 40 HB3 SER 40 0.006 -2.536 -7.796
353 HG SER 40 HG SER 40 0.415 -1.903 -9.977
354 H PHE 41 H PHE 41 0.685 -1.119 -4.532
355 HA PHE 41 HA PHE 41 3.147 -2.641 -4.047
356 HB2 PHE 41 HB2 PHE 41 3.220 -1.650 -1.768
357 HB3 PHE 41 HB3 PHE 41 3.477 -0.471 -3.032
358 HD1 PHE 41 HD1 PHE 41 1.573 1.110 -3.595
359 HD2 PHE 41 HD2 PHE 41 1.464 -1.449 -0.189
360 HE1 PHE 41 HE1 PHE 41 -0.178 2.502 -2.594
361 HE2 PHE 41 HE2 PHE 41 -0.284 -0.056 0.804
362 HZ PHE 41 HZ PHE 41 -1.111 1.924 -0.400
363 H GLU 42 H GLU 42 2.900 -3.774 -1.843
364 HA GLU 42 HA GLU 42 0.280 -5.029 -2.012
365 HB2 GLU 42 HB2 GLU 42 2.870 -6.199 -1.030
366 HB3 GLU 42 HB3 GLU 42 1.323 -7.034 -1.159
367 HG2 GLU 42 HG2 GLU 42 1.323 -6.523 -3.567
368 HG3 GLU 42 HG3 GLU 42 2.968 -5.919 -3.402
369 H ASN 43 H ASN 43 -0.397 -6.079 0.036
370 HA ASN 43 HA ASN 43 -0.502 -4.012 2.041
371 HB2 ASN 43 HB2 ASN 43 -1.815 -6.741 1.822
372 HB3 ASN 43 HB3 ASN 43 -1.876 -5.833 3.324
373 HD21 ASN 43 HD21 ASN 43 -2.150 -4.739 -0.059
374 HD22 ASN 43 HD22 ASN 43 -3.717 -4.051 0.133
375 H GLU 44 H GLU 44 1.116 -6.920 1.422
376 HA GLU 44 HA GLU 44 2.341 -7.395 3.862
377 HB2 GLU 44 HB2 GLU 44 3.344 -7.946 1.079
378 HB3 GLU 44 HB3 GLU 44 3.817 -8.784 2.552
379 HG2 GLU 44 HG2 GLU 44 2.284 -10.278 1.849
380 HG3 GLU 44 HG3 GLU 44 1.181 -9.182 2.661
381 H ASP 45 H ASP 45 2.835 -4.880 1.510
382 HA ASP 45 HA ASP 45 5.614 -4.374 2.247
383 HB2 ASP 45 HB2 ASP 45 3.711 -2.878 0.445
384 HB3 ASP 45 HB3 ASP 45 5.294 -2.261 0.873
385 H ILE 46 H ILE 46 2.572 -3.578 3.365
386 HA ILE 46 HA ILE 46 3.103 -0.907 4.144
387 HB ILE 46 HB ILE 46 0.928 -2.777 5.143
388 HG12 ILE 46 HG12 ILE 46 0.783 -0.678 2.975
389 HG13 ILE 46 HG13 ILE 46 1.020 -2.388 2.655
390 HG21 ILE 46 HG21 ILE 46 1.347 0.197 5.384
391 HG22 ILE 46 HG22 ILE 46 1.006 -0.991 6.659
392 HG23 ILE 46 HG23 ILE 46 -0.248 -0.547 5.514
393 HD11 ILE 46 HD11 ILE 46 -1.153 -2.844 3.720
394 HD12 ILE 46 HD12 ILE 46 -1.269 -1.779 2.321
395 HD13 ILE 46 HD13 ILE 46 -1.377 -1.108 3.950
396 H TYR 47 H TYR 47 4.099 -0.125 5.807
397 HA TYR 47 HA TYR 47 5.552 -1.852 7.575
398 HB2 TYR 47 HB2 TYR 47 5.673 0.905 6.765
399 HB3 TYR 47 HB3 TYR 47 5.723 0.797 8.524
400 HD1 TYR 47 HD1 TYR 47 7.570 0.412 5.472
401 HD2 TYR 47 HD2 TYR 47 7.490 -0.684 9.579
402 HE1 TYR 47 HE1 TYR 47 9.967 -0.153 5.359
403 HE2 TYR 47 HE2 TYR 47 9.883 -1.251 9.483
404 HH TYR 47 HH TYR 47 11.516 -1.910 7.802
405 H ASN 48 H ASN 48 2.498 -0.719 7.656
406 HA ASN 48 HA ASN 48 2.239 -0.553 10.552
407 HB2 ASN 48 HB2 ASN 48 0.081 -0.578 8.410
408 HB3 ASN 48 HB3 ASN 48 -0.220 -0.413 10.128
409 HD21 ASN 48 HD21 ASN 48 -0.879 1.391 8.005
410 HD22 ASN 48 HD22 ASN 48 -0.125 2.897 8.402
411 H VAL 49 H VAL 49 2.467 -2.915 8.235
412 HA VAL 49 HA VAL 49 1.142 -4.893 9.914
413 HB VAL 49 HB VAL 49 2.044 -5.198 7.032
414 HG11 VAL 49 HG11 VAL 49 0.227 -6.899 8.726
415 HG12 VAL 49 HG12 VAL 49 1.894 -7.279 8.299
416 HG13 VAL 49 HG13 VAL 49 0.658 -7.206 7.044
417 HG21 VAL 49 HG21 VAL 49 -0.298 -4.987 6.372
418 HG22 VAL 49 HG22 VAL 49 0.250 -3.519 7.183
419 HG23 VAL 49 HG23 VAL 49 -0.750 -4.684 8.050
420 H ARG 50 H ARG 50 2.787 -5.088 11.341
421 HA ARG 50 HA ARG 50 5.190 -6.396 10.322
422 HB2 ARG 50 HB2 ARG 50 6.532 -5.075 11.994
423 HB3 ARG 50 HB3 ARG 50 5.908 -4.129 10.651
424 HG2 ARG 50 HG2 ARG 50 4.041 -3.403 12.122
425 HG3 ARG 50 HG3 ARG 50 4.845 -4.221 13.463
426 HD2 ARG 50 HD2 ARG 50 6.819 -2.799 13.095
427 HD3 ARG 50 HD3 ARG 50 5.953 -1.962 11.809
428 HE ARG 50 HE ARG 50 4.266 -1.694 13.847
429 HH11 ARG 50 HH11 ARG 50 7.747 -1.103 13.651
430 HH12 ARG 50 HH12 ARG 50 7.747 0.117 14.836
431 HH21 ARG 50 HH21 ARG 50 4.281 -0.009 15.519
432 HH22 ARG 50 HH22 ARG 50 5.739 0.752 15.905
433 H GLY 51 H GLY 51 2.614 -7.084 11.690
434 HA2 GLY 51 HA2 GLY 51 3.723 -8.263 14.142
435 HA3 GLY 51 HA3 GLY 51 2.028 -7.852 13.910
436 H LYS 52 H LYS 52 3.455 -9.123 11.148
437 HA LYS 52 HA LYS 52 2.176 -11.715 11.626
438 HB2 LYS 52 HB2 LYS 52 3.146 -10.430 9.042
439 HB3 LYS 52 HB3 LYS 52 2.489 -12.044 9.157
440 HG2 LYS 52 HG2 LYS 52 0.343 -10.995 9.962
441 HG3 LYS 52 HG3 LYS 52 1.053 -9.433 9.544
442 HD2 LYS 52 HD2 LYS 52 1.418 -10.245 7.227
443 HD3 LYS 52 HD3 LYS 52 0.631 -11.758 7.656
444 HE2 LYS 52 HE2 LYS 52 -0.671 -9.036 7.780
445 HE3 LYS 52 HE3 LYS 52 -0.849 -10.166 6.447
446 HZ1 LYS 52 HZ1 LYS 52 -2.724 -10.309 7.939
447 HZ2 LYS 52 HZ2 LYS 52 -1.709 -10.659 9.246
448 HZ3 LYS 52 HZ3 LYS 52 -1.851 -11.745 7.964
Start of MODEL 11
1 H1 SER 0 H1 SER 0 -1.937 -12.179 -4.579
2 H2 SER 0 H2 SER 0 -1.547 -12.137 -2.945
3 H3 SER 0 H3 SER 0 -0.366 -12.551 -4.100
4 HA SER 0 HA SER 0 -0.083 -10.307 -3.327
5 HB2 SER 0 HB2 SER 0 0.421 -11.129 -5.710
6 HB3 SER 0 HB3 SER 0 -1.085 -10.351 -6.179
7 HG SER 0 HG SER 0 1.358 -9.251 -5.678
8 H MET 1 H MET 1 -1.202 -8.799 -2.272
9 HA MET 1 HA MET 1 -3.935 -8.148 -3.152
10 HB2 MET 1 HB2 MET 1 -3.764 -9.098 -0.854
11 HB3 MET 1 HB3 MET 1 -2.652 -7.800 -0.438
12 HG2 MET 1 HG2 MET 1 -4.822 -7.302 0.445
13 HG3 MET 1 HG3 MET 1 -4.436 -6.167 -0.842
14 HE1 MET 1 HE1 MET 1 -7.373 -6.838 0.474
15 HE2 MET 1 HE2 MET 1 -8.346 -6.655 -0.987
16 HE3 MET 1 HE3 MET 1 -7.032 -5.528 -0.656
17 H ASN 2 H ASN 2 -3.269 -6.666 -4.638
18 HA ASN 2 HA ASN 2 -1.376 -4.659 -3.863
19 HB2 ASN 2 HB2 ASN 2 -2.537 -5.445 -6.486
20 HB3 ASN 2 HB3 ASN 2 -1.923 -3.810 -6.310
21 HD21 ASN 2 HD21 ASN 2 0.237 -4.481 -4.510
22 HD22 ASN 2 HD22 ASN 2 1.384 -5.388 -5.359
23 H ARG 3 H ARG 3 -1.666 -2.839 -3.213
24 HA ARG 3 HA ARG 3 -4.215 -1.413 -3.581
25 HB2 ARG 3 HB2 ARG 3 -3.429 -1.921 -1.170
26 HB3 ARG 3 HB3 ARG 3 -2.058 -0.882 -1.541
27 HG2 ARG 3 HG2 ARG 3 -3.668 0.358 -0.251
28 HG3 ARG 3 HG3 ARG 3 -3.585 1.015 -1.883
29 HD2 ARG 3 HD2 ARG 3 -5.596 -1.065 -1.611
30 HD3 ARG 3 HD3 ARG 3 -5.867 0.285 -0.511
31 HE ARG 3 HE ARG 3 -6.060 1.733 -2.327
32 HH11 ARG 3 HH11 ARG 3 -6.037 -1.712 -3.276
33 HH12 ARG 3 HH12 ARG 3 -6.540 -1.426 -4.866
34 HH21 ARG 3 HH21 ARG 3 -6.743 2.088 -4.619
35 HH22 ARG 3 HH22 ARG 3 -6.947 0.738 -5.648
36 H LEU 4 H LEU 4 -3.867 0.920 -4.008
37 HA LEU 4 HA LEU 4 -1.393 1.333 -5.559
38 HB2 LEU 4 HB2 LEU 4 -4.158 2.376 -6.129
39 HB3 LEU 4 HB3 LEU 4 -2.725 2.757 -7.055
40 HG LEU 4 HG LEU 4 -4.047 0.055 -6.840
41 HD11 LEU 4 HD11 LEU 4 -3.859 2.016 -9.117
42 HD12 LEU 4 HD12 LEU 4 -5.307 1.616 -8.195
43 HD13 LEU 4 HD13 LEU 4 -4.541 0.394 -9.215
44 HD21 LEU 4 HD21 LEU 4 -2.446 -0.615 -8.594
45 HD22 LEU 4 HD22 LEU 4 -1.664 -0.232 -7.064
46 HD23 LEU 4 HD23 LEU 4 -1.613 0.927 -8.394
47 H GLY 5 H GLY 5 -0.241 3.078 -5.056
48 HA2 GLY 5 HA2 GLY 5 -1.592 5.403 -4.028
49 HA3 GLY 5 HA3 GLY 5 -0.434 4.656 -2.923
50 H ILE 6 H ILE 6 -0.301 7.235 -3.942
51 HA ILE 6 HA ILE 6 1.769 7.218 -6.015
52 HB ILE 6 HB ILE 6 0.474 9.572 -4.632
53 HG12 ILE 6 HG12 ILE 6 -0.287 8.422 -7.324
54 HG13 ILE 6 HG13 ILE 6 -1.182 8.109 -5.840
55 HG21 ILE 6 HG21 ILE 6 1.252 10.829 -6.595
56 HG22 ILE 6 HG22 ILE 6 2.018 9.370 -7.220
57 HG23 ILE 6 HG23 ILE 6 2.588 10.090 -5.713
58 HD11 ILE 6 HD11 ILE 6 -0.721 10.799 -7.082
59 HD12 ILE 6 HD12 ILE 6 -1.670 10.469 -5.616
60 HD13 ILE 6 HD13 ILE 6 -2.212 9.862 -7.180
61 H ILE 7 H ILE 7 3.832 7.485 -5.520
62 HA ILE 7 HA ILE 7 4.691 7.565 -2.825
63 HB ILE 7 HB ILE 7 6.315 8.213 -5.311
64 HG12 ILE 7 HG12 ILE 7 5.272 5.934 -5.306
65 HG13 ILE 7 HG13 ILE 7 7.028 5.907 -5.307
66 HG21 ILE 7 HG21 ILE 7 7.324 9.029 -3.199
67 HG22 ILE 7 HG22 ILE 7 8.272 7.746 -3.945
68 HG23 ILE 7 HG23 ILE 7 7.250 7.390 -2.554
69 HD11 ILE 7 HD11 ILE 7 5.844 4.256 -3.783
70 HD12 ILE 7 HD12 ILE 7 5.442 5.643 -2.773
71 HD13 ILE 7 HD13 ILE 7 7.128 5.230 -3.078
72 H TYR 8 H TYR 8 4.311 9.142 -1.636
73 HA TYR 8 HA TYR 8 4.088 11.882 -2.560
74 HB2 TYR 8 HB2 TYR 8 2.456 10.701 -1.031
75 HB3 TYR 8 HB3 TYR 8 3.708 10.725 0.196
76 HD1 TYR 8 HD1 TYR 8 4.117 12.686 1.485
77 HD2 TYR 8 HD2 TYR 8 1.473 12.817 -1.842
78 HE1 TYR 8 HE1 TYR 8 3.296 14.875 2.234
79 HE2 TYR 8 HE2 TYR 8 0.652 15.021 -1.110
80 HH TYR 8 HH TYR 8 2.166 16.933 0.970
81 H GLU 9 H GLU 9 6.147 9.802 -0.600
82 HA GLU 9 HA GLU 9 8.287 11.682 -0.580
83 HB2 GLU 9 HB2 GLU 9 6.597 12.379 1.270
84 HB3 GLU 9 HB3 GLU 9 7.165 10.947 2.108
85 HG2 GLU 9 HG2 GLU 9 9.407 11.797 2.136
86 HG3 GLU 9 HG3 GLU 9 8.914 13.196 1.185
87 H ILE 10 H ILE 10 10.149 10.710 0.683
88 HA ILE 10 HA ILE 10 9.991 7.785 0.810
89 HB ILE 10 HB ILE 10 12.233 9.525 -0.243
90 HG12 ILE 10 HG12 ILE 10 10.381 9.116 -1.788
91 HG13 ILE 10 HG13 ILE 10 11.899 8.441 -2.382
92 HG21 ILE 10 HG21 ILE 10 13.260 7.752 1.011
93 HG22 ILE 10 HG22 ILE 10 13.460 7.406 -0.709
94 HG23 ILE 10 HG23 ILE 10 12.235 6.550 0.228
95 HD11 ILE 10 HD11 ILE 10 9.571 6.957 -1.165
96 HD12 ILE 10 HD12 ILE 10 11.111 6.210 -1.592
97 HD13 ILE 10 HD13 ILE 10 10.098 6.914 -2.847
98 H GLN 11 H GLN 11 10.836 6.929 2.654
99 HA GLN 11 HA GLN 11 12.394 8.684 4.402
100 HB2 GLN 11 HB2 GLN 11 9.955 7.196 4.967
101 HB3 GLN 11 HB3 GLN 11 11.276 6.649 5.989
102 HG2 GLN 11 HG2 GLN 11 10.431 8.304 7.289
103 HG3 GLN 11 HG3 GLN 11 11.609 9.231 6.363
104 HE21 GLN 11 HE21 GLN 11 10.835 10.482 4.578
105 HE22 GLN 11 HE22 GLN 11 9.225 11.104 4.625
106 H GLY 12 H GLY 12 14.123 7.767 3.083
107 HA2 GLY 12 HA2 GLY 12 15.919 6.370 2.836
108 HA3 GLY 12 HA3 GLY 12 15.447 5.623 4.351
109 H MET 13 H MET 13 14.449 3.714 4.349
110 HA MET 13 HA MET 13 14.240 2.339 1.776
111 HB2 MET 13 HB2 MET 13 14.567 1.354 4.599
112 HB3 MET 13 HB3 MET 13 14.047 0.284 3.310
113 HG2 MET 13 HG2 MET 13 16.512 1.890 2.911
114 HG3 MET 13 HG3 MET 13 16.576 0.504 3.992
115 HE1 MET 13 HE1 MET 13 16.203 0.479 -0.580
116 HE2 MET 13 HE2 MET 13 16.432 1.876 0.476
117 HE3 MET 13 HE3 MET 13 14.837 1.142 0.304
118 H LYS 14 H LYS 14 12.302 4.049 3.624
119 HA LYS 14 HA LYS 14 9.964 2.332 3.152
120 HB2 LYS 14 HB2 LYS 14 10.182 4.666 5.049
121 HB3 LYS 14 HB3 LYS 14 8.863 3.510 4.932
122 HG2 LYS 14 HG2 LYS 14 10.212 1.763 5.807
123 HG3 LYS 14 HG3 LYS 14 11.662 2.762 5.712
124 HD2 LYS 14 HD2 LYS 14 10.621 4.309 7.350
125 HD3 LYS 14 HD3 LYS 14 9.285 3.163 7.511
126 HE2 LYS 14 HE2 LYS 14 10.832 1.437 8.218
127 HE3 LYS 14 HE3 LYS 14 12.180 2.553 8.023
128 HZ1 LYS 14 HZ1 LYS 14 9.936 2.902 9.928
129 HZ2 LYS 14 HZ2 LYS 14 11.293 3.917 9.771
130 HZ3 LYS 14 HZ3 LYS 14 11.474 2.348 10.329
131 H ALA 15 H ALA 15 8.115 3.434 2.347
132 HA ALA 15 HA ALA 15 8.672 6.050 1.149
133 HB1 ALA 15 HB1 ALA 15 7.336 3.727 -0.244
134 HB2 ALA 15 HB2 ALA 15 8.948 4.359 -0.592
135 HB3 ALA 15 HB3 ALA 15 7.525 5.358 -0.889
136 H VAL 16 H VAL 16 6.956 7.387 1.029
137 HA VAL 16 HA VAL 16 4.600 6.624 2.603
138 HB VAL 16 HB VAL 16 5.428 9.377 1.614
139 HG11 VAL 16 HG11 VAL 16 3.019 9.157 1.969
140 HG12 VAL 16 HG12 VAL 16 3.743 10.237 3.162
141 HG13 VAL 16 HG13 VAL 16 3.306 8.590 3.616
142 HG21 VAL 16 HG21 VAL 16 5.691 8.185 4.364
143 HG22 VAL 16 HG22 VAL 16 5.987 9.867 3.936
144 HG23 VAL 16 HG23 VAL 16 7.024 8.594 3.272
145 H VAL 17 H VAL 17 2.949 5.970 1.445
146 HA VAL 17 HA VAL 17 2.672 7.028 -1.270
147 HB VAL 17 HB VAL 17 1.026 5.050 -1.526
148 HG11 VAL 17 HG11 VAL 17 4.005 4.634 -1.428
149 HG12 VAL 17 HG12 VAL 17 3.049 5.210 -2.793
150 HG13 VAL 17 HG13 VAL 17 2.857 3.558 -2.218
151 HG21 VAL 17 HG21 VAL 17 1.249 3.187 -0.149
152 HG22 VAL 17 HG22 VAL 17 1.284 4.541 0.987
153 HG23 VAL 17 HG23 VAL 17 2.782 3.751 0.514
154 H LEU 18 H LEU 18 1.056 8.224 -1.708
155 HA LEU 18 HA LEU 18 -1.141 8.493 0.177
156 HB2 LEU 18 HB2 LEU 18 -0.155 10.538 -0.640
157 HB3 LEU 18 HB3 LEU 18 -0.318 10.020 -2.302
158 HG LEU 18 HG LEU 18 -2.795 10.151 -2.041
159 HD11 LEU 18 HD11 LEU 18 -2.105 11.385 0.619
160 HD12 LEU 18 HD12 LEU 18 -2.940 9.855 0.364
161 HD13 LEU 18 HD13 LEU 18 -3.700 11.368 -0.131
162 HD21 LEU 18 HD21 LEU 18 -1.212 12.648 -1.470
163 HD22 LEU 18 HD22 LEU 18 -2.883 12.614 -2.019
164 HD23 LEU 18 HD23 LEU 18 -1.603 11.983 -3.057
165 H THR 19 H THR 19 -2.551 6.919 -0.111
166 HA THR 19 HA THR 19 -2.677 5.368 -2.443
167 HB THR 19 HB THR 19 -4.611 4.294 -1.299
168 HG1 THR 19 HG1 THR 19 -4.917 4.999 0.883
169 HG21 THR 19 HG21 THR 19 -2.150 4.753 0.392
170 HG22 THR 19 HG22 THR 19 -2.291 3.570 -0.910
171 HG23 THR 19 HG23 THR 19 -3.267 3.396 0.550
172 H SER 20 H SER 20 -4.838 4.833 -3.480
173 HA SER 20 HA SER 20 -5.951 7.075 -4.743
174 HB2 SER 20 HB2 SER 20 -7.657 5.242 -5.462
175 HB3 SER 20 HB3 SER 20 -5.976 5.075 -5.973
176 HG SER 20 HG SER 20 -7.232 3.771 -3.752
177 H GLU 21 H GLU 21 -6.492 5.652 -1.754
178 HA GLU 21 HA GLU 21 -9.204 6.509 -1.408
179 HB2 GLU 21 HB2 GLU 21 -7.213 5.170 0.386
180 HB3 GLU 21 HB3 GLU 21 -8.840 5.610 0.889
181 HG2 GLU 21 HG2 GLU 21 -9.032 3.389 0.302
182 HG3 GLU 21 HG3 GLU 21 -9.641 4.258 -1.086
183 H GLY 22 H GLY 22 -6.106 7.932 -1.209
184 HA2 GLY 22 HA2 GLY 22 -5.586 10.064 -0.554
185 HA3 GLY 22 HA3 GLY 22 -7.170 10.210 0.193
186 H GLU 23 H GLU 23 -5.103 7.498 0.940
187 HA GLU 23 HA GLU 23 -4.702 8.649 3.600
188 HB2 GLU 23 HB2 GLU 23 -4.830 5.739 2.786
189 HB3 GLU 23 HB3 GLU 23 -4.613 6.348 4.422
190 HG2 GLU 23 HG2 GLU 23 -6.824 7.398 4.312
191 HG3 GLU 23 HG3 GLU 23 -7.025 6.750 2.687
192 H PHE 24 H PHE 24 -2.644 8.613 4.475
193 HA PHE 24 HA PHE 24 -0.532 8.038 2.533
194 HB2 PHE 24 HB2 PHE 24 -0.343 9.429 5.222
195 HB3 PHE 24 HB3 PHE 24 0.947 9.240 4.048
196 HD1 PHE 24 HD1 PHE 24 1.235 10.739 2.304
197 HD2 PHE 24 HD2 PHE 24 -2.298 10.892 4.657
198 HE1 PHE 24 HE1 PHE 24 0.640 12.897 1.281
199 HE2 PHE 24 HE2 PHE 24 -2.896 13.050 3.642
200 HZ PHE 24 HZ PHE 24 -1.424 14.054 1.954
201 H LEU 25 H LEU 25 0.250 6.146 2.594
202 HA LEU 25 HA LEU 25 0.382 4.706 5.152
203 HB2 LEU 25 HB2 LEU 25 -0.145 3.832 2.352
204 HB3 LEU 25 HB3 LEU 25 0.723 2.730 3.399
205 HG LEU 25 HG LEU 25 -1.218 2.730 4.953
206 HD11 LEU 25 HD11 LEU 25 -2.565 4.374 2.819
207 HD12 LEU 25 HD12 LEU 25 -2.131 4.934 4.433
208 HD13 LEU 25 HD13 LEU 25 -3.347 3.669 4.232
209 HD21 LEU 25 HD21 LEU 25 -0.973 1.059 3.179
210 HD22 LEU 25 HD22 LEU 25 -1.951 2.070 2.114
211 HD23 LEU 25 HD23 LEU 25 -2.659 1.387 3.581
212 H ILE 26 H ILE 26 2.255 3.606 5.619
213 HA ILE 26 HA ILE 26 4.654 4.562 4.227
214 HB ILE 26 HB ILE 26 4.427 3.223 6.945
215 HG12 ILE 26 HG12 ILE 26 3.277 5.385 7.031
216 HG13 ILE 26 HG13 ILE 26 4.767 5.445 7.959
217 HG21 ILE 26 HG21 ILE 26 6.709 4.025 7.309
218 HG22 ILE 26 HG22 ILE 26 6.724 4.719 5.688
219 HG23 ILE 26 HG23 ILE 26 6.612 2.971 5.898
220 HD11 ILE 26 HD11 ILE 26 4.301 6.595 5.215
221 HD12 ILE 26 HD12 ILE 26 5.848 6.589 6.055
222 HD13 ILE 26 HD13 ILE 26 4.483 7.489 6.726
223 H ILE 27 H ILE 27 5.485 3.114 2.905
224 HA ILE 27 HA ILE 27 4.977 0.270 3.467
225 HB ILE 27 HB ILE 27 4.881 -0.163 1.065
226 HG12 ILE 27 HG12 ILE 27 4.722 2.821 0.609
227 HG13 ILE 27 HG13 ILE 27 6.237 1.939 0.500
228 HG21 ILE 27 HG21 ILE 27 2.666 0.868 0.617
229 HG22 ILE 27 HG22 ILE 27 2.886 1.858 2.063
230 HG23 ILE 27 HG23 ILE 27 2.792 0.103 2.200
231 HD11 ILE 27 HD11 ILE 27 5.311 0.571 -1.286
232 HD12 ILE 27 HD12 ILE 27 5.254 2.293 -1.673
233 HD13 ILE 27 HD13 ILE 27 3.788 1.454 -1.173
234 H ARG 28 H ARG 28 6.457 -1.146 2.403
235 HA ARG 28 HA ARG 28 9.199 -0.550 2.727
236 HB2 ARG 28 HB2 ARG 28 8.013 -2.701 0.961
237 HB3 ARG 28 HB3 ARG 28 9.637 -2.666 1.626
238 HG2 ARG 28 HG2 ARG 28 8.687 -2.894 3.881
239 HG3 ARG 28 HG3 ARG 28 7.078 -2.990 3.171
240 HD2 ARG 28 HD2 ARG 28 9.366 -4.889 2.699
241 HD3 ARG 28 HD3 ARG 28 7.929 -5.204 3.666
242 HE ARG 28 HE ARG 28 7.301 -4.525 0.943
243 HH11 ARG 28 HH11 ARG 28 8.273 -7.201 3.033
244 HH12 ARG 28 HH12 ARG 28 7.660 -8.395 1.980
245 HH21 ARG 28 HH21 ARG 28 6.438 -6.096 -0.409
246 HH22 ARG 28 HH22 ARG 28 6.569 -7.768 -0.051
247 H ARG 29 H ARG 29 10.494 0.569 1.416
248 HA ARG 29 HA ARG 29 9.456 1.296 -1.163
249 HB2 ARG 29 HB2 ARG 29 10.572 2.987 0.266
250 HB3 ARG 29 HB3 ARG 29 12.070 2.073 0.123
251 HG2 ARG 29 HG2 ARG 29 11.663 2.321 -2.416
252 HG3 ARG 29 HG3 ARG 29 10.616 3.654 -1.947
253 HD2 ARG 29 HD2 ARG 29 12.520 4.620 -0.690
254 HD3 ARG 29 HD3 ARG 29 13.526 3.305 -1.308
255 HE ARG 29 HE ARG 29 12.261 4.544 -3.464
256 HH11 ARG 29 HH11 ARG 29 14.817 5.228 -1.109
257 HH12 ARG 29 HH12 ARG 29 15.635 6.297 -2.128
258 HH21 ARG 29 HH21 ARG 29 13.358 6.016 -4.850
259 HH22 ARG 29 HH22 ARG 29 14.800 6.750 -4.337
260 H ARG 30 H ARG 30 10.032 0.397 -2.971
261 HA ARG 30 HA ARG 30 12.233 -1.507 -2.950
262 HB2 ARG 30 HB2 ARG 30 10.098 -1.165 -5.082
263 HB3 ARG 30 HB3 ARG 30 11.175 -2.536 -4.848
264 HG2 ARG 30 HG2 ARG 30 10.001 -3.178 -2.827
265 HG3 ARG 30 HG3 ARG 30 8.971 -1.747 -2.945
266 HD2 ARG 30 HD2 ARG 30 8.246 -2.609 -5.205
267 HD3 ARG 30 HD3 ARG 30 9.083 -4.108 -4.808
268 HE ARG 30 HE ARG 30 7.343 -3.671 -2.710
269 HH11 ARG 30 HH11 ARG 30 7.025 -4.014 -6.229
270 HH12 ARG 30 HH12 ARG 30 5.486 -4.730 -6.147
271 HH21 ARG 30 HH21 ARG 30 5.166 -4.666 -2.618
272 HH22 ARG 30 HH22 ARG 30 4.416 -5.125 -4.037
273 H LYS 31 H LYS 31 13.529 -1.399 -5.099
274 HA LYS 31 HA LYS 31 14.613 1.204 -5.186
275 HB2 LYS 31 HB2 LYS 31 15.182 -1.240 -6.832
276 HB3 LYS 31 HB3 LYS 31 16.016 0.281 -7.110
277 HG2 LYS 31 HG2 LYS 31 16.805 0.252 -4.777
278 HG3 LYS 31 HG3 LYS 31 16.019 -1.306 -4.542
279 HD2 LYS 31 HD2 LYS 31 18.306 -1.767 -4.967
280 HD3 LYS 31 HD3 LYS 31 17.446 -2.174 -6.449
281 HE2 LYS 31 HE2 LYS 31 19.488 -0.978 -6.981
282 HE3 LYS 31 HE3 LYS 31 18.103 0.037 -7.379
283 HZ1 LYS 31 HZ1 LYS 31 19.788 0.262 -4.933
284 HZ2 LYS 31 HZ2 LYS 31 18.449 1.204 -5.258
285 HZ3 LYS 31 HZ3 LYS 31 19.799 1.319 -6.249
286 H ASP 32 H ASP 32 12.083 -0.111 -7.026
287 HA ASP 32 HA ASP 32 12.410 1.651 -9.283
288 HB2 ASP 32 HB2 ASP 32 11.258 -0.593 -9.408
289 HB3 ASP 32 HB3 ASP 32 9.906 0.130 -8.542
290 H MET 33 H MET 33 11.191 2.003 -6.171
291 HA MET 33 HA MET 33 8.995 3.733 -6.657
292 HB2 MET 33 HB2 MET 33 10.555 2.939 -4.270
293 HB3 MET 33 HB3 MET 33 9.655 4.439 -4.171
294 HG2 MET 33 HG2 MET 33 8.308 2.737 -3.252
295 HG3 MET 33 HG3 MET 33 7.612 3.154 -4.812
296 HE1 MET 33 HE1 MET 33 6.168 0.880 -4.516
297 HE2 MET 33 HE2 MET 33 7.028 0.504 -3.022
298 HE3 MET 33 HE3 MET 33 6.910 -0.705 -4.296
299 H LYS 34 H LYS 34 9.245 5.532 -7.732
300 HA LYS 34 HA LYS 34 11.258 7.450 -6.828
301 HB2 LYS 34 HB2 LYS 34 9.896 7.003 -9.469
302 HB3 LYS 34 HB3 LYS 34 10.455 8.600 -9.044
303 HG2 LYS 34 HG2 LYS 34 12.288 7.872 -10.203
304 HG3 LYS 34 HG3 LYS 34 12.731 7.303 -8.594
305 HD2 LYS 34 HD2 LYS 34 13.133 5.512 -10.109
306 HD3 LYS 34 HD3 LYS 34 11.682 5.107 -9.195
307 HE2 LYS 34 HE2 LYS 34 10.339 6.053 -11.135
308 HE3 LYS 34 HE3 LYS 34 11.857 6.136 -12.019
309 HZ1 LYS 34 HZ1 LYS 34 10.719 3.660 -10.861
310 HZ2 LYS 34 HZ2 LYS 34 12.095 3.791 -11.850
311 HZ3 LYS 34 HZ3 LYS 34 10.579 4.130 -12.476
312 H VAL 35 H VAL 35 10.460 9.570 -6.477
313 HA VAL 35 HA VAL 35 7.896 9.564 -5.262
314 HB VAL 35 HB VAL 35 9.564 12.027 -5.797
315 HG11 VAL 35 HG11 VAL 35 7.647 11.305 -3.590
316 HG12 VAL 35 HG12 VAL 35 7.367 12.446 -4.902
317 HG13 VAL 35 HG13 VAL 35 8.586 12.792 -3.671
318 HG21 VAL 35 HG21 VAL 35 11.084 10.403 -4.824
319 HG22 VAL 35 HG22 VAL 35 9.915 10.040 -3.559
320 HG23 VAL 35 HG23 VAL 35 10.672 11.633 -3.626
321 H GLY 36 H GLY 36 6.015 10.324 -6.014
322 HA2 GLY 36 HA2 GLY 36 4.768 11.887 -7.333
323 HA3 GLY 36 HA3 GLY 36 6.045 11.820 -8.539
324 H GLN 37 H GLN 37 6.060 8.793 -8.114
325 HA GLN 37 HA GLN 37 3.973 8.391 -10.116
326 HB2 GLN 37 HB2 GLN 37 5.147 6.507 -10.911
327 HB3 GLN 37 HB3 GLN 37 6.408 7.646 -10.487
328 HG2 GLN 37 HG2 GLN 37 6.705 6.423 -8.331
329 HG3 GLN 37 HG3 GLN 37 5.538 5.232 -8.902
330 HE21 GLN 37 HE21 GLN 37 6.954 3.515 -8.952
331 HE22 GLN 37 HE22 GLN 37 8.267 3.386 -10.035
332 H GLN 38 H GLN 38 2.521 6.668 -10.077
333 HA GLN 38 HA GLN 38 1.632 5.941 -7.405
334 HB2 GLN 38 HB2 GLN 38 0.005 6.775 -9.104
335 HB3 GLN 38 HB3 GLN 38 0.395 5.394 -10.117
336 HG2 GLN 38 HG2 GLN 38 -0.359 3.949 -8.167
337 HG3 GLN 38 HG3 GLN 38 -1.026 5.423 -7.475
338 HE21 GLN 38 HE21 GLN 38 -2.857 6.347 -8.402
339 HE22 GLN 38 HE22 GLN 38 -3.768 5.541 -9.606
340 H VAL 39 H VAL 39 2.067 4.045 -6.547
341 HA VAL 39 HA VAL 39 3.200 2.007 -8.319
342 HB VAL 39 HB VAL 39 4.570 1.209 -6.419
343 HG11 VAL 39 HG11 VAL 39 5.020 4.138 -6.933
344 HG12 VAL 39 HG12 VAL 39 5.459 2.846 -8.044
345 HG13 VAL 39 HG13 VAL 39 6.231 2.945 -6.462
346 HG21 VAL 39 HG21 VAL 39 4.790 2.534 -4.381
347 HG22 VAL 39 HG22 VAL 39 3.120 2.011 -4.599
348 HG23 VAL 39 HG23 VAL 39 3.579 3.669 -4.979
349 H SER 40 H SER 40 2.656 -0.116 -7.977
350 HA SER 40 HA SER 40 0.306 -0.626 -6.351
351 HB2 SER 40 HB2 SER 40 1.741 -2.668 -8.020
352 HB3 SER 40 HB3 SER 40 0.020 -2.533 -7.669
353 HG SER 40 HG SER 40 -0.025 -0.676 -9.015
354 H PHE 41 H PHE 41 0.645 -1.302 -4.322
355 HA PHE 41 HA PHE 41 3.023 -2.932 -3.769
356 HB2 PHE 41 HB2 PHE 41 3.037 -1.949 -1.483
357 HB3 PHE 41 HB3 PHE 41 3.471 -0.807 -2.737
358 HD1 PHE 41 HD1 PHE 41 1.795 0.965 -3.376
359 HD2 PHE 41 HD2 PHE 41 1.145 -1.664 -0.096
360 HE1 PHE 41 HE1 PHE 41 0.050 2.468 -2.519
361 HE2 PHE 41 HE2 PHE 41 -0.605 -0.163 0.761
362 HZ PHE 41 HZ PHE 41 -1.156 1.892 -0.445
363 H GLU 42 H GLU 42 2.678 -4.175 -1.763
364 HA GLU 42 HA GLU 42 -0.097 -5.114 -1.802
365 HB2 GLU 42 HB2 GLU 42 2.420 -6.610 -0.988
366 HB3 GLU 42 HB3 GLU 42 0.771 -7.214 -0.871
367 HG2 GLU 42 HG2 GLU 42 1.412 -8.199 -2.777
368 HG3 GLU 42 HG3 GLU 42 0.688 -6.729 -3.426
369 H ASN 43 H ASN 43 -0.750 -6.121 0.409
370 HA ASN 43 HA ASN 43 -0.550 -4.038 2.353
371 HB2 ASN 43 HB2 ASN 43 -1.675 -6.848 2.605
372 HB3 ASN 43 HB3 ASN 43 -1.676 -5.697 3.920
373 HD21 ASN 43 HD21 ASN 43 -2.331 -3.400 2.163
374 HD22 ASN 43 HD22 ASN 43 -3.998 -3.643 1.780
375 H GLU 44 H GLU 44 1.102 -6.958 1.723
376 HA GLU 44 HA GLU 44 2.496 -7.278 4.133
377 HB2 GLU 44 HB2 GLU 44 3.210 -8.062 1.310
378 HB3 GLU 44 HB3 GLU 44 4.127 -8.569 2.723
379 HG2 GLU 44 HG2 GLU 44 2.193 -9.719 3.606
380 HG3 GLU 44 HG3 GLU 44 1.209 -9.153 2.270
381 H ASP 45 H ASP 45 2.900 -5.039 1.517
382 HA ASP 45 HA ASP 45 5.594 -4.277 2.184
383 HB2 ASP 45 HB2 ASP 45 3.516 -3.001 0.428
384 HB3 ASP 45 HB3 ASP 45 5.083 -2.266 0.731
385 H ILE 46 H ILE 46 2.483 -3.495 3.308
386 HA ILE 46 HA ILE 46 3.045 -0.817 4.063
387 HB ILE 46 HB ILE 46 0.848 -2.622 5.105
388 HG12 ILE 46 HG12 ILE 46 0.771 -0.600 2.853
389 HG13 ILE 46 HG13 ILE 46 0.886 -2.338 2.625
390 HG21 ILE 46 HG21 ILE 46 1.237 -0.672 6.519
391 HG22 ILE 46 HG22 ILE 46 -0.287 -0.486 5.640
392 HG23 ILE 46 HG23 ILE 46 1.158 0.384 5.111
393 HD11 ILE 46 HD11 ILE 46 -1.282 -2.631 3.684
394 HD12 ILE 46 HD12 ILE 46 -1.385 -1.534 2.307
395 HD13 ILE 46 HD13 ILE 46 -1.391 -0.892 3.951
396 H TYR 47 H TYR 47 4.265 -0.172 5.545
397 HA TYR 47 HA TYR 47 5.336 -1.928 7.585
398 HB2 TYR 47 HB2 TYR 47 5.979 0.736 6.486
399 HB3 TYR 47 HB3 TYR 47 6.443 0.448 8.159
400 HD1 TYR 47 HD1 TYR 47 7.970 0.866 5.369
401 HD2 TYR 47 HD2 TYR 47 7.284 -2.440 7.962
402 HE1 TYR 47 HE1 TYR 47 10.035 -0.179 4.584
403 HE2 TYR 47 HE2 TYR 47 9.355 -3.498 7.159
404 HH TYR 47 HH TYR 47 10.914 -3.421 5.348
405 H ASN 48 H ASN 48 2.780 0.232 7.288
406 HA ASN 48 HA ASN 48 2.705 1.346 9.873
407 HB2 ASN 48 HB2 ASN 48 0.402 0.778 7.989
408 HB3 ASN 48 HB3 ASN 48 0.239 1.653 9.500
409 HD21 ASN 48 HD21 ASN 48 1.205 3.699 9.665
410 HD22 ASN 48 HD22 ASN 48 1.563 4.650 8.283
411 H VAL 49 H VAL 49 2.730 0.175 11.630
412 HA VAL 49 HA VAL 49 1.011 -2.182 11.751
413 HB VAL 49 HB VAL 49 3.271 -1.461 13.656
414 HG11 VAL 49 HG11 VAL 49 1.795 -4.040 13.192
415 HG12 VAL 49 HG12 VAL 49 1.567 -2.948 14.558
416 HG13 VAL 49 HG13 VAL 49 3.106 -3.791 14.346
417 HG21 VAL 49 HG21 VAL 49 4.658 -3.099 12.517
418 HG22 VAL 49 HG22 VAL 49 4.142 -1.853 11.374
419 HG23 VAL 49 HG23 VAL 49 3.359 -3.433 11.372
420 H ARG 50 H ARG 50 -0.841 -0.993 12.098
421 HA ARG 50 HA ARG 50 -0.922 0.802 14.399
422 HB2 ARG 50 HB2 ARG 50 -1.741 1.533 12.133
423 HB3 ARG 50 HB3 ARG 50 -3.014 0.336 12.275
424 HG2 ARG 50 HG2 ARG 50 -3.968 1.496 14.153
425 HG3 ARG 50 HG3 ARG 50 -2.612 2.624 14.193
426 HD2 ARG 50 HD2 ARG 50 -3.214 3.327 11.879
427 HD3 ARG 50 HD3 ARG 50 -4.655 2.320 12.000
428 HE ARG 50 HE ARG 50 -4.828 3.914 14.166
429 HH11 ARG 50 HH11 ARG 50 -4.355 4.629 10.728
430 HH12 ARG 50 HH12 ARG 50 -5.136 6.138 10.786
431 HH21 ARG 50 HH21 ARG 50 -5.912 5.963 14.241
432 HH22 ARG 50 HH22 ARG 50 -6.085 6.901 12.817
433 H GLY 51 H GLY 51 -1.122 -0.517 16.132
434 HA2 GLY 51 HA2 GLY 51 -2.966 -1.320 17.532
435 HA3 GLY 51 HA3 GLY 51 -3.452 -2.309 16.154
436 H LYS 52 H LYS 52 -3.268 -4.083 17.641
437 HA LYS 52 HA LYS 52 -0.684 -5.314 17.495
438 HB2 LYS 52 HB2 LYS 52 -0.619 -4.060 19.658
439 HB3 LYS 52 HB3 LYS 52 -2.099 -4.879 20.129
440 HG2 LYS 52 HG2 LYS 52 -0.911 -7.030 20.065
441 HG3 LYS 52 HG3 LYS 52 0.574 -6.174 19.644
442 HD2 LYS 52 HD2 LYS 52 0.598 -6.598 22.011
443 HD3 LYS 52 HD3 LYS 52 0.356 -4.875 21.753
444 HE2 LYS 52 HE2 LYS 52 -2.055 -5.153 22.133
445 HE3 LYS 52 HE3 LYS 52 -1.817 -6.883 22.366
446 HZ1 LYS 52 HZ1 LYS 52 -0.574 -6.445 24.347
447 HZ2 LYS 52 HZ2 LYS 52 -1.996 -5.553 24.433
448 HZ3 LYS 52 HZ3 LYS 52 -0.556 -4.790 24.034
Start of MODEL 12
1 H1 SER 0 H1 SER 0 -1.796 -12.042 -3.068
2 H2 SER 0 H2 SER 0 -2.870 -12.722 -1.948
3 H3 SER 0 H3 SER 0 -1.173 -12.890 -1.755
4 HA SER 0 HA SER 0 -2.187 -11.270 -0.287
5 HB2 SER 0 HB2 SER 0 -0.176 -10.192 -2.263
6 HB3 SER 0 HB3 SER 0 -0.315 -9.796 -0.547
7 HG SER 0 HG SER 0 1.251 -11.270 -0.652
8 H MET 1 H MET 1 -2.343 -8.644 -0.489
9 HA MET 1 HA MET 1 -4.345 -8.165 -2.604
10 HB2 MET 1 HB2 MET 1 -4.096 -6.694 0.026
11 HB3 MET 1 HB3 MET 1 -5.389 -6.537 -1.142
12 HG2 MET 1 HG2 MET 1 -5.944 -8.959 -0.649
13 HG3 MET 1 HG3 MET 1 -4.783 -8.827 0.679
14 HE1 MET 1 HE1 MET 1 -4.983 -7.064 2.619
15 HE2 MET 1 HE2 MET 1 -6.431 -6.129 2.985
16 HE3 MET 1 HE3 MET 1 -5.409 -5.669 1.627
17 H ASN 2 H ASN 2 -3.737 -6.677 -4.083
18 HA ASN 2 HA ASN 2 -1.409 -5.026 -3.532
19 HB2 ASN 2 HB2 ASN 2 -2.888 -5.720 -6.043
20 HB3 ASN 2 HB3 ASN 2 -1.910 -4.263 -5.996
21 HD21 ASN 2 HD21 ASN 2 0.357 -4.589 -5.267
22 HD22 ASN 2 HD22 ASN 2 1.161 -6.024 -5.765
23 H ARG 3 H ARG 3 -1.445 -2.922 -3.185
24 HA ARG 3 HA ARG 3 -4.002 -1.507 -3.435
25 HB2 ARG 3 HB2 ARG 3 -2.852 -2.079 -1.136
26 HB3 ARG 3 HB3 ARG 3 -1.842 -0.709 -1.554
27 HG2 ARG 3 HG2 ARG 3 -3.561 0.791 -1.353
28 HG3 ARG 3 HG3 ARG 3 -4.812 -0.426 -1.627
29 HD2 ARG 3 HD2 ARG 3 -4.135 -1.529 0.454
30 HD3 ARG 3 HD3 ARG 3 -3.033 -0.213 0.790
31 HE ARG 3 HE ARG 3 -5.568 0.939 0.420
32 HH11 ARG 3 HH11 ARG 3 -4.077 -1.334 2.732
33 HH12 ARG 3 HH12 ARG 3 -5.055 -0.846 4.032
34 HH21 ARG 3 HH21 ARG 3 -6.912 1.567 2.182
35 HH22 ARG 3 HH22 ARG 3 -6.723 0.838 3.708
36 H LEU 4 H LEU 4 -3.752 0.729 -4.071
37 HA LEU 4 HA LEU 4 -1.250 1.225 -5.538
38 HB2 LEU 4 HB2 LEU 4 -4.053 2.164 -6.099
39 HB3 LEU 4 HB3 LEU 4 -2.632 2.704 -6.959
40 HG LEU 4 HG LEU 4 -3.783 -0.086 -6.954
41 HD11 LEU 4 HD11 LEU 4 -4.255 0.361 -9.301
42 HD12 LEU 4 HD12 LEU 4 -3.612 1.992 -9.123
43 HD13 LEU 4 HD13 LEU 4 -5.074 1.521 -8.253
44 HD21 LEU 4 HD21 LEU 4 -2.086 -0.508 -8.741
45 HD22 LEU 4 HD22 LEU 4 -1.417 -0.291 -7.129
46 HD23 LEU 4 HD23 LEU 4 -1.319 1.022 -8.302
47 H GLY 5 H GLY 5 -0.162 3.055 -5.088
48 HA2 GLY 5 HA2 GLY 5 -1.548 5.304 -3.926
49 HA3 GLY 5 HA3 GLY 5 -0.350 4.542 -2.881
50 H ILE 6 H ILE 6 -0.307 7.146 -3.841
51 HA ILE 6 HA ILE 6 1.731 7.210 -5.941
52 HB ILE 6 HB ILE 6 0.334 9.483 -4.508
53 HG12 ILE 6 HG12 ILE 6 -0.262 8.484 -7.293
54 HG13 ILE 6 HG13 ILE 6 -1.154 7.931 -5.881
55 HG21 ILE 6 HG21 ILE 6 1.953 9.473 -7.055
56 HG22 ILE 6 HG22 ILE 6 2.485 10.106 -5.496
57 HG23 ILE 6 HG23 ILE 6 1.143 10.871 -6.346
58 HD11 ILE 6 HD11 ILE 6 -1.847 10.239 -5.440
59 HD12 ILE 6 HD12 ILE 6 -2.347 9.683 -7.037
60 HD13 ILE 6 HD13 ILE 6 -0.956 10.760 -6.873
61 H ILE 7 H ILE 7 3.798 7.521 -5.488
62 HA ILE 7 HA ILE 7 4.697 7.558 -2.786
63 HB ILE 7 HB ILE 7 6.270 8.212 -5.291
64 HG12 ILE 7 HG12 ILE 7 5.252 5.954 -5.304
65 HG13 ILE 7 HG13 ILE 7 7.008 5.915 -5.276
66 HG21 ILE 7 HG21 ILE 7 7.266 7.360 -2.569
67 HG22 ILE 7 HG22 ILE 7 7.305 9.014 -3.171
68 HG23 ILE 7 HG23 ILE 7 8.259 7.761 -3.971
69 HD11 ILE 7 HD11 ILE 7 5.247 5.545 -2.865
70 HD12 ILE 7 HD12 ILE 7 7.001 5.367 -2.935
71 HD13 ILE 7 HD13 ILE 7 5.962 4.239 -3.803
72 H TYR 8 H TYR 8 4.237 9.155 -1.615
73 HA TYR 8 HA TYR 8 4.095 11.855 -2.590
74 HB2 TYR 8 HB2 TYR 8 2.501 10.755 -0.937
75 HB3 TYR 8 HB3 TYR 8 3.792 10.878 0.246
76 HD1 TYR 8 HD1 TYR 8 4.287 12.950 1.302
77 HD2 TYR 8 HD2 TYR 8 1.474 12.788 -1.873
78 HE1 TYR 8 HE1 TYR 8 3.565 15.223 1.848
79 HE2 TYR 8 HE2 TYR 8 0.735 15.073 -1.344
80 HH TYR 8 HH TYR 8 0.751 16.572 0.676
81 H GLU 9 H GLU 9 6.162 9.845 -0.565
82 HA GLU 9 HA GLU 9 8.368 11.628 -0.794
83 HB2 GLU 9 HB2 GLU 9 6.853 12.618 1.050
84 HB3 GLU 9 HB3 GLU 9 7.291 11.208 2.001
85 HG2 GLU 9 HG2 GLU 9 9.632 11.855 1.911
86 HG3 GLU 9 HG3 GLU 9 9.223 13.237 0.898
87 H ILE 10 H ILE 10 10.257 10.666 0.417
88 HA ILE 10 HA ILE 10 9.954 7.765 0.740
89 HB ILE 10 HB ILE 10 12.252 9.364 -0.421
90 HG12 ILE 10 HG12 ILE 10 10.356 8.947 -1.953
91 HG13 ILE 10 HG13 ILE 10 11.842 8.175 -2.497
92 HG21 ILE 10 HG21 ILE 10 13.448 7.260 -0.746
93 HG22 ILE 10 HG22 ILE 10 12.147 6.393 0.072
94 HG23 ILE 10 HG23 ILE 10 13.124 7.555 0.965
95 HD11 ILE 10 HD11 ILE 10 9.475 6.859 -1.176
96 HD12 ILE 10 HD12 ILE 10 10.987 6.043 -1.567
97 HD13 ILE 10 HD13 ILE 10 9.981 6.700 -2.860
98 H GLN 11 H GLN 11 10.887 6.882 2.532
99 HA GLN 11 HA GLN 11 12.411 8.645 4.312
100 HB2 GLN 11 HB2 GLN 11 10.118 6.857 4.864
101 HB3 GLN 11 HB3 GLN 11 11.462 6.714 5.983
102 HG2 GLN 11 HG2 GLN 11 10.329 8.323 7.056
103 HG3 GLN 11 HG3 GLN 11 11.212 9.368 5.945
104 HE21 GLN 11 HE21 GLN 11 10.132 10.338 4.267
105 HE22 GLN 11 HE22 GLN 11 8.410 10.420 4.217
106 H GLY 12 H GLY 12 14.194 7.796 3.001
107 HA2 GLY 12 HA2 GLY 12 16.021 6.435 2.803
108 HA3 GLY 12 HA3 GLY 12 15.476 5.609 4.263
109 H MET 13 H MET 13 14.566 3.644 4.098
110 HA MET 13 HA MET 13 14.126 2.630 1.391
111 HB2 MET 13 HB2 MET 13 14.907 1.216 3.927
112 HB3 MET 13 HB3 MET 13 14.253 0.340 2.553
113 HG2 MET 13 HG2 MET 13 16.127 1.465 1.207
114 HG3 MET 13 HG3 MET 13 16.837 1.832 2.776
115 HE1 MET 13 HE1 MET 13 14.859 -1.333 1.410
116 HE2 MET 13 HE2 MET 13 16.215 -2.381 1.003
117 HE3 MET 13 HE3 MET 13 15.979 -0.868 0.132
118 H LYS 14 H LYS 14 12.364 4.129 3.307
119 HA LYS 14 HA LYS 14 10.039 2.341 3.054
120 HB2 LYS 14 HB2 LYS 14 10.360 4.683 4.941
121 HB3 LYS 14 HB3 LYS 14 8.988 3.591 4.859
122 HG2 LYS 14 HG2 LYS 14 10.404 1.759 5.618
123 HG3 LYS 14 HG3 LYS 14 11.781 2.861 5.696
124 HD2 LYS 14 HD2 LYS 14 10.487 4.247 7.311
125 HD3 LYS 14 HD3 LYS 14 9.249 2.990 7.317
126 HE2 LYS 14 HE2 LYS 14 10.848 1.368 8.097
127 HE3 LYS 14 HE3 LYS 14 12.142 2.570 8.035
128 HZ1 LYS 14 HZ1 LYS 14 10.937 3.833 9.730
129 HZ2 LYS 14 HZ2 LYS 14 11.363 2.295 10.266
130 HZ3 LYS 14 HZ3 LYS 14 9.774 2.613 9.830
131 H ALA 15 H ALA 15 8.080 3.499 2.440
132 HA ALA 15 HA ALA 15 8.595 6.064 1.133
133 HB1 ALA 15 HB1 ALA 15 8.810 4.322 -0.570
134 HB2 ALA 15 HB2 ALA 15 7.403 5.347 -0.853
135 HB3 ALA 15 HB3 ALA 15 7.195 3.733 -0.174
136 H VAL 16 H VAL 16 6.915 7.405 1.078
137 HA VAL 16 HA VAL 16 4.552 6.728 2.689
138 HB VAL 16 HB VAL 16 5.378 9.409 1.521
139 HG11 VAL 16 HG11 VAL 16 3.739 10.383 3.036
140 HG12 VAL 16 HG12 VAL 16 3.306 8.777 3.625
141 HG13 VAL 16 HG13 VAL 16 2.971 9.222 1.950
142 HG21 VAL 16 HG21 VAL 16 6.998 8.714 3.181
143 HG22 VAL 16 HG22 VAL 16 5.688 8.380 4.322
144 HG23 VAL 16 HG23 VAL 16 6.001 10.036 3.804
145 H VAL 17 H VAL 17 2.921 5.948 1.537
146 HA VAL 17 HA VAL 17 2.619 6.955 -1.187
147 HB VAL 17 HB VAL 17 1.052 4.948 -1.484
148 HG11 VAL 17 HG11 VAL 17 3.150 5.109 -2.619
149 HG12 VAL 17 HG12 VAL 17 2.937 3.461 -2.032
150 HG13 VAL 17 HG13 VAL 17 4.012 4.570 -1.180
151 HG21 VAL 17 HG21 VAL 17 0.850 4.282 0.826
152 HG22 VAL 17 HG22 VAL 17 2.589 4.008 0.934
153 HG23 VAL 17 HG23 VAL 17 1.594 2.982 -0.104
154 H LEU 18 H LEU 18 1.061 8.200 -1.627
155 HA LEU 18 HA LEU 18 -1.173 8.497 0.201
156 HB2 LEU 18 HB2 LEU 18 -0.191 10.535 -0.697
157 HB3 LEU 18 HB3 LEU 18 -0.337 9.938 -2.332
158 HG LEU 18 HG LEU 18 -2.822 10.050 -2.089
159 HD11 LEU 18 HD11 LEU 18 -2.964 9.903 0.343
160 HD12 LEU 18 HD12 LEU 18 -3.760 11.355 -0.264
161 HD13 LEU 18 HD13 LEU 18 -2.165 11.472 0.476
162 HD21 LEU 18 HD21 LEU 18 -2.960 12.470 -2.288
163 HD22 LEU 18 HD22 LEU 18 -1.569 11.837 -3.171
164 HD23 LEU 18 HD23 LEU 18 -1.340 12.620 -1.605
165 H THR 19 H THR 19 -2.521 6.891 -0.033
166 HA THR 19 HA THR 19 -2.654 5.244 -2.323
167 HB THR 19 HB THR 19 -4.680 4.275 -1.149
168 HG1 THR 19 HG1 THR 19 -4.617 5.037 1.173
169 HG21 THR 19 HG21 THR 19 -3.311 3.302 0.673
170 HG22 THR 19 HG22 THR 19 -2.082 4.535 0.367
171 HG23 THR 19 HG23 THR 19 -2.449 3.334 -0.869
172 H SER 20 H SER 20 -4.737 4.729 -3.458
173 HA SER 20 HA SER 20 -5.881 6.994 -4.639
174 HB2 SER 20 HB2 SER 20 -7.409 5.087 -5.526
175 HB3 SER 20 HB3 SER 20 -5.695 5.072 -5.954
176 HG SER 20 HG SER 20 -6.761 3.081 -5.038
177 H GLU 21 H GLU 21 -6.353 5.632 -1.680
178 HA GLU 21 HA GLU 21 -9.163 6.256 -1.409
179 HB2 GLU 21 HB2 GLU 21 -7.161 5.211 0.578
180 HB3 GLU 21 HB3 GLU 21 -8.898 5.342 0.817
181 HG2 GLU 21 HG2 GLU 21 -9.362 3.601 -0.582
182 HG3 GLU 21 HG3 GLU 21 -7.842 3.761 -1.462
183 H GLY 22 H GLY 22 -6.155 7.815 -1.133
184 HA2 GLY 22 HA2 GLY 22 -5.824 10.036 -0.579
185 HA3 GLY 22 HA3 GLY 22 -7.406 10.055 0.190
186 H GLU 23 H GLU 23 -5.065 7.602 0.985
187 HA GLU 23 HA GLU 23 -4.699 8.923 3.582
188 HB2 GLU 23 HB2 GLU 23 -4.722 5.996 2.907
189 HB3 GLU 23 HB3 GLU 23 -4.327 6.659 4.479
190 HG2 GLU 23 HG2 GLU 23 -6.654 7.696 4.415
191 HG3 GLU 23 HG3 GLU 23 -6.954 6.586 3.071
192 H PHE 24 H PHE 24 -2.627 8.632 4.554
193 HA PHE 24 HA PHE 24 -0.527 8.148 2.576
194 HB2 PHE 24 HB2 PHE 24 -0.329 9.666 5.208
195 HB3 PHE 24 HB3 PHE 24 0.950 9.439 4.033
196 HD1 PHE 24 HD1 PHE 24 1.246 10.907 2.257
197 HD2 PHE 24 HD2 PHE 24 -2.367 11.002 4.497
198 HE1 PHE 24 HE1 PHE 24 0.588 12.976 1.109
199 HE2 PHE 24 HE2 PHE 24 -3.032 13.073 3.349
200 HZ PHE 24 HZ PHE 24 -1.553 14.057 1.652
201 H LEU 25 H LEU 25 0.289 6.262 2.736
202 HA LEU 25 HA LEU 25 0.413 4.948 5.371
203 HB2 LEU 25 HB2 LEU 25 -0.056 3.787 2.632
204 HB3 LEU 25 HB3 LEU 25 0.584 2.809 3.931
205 HG LEU 25 HG LEU 25 -1.536 3.408 5.237
206 HD11 LEU 25 HD11 LEU 25 -3.469 4.067 3.937
207 HD12 LEU 25 HD12 LEU 25 -2.457 4.271 2.510
208 HD13 LEU 25 HD13 LEU 25 -2.230 5.319 3.909
209 HD21 LEU 25 HD21 LEU 25 -1.783 1.814 2.692
210 HD22 LEU 25 HD22 LEU 25 -2.864 1.717 4.078
211 HD23 LEU 25 HD23 LEU 25 -1.176 1.229 4.242
212 H ILE 26 H ILE 26 2.316 3.975 5.961
213 HA ILE 26 HA ILE 26 4.641 4.656 4.342
214 HB ILE 26 HB ILE 26 4.526 3.403 7.112
215 HG12 ILE 26 HG12 ILE 26 3.559 5.658 7.184
216 HG13 ILE 26 HG13 ILE 26 5.113 5.632 8.001
217 HG21 ILE 26 HG21 ILE 26 6.888 4.051 7.294
218 HG22 ILE 26 HG22 ILE 26 6.837 4.658 5.639
219 HG23 ILE 26 HG23 ILE 26 6.612 2.936 5.951
220 HD11 ILE 26 HD11 ILE 26 6.132 6.639 5.994
221 HD12 ILE 26 HD12 ILE 26 4.871 7.643 6.701
222 HD13 ILE 26 HD13 ILE 26 4.538 6.701 5.245
223 H ILE 27 H ILE 27 5.463 3.183 3.050
224 HA ILE 27 HA ILE 27 4.950 0.330 3.625
225 HB ILE 27 HB ILE 27 4.857 -0.118 1.206
226 HG12 ILE 27 HG12 ILE 27 4.598 2.839 0.691
227 HG13 ILE 27 HG13 ILE 27 6.172 2.054 0.693
228 HG21 ILE 27 HG21 ILE 27 2.838 1.883 2.206
229 HG22 ILE 27 HG22 ILE 27 2.753 0.121 2.313
230 HG23 ILE 27 HG23 ILE 27 2.638 0.911 0.750
231 HD11 ILE 27 HD11 ILE 27 5.444 0.571 -1.094
232 HD12 ILE 27 HD12 ILE 27 5.279 2.268 -1.549
233 HD13 ILE 27 HD13 ILE 27 3.853 1.337 -1.085
234 H ARG 28 H ARG 28 6.464 -1.070 2.370
235 HA ARG 28 HA ARG 28 9.195 -0.401 2.796
236 HB2 ARG 28 HB2 ARG 28 8.078 -2.504 0.935
237 HB3 ARG 28 HB3 ARG 28 9.698 -2.439 1.591
238 HG2 ARG 28 HG2 ARG 28 8.875 -2.980 3.788
239 HG3 ARG 28 HG3 ARG 28 7.204 -2.896 3.216
240 HD2 ARG 28 HD2 ARG 28 7.728 -4.677 1.582
241 HD3 ARG 28 HD3 ARG 28 9.330 -4.809 2.290
242 HE ARG 28 HE ARG 28 8.038 -5.337 4.412
243 HH11 ARG 28 HH11 ARG 28 6.658 -6.081 1.207
244 HH12 ARG 28 HH12 ARG 28 6.087 -7.612 1.661
245 HH21 ARG 28 HH21 ARG 28 7.187 -7.501 5.012
246 HH22 ARG 28 HH22 ARG 28 6.396 -8.428 3.817
247 H ARG 29 H ARG 29 10.556 0.616 1.420
248 HA ARG 29 HA ARG 29 9.424 1.473 -1.091
249 HB2 ARG 29 HB2 ARG 29 10.734 3.083 0.273
250 HB3 ARG 29 HB3 ARG 29 12.173 2.090 0.011
251 HG2 ARG 29 HG2 ARG 29 11.468 2.419 -2.507
252 HG3 ARG 29 HG3 ARG 29 10.703 3.864 -1.848
253 HD2 ARG 29 HD2 ARG 29 12.913 4.424 -0.812
254 HD3 ARG 29 HD3 ARG 29 13.585 3.068 -1.739
255 HE ARG 29 HE ARG 29 12.312 4.505 -3.622
256 HH11 ARG 29 HH11 ARG 29 14.924 5.299 -1.362
257 HH12 ARG 29 HH12 ARG 29 15.405 6.685 -2.225
258 HH21 ARG 29 HH21 ARG 29 13.000 6.360 -4.800
259 HH22 ARG 29 HH22 ARG 29 14.312 7.289 -4.226
260 H ARG 30 H ARG 30 9.689 0.410 -2.867
261 HA ARG 30 HA ARG 30 11.653 -1.685 -2.933
262 HB2 ARG 30 HB2 ARG 30 9.365 -0.993 -4.782
263 HB3 ARG 30 HB3 ARG 30 10.529 -2.262 -5.135
264 HG2 ARG 30 HG2 ARG 30 9.873 -3.454 -3.120
265 HG3 ARG 30 HG3 ARG 30 8.748 -2.163 -2.711
266 HD2 ARG 30 HD2 ARG 30 7.293 -2.719 -4.442
267 HD3 ARG 30 HD3 ARG 30 8.538 -3.605 -5.327
268 HE ARG 30 HE ARG 30 8.402 -5.055 -3.153
269 HH11 ARG 30 HH11 ARG 30 5.614 -3.773 -4.964
270 HH12 ARG 30 HH12 ARG 30 4.635 -5.135 -4.550
271 HH21 ARG 30 HH21 ARG 30 7.047 -6.845 -2.732
272 HH22 ARG 30 HH22 ARG 30 5.441 -6.874 -3.323
273 H LYS 31 H LYS 31 12.602 -1.835 -5.362
274 HA LYS 31 HA LYS 31 14.506 0.279 -5.128
275 HB2 LYS 31 HB2 LYS 31 14.391 -1.974 -7.103
276 HB3 LYS 31 HB3 LYS 31 15.771 -0.926 -6.812
277 HG2 LYS 31 HG2 LYS 31 15.958 -1.742 -4.543
278 HG3 LYS 31 HG3 LYS 31 14.520 -2.739 -4.757
279 HD2 LYS 31 HD2 LYS 31 15.760 -3.801 -6.692
280 HD3 LYS 31 HD3 LYS 31 17.206 -3.018 -6.058
281 HE2 LYS 31 HE2 LYS 31 16.804 -4.128 -3.885
282 HE3 LYS 31 HE3 LYS 31 15.436 -4.980 -4.602
283 HZ1 LYS 31 HZ1 LYS 31 18.282 -5.211 -5.408
284 HZ2 LYS 31 HZ2 LYS 31 17.002 -5.948 -6.213
285 HZ3 LYS 31 HZ3 LYS 31 17.366 -6.391 -4.629
286 H ASP 32 H ASP 32 11.690 0.101 -6.942
287 HA ASP 32 HA ASP 32 12.819 2.036 -8.848
288 HB2 ASP 32 HB2 ASP 32 11.892 -0.171 -9.713
289 HB3 ASP 32 HB3 ASP 32 10.306 0.451 -9.292
290 H MET 33 H MET 33 11.296 2.134 -6.106
291 HA MET 33 HA MET 33 8.964 3.691 -6.660
292 HB2 MET 33 HB2 MET 33 10.430 2.864 -4.257
293 HB3 MET 33 HB3 MET 33 9.621 4.413 -4.107
294 HG2 MET 33 HG2 MET 33 8.152 2.785 -3.268
295 HG3 MET 33 HG3 MET 33 7.523 3.265 -4.841
296 HE1 MET 33 HE1 MET 33 6.698 0.725 -3.146
297 HE2 MET 33 HE2 MET 33 6.680 -0.593 -4.313
298 HE3 MET 33 HE3 MET 33 5.949 0.957 -4.727
299 H LYS 34 H LYS 34 9.080 5.564 -7.657
300 HA LYS 34 HA LYS 34 11.113 7.500 -6.886
301 HB2 LYS 34 HB2 LYS 34 9.466 7.205 -9.385
302 HB3 LYS 34 HB3 LYS 34 10.673 8.444 -9.096
303 HG2 LYS 34 HG2 LYS 34 12.437 6.967 -9.326
304 HG3 LYS 34 HG3 LYS 34 11.437 5.565 -8.936
305 HD2 LYS 34 HD2 LYS 34 10.196 6.077 -11.105
306 HD3 LYS 34 HD3 LYS 34 11.548 7.133 -11.499
307 HE2 LYS 34 HE2 LYS 34 11.760 4.196 -10.834
308 HE3 LYS 34 HE3 LYS 34 11.770 4.861 -12.460
309 HZ1 LYS 34 HZ1 LYS 34 13.798 6.035 -11.932
310 HZ2 LYS 34 HZ2 LYS 34 13.963 4.379 -11.673
311 HZ3 LYS 34 HZ3 LYS 34 13.780 5.415 -10.352
312 H VAL 35 H VAL 35 10.358 9.572 -6.418
313 HA VAL 35 HA VAL 35 7.803 9.719 -5.196
314 HB VAL 35 HB VAL 35 9.677 12.024 -5.815
315 HG11 VAL 35 HG11 VAL 35 8.595 13.147 -3.944
316 HG12 VAL 35 HG12 VAL 35 7.555 11.748 -3.691
317 HG13 VAL 35 HG13 VAL 35 7.406 12.702 -5.170
318 HG21 VAL 35 HG21 VAL 35 10.563 11.695 -3.549
319 HG22 VAL 35 HG22 VAL 35 10.837 10.276 -4.564
320 HG23 VAL 35 HG23 VAL 35 9.547 10.267 -3.372
321 H GLY 36 H GLY 36 5.894 10.228 -6.051
322 HA2 GLY 36 HA2 GLY 36 4.634 11.877 -7.284
323 HA3 GLY 36 HA3 GLY 36 5.873 11.813 -8.527
324 H GLN 37 H GLN 37 5.864 8.768 -8.174
325 HA GLN 37 HA GLN 37 3.677 8.450 -10.077
326 HB2 GLN 37 HB2 GLN 37 4.672 6.332 -10.727
327 HB3 GLN 37 HB3 GLN 37 5.875 7.608 -10.787
328 HG2 GLN 37 HG2 GLN 37 6.895 6.838 -8.783
329 HG3 GLN 37 HG3 GLN 37 5.566 5.731 -8.471
330 HE21 GLN 37 HE21 GLN 37 8.214 6.398 -10.543
331 HE22 GLN 37 HE22 GLN 37 8.504 4.764 -11.065
332 H GLN 38 H GLN 38 2.321 6.694 -10.032
333 HA GLN 38 HA GLN 38 1.464 5.940 -7.354
334 HB2 GLN 38 HB2 GLN 38 -0.140 6.805 -9.124
335 HB3 GLN 38 HB3 GLN 38 0.143 5.306 -9.996
336 HG2 GLN 38 HG2 GLN 38 -0.839 4.015 -8.262
337 HG3 GLN 38 HG3 GLN 38 -0.893 5.405 -7.178
338 HE21 GLN 38 HE21 GLN 38 -3.091 5.303 -6.877
339 HE22 GLN 38 HE22 GLN 38 -4.221 5.690 -8.119
340 H VAL 39 H VAL 39 2.080 4.101 -6.536
341 HA VAL 39 HA VAL 39 3.271 2.137 -8.355
342 HB VAL 39 HB VAL 39 4.625 1.378 -6.433
343 HG11 VAL 39 HG11 VAL 39 4.921 4.319 -7.003
344 HG12 VAL 39 HG12 VAL 39 5.539 3.020 -8.016
345 HG13 VAL 39 HG13 VAL 39 6.181 3.251 -6.391
346 HG21 VAL 39 HG21 VAL 39 4.745 2.667 -4.387
347 HG22 VAL 39 HG22 VAL 39 3.079 2.151 -4.662
348 HG23 VAL 39 HG23 VAL 39 3.551 3.810 -5.004
349 H SER 40 H SER 40 2.886 0.013 -8.055
350 HA SER 40 HA SER 40 0.546 -0.668 -6.496
351 HB2 SER 40 HB2 SER 40 0.931 -2.880 -7.749
352 HB3 SER 40 HB3 SER 40 0.441 -1.489 -8.719
353 HG SER 40 HG SER 40 3.169 -2.141 -8.307
354 H PHE 41 H PHE 41 0.931 -1.324 -4.497
355 HA PHE 41 HA PHE 41 3.287 -3.004 -4.008
356 HB2 PHE 41 HB2 PHE 41 3.251 -2.135 -1.660
357 HB3 PHE 41 HB3 PHE 41 3.751 -0.948 -2.847
358 HD1 PHE 41 HD1 PHE 41 1.405 -1.789 -0.229
359 HD2 PHE 41 HD2 PHE 41 2.058 0.829 -3.525
360 HE1 PHE 41 HE1 PHE 41 -0.300 -0.265 0.644
361 HE2 PHE 41 HE2 PHE 41 0.345 2.357 -2.644
362 HZ PHE 41 HZ PHE 41 -0.834 1.807 -0.557
363 H GLU 42 H GLU 42 2.871 -4.297 -1.965
364 HA GLU 42 HA GLU 42 0.094 -5.161 -2.151
365 HB2 GLU 42 HB2 GLU 42 2.500 -6.661 -1.103
366 HB3 GLU 42 HB3 GLU 42 0.840 -7.229 -1.038
367 HG2 GLU 42 HG2 GLU 42 1.608 -8.320 -2.862
368 HG3 GLU 42 HG3 GLU 42 0.873 -6.899 -3.608
369 H ASN 43 H ASN 43 -0.805 -5.913 -0.117
370 HA ASN 43 HA ASN 43 -0.528 -3.797 1.776
371 HB2 ASN 43 HB2 ASN 43 -2.345 -6.189 1.632
372 HB3 ASN 43 HB3 ASN 43 -2.212 -5.300 3.151
373 HD21 ASN 43 HD21 ASN 43 -2.910 -4.948 -0.273
374 HD22 ASN 43 HD22 ASN 43 -4.059 -3.669 -0.105
375 H GLU 44 H GLU 44 0.974 -6.746 1.349
376 HA GLU 44 HA GLU 44 1.844 -7.306 3.996
377 HB2 GLU 44 HB2 GLU 44 3.337 -7.895 1.427
378 HB3 GLU 44 HB3 GLU 44 3.519 -8.711 2.968
379 HG2 GLU 44 HG2 GLU 44 1.253 -9.625 2.731
380 HG3 GLU 44 HG3 GLU 44 1.105 -8.814 1.174
381 H ASP 45 H ASP 45 2.804 -5.082 1.472
382 HA ASP 45 HA ASP 45 5.447 -4.533 2.464
383 HB2 ASP 45 HB2 ASP 45 3.758 -3.104 0.404
384 HB3 ASP 45 HB3 ASP 45 5.417 -2.665 0.799
385 H ILE 46 H ILE 46 2.381 -3.561 3.303
386 HA ILE 46 HA ILE 46 2.928 -0.879 4.014
387 HB ILE 46 HB ILE 46 0.723 -2.737 4.956
388 HG12 ILE 46 HG12 ILE 46 0.700 -0.549 2.867
389 HG13 ILE 46 HG13 ILE 46 0.820 -2.265 2.514
390 HG21 ILE 46 HG21 ILE 46 0.964 0.266 5.183
391 HG22 ILE 46 HG22 ILE 46 1.097 -0.885 6.512
392 HG23 ILE 46 HG23 ILE 46 -0.439 -0.703 5.656
393 HD11 ILE 46 HD11 ILE 46 -1.421 -1.431 2.189
394 HD12 ILE 46 HD12 ILE 46 -1.488 -0.886 3.869
395 HD13 ILE 46 HD13 ILE 46 -1.383 -2.605 3.500
396 H TYR 47 H TYR 47 4.077 -0.143 5.532
397 HA TYR 47 HA TYR 47 5.273 -1.847 7.531
398 HB2 TYR 47 HB2 TYR 47 5.772 0.812 6.400
399 HB3 TYR 47 HB3 TYR 47 6.129 0.681 8.119
400 HD1 TYR 47 HD1 TYR 47 7.725 0.813 5.211
401 HD2 TYR 47 HD2 TYR 47 7.301 -1.937 8.424
402 HE1 TYR 47 HE1 TYR 47 9.915 -0.162 4.665
403 HE2 TYR 47 HE2 TYR 47 9.493 -2.912 7.867
404 HH TYR 47 HH TYR 47 10.970 -3.102 5.921
405 H ASN 48 H ASN 48 2.539 0.034 7.334
406 HA ASN 48 HA ASN 48 2.268 1.178 9.869
407 HB2 ASN 48 HB2 ASN 48 0.105 -0.073 8.159
408 HB3 ASN 48 HB3 ASN 48 -0.198 0.884 9.594
409 HD21 ASN 48 HD21 ASN 48 -1.364 1.646 7.346
410 HD22 ASN 48 HD22 ASN 48 -0.622 3.069 6.718
411 H VAL 49 H VAL 49 1.677 0.419 11.775
412 HA VAL 49 HA VAL 49 2.063 -2.449 12.109
413 HB VAL 49 HB VAL 49 1.491 -0.548 14.380
414 HG11 VAL 49 HG11 VAL 49 3.159 -3.028 14.223
415 HG12 VAL 49 HG12 VAL 49 1.515 -2.919 14.843
416 HG13 VAL 49 HG13 VAL 49 2.830 -2.074 15.671
417 HG21 VAL 49 HG21 VAL 49 3.267 0.478 13.033
418 HG22 VAL 49 HG22 VAL 49 4.204 -1.014 13.147
419 HG23 VAL 49 HG23 VAL 49 3.861 -0.069 14.598
420 H ARG 50 H ARG 50 -0.191 -0.172 13.542
421 HA ARG 50 HA ARG 50 -2.336 -2.097 13.015
422 HB2 ARG 50 HB2 ARG 50 -1.953 -0.426 15.506
423 HB3 ARG 50 HB3 ARG 50 -3.361 -1.436 15.190
424 HG2 ARG 50 HG2 ARG 50 -2.055 -3.405 15.337
425 HG3 ARG 50 HG3 ARG 50 -0.553 -2.484 15.365
426 HD2 ARG 50 HD2 ARG 50 -1.324 -1.475 17.518
427 HD3 ARG 50 HD3 ARG 50 -2.686 -2.591 17.480
428 HE ARG 50 HE ARG 50 -0.071 -3.788 17.228
429 HH11 ARG 50 HH11 ARG 50 -2.608 -2.848 19.494
430 HH12 ARG 50 HH12 ARG 50 -2.272 -4.085 20.612
431 HH21 ARG 50 HH21 ARG 50 0.463 -5.417 18.764
432 HH22 ARG 50 HH22 ARG 50 -0.420 -5.580 20.207
433 H GLY 51 H GLY 51 -2.508 1.076 14.568
434 HA2 GLY 51 HA2 GLY 51 -4.199 1.964 12.367
435 HA3 GLY 51 HA3 GLY 51 -4.026 2.737 13.945
436 H LYS 52 H LYS 52 -2.090 1.851 11.163
437 HA LYS 52 HA LYS 52 -0.468 2.868 9.999
438 HB2 LYS 52 HB2 LYS 52 -1.596 5.356 11.311
439 HB3 LYS 52 HB3 LYS 52 -0.142 5.444 10.340
440 HG2 LYS 52 HG2 LYS 52 -1.892 6.080 8.899
441 HG3 LYS 52 HG3 LYS 52 -1.524 4.411 8.459
442 HD2 LYS 52 HD2 LYS 52 -3.424 3.645 9.804
443 HD3 LYS 52 HD3 LYS 52 -3.781 5.311 10.253
444 HE2 LYS 52 HE2 LYS 52 -3.710 4.359 7.399
445 HE3 LYS 52 HE3 LYS 52 -5.173 4.329 8.379
446 HZ1 LYS 52 HZ1 LYS 52 -4.903 6.750 8.673
447 HZ2 LYS 52 HZ2 LYS 52 -5.183 6.278 7.100
448 HZ3 LYS 52 HZ3 LYS 52 -3.628 6.752 7.555
Start of MODEL 13
1 H1 SER 0 H1 SER 0 -0.448 -9.558 -0.565
2 H2 SER 0 H2 SER 0 -0.627 -11.160 -1.059
3 H3 SER 0 H3 SER 0 0.014 -10.798 0.476
4 HA SER 0 HA SER 0 -2.400 -11.506 0.300
5 HB2 SER 0 HB2 SER 0 -3.014 -9.625 1.987
6 HB3 SER 0 HB3 SER 0 -1.688 -10.714 2.394
7 HG SER 0 HG SER 0 -0.959 -8.715 2.769
8 H MET 1 H MET 1 -2.102 -7.969 -0.062
9 HA MET 1 HA MET 1 -4.120 -8.015 -2.182
10 HB2 MET 1 HB2 MET 1 -4.367 -6.261 0.273
11 HB3 MET 1 HB3 MET 1 -5.417 -6.231 -1.129
12 HG2 MET 1 HG2 MET 1 -6.214 -8.472 -0.574
13 HG3 MET 1 HG3 MET 1 -5.088 -8.507 0.784
14 HE1 MET 1 HE1 MET 1 -8.736 -5.668 0.533
15 HE2 MET 1 HE2 MET 1 -8.196 -6.727 -0.771
16 HE3 MET 1 HE3 MET 1 -7.236 -5.320 -0.321
17 H ASN 2 H ASN 2 -3.225 -6.886 -3.773
18 HA ASN 2 HA ASN 2 -1.251 -4.902 -3.494
19 HB2 ASN 2 HB2 ASN 2 -2.984 -5.883 -5.714
20 HB3 ASN 2 HB3 ASN 2 -2.329 -4.263 -5.871
21 HD21 ASN 2 HD21 ASN 2 0.208 -4.854 -4.568
22 HD22 ASN 2 HD22 ASN 2 1.085 -5.859 -5.663
23 H ARG 3 H ARG 3 -1.434 -2.724 -3.633
24 HA ARG 3 HA ARG 3 -4.067 -1.471 -3.681
25 HB2 ARG 3 HB2 ARG 3 -3.023 -1.931 -1.258
26 HB3 ARG 3 HB3 ARG 3 -2.110 -0.485 -1.644
27 HG2 ARG 3 HG2 ARG 3 -4.006 0.186 -0.387
28 HG3 ARG 3 HG3 ARG 3 -4.289 0.677 -2.061
29 HD2 ARG 3 HD2 ARG 3 -5.640 -1.355 -2.407
30 HD3 ARG 3 HD3 ARG 3 -5.318 -1.804 -0.737
31 HE ARG 3 HE ARG 3 -6.483 0.600 -0.461
32 HH11 ARG 3 HH11 ARG 3 -7.450 -2.245 -2.370
33 HH12 ARG 3 HH12 ARG 3 -9.119 -1.944 -2.157
34 HH21 ARG 3 HH21 ARG 3 -8.755 0.927 -0.186
35 HH22 ARG 3 HH22 ARG 3 -9.879 -0.149 -0.924
36 H LEU 4 H LEU 4 -3.873 0.847 -4.192
37 HA LEU 4 HA LEU 4 -1.432 1.355 -5.744
38 HB2 LEU 4 HB2 LEU 4 -4.206 2.461 -6.133
39 HB3 LEU 4 HB3 LEU 4 -2.823 2.763 -7.156
40 HG LEU 4 HG LEU 4 -4.213 0.105 -6.807
41 HD11 LEU 4 HD11 LEU 4 -4.231 2.037 -9.117
42 HD12 LEU 4 HD12 LEU 4 -5.570 1.720 -8.012
43 HD13 LEU 4 HD13 LEU 4 -4.998 0.452 -9.090
44 HD21 LEU 4 HD21 LEU 4 -1.945 0.943 -8.607
45 HD22 LEU 4 HD22 LEU 4 -2.824 -0.580 -8.742
46 HD23 LEU 4 HD23 LEU 4 -1.874 -0.238 -7.298
47 H GLY 5 H GLY 5 -0.256 3.075 -5.185
48 HA2 GLY 5 HA2 GLY 5 -1.559 5.375 -4.047
49 HA3 GLY 5 HA3 GLY 5 -0.428 4.574 -2.959
50 H ILE 6 H ILE 6 -0.257 7.162 -3.876
51 HA ILE 6 HA ILE 6 1.794 7.223 -5.964
52 HB ILE 6 HB ILE 6 0.481 9.517 -4.488
53 HG12 ILE 6 HG12 ILE 6 -0.285 8.495 -7.226
54 HG13 ILE 6 HG13 ILE 6 -1.128 8.012 -5.760
55 HG21 ILE 6 HG21 ILE 6 2.573 10.104 -5.566
56 HG22 ILE 6 HG22 ILE 6 1.221 10.841 -6.430
57 HG23 ILE 6 HG23 ILE 6 2.011 9.405 -7.084
58 HD11 ILE 6 HD11 ILE 6 -1.771 10.316 -5.346
59 HD12 ILE 6 HD12 ILE 6 -2.275 9.812 -6.961
60 HD13 ILE 6 HD13 ILE 6 -0.852 10.834 -6.762
61 H ILE 7 H ILE 7 3.867 7.360 -5.476
62 HA ILE 7 HA ILE 7 4.779 7.412 -2.789
63 HB ILE 7 HB ILE 7 6.386 8.054 -5.286
64 HG12 ILE 7 HG12 ILE 7 5.297 5.817 -5.374
65 HG13 ILE 7 HG13 ILE 7 7.051 5.727 -5.316
66 HG21 ILE 7 HG21 ILE 7 7.322 7.134 -2.563
67 HG22 ILE 7 HG22 ILE 7 7.437 8.782 -3.168
68 HG23 ILE 7 HG23 ILE 7 8.347 7.488 -3.953
69 HD11 ILE 7 HD11 ILE 7 5.236 5.340 -2.945
70 HD12 ILE 7 HD12 ILE 7 6.985 5.122 -2.992
71 HD13 ILE 7 HD13 ILE 7 5.937 4.044 -3.913
72 H TYR 8 H TYR 8 4.259 9.014 -1.653
73 HA TYR 8 HA TYR 8 4.212 11.717 -2.629
74 HB2 TYR 8 HB2 TYR 8 2.514 10.602 -1.066
75 HB3 TYR 8 HB3 TYR 8 3.731 10.786 0.189
76 HD1 TYR 8 HD1 TYR 8 1.432 12.552 -2.056
77 HD2 TYR 8 HD2 TYR 8 4.210 12.939 1.133
78 HE1 TYR 8 HE1 TYR 8 0.627 14.833 -1.643
79 HE2 TYR 8 HE2 TYR 8 3.433 15.203 1.561
80 HH TYR 8 HH TYR 8 0.559 16.431 0.173
81 H GLU 9 H GLU 9 6.166 9.655 -0.568
82 HA GLU 9 HA GLU 9 8.280 11.576 -0.527
83 HB2 GLU 9 HB2 GLU 9 6.639 12.339 1.244
84 HB3 GLU 9 HB3 GLU 9 6.947 10.853 2.105
85 HG2 GLU 9 HG2 GLU 9 9.319 11.526 2.307
86 HG3 GLU 9 HG3 GLU 9 8.906 13.046 1.509
87 H ILE 10 H ILE 10 10.208 10.617 0.547
88 HA ILE 10 HA ILE 10 10.082 7.673 0.770
89 HB ILE 10 HB ILE 10 12.239 9.443 -0.425
90 HG12 ILE 10 HG12 ILE 10 10.325 8.831 -1.879
91 HG13 ILE 10 HG13 ILE 10 11.874 8.245 -2.485
92 HG21 ILE 10 HG21 ILE 10 13.306 7.730 0.949
93 HG22 ILE 10 HG22 ILE 10 13.597 7.454 -0.764
94 HG23 ILE 10 HG23 ILE 10 12.405 6.478 0.092
95 HD11 ILE 10 HD11 ILE 10 9.713 6.644 -1.116
96 HD12 ILE 10 HD12 ILE 10 11.300 6.015 -1.562
97 HD13 ILE 10 HD13 ILE 10 10.191 6.568 -2.814
98 H GLN 11 H GLN 11 10.918 6.842 2.611
99 HA GLN 11 HA GLN 11 12.538 8.612 4.326
100 HB2 GLN 11 HB2 GLN 11 10.187 6.958 4.932
101 HB3 GLN 11 HB3 GLN 11 11.557 6.638 5.984
102 HG2 GLN 11 HG2 GLN 11 10.515 8.242 7.164
103 HG3 GLN 11 HG3 GLN 11 11.545 9.268 6.168
104 HE21 GLN 11 HE21 GLN 11 10.639 10.355 4.448
105 HE22 GLN 11 HE22 GLN 11 8.942 10.686 4.393
106 H GLY 12 H GLY 12 14.261 7.624 2.928
107 HA2 GLY 12 HA2 GLY 12 15.985 6.153 2.679
108 HA3 GLY 12 HA3 GLY 12 15.547 5.500 4.255
109 H MET 13 H MET 13 14.448 3.644 4.383
110 HA MET 13 HA MET 13 14.127 2.074 1.922
111 HB2 MET 13 HB2 MET 13 14.076 1.194 4.812
112 HB3 MET 13 HB3 MET 13 14.013 0.136 3.416
113 HG2 MET 13 HG2 MET 13 16.332 1.966 3.937
114 HG3 MET 13 HG3 MET 13 16.233 0.355 4.631
115 HE1 MET 13 HE1 MET 13 15.850 2.157 1.001
116 HE2 MET 13 HE2 MET 13 17.324 1.474 0.331
117 HE3 MET 13 HE3 MET 13 17.400 2.481 1.775
118 H LYS 14 H LYS 14 12.280 4.050 3.695
119 HA LYS 14 HA LYS 14 9.864 2.409 3.313
120 HB2 LYS 14 HB2 LYS 14 10.193 4.874 5.015
121 HB3 LYS 14 HB3 LYS 14 8.771 3.850 4.916
122 HG2 LYS 14 HG2 LYS 14 9.957 2.042 5.978
123 HG3 LYS 14 HG3 LYS 14 11.444 2.993 5.990
124 HD2 LYS 14 HD2 LYS 14 10.231 4.707 7.349
125 HD3 LYS 14 HD3 LYS 14 8.882 3.578 7.462
126 HE2 LYS 14 HE2 LYS 14 11.654 2.855 8.246
127 HE3 LYS 14 HE3 LYS 14 10.540 3.624 9.381
128 HZ1 LYS 14 HZ1 LYS 14 10.626 1.152 9.521
129 HZ2 LYS 14 HZ2 LYS 14 10.012 1.033 7.974
130 HZ3 LYS 14 HZ3 LYS 14 9.081 1.724 9.208
131 H ALA 15 H ALA 15 8.054 3.499 2.439
132 HA ALA 15 HA ALA 15 8.595 6.055 1.136
133 HB1 ALA 15 HB1 ALA 15 7.312 3.658 -0.179
134 HB2 ALA 15 HB2 ALA 15 8.900 4.329 -0.560
135 HB3 ALA 15 HB3 ALA 15 7.442 5.274 -0.871
136 H VAL 16 H VAL 16 6.892 7.387 1.106
137 HA VAL 16 HA VAL 16 4.533 6.583 2.654
138 HB VAL 16 HB VAL 16 5.299 9.346 1.643
139 HG11 VAL 16 HG11 VAL 16 2.901 9.081 2.027
140 HG12 VAL 16 HG12 VAL 16 3.614 10.184 3.201
141 HG13 VAL 16 HG13 VAL 16 3.219 8.531 3.672
142 HG21 VAL 16 HG21 VAL 16 5.919 9.875 3.928
143 HG22 VAL 16 HG22 VAL 16 6.930 8.568 3.297
144 HG23 VAL 16 HG23 VAL 16 5.600 8.216 4.414
145 H VAL 17 H VAL 17 2.844 5.953 1.514
146 HA VAL 17 HA VAL 17 2.614 6.982 -1.207
147 HB VAL 17 HB VAL 17 1.043 5.061 -1.620
148 HG11 VAL 17 HG11 VAL 17 3.207 5.033 -2.570
149 HG12 VAL 17 HG12 VAL 17 2.867 3.416 -1.952
150 HG13 VAL 17 HG13 VAL 17 3.931 4.499 -1.053
151 HG21 VAL 17 HG21 VAL 17 2.184 4.066 1.001
152 HG22 VAL 17 HG22 VAL 17 1.371 3.046 -0.180
153 HG23 VAL 17 HG23 VAL 17 0.499 4.372 0.585
154 H LEU 18 H LEU 18 1.061 8.196 -1.685
155 HA LEU 18 HA LEU 18 -1.168 8.541 0.151
156 HB2 LEU 18 HB2 LEU 18 -0.089 10.560 -0.689
157 HB3 LEU 18 HB3 LEU 18 -0.275 10.013 -2.338
158 HG LEU 18 HG LEU 18 -2.724 10.255 -2.130
159 HD11 LEU 18 HD11 LEU 18 -3.635 11.499 -0.205
160 HD12 LEU 18 HD12 LEU 18 -2.067 11.351 0.598
161 HD13 LEU 18 HD13 LEU 18 -3.014 9.909 0.234
162 HD21 LEU 18 HD21 LEU 18 -2.753 12.715 -2.063
163 HD22 LEU 18 HD22 LEU 18 -1.444 12.069 -3.054
164 HD23 LEU 18 HD23 LEU 18 -1.105 12.694 -1.438
165 H THR 19 H THR 19 -2.569 6.961 -0.152
166 HA THR 19 HA THR 19 -2.716 5.441 -2.529
167 HB THR 19 HB THR 19 -4.690 4.383 -1.416
168 HG1 THR 19 HG1 THR 19 -4.878 5.052 0.860
169 HG21 THR 19 HG21 THR 19 -3.387 3.358 0.387
170 HG22 THR 19 HG22 THR 19 -2.236 4.690 0.319
171 HG23 THR 19 HG23 THR 19 -2.386 3.584 -1.050
172 H SER 20 H SER 20 -4.858 5.020 -3.634
173 HA SER 20 HA SER 20 -5.860 7.387 -4.761
174 HB2 SER 20 HB2 SER 20 -7.524 5.642 -5.708
175 HB3 SER 20 HB3 SER 20 -5.816 5.490 -6.131
176 HG SER 20 HG SER 20 -7.407 3.805 -4.833
177 H GLU 21 H GLU 21 -6.481 5.860 -1.873
178 HA GLU 21 HA GLU 21 -9.254 6.597 -1.574
179 HB2 GLU 21 HB2 GLU 21 -7.334 5.548 0.499
180 HB3 GLU 21 HB3 GLU 21 -9.091 5.554 0.579
181 HG2 GLU 21 HG2 GLU 21 -9.090 4.045 -1.413
182 HG3 GLU 21 HG3 GLU 21 -7.342 3.914 -1.226
183 H GLY 22 H GLY 22 -6.187 8.004 -1.177
184 HA2 GLY 22 HA2 GLY 22 -5.792 10.238 -0.646
185 HA3 GLY 22 HA3 GLY 22 -7.358 10.318 0.136
186 H GLU 23 H GLU 23 -5.250 7.689 0.894
187 HA GLU 23 HA GLU 23 -4.852 8.857 3.557
188 HB2 GLU 23 HB2 GLU 23 -4.844 5.966 2.697
189 HB3 GLU 23 HB3 GLU 23 -4.703 6.555 4.342
190 HG2 GLU 23 HG2 GLU 23 -7.108 7.075 2.623
191 HG3 GLU 23 HG3 GLU 23 -6.959 5.661 3.662
192 H PHE 24 H PHE 24 -2.765 8.764 4.445
193 HA PHE 24 HA PHE 24 -0.641 8.180 2.523
194 HB2 PHE 24 HB2 PHE 24 -0.427 9.623 5.198
195 HB3 PHE 24 HB3 PHE 24 0.863 9.379 4.043
196 HD1 PHE 24 HD1 PHE 24 1.236 10.877 2.269
197 HD2 PHE 24 HD2 PHE 24 -2.364 11.108 4.537
198 HE1 PHE 24 HE1 PHE 24 0.697 13.023 1.205
199 HE2 PHE 24 HE2 PHE 24 -2.904 13.256 3.470
200 HZ PHE 24 HZ PHE 24 -1.369 14.213 1.800
201 H LEU 25 H LEU 25 0.223 6.284 2.669
202 HA LEU 25 HA LEU 25 0.289 4.898 5.279
203 HB2 LEU 25 HB2 LEU 25 -0.123 3.849 2.494
204 HB3 LEU 25 HB3 LEU 25 0.539 2.818 3.738
205 HG LEU 25 HG LEU 25 -1.566 3.171 5.062
206 HD11 LEU 25 HD11 LEU 25 -2.577 4.395 2.506
207 HD12 LEU 25 HD12 LEU 25 -2.271 5.277 3.998
208 HD13 LEU 25 HD13 LEU 25 -3.524 4.034 3.948
209 HD21 LEU 25 HD21 LEU 25 -1.646 1.958 2.331
210 HD22 LEU 25 HD22 LEU 25 -2.952 1.764 3.506
211 HD23 LEU 25 HD23 LEU 25 -1.331 1.166 3.877
212 H ILE 26 H ILE 26 2.220 3.822 5.818
213 HA ILE 26 HA ILE 26 4.548 4.628 4.248
214 HB ILE 26 HB ILE 26 4.446 3.252 6.946
215 HG12 ILE 26 HG12 ILE 26 3.339 5.459 7.068
216 HG13 ILE 26 HG13 ILE 26 4.819 5.415 8.009
217 HG21 ILE 26 HG21 ILE 26 6.780 3.961 7.191
218 HG22 ILE 26 HG22 ILE 26 6.717 4.744 5.618
219 HG23 ILE 26 HG23 ILE 26 6.570 2.994 5.734
220 HD11 ILE 26 HD11 ILE 26 5.971 6.596 6.168
221 HD12 ILE 26 HD12 ILE 26 4.631 7.517 6.854
222 HD13 ILE 26 HD13 ILE 26 4.429 6.685 5.311
223 H ILE 27 H ILE 27 5.419 3.157 2.952
224 HA ILE 27 HA ILE 27 4.902 0.301 3.496
225 HB ILE 27 HB ILE 27 4.833 -0.152 1.082
226 HG12 ILE 27 HG12 ILE 27 4.839 2.827 0.597
227 HG13 ILE 27 HG13 ILE 27 6.312 1.867 0.548
228 HG21 ILE 27 HG21 ILE 27 2.898 1.960 2.003
229 HG22 ILE 27 HG22 ILE 27 2.685 0.206 2.038
230 HG23 ILE 27 HG23 ILE 27 2.719 1.061 0.503
231 HD11 ILE 27 HD11 ILE 27 5.379 0.526 -1.256
232 HD12 ILE 27 HD12 ILE 27 5.411 2.244 -1.666
233 HD13 ILE 27 HD13 ILE 27 3.893 1.477 -1.192
234 H ARG 28 H ARG 28 6.470 -1.088 2.426
235 HA ARG 28 HA ARG 28 9.187 -0.344 2.809
236 HB2 ARG 28 HB2 ARG 28 8.051 -2.675 1.238
237 HB3 ARG 28 HB3 ARG 28 9.727 -2.504 1.737
238 HG2 ARG 28 HG2 ARG 28 8.932 -2.537 4.103
239 HG3 ARG 28 HG3 ARG 28 7.322 -2.912 3.496
240 HD2 ARG 28 HD2 ARG 28 9.813 -4.560 3.047
241 HD3 ARG 28 HD3 ARG 28 8.533 -4.924 4.195
242 HE ARG 28 HE ARG 28 7.553 -4.677 1.508
243 HH11 ARG 28 HH11 ARG 28 9.165 -6.931 3.702
244 HH12 ARG 28 HH12 ARG 28 8.608 -8.314 2.907
245 HH21 ARG 28 HH21 ARG 28 6.805 -6.490 0.450
246 HH22 ARG 28 HH22 ARG 28 7.176 -8.087 0.965
247 H ARG 29 H ARG 29 10.510 0.635 1.439
248 HA ARG 29 HA ARG 29 9.503 1.394 -1.160
249 HB2 ARG 29 HB2 ARG 29 10.552 3.096 0.227
250 HB3 ARG 29 HB3 ARG 29 12.010 2.136 0.335
251 HG2 ARG 29 HG2 ARG 29 11.743 2.366 -2.350
252 HG3 ARG 29 HG3 ARG 29 11.090 3.913 -1.800
253 HD2 ARG 29 HD2 ARG 29 13.074 4.255 -0.449
254 HD3 ARG 29 HD3 ARG 29 13.740 2.725 -1.039
255 HE ARG 29 HE ARG 29 13.342 4.021 -3.312
256 HH11 ARG 29 HH11 ARG 29 14.937 5.024 -0.304
257 HH12 ARG 29 HH12 ARG 29 15.823 6.280 -1.012
258 HH21 ARG 29 HH21 ARG 29 14.602 5.772 -4.311
259 HH22 ARG 29 HH22 ARG 29 15.607 6.724 -3.338
260 H ARG 30 H ARG 30 10.003 0.337 -2.902
261 HA ARG 30 HA ARG 30 12.182 -1.595 -2.896
262 HB2 ARG 30 HB2 ARG 30 10.175 -0.961 -5.085
263 HB3 ARG 30 HB3 ARG 30 11.272 -2.331 -5.038
264 HG2 ARG 30 HG2 ARG 30 10.060 -3.340 -3.255
265 HG3 ARG 30 HG3 ARG 30 9.077 -1.891 -3.030
266 HD2 ARG 30 HD2 ARG 30 8.248 -2.221 -5.388
267 HD3 ARG 30 HD3 ARG 30 9.061 -3.783 -5.379
268 HE ARG 30 HE ARG 30 7.601 -3.991 -3.201
269 HH11 ARG 30 HH11 ARG 30 6.643 -2.876 -6.423
270 HH12 ARG 30 HH12 ARG 30 5.017 -3.361 -6.261
271 HH21 ARG 30 HH21 ARG 30 5.298 -4.644 -2.996
272 HH22 ARG 30 HH22 ARG 30 4.292 -4.416 -4.354
273 H LYS 31 H LYS 31 13.485 -1.506 -5.015
274 HA LYS 31 HA LYS 31 14.651 1.114 -5.154
275 HB2 LYS 31 HB2 LYS 31 15.289 -1.397 -6.689
276 HB3 LYS 31 HB3 LYS 31 16.287 0.053 -6.668
277 HG2 LYS 31 HG2 LYS 31 16.687 -0.247 -4.281
278 HG3 LYS 31 HG3 LYS 31 15.638 -1.663 -4.275
279 HD2 LYS 31 HD2 LYS 31 18.187 -1.376 -5.855
280 HD3 LYS 31 HD3 LYS 31 18.020 -2.269 -4.341
281 HE2 LYS 31 HE2 LYS 31 16.314 -3.707 -5.471
282 HE3 LYS 31 HE3 LYS 31 16.688 -2.862 -6.975
283 HZ1 LYS 31 HZ1 LYS 31 18.544 -4.535 -5.382
284 HZ2 LYS 31 HZ2 LYS 31 18.982 -3.608 -6.744
285 HZ3 LYS 31 HZ3 LYS 31 17.890 -4.863 -6.907
286 H ASP 32 H ASP 32 12.125 -0.326 -6.655
287 HA ASP 32 HA ASP 32 12.349 1.042 -9.214
288 HB2 ASP 32 HB2 ASP 32 11.406 -1.298 -8.886
289 HB3 ASP 32 HB3 ASP 32 9.993 -0.524 -8.181
290 H MET 33 H MET 33 11.416 1.826 -6.149
291 HA MET 33 HA MET 33 9.028 3.329 -6.645
292 HB2 MET 33 HB2 MET 33 10.785 2.826 -4.335
293 HB3 MET 33 HB3 MET 33 9.967 4.377 -4.332
294 HG2 MET 33 HG2 MET 33 8.696 2.791 -3.089
295 HG3 MET 33 HG3 MET 33 7.821 3.214 -4.558
296 HE1 MET 33 HE1 MET 33 6.210 1.079 -4.346
297 HE2 MET 33 HE2 MET 33 7.023 0.712 -2.823
298 HE3 MET 33 HE3 MET 33 6.817 -0.547 -4.040
299 H LYS 34 H LYS 34 8.934 5.219 -7.624
300 HA LYS 34 HA LYS 34 11.152 7.085 -7.365
301 HB2 LYS 34 HB2 LYS 34 9.144 6.624 -9.558
302 HB3 LYS 34 HB3 LYS 34 10.225 7.999 -9.488
303 HG2 LYS 34 HG2 LYS 34 12.144 6.509 -9.671
304 HG3 LYS 34 HG3 LYS 34 11.066 5.116 -9.652
305 HD2 LYS 34 HD2 LYS 34 10.064 5.776 -11.725
306 HD3 LYS 34 HD3 LYS 34 10.960 7.298 -11.725
307 HE2 LYS 34 HE2 LYS 34 12.183 4.550 -11.851
308 HE3 LYS 34 HE3 LYS 34 11.926 5.613 -13.237
309 HZ1 LYS 34 HZ1 LYS 34 13.441 7.215 -12.239
310 HZ2 LYS 34 HZ2 LYS 34 14.186 5.714 -12.385
311 HZ3 LYS 34 HZ3 LYS 34 13.645 6.219 -10.890
312 H VAL 35 H VAL 35 10.528 9.122 -6.733
313 HA VAL 35 HA VAL 35 8.088 9.326 -5.294
314 HB VAL 35 HB VAL 35 9.915 11.645 -5.998
315 HG11 VAL 35 HG11 VAL 35 7.693 12.122 -4.918
316 HG12 VAL 35 HG12 VAL 35 9.100 12.679 -4.016
317 HG13 VAL 35 HG13 VAL 35 8.257 11.229 -3.499
318 HG21 VAL 35 HG21 VAL 35 10.178 9.661 -3.760
319 HG22 VAL 35 HG22 VAL 35 11.104 11.162 -3.877
320 HG23 VAL 35 HG23 VAL 35 11.311 9.895 -5.088
321 H GLY 36 H GLY 36 6.187 10.207 -5.872
322 HA2 GLY 36 HA2 GLY 36 4.903 11.811 -7.043
323 HA3 GLY 36 HA3 GLY 36 6.094 11.784 -8.331
324 H GLN 37 H GLN 37 6.035 8.699 -8.129
325 HA GLN 37 HA GLN 37 3.784 8.588 -9.970
326 HB2 GLN 37 HB2 GLN 37 4.704 6.526 -10.848
327 HB3 GLN 37 HB3 GLN 37 5.933 7.780 -10.841
328 HG2 GLN 37 HG2 GLN 37 6.923 6.781 -8.846
329 HG3 GLN 37 HG3 GLN 37 5.671 5.542 -8.850
330 HE21 GLN 37 HE21 GLN 37 7.217 3.885 -9.060
331 HE22 GLN 37 HE22 GLN 37 8.035 3.615 -10.546
332 H GLN 38 H GLN 38 2.179 7.084 -9.933
333 HA GLN 38 HA GLN 38 1.513 6.012 -7.323
334 HB2 GLN 38 HB2 GLN 38 -0.204 7.048 -8.885
335 HB3 GLN 38 HB3 GLN 38 0.015 5.647 -9.924
336 HG2 GLN 38 HG2 GLN 38 -0.712 4.185 -8.108
337 HG3 GLN 38 HG3 GLN 38 -0.930 5.592 -7.069
338 HE21 GLN 38 HE21 GLN 38 -2.649 6.982 -7.459
339 HE22 GLN 38 HE22 GLN 38 -3.983 6.514 -8.449
340 H VAL 39 H VAL 39 2.024 4.117 -6.677
341 HA VAL 39 HA VAL 39 3.005 2.183 -8.649
342 HB VAL 39 HB VAL 39 4.554 1.348 -6.951
343 HG11 VAL 39 HG11 VAL 39 6.088 3.230 -6.806
344 HG12 VAL 39 HG12 VAL 39 4.774 4.329 -7.232
345 HG13 VAL 39 HG13 VAL 39 5.337 3.139 -8.401
346 HG21 VAL 39 HG21 VAL 39 3.266 1.791 -4.945
347 HG22 VAL 39 HG22 VAL 39 3.447 3.529 -5.177
348 HG23 VAL 39 HG23 VAL 39 4.858 2.539 -4.804
349 H SER 40 H SER 40 2.752 -0.049 -8.010
350 HA SER 40 HA SER 40 0.378 -0.509 -6.396
351 HB2 SER 40 HB2 SER 40 1.797 -2.443 -8.220
352 HB3 SER 40 HB3 SER 40 0.140 -2.528 -7.616
353 HG SER 40 HG SER 40 0.141 -1.858 -9.702
354 H PHE 41 H PHE 41 0.768 -1.212 -4.421
355 HA PHE 41 HA PHE 41 3.206 -2.783 -3.926
356 HB2 PHE 41 HB2 PHE 41 3.099 -1.882 -1.567
357 HB3 PHE 41 HB3 PHE 41 3.566 -0.711 -2.786
358 HD1 PHE 41 HD1 PHE 41 2.035 1.111 -3.388
359 HD2 PHE 41 HD2 PHE 41 1.011 -1.718 -0.383
360 HE1 PHE 41 HE1 PHE 41 0.230 2.581 -2.617
361 HE2 PHE 41 HE2 PHE 41 -0.802 -0.246 0.383
362 HZ PHE 41 HZ PHE 41 -1.193 1.894 -0.729
363 H GLU 42 H GLU 42 2.868 -4.037 -1.790
364 HA GLU 42 HA GLU 42 0.191 -5.228 -1.940
365 HB2 GLU 42 HB2 GLU 42 2.866 -6.363 -1.191
366 HB3 GLU 42 HB3 GLU 42 1.355 -7.025 -0.593
367 HG2 GLU 42 HG2 GLU 42 1.503 -6.621 -3.487
368 HG3 GLU 42 HG3 GLU 42 2.432 -7.963 -2.799
369 H ASN 43 H ASN 43 -0.454 -6.166 0.112
370 HA ASN 43 HA ASN 43 -0.491 -4.091 2.106
371 HB2 ASN 43 HB2 ASN 43 -2.023 -6.592 1.714
372 HB3 ASN 43 HB3 ASN 43 -1.753 -6.137 3.392
373 HD21 ASN 43 HD21 ASN 43 -2.839 -4.739 0.299
374 HD22 ASN 43 HD22 ASN 43 -4.040 -3.739 1.052
375 H GLU 44 H GLU 44 1.217 -6.988 1.646
376 HA GLU 44 HA GLU 44 2.290 -7.143 4.278
377 HB2 GLU 44 HB2 GLU 44 3.206 -8.368 1.680
378 HB3 GLU 44 HB3 GLU 44 3.830 -8.781 3.274
379 HG2 GLU 44 HG2 GLU 44 1.720 -9.631 3.955
380 HG3 GLU 44 HG3 GLU 44 0.952 -9.036 2.495
381 H ASP 45 H ASP 45 2.800 -5.090 1.651
382 HA ASP 45 HA ASP 45 5.590 -4.510 2.274
383 HB2 ASP 45 HB2 ASP 45 3.699 -3.382 0.197
384 HB3 ASP 45 HB3 ASP 45 5.241 -2.647 0.556
385 H ILE 46 H ILE 46 2.457 -3.510 3.077
386 HA ILE 46 HA ILE 46 3.068 -0.799 3.692
387 HB ILE 46 HB ILE 46 0.758 -2.465 4.726
388 HG12 ILE 46 HG12 ILE 46 0.790 -0.679 2.290
389 HG13 ILE 46 HG13 ILE 46 0.917 -2.434 2.218
390 HG21 ILE 46 HG21 ILE 46 1.146 -0.390 5.921
391 HG22 ILE 46 HG22 ILE 46 -0.363 -0.333 5.015
392 HG23 ILE 46 HG23 ILE 46 1.066 0.523 4.411
393 HD11 ILE 46 HD11 ILE 46 -1.312 -2.529 3.374
394 HD12 ILE 46 HD12 ILE 46 -1.336 -1.848 1.752
395 HD13 ILE 46 HD13 ILE 46 -1.423 -0.785 3.154
396 H TYR 47 H TYR 47 4.170 -0.120 5.335
397 HA TYR 47 HA TYR 47 5.036 -1.887 7.427
398 HB2 TYR 47 HB2 TYR 47 5.733 0.809 6.467
399 HB3 TYR 47 HB3 TYR 47 5.943 0.568 8.203
400 HD1 TYR 47 HD1 TYR 47 6.880 -2.231 8.289
401 HD2 TYR 47 HD2 TYR 47 7.875 0.901 5.585
402 HE1 TYR 47 HE1 TYR 47 9.046 -3.289 7.876
403 HE2 TYR 47 HE2 TYR 47 10.053 -0.156 5.169
404 HH TYR 47 HH TYR 47 10.723 -3.321 6.089
405 H ASN 48 H ASN 48 2.503 0.215 6.951
406 HA ASN 48 HA ASN 48 1.865 0.763 9.676
407 HB2 ASN 48 HB2 ASN 48 0.111 0.759 7.193
408 HB3 ASN 48 HB3 ASN 48 -0.464 1.212 8.786
409 HD21 ASN 48 HD21 ASN 48 -0.974 3.198 7.860
410 HD22 ASN 48 HD22 ASN 48 0.214 4.443 7.700
411 H VAL 49 H VAL 49 1.285 -1.828 7.484
412 HA VAL 49 HA VAL 49 -0.337 -3.300 9.415
413 HB VAL 49 HB VAL 49 0.675 -4.251 6.710
414 HG11 VAL 49 HG11 VAL 49 -1.131 -5.917 6.872
415 HG12 VAL 49 HG12 VAL 49 -1.535 -5.304 8.477
416 HG13 VAL 49 HG13 VAL 49 0.029 -6.063 8.193
417 HG21 VAL 49 HG21 VAL 49 -1.551 -3.730 5.818
418 HG22 VAL 49 HG22 VAL 49 -0.742 -2.279 6.414
419 HG23 VAL 49 HG23 VAL 49 -2.009 -3.039 7.373
420 H ARG 50 H ARG 50 2.565 -3.895 7.513
421 HA ARG 50 HA ARG 50 3.518 -5.933 9.309
422 HB2 ARG 50 HB2 ARG 50 3.879 -6.350 6.973
423 HB3 ARG 50 HB3 ARG 50 4.529 -4.738 6.722
424 HG2 ARG 50 HG2 ARG 50 6.568 -5.589 6.928
425 HG3 ARG 50 HG3 ARG 50 6.208 -5.943 8.615
426 HD2 ARG 50 HD2 ARG 50 6.927 -7.971 7.677
427 HD3 ARG 50 HD3 ARG 50 5.173 -8.104 7.793
428 HE ARG 50 HE ARG 50 5.447 -7.230 5.302
429 HH11 ARG 50 HH11 ARG 50 7.247 -9.776 6.993
430 HH12 ARG 50 HH12 ARG 50 7.496 -10.718 5.597
431 HH21 ARG 50 HH21 ARG 50 5.811 -8.587 3.366
432 HH22 ARG 50 HH22 ARG 50 6.692 -10.029 3.537
433 H GLY 51 H GLY 51 4.558 -5.325 11.126
434 HA2 GLY 51 HA2 GLY 51 5.606 -2.693 11.470
435 HA3 GLY 51 HA3 GLY 51 5.786 -4.039 12.588
436 H LYS 52 H LYS 52 7.184 -5.862 11.504
437 HA LYS 52 HA LYS 52 9.256 -5.162 9.785
438 HB2 LYS 52 HB2 LYS 52 11.113 -5.487 11.588
439 HB3 LYS 52 HB3 LYS 52 10.380 -3.904 11.433
440 HG2 LYS 52 HG2 LYS 52 8.901 -4.490 13.376
441 HG3 LYS 52 HG3 LYS 52 9.833 -5.977 13.557
442 HD2 LYS 52 HD2 LYS 52 10.729 -4.381 15.099
443 HD3 LYS 52 HD3 LYS 52 11.889 -4.550 13.781
444 HE2 LYS 52 HE2 LYS 52 11.027 -2.501 12.759
445 HE3 LYS 52 HE3 LYS 52 9.853 -2.337 14.062
446 HZ1 LYS 52 HZ1 LYS 52 12.808 -2.194 14.288
447 HZ2 LYS 52 HZ2 LYS 52 11.780 -2.193 15.609
448 HZ3 LYS 52 HZ3 LYS 52 11.714 -0.930 14.499
Start of MODEL 14
1 H1 SER 0 H1 SER 0 0.376 -11.400 -2.331
2 H2 SER 0 H2 SER 0 1.068 -11.013 -0.832
3 H3 SER 0 H3 SER 0 0.502 -9.814 -1.841
4 HA SER 0 HA SER 0 -1.282 -11.952 -0.943
5 HB2 SER 0 HB2 SER 0 -2.002 -10.535 0.989
6 HB3 SER 0 HB3 SER 0 -0.347 -11.109 1.145
7 HG SER 0 HG SER 0 -0.460 -8.987 1.704
8 H MET 1 H MET 1 -1.719 -8.492 -0.666
9 HA MET 1 HA MET 1 -3.616 -8.488 -2.928
10 HB2 MET 1 HB2 MET 1 -4.077 -6.973 -0.355
11 HB3 MET 1 HB3 MET 1 -5.186 -7.169 -1.699
12 HG2 MET 1 HG2 MET 1 -5.203 -9.636 -1.120
13 HG3 MET 1 HG3 MET 1 -4.376 -9.166 0.367
14 HE1 MET 1 HE1 MET 1 -7.092 -6.772 1.996
15 HE2 MET 1 HE2 MET 1 -5.852 -6.254 0.854
16 HE3 MET 1 HE3 MET 1 -5.450 -7.402 2.130
17 H ASN 2 H ASN 2 -3.672 -6.518 -3.996
18 HA ASN 2 HA ASN 2 -1.321 -4.870 -3.567
19 HB2 ASN 2 HB2 ASN 2 -3.266 -5.147 -5.841
20 HB3 ASN 2 HB3 ASN 2 -2.158 -3.791 -5.745
21 HD21 ASN 2 HD21 ASN 2 0.157 -5.008 -4.828
22 HD22 ASN 2 HD22 ASN 2 0.669 -6.165 -6.000
23 H ARG 3 H ARG 3 -1.482 -2.594 -3.718
24 HA ARG 3 HA ARG 3 -4.027 -1.313 -3.269
25 HB2 ARG 3 HB2 ARG 3 -2.725 -1.895 -1.036
26 HB3 ARG 3 HB3 ARG 3 -1.672 -0.587 -1.559
27 HG2 ARG 3 HG2 ARG 3 -3.228 0.341 -0.035
28 HG3 ARG 3 HG3 ARG 3 -3.692 0.890 -1.649
29 HD2 ARG 3 HD2 ARG 3 -5.348 -0.929 -1.751
30 HD3 ARG 3 HD3 ARG 3 -4.895 -1.398 -0.124
31 HE ARG 3 HE ARG 3 -5.691 1.353 -0.279
32 HH11 ARG 3 HH11 ARG 3 -6.920 -1.941 0.088
33 HH12 ARG 3 HH12 ARG 3 -8.363 -1.473 0.846
34 HH21 ARG 3 HH21 ARG 3 -7.585 1.996 0.784
35 HH22 ARG 3 HH22 ARG 3 -8.764 0.857 1.289
36 H LEU 4 H LEU 4 -3.828 0.948 -3.875
37 HA LEU 4 HA LEU 4 -1.516 1.420 -5.657
38 HB2 LEU 4 HB2 LEU 4 -4.378 2.299 -5.891
39 HB3 LEU 4 HB3 LEU 4 -3.097 2.770 -6.981
40 HG LEU 4 HG LEU 4 -4.088 -0.056 -6.584
41 HD11 LEU 4 HD11 LEU 4 -5.110 0.187 -8.766
42 HD12 LEU 4 HD12 LEU 4 -4.547 1.853 -8.857
43 HD13 LEU 4 HD13 LEU 4 -5.747 1.397 -7.650
44 HD21 LEU 4 HD21 LEU 4 -2.746 -0.552 -8.571
45 HD22 LEU 4 HD22 LEU 4 -1.748 0.023 -7.242
46 HD23 LEU 4 HD23 LEU 4 -2.147 1.107 -8.579
47 H GLY 5 H GLY 5 -0.302 3.089 -5.171
48 HA2 GLY 5 HA2 GLY 5 -1.566 5.421 -4.088
49 HA3 GLY 5 HA3 GLY 5 -0.393 4.642 -3.021
50 H ILE 6 H ILE 6 -0.275 7.176 -4.020
51 HA ILE 6 HA ILE 6 1.784 7.174 -6.094
52 HB ILE 6 HB ILE 6 0.438 9.485 -4.661
53 HG12 ILE 6 HG12 ILE 6 -0.187 8.499 -7.443
54 HG13 ILE 6 HG13 ILE 6 -1.092 7.978 -6.026
55 HG21 ILE 6 HG21 ILE 6 1.276 10.838 -6.529
56 HG22 ILE 6 HG22 ILE 6 2.068 9.416 -7.204
57 HG23 ILE 6 HG23 ILE 6 2.599 10.066 -5.652
58 HD11 ILE 6 HD11 ILE 6 -1.744 10.285 -5.595
59 HD12 ILE 6 HD12 ILE 6 -2.225 9.770 -7.212
60 HD13 ILE 6 HD13 ILE 6 -0.816 10.812 -6.998
61 H ILE 7 H ILE 7 3.854 7.371 -5.554
62 HA ILE 7 HA ILE 7 4.620 7.390 -2.815
63 HB ILE 7 HB ILE 7 6.365 7.969 -5.221
64 HG12 ILE 7 HG12 ILE 7 5.225 5.763 -5.344
65 HG13 ILE 7 HG13 ILE 7 6.974 5.636 -5.224
66 HG21 ILE 7 HG21 ILE 7 8.240 7.366 -3.789
67 HG22 ILE 7 HG22 ILE 7 7.138 7.036 -2.455
68 HG23 ILE 7 HG23 ILE 7 7.324 8.685 -3.053
69 HD11 ILE 7 HD11 ILE 7 5.677 3.995 -3.848
70 HD12 ILE 7 HD12 ILE 7 5.146 5.353 -2.854
71 HD13 ILE 7 HD13 ILE 7 6.859 4.954 -2.964
72 H TYR 8 H TYR 8 4.196 9.027 -1.687
73 HA TYR 8 HA TYR 8 4.093 11.694 -2.728
74 HB2 TYR 8 HB2 TYR 8 2.488 10.660 -1.058
75 HB3 TYR 8 HB3 TYR 8 3.789 10.758 0.119
76 HD1 TYR 8 HD1 TYR 8 4.348 12.828 1.159
77 HD2 TYR 8 HD2 TYR 8 1.506 12.699 -1.994
78 HE1 TYR 8 HE1 TYR 8 3.687 15.124 1.685
79 HE2 TYR 8 HE2 TYR 8 0.829 15.007 -1.484
80 HH TYR 8 HH TYR 8 0.886 16.541 0.428
81 H GLU 9 H GLU 9 6.154 9.688 -0.722
82 HA GLU 9 HA GLU 9 8.332 11.518 -0.843
83 HB2 GLU 9 HB2 GLU 9 6.735 12.409 0.940
84 HB3 GLU 9 HB3 GLU 9 7.115 10.964 1.857
85 HG2 GLU 9 HG2 GLU 9 9.456 11.627 1.929
86 HG3 GLU 9 HG3 GLU 9 9.071 13.073 0.990
87 H ILE 10 H ILE 10 10.210 10.508 0.126
88 HA ILE 10 HA ILE 10 9.923 7.634 0.624
89 HB ILE 10 HB ILE 10 12.166 9.233 -0.648
90 HG12 ILE 10 HG12 ILE 10 10.297 8.499 -2.093
91 HG13 ILE 10 HG13 ILE 10 11.845 7.808 -2.581
92 HG21 ILE 10 HG21 ILE 10 13.509 7.184 -0.788
93 HG22 ILE 10 HG22 ILE 10 12.320 6.351 0.214
94 HG23 ILE 10 HG23 ILE 10 13.243 7.699 0.880
95 HD11 ILE 10 HD11 ILE 10 10.125 6.157 -2.773
96 HD12 ILE 10 HD12 ILE 10 9.590 6.447 -1.120
97 HD13 ILE 10 HD13 ILE 10 11.171 5.718 -1.421
98 H GLN 11 H GLN 11 10.984 6.804 2.417
99 HA GLN 11 HA GLN 11 12.352 8.717 4.154
100 HB2 GLN 11 HB2 GLN 11 9.811 7.733 4.639
101 HB3 GLN 11 HB3 GLN 11 10.840 6.623 5.526
102 HG2 GLN 11 HG2 GLN 11 10.559 8.119 7.155
103 HG3 GLN 11 HG3 GLN 11 11.906 8.920 6.354
104 HE21 GLN 11 HE21 GLN 11 10.315 9.885 4.097
105 HE22 GLN 11 HE22 GLN 11 9.290 11.130 4.700
106 H GLY 12 H GLY 12 14.195 7.697 3.131
107 HA2 GLY 12 HA2 GLY 12 15.962 6.241 3.151
108 HA3 GLY 12 HA3 GLY 12 15.239 5.484 4.571
109 H MET 13 H MET 13 14.453 3.501 4.338
110 HA MET 13 HA MET 13 13.980 2.555 1.616
111 HB2 MET 13 HB2 MET 13 14.675 0.971 4.099
112 HB3 MET 13 HB3 MET 13 14.185 0.239 2.582
113 HG2 MET 13 HG2 MET 13 16.138 1.619 1.573
114 HG3 MET 13 HG3 MET 13 16.692 1.714 3.239
115 HE1 MET 13 HE1 MET 13 16.021 -0.482 0.145
116 HE2 MET 13 HE2 MET 13 14.902 -1.286 1.249
117 HE3 MET 13 HE3 MET 13 16.350 -2.119 0.699
118 H LYS 14 H LYS 14 12.262 4.007 3.674
119 HA LYS 14 HA LYS 14 9.934 2.262 3.357
120 HB2 LYS 14 HB2 LYS 14 10.182 4.745 5.064
121 HB3 LYS 14 HB3 LYS 14 8.863 3.600 5.050
122 HG2 LYS 14 HG2 LYS 14 10.327 1.901 6.043
123 HG3 LYS 14 HG3 LYS 14 11.650 3.074 6.067
124 HD2 LYS 14 HD2 LYS 14 10.130 4.576 7.410
125 HD3 LYS 14 HD3 LYS 14 9.045 3.197 7.573
126 HE2 LYS 14 HE2 LYS 14 10.804 1.927 8.678
127 HE3 LYS 14 HE3 LYS 14 11.925 3.268 8.451
128 HZ1 LYS 14 HZ1 LYS 14 10.411 4.634 9.834
129 HZ2 LYS 14 HZ2 LYS 14 11.078 3.341 10.664
130 HZ3 LYS 14 HZ3 LYS 14 9.484 3.254 10.144
131 H ALA 15 H ALA 15 8.030 3.425 2.605
132 HA ALA 15 HA ALA 15 8.606 5.928 1.211
133 HB1 ALA 15 HB1 ALA 15 7.157 3.555 0.022
134 HB2 ALA 15 HB2 ALA 15 8.751 4.140 -0.450
135 HB3 ALA 15 HB3 ALA 15 7.326 5.141 -0.729
136 H VAL 16 H VAL 16 6.928 7.337 1.154
137 HA VAL 16 HA VAL 16 4.600 6.663 2.801
138 HB VAL 16 HB VAL 16 5.550 9.373 1.785
139 HG11 VAL 16 HG11 VAL 16 3.361 8.713 3.760
140 HG12 VAL 16 HG12 VAL 16 3.127 9.279 2.108
141 HG13 VAL 16 HG13 VAL 16 3.884 10.335 3.301
142 HG21 VAL 16 HG21 VAL 16 7.069 8.475 3.491
143 HG22 VAL 16 HG22 VAL 16 5.681 8.236 4.568
144 HG23 VAL 16 HG23 VAL 16 6.152 9.862 4.092
145 H VAL 17 H VAL 17 2.962 5.967 1.640
146 HA VAL 17 HA VAL 17 2.709 6.964 -1.098
147 HB VAL 17 HB VAL 17 1.022 5.077 -1.364
148 HG11 VAL 17 HG11 VAL 17 3.158 5.005 -2.424
149 HG12 VAL 17 HG12 VAL 17 2.788 3.408 -1.772
150 HG13 VAL 17 HG13 VAL 17 3.931 4.462 -0.935
151 HG21 VAL 17 HG21 VAL 17 1.163 3.192 0.134
152 HG22 VAL 17 HG22 VAL 17 0.802 4.649 1.058
153 HG23 VAL 17 HG23 VAL 17 2.434 3.992 1.063
154 H LEU 18 H LEU 18 1.116 8.110 -1.671
155 HA LEU 18 HA LEU 18 -1.081 8.581 0.175
156 HB2 LEU 18 HB2 LEU 18 0.024 10.538 -0.751
157 HB3 LEU 18 HB3 LEU 18 -0.146 9.916 -2.374
158 HG LEU 18 HG LEU 18 -2.619 10.157 -2.159
159 HD11 LEU 18 HD11 LEU 18 -3.480 11.558 -0.348
160 HD12 LEU 18 HD12 LEU 18 -1.895 11.506 0.430
161 HD13 LEU 18 HD13 LEU 18 -2.835 10.025 0.231
162 HD21 LEU 18 HD21 LEU 18 -2.639 12.577 -2.399
163 HD22 LEU 18 HD22 LEU 18 -1.254 11.876 -3.238
164 HD23 LEU 18 HD23 LEU 18 -1.031 12.674 -1.681
165 H THR 19 H THR 19 -2.489 6.947 -0.078
166 HA THR 19 HA THR 19 -2.663 5.455 -2.484
167 HB THR 19 HB THR 19 -4.579 4.305 -1.394
168 HG1 THR 19 HG1 THR 19 -5.290 4.900 0.531
169 HG21 THR 19 HG21 THR 19 -3.285 3.308 0.443
170 HG22 THR 19 HG22 THR 19 -2.137 4.646 0.349
171 HG23 THR 19 HG23 THR 19 -2.301 3.528 -1.006
172 H SER 20 H SER 20 -4.841 5.072 -3.556
173 HA SER 20 HA SER 20 -5.703 7.415 -4.779
174 HB2 SER 20 HB2 SER 20 -7.631 5.849 -5.516
175 HB3 SER 20 HB3 SER 20 -5.977 5.460 -5.995
176 HG SER 20 HG SER 20 -6.970 4.404 -3.561
177 H GLU 21 H GLU 21 -6.737 5.910 -1.891
178 HA GLU 21 HA GLU 21 -9.290 7.131 -1.612
179 HB2 GLU 21 HB2 GLU 21 -7.524 6.079 0.577
180 HB3 GLU 21 HB3 GLU 21 -9.269 6.298 0.628
181 HG2 GLU 21 HG2 GLU 21 -9.229 4.100 0.217
182 HG3 GLU 21 HG3 GLU 21 -9.135 4.664 -1.438
183 H GLY 22 H GLY 22 -6.056 8.212 -1.166
184 HA2 GLY 22 HA2 GLY 22 -5.454 10.418 -0.751
185 HA3 GLY 22 HA3 GLY 22 -7.013 10.683 0.022
186 H GLU 23 H GLU 23 -5.134 7.880 0.818
187 HA GLU 23 HA GLU 23 -4.744 8.958 3.525
188 HB2 GLU 23 HB2 GLU 23 -4.744 6.096 2.566
189 HB3 GLU 23 HB3 GLU 23 -4.653 6.644 4.230
190 HG2 GLU 23 HG2 GLU 23 -6.992 7.103 2.402
191 HG3 GLU 23 HG3 GLU 23 -6.872 5.795 3.582
192 H PHE 24 H PHE 24 -2.695 8.816 4.453
193 HA PHE 24 HA PHE 24 -0.532 8.158 2.584
194 HB2 PHE 24 HB2 PHE 24 -0.297 9.683 5.210
195 HB3 PHE 24 HB3 PHE 24 0.962 9.375 4.037
196 HD1 PHE 24 HD1 PHE 24 1.436 10.871 2.374
197 HD2 PHE 24 HD2 PHE 24 -2.295 11.105 4.393
198 HE1 PHE 24 HE1 PHE 24 0.964 13.005 1.253
199 HE2 PHE 24 HE2 PHE 24 -2.776 13.238 3.272
200 HZ PHE 24 HZ PHE 24 -1.141 14.191 1.701
201 H LEU 25 H LEU 25 0.222 6.273 2.786
202 HA LEU 25 HA LEU 25 0.225 4.947 5.425
203 HB2 LEU 25 HB2 LEU 25 -0.195 3.883 2.657
204 HB3 LEU 25 HB3 LEU 25 0.554 2.854 3.851
205 HG LEU 25 HG LEU 25 -1.487 3.043 5.260
206 HD11 LEU 25 HD11 LEU 25 -2.645 4.518 2.902
207 HD12 LEU 25 HD12 LEU 25 -2.289 5.221 4.484
208 HD13 LEU 25 HD13 LEU 25 -3.529 3.979 4.330
209 HD21 LEU 25 HD21 LEU 25 -1.116 1.258 3.538
210 HD22 LEU 25 HD22 LEU 25 -2.175 2.178 2.469
211 HD23 LEU 25 HD23 LEU 25 -2.797 1.540 3.989
212 H ILE 26 H ILE 26 2.124 3.905 6.089
213 HA ILE 26 HA ILE 26 4.522 4.677 4.631
214 HB ILE 26 HB ILE 26 4.248 3.342 7.351
215 HG12 ILE 26 HG12 ILE 26 3.258 5.583 7.444
216 HG13 ILE 26 HG13 ILE 26 4.759 5.536 8.354
217 HG21 ILE 26 HG21 ILE 26 6.408 2.919 6.333
218 HG22 ILE 26 HG22 ILE 26 6.583 4.009 7.707
219 HG23 ILE 26 HG23 ILE 26 6.647 4.647 6.065
220 HD11 ILE 26 HD11 ILE 26 4.340 6.720 5.614
221 HD12 ILE 26 HD12 ILE 26 5.895 6.611 6.437
222 HD13 ILE 26 HD13 ILE 26 4.606 7.599 7.119
223 H ILE 27 H ILE 27 5.370 3.224 3.298
224 HA ILE 27 HA ILE 27 4.847 0.384 3.840
225 HB ILE 27 HB ILE 27 4.679 -0.098 1.469
226 HG12 ILE 27 HG12 ILE 27 4.796 2.860 0.863
227 HG13 ILE 27 HG13 ILE 27 6.219 1.823 0.807
228 HG21 ILE 27 HG21 ILE 27 2.584 1.065 0.905
229 HG22 ILE 27 HG22 ILE 27 2.855 2.165 2.255
230 HG23 ILE 27 HG23 ILE 27 2.586 0.453 2.556
231 HD11 ILE 27 HD11 ILE 27 3.728 1.493 -0.854
232 HD12 ILE 27 HD12 ILE 27 5.149 0.456 -0.910
233 HD13 ILE 27 HD13 ILE 27 5.268 2.146 -1.406
234 H ARG 28 H ARG 28 6.378 -1.028 2.908
235 HA ARG 28 HA ARG 28 9.116 -0.355 3.157
236 HB2 ARG 28 HB2 ARG 28 7.810 -2.663 1.688
237 HB3 ARG 28 HB3 ARG 28 9.517 -2.550 2.069
238 HG2 ARG 28 HG2 ARG 28 9.038 -2.716 4.431
239 HG3 ARG 28 HG3 ARG 28 7.302 -2.687 4.105
240 HD2 ARG 28 HD2 ARG 28 7.477 -4.776 2.874
241 HD3 ARG 28 HD3 ARG 28 9.217 -4.798 3.102
242 HE ARG 28 HE ARG 28 8.150 -4.678 5.625
243 HH11 ARG 28 HH11 ARG 28 7.857 -6.911 2.898
244 HH12 ARG 28 HH12 ARG 28 7.558 -8.283 3.861
245 HH21 ARG 28 HH21 ARG 28 7.848 -6.547 6.942
246 HH22 ARG 28 HH22 ARG 28 7.617 -8.091 6.269
247 H ARG 29 H ARG 29 10.460 0.501 1.674
248 HA ARG 29 HA ARG 29 9.346 1.164 -0.920
249 HB2 ARG 29 HB2 ARG 29 10.565 2.908 0.339
250 HB3 ARG 29 HB3 ARG 29 12.014 1.915 0.282
251 HG2 ARG 29 HG2 ARG 29 11.471 2.012 -2.324
252 HG3 ARG 29 HG3 ARG 29 10.748 3.544 -1.833
253 HD2 ARG 29 HD2 ARG 29 12.869 4.205 -0.810
254 HD3 ARG 29 HD3 ARG 29 13.553 2.639 -1.273
255 HE ARG 29 HE ARG 29 12.766 3.543 -3.626
256 HH11 ARG 29 HH11 ARG 29 14.619 5.244 -1.108
257 HH12 ARG 29 HH12 ARG 29 15.452 6.218 -2.230
258 HH21 ARG 29 HH21 ARG 29 13.967 4.927 -5.134
259 HH22 ARG 29 HH22 ARG 29 15.067 6.049 -4.514
260 H ARG 30 H ARG 30 9.733 0.011 -2.625
261 HA ARG 30 HA ARG 30 11.935 -1.902 -2.595
262 HB2 ARG 30 HB2 ARG 30 9.640 -1.636 -4.563
263 HB3 ARG 30 HB3 ARG 30 10.829 -2.924 -4.525
264 HG2 ARG 30 HG2 ARG 30 9.916 -3.620 -2.308
265 HG3 ARG 30 HG3 ARG 30 8.643 -2.409 -2.515
266 HD2 ARG 30 HD2 ARG 30 8.093 -3.499 -4.702
267 HD3 ARG 30 HD3 ARG 30 9.216 -4.783 -4.275
268 HE ARG 30 HE ARG 30 7.155 -4.342 -2.300
269 HH11 ARG 30 HH11 ARG 30 8.020 -6.130 -5.242
270 HH12 ARG 30 HH12 ARG 30 6.752 -7.270 -5.067
271 HH21 ARG 30 HH21 ARG 30 5.420 -5.794 -2.144
272 HH22 ARG 30 HH22 ARG 30 5.214 -7.112 -3.217
273 H LYS 31 H LYS 31 12.827 -2.056 -5.026
274 HA LYS 31 HA LYS 31 14.196 0.393 -5.396
275 HB2 LYS 31 HB2 LYS 31 14.106 -2.095 -7.092
276 HB3 LYS 31 HB3 LYS 31 15.171 -0.733 -7.404
277 HG2 LYS 31 HG2 LYS 31 16.271 -1.052 -5.289
278 HG3 LYS 31 HG3 LYS 31 15.151 -2.344 -4.863
279 HD2 LYS 31 HD2 LYS 31 15.964 -3.554 -6.919
280 HD3 LYS 31 HD3 LYS 31 17.230 -2.331 -7.037
281 HE2 LYS 31 HE2 LYS 31 17.888 -2.905 -4.704
282 HE3 LYS 31 HE3 LYS 31 16.742 -4.235 -4.753
283 HZ1 LYS 31 HZ1 LYS 31 17.994 -5.080 -6.720
284 HZ2 LYS 31 HZ2 LYS 31 18.857 -5.089 -5.274
285 HZ3 LYS 31 HZ3 LYS 31 19.164 -3.893 -6.421
286 H ASP 32 H ASP 32 11.302 -0.844 -6.749
287 HA ASP 32 HA ASP 32 11.426 0.998 -8.984
288 HB2 ASP 32 HB2 ASP 32 9.420 -1.116 -8.229
289 HB3 ASP 32 HB3 ASP 32 9.109 0.047 -9.515
290 H MET 33 H MET 33 10.833 1.566 -5.931
291 HA MET 33 HA MET 33 8.458 3.206 -6.285
292 HB2 MET 33 HB2 MET 33 10.146 2.424 -3.966
293 HB3 MET 33 HB3 MET 33 9.253 3.924 -3.849
294 HG2 MET 33 HG2 MET 33 7.921 2.272 -2.824
295 HG3 MET 33 HG3 MET 33 7.186 2.593 -4.391
296 HE1 MET 33 HE1 MET 33 6.731 0.008 -2.434
297 HE2 MET 33 HE2 MET 33 6.572 -1.250 -3.664
298 HE3 MET 33 HE3 MET 33 5.796 0.318 -3.897
299 H LYS 34 H LYS 34 8.663 5.134 -7.242
300 HA LYS 34 HA LYS 34 11.006 6.765 -6.662
301 HB2 LYS 34 HB2 LYS 34 9.376 6.434 -9.174
302 HB3 LYS 34 HB3 LYS 34 10.516 7.735 -8.895
303 HG2 LYS 34 HG2 LYS 34 12.358 6.164 -8.833
304 HG3 LYS 34 HG3 LYS 34 11.240 4.803 -8.908
305 HD2 LYS 34 HD2 LYS 34 12.275 5.251 -11.098
306 HD3 LYS 34 HD3 LYS 34 10.528 5.485 -11.139
307 HE2 LYS 34 HE2 LYS 34 10.858 7.906 -10.897
308 HE3 LYS 34 HE3 LYS 34 12.607 7.662 -10.895
309 HZ1 LYS 34 HZ1 LYS 34 10.779 6.945 -13.119
310 HZ2 LYS 34 HZ2 LYS 34 12.463 6.854 -13.148
311 HZ3 LYS 34 HZ3 LYS 34 11.692 8.351 -13.037
312 H VAL 35 H VAL 35 10.463 8.938 -6.260
313 HA VAL 35 HA VAL 35 7.922 9.385 -5.101
314 HB VAL 35 HB VAL 35 9.943 11.514 -5.865
315 HG11 VAL 35 HG11 VAL 35 7.749 11.462 -3.797
316 HG12 VAL 35 HG12 VAL 35 7.792 12.442 -5.258
317 HG13 VAL 35 HG13 VAL 35 8.943 12.750 -3.955
318 HG21 VAL 35 HG21 VAL 35 10.952 11.257 -3.719
319 HG22 VAL 35 HG22 VAL 35 10.900 9.657 -4.472
320 HG23 VAL 35 HG23 VAL 35 9.722 10.097 -3.233
321 H GLY 36 H GLY 36 6.099 10.163 -5.921
322 HA2 GLY 36 HA2 GLY 36 4.974 11.820 -7.199
323 HA3 GLY 36 HA3 GLY 36 6.240 11.700 -8.406
324 H GLN 37 H GLN 37 6.086 8.696 -8.225
325 HA GLN 37 HA GLN 37 3.880 8.556 -10.111
326 HB2 GLN 37 HB2 GLN 37 4.858 6.543 -10.971
327 HB3 GLN 37 HB3 GLN 37 6.091 7.785 -10.864
328 HG2 GLN 37 HG2 GLN 37 6.833 6.734 -8.719
329 HG3 GLN 37 HG3 GLN 37 5.716 5.414 -9.057
330 HE21 GLN 37 HE21 GLN 37 7.314 3.865 -9.277
331 HE22 GLN 37 HE22 GLN 37 8.404 3.867 -10.610
332 H GLN 38 H GLN 38 2.483 6.712 -10.169
333 HA GLN 38 HA GLN 38 1.630 5.919 -7.499
334 HB2 GLN 38 HB2 GLN 38 0.022 6.935 -9.132
335 HB3 GLN 38 HB3 GLN 38 0.238 5.520 -10.158
336 HG2 GLN 38 HG2 GLN 38 -0.659 4.116 -8.369
337 HG3 GLN 38 HG3 GLN 38 -0.854 5.541 -7.350
338 HE21 GLN 38 HE21 GLN 38 -3.053 5.392 -7.180
339 HE22 GLN 38 HE22 GLN 38 -4.118 5.642 -8.510
340 H VAL 39 H VAL 39 2.055 4.011 -6.758
341 HA VAL 39 HA VAL 39 3.075 2.028 -8.649
342 HB VAL 39 HB VAL 39 4.602 1.210 -6.941
343 HG11 VAL 39 HG11 VAL 39 6.127 3.067 -6.717
344 HG12 VAL 39 HG12 VAL 39 4.833 4.199 -7.107
345 HG13 VAL 39 HG13 VAL 39 5.398 3.057 -8.325
346 HG21 VAL 39 HG21 VAL 39 3.503 3.362 -5.124
347 HG22 VAL 39 HG22 VAL 39 4.838 2.262 -4.755
348 HG23 VAL 39 HG23 VAL 39 3.211 1.628 -4.981
349 H SER 40 H SER 40 2.681 -0.155 -8.102
350 HA SER 40 HA SER 40 0.296 -0.554 -6.481
351 HB2 SER 40 HB2 SER 40 1.617 -2.502 -8.382
352 HB3 SER 40 HB3 SER 40 -0.029 -2.557 -7.745
353 HG SER 40 HG SER 40 0.495 -0.241 -8.999
354 H PHE 41 H PHE 41 0.762 -1.195 -4.508
355 HA PHE 41 HA PHE 41 3.154 -2.842 -4.117
356 HB2 PHE 41 HB2 PHE 41 3.248 -1.899 -1.788
357 HB3 PHE 41 HB3 PHE 41 3.639 -0.749 -3.047
358 HD1 PHE 41 HD1 PHE 41 1.918 0.997 -3.657
359 HD2 PHE 41 HD2 PHE 41 1.464 -1.553 -0.289
360 HE1 PHE 41 HE1 PHE 41 0.259 2.538 -2.723
361 HE2 PHE 41 HE2 PHE 41 -0.209 -0.009 0.645
362 HZ PHE 41 HZ PHE 41 -0.807 2.031 -0.567
363 H GLU 42 H GLU 42 2.872 -4.019 -1.917
364 HA GLU 42 HA GLU 42 0.186 -5.163 -2.087
365 HB2 GLU 42 HB2 GLU 42 2.654 -6.453 -0.968
366 HB3 GLU 42 HB3 GLU 42 1.085 -7.191 -1.286
367 HG2 GLU 42 HG2 GLU 42 1.433 -6.624 -3.686
368 HG3 GLU 42 HG3 GLU 42 3.098 -6.225 -3.264
369 H ASN 43 H ASN 43 -0.549 -6.130 -0.075
370 HA ASN 43 HA ASN 43 -0.528 -4.220 2.021
371 HB2 ASN 43 HB2 ASN 43 -1.739 -6.949 1.708
372 HB3 ASN 43 HB3 ASN 43 -1.663 -6.234 3.314
373 HD21 ASN 43 HD21 ASN 43 -2.252 -4.601 0.189
374 HD22 ASN 43 HD22 ASN 43 -3.835 -4.061 0.632
375 H GLU 44 H GLU 44 1.384 -6.902 1.244
376 HA GLU 44 HA GLU 44 2.572 -7.344 3.792
377 HB2 GLU 44 HB2 GLU 44 3.481 -8.080 1.012
378 HB3 GLU 44 HB3 GLU 44 4.209 -8.666 2.503
379 HG2 GLU 44 HG2 GLU 44 2.145 -9.748 3.115
380 HG3 GLU 44 HG3 GLU 44 1.364 -9.111 1.671
381 H ASP 45 H ASP 45 2.942 -4.935 1.365
382 HA ASP 45 HA ASP 45 5.662 -4.289 2.176
383 HB2 ASP 45 HB2 ASP 45 3.784 -2.881 0.264
384 HB3 ASP 45 HB3 ASP 45 5.411 -2.335 0.630
385 H ILE 46 H ILE 46 2.492 -3.611 3.075
386 HA ILE 46 HA ILE 46 2.976 -0.909 3.868
387 HB ILE 46 HB ILE 46 0.601 -2.565 4.749
388 HG12 ILE 46 HG12 ILE 46 0.860 -0.950 2.207
389 HG13 ILE 46 HG13 ILE 46 0.884 -2.705 2.273
390 HG21 ILE 46 HG21 ILE 46 -0.506 -0.391 4.815
391 HG22 ILE 46 HG22 ILE 46 0.975 0.394 4.261
392 HG23 ILE 46 HG23 ILE 46 0.930 -0.410 5.835
393 HD11 ILE 46 HD11 ILE 46 -1.303 -1.959 1.594
394 HD12 ILE 46 HD12 ILE 46 -1.416 -0.891 2.990
395 HD13 ILE 46 HD13 ILE 46 -1.424 -2.637 3.219
396 H TYR 47 H TYR 47 3.938 -0.257 5.585
397 HA TYR 47 HA TYR 47 4.618 -1.976 7.780
398 HB2 TYR 47 HB2 TYR 47 5.147 0.804 6.910
399 HB3 TYR 47 HB3 TYR 47 5.261 0.512 8.656
400 HD1 TYR 47 HD1 TYR 47 6.999 0.746 5.670
401 HD2 TYR 47 HD2 TYR 47 6.782 -1.690 9.150
402 HE1 TYR 47 HE1 TYR 47 9.301 0.001 5.283
403 HE2 TYR 47 HE2 TYR 47 9.094 -2.445 8.764
404 HH TYR 47 HH TYR 47 11.156 -0.940 6.469
405 H ASN 48 H ASN 48 2.229 0.300 6.925
406 HA ASN 48 HA ASN 48 1.074 0.641 9.534
407 HB2 ASN 48 HB2 ASN 48 -0.050 1.219 6.764
408 HB3 ASN 48 HB3 ASN 48 -0.910 1.552 8.254
409 HD21 ASN 48 HD21 ASN 48 -1.013 3.720 7.843
410 HD22 ASN 48 HD22 ASN 48 0.354 4.763 7.958
411 H VAL 49 H VAL 49 -0.854 -0.296 10.266
412 HA VAL 49 HA VAL 49 -1.370 -2.920 9.104
413 HB VAL 49 HB VAL 49 -2.484 -1.692 11.653
414 HG11 VAL 49 HG11 VAL 49 -2.507 -4.541 10.666
415 HG12 VAL 49 HG12 VAL 49 -3.898 -3.469 10.822
416 HG13 VAL 49 HG13 VAL 49 -3.046 -4.020 12.262
417 HG21 VAL 49 HG21 VAL 49 -0.168 -3.590 11.308
418 HG22 VAL 49 HG22 VAL 49 -0.885 -3.131 12.853
419 HG23 VAL 49 HG23 VAL 49 -0.085 -1.915 11.855
420 H ARG 50 H ARG 50 -3.101 -0.130 10.323
421 HA ARG 50 HA ARG 50 -4.723 0.448 8.167
422 HB2 ARG 50 HB2 ARG 50 -5.692 -1.840 8.652
423 HB3 ARG 50 HB3 ARG 50 -6.211 -1.235 10.221
424 HG2 ARG 50 HG2 ARG 50 -7.762 0.228 9.233
425 HG3 ARG 50 HG3 ARG 50 -7.065 0.008 7.627
426 HD2 ARG 50 HD2 ARG 50 -7.800 -2.311 7.601
427 HD3 ARG 50 HD3 ARG 50 -8.433 -2.154 9.239
428 HE ARG 50 HE ARG 50 -9.837 -0.308 8.141
429 HH11 ARG 50 HH11 ARG 50 -9.064 -3.447 6.676
430 HH12 ARG 50 HH12 ARG 50 -10.411 -3.470 5.641
431 HH21 ARG 50 HH21 ARG 50 -11.736 -0.374 6.756
432 HH22 ARG 50 HH22 ARG 50 -11.973 -1.686 5.703
433 H GLY 51 H GLY 51 -4.614 2.542 8.748
434 HA2 GLY 51 HA2 GLY 51 -5.548 4.348 9.961
435 HA3 GLY 51 HA3 GLY 51 -5.679 3.298 11.378
436 H LYS 52 H LYS 52 -3.129 2.126 11.080
437 HA LYS 52 HA LYS 52 -1.030 3.935 10.949
438 HB2 LYS 52 HB2 LYS 52 -2.339 4.117 13.364
439 HB3 LYS 52 HB3 LYS 52 -1.309 2.729 13.672
440 HG2 LYS 52 HG2 LYS 52 -0.292 5.419 12.759
441 HG3 LYS 52 HG3 LYS 52 -0.361 4.890 14.438
442 HD2 LYS 52 HD2 LYS 52 1.157 3.058 13.954
443 HD3 LYS 52 HD3 LYS 52 1.159 3.493 12.245
444 HE2 LYS 52 HE2 LYS 52 2.184 5.215 14.504
445 HE3 LYS 52 HE3 LYS 52 3.176 4.280 13.398
446 HZ1 LYS 52 HZ1 LYS 52 2.247 5.625 11.559
447 HZ2 LYS 52 HZ2 LYS 52 3.108 6.539 12.666
448 HZ3 LYS 52 HZ3 LYS 52 1.442 6.577 12.681
Start of MODEL 15
1 H1 SER 0 H1 SER 0 -2.476 -8.719 1.772
2 H2 SER 0 H2 SER 0 -1.388 -8.655 0.433
3 H3 SER 0 H3 SER 0 -1.295 -9.901 1.551
4 HA SER 0 HA SER 0 -2.400 -10.529 -0.523
5 HB2 SER 0 HB2 SER 0 -4.605 -11.179 0.782
6 HB3 SER 0 HB3 SER 0 -3.052 -11.919 1.194
7 HG SER 0 HG SER 0 -3.807 -11.224 3.089
8 H MET 1 H MET 1 -2.570 -7.565 -0.440
9 HA MET 1 HA MET 1 -5.030 -7.157 -1.827
10 HB2 MET 1 HB2 MET 1 -4.496 -5.512 0.674
11 HB3 MET 1 HB3 MET 1 -5.768 -5.232 -0.495
12 HG2 MET 1 HG2 MET 1 -6.809 -7.366 0.166
13 HG3 MET 1 HG3 MET 1 -5.515 -7.583 1.351
14 HE1 MET 1 HE1 MET 1 -8.596 -5.447 0.275
15 HE2 MET 1 HE2 MET 1 -7.382 -4.172 0.421
16 HE3 MET 1 HE3 MET 1 -8.716 -4.254 1.566
17 H ASN 2 H ASN 2 -3.602 -6.696 -3.479
18 HA ASN 2 HA ASN 2 -1.583 -4.794 -3.506
19 HB2 ASN 2 HB2 ASN 2 -3.521 -5.473 -5.727
20 HB3 ASN 2 HB3 ASN 2 -2.164 -4.379 -5.932
21 HD21 ASN 2 HD21 ASN 2 -0.005 -5.255 -5.729
22 HD22 ASN 2 HD22 ASN 2 0.265 -6.914 -6.006
23 H ARG 3 H ARG 3 -1.534 -2.754 -3.192
24 HA ARG 3 HA ARG 3 -4.019 -1.204 -3.384
25 HB2 ARG 3 HB2 ARG 3 -2.908 -1.655 -1.064
26 HB3 ARG 3 HB3 ARG 3 -1.715 -0.501 -1.619
27 HG2 ARG 3 HG2 ARG 3 -3.277 0.685 -0.274
28 HG3 ARG 3 HG3 ARG 3 -3.531 1.165 -1.952
29 HD2 ARG 3 HD2 ARG 3 -5.182 -1.102 -1.366
30 HD3 ARG 3 HD3 ARG 3 -5.384 0.125 -0.114
31 HE ARG 3 HE ARG 3 -6.157 1.653 -1.698
32 HH11 ARG 3 HH11 ARG 3 -5.710 -1.611 -3.115
33 HH12 ARG 3 HH12 ARG 3 -6.577 -1.241 -4.523
34 HH21 ARG 3 HH21 ARG 3 -7.401 2.058 -3.600
35 HH22 ARG 3 HH22 ARG 3 -7.570 0.875 -4.830
36 H LEU 4 H LEU 4 -3.747 0.951 -4.103
37 HA LEU 4 HA LEU 4 -1.339 1.320 -5.714
38 HB2 LEU 4 HB2 LEU 4 -4.155 2.292 -6.182
39 HB3 LEU 4 HB3 LEU 4 -2.788 2.721 -7.183
40 HG LEU 4 HG LEU 4 -3.965 -0.044 -6.858
41 HD11 LEU 4 HD11 LEU 4 -4.021 1.858 -9.194
42 HD12 LEU 4 HD12 LEU 4 -5.380 1.471 -8.139
43 HD13 LEU 4 HD13 LEU 4 -4.681 0.223 -9.170
44 HD21 LEU 4 HD21 LEU 4 -1.594 -0.230 -7.246
45 HD22 LEU 4 HD22 LEU 4 -1.679 0.939 -8.567
46 HD23 LEU 4 HD23 LEU 4 -2.449 -0.639 -8.736
47 H GLY 5 H GLY 5 -0.205 3.153 -5.245
48 HA2 GLY 5 HA2 GLY 5 -1.580 5.427 -4.100
49 HA3 GLY 5 HA3 GLY 5 -0.399 4.644 -3.047
50 H ILE 6 H ILE 6 -0.339 7.255 -3.977
51 HA ILE 6 HA ILE 6 1.732 7.314 -6.044
52 HB ILE 6 HB ILE 6 0.335 9.602 -4.620
53 HG12 ILE 6 HG12 ILE 6 -0.243 8.598 -7.411
54 HG13 ILE 6 HG13 ILE 6 -1.170 8.091 -6.008
55 HG21 ILE 6 HG21 ILE 6 2.027 9.563 -7.123
56 HG22 ILE 6 HG22 ILE 6 2.482 10.241 -5.560
57 HG23 ILE 6 HG23 ILE 6 1.175 10.972 -6.489
58 HD11 ILE 6 HD11 ILE 6 -2.259 9.890 -7.274
59 HD12 ILE 6 HD12 ILE 6 -0.876 10.938 -6.958
60 HD13 ILE 6 HD13 ILE 6 -1.878 10.375 -5.622
61 H ILE 7 H ILE 7 3.792 7.493 -5.505
62 HA ILE 7 HA ILE 7 4.619 7.554 -2.781
63 HB ILE 7 HB ILE 7 6.284 8.125 -5.251
64 HG12 ILE 7 HG12 ILE 7 5.182 5.914 -5.256
65 HG13 ILE 7 HG13 ILE 7 6.937 5.809 -5.197
66 HG21 ILE 7 HG21 ILE 7 7.169 7.280 -2.484
67 HG22 ILE 7 HG22 ILE 7 7.273 8.923 -3.107
68 HG23 ILE 7 HG23 ILE 7 8.212 7.632 -3.863
69 HD11 ILE 7 HD11 ILE 7 5.206 5.604 -2.751
70 HD12 ILE 7 HD12 ILE 7 6.911 5.179 -2.926
71 HD13 ILE 7 HD13 ILE 7 5.671 4.218 -3.726
72 H TYR 8 H TYR 8 4.252 9.100 -1.617
73 HA TYR 8 HA TYR 8 4.055 11.787 -2.559
74 HB2 TYR 8 HB2 TYR 8 2.606 10.559 -0.826
75 HB3 TYR 8 HB3 TYR 8 3.926 10.883 0.290
76 HD1 TYR 8 HD1 TYR 8 1.470 12.486 -1.964
77 HD2 TYR 8 HD2 TYR 8 4.134 12.964 1.297
78 HE1 TYR 8 HE1 TYR 8 0.518 14.705 -1.527
79 HE2 TYR 8 HE2 TYR 8 3.215 15.170 1.756
80 HH TYR 8 HH TYR 8 1.977 16.904 0.649
81 H GLU 9 H GLU 9 6.174 9.813 -0.557
82 HA GLU 9 HA GLU 9 8.419 11.526 -0.890
83 HB2 GLU 9 HB2 GLU 9 6.978 12.715 0.879
84 HB3 GLU 9 HB3 GLU 9 7.300 11.350 1.925
85 HG2 GLU 9 HG2 GLU 9 9.706 11.817 1.778
86 HG3 GLU 9 HG3 GLU 9 9.368 13.198 0.737
87 H ILE 10 H ILE 10 10.293 10.599 0.207
88 HA ILE 10 HA ILE 10 9.947 7.719 0.701
89 HB ILE 10 HB ILE 10 12.302 9.236 -0.439
90 HG12 ILE 10 HG12 ILE 10 10.370 8.879 -1.908
91 HG13 ILE 10 HG13 ILE 10 11.858 8.151 -2.527
92 HG21 ILE 10 HG21 ILE 10 13.390 7.045 -0.769
93 HG22 ILE 10 HG22 ILE 10 12.051 6.267 0.074
94 HG23 ILE 10 HG23 ILE 10 13.102 7.384 0.939
95 HD11 ILE 10 HD11 ILE 10 9.498 6.759 -1.256
96 HD12 ILE 10 HD12 ILE 10 11.016 5.958 -1.658
97 HD13 ILE 10 HD13 ILE 10 10.025 6.650 -2.935
98 H GLN 11 H GLN 11 10.878 6.869 2.512
99 HA GLN 11 HA GLN 11 12.373 8.685 4.251
100 HB2 GLN 11 HB2 GLN 11 9.864 7.360 4.788
101 HB3 GLN 11 HB3 GLN 11 11.103 6.738 5.865
102 HG2 GLN 11 HG2 GLN 11 10.329 8.484 7.100
103 HG3 GLN 11 HG3 GLN 11 11.632 9.276 6.222
104 HE21 GLN 11 HE21 GLN 11 11.050 10.575 4.383
105 HE22 GLN 11 HE22 GLN 11 9.531 11.363 4.338
106 H GLY 12 H GLY 12 14.160 7.665 3.064
107 HA2 GLY 12 HA2 GLY 12 15.973 6.258 3.120
108 HA3 GLY 12 HA3 GLY 12 15.267 5.501 4.543
109 H MET 13 H MET 13 14.393 3.566 4.363
110 HA MET 13 HA MET 13 14.116 2.447 1.678
111 HB2 MET 13 HB2 MET 13 14.582 1.135 4.352
112 HB3 MET 13 HB3 MET 13 14.032 0.223 2.960
113 HG2 MET 13 HG2 MET 13 16.458 1.911 2.670
114 HG3 MET 13 HG3 MET 13 16.581 0.415 3.588
115 HE1 MET 13 HE1 MET 13 14.635 1.360 0.088
116 HE2 MET 13 HE2 MET 13 15.935 0.820 -0.970
117 HE3 MET 13 HE3 MET 13 16.221 2.126 0.177
118 H LYS 14 H LYS 14 12.270 4.009 3.682
119 HA LYS 14 HA LYS 14 9.932 2.318 3.207
120 HB2 LYS 14 HB2 LYS 14 10.297 4.645 5.093
121 HB3 LYS 14 HB3 LYS 14 8.804 3.761 4.858
122 HG2 LYS 14 HG2 LYS 14 9.875 1.721 5.684
123 HG3 LYS 14 HG3 LYS 14 11.362 2.630 5.954
124 HD2 LYS 14 HD2 LYS 14 8.784 3.513 7.195
125 HD3 LYS 14 HD3 LYS 14 9.751 2.241 7.942
126 HE2 LYS 14 HE2 LYS 14 11.644 3.723 8.068
127 HE3 LYS 14 HE3 LYS 14 10.744 5.001 7.245
128 HZ1 LYS 14 HZ1 LYS 14 9.196 5.014 9.112
129 HZ2 LYS 14 HZ2 LYS 14 10.766 5.377 9.579
130 HZ3 LYS 14 HZ3 LYS 14 10.131 3.846 9.911
131 H ALA 15 H ALA 15 8.063 3.461 2.495
132 HA ALA 15 HA ALA 15 8.605 5.994 1.154
133 HB1 ALA 15 HB1 ALA 15 8.846 4.231 -0.526
134 HB2 ALA 15 HB2 ALA 15 7.431 5.236 -0.841
135 HB3 ALA 15 HB3 ALA 15 7.234 3.631 -0.134
136 H VAL 16 H VAL 16 6.939 7.361 1.127
137 HA VAL 16 HA VAL 16 4.586 6.641 2.705
138 HB VAL 16 HB VAL 16 5.520 9.342 1.672
139 HG11 VAL 16 HG11 VAL 16 3.092 9.239 1.952
140 HG12 VAL 16 HG12 VAL 16 3.837 10.320 3.132
141 HG13 VAL 16 HG13 VAL 16 3.304 8.709 3.623
142 HG21 VAL 16 HG21 VAL 16 7.011 8.477 3.403
143 HG22 VAL 16 HG22 VAL 16 5.613 8.223 4.460
144 HG23 VAL 16 HG23 VAL 16 6.066 9.853 3.986
145 H VAL 17 H VAL 17 2.936 5.917 1.539
146 HA VAL 17 HA VAL 17 2.648 6.987 -1.166
147 HB VAL 17 HB VAL 17 1.032 5.075 -1.545
148 HG11 VAL 17 HG11 VAL 17 3.168 5.077 -2.570
149 HG12 VAL 17 HG12 VAL 17 2.806 3.447 -2.003
150 HG13 VAL 17 HG13 VAL 17 3.925 4.468 -1.098
151 HG21 VAL 17 HG21 VAL 17 0.489 4.168 0.519
152 HG22 VAL 17 HG22 VAL 17 2.153 4.240 1.096
153 HG23 VAL 17 HG23 VAL 17 1.685 3.027 -0.092
154 H LEU 18 H LEU 18 1.055 8.173 -1.651
155 HA LEU 18 HA LEU 18 -1.124 8.505 0.240
156 HB2 LEU 18 HB2 LEU 18 -0.050 10.536 -0.581
157 HB3 LEU 18 HB3 LEU 18 -0.251 10.016 -2.235
158 HG LEU 18 HG LEU 18 -2.715 10.210 -1.952
159 HD11 LEU 18 HD11 LEU 18 -3.576 11.486 -0.046
160 HD12 LEU 18 HD12 LEU 18 -1.976 11.418 0.700
161 HD13 LEU 18 HD13 LEU 18 -2.891 9.936 0.433
162 HD21 LEU 18 HD21 LEU 18 -1.119 12.706 -1.392
163 HD22 LEU 18 HD22 LEU 18 -2.774 12.656 -2.002
164 HD23 LEU 18 HD23 LEU 18 -1.456 12.009 -2.979
165 H THR 19 H THR 19 -2.507 6.897 -0.086
166 HA THR 19 HA THR 19 -2.643 5.421 -2.475
167 HB THR 19 HB THR 19 -4.672 4.382 -1.400
168 HG1 THR 19 HG1 THR 19 -4.933 4.936 0.820
169 HG21 THR 19 HG21 THR 19 -3.360 3.305 0.393
170 HG22 THR 19 HG22 THR 19 -2.127 4.558 0.219
171 HG23 THR 19 HG23 THR 19 -2.445 3.447 -1.109
172 H SER 20 H SER 20 -4.759 5.025 -3.643
173 HA SER 20 HA SER 20 -5.699 7.404 -4.750
174 HB2 SER 20 HB2 SER 20 -7.419 5.704 -5.713
175 HB3 SER 20 HB3 SER 20 -5.718 5.547 -6.154
176 HG SER 20 HG SER 20 -7.091 4.066 -4.120
177 H GLU 21 H GLU 21 -6.477 5.812 -1.913
178 HA GLU 21 HA GLU 21 -9.182 6.715 -1.633
179 HB2 GLU 21 HB2 GLU 21 -7.282 5.329 0.229
180 HB3 GLU 21 HB3 GLU 21 -8.930 5.772 0.659
181 HG2 GLU 21 HG2 GLU 21 -9.074 3.557 0.019
182 HG3 GLU 21 HG3 GLU 21 -9.658 4.456 -1.358
183 H GLY 22 H GLY 22 -6.115 8.090 -1.277
184 HA2 GLY 22 HA2 GLY 22 -5.637 10.263 -0.660
185 HA3 GLY 22 HA3 GLY 22 -7.216 10.384 0.099
186 H GLU 23 H GLU 23 -5.127 7.699 0.867
187 HA GLU 23 HA GLU 23 -4.767 8.865 3.532
188 HB2 GLU 23 HB2 GLU 23 -4.985 5.991 2.650
189 HB3 GLU 23 HB3 GLU 23 -4.602 6.495 4.285
190 HG2 GLU 23 HG2 GLU 23 -7.154 7.090 2.803
191 HG3 GLU 23 HG3 GLU 23 -6.947 5.862 4.049
192 H PHE 24 H PHE 24 -2.719 8.708 4.477
193 HA PHE 24 HA PHE 24 -0.569 8.111 2.586
194 HB2 PHE 24 HB2 PHE 24 -0.364 9.515 5.283
195 HB3 PHE 24 HB3 PHE 24 0.924 9.262 4.131
196 HD1 PHE 24 HD1 PHE 24 -2.234 11.075 4.679
197 HD2 PHE 24 HD2 PHE 24 1.294 10.714 2.331
198 HE1 PHE 24 HE1 PHE 24 -2.716 13.243 3.611
199 HE2 PHE 24 HE2 PHE 24 0.811 12.860 1.271
200 HZ PHE 24 HZ PHE 24 -1.186 14.132 1.909
201 H LEU 25 H LEU 25 0.181 6.177 2.689
202 HA LEU 25 HA LEU 25 0.187 4.723 5.253
203 HB2 LEU 25 HB2 LEU 25 -0.012 3.866 2.398
204 HB3 LEU 25 HB3 LEU 25 0.641 2.764 3.581
205 HG LEU 25 HG LEU 25 -1.523 2.768 4.771
206 HD11 LEU 25 HD11 LEU 25 -2.298 5.019 4.199
207 HD12 LEU 25 HD12 LEU 25 -3.489 3.796 3.756
208 HD13 LEU 25 HD13 LEU 25 -2.474 4.532 2.514
209 HD21 LEU 25 HD21 LEU 25 -2.840 1.894 2.659
210 HD22 LEU 25 HD22 LEU 25 -1.487 1.009 3.369
211 HD23 LEU 25 HD23 LEU 25 -1.237 2.000 1.933
212 H ILE 26 H ILE 26 2.122 3.749 5.896
213 HA ILE 26 HA ILE 26 4.493 4.643 4.450
214 HB ILE 26 HB ILE 26 4.262 3.317 7.179
215 HG12 ILE 26 HG12 ILE 26 3.227 5.553 7.209
216 HG13 ILE 26 HG13 ILE 26 4.703 5.531 8.159
217 HG21 ILE 26 HG21 ILE 26 6.626 4.671 5.877
218 HG22 ILE 26 HG22 ILE 26 6.432 2.937 6.136
219 HG23 ILE 26 HG23 ILE 26 6.581 4.025 7.519
220 HD11 ILE 26 HD11 ILE 26 4.611 7.562 6.927
221 HD12 ILE 26 HD12 ILE 26 4.308 6.700 5.421
222 HD13 ILE 26 HD13 ILE 26 5.877 6.559 6.220
223 H ILE 27 H ILE 27 5.379 3.212 3.125
224 HA ILE 27 HA ILE 27 4.901 0.360 3.668
225 HB ILE 27 HB ILE 27 4.762 -0.114 1.280
226 HG12 ILE 27 HG12 ILE 27 4.865 2.858 0.743
227 HG13 ILE 27 HG13 ILE 27 6.285 1.823 0.641
228 HG21 ILE 27 HG21 ILE 27 2.898 2.119 2.059
229 HG22 ILE 27 HG22 ILE 27 2.652 0.403 2.365
230 HG23 ILE 27 HG23 ILE 27 2.654 1.010 0.714
231 HD11 ILE 27 HD11 ILE 27 3.774 1.570 -0.994
232 HD12 ILE 27 HD12 ILE 27 5.170 0.500 -1.089
233 HD13 ILE 27 HD13 ILE 27 5.328 2.201 -1.539
234 H ARG 28 H ARG 28 6.441 -0.994 2.457
235 HA ARG 28 HA ARG 28 9.155 -0.224 2.928
236 HB2 ARG 28 HB2 ARG 28 7.983 -2.624 1.496
237 HB3 ARG 28 HB3 ARG 28 9.660 -2.470 2.006
238 HG2 ARG 28 HG2 ARG 28 8.917 -2.424 4.347
239 HG3 ARG 28 HG3 ARG 28 7.248 -2.587 3.807
240 HD2 ARG 28 HD2 ARG 28 7.997 -4.725 2.647
241 HD3 ARG 28 HD3 ARG 28 9.489 -4.572 3.579
242 HE ARG 28 HE ARG 28 6.971 -4.517 5.029
243 HH11 ARG 28 HH11 ARG 28 9.883 -6.334 4.182
244 HH12 ARG 28 HH12 ARG 28 9.637 -7.537 5.359
245 HH21 ARG 28 HH21 ARG 28 6.649 -6.179 6.643
246 HH22 ARG 28 HH22 ARG 28 7.782 -7.439 6.802
247 H ARG 29 H ARG 29 10.549 0.555 1.426
248 HA ARG 29 HA ARG 29 9.379 1.249 -1.125
249 HB2 ARG 29 HB2 ARG 29 10.574 2.976 0.193
250 HB3 ARG 29 HB3 ARG 29 12.061 2.052 0.004
251 HG2 ARG 29 HG2 ARG 29 11.384 2.218 -2.541
252 HG3 ARG 29 HG3 ARG 29 10.559 3.663 -1.970
253 HD2 ARG 29 HD2 ARG 29 12.652 4.513 -1.076
254 HD3 ARG 29 HD3 ARG 29 13.454 3.011 -1.564
255 HE ARG 29 HE ARG 29 12.360 3.864 -3.869
256 HH11 ARG 29 HH11 ARG 29 14.547 5.515 -1.589
257 HH12 ARG 29 HH12 ARG 29 15.249 6.470 -2.787
258 HH21 ARG 29 HH21 ARG 29 13.345 5.172 -5.470
259 HH22 ARG 29 HH22 ARG 29 14.550 6.294 -5.051
260 H ARG 30 H ARG 30 9.752 0.184 -2.870
261 HA ARG 30 HA ARG 30 12.027 -1.674 -3.036
262 HB2 ARG 30 HB2 ARG 30 9.659 -1.435 -4.910
263 HB3 ARG 30 HB3 ARG 30 10.856 -2.705 -4.886
264 HG2 ARG 30 HG2 ARG 30 9.953 -3.567 -2.815
265 HG3 ARG 30 HG3 ARG 30 8.797 -2.223 -2.739
266 HD2 ARG 30 HD2 ARG 30 7.885 -2.926 -4.917
267 HD3 ARG 30 HD3 ARG 30 8.983 -4.294 -4.919
268 HE ARG 30 HE ARG 30 7.153 -4.115 -2.657
269 HH11 ARG 30 HH11 ARG 30 7.849 -5.556 -5.819
270 HH12 ARG 30 HH12 ARG 30 6.680 -6.788 -5.644
271 HH21 ARG 30 HH21 ARG 30 5.537 -5.726 -2.480
272 HH22 ARG 30 HH22 ARG 30 5.365 -6.913 -3.704
273 H LYS 31 H LYS 31 12.543 -1.763 -5.656
274 HA LYS 31 HA LYS 31 13.681 0.791 -6.245
275 HB2 LYS 31 HB2 LYS 31 13.582 -1.808 -7.792
276 HB3 LYS 31 HB3 LYS 31 14.364 -0.365 -8.409
277 HG2 LYS 31 HG2 LYS 31 15.957 -0.372 -6.644
278 HG3 LYS 31 HG3 LYS 31 15.098 -1.649 -5.790
279 HD2 LYS 31 HD2 LYS 31 16.252 -2.019 -8.548
280 HD3 LYS 31 HD3 LYS 31 17.185 -2.328 -7.086
281 HE2 LYS 31 HE2 LYS 31 15.306 -3.881 -6.388
282 HE3 LYS 31 HE3 LYS 31 14.680 -3.721 -8.027
283 HZ1 LYS 31 HZ1 LYS 31 17.310 -4.855 -7.224
284 HZ2 LYS 31 HZ2 LYS 31 16.866 -4.553 -8.820
285 HZ3 LYS 31 HZ3 LYS 31 16.008 -5.665 -7.914
286 H ASP 32 H ASP 32 10.700 -0.570 -6.740
287 HA ASP 32 HA ASP 32 9.896 0.698 -9.204
288 HB2 ASP 32 HB2 ASP 32 8.401 -0.725 -7.007
289 HB3 ASP 32 HB3 ASP 32 7.569 0.094 -8.320
290 H MET 33 H MET 33 10.334 1.778 -6.034
291 HA MET 33 HA MET 33 8.150 3.664 -6.164
292 HB2 MET 33 HB2 MET 33 9.969 2.768 -3.974
293 HB3 MET 33 HB3 MET 33 8.961 4.191 -3.810
294 HG2 MET 33 HG2 MET 33 7.805 2.394 -2.768
295 HG3 MET 33 HG3 MET 33 6.986 2.730 -4.292
296 HE1 MET 33 HE1 MET 33 6.599 -1.172 -3.792
297 HE2 MET 33 HE2 MET 33 5.753 0.378 -3.879
298 HE3 MET 33 HE3 MET 33 6.749 -0.012 -2.472
299 H LYS 34 H LYS 34 8.514 5.505 -7.146
300 HA LYS 34 HA LYS 34 10.894 7.017 -6.521
301 HB2 LYS 34 HB2 LYS 34 9.445 6.648 -9.140
302 HB3 LYS 34 HB3 LYS 34 10.623 7.907 -8.824
303 HG2 LYS 34 HG2 LYS 34 12.361 6.218 -8.504
304 HG3 LYS 34 HG3 LYS 34 11.167 4.940 -8.730
305 HD2 LYS 34 HD2 LYS 34 12.400 5.224 -10.779
306 HD3 LYS 34 HD3 LYS 34 10.755 5.809 -11.023
307 HE2 LYS 34 HE2 LYS 34 11.479 8.092 -10.758
308 HE3 LYS 34 HE3 LYS 34 13.107 7.560 -10.350
309 HZ1 LYS 34 HZ1 LYS 34 11.793 7.090 -12.972
310 HZ2 LYS 34 HZ2 LYS 34 13.385 6.712 -12.556
311 HZ3 LYS 34 HZ3 LYS 34 12.895 8.319 -12.635
312 H VAL 35 H VAL 35 10.343 9.265 -6.319
313 HA VAL 35 HA VAL 35 7.749 9.590 -5.205
314 HB VAL 35 HB VAL 35 9.783 11.770 -5.746
315 HG11 VAL 35 HG11 VAL 35 8.655 12.955 -3.934
316 HG12 VAL 35 HG12 VAL 35 7.531 11.613 -3.739
317 HG13 VAL 35 HG13 VAL 35 7.507 12.570 -5.219
318 HG21 VAL 35 HG21 VAL 35 10.779 9.992 -4.439
319 HG22 VAL 35 HG22 VAL 35 9.397 10.020 -3.342
320 HG23 VAL 35 HG23 VAL 35 10.477 11.409 -3.425
321 H GLY 36 H GLY 36 5.943 10.298 -6.034
322 HA2 GLY 36 HA2 GLY 36 4.809 11.986 -7.317
323 HA3 GLY 36 HA3 GLY 36 6.063 11.830 -8.536
324 H GLN 37 H GLN 37 5.981 8.853 -8.270
325 HA GLN 37 HA GLN 37 3.745 8.598 -10.108
326 HB2 GLN 37 HB2 GLN 37 4.753 6.566 -10.928
327 HB3 GLN 37 HB3 GLN 37 5.953 7.845 -10.900
328 HG2 GLN 37 HG2 GLN 37 6.698 6.845 -8.665
329 HG3 GLN 37 HG3 GLN 37 5.723 5.446 -9.112
330 HE21 GLN 37 HE21 GLN 37 7.552 4.066 -9.310
331 HE22 GLN 37 HE22 GLN 37 8.653 4.258 -10.597
332 H GLN 38 H GLN 38 2.374 6.778 -10.086
333 HA GLN 38 HA GLN 38 1.554 5.995 -7.410
334 HB2 GLN 38 HB2 GLN 38 -0.001 6.791 -9.322
335 HB3 GLN 38 HB3 GLN 38 0.278 5.206 -10.022
336 HG2 GLN 38 HG2 GLN 38 -0.542 4.245 -7.821
337 HG3 GLN 38 HG3 GLN 38 -1.094 5.873 -7.430
338 HE21 GLN 38 HE21 GLN 38 -3.271 5.355 -7.438
339 HE22 GLN 38 HE22 GLN 38 -4.115 4.933 -8.878
340 H VAL 39 H VAL 39 2.062 4.094 -6.619
341 HA VAL 39 HA VAL 39 3.265 2.135 -8.449
342 HB VAL 39 HB VAL 39 4.580 1.295 -6.527
343 HG11 VAL 39 HG11 VAL 39 4.956 4.224 -7.128
344 HG12 VAL 39 HG12 VAL 39 5.617 2.867 -8.042
345 HG13 VAL 39 HG13 VAL 39 6.159 3.167 -6.390
346 HG21 VAL 39 HG21 VAL 39 3.687 3.759 -5.044
347 HG22 VAL 39 HG22 VAL 39 4.675 2.426 -4.428
348 HG23 VAL 39 HG23 VAL 39 2.969 2.171 -4.799
349 H SER 40 H SER 40 3.086 -0.103 -7.747
350 HA SER 40 HA SER 40 0.538 -0.620 -6.428
351 HB2 SER 40 HB2 SER 40 1.207 -2.878 -7.861
352 HB3 SER 40 HB3 SER 40 0.102 -1.622 -8.423
353 HG SER 40 HG SER 40 1.886 -0.582 -9.389
354 H PHE 41 H PHE 41 0.747 -1.617 -4.541
355 HA PHE 41 HA PHE 41 3.096 -3.274 -4.047
356 HB2 PHE 41 HB2 PHE 41 3.211 -2.304 -1.740
357 HB3 PHE 41 HB3 PHE 41 3.727 -1.215 -3.008
358 HD1 PHE 41 HD1 PHE 41 1.382 -1.800 -0.316
359 HD2 PHE 41 HD2 PHE 41 2.181 0.658 -3.693
360 HE1 PHE 41 HE1 PHE 41 -0.223 -0.133 0.516
361 HE2 PHE 41 HE2 PHE 41 0.579 2.329 -2.858
362 HZ PHE 41 HZ PHE 41 -0.625 1.923 -0.750
363 H GLU 42 H GLU 42 2.736 -4.489 -1.990
364 HA GLU 42 HA GLU 42 -0.056 -5.344 -1.960
365 HB2 GLU 42 HB2 GLU 42 2.505 -6.796 -1.561
366 HB3 GLU 42 HB3 GLU 42 1.137 -7.159 -0.504
367 HG2 GLU 42 HG2 GLU 42 0.650 -7.040 -3.361
368 HG3 GLU 42 HG3 GLU 42 1.412 -8.494 -2.686
369 H ASN 43 H ASN 43 -0.539 -6.351 0.202
370 HA ASN 43 HA ASN 43 -0.470 -4.187 2.084
371 HB2 ASN 43 HB2 ASN 43 -1.936 -6.741 1.992
372 HB3 ASN 43 HB3 ASN 43 -1.496 -6.202 3.608
373 HD21 ASN 43 HD21 ASN 43 -2.361 -4.157 0.822
374 HD22 ASN 43 HD22 ASN 43 -3.763 -3.517 1.588
375 H GLU 44 H GLU 44 1.302 -7.172 1.702
376 HA GLU 44 HA GLU 44 2.541 -7.179 4.180
377 HB2 GLU 44 HB2 GLU 44 3.253 -8.242 1.498
378 HB3 GLU 44 HB3 GLU 44 4.228 -8.524 2.931
379 HG2 GLU 44 HG2 GLU 44 2.881 -10.336 2.566
380 HG3 GLU 44 HG3 GLU 44 2.252 -9.548 4.021
381 H ASP 45 H ASP 45 2.928 -5.179 1.367
382 HA ASP 45 HA ASP 45 5.638 -4.403 1.980
383 HB2 ASP 45 HB2 ASP 45 3.619 -3.221 0.068
384 HB3 ASP 45 HB3 ASP 45 5.226 -2.580 0.301
385 H ILE 46 H ILE 46 2.500 -3.559 2.999
386 HA ILE 46 HA ILE 46 3.162 -0.881 3.699
387 HB ILE 46 HB ILE 46 0.870 -2.501 4.857
388 HG12 ILE 46 HG12 ILE 46 0.791 -0.819 2.352
389 HG13 ILE 46 HG13 ILE 46 0.898 -2.573 2.339
390 HG21 ILE 46 HG21 ILE 46 1.364 -0.341 5.924
391 HG22 ILE 46 HG22 ILE 46 -0.192 -0.307 5.096
392 HG23 ILE 46 HG23 ILE 46 1.216 0.463 4.361
393 HD11 ILE 46 HD11 ILE 46 -1.347 -0.987 3.572
394 HD12 ILE 46 HD12 ILE 46 -1.253 -2.738 3.429
395 HD13 ILE 46 HD13 ILE 46 -1.390 -1.742 1.980
396 H TYR 47 H TYR 47 4.086 -0.199 5.418
397 HA TYR 47 HA TYR 47 5.363 -1.963 7.252
398 HB2 TYR 47 HB2 TYR 47 5.448 0.797 6.486
399 HB3 TYR 47 HB3 TYR 47 5.328 0.680 8.238
400 HD1 TYR 47 HD1 TYR 47 7.194 0.079 9.516
401 HD2 TYR 47 HD2 TYR 47 7.348 -0.344 5.288
402 HE1 TYR 47 HE1 TYR 47 9.603 -0.319 9.644
403 HE2 TYR 47 HE2 TYR 47 9.763 -0.762 5.415
404 HH TYR 47 HH TYR 47 11.300 -1.546 8.216
405 H ASN 48 H ASN 48 2.589 0.063 7.187
406 HA ASN 48 HA ASN 48 1.982 -0.068 9.988
407 HB2 ASN 48 HB2 ASN 48 0.138 0.703 7.719
408 HB3 ASN 48 HB3 ASN 48 -0.147 0.973 9.430
409 HD21 ASN 48 HD21 ASN 48 1.042 2.584 10.483
410 HD22 ASN 48 HD22 ASN 48 1.819 3.834 9.582
411 H VAL 49 H VAL 49 0.562 -1.533 7.105
412 HA VAL 49 HA VAL 49 -1.182 -2.933 6.778
413 HB VAL 49 HB VAL 49 -0.115 -4.326 9.243
414 HG11 VAL 49 HG11 VAL 49 -1.596 -5.431 6.826
415 HG12 VAL 49 HG12 VAL 49 -2.260 -5.245 8.450
416 HG13 VAL 49 HG13 VAL 49 -0.976 -6.416 8.152
417 HG21 VAL 49 HG21 VAL 49 1.714 -3.933 7.684
418 HG22 VAL 49 HG22 VAL 49 0.807 -4.728 6.396
419 HG23 VAL 49 HG23 VAL 49 1.351 -5.653 7.794
420 H ARG 50 H ARG 50 -2.350 -0.978 7.478
421 HA ARG 50 HA ARG 50 -3.215 -0.948 10.226
422 HB2 ARG 50 HB2 ARG 50 -2.331 1.101 8.975
423 HB3 ARG 50 HB3 ARG 50 -3.888 1.136 8.165
424 HG2 ARG 50 HG2 ARG 50 -5.020 1.398 10.312
425 HG3 ARG 50 HG3 ARG 50 -3.470 1.304 11.148
426 HD2 ARG 50 HD2 ARG 50 -2.744 3.328 9.941
427 HD3 ARG 50 HD3 ARG 50 -4.332 3.423 9.184
428 HE ARG 50 HE ARG 50 -4.631 3.304 11.972
429 HH11 ARG 50 HH11 ARG 50 -3.596 5.557 9.450
430 HH12 ARG 50 HH12 ARG 50 -3.979 6.965 10.326
431 HH21 ARG 50 HH21 ARG 50 -5.142 5.218 13.212
432 HH22 ARG 50 HH22 ARG 50 -4.850 6.760 12.570
433 H GLY 51 H GLY 51 -5.202 -0.867 10.897
434 HA2 GLY 51 HA2 GLY 51 -7.606 -0.875 9.519
435 HA3 GLY 51 HA3 GLY 51 -7.169 -2.553 9.920
436 H LYS 52 H LYS 52 -5.676 -2.223 12.045
437 HA LYS 52 HA LYS 52 -6.845 -0.462 13.978
438 HB2 LYS 52 HB2 LYS 52 -8.003 -2.598 14.402
439 HB3 LYS 52 HB3 LYS 52 -6.467 -3.457 14.352
440 HG2 LYS 52 HG2 LYS 52 -5.729 -2.414 16.357
441 HG3 LYS 52 HG3 LYS 52 -7.102 -1.314 16.358
442 HD2 LYS 52 HD2 LYS 52 -8.620 -3.155 16.760
443 HD3 LYS 52 HD3 LYS 52 -7.292 -4.312 16.640
444 HE2 LYS 52 HE2 LYS 52 -7.945 -3.793 18.976
445 HE3 LYS 52 HE3 LYS 52 -6.264 -3.413 18.622
446 HZ1 LYS 52 HZ1 LYS 52 -6.882 -1.081 18.408
447 HZ2 LYS 52 HZ2 LYS 52 -7.321 -1.689 19.910
448 HZ3 LYS 52 HZ3 LYS 52 -8.504 -1.461 18.729
Start of MODEL 16
1 H1 SER 0 H1 SER 0 -1.683 -11.832 -4.586
2 H2 SER 0 H2 SER 0 -2.810 -10.628 -5.029
3 H3 SER 0 H3 SER 0 -3.228 -11.793 -3.874
4 HA SER 0 HA SER 0 -1.785 -10.905 -2.317
5 HB2 SER 0 HB2 SER 0 -0.748 -9.073 -4.463
6 HB3 SER 0 HB3 SER 0 -0.018 -9.453 -2.908
7 HG SER 0 HG SER 0 1.064 -10.650 -4.358
8 H MET 1 H MET 1 -2.271 -8.900 -1.149
9 HA MET 1 HA MET 1 -4.593 -7.592 -2.266
10 HB2 MET 1 HB2 MET 1 -4.516 -8.307 0.167
11 HB3 MET 1 HB3 MET 1 -3.306 -7.045 0.402
12 HG2 MET 1 HG2 MET 1 -5.525 -6.291 1.061
13 HG3 MET 1 HG3 MET 1 -4.874 -5.344 -0.276
14 HE1 MET 1 HE1 MET 1 -7.076 -4.324 -1.044
15 HE2 MET 1 HE2 MET 1 -7.925 -5.056 0.319
16 HE3 MET 1 HE3 MET 1 -8.573 -5.213 -1.314
17 H ASN 2 H ASN 2 -3.658 -6.551 -3.888
18 HA ASN 2 HA ASN 2 -1.530 -4.674 -3.438
19 HB2 ASN 2 HB2 ASN 2 -3.005 -5.575 -5.860
20 HB3 ASN 2 HB3 ASN 2 -2.050 -4.097 -5.913
21 HD21 ASN 2 HD21 ASN 2 0.178 -4.256 -5.460
22 HD22 ASN 2 HD22 ASN 2 1.028 -5.744 -5.666
23 H ARG 3 H ARG 3 -1.683 -2.693 -3.030
24 HA ARG 3 HA ARG 3 -4.243 -1.293 -3.406
25 HB2 ARG 3 HB2 ARG 3 -3.099 -1.702 -1.015
26 HB3 ARG 3 HB3 ARG 3 -2.153 -0.309 -1.509
27 HG2 ARG 3 HG2 ARG 3 -3.882 0.628 -0.288
28 HG3 ARG 3 HG3 ARG 3 -4.433 0.807 -1.957
29 HD2 ARG 3 HD2 ARG 3 -5.683 -1.359 -1.667
30 HD3 ARG 3 HD3 ARG 3 -5.265 -1.286 0.041
31 HE ARG 3 HE ARG 3 -6.959 0.629 -1.398
32 HH11 ARG 3 HH11 ARG 3 -5.963 -0.836 1.668
33 HH12 ARG 3 HH12 ARG 3 -7.309 -0.290 2.548
34 HH21 ARG 3 HH21 ARG 3 -8.852 1.414 -0.166
35 HH22 ARG 3 HH22 ARG 3 -8.996 1.024 1.482
36 H LEU 4 H LEU 4 -3.986 0.932 -4.113
37 HA LEU 4 HA LEU 4 -1.510 1.352 -5.651
38 HB2 LEU 4 HB2 LEU 4 -4.244 2.538 -6.087
39 HB3 LEU 4 HB3 LEU 4 -2.849 2.719 -7.126
40 HG LEU 4 HG LEU 4 -4.338 0.137 -6.637
41 HD11 LEU 4 HD11 LEU 4 -5.695 1.689 -7.880
42 HD12 LEU 4 HD12 LEU 4 -5.117 0.402 -8.941
43 HD13 LEU 4 HD13 LEU 4 -4.367 1.998 -8.996
44 HD21 LEU 4 HD21 LEU 4 -2.026 -0.311 -7.156
45 HD22 LEU 4 HD22 LEU 4 -2.071 0.815 -8.510
46 HD23 LEU 4 HD23 LEU 4 -3.007 -0.677 -8.575
47 H GLY 5 H GLY 5 -0.321 3.114 -5.235
48 HA2 GLY 5 HA2 GLY 5 -1.545 5.435 -4.015
49 HA3 GLY 5 HA3 GLY 5 -0.344 4.604 -3.024
50 H ILE 6 H ILE 6 -0.257 7.208 -3.940
51 HA ILE 6 HA ILE 6 1.742 7.254 -6.081
52 HB ILE 6 HB ILE 6 0.379 9.534 -4.622
53 HG12 ILE 6 HG12 ILE 6 -0.295 8.533 -7.386
54 HG13 ILE 6 HG13 ILE 6 -1.144 7.973 -5.951
55 HG21 ILE 6 HG21 ILE 6 1.141 10.901 -6.509
56 HG22 ILE 6 HG22 ILE 6 1.948 9.493 -7.203
57 HG23 ILE 6 HG23 ILE 6 2.502 10.156 -5.666
58 HD11 ILE 6 HD11 ILE 6 -0.970 10.827 -6.874
59 HD12 ILE 6 HD12 ILE 6 -1.896 10.225 -5.491
60 HD13 ILE 6 HD13 ILE 6 -2.343 9.749 -7.129
61 H ILE 7 H ILE 7 3.808 7.460 -5.606
62 HA ILE 7 HA ILE 7 4.713 7.501 -2.919
63 HB ILE 7 HB ILE 7 6.312 8.157 -5.416
64 HG12 ILE 7 HG12 ILE 7 5.246 5.877 -5.467
65 HG13 ILE 7 HG13 ILE 7 7.002 5.843 -5.462
66 HG21 ILE 7 HG21 ILE 7 7.364 8.910 -3.309
67 HG22 ILE 7 HG22 ILE 7 8.280 7.625 -4.097
68 HG23 ILE 7 HG23 ILE 7 7.271 7.257 -2.697
69 HD11 ILE 7 HD11 ILE 7 5.962 4.144 -4.014
70 HD12 ILE 7 HD12 ILE 7 5.292 5.443 -3.023
71 HD13 ILE 7 HD13 ILE 7 7.036 5.240 -3.147
72 H TYR 8 H TYR 8 4.316 9.124 -1.723
73 HA TYR 8 HA TYR 8 4.184 11.830 -2.736
74 HB2 TYR 8 HB2 TYR 8 2.495 10.794 -1.172
75 HB3 TYR 8 HB3 TYR 8 3.739 10.799 0.065
76 HD1 TYR 8 HD1 TYR 8 4.299 12.821 1.237
77 HD2 TYR 8 HD2 TYR 8 1.560 12.903 -2.018
78 HE1 TYR 8 HE1 TYR 8 3.598 15.083 1.897
79 HE2 TYR 8 HE2 TYR 8 0.852 15.168 -1.374
80 HH TYR 8 HH TYR 8 2.581 17.051 0.857
81 H GLU 9 H GLU 9 6.155 9.772 -0.696
82 HA GLU 9 HA GLU 9 8.348 11.599 -0.672
83 HB2 GLU 9 HB2 GLU 9 6.718 12.528 1.020
84 HB3 GLU 9 HB3 GLU 9 6.902 11.036 1.916
85 HG2 GLU 9 HG2 GLU 9 9.326 11.552 2.110
86 HG3 GLU 9 HG3 GLU 9 8.995 13.141 1.419
87 H ILE 10 H ILE 10 10.101 10.636 0.732
88 HA ILE 10 HA ILE 10 9.913 7.704 0.863
89 HB ILE 10 HB ILE 10 12.253 9.424 0.040
90 HG12 ILE 10 HG12 ILE 10 10.413 9.195 -1.545
91 HG13 ILE 10 HG13 ILE 10 11.952 8.618 -2.205
92 HG21 ILE 10 HG21 ILE 10 13.035 7.472 1.252
93 HG22 ILE 10 HG22 ILE 10 13.414 7.295 -0.464
94 HG23 ILE 10 HG23 ILE 10 12.056 6.414 0.235
95 HD11 ILE 10 HD11 ILE 10 10.180 7.120 -2.879
96 HD12 ILE 10 HD12 ILE 10 9.603 6.983 -1.220
97 HD13 ILE 10 HD13 ILE 10 11.160 6.289 -1.671
98 H GLN 11 H GLN 11 10.817 6.793 2.688
99 HA GLN 11 HA GLN 11 12.133 8.562 4.609
100 HB2 GLN 11 HB2 GLN 11 9.916 6.566 5.173
101 HB3 GLN 11 HB3 GLN 11 10.927 7.268 6.421
102 HG2 GLN 11 HG2 GLN 11 9.156 8.705 4.568
103 HG3 GLN 11 HG3 GLN 11 8.826 8.406 6.278
104 HE21 GLN 11 HE21 GLN 11 9.183 10.927 4.689
105 HE22 GLN 11 HE22 GLN 11 10.369 11.804 5.528
106 H GLY 12 H GLY 12 14.023 7.556 3.536
107 HA2 GLY 12 HA2 GLY 12 15.808 6.151 3.687
108 HA3 GLY 12 HA3 GLY 12 15.019 5.379 5.056
109 H MET 13 H MET 13 14.343 3.378 4.786
110 HA MET 13 HA MET 13 14.191 2.375 2.057
111 HB2 MET 13 HB2 MET 13 14.644 1.031 4.690
112 HB3 MET 13 HB3 MET 13 14.029 0.102 3.330
113 HG2 MET 13 HG2 MET 13 16.505 1.763 3.072
114 HG3 MET 13 HG3 MET 13 16.566 0.143 3.754
115 HE1 MET 13 HE1 MET 13 16.140 1.316 -0.645
116 HE2 MET 13 HE2 MET 13 16.306 2.400 0.741
117 HE3 MET 13 HE3 MET 13 14.731 1.724 0.315
118 H LYS 14 H LYS 14 12.223 3.860 3.866
119 HA LYS 14 HA LYS 14 9.899 2.185 3.249
120 HB2 LYS 14 HB2 LYS 14 10.102 4.453 5.242
121 HB3 LYS 14 HB3 LYS 14 8.722 3.392 4.997
122 HG2 LYS 14 HG2 LYS 14 10.015 1.505 5.813
123 HG3 LYS 14 HG3 LYS 14 11.419 2.547 6.023
124 HD2 LYS 14 HD2 LYS 14 10.215 3.857 7.684
125 HD3 LYS 14 HD3 LYS 14 8.770 2.871 7.431
126 HE2 LYS 14 HE2 LYS 14 9.935 0.899 8.214
127 HE3 LYS 14 HE3 LYS 14 11.426 1.826 8.372
128 HZ1 LYS 14 HZ1 LYS 14 10.459 3.107 10.103
129 HZ2 LYS 14 HZ2 LYS 14 10.262 1.477 10.480
130 HZ3 LYS 14 HZ3 LYS 14 8.949 2.378 9.913
131 H ALA 15 H ALA 15 8.060 3.422 2.489
132 HA ALA 15 HA ALA 15 8.723 6.006 1.287
133 HB1 ALA 15 HB1 ALA 15 8.970 4.296 -0.454
134 HB2 ALA 15 HB2 ALA 15 7.583 5.343 -0.775
135 HB3 ALA 15 HB3 ALA 15 7.334 3.725 -0.124
136 H VAL 16 H VAL 16 6.964 7.348 1.006
137 HA VAL 16 HA VAL 16 4.606 6.669 2.628
138 HB VAL 16 HB VAL 16 5.457 9.393 1.590
139 HG11 VAL 16 HG11 VAL 16 3.073 9.205 2.024
140 HG12 VAL 16 HG12 VAL 16 3.834 10.284 3.191
141 HG13 VAL 16 HG13 VAL 16 3.401 8.640 3.661
142 HG21 VAL 16 HG21 VAL 16 6.163 9.926 3.849
143 HG22 VAL 16 HG22 VAL 16 7.101 8.560 3.217
144 HG23 VAL 16 HG23 VAL 16 5.787 8.288 4.369
145 H VAL 17 H VAL 17 2.977 5.982 1.431
146 HA VAL 17 HA VAL 17 2.730 7.077 -1.265
147 HB VAL 17 HB VAL 17 1.182 5.145 -1.725
148 HG11 VAL 17 HG11 VAL 17 3.322 5.145 -2.677
149 HG12 VAL 17 HG12 VAL 17 3.032 3.520 -2.047
150 HG13 VAL 17 HG13 VAL 17 4.078 4.638 -1.168
151 HG21 VAL 17 HG21 VAL 17 2.321 4.106 0.880
152 HG22 VAL 17 HG22 VAL 17 1.530 3.106 -0.333
153 HG23 VAL 17 HG23 VAL 17 0.632 4.397 0.463
154 H LEU 18 H LEU 18 1.138 8.304 -1.736
155 HA LEU 18 HA LEU 18 -1.067 8.604 0.131
156 HB2 LEU 18 HB2 LEU 18 -0.055 10.643 -0.738
157 HB3 LEU 18 HB3 LEU 18 -0.251 10.086 -2.384
158 HG LEU 18 HG LEU 18 -2.719 10.247 -2.097
159 HD11 LEU 18 HD11 LEU 18 -3.612 11.497 -0.202
160 HD12 LEU 18 HD12 LEU 18 -2.006 11.549 0.521
161 HD13 LEU 18 HD13 LEU 18 -2.836 10.001 0.326
162 HD21 LEU 18 HD21 LEU 18 -1.489 12.055 -3.144
163 HD22 LEU 18 HD22 LEU 18 -1.138 12.756 -1.566
164 HD23 LEU 18 HD23 LEU 18 -2.798 12.706 -2.156
165 H THR 19 H THR 19 -2.391 7.015 -0.128
166 HA THR 19 HA THR 19 -2.553 5.384 -2.416
167 HB THR 19 HB THR 19 -4.570 4.419 -1.227
168 HG1 THR 19 HG1 THR 19 -3.692 5.993 0.946
169 HG21 THR 19 HG21 THR 19 -2.345 3.469 -0.952
170 HG22 THR 19 HG22 THR 19 -3.207 3.470 0.596
171 HG23 THR 19 HG23 THR 19 -1.968 4.686 0.274
172 H SER 20 H SER 20 -4.619 4.871 -3.589
173 HA SER 20 HA SER 20 -5.810 7.148 -4.739
174 HB2 SER 20 HB2 SER 20 -7.335 5.260 -5.664
175 HB3 SER 20 HB3 SER 20 -5.617 5.233 -6.086
176 HG SER 20 HG SER 20 -6.971 3.745 -4.096
177 H GLU 21 H GLU 21 -6.253 5.726 -1.809
178 HA GLU 21 HA GLU 21 -9.106 6.250 -1.545
179 HB2 GLU 21 HB2 GLU 21 -7.477 5.260 0.736
180 HB3 GLU 21 HB3 GLU 21 -9.087 4.792 0.222
181 HG2 GLU 21 HG2 GLU 21 -6.556 3.966 -1.192
182 HG3 GLU 21 HG3 GLU 21 -7.364 2.996 0.030
183 H GLY 22 H GLY 22 -6.243 7.898 -1.321
184 HA2 GLY 22 HA2 GLY 22 -5.910 10.062 -0.644
185 HA3 GLY 22 HA3 GLY 22 -7.458 10.026 0.173
186 H GLU 23 H GLU 23 -5.181 7.521 0.955
187 HA GLU 23 HA GLU 23 -4.634 8.916 3.505
188 HB2 GLU 23 HB2 GLU 23 -4.936 5.972 2.924
189 HB3 GLU 23 HB3 GLU 23 -4.355 6.616 4.452
190 HG2 GLU 23 HG2 GLU 23 -7.035 7.163 3.234
191 HG3 GLU 23 HG3 GLU 23 -6.708 5.996 4.522
192 H PHE 24 H PHE 24 -2.545 8.832 4.354
193 HA PHE 24 HA PHE 24 -0.459 8.185 2.418
194 HB2 PHE 24 HB2 PHE 24 -0.232 9.591 5.109
195 HB3 PHE 24 HB3 PHE 24 1.058 9.330 3.958
196 HD1 PHE 24 HD1 PHE 24 1.415 10.759 2.144
197 HD2 PHE 24 HD2 PHE 24 -2.096 11.146 4.509
198 HE1 PHE 24 HE1 PHE 24 0.929 12.905 1.071
199 HE2 PHE 24 HE2 PHE 24 -2.583 13.308 3.430
200 HZ PHE 24 HZ PHE 24 -1.068 14.180 1.708
201 H LEU 25 H LEU 25 0.297 6.226 2.518
202 HA LEU 25 HA LEU 25 0.387 4.881 5.128
203 HB2 LEU 25 HB2 LEU 25 -0.041 3.842 2.363
204 HB3 LEU 25 HB3 LEU 25 0.746 2.829 3.551
205 HG LEU 25 HG LEU 25 -1.284 3.011 4.989
206 HD11 LEU 25 HD11 LEU 25 -2.499 4.352 2.586
207 HD12 LEU 25 HD12 LEU 25 -2.168 5.118 4.138
208 HD13 LEU 25 HD13 LEU 25 -3.361 3.823 4.030
209 HD21 LEU 25 HD21 LEU 25 -1.447 1.905 2.220
210 HD22 LEU 25 HD22 LEU 25 -2.723 1.630 3.412
211 HD23 LEU 25 HD23 LEU 25 -1.082 1.059 3.724
212 H ILE 26 H ILE 26 2.214 4.051 5.806
213 HA ILE 26 HA ILE 26 4.662 4.667 4.338
214 HB ILE 26 HB ILE 26 4.351 3.460 7.114
215 HG12 ILE 26 HG12 ILE 26 3.407 5.770 6.993
216 HG13 ILE 26 HG13 ILE 26 4.805 5.656 8.052
217 HG21 ILE 26 HG21 ILE 26 6.504 2.964 6.096
218 HG22 ILE 26 HG22 ILE 26 6.700 4.094 7.439
219 HG23 ILE 26 HG23 ILE 26 6.763 4.680 5.779
220 HD11 ILE 26 HD11 ILE 26 4.880 7.700 6.743
221 HD12 ILE 26 HD12 ILE 26 4.766 6.771 5.254
222 HD13 ILE 26 HD13 ILE 26 6.200 6.639 6.264
223 H ILE 27 H ILE 27 5.406 3.176 3.044
224 HA ILE 27 HA ILE 27 4.926 0.335 3.663
225 HB ILE 27 HB ILE 27 4.784 -0.138 1.255
226 HG12 ILE 27 HG12 ILE 27 4.599 2.819 0.712
227 HG13 ILE 27 HG13 ILE 27 6.148 1.981 0.682
228 HG21 ILE 27 HG21 ILE 27 2.577 0.829 0.801
229 HG22 ILE 27 HG22 ILE 27 2.810 1.967 2.128
230 HG23 ILE 27 HG23 ILE 27 2.698 0.242 2.457
231 HD11 ILE 27 HD11 ILE 27 5.320 0.512 -1.075
232 HD12 ILE 27 HD12 ILE 27 5.215 2.208 -1.541
233 HD13 ILE 27 HD13 ILE 27 3.762 1.341 -1.041
234 H ARG 28 H ARG 28 6.473 -1.045 2.521
235 HA ARG 28 HA ARG 28 9.199 -0.325 2.834
236 HB2 ARG 28 HB2 ARG 28 7.984 -2.539 1.174
237 HB3 ARG 28 HB3 ARG 28 9.687 -2.387 1.547
238 HG2 ARG 28 HG2 ARG 28 9.176 -2.678 3.922
239 HG3 ARG 28 HG3 ARG 28 7.465 -2.845 3.519
240 HD2 ARG 28 HD2 ARG 28 8.053 -4.786 2.075
241 HD3 ARG 28 HD3 ARG 28 9.715 -4.653 2.648
242 HE ARG 28 HE ARG 28 8.474 -4.845 4.940
243 HH11 ARG 28 HH11 ARG 28 7.983 -6.790 2.014
244 HH12 ARG 28 HH12 ARG 28 7.393 -8.143 2.860
245 HH21 ARG 28 HH21 ARG 28 7.656 -6.700 6.071
246 HH22 ARG 28 HH22 ARG 28 7.214 -8.096 5.182
247 H ARG 29 H ARG 29 10.513 0.750 1.528
248 HA ARG 29 HA ARG 29 9.519 1.620 -1.040
249 HB2 ARG 29 HB2 ARG 29 10.827 3.152 0.475
250 HB3 ARG 29 HB3 ARG 29 12.247 2.149 0.157
251 HG2 ARG 29 HG2 ARG 29 11.528 2.610 -2.339
252 HG3 ARG 29 HG3 ARG 29 10.815 4.044 -1.616
253 HD2 ARG 29 HD2 ARG 29 13.054 4.579 -0.655
254 HD3 ARG 29 HD3 ARG 29 13.699 3.182 -1.530
255 HE ARG 29 HE ARG 29 12.521 4.477 -3.505
256 HH11 ARG 29 HH11 ARG 29 14.894 5.681 -1.140
257 HH12 ARG 29 HH12 ARG 29 15.287 7.034 -2.076
258 HH21 ARG 29 HH21 ARG 29 13.092 6.335 -4.738
259 HH22 ARG 29 HH22 ARG 29 14.255 7.425 -4.160
260 H ARG 30 H ARG 30 9.921 0.570 -2.868
261 HA ARG 30 HA ARG 30 12.027 -1.419 -2.881
262 HB2 ARG 30 HB2 ARG 30 9.766 -0.802 -4.817
263 HB3 ARG 30 HB3 ARG 30 11.080 -1.883 -5.249
264 HG2 ARG 30 HG2 ARG 30 9.453 -3.374 -4.556
265 HG3 ARG 30 HG3 ARG 30 10.377 -3.158 -3.073
266 HD2 ARG 30 HD2 ARG 30 8.733 -1.649 -2.196
267 HD3 ARG 30 HD3 ARG 30 7.907 -1.566 -3.747
268 HE ARG 30 HE ARG 30 7.696 -3.644 -1.742
269 HH11 ARG 30 HH11 ARG 30 7.033 -2.830 -5.164
270 HH12 ARG 30 HH12 ARG 30 5.781 -3.959 -5.310
271 HH21 ARG 30 HH21 ARG 30 5.934 -5.161 -1.992
272 HH22 ARG 30 HH22 ARG 30 5.107 -5.323 -3.444
273 H LYS 31 H LYS 31 13.385 -1.368 -4.995
274 HA LYS 31 HA LYS 31 14.919 0.992 -4.801
275 HB2 LYS 31 HB2 LYS 31 15.042 -1.228 -6.827
276 HB3 LYS 31 HB3 LYS 31 16.261 0.024 -6.659
277 HG2 LYS 31 HG2 LYS 31 16.917 -0.755 -4.540
278 HG3 LYS 31 HG3 LYS 31 15.483 -1.769 -4.378
279 HD2 LYS 31 HD2 LYS 31 16.356 -2.998 -6.450
280 HD3 LYS 31 HD3 LYS 31 17.877 -2.167 -6.144
281 HE2 LYS 31 HE2 LYS 31 18.079 -3.174 -3.977
282 HE3 LYS 31 HE3 LYS 31 16.455 -3.842 -4.086
283 HZ1 LYS 31 HZ1 LYS 31 18.741 -4.601 -5.820
284 HZ2 LYS 31 HZ2 LYS 31 17.193 -5.262 -5.891
285 HZ3 LYS 31 HZ3 LYS 31 18.148 -5.508 -4.531
286 H ASP 32 H ASP 32 12.458 0.077 -7.071
287 HA ASP 32 HA ASP 32 13.165 2.198 -8.916
288 HB2 ASP 32 HB2 ASP 32 12.305 -0.062 -9.659
289 HB3 ASP 32 HB3 ASP 32 10.725 0.419 -9.055
290 H MET 33 H MET 33 11.651 2.275 -6.062
291 HA MET 33 HA MET 33 9.282 3.752 -6.531
292 HB2 MET 33 HB2 MET 33 10.890 3.030 -4.232
293 HB3 MET 33 HB3 MET 33 10.172 4.626 -4.074
294 HG2 MET 33 HG2 MET 33 8.713 3.072 -3.073
295 HG3 MET 33 HG3 MET 33 7.973 3.594 -4.584
296 HE1 MET 33 HE1 MET 33 6.303 1.641 -4.561
297 HE2 MET 33 HE2 MET 33 6.956 0.985 -3.052
298 HE3 MET 33 HE3 MET 33 6.743 -0.064 -4.456
299 H LYS 34 H LYS 34 9.275 5.569 -7.641
300 HA LYS 34 HA LYS 34 11.236 7.638 -7.043
301 HB2 LYS 34 HB2 LYS 34 9.538 7.079 -9.463
302 HB3 LYS 34 HB3 LYS 34 10.551 8.497 -9.258
303 HG2 LYS 34 HG2 LYS 34 12.536 7.124 -9.217
304 HG3 LYS 34 HG3 LYS 34 11.544 5.663 -9.263
305 HD2 LYS 34 HD2 LYS 34 11.480 7.742 -11.425
306 HD3 LYS 34 HD3 LYS 34 12.598 6.373 -11.448
307 HE2 LYS 34 HE2 LYS 34 9.584 6.184 -11.352
308 HE3 LYS 34 HE3 LYS 34 10.580 5.962 -12.784
309 HZ1 LYS 34 HZ1 LYS 34 10.009 3.843 -11.841
310 HZ2 LYS 34 HZ2 LYS 34 10.673 4.243 -10.352
311 HZ3 LYS 34 HZ3 LYS 34 11.646 4.105 -11.706
312 H VAL 35 H VAL 35 10.408 9.636 -6.568
313 HA VAL 35 HA VAL 35 7.835 9.613 -5.341
314 HB VAL 35 HB VAL 35 9.580 12.046 -5.774
315 HG11 VAL 35 HG11 VAL 35 8.547 12.778 -3.643
316 HG12 VAL 35 HG12 VAL 35 7.506 11.360 -3.706
317 HG13 VAL 35 HG13 VAL 35 7.396 12.590 -4.966
318 HG21 VAL 35 HG21 VAL 35 9.744 10.030 -3.537
319 HG22 VAL 35 HG22 VAL 35 10.609 11.568 -3.591
320 HG23 VAL 35 HG23 VAL 35 10.967 10.311 -4.774
321 H GLY 36 H GLY 36 5.941 10.275 -6.135
322 HA2 GLY 36 HA2 GLY 36 4.731 12.014 -7.307
323 HA3 GLY 36 HA3 GLY 36 5.975 11.940 -8.549
324 H GLN 37 H GLN 37 5.885 8.923 -8.302
325 HA GLN 37 HA GLN 37 3.680 8.673 -10.191
326 HB2 GLN 37 HB2 GLN 37 4.708 6.541 -10.870
327 HB3 GLN 37 HB3 GLN 37 5.832 7.885 -10.980
328 HG2 GLN 37 HG2 GLN 37 6.864 7.207 -8.892
329 HG3 GLN 37 HG3 GLN 37 5.734 5.859 -8.768
330 HE21 GLN 37 HE21 GLN 37 7.403 4.361 -8.796
331 HE22 GLN 37 HE22 GLN 37 8.274 3.987 -10.215
332 H GLN 38 H GLN 38 2.169 6.995 -10.146
333 HA GLN 38 HA GLN 38 1.502 6.033 -7.485
334 HB2 GLN 38 HB2 GLN 38 -0.261 6.994 -9.042
335 HB3 GLN 38 HB3 GLN 38 -0.011 5.596 -10.073
336 HG2 GLN 38 HG2 GLN 38 -0.791 4.111 -8.377
337 HG3 GLN 38 HG3 GLN 38 -0.851 5.410 -7.191
338 HE21 GLN 38 HE21 GLN 38 -2.487 6.946 -7.347
339 HE22 GLN 38 HE22 GLN 38 -3.925 6.667 -8.257
340 H VAL 39 H VAL 39 1.889 4.100 -6.799
341 HA VAL 39 HA VAL 39 3.011 2.146 -8.681
342 HB VAL 39 HB VAL 39 4.430 1.352 -6.787
343 HG11 VAL 39 HG11 VAL 39 4.787 4.270 -7.425
344 HG12 VAL 39 HG12 VAL 39 5.380 2.914 -8.384
345 HG13 VAL 39 HG13 VAL 39 6.026 3.200 -6.770
346 HG21 VAL 39 HG21 VAL 39 3.368 3.782 -5.341
347 HG22 VAL 39 HG22 VAL 39 4.648 2.719 -4.758
348 HG23 VAL 39 HG23 VAL 39 3.005 2.106 -4.946
349 H SER 40 H SER 40 2.764 -0.079 -7.939
350 HA SER 40 HA SER 40 0.295 -0.497 -6.403
351 HB2 SER 40 HB2 SER 40 1.639 -2.454 -8.263
352 HB3 SER 40 HB3 SER 40 -0.012 -2.516 -7.645
353 HG SER 40 HG SER 40 0.286 -0.211 -8.933
354 H PHE 41 H PHE 41 0.574 -1.457 -4.453
355 HA PHE 41 HA PHE 41 3.008 -3.007 -4.020
356 HB2 PHE 41 HB2 PHE 41 3.114 -2.051 -1.711
357 HB3 PHE 41 HB3 PHE 41 3.529 -0.914 -2.977
358 HD1 PHE 41 HD1 PHE 41 1.935 0.927 -3.526
359 HD2 PHE 41 HD2 PHE 41 1.209 -1.761 -0.309
360 HE1 PHE 41 HE1 PHE 41 0.246 2.466 -2.621
361 HE2 PHE 41 HE2 PHE 41 -0.479 -0.222 0.599
362 HZ PHE 41 HZ PHE 41 -0.961 1.886 -0.554
363 H GLU 42 H GLU 42 2.784 -4.286 -2.066
364 HA GLU 42 HA GLU 42 0.061 -5.348 -1.979
365 HB2 GLU 42 HB2 GLU 42 2.689 -6.681 -1.281
366 HB3 GLU 42 HB3 GLU 42 1.073 -7.353 -1.050
367 HG2 GLU 42 HG2 GLU 42 1.928 -8.328 -2.948
368 HG3 GLU 42 HG3 GLU 42 0.705 -7.155 -3.488
369 H ASN 43 H ASN 43 -0.460 -6.413 0.188
370 HA ASN 43 HA ASN 43 -0.316 -4.335 2.143
371 HB2 ASN 43 HB2 ASN 43 -1.751 -6.908 1.928
372 HB3 ASN 43 HB3 ASN 43 -1.458 -6.321 3.563
373 HD21 ASN 43 HD21 ASN 43 -2.093 -4.396 0.653
374 HD22 ASN 43 HD22 ASN 43 -3.562 -3.704 1.251
375 H GLU 44 H GLU 44 1.499 -7.130 1.512
376 HA GLU 44 HA GLU 44 2.622 -7.678 4.036
377 HB2 GLU 44 HB2 GLU 44 3.896 -7.884 1.322
378 HB3 GLU 44 HB3 GLU 44 4.486 -8.650 2.784
379 HG2 GLU 44 HG2 GLU 44 2.680 -10.142 2.840
380 HG3 GLU 44 HG3 GLU 44 1.778 -9.212 1.639
381 H ASP 45 H ASP 45 3.329 -5.341 1.543
382 HA ASP 45 HA ASP 45 5.819 -4.523 2.734
383 HB2 ASP 45 HB2 ASP 45 4.274 -3.483 0.369
384 HB3 ASP 45 HB3 ASP 45 5.772 -2.753 0.936
385 H ILE 46 H ILE 46 2.662 -3.839 3.413
386 HA ILE 46 HA ILE 46 3.010 -1.052 3.941
387 HB ILE 46 HB ILE 46 0.776 -2.901 4.850
388 HG12 ILE 46 HG12 ILE 46 0.885 -0.939 2.549
389 HG13 ILE 46 HG13 ILE 46 0.960 -2.685 2.391
390 HG21 ILE 46 HG21 ILE 46 -0.493 -0.809 5.228
391 HG22 ILE 46 HG22 ILE 46 0.967 0.117 4.867
392 HG23 ILE 46 HG23 ILE 46 0.919 -0.939 6.278
393 HD11 ILE 46 HD11 ILE 46 -1.253 -1.914 1.861
394 HD12 ILE 46 HD12 ILE 46 -1.358 -1.057 3.397
395 HD13 ILE 46 HD13 ILE 46 -1.311 -2.813 3.378
396 H TYR 47 H TYR 47 4.004 -0.232 5.532
397 HA TYR 47 HA TYR 47 4.861 -1.834 7.776
398 HB2 TYR 47 HB2 TYR 47 5.502 0.793 6.600
399 HB3 TYR 47 HB3 TYR 47 5.800 0.634 8.344
400 HD1 TYR 47 HD1 TYR 47 7.009 -1.908 8.682
401 HD2 TYR 47 HD2 TYR 47 7.339 0.713 5.359
402 HE1 TYR 47 HE1 TYR 47 9.183 -2.897 8.111
403 HE2 TYR 47 HE2 TYR 47 9.515 -0.275 4.790
404 HH TYR 47 HH TYR 47 10.610 -3.148 6.245
405 H ASN 48 H ASN 48 2.311 0.209 6.975
406 HA ASN 48 HA ASN 48 1.798 1.192 9.656
407 HB2 ASN 48 HB2 ASN 48 0.383 1.559 7.037
408 HB3 ASN 48 HB3 ASN 48 -0.403 1.999 8.544
409 HD21 ASN 48 HD21 ASN 48 2.380 2.838 9.635
410 HD22 ASN 48 HD22 ASN 48 2.575 4.374 8.920
411 H VAL 49 H VAL 49 1.596 -1.772 8.879
412 HA VAL 49 HA VAL 49 -1.157 -2.324 9.568
413 HB VAL 49 HB VAL 49 1.203 -4.239 9.344
414 HG11 VAL 49 HG11 VAL 49 -0.501 -6.010 9.225
415 HG12 VAL 49 HG12 VAL 49 -1.757 -4.808 9.527
416 HG13 VAL 49 HG13 VAL 49 -0.549 -5.151 10.763
417 HG21 VAL 49 HG21 VAL 49 0.162 -4.899 7.189
418 HG22 VAL 49 HG22 VAL 49 0.741 -3.235 7.198
419 HG23 VAL 49 HG23 VAL 49 -0.982 -3.570 7.372
420 H ARG 50 H ARG 50 -1.670 -1.782 11.558
421 HA ARG 50 HA ARG 50 0.262 -1.961 13.718
422 HB2 ARG 50 HB2 ARG 50 -2.308 -0.559 13.288
423 HB3 ARG 50 HB3 ARG 50 -1.978 -1.072 14.933
424 HG2 ARG 50 HG2 ARG 50 -1.266 1.216 14.564
425 HG3 ARG 50 HG3 ARG 50 0.115 0.181 14.918
426 HD2 ARG 50 HD2 ARG 50 0.412 -0.002 12.395
427 HD3 ARG 50 HD3 ARG 50 -0.755 1.311 12.273
428 HE ARG 50 HE ARG 50 1.697 1.575 13.846
429 HH11 ARG 50 HH11 ARG 50 -0.452 2.800 11.284
430 HH12 ARG 50 HH12 ARG 50 0.470 4.210 11.019
431 HH21 ARG 50 HH21 ARG 50 2.972 3.533 13.399
432 HH22 ARG 50 HH22 ARG 50 2.452 4.605 12.183
433 H GLY 51 H GLY 51 -0.018 -3.164 15.560
434 HA2 GLY 51 HA2 GLY 51 -1.968 -5.333 15.308
435 HA3 GLY 51 HA3 GLY 51 -0.435 -5.444 16.174
436 H LYS 52 H LYS 52 -3.655 -4.129 16.219
437 HA LYS 52 HA LYS 52 -3.570 -4.079 19.110
438 HB2 LYS 52 HB2 LYS 52 -4.276 -1.667 17.410
439 HB3 LYS 52 HB3 LYS 52 -4.872 -1.853 19.048
440 HG2 LYS 52 HG2 LYS 52 -1.932 -2.036 18.611
441 HG3 LYS 52 HG3 LYS 52 -2.692 -0.452 18.474
442 HD2 LYS 52 HD2 LYS 52 -1.978 -0.628 20.725
443 HD3 LYS 52 HD3 LYS 52 -3.712 -0.894 20.760
444 HE2 LYS 52 HE2 LYS 52 -2.527 -2.471 22.219
445 HE3 LYS 52 HE3 LYS 52 -3.353 -3.317 20.929
446 HZ1 LYS 52 HZ1 LYS 52 -1.248 -3.538 19.759
447 HZ2 LYS 52 HZ2 LYS 52 -1.102 -4.164 21.296
448 HZ3 LYS 52 HZ3 LYS 52 -0.454 -2.650 20.952
Start of MODEL 17
1 H1 SER 0 H1 SER 0 -1.126 -10.865 -0.218
2 H2 SER 0 H2 SER 0 -2.197 -9.810 0.516
3 H3 SER 0 H3 SER 0 -1.310 -9.300 -0.882
4 HA SER 0 HA SER 0 -2.529 -11.218 -1.962
5 HB2 SER 0 HB2 SER 0 -4.734 -11.495 -0.644
6 HB3 SER 0 HB3 SER 0 -3.293 -12.371 -0.117
7 HG SER 0 HG SER 0 -4.558 -11.076 1.512
8 H MET 1 H MET 1 -2.532 -8.006 -0.893
9 HA MET 1 HA MET 1 -4.813 -7.355 -2.539
10 HB2 MET 1 HB2 MET 1 -4.468 -6.190 0.239
11 HB3 MET 1 HB3 MET 1 -5.732 -5.779 -0.899
12 HG2 MET 1 HG2 MET 1 -6.244 -8.373 -0.713
13 HG3 MET 1 HG3 MET 1 -5.408 -8.158 0.824
14 HE1 MET 1 HE1 MET 1 -6.280 -5.161 1.621
15 HE2 MET 1 HE2 MET 1 -6.270 -6.511 2.759
16 HE3 MET 1 HE3 MET 1 -7.699 -5.490 2.618
17 H ASN 2 H ASN 2 -3.112 -6.800 -3.944
18 HA ASN 2 HA ASN 2 -1.309 -4.728 -3.538
19 HB2 ASN 2 HB2 ASN 2 -2.775 -5.568 -6.033
20 HB3 ASN 2 HB3 ASN 2 -1.631 -4.238 -6.030
21 HD21 ASN 2 HD21 ASN 2 0.577 -4.704 -5.645
22 HD22 ASN 2 HD22 ASN 2 1.217 -6.267 -5.934
23 H ARG 3 H ARG 3 -1.517 -2.682 -3.230
24 HA ARG 3 HA ARG 3 -4.089 -1.390 -3.809
25 HB2 ARG 3 HB2 ARG 3 -3.195 -1.730 -1.293
26 HB3 ARG 3 HB3 ARG 3 -2.303 -0.272 -1.696
27 HG2 ARG 3 HG2 ARG 3 -4.238 0.556 -0.716
28 HG3 ARG 3 HG3 ARG 3 -4.599 0.659 -2.443
29 HD2 ARG 3 HD2 ARG 3 -5.588 -1.697 -2.144
30 HD3 ARG 3 HD3 ARG 3 -5.551 -1.324 -0.428
31 HE ARG 3 HE ARG 3 -6.865 0.810 -1.488
32 HH11 ARG 3 HH11 ARG 3 -7.402 -2.679 -1.815
33 HH12 ARG 3 HH12 ARG 3 -9.087 -2.552 -1.930
34 HH21 ARG 3 HH21 ARG 3 -9.137 0.996 -1.671
35 HH22 ARG 3 HH22 ARG 3 -10.121 -0.404 -1.822
36 H LEU 4 H LEU 4 -3.852 0.888 -4.365
37 HA LEU 4 HA LEU 4 -1.319 1.348 -5.772
38 HB2 LEU 4 HB2 LEU 4 -4.035 2.562 -6.269
39 HB3 LEU 4 HB3 LEU 4 -2.607 2.773 -7.256
40 HG LEU 4 HG LEU 4 -4.129 0.188 -6.908
41 HD11 LEU 4 HD11 LEU 4 -4.812 0.528 -9.231
42 HD12 LEU 4 HD12 LEU 4 -4.022 2.103 -9.232
43 HD13 LEU 4 HD13 LEU 4 -5.404 1.810 -8.175
44 HD21 LEU 4 HD21 LEU 4 -1.792 -0.248 -7.324
45 HD22 LEU 4 HD22 LEU 4 -1.785 0.890 -8.674
46 HD23 LEU 4 HD23 LEU 4 -2.723 -0.601 -8.780
47 H GLY 5 H GLY 5 -0.144 3.061 -5.179
48 HA2 GLY 5 HA2 GLY 5 -1.477 5.300 -3.910
49 HA3 GLY 5 HA3 GLY 5 -0.243 4.478 -2.952
50 H ILE 6 H ILE 6 -0.218 7.127 -3.807
51 HA ILE 6 HA ILE 6 1.773 7.175 -5.946
52 HB ILE 6 HB ILE 6 0.416 9.526 -4.607
53 HG12 ILE 6 HG12 ILE 6 -0.432 8.361 -7.249
54 HG13 ILE 6 HG13 ILE 6 -1.137 7.785 -5.744
55 HG21 ILE 6 HG21 ILE 6 2.441 10.064 -5.816
56 HG22 ILE 6 HG22 ILE 6 1.035 10.679 -6.686
57 HG23 ILE 6 HG23 ILE 6 1.851 9.217 -7.245
58 HD11 ILE 6 HD11 ILE 6 -1.881 10.082 -5.260
59 HD12 ILE 6 HD12 ILE 6 -2.558 9.431 -6.745
60 HD13 ILE 6 HD13 ILE 6 -1.225 10.593 -6.820
61 H ILE 7 H ILE 7 3.834 7.532 -5.505
62 HA ILE 7 HA ILE 7 4.731 7.614 -2.831
63 HB ILE 7 HB ILE 7 6.299 8.313 -5.319
64 HG12 ILE 7 HG12 ILE 7 5.344 6.117 -5.585
65 HG13 ILE 7 HG13 ILE 7 7.064 5.955 -5.251
66 HG21 ILE 7 HG21 ILE 7 8.263 7.737 -4.025
67 HG22 ILE 7 HG22 ILE 7 7.257 7.334 -2.630
68 HG23 ILE 7 HG23 ILE 7 7.351 9.002 -3.195
69 HD11 ILE 7 HD11 ILE 7 6.462 5.445 -2.868
70 HD12 ILE 7 HD12 ILE 7 5.829 4.283 -4.041
71 HD13 ILE 7 HD13 ILE 7 4.774 5.507 -3.361
72 H TYR 8 H TYR 8 4.300 9.204 -1.646
73 HA TYR 8 HA TYR 8 4.142 11.926 -2.595
74 HB2 TYR 8 HB2 TYR 8 2.550 10.829 -0.958
75 HB3 TYR 8 HB3 TYR 8 3.860 10.861 0.211
76 HD1 TYR 8 HD1 TYR 8 4.467 12.892 1.321
77 HD2 TYR 8 HD2 TYR 8 1.530 12.897 -1.744
78 HE1 TYR 8 HE1 TYR 8 3.805 15.153 1.990
79 HE2 TYR 8 HE2 TYR 8 0.842 15.160 -1.098
80 HH TYR 8 HH TYR 8 0.985 16.584 1.071
81 H GLU 9 H GLU 9 6.165 9.857 -0.632
82 HA GLU 9 HA GLU 9 8.393 11.605 -0.781
83 HB2 GLU 9 HB2 GLU 9 6.971 12.605 1.076
84 HB3 GLU 9 HB3 GLU 9 7.189 11.104 1.958
85 HG2 GLU 9 HG2 GLU 9 9.577 11.474 2.052
86 HG3 GLU 9 HG3 GLU 9 9.406 12.932 1.082
87 H ILE 10 H ILE 10 10.273 10.535 0.137
88 HA ILE 10 HA ILE 10 9.944 7.631 0.515
89 HB ILE 10 HB ILE 10 12.231 9.255 -0.638
90 HG12 ILE 10 HG12 ILE 10 10.270 8.709 -2.107
91 HG13 ILE 10 HG13 ILE 10 11.818 8.116 -2.711
92 HG21 ILE 10 HG21 ILE 10 13.160 7.501 0.777
93 HG22 ILE 10 HG22 ILE 10 13.462 7.146 -0.926
94 HG23 ILE 10 HG23 ILE 10 12.181 6.297 -0.058
95 HD11 ILE 10 HD11 ILE 10 11.227 5.878 -1.881
96 HD12 ILE 10 HD12 ILE 10 10.052 6.499 -3.043
97 HD13 ILE 10 HD13 ILE 10 9.676 6.506 -1.321
98 H GLN 11 H GLN 11 10.812 6.776 2.334
99 HA GLN 11 HA GLN 11 12.192 8.614 4.145
100 HB2 GLN 11 HB2 GLN 11 9.664 7.527 4.523
101 HB3 GLN 11 HB3 GLN 11 10.713 6.445 5.422
102 HG2 GLN 11 HG2 GLN 11 10.211 7.957 7.050
103 HG3 GLN 11 HG3 GLN 11 11.671 8.681 6.385
104 HE21 GLN 11 HE21 GLN 11 10.434 9.783 4.004
105 HE22 GLN 11 HE22 GLN 11 9.409 11.058 4.519
106 H GLY 12 H GLY 12 14.052 7.654 3.049
107 HA2 GLY 12 HA2 GLY 12 15.883 6.269 3.106
108 HA3 GLY 12 HA3 GLY 12 15.146 5.448 4.478
109 H MET 13 H MET 13 14.488 3.456 4.176
110 HA MET 13 HA MET 13 14.086 2.562 1.428
111 HB2 MET 13 HB2 MET 13 14.890 1.034 3.894
112 HB3 MET 13 HB3 MET 13 14.245 0.214 2.482
113 HG2 MET 13 HG2 MET 13 16.102 1.526 1.209
114 HG3 MET 13 HG3 MET 13 16.831 1.668 2.804
115 HE1 MET 13 HE1 MET 13 15.909 -0.578 -0.183
116 HE2 MET 13 HE2 MET 13 14.812 -1.302 0.993
117 HE3 MET 13 HE3 MET 13 16.191 -2.217 0.400
118 H LYS 14 H LYS 14 12.256 3.935 3.409
119 HA LYS 14 HA LYS 14 9.977 2.147 2.991
120 HB2 LYS 14 HB2 LYS 14 10.311 4.383 5.008
121 HB3 LYS 14 HB3 LYS 14 8.900 3.354 4.827
122 HG2 LYS 14 HG2 LYS 14 10.188 1.425 5.524
123 HG3 LYS 14 HG3 LYS 14 11.642 2.414 5.618
124 HD2 LYS 14 HD2 LYS 14 10.512 3.798 7.345
125 HD3 LYS 14 HD3 LYS 14 9.158 2.669 7.303
126 HE2 LYS 14 HE2 LYS 14 10.655 2.135 9.151
127 HE3 LYS 14 HE3 LYS 14 10.650 0.846 7.958
128 HZ1 LYS 14 HZ1 LYS 14 12.747 1.634 7.096
129 HZ2 LYS 14 HZ2 LYS 14 12.905 1.411 8.759
130 HZ3 LYS 14 HZ3 LYS 14 12.732 2.955 8.131
131 H ALA 15 H ALA 15 7.991 3.426 2.466
132 HA ALA 15 HA ALA 15 8.605 5.992 1.201
133 HB1 ALA 15 HB1 ALA 15 7.116 3.747 -0.157
134 HB2 ALA 15 HB2 ALA 15 8.751 4.284 -0.549
135 HB3 ALA 15 HB3 ALA 15 7.383 5.365 -0.808
136 H VAL 16 H VAL 16 6.926 7.391 1.091
137 HA VAL 16 HA VAL 16 4.568 6.739 2.715
138 HB VAL 16 HB VAL 16 5.533 9.437 1.686
139 HG11 VAL 16 HG11 VAL 16 3.102 9.342 1.961
140 HG12 VAL 16 HG12 VAL 16 3.838 10.419 3.148
141 HG13 VAL 16 HG13 VAL 16 3.307 8.807 3.630
142 HG21 VAL 16 HG21 VAL 16 7.004 8.530 3.441
143 HG22 VAL 16 HG22 VAL 16 5.581 8.353 4.490
144 HG23 VAL 16 HG23 VAL 16 6.101 9.953 3.984
145 H VAL 17 H VAL 17 2.897 6.092 1.582
146 HA VAL 17 HA VAL 17 2.618 7.079 -1.167
147 HB VAL 17 HB VAL 17 0.919 5.142 -1.357
148 HG11 VAL 17 HG11 VAL 17 3.909 4.836 -1.414
149 HG12 VAL 17 HG12 VAL 17 2.780 5.119 -2.742
150 HG13 VAL 17 HG13 VAL 17 2.809 3.560 -1.929
151 HG21 VAL 17 HG21 VAL 17 0.964 3.397 0.122
152 HG22 VAL 17 HG22 VAL 17 1.409 4.706 1.221
153 HG23 VAL 17 HG23 VAL 17 2.659 3.671 0.537
154 H LEU 18 H LEU 18 1.030 8.306 -1.646
155 HA LEU 18 HA LEU 18 -1.216 8.619 0.169
156 HB2 LEU 18 HB2 LEU 18 -0.281 10.640 -0.802
157 HB3 LEU 18 HB3 LEU 18 -0.406 9.979 -2.415
158 HG LEU 18 HG LEU 18 -2.899 10.054 -2.186
159 HD11 LEU 18 HD11 LEU 18 -3.884 11.347 -0.399
160 HD12 LEU 18 HD12 LEU 18 -2.291 11.621 0.302
161 HD13 LEU 18 HD13 LEU 18 -2.976 9.991 0.285
162 HD21 LEU 18 HD21 LEU 18 -1.484 12.661 -1.742
163 HD22 LEU 18 HD22 LEU 18 -3.074 12.443 -2.482
164 HD23 LEU 18 HD23 LEU 18 -1.628 11.831 -3.295
165 H THR 19 H THR 19 -2.513 6.975 -0.017
166 HA THR 19 HA THR 19 -2.568 5.268 -2.300
167 HB THR 19 HB THR 19 -4.326 4.063 -1.000
168 HG1 THR 19 HG1 THR 19 -3.658 5.811 1.124
169 HG21 THR 19 HG21 THR 19 -1.930 3.535 -0.778
170 HG22 THR 19 HG22 THR 19 -2.794 3.319 0.751
171 HG23 THR 19 HG23 THR 19 -1.793 4.746 0.499
172 H SER 20 H SER 20 -4.742 4.455 -3.123
173 HA SER 20 HA SER 20 -6.256 6.420 -4.408
174 HB2 SER 20 HB2 SER 20 -7.756 4.336 -4.730
175 HB3 SER 20 HB3 SER 20 -6.107 4.287 -5.371
176 HG SER 20 HG SER 20 -7.162 3.018 -3.068
177 H GLU 21 H GLU 21 -6.244 5.330 -1.241
178 HA GLU 21 HA GLU 21 -9.042 5.720 -0.628
179 HB2 GLU 21 HB2 GLU 21 -6.815 5.292 1.333
180 HB3 GLU 21 HB3 GLU 21 -8.503 4.834 1.475
181 HG2 GLU 21 HG2 GLU 21 -6.467 3.570 -0.349
182 HG3 GLU 21 HG3 GLU 21 -7.069 2.889 1.154
183 H GLY 22 H GLY 22 -6.242 7.633 -0.972
184 HA2 GLY 22 HA2 GLY 22 -5.921 9.858 -0.513
185 HA3 GLY 22 HA3 GLY 22 -7.462 9.880 0.343
186 H GLU 23 H GLU 23 -5.401 7.399 1.225
187 HA GLU 23 HA GLU 23 -4.812 8.689 3.798
188 HB2 GLU 23 HB2 GLU 23 -4.874 5.784 2.972
189 HB3 GLU 23 HB3 GLU 23 -4.504 6.346 4.586
190 HG2 GLU 23 HG2 GLU 23 -7.121 6.759 3.155
191 HG3 GLU 23 HG3 GLU 23 -6.801 5.486 4.333
192 H PHE 24 H PHE 24 -2.689 8.770 4.502
193 HA PHE 24 HA PHE 24 -0.640 8.111 2.527
194 HB2 PHE 24 HB2 PHE 24 -0.394 9.721 5.098
195 HB3 PHE 24 HB3 PHE 24 0.893 9.397 3.954
196 HD1 PHE 24 HD1 PHE 24 1.338 10.862 2.256
197 HD2 PHE 24 HD2 PHE 24 -2.437 11.017 4.201
198 HE1 PHE 24 HE1 PHE 24 0.797 12.924 1.045
199 HE2 PHE 24 HE2 PHE 24 -2.981 13.089 2.981
200 HZ PHE 24 HZ PHE 24 -1.363 14.039 1.404
201 H LEU 25 H LEU 25 0.235 6.246 2.709
202 HA LEU 25 HA LEU 25 0.327 4.901 5.339
203 HB2 LEU 25 HB2 LEU 25 -0.016 3.881 2.553
204 HB3 LEU 25 HB3 LEU 25 0.778 2.858 3.719
205 HG LEU 25 HG LEU 25 -1.285 2.997 5.140
206 HD11 LEU 25 HD11 LEU 25 -3.347 3.586 3.676
207 HD12 LEU 25 HD12 LEU 25 -2.198 4.608 2.810
208 HD13 LEU 25 HD13 LEU 25 -2.477 4.857 4.536
209 HD21 LEU 25 HD21 LEU 25 -0.783 1.110 3.625
210 HD22 LEU 25 HD22 LEU 25 -1.705 1.916 2.358
211 HD23 LEU 25 HD23 LEU 25 -2.510 1.387 3.837
212 H ILE 26 H ILE 26 2.209 3.813 5.928
213 HA ILE 26 HA ILE 26 4.628 4.667 4.526
214 HB ILE 26 HB ILE 26 4.351 3.374 7.268
215 HG12 ILE 26 HG12 ILE 26 3.341 5.624 7.298
216 HG13 ILE 26 HG13 ILE 26 4.825 5.584 8.241
217 HG21 ILE 26 HG21 ILE 26 6.684 4.064 7.612
218 HG22 ILE 26 HG22 ILE 26 6.736 4.681 5.962
219 HG23 ILE 26 HG23 ILE 26 6.513 2.955 6.250
220 HD11 ILE 26 HD11 ILE 26 6.010 6.614 6.329
221 HD12 ILE 26 HD12 ILE 26 4.727 7.625 6.984
222 HD13 ILE 26 HD13 ILE 26 4.466 6.734 5.482
223 H ILE 27 H ILE 27 5.309 3.205 3.145
224 HA ILE 27 HA ILE 27 4.843 0.369 3.788
225 HB ILE 27 HB ILE 27 4.641 -0.105 1.389
226 HG12 ILE 27 HG12 ILE 27 4.568 2.885 0.942
227 HG13 ILE 27 HG13 ILE 27 5.997 1.898 0.682
228 HG21 ILE 27 HG21 ILE 27 2.703 1.958 2.426
229 HG22 ILE 27 HG22 ILE 27 2.561 0.200 2.549
230 HG23 ILE 27 HG23 ILE 27 2.432 0.986 0.982
231 HD11 ILE 27 HD11 ILE 27 4.765 2.378 -1.375
232 HD12 ILE 27 HD12 ILE 27 3.375 1.502 -0.721
233 HD13 ILE 27 HD13 ILE 27 4.891 0.653 -1.033
234 H ARG 28 H ARG 28 6.318 -1.029 2.573
235 HA ARG 28 HA ARG 28 9.051 -0.341 2.857
236 HB2 ARG 28 HB2 ARG 28 7.855 -2.531 1.142
237 HB3 ARG 28 HB3 ARG 28 9.518 -2.430 1.678
238 HG2 ARG 28 HG2 ARG 28 8.778 -2.761 3.992
239 HG3 ARG 28 HG3 ARG 28 7.108 -2.879 3.434
240 HD2 ARG 28 HD2 ARG 28 7.879 -4.758 1.923
241 HD3 ARG 28 HD3 ARG 28 9.403 -4.721 2.801
242 HE ARG 28 HE ARG 28 7.059 -4.991 4.455
243 HH11 ARG 28 HH11 ARG 28 9.633 -6.698 2.715
244 HH12 ARG 28 HH12 ARG 28 9.392 -8.180 3.485
245 HH21 ARG 28 HH21 ARG 28 6.722 -7.041 5.549
246 HH22 ARG 28 HH22 ARG 28 7.679 -8.391 5.140
247 H ARG 29 H ARG 29 10.386 0.577 1.429
248 HA ARG 29 HA ARG 29 9.266 1.500 -1.064
249 HB2 ARG 29 HB2 ARG 29 10.599 3.089 0.128
250 HB3 ARG 29 HB3 ARG 29 11.919 1.945 0.291
251 HG2 ARG 29 HG2 ARG 29 11.853 2.045 -2.347
252 HG3 ARG 29 HG3 ARG 29 11.125 3.621 -2.019
253 HD2 ARG 29 HD2 ARG 29 12.989 4.196 -0.596
254 HD3 ARG 29 HD3 ARG 29 13.687 2.593 -0.903
255 HE ARG 29 HE ARG 29 13.445 3.594 -3.374
256 HH11 ARG 29 HH11 ARG 29 14.955 4.966 -0.425
257 HH12 ARG 29 HH12 ARG 29 16.076 5.888 -1.295
258 HH21 ARG 29 HH21 ARG 29 15.025 4.836 -4.529
259 HH22 ARG 29 HH22 ARG 29 16.147 5.797 -3.684
260 H ARG 30 H ARG 30 9.615 0.618 -2.909
261 HA ARG 30 HA ARG 30 11.367 -1.712 -3.091
262 HB2 ARG 30 HB2 ARG 30 9.048 -0.825 -4.842
263 HB3 ARG 30 HB3 ARG 30 10.025 -2.254 -5.128
264 HG2 ARG 30 HG2 ARG 30 9.179 -3.305 -3.136
265 HG3 ARG 30 HG3 ARG 30 8.342 -1.823 -2.664
266 HD2 ARG 30 HD2 ARG 30 6.900 -1.981 -4.609
267 HD3 ARG 30 HD3 ARG 30 7.785 -3.387 -5.183
268 HE ARG 30 HE ARG 30 6.650 -3.728 -2.558
269 HH11 ARG 30 HH11 ARG 30 5.867 -3.870 -6.027
270 HH12 ARG 30 HH12 ARG 30 4.694 -5.077 -5.843
271 HH21 ARG 30 HH21 ARG 30 5.027 -5.412 -2.348
272 HH22 ARG 30 HH22 ARG 30 4.268 -6.048 -3.739
273 H LYS 31 H LYS 31 11.915 -1.742 -5.739
274 HA LYS 31 HA LYS 31 13.830 0.364 -5.826
275 HB2 LYS 31 HB2 LYS 31 13.167 -1.822 -7.761
276 HB3 LYS 31 HB3 LYS 31 14.481 -0.681 -8.004
277 HG2 LYS 31 HG2 LYS 31 15.639 -1.465 -6.069
278 HG3 LYS 31 HG3 LYS 31 14.253 -2.441 -5.577
279 HD2 LYS 31 HD2 LYS 31 15.940 -2.871 -8.048
280 HD3 LYS 31 HD3 LYS 31 16.002 -3.829 -6.569
281 HE2 LYS 31 HE2 LYS 31 13.551 -4.311 -6.925
282 HE3 LYS 31 HE3 LYS 31 13.716 -3.603 -8.525
283 HZ1 LYS 31 HZ1 LYS 31 15.329 -5.273 -9.085
284 HZ2 LYS 31 HZ2 LYS 31 13.926 -6.019 -8.506
285 HZ3 LYS 31 HZ3 LYS 31 15.279 -5.892 -7.520
286 H ASP 32 H ASP 32 10.807 -0.297 -7.426
287 HA ASP 32 HA ASP 32 11.115 1.794 -9.394
288 HB2 ASP 32 HB2 ASP 32 9.889 -0.329 -9.874
289 HB3 ASP 32 HB3 ASP 32 8.647 0.167 -8.733
290 H MET 33 H MET 33 10.778 2.199 -6.297
291 HA MET 33 HA MET 33 8.486 3.915 -6.149
292 HB2 MET 33 HB2 MET 33 10.618 3.043 -4.317
293 HB3 MET 33 HB3 MET 33 9.975 4.646 -4.013
294 HG2 MET 33 HG2 MET 33 8.832 2.987 -2.687
295 HG3 MET 33 HG3 MET 33 7.741 3.734 -3.843
296 HE1 MET 33 HE1 MET 33 6.133 1.774 -3.133
297 HE2 MET 33 HE2 MET 33 7.301 0.806 -2.233
298 HE3 MET 33 HE3 MET 33 6.382 0.079 -3.551
299 H LYS 34 H LYS 34 8.492 5.732 -7.335
300 HA LYS 34 HA LYS 34 10.826 7.470 -7.152
301 HB2 LYS 34 HB2 LYS 34 8.986 6.804 -9.428
302 HB3 LYS 34 HB3 LYS 34 9.965 8.260 -9.408
303 HG2 LYS 34 HG2 LYS 34 11.942 7.063 -9.660
304 HG3 LYS 34 HG3 LYS 34 11.222 5.580 -9.019
305 HD2 LYS 34 HD2 LYS 34 10.174 6.736 -11.552
306 HD3 LYS 34 HD3 LYS 34 11.681 5.802 -11.599
307 HE2 LYS 34 HE2 LYS 34 10.459 3.947 -10.500
308 HE3 LYS 34 HE3 LYS 34 8.990 4.908 -10.588
309 HZ1 LYS 34 HZ1 LYS 34 10.574 4.136 -12.973
310 HZ2 LYS 34 HZ2 LYS 34 9.020 4.791 -12.945
311 HZ3 LYS 34 HZ3 LYS 34 9.308 3.223 -12.342
312 H VAL 35 H VAL 35 10.287 9.486 -6.455
313 HA VAL 35 HA VAL 35 7.769 9.865 -5.275
314 HB VAL 35 HB VAL 35 9.697 12.103 -5.940
315 HG11 VAL 35 HG11 VAL 35 7.416 12.688 -5.124
316 HG12 VAL 35 HG12 VAL 35 8.715 13.227 -4.058
317 HG13 VAL 35 HG13 VAL 35 7.768 11.797 -3.645
318 HG21 VAL 35 HG21 VAL 35 10.755 11.705 -3.785
319 HG22 VAL 35 HG22 VAL 35 10.892 10.267 -4.796
320 HG23 VAL 35 HG23 VAL 35 9.695 10.326 -3.500
321 H GLY 36 H GLY 36 5.910 10.391 -6.121
322 HA2 GLY 36 HA2 GLY 36 4.662 12.077 -7.346
323 HA3 GLY 36 HA3 GLY 36 5.904 11.994 -8.586
324 H GLN 37 H GLN 37 5.926 8.969 -8.394
325 HA GLN 37 HA GLN 37 3.572 8.700 -10.001
326 HB2 GLN 37 HB2 GLN 37 4.699 6.543 -10.851
327 HB3 GLN 37 HB3 GLN 37 5.321 8.132 -11.307
328 HG2 GLN 37 HG2 GLN 37 7.221 6.964 -10.950
329 HG3 GLN 37 HG3 GLN 37 6.988 7.784 -9.418
330 HE21 GLN 37 HE21 GLN 37 6.759 4.726 -11.088
331 HE22 GLN 37 HE22 GLN 37 6.906 3.754 -9.677
332 H GLN 38 H GLN 38 2.459 6.660 -10.090
333 HA GLN 38 HA GLN 38 1.743 5.937 -7.372
334 HB2 GLN 38 HB2 GLN 38 0.072 6.810 -9.052
335 HB3 GLN 38 HB3 GLN 38 0.297 5.312 -9.935
336 HG2 GLN 38 HG2 GLN 38 -0.597 4.042 -8.131
337 HG3 GLN 38 HG3 GLN 38 -0.616 5.458 -7.077
338 HE21 GLN 38 HE21 GLN 38 -2.832 5.313 -6.727
339 HE22 GLN 38 HE22 GLN 38 -3.970 5.674 -7.984
340 H VAL 39 H VAL 39 2.207 4.063 -6.568
341 HA VAL 39 HA VAL 39 3.353 2.029 -8.347
342 HB VAL 39 HB VAL 39 4.559 1.171 -6.365
343 HG11 VAL 39 HG11 VAL 39 6.202 2.989 -6.165
344 HG12 VAL 39 HG12 VAL 39 5.078 4.053 -7.005
345 HG13 VAL 39 HG13 VAL 39 5.744 2.648 -7.833
346 HG21 VAL 39 HG21 VAL 39 4.694 2.525 -4.316
347 HG22 VAL 39 HG22 VAL 39 3.055 1.959 -4.621
348 HG23 VAL 39 HG23 VAL 39 3.489 3.629 -4.979
349 H SER 40 H SER 40 2.843 -0.109 -7.962
350 HA SER 40 HA SER 40 0.400 -0.561 -6.462
351 HB2 SER 40 HB2 SER 40 1.906 -2.445 -8.288
352 HB3 SER 40 HB3 SER 40 0.232 -2.590 -7.739
353 HG SER 40 HG SER 40 0.713 -0.214 -8.993
354 H PHE 41 H PHE 41 0.729 -1.205 -4.430
355 HA PHE 41 HA PHE 41 3.113 -2.825 -3.855
356 HB2 PHE 41 HB2 PHE 41 3.131 -1.865 -1.575
357 HB3 PHE 41 HB3 PHE 41 3.427 -0.654 -2.799
358 HD1 PHE 41 HD1 PHE 41 1.695 1.065 -3.270
359 HD2 PHE 41 HD2 PHE 41 1.176 -1.824 -0.189
360 HE1 PHE 41 HE1 PHE 41 -0.110 2.416 -2.302
361 HE2 PHE 41 HE2 PHE 41 -0.637 -0.473 0.775
362 HZ PHE 41 HZ PHE 41 -1.283 1.637 -0.271
363 H GLU 42 H GLU 42 2.705 -3.973 -1.706
364 HA GLU 42 HA GLU 42 0.015 -5.142 -1.926
365 HB2 GLU 42 HB2 GLU 42 2.671 -6.375 -1.598
366 HB3 GLU 42 HB3 GLU 42 1.358 -6.977 -0.590
367 HG2 GLU 42 HG2 GLU 42 0.817 -6.631 -3.433
368 HG3 GLU 42 HG3 GLU 42 1.775 -8.017 -2.911
369 H ASN 43 H ASN 43 -0.475 -6.383 0.081
370 HA ASN 43 HA ASN 43 -0.658 -4.456 2.222
371 HB2 ASN 43 HB2 ASN 43 -1.903 -7.093 1.704
372 HB3 ASN 43 HB3 ASN 43 -1.629 -6.728 3.407
373 HD21 ASN 43 HD21 ASN 43 -2.476 -4.557 0.725
374 HD22 ASN 43 HD22 ASN 43 -3.955 -4.043 1.437
375 H GLU 44 H GLU 44 1.363 -6.995 1.391
376 HA GLU 44 HA GLU 44 2.534 -7.556 3.921
377 HB2 GLU 44 HB2 GLU 44 3.695 -7.872 1.161
378 HB3 GLU 44 HB3 GLU 44 4.266 -8.643 2.630
379 HG2 GLU 44 HG2 GLU 44 2.259 -9.955 2.778
380 HG3 GLU 44 HG3 GLU 44 1.563 -9.103 1.397
381 H ASP 45 H ASP 45 2.962 -5.142 1.446
382 HA ASP 45 HA ASP 45 5.597 -4.361 2.299
383 HB2 ASP 45 HB2 ASP 45 3.685 -3.244 0.263
384 HB3 ASP 45 HB3 ASP 45 5.171 -2.412 0.699
385 H ILE 46 H ILE 46 2.501 -3.750 3.385
386 HA ILE 46 HA ILE 46 2.937 -1.013 4.038
387 HB ILE 46 HB ILE 46 0.758 -2.805 5.168
388 HG12 ILE 46 HG12 ILE 46 0.657 -1.101 2.663
389 HG13 ILE 46 HG13 ILE 46 0.788 -2.853 2.667
390 HG21 ILE 46 HG21 ILE 46 1.062 -0.673 6.309
391 HG22 ILE 46 HG22 ILE 46 -0.449 -0.672 5.398
392 HG23 ILE 46 HG23 ILE 46 0.959 0.185 4.773
393 HD11 ILE 46 HD11 ILE 46 -1.521 -1.229 3.731
394 HD12 ILE 46 HD12 ILE 46 -1.406 -2.986 3.782
395 HD13 ILE 46 HD13 ILE 46 -1.501 -2.157 2.230
396 H TYR 47 H TYR 47 4.006 -0.257 5.633
397 HA TYR 47 HA TYR 47 5.041 -1.980 7.700
398 HB2 TYR 47 HB2 TYR 47 5.588 0.721 6.695
399 HB3 TYR 47 HB3 TYR 47 5.819 0.536 8.439
400 HD1 TYR 47 HD1 TYR 47 7.391 0.422 5.361
401 HD2 TYR 47 HD2 TYR 47 7.181 -1.726 9.019
402 HE1 TYR 47 HE1 TYR 47 9.612 -0.547 4.918
403 HE2 TYR 47 HE2 TYR 47 9.400 -2.697 8.580
404 HH TYR 47 HH TYR 47 10.857 -3.164 6.611
405 H ASN 48 H ASN 48 2.487 0.222 7.230
406 HA ASN 48 HA ASN 48 1.779 0.513 9.995
407 HB2 ASN 48 HB2 ASN 48 0.026 0.715 7.494
408 HB3 ASN 48 HB3 ASN 48 -0.497 1.137 9.114
409 HD21 ASN 48 HD21 ASN 48 0.247 3.054 10.040
410 HD22 ASN 48 HD22 ASN 48 1.042 4.278 9.133
411 H VAL 49 H VAL 49 0.508 -0.888 11.171
412 HA VAL 49 HA VAL 49 0.896 -3.549 10.282
413 HB VAL 49 HB VAL 49 -0.349 -2.601 12.874
414 HG11 VAL 49 HG11 VAL 49 0.165 -4.830 13.708
415 HG12 VAL 49 HG12 VAL 49 0.781 -5.292 12.121
416 HG13 VAL 49 HG13 VAL 49 -0.931 -4.924 12.330
417 HG21 VAL 49 HG21 VAL 49 2.459 -3.426 12.190
418 HG22 VAL 49 HG22 VAL 49 1.872 -3.081 13.815
419 HG23 VAL 49 HG23 VAL 49 1.917 -1.801 12.599
420 H ARG 50 H ARG 50 -0.369 -3.973 8.611
421 HA ARG 50 HA ARG 50 -3.248 -4.217 9.158
422 HB2 ARG 50 HB2 ARG 50 -1.858 -3.307 6.845
423 HB3 ARG 50 HB3 ARG 50 -2.573 -4.850 6.415
424 HG2 ARG 50 HG2 ARG 50 -4.393 -2.988 7.812
425 HG3 ARG 50 HG3 ARG 50 -3.844 -2.453 6.231
426 HD2 ARG 50 HD2 ARG 50 -5.996 -3.739 6.179
427 HD3 ARG 50 HD3 ARG 50 -4.722 -4.434 5.182
428 HE ARG 50 HE ARG 50 -4.362 -5.857 7.338
429 HH11 ARG 50 HH11 ARG 50 -7.526 -5.047 5.941
430 HH12 ARG 50 HH12 ARG 50 -8.232 -6.498 6.508
431 HH21 ARG 50 HH21 ARG 50 -5.343 -7.716 8.114
432 HH22 ARG 50 HH22 ARG 50 -6.980 -8.031 7.807
433 H GLY 51 H GLY 51 -0.583 -5.918 9.495
434 HA2 GLY 51 HA2 GLY 51 -2.003 -8.446 9.030
435 HA3 GLY 51 HA3 GLY 51 -0.279 -8.283 8.682
436 H LYS 52 H LYS 52 -0.027 -10.033 10.270
437 HA LYS 52 HA LYS 52 0.352 -8.825 12.890
438 HB2 LYS 52 HB2 LYS 52 -0.663 -11.653 12.449
439 HB3 LYS 52 HB3 LYS 52 -0.322 -10.905 13.993
440 HG2 LYS 52 HG2 LYS 52 -2.198 -9.412 13.722
441 HG3 LYS 52 HG3 LYS 52 -2.503 -10.041 12.102
442 HD2 LYS 52 HD2 LYS 52 -2.718 -12.311 13.183
443 HD3 LYS 52 HD3 LYS 52 -2.751 -11.469 14.731
444 HE2 LYS 52 HE2 LYS 52 -4.702 -10.191 13.963
445 HE3 LYS 52 HE3 LYS 52 -4.669 -11.080 12.441
446 HZ1 LYS 52 HZ1 LYS 52 -4.939 -13.149 13.797
447 HZ2 LYS 52 HZ2 LYS 52 -6.259 -12.105 13.863
448 HZ3 LYS 52 HZ3 LYS 52 -5.184 -12.173 15.145
Start of MODEL 18
1 H1 SER 0 H1 SER 0 -0.642 -10.852 -0.043
2 H2 SER 0 H2 SER 0 -1.918 -11.512 -0.922
3 H3 SER 0 H3 SER 0 -1.592 -12.107 0.624
4 HA SER 0 HA SER 0 -3.434 -10.824 0.855
5 HB2 SER 0 HB2 SER 0 -1.075 -9.024 1.457
6 HB3 SER 0 HB3 SER 0 -2.685 -8.845 2.135
7 HG SER 0 HG SER 0 -0.881 -11.027 2.557
8 H MET 1 H MET 1 -4.216 -8.352 0.661
9 HA MET 1 HA MET 1 -4.891 -7.942 -2.014
10 HB2 MET 1 HB2 MET 1 -4.922 -5.663 -0.075
11 HB3 MET 1 HB3 MET 1 -6.040 -6.027 -1.372
12 HG2 MET 1 HG2 MET 1 -6.914 -7.909 -0.046
13 HG3 MET 1 HG3 MET 1 -5.740 -7.478 1.212
14 HE1 MET 1 HE1 MET 1 -9.116 -4.552 -0.014
15 HE2 MET 1 HE2 MET 1 -8.707 -5.989 -0.949
16 HE3 MET 1 HE3 MET 1 -7.574 -4.639 -0.860
17 H ASN 2 H ASN 2 -4.419 -6.348 -3.459
18 HA ASN 2 HA ASN 2 -1.793 -5.130 -3.291
19 HB2 ASN 2 HB2 ASN 2 -3.791 -5.528 -5.512
20 HB3 ASN 2 HB3 ASN 2 -2.518 -4.327 -5.659
21 HD21 ASN 2 HD21 ASN 2 -0.388 -5.635 -4.515
22 HD22 ASN 2 HD22 ASN 2 -0.033 -7.057 -5.432
23 H ARG 3 H ARG 3 -1.554 -2.902 -3.526
24 HA ARG 3 HA ARG 3 -3.965 -1.314 -3.367
25 HB2 ARG 3 HB2 ARG 3 -2.512 -1.803 -1.096
26 HB3 ARG 3 HB3 ARG 3 -1.790 -0.308 -1.676
27 HG2 ARG 3 HG2 ARG 3 -3.496 0.438 -0.299
28 HG3 ARG 3 HG3 ARG 3 -4.206 0.513 -1.921
29 HD2 ARG 3 HD2 ARG 3 -4.841 -2.013 -1.267
30 HD3 ARG 3 HD3 ARG 3 -4.814 -1.299 0.338
31 HE ARG 3 HE ARG 3 -6.473 0.316 -0.488
32 HH11 ARG 3 HH11 ARG 3 -6.070 -2.716 -2.385
33 HH12 ARG 3 HH12 ARG 3 -7.698 -2.795 -2.833
34 HH21 ARG 3 HH21 ARG 3 -8.716 0.158 -1.121
35 HH22 ARG 3 HH22 ARG 3 -9.252 -1.123 -2.106
36 H LEU 4 H LEU 4 -3.535 0.919 -3.954
37 HA LEU 4 HA LEU 4 -1.148 1.225 -5.630
38 HB2 LEU 4 HB2 LEU 4 -3.968 2.191 -6.100
39 HB3 LEU 4 HB3 LEU 4 -2.583 2.586 -7.084
40 HG LEU 4 HG LEU 4 -3.764 -0.179 -6.761
41 HD11 LEU 4 HD11 LEU 4 -3.918 1.747 -9.070
42 HD12 LEU 4 HD12 LEU 4 -5.247 1.302 -7.994
43 HD13 LEU 4 HD13 LEU 4 -4.530 0.094 -9.059
44 HD21 LEU 4 HD21 LEU 4 -2.301 -0.694 -8.722
45 HD22 LEU 4 HD22 LEU 4 -1.445 -0.379 -7.220
46 HD23 LEU 4 HD23 LEU 4 -1.512 0.866 -8.470
47 H GLY 5 H GLY 5 -0.035 3.038 -5.152
48 HA2 GLY 5 HA2 GLY 5 -1.451 5.318 -4.075
49 HA3 GLY 5 HA3 GLY 5 -0.278 4.576 -2.982
50 H ILE 6 H ILE 6 -0.264 7.146 -3.960
51 HA ILE 6 HA ILE 6 1.828 7.221 -6.000
52 HB ILE 6 HB ILE 6 0.351 9.502 -4.660
53 HG12 ILE 6 HG12 ILE 6 -0.149 8.375 -7.417
54 HG13 ILE 6 HG13 ILE 6 -1.112 7.937 -6.010
55 HG21 ILE 6 HG21 ILE 6 2.480 10.185 -5.579
56 HG22 ILE 6 HG22 ILE 6 1.179 10.799 -6.605
57 HG23 ILE 6 HG23 ILE 6 2.108 9.391 -7.107
58 HD11 ILE 6 HD11 ILE 6 -1.815 10.253 -5.767
59 HD12 ILE 6 HD12 ILE 6 -2.192 9.643 -7.380
60 HD13 ILE 6 HD13 ILE 6 -0.808 10.709 -7.142
61 H ILE 7 H ILE 7 3.849 7.538 -5.484
62 HA ILE 7 HA ILE 7 4.638 7.626 -2.762
63 HB ILE 7 HB ILE 7 6.288 8.242 -5.222
64 HG12 ILE 7 HG12 ILE 7 5.293 5.995 -5.221
65 HG13 ILE 7 HG13 ILE 7 7.049 5.957 -5.099
66 HG21 ILE 7 HG21 ILE 7 8.234 7.863 -3.826
67 HG22 ILE 7 HG22 ILE 7 7.205 7.471 -2.449
68 HG23 ILE 7 HG23 ILE 7 7.229 9.115 -3.089
69 HD11 ILE 7 HD11 ILE 7 5.776 4.335 -3.619
70 HD12 ILE 7 HD12 ILE 7 5.264 5.734 -2.682
71 HD13 ILE 7 HD13 ILE 7 6.977 5.346 -2.829
72 H TYR 8 H TYR 8 4.240 9.204 -1.598
73 HA TYR 8 HA TYR 8 4.005 11.905 -2.585
74 HB2 TYR 8 HB2 TYR 8 2.397 10.783 -0.991
75 HB3 TYR 8 HB3 TYR 8 3.675 10.827 0.211
76 HD1 TYR 8 HD1 TYR 8 1.316 12.820 -1.737
77 HD2 TYR 8 HD2 TYR 8 4.250 12.882 1.329
78 HE1 TYR 8 HE1 TYR 8 0.569 15.076 -1.071
79 HE2 TYR 8 HE2 TYR 8 3.518 15.128 2.004
80 HH TYR 8 HH TYR 8 2.367 17.070 0.884
81 H GLU 9 H GLU 9 6.100 9.892 -0.625
82 HA GLU 9 HA GLU 9 8.237 11.801 -0.587
83 HB2 GLU 9 HB2 GLU 9 6.591 12.590 1.167
84 HB3 GLU 9 HB3 GLU 9 6.830 11.070 1.996
85 HG2 GLU 9 HG2 GLU 9 9.215 11.673 2.276
86 HG3 GLU 9 HG3 GLU 9 8.848 13.248 1.563
87 H ILE 10 H ILE 10 10.182 10.724 0.239
88 HA ILE 10 HA ILE 10 9.892 7.831 0.676
89 HB ILE 10 HB ILE 10 12.063 9.407 -0.743
90 HG12 ILE 10 HG12 ILE 10 10.067 8.772 -2.076
91 HG13 ILE 10 HG13 ILE 10 11.564 8.082 -2.690
92 HG21 ILE 10 HG21 ILE 10 12.185 6.477 -0.066
93 HG22 ILE 10 HG22 ILE 10 13.144 7.747 0.684
94 HG23 ILE 10 HG23 ILE 10 13.362 7.374 -1.028
95 HD11 ILE 10 HD11 ILE 10 10.971 5.944 -1.646
96 HD12 ILE 10 HD12 ILE 10 9.760 6.490 -2.806
97 HD13 ILE 10 HD13 ILE 10 9.458 6.654 -1.078
98 H GLN 11 H GLN 11 11.102 6.944 2.358
99 HA GLN 11 HA GLN 11 12.828 8.737 3.901
100 HB2 GLN 11 HB2 GLN 11 10.434 7.294 4.827
101 HB3 GLN 11 HB3 GLN 11 11.859 7.048 5.824
102 HG2 GLN 11 HG2 GLN 11 11.201 8.890 6.874
103 HG3 GLN 11 HG3 GLN 11 11.848 9.756 5.490
104 HE21 GLN 11 HE21 GLN 11 10.450 10.572 3.967
105 HE22 GLN 11 HE22 GLN 11 8.764 10.770 4.293
106 H GLY 12 H GLY 12 14.398 7.579 2.524
107 HA2 GLY 12 HA2 GLY 12 16.120 6.098 2.395
108 HA3 GLY 12 HA3 GLY 12 15.608 5.461 3.955
109 H MET 13 H MET 13 14.595 3.574 4.035
110 HA MET 13 HA MET 13 13.888 2.376 1.472
111 HB2 MET 13 HB2 MET 13 14.620 1.034 4.076
112 HB3 MET 13 HB3 MET 13 14.005 0.173 2.674
113 HG2 MET 13 HG2 MET 13 15.977 1.294 1.428
114 HG3 MET 13 HG3 MET 13 16.633 1.542 3.042
115 HE1 MET 13 HE1 MET 13 15.944 -2.489 0.926
116 HE2 MET 13 HE2 MET 13 16.015 -0.919 0.138
117 HE3 MET 13 HE3 MET 13 14.646 -1.318 1.177
118 H LYS 14 H LYS 14 12.356 4.150 3.416
119 HA LYS 14 HA LYS 14 9.903 2.511 3.449
120 HB2 LYS 14 HB2 LYS 14 10.330 5.106 4.942
121 HB3 LYS 14 HB3 LYS 14 9.002 3.986 5.110
122 HG2 LYS 14 HG2 LYS 14 10.687 2.332 6.023
123 HG3 LYS 14 HG3 LYS 14 11.813 3.692 6.088
124 HD2 LYS 14 HD2 LYS 14 10.177 4.942 7.454
125 HD3 LYS 14 HD3 LYS 14 9.127 3.524 7.439
126 HE2 LYS 14 HE2 LYS 14 10.219 3.298 9.455
127 HE3 LYS 14 HE3 LYS 14 11.192 2.296 8.378
128 HZ1 LYS 14 HZ1 LYS 14 12.492 3.711 9.838
129 HZ2 LYS 14 HZ2 LYS 14 11.837 5.090 9.145
130 HZ3 LYS 14 HZ3 LYS 14 12.822 4.054 8.226
131 H ALA 15 H ALA 15 8.044 3.581 2.623
132 HA ALA 15 HA ALA 15 8.559 6.086 1.224
133 HB1 ALA 15 HB1 ALA 15 7.195 3.702 -0.026
134 HB2 ALA 15 HB2 ALA 15 8.817 4.287 -0.415
135 HB3 ALA 15 HB3 ALA 15 7.413 5.297 -0.750
136 H VAL 16 H VAL 16 6.892 7.439 1.200
137 HA VAL 16 HA VAL 16 4.525 6.702 2.747
138 HB VAL 16 HB VAL 16 5.399 9.435 1.730
139 HG11 VAL 16 HG11 VAL 16 3.690 10.342 3.229
140 HG12 VAL 16 HG12 VAL 16 3.223 8.704 3.687
141 HG13 VAL 16 HG13 VAL 16 2.977 9.259 2.031
142 HG21 VAL 16 HG21 VAL 16 5.959 9.958 4.035
143 HG22 VAL 16 HG22 VAL 16 6.931 8.597 3.455
144 HG23 VAL 16 HG23 VAL 16 5.542 8.316 4.518
145 H VAL 17 H VAL 17 2.957 5.954 1.565
146 HA VAL 17 HA VAL 17 2.671 6.919 -1.185
147 HB VAL 17 HB VAL 17 0.992 4.934 -1.302
148 HG11 VAL 17 HG11 VAL 17 3.982 4.566 -1.266
149 HG12 VAL 17 HG12 VAL 17 2.961 4.994 -2.636
150 HG13 VAL 17 HG13 VAL 17 2.836 3.396 -1.911
151 HG21 VAL 17 HG21 VAL 17 1.533 3.033 0.194
152 HG22 VAL 17 HG22 VAL 17 1.055 4.460 1.105
153 HG23 VAL 17 HG23 VAL 17 2.753 4.040 0.970
154 H LEU 18 H LEU 18 1.087 8.189 -1.645
155 HA LEU 18 HA LEU 18 -1.159 8.434 0.183
156 HB2 LEU 18 HB2 LEU 18 -0.148 10.508 -0.656
157 HB3 LEU 18 HB3 LEU 18 -0.308 9.951 -2.303
158 HG LEU 18 HG LEU 18 -2.784 10.055 -2.054
159 HD11 LEU 18 HD11 LEU 18 -3.695 11.349 -0.162
160 HD12 LEU 18 HD12 LEU 18 -2.109 11.288 0.607
161 HD13 LEU 18 HD13 LEU 18 -3.010 9.799 0.313
162 HD21 LEU 18 HD21 LEU 18 -1.557 11.895 -3.078
163 HD22 LEU 18 HD22 LEU 18 -1.308 12.627 -1.492
164 HD23 LEU 18 HD23 LEU 18 -2.934 12.495 -2.158
165 H THR 19 H THR 19 -2.449 6.775 -0.152
166 HA THR 19 HA THR 19 -2.434 5.198 -2.466
167 HB THR 19 HB THR 19 -4.476 4.122 -1.463
168 HG1 THR 19 HG1 THR 19 -4.730 4.841 0.831
169 HG21 THR 19 HG21 THR 19 -2.051 4.499 0.297
170 HG22 THR 19 HG22 THR 19 -2.234 3.301 -0.986
171 HG23 THR 19 HG23 THR 19 -3.235 3.200 0.465
172 H SER 20 H SER 20 -4.452 4.637 -3.731
173 HA SER 20 HA SER 20 -5.477 6.881 -5.040
174 HB2 SER 20 HB2 SER 20 -7.024 5.017 -5.932
175 HB3 SER 20 HB3 SER 20 -5.288 4.906 -6.268
176 HG SER 20 HG SER 20 -6.766 3.116 -5.104
177 H GLU 21 H GLU 21 -6.273 5.376 -2.155
178 HA GLU 21 HA GLU 21 -9.045 6.210 -2.027
179 HB2 GLU 21 HB2 GLU 21 -7.339 4.883 0.088
180 HB3 GLU 21 HB3 GLU 21 -9.094 4.981 0.050
181 HG2 GLU 21 HG2 GLU 21 -9.176 3.529 -1.892
182 HG3 GLU 21 HG3 GLU 21 -7.417 3.494 -1.971
183 H GLY 22 H GLY 22 -6.083 7.644 -1.661
184 HA2 GLY 22 HA2 GLY 22 -5.604 9.771 -1.015
185 HA3 GLY 22 HA3 GLY 22 -7.221 9.913 -0.356
186 H GLU 23 H GLU 23 -5.016 7.351 0.632
187 HA GLU 23 HA GLU 23 -4.806 8.725 3.222
188 HB2 GLU 23 HB2 GLU 23 -4.820 5.777 2.638
189 HB3 GLU 23 HB3 GLU 23 -4.651 6.499 4.229
190 HG2 GLU 23 HG2 GLU 23 -6.901 7.525 3.907
191 HG3 GLU 23 HG3 GLU 23 -7.044 6.574 2.426
192 H PHE 24 H PHE 24 -2.806 8.615 4.290
193 HA PHE 24 HA PHE 24 -0.532 8.006 2.531
194 HB2 PHE 24 HB2 PHE 24 -0.476 9.440 5.217
195 HB3 PHE 24 HB3 PHE 24 0.838 9.263 4.073
196 HD1 PHE 24 HD1 PHE 24 1.187 10.796 2.359
197 HD2 PHE 24 HD2 PHE 24 -2.446 10.878 4.576
198 HE1 PHE 24 HE1 PHE 24 0.604 12.947 1.334
199 HE2 PHE 24 HE2 PHE 24 -3.028 13.032 3.551
200 HZ PHE 24 HZ PHE 24 -1.502 14.062 1.929
201 H LEU 25 H LEU 25 0.364 6.164 2.770
202 HA LEU 25 HA LEU 25 0.339 4.889 5.414
203 HB2 LEU 25 HB2 LEU 25 -0.021 3.666 2.687
204 HB3 LEU 25 HB3 LEU 25 0.593 2.720 4.018
205 HG LEU 25 HG LEU 25 -1.558 3.411 5.257
206 HD11 LEU 25 HD11 LEU 25 -2.249 5.169 3.731
207 HD12 LEU 25 HD12 LEU 25 -3.469 3.905 3.870
208 HD13 LEU 25 HD13 LEU 25 -2.437 3.980 2.442
209 HD21 LEU 25 HD21 LEU 25 -1.604 1.561 2.888
210 HD22 LEU 25 HD22 LEU 25 -2.823 1.604 4.158
211 HD23 LEU 25 HD23 LEU 25 -1.155 1.172 4.552
212 H ILE 26 H ILE 26 2.207 3.824 6.033
213 HA ILE 26 HA ILE 26 4.608 4.610 4.575
214 HB ILE 26 HB ILE 26 4.350 3.295 7.303
215 HG12 ILE 26 HG12 ILE 26 3.345 5.523 7.355
216 HG13 ILE 26 HG13 ILE 26 4.851 5.503 8.265
217 HG21 ILE 26 HG21 ILE 26 6.506 2.882 6.250
218 HG22 ILE 26 HG22 ILE 26 6.675 3.941 7.647
219 HG23 ILE 26 HG23 ILE 26 6.738 4.616 6.016
220 HD11 ILE 26 HD11 ILE 26 5.970 6.560 6.328
221 HD12 ILE 26 HD12 ILE 26 4.678 7.539 7.017
222 HD13 ILE 26 HD13 ILE 26 4.404 6.649 5.519
223 H ILE 27 H ILE 27 5.366 3.193 3.186
224 HA ILE 27 HA ILE 27 4.916 0.343 3.743
225 HB ILE 27 HB ILE 27 4.804 -0.123 1.362
226 HG12 ILE 27 HG12 ILE 27 4.957 2.848 0.831
227 HG13 ILE 27 HG13 ILE 27 6.350 1.782 0.727
228 HG21 ILE 27 HG21 ILE 27 2.665 0.453 2.432
229 HG22 ILE 27 HG22 ILE 27 2.713 1.007 0.768
230 HG23 ILE 27 HG23 ILE 27 2.966 2.148 2.079
231 HD11 ILE 27 HD11 ILE 27 5.370 2.235 -1.447
232 HD12 ILE 27 HD12 ILE 27 3.838 1.544 -0.907
233 HD13 ILE 27 HD13 ILE 27 5.268 0.520 -1.044
234 H ARG 28 H ARG 28 6.479 -1.062 2.791
235 HA ARG 28 HA ARG 28 9.165 -0.200 3.126
236 HB2 ARG 28 HB2 ARG 28 7.884 -2.735 2.113
237 HB3 ARG 28 HB3 ARG 28 9.635 -2.543 2.191
238 HG2 ARG 28 HG2 ARG 28 9.362 -2.072 4.654
239 HG3 ARG 28 HG3 ARG 28 7.672 -2.541 4.477
240 HD2 ARG 28 HD2 ARG 28 9.986 -4.310 3.726
241 HD3 ARG 28 HD3 ARG 28 9.202 -4.344 5.305
242 HE ARG 28 HE ARG 28 7.143 -4.669 3.665
243 HH11 ARG 28 HH11 ARG 28 10.285 -6.335 3.778
244 HH12 ARG 28 HH12 ARG 28 9.667 -7.804 3.155
245 HH21 ARG 28 HH21 ARG 28 6.341 -6.736 2.824
246 HH22 ARG 28 HH22 ARG 28 7.429 -8.010 2.574
247 H ARG 29 H ARG 29 10.322 0.776 1.675
248 HA ARG 29 HA ARG 29 9.264 1.354 -0.909
249 HB2 ARG 29 HB2 ARG 29 10.588 2.965 0.400
250 HB3 ARG 29 HB3 ARG 29 11.998 1.927 0.222
251 HG2 ARG 29 HG2 ARG 29 11.466 2.165 -2.312
252 HG3 ARG 29 HG3 ARG 29 10.615 3.616 -1.782
253 HD2 ARG 29 HD2 ARG 29 12.721 4.300 -0.627
254 HD3 ARG 29 HD3 ARG 29 13.509 2.930 -1.417
255 HE ARG 29 HE ARG 29 12.244 4.327 -3.415
256 HH11 ARG 29 HH11 ARG 29 14.838 4.987 -1.093
257 HH12 ARG 29 HH12 ARG 29 15.601 6.143 -2.068
258 HH21 ARG 29 HH21 ARG 29 13.228 5.968 -4.727
259 HH22 ARG 29 HH22 ARG 29 14.650 6.727 -4.175
260 H ARG 30 H ARG 30 9.637 0.360 -2.754
261 HA ARG 30 HA ARG 30 11.618 -1.775 -2.898
262 HB2 ARG 30 HB2 ARG 30 9.438 -0.920 -4.813
263 HB3 ARG 30 HB3 ARG 30 10.479 -2.305 -5.064
264 HG2 ARG 30 HG2 ARG 30 9.490 -3.338 -3.027
265 HG3 ARG 30 HG3 ARG 30 8.404 -1.951 -2.899
266 HD2 ARG 30 HD2 ARG 30 7.686 -2.459 -5.273
267 HD3 ARG 30 HD3 ARG 30 8.569 -3.972 -5.116
268 HE ARG 30 HE ARG 30 6.812 -3.839 -2.963
269 HH11 ARG 30 HH11 ARG 30 6.595 -3.971 -6.498
270 HH12 ARG 30 HH12 ARG 30 5.078 -4.734 -6.528
271 HH21 ARG 30 HH21 ARG 30 4.808 -4.921 -2.962
272 HH22 ARG 30 HH22 ARG 30 4.016 -5.379 -4.380
273 H LYS 31 H LYS 31 12.538 -1.712 -5.375
274 HA LYS 31 HA LYS 31 14.302 0.492 -5.326
275 HB2 LYS 31 HB2 LYS 31 13.813 -1.540 -7.500
276 HB3 LYS 31 HB3 LYS 31 15.082 -0.335 -7.572
277 HG2 LYS 31 HG2 LYS 31 14.826 -2.624 -5.624
278 HG3 LYS 31 HG3 LYS 31 16.041 -2.408 -6.877
279 HD2 LYS 31 HD2 LYS 31 15.716 -0.687 -4.402
280 HD3 LYS 31 HD3 LYS 31 16.929 -1.929 -4.650
281 HE2 LYS 31 HE2 LYS 31 17.922 -0.669 -6.472
282 HE3 LYS 31 HE3 LYS 31 16.644 0.540 -6.355
283 HZ1 LYS 31 HZ1 LYS 31 18.671 1.282 -5.265
284 HZ2 LYS 31 HZ2 LYS 31 18.649 -0.047 -4.244
285 HZ3 LYS 31 HZ3 LYS 31 17.425 1.110 -4.146
286 H ASP 32 H ASP 32 11.504 -0.156 -7.345
287 HA ASP 32 HA ASP 32 11.974 2.219 -8.931
288 HB2 ASP 32 HB2 ASP 32 10.964 -0.009 -9.742
289 HB3 ASP 32 HB3 ASP 32 9.465 0.567 -9.035
290 H MET 33 H MET 33 11.205 2.380 -5.963
291 HA MET 33 HA MET 33 8.727 3.858 -6.198
292 HB2 MET 33 HB2 MET 33 10.474 3.039 -3.972
293 HB3 MET 33 HB3 MET 33 9.616 4.552 -3.747
294 HG2 MET 33 HG2 MET 33 8.346 2.787 -2.770
295 HG3 MET 33 HG3 MET 33 7.501 3.375 -4.200
296 HE1 MET 33 HE1 MET 33 5.955 1.108 -4.194
297 HE2 MET 33 HE2 MET 33 6.824 0.669 -2.724
298 HE3 MET 33 HE3 MET 33 6.671 -0.495 -4.040
299 H LYS 34 H LYS 34 8.828 5.658 -7.261
300 HA LYS 34 HA LYS 34 10.975 7.570 -6.772
301 HB2 LYS 34 HB2 LYS 34 9.265 7.017 -9.200
302 HB3 LYS 34 HB3 LYS 34 10.414 8.331 -9.055
303 HG2 LYS 34 HG2 LYS 34 12.229 6.952 -9.323
304 HG3 LYS 34 HG3 LYS 34 11.408 5.569 -8.601
305 HD2 LYS 34 HD2 LYS 34 10.067 5.285 -10.614
306 HD3 LYS 34 HD3 LYS 34 10.805 6.712 -11.335
307 HE2 LYS 34 HE2 LYS 34 12.936 5.636 -11.459
308 HE3 LYS 34 HE3 LYS 34 12.364 4.293 -10.467
309 HZ1 LYS 34 HZ1 LYS 34 10.980 4.830 -12.995
310 HZ2 LYS 34 HZ2 LYS 34 11.274 3.347 -12.213
311 HZ3 LYS 34 HZ3 LYS 34 12.488 4.108 -13.065
312 H VAL 35 H VAL 35 10.259 9.603 -6.227
313 HA VAL 35 HA VAL 35 7.661 9.821 -5.107
314 HB VAL 35 HB VAL 35 9.581 12.102 -5.648
315 HG11 VAL 35 HG11 VAL 35 7.281 12.746 -4.999
316 HG12 VAL 35 HG12 VAL 35 8.483 13.212 -3.793
317 HG13 VAL 35 HG13 VAL 35 7.466 11.804 -3.516
318 HG21 VAL 35 HG21 VAL 35 10.521 11.738 -3.454
319 HG22 VAL 35 HG22 VAL 35 10.681 10.255 -4.399
320 HG23 VAL 35 HG23 VAL 35 9.416 10.395 -3.177
321 H GLY 36 H GLY 36 5.823 10.404 -6.018
322 HA2 GLY 36 HA2 GLY 36 4.680 12.106 -7.309
323 HA3 GLY 36 HA3 GLY 36 5.962 11.968 -8.501
324 H GLN 37 H GLN 37 5.928 8.972 -8.251
325 HA GLN 37 HA GLN 37 3.690 8.687 -10.096
326 HB2 GLN 37 HB2 GLN 37 4.740 6.738 -11.002
327 HB3 GLN 37 HB3 GLN 37 5.952 7.997 -10.871
328 HG2 GLN 37 HG2 GLN 37 6.838 6.924 -8.860
329 HG3 GLN 37 HG3 GLN 37 5.604 5.672 -8.993
330 HE21 GLN 37 HE21 GLN 37 7.103 4.030 -9.234
331 HE22 GLN 37 HE22 GLN 37 8.047 3.800 -10.627
332 H GLN 38 H GLN 38 2.286 6.884 -10.059
333 HA GLN 38 HA GLN 38 1.674 5.989 -7.366
334 HB2 GLN 38 HB2 GLN 38 -0.139 6.789 -8.909
335 HB3 GLN 38 HB3 GLN 38 0.204 5.413 -9.941
336 HG2 GLN 38 HG2 GLN 38 -0.465 3.881 -8.197
337 HG3 GLN 38 HG3 GLN 38 -0.664 5.213 -7.062
338 HE21 GLN 38 HE21 GLN 38 -2.462 6.583 -7.285
339 HE22 GLN 38 HE22 GLN 38 -3.817 6.140 -8.229
340 H VAL 39 H VAL 39 2.189 4.134 -6.592
341 HA VAL 39 HA VAL 39 3.430 2.195 -8.395
342 HB VAL 39 HB VAL 39 4.711 1.396 -6.427
343 HG11 VAL 39 HG11 VAL 39 5.105 4.352 -6.783
344 HG12 VAL 39 HG12 VAL 39 5.595 3.158 -7.988
345 HG13 VAL 39 HG13 VAL 39 6.330 3.147 -6.383
346 HG21 VAL 39 HG21 VAL 39 4.771 2.714 -4.362
347 HG22 VAL 39 HG22 VAL 39 3.143 2.116 -4.677
348 HG23 VAL 39 HG23 VAL 39 3.545 3.795 -5.017
349 H SER 40 H SER 40 3.022 0.013 -8.009
350 HA SER 40 HA SER 40 0.538 -0.544 -6.608
351 HB2 SER 40 HB2 SER 40 1.953 -2.491 -8.370
352 HB3 SER 40 HB3 SER 40 0.218 -2.200 -8.173
353 HG SER 40 HG SER 40 0.837 -0.030 -9.168
354 H PHE 41 H PHE 41 0.668 -1.667 -4.752
355 HA PHE 41 HA PHE 41 2.983 -3.343 -4.247
356 HB2 PHE 41 HB2 PHE 41 3.184 -2.414 -1.926
357 HB3 PHE 41 HB3 PHE 41 3.667 -1.292 -3.179
358 HD1 PHE 41 HD1 PHE 41 2.109 0.604 -3.769
359 HD2 PHE 41 HD2 PHE 41 1.452 -1.911 -0.402
360 HE1 PHE 41 HE1 PHE 41 0.606 2.295 -2.806
361 HE2 PHE 41 HE2 PHE 41 -0.061 -0.227 0.560
362 HZ PHE 41 HZ PHE 41 -0.482 1.872 -0.636
363 H GLU 42 H GLU 42 2.522 -4.389 -1.934
364 HA GLU 42 HA GLU 42 -0.302 -5.203 -1.967
365 HB2 GLU 42 HB2 GLU 42 2.110 -6.801 -1.035
366 HB3 GLU 42 HB3 GLU 42 0.417 -7.259 -0.894
367 HG2 GLU 42 HG2 GLU 42 1.093 -8.478 -2.664
368 HG3 GLU 42 HG3 GLU 42 0.378 -7.072 -3.457
369 H ASN 43 H ASN 43 -1.067 -5.869 0.124
370 HA ASN 43 HA ASN 43 -0.602 -3.937 2.103
371 HB2 ASN 43 HB2 ASN 43 -2.176 -6.507 2.072
372 HB3 ASN 43 HB3 ASN 43 -1.905 -5.682 3.611
373 HD21 ASN 43 HD21 ASN 43 -2.977 -3.752 3.991
374 HD22 ASN 43 HD22 ASN 43 -4.175 -3.170 2.883
375 H GLU 44 H GLU 44 1.043 -6.767 1.352
376 HA GLU 44 HA GLU 44 2.337 -7.241 3.852
377 HB2 GLU 44 HB2 GLU 44 3.055 -8.116 1.055
378 HB3 GLU 44 HB3 GLU 44 3.727 -8.760 2.551
379 HG2 GLU 44 HG2 GLU 44 1.686 -9.710 3.182
380 HG3 GLU 44 HG3 GLU 44 0.812 -8.795 1.968
381 H ASP 45 H ASP 45 2.791 -4.982 1.268
382 HA ASP 45 HA ASP 45 5.616 -4.589 1.788
383 HB2 ASP 45 HB2 ASP 45 3.653 -2.958 0.160
384 HB3 ASP 45 HB3 ASP 45 5.334 -2.541 0.363
385 H ILE 46 H ILE 46 2.597 -3.534 2.936
386 HA ILE 46 HA ILE 46 3.410 -0.976 3.795
387 HB ILE 46 HB ILE 46 1.115 -2.554 5.008
388 HG12 ILE 46 HG12 ILE 46 1.067 -0.880 2.482
389 HG13 ILE 46 HG13 ILE 46 0.998 -2.638 2.526
390 HG21 ILE 46 HG21 ILE 46 0.171 -0.421 5.505
391 HG22 ILE 46 HG22 ILE 46 1.307 0.403 4.451
392 HG23 ILE 46 HG23 ILE 46 1.870 -0.277 5.968
393 HD11 ILE 46 HD11 ILE 46 -1.045 -0.744 3.669
394 HD12 ILE 46 HD12 ILE 46 -1.130 -2.502 3.727
395 HD13 ILE 46 HD13 ILE 46 -1.193 -1.666 2.174
396 H TYR 47 H TYR 47 4.142 -0.309 5.690
397 HA TYR 47 HA TYR 47 5.650 -2.143 7.329
398 HB2 TYR 47 HB2 TYR 47 5.504 0.707 6.847
399 HB3 TYR 47 HB3 TYR 47 5.606 0.369 8.575
400 HD1 TYR 47 HD1 TYR 47 7.359 0.743 5.509
401 HD2 TYR 47 HD2 TYR 47 7.578 -1.127 9.319
402 HE1 TYR 47 HE1 TYR 47 9.789 0.536 5.260
403 HE2 TYR 47 HE2 TYR 47 10.015 -1.341 9.078
404 HH TYR 47 HH TYR 47 11.663 -1.409 7.285
405 H ASN 48 H ASN 48 2.519 -1.348 7.263
406 HA ASN 48 HA ASN 48 2.120 -1.453 10.159
407 HB2 ASN 48 HB2 ASN 48 0.343 -0.279 8.002
408 HB3 ASN 48 HB3 ASN 48 -0.120 -0.437 9.687
409 HD21 ASN 48 HD21 ASN 48 -0.357 1.682 10.008
410 HD22 ASN 48 HD22 ASN 48 0.926 2.851 9.985
411 H VAL 49 H VAL 49 1.691 -3.409 10.681
412 HA VAL 49 HA VAL 49 -0.108 -5.075 9.047
413 HB VAL 49 HB VAL 49 2.355 -6.132 10.508
414 HG11 VAL 49 HG11 VAL 49 2.044 -8.158 9.176
415 HG12 VAL 49 HG12 VAL 49 0.619 -7.445 8.424
416 HG13 VAL 49 HG13 VAL 49 0.620 -7.796 10.154
417 HG21 VAL 49 HG21 VAL 49 3.152 -4.696 8.713
418 HG22 VAL 49 HG22 VAL 49 2.126 -5.545 7.557
419 HG23 VAL 49 HG23 VAL 49 3.468 -6.391 8.331
420 H ARG 50 H ARG 50 -1.172 -6.740 10.434
421 HA ARG 50 HA ARG 50 -1.426 -5.788 13.167
422 HB2 ARG 50 HB2 ARG 50 -3.163 -7.601 11.492
423 HB3 ARG 50 HB3 ARG 50 -3.376 -7.451 13.230
424 HG2 ARG 50 HG2 ARG 50 -3.584 -5.203 11.231
425 HG3 ARG 50 HG3 ARG 50 -4.936 -6.022 12.015
426 HD2 ARG 50 HD2 ARG 50 -4.007 -5.294 14.218
427 HD3 ARG 50 HD3 ARG 50 -2.801 -4.356 13.353
428 HE ARG 50 HE ARG 50 -5.301 -3.629 12.391
429 HH11 ARG 50 HH11 ARG 50 -3.452 -3.375 15.442
430 HH12 ARG 50 HH12 ARG 50 -4.197 -1.933 15.917
431 HH21 ARG 50 HH21 ARG 50 -6.301 -1.604 13.116
432 HH22 ARG 50 HH22 ARG 50 -5.838 -0.917 14.594
433 H GLY 51 H GLY 51 0.465 -6.544 13.998
434 HA2 GLY 51 HA2 GLY 51 0.453 -9.006 15.242
435 HA3 GLY 51 HA3 GLY 51 1.390 -9.192 13.763
436 H LYS 52 H LYS 52 3.470 -9.235 14.406
437 HA LYS 52 HA LYS 52 4.580 -6.823 15.389
438 HB2 LYS 52 HB2 LYS 52 5.829 -7.941 17.285
439 HB3 LYS 52 HB3 LYS 52 4.116 -7.710 17.562
440 HG2 LYS 52 HG2 LYS 52 3.744 -10.090 17.024
441 HG3 LYS 52 HG3 LYS 52 5.487 -10.293 16.831
442 HD2 LYS 52 HD2 LYS 52 5.780 -9.480 19.160
443 HD3 LYS 52 HD3 LYS 52 4.028 -9.450 19.333
444 HE2 LYS 52 HE2 LYS 52 4.932 -11.477 20.304
445 HE3 LYS 52 HE3 LYS 52 3.966 -11.873 18.888
446 HZ1 LYS 52 HZ1 LYS 52 6.092 -13.086 19.036
447 HZ2 LYS 52 HZ2 LYS 52 6.939 -11.663 18.891
448 HZ3 LYS 52 HZ3 LYS 52 5.966 -12.206 17.619
Start of MODEL 19
1 H1 SER 0 H1 SER 0 0.026 -9.957 -2.027
2 H2 SER 0 H2 SER 0 -0.130 -11.544 -2.572
3 H3 SER 0 H3 SER 0 0.688 -11.186 -1.109
4 HA SER 0 HA SER 0 -1.661 -12.040 -0.887
5 HB2 SER 0 HB2 SER 0 -0.363 -10.913 0.917
6 HB3 SER 0 HB3 SER 0 -0.910 -9.355 0.315
7 HG SER 0 HG SER 0 -2.265 -11.290 1.792
8 H MET 1 H MET 1 -1.388 -8.553 -1.686
9 HA MET 1 HA MET 1 -3.341 -8.442 -3.591
10 HB2 MET 1 HB2 MET 1 -4.974 -7.006 -2.263
11 HB3 MET 1 HB3 MET 1 -5.174 -8.758 -2.145
12 HG2 MET 1 HG2 MET 1 -3.985 -8.619 0.053
13 HG3 MET 1 HG3 MET 1 -3.961 -6.865 -0.126
14 HE1 MET 1 HE1 MET 1 -6.112 -5.339 -0.146
15 HE2 MET 1 HE2 MET 1 -7.760 -5.940 0.045
16 HE3 MET 1 HE3 MET 1 -6.867 -6.276 -1.438
17 H ASN 2 H ASN 2 -2.712 -6.834 -4.688
18 HA ASN 2 HA ASN 2 -1.050 -4.794 -3.614
19 HB2 ASN 2 HB2 ASN 2 -2.257 -5.111 -6.361
20 HB3 ASN 2 HB3 ASN 2 -1.230 -3.763 -5.910
21 HD21 ASN 2 HD21 ASN 2 0.981 -4.301 -5.218
22 HD22 ASN 2 HD22 ASN 2 1.731 -5.698 -5.904
23 H ARG 3 H ARG 3 -1.382 -2.698 -3.502
24 HA ARG 3 HA ARG 3 -4.099 -1.597 -3.663
25 HB2 ARG 3 HB2 ARG 3 -3.063 -2.078 -1.283
26 HB3 ARG 3 HB3 ARG 3 -2.055 -0.688 -1.644
27 HG2 ARG 3 HG2 ARG 3 -3.824 0.182 -0.395
28 HG3 ARG 3 HG3 ARG 3 -4.246 0.561 -2.068
29 HD2 ARG 3 HD2 ARG 3 -5.625 -1.496 -2.131
30 HD3 ARG 3 HD3 ARG 3 -5.249 -1.729 -0.422
31 HE ARG 3 HE ARG 3 -6.315 0.613 -0.229
32 HH11 ARG 3 HH11 ARG 3 -7.432 -1.916 -2.488
33 HH12 ARG 3 HH12 ARG 3 -9.050 -1.426 -2.414
34 HH21 ARG 3 HH21 ARG 3 -8.472 1.250 -0.173
35 HH22 ARG 3 HH22 ARG 3 -9.689 0.441 -1.056
36 H LEU 4 H LEU 4 -3.975 0.772 -4.177
37 HA LEU 4 HA LEU 4 -1.497 1.386 -5.639
38 HB2 LEU 4 HB2 LEU 4 -4.287 2.445 -6.024
39 HB3 LEU 4 HB3 LEU 4 -2.877 3.000 -6.891
40 HG LEU 4 HG LEU 4 -4.106 0.260 -7.049
41 HD11 LEU 4 HD11 LEU 4 -4.624 0.959 -9.354
42 HD12 LEU 4 HD12 LEU 4 -3.975 2.554 -8.996
43 HD13 LEU 4 HD13 LEU 4 -5.411 1.979 -8.152
44 HD21 LEU 4 HD21 LEU 4 -1.737 1.414 -8.534
45 HD22 LEU 4 HD22 LEU 4 -2.473 -0.167 -8.811
46 HD23 LEU 4 HD23 LEU 4 -1.661 0.165 -7.291
47 H GLY 5 H GLY 5 -0.379 3.142 -5.177
48 HA2 GLY 5 HA2 GLY 5 -1.607 5.400 -3.932
49 HA3 GLY 5 HA3 GLY 5 -0.418 4.574 -2.915
50 H ILE 6 H ILE 6 -0.274 7.174 -3.879
51 HA ILE 6 HA ILE 6 1.777 7.081 -5.968
52 HB ILE 6 HB ILE 6 0.417 9.465 -4.682
53 HG12 ILE 6 HG12 ILE 6 -0.150 8.344 -7.423
54 HG13 ILE 6 HG13 ILE 6 -1.086 7.890 -6.005
55 HG21 ILE 6 HG21 ILE 6 2.105 9.259 -7.181
56 HG22 ILE 6 HG22 ILE 6 2.598 9.991 -5.652
57 HG23 ILE 6 HG23 ILE 6 1.300 10.718 -6.600
58 HD11 ILE 6 HD11 ILE 6 -2.190 9.612 -7.294
59 HD12 ILE 6 HD12 ILE 6 -0.777 10.662 -7.112
60 HD13 ILE 6 HD13 ILE 6 -1.742 10.213 -5.697
61 H ILE 7 H ILE 7 3.819 7.234 -5.410
62 HA ILE 7 HA ILE 7 4.582 7.383 -2.692
63 HB ILE 7 HB ILE 7 6.347 7.887 -5.095
64 HG12 ILE 7 HG12 ILE 7 5.178 5.717 -5.251
65 HG13 ILE 7 HG13 ILE 7 6.912 5.522 -5.026
66 HG21 ILE 7 HG21 ILE 7 7.032 6.981 -2.289
67 HG22 ILE 7 HG22 ILE 7 7.311 8.594 -2.934
68 HG23 ILE 7 HG23 ILE 7 8.184 7.213 -3.605
69 HD11 ILE 7 HD11 ILE 7 4.874 5.321 -2.832
70 HD12 ILE 7 HD12 ILE 7 6.597 4.947 -2.728
71 HD13 ILE 7 HD13 ILE 7 5.535 3.947 -3.715
72 H TYR 8 H TYR 8 4.378 8.998 -1.545
73 HA TYR 8 HA TYR 8 4.267 11.689 -2.610
74 HB2 TYR 8 HB2 TYR 8 2.574 10.692 -1.017
75 HB3 TYR 8 HB3 TYR 8 3.843 10.725 0.201
76 HD1 TYR 8 HD1 TYR 8 4.376 12.735 1.348
77 HD2 TYR 8 HD2 TYR 8 1.717 12.812 -1.959
78 HE1 TYR 8 HE1 TYR 8 3.750 15.031 1.930
79 HE2 TYR 8 HE2 TYR 8 1.076 15.132 -1.394
80 HH TYR 8 HH TYR 8 1.058 16.556 0.679
81 H GLU 9 H GLU 9 6.282 9.630 -0.607
82 HA GLU 9 HA GLU 9 8.383 11.577 -0.556
83 HB2 GLU 9 HB2 GLU 9 6.754 12.345 1.186
84 HB3 GLU 9 HB3 GLU 9 6.979 10.825 2.018
85 HG2 GLU 9 HG2 GLU 9 9.115 11.398 2.720
86 HG3 GLU 9 HG3 GLU 9 9.284 12.678 1.525
87 H ILE 10 H ILE 10 10.342 10.508 -0.143
88 HA ILE 10 HA ILE 10 10.203 7.655 0.567
89 HB ILE 10 HB ILE 10 12.145 9.192 -1.181
90 HG12 ILE 10 HG12 ILE 10 10.098 8.201 -2.197
91 HG13 ILE 10 HG13 ILE 10 11.594 7.590 -2.897
92 HG21 ILE 10 HG21 ILE 10 13.566 7.188 -1.356
93 HG22 ILE 10 HG22 ILE 10 12.628 6.433 -0.066
94 HG23 ILE 10 HG23 ILE 10 13.565 7.887 0.264
95 HD11 ILE 10 HD11 ILE 10 9.793 6.193 -0.933
96 HD12 ILE 10 HD12 ILE 10 11.335 5.559 -1.513
97 HD13 ILE 10 HD13 ILE 10 10.006 5.813 -2.642
98 H GLN 11 H GLN 11 11.234 6.985 2.351
99 HA GLN 11 HA GLN 11 13.149 8.772 3.624
100 HB2 GLN 11 HB2 GLN 11 10.596 7.764 4.759
101 HB3 GLN 11 HB3 GLN 11 11.990 7.917 5.826
102 HG2 GLN 11 HG2 GLN 11 12.069 10.173 5.634
103 HG3 GLN 11 HG3 GLN 11 11.277 10.175 4.059
104 HE21 GLN 11 HE21 GLN 11 9.091 10.060 3.963
105 HE22 GLN 11 HE22 GLN 11 8.071 10.419 5.294
106 H GLY 12 H GLY 12 14.750 7.443 2.979
107 HA2 GLY 12 HA2 GLY 12 16.309 5.816 3.334
108 HA3 GLY 12 HA3 GLY 12 15.379 5.322 4.742
109 H MET 13 H MET 13 14.302 3.535 4.659
110 HA MET 13 HA MET 13 14.049 2.212 2.064
111 HB2 MET 13 HB2 MET 13 14.178 0.975 4.822
112 HB3 MET 13 HB3 MET 13 13.955 0.078 3.327
113 HG2 MET 13 HG2 MET 13 16.341 1.836 3.539
114 HG3 MET 13 HG3 MET 13 16.331 0.359 4.490
115 HE1 MET 13 HE1 MET 13 14.901 0.960 0.681
116 HE2 MET 13 HE2 MET 13 16.436 0.643 -0.128
117 HE3 MET 13 HE3 MET 13 16.294 1.991 1.000
118 H LYS 14 H LYS 14 12.269 4.135 3.776
119 HA LYS 14 HA LYS 14 9.831 2.516 3.530
120 HB2 LYS 14 HB2 LYS 14 10.234 5.043 5.116
121 HB3 LYS 14 HB3 LYS 14 8.791 4.061 5.060
122 HG2 LYS 14 HG2 LYS 14 10.026 2.224 6.138
123 HG3 LYS 14 HG3 LYS 14 11.432 3.289 6.261
124 HD2 LYS 14 HD2 LYS 14 10.125 4.876 7.564
125 HD3 LYS 14 HD3 LYS 14 8.717 3.829 7.419
126 HE2 LYS 14 HE2 LYS 14 9.816 2.087 8.670
127 HE3 LYS 14 HE3 LYS 14 11.306 3.029 8.725
128 HZ1 LYS 14 HZ1 LYS 14 9.976 3.149 10.780
129 HZ2 LYS 14 HZ2 LYS 14 8.742 3.909 9.914
130 HZ3 LYS 14 HZ3 LYS 14 10.240 4.663 10.066
131 H ALA 15 H ALA 15 8.053 3.562 2.640
132 HA ALA 15 HA ALA 15 8.560 6.061 1.232
133 HB1 ALA 15 HB1 ALA 15 7.162 3.673 0.046
134 HB2 ALA 15 HB2 ALA 15 8.806 4.166 -0.340
135 HB3 ALA 15 HB3 ALA 15 7.450 5.231 -0.726
136 H VAL 16 H VAL 16 6.906 7.363 1.237
137 HA VAL 16 HA VAL 16 4.517 6.601 2.766
138 HB VAL 16 HB VAL 16 5.313 9.349 1.751
139 HG11 VAL 16 HG11 VAL 16 3.677 10.196 3.358
140 HG12 VAL 16 HG12 VAL 16 3.267 8.545 3.819
141 HG13 VAL 16 HG13 VAL 16 2.922 9.115 2.186
142 HG21 VAL 16 HG21 VAL 16 5.656 8.220 4.521
143 HG22 VAL 16 HG22 VAL 16 6.041 9.860 3.990
144 HG23 VAL 16 HG23 VAL 16 6.959 8.494 3.356
145 H VAL 17 H VAL 17 2.817 5.986 1.629
146 HA VAL 17 HA VAL 17 2.593 6.955 -1.126
147 HB VAL 17 HB VAL 17 0.814 5.061 -1.282
148 HG11 VAL 17 HG11 VAL 17 2.797 5.138 -2.616
149 HG12 VAL 17 HG12 VAL 17 2.511 3.490 -2.047
150 HG13 VAL 17 HG13 VAL 17 3.747 4.486 -1.278
151 HG21 VAL 17 HG21 VAL 17 0.807 4.387 1.024
152 HG22 VAL 17 HG22 VAL 17 2.535 4.040 0.966
153 HG23 VAL 17 HG23 VAL 17 1.407 3.064 0.022
154 H LEU 18 H LEU 18 1.060 8.231 -1.620
155 HA LEU 18 HA LEU 18 -1.153 8.628 0.214
156 HB2 LEU 18 HB2 LEU 18 -0.088 10.607 -0.662
157 HB3 LEU 18 HB3 LEU 18 -0.223 10.025 -2.304
158 HG LEU 18 HG LEU 18 -2.724 10.231 -2.047
159 HD11 LEU 18 HD11 LEU 18 -2.869 10.168 0.358
160 HD12 LEU 18 HD12 LEU 18 -3.534 11.684 -0.248
161 HD13 LEU 18 HD13 LEU 18 -1.929 11.655 0.482
162 HD21 LEU 18 HD21 LEU 18 -2.729 12.644 -2.319
163 HD22 LEU 18 HD22 LEU 18 -1.400 11.903 -3.216
164 HD23 LEU 18 HD23 LEU 18 -1.087 12.728 -1.684
165 H THR 19 H THR 19 -2.549 7.045 -0.028
166 HA THR 19 HA THR 19 -2.655 5.437 -2.353
167 HB THR 19 HB THR 19 -4.504 4.270 -1.156
168 HG1 THR 19 HG1 THR 19 -4.671 4.971 1.097
169 HG21 THR 19 HG21 THR 19 -3.064 3.380 0.597
170 HG22 THR 19 HG22 THR 19 -2.040 4.814 0.510
171 HG23 THR 19 HG23 THR 19 -2.109 3.699 -0.854
172 H SER 20 H SER 20 -4.910 4.779 -3.218
173 HA SER 20 HA SER 20 -6.060 6.949 -4.557
174 HB2 SER 20 HB2 SER 20 -7.742 5.062 -5.136
175 HB3 SER 20 HB3 SER 20 -6.064 4.889 -5.659
176 HG SER 20 HG SER 20 -7.505 3.395 -3.914
177 H GLU 21 H GLU 21 -6.470 5.874 -1.429
178 HA GLU 21 HA GLU 21 -9.202 6.838 -1.139
179 HB2 GLU 21 HB2 GLU 21 -7.328 5.516 0.826
180 HB3 GLU 21 HB3 GLU 21 -8.998 5.952 1.155
181 HG2 GLU 21 HG2 GLU 21 -9.804 4.371 -0.412
182 HG3 GLU 21 HG3 GLU 21 -8.181 4.067 -1.030
183 H GLY 22 H GLY 22 -6.159 8.113 -1.245
184 HA2 GLY 22 HA2 GLY 22 -5.446 10.216 -0.734
185 HA3 GLY 22 HA3 GLY 22 -6.995 10.515 0.042
186 H GLU 23 H GLU 23 -5.221 7.741 1.038
187 HA GLU 23 HA GLU 23 -4.729 9.021 3.625
188 HB2 GLU 23 HB2 GLU 23 -4.905 6.131 2.765
189 HB3 GLU 23 HB3 GLU 23 -4.447 6.649 4.379
190 HG2 GLU 23 HG2 GLU 23 -7.051 7.403 3.113
191 HG3 GLU 23 HG3 GLU 23 -6.832 5.935 4.069
192 H PHE 24 H PHE 24 -2.647 8.897 4.534
193 HA PHE 24 HA PHE 24 -0.556 8.262 2.605
194 HB2 PHE 24 HB2 PHE 24 -0.321 9.726 5.264
195 HB3 PHE 24 HB3 PHE 24 0.959 9.447 4.094
196 HD1 PHE 24 HD1 PHE 24 -2.247 11.222 4.586
197 HD2 PHE 24 HD2 PHE 24 1.343 10.887 2.343
198 HE1 PHE 24 HE1 PHE 24 -2.747 13.365 3.490
199 HE2 PHE 24 HE2 PHE 24 0.851 13.035 1.232
200 HZ PHE 24 HZ PHE 24 -1.199 14.275 1.814
201 H LEU 25 H LEU 25 0.158 6.322 2.755
202 HA LEU 25 HA LEU 25 0.169 4.960 5.370
203 HB2 LEU 25 HB2 LEU 25 -0.332 4.027 2.600
204 HB3 LEU 25 HB3 LEU 25 0.554 2.935 3.647
205 HG LEU 25 HG LEU 25 -1.386 3.005 5.229
206 HD11 LEU 25 HD11 LEU 25 -2.339 5.148 4.572
207 HD12 LEU 25 HD12 LEU 25 -3.527 3.850 4.423
208 HD13 LEU 25 HD13 LEU 25 -2.733 4.490 2.984
209 HD21 LEU 25 HD21 LEU 25 -1.097 1.207 3.619
210 HD22 LEU 25 HD22 LEU 25 -1.996 2.126 2.413
211 HD23 LEU 25 HD23 LEU 25 -2.805 1.562 3.873
212 H ILE 26 H ILE 26 2.032 3.854 5.986
213 HA ILE 26 HA ILE 26 4.444 4.708 4.578
214 HB ILE 26 HB ILE 26 4.176 3.326 7.273
215 HG12 ILE 26 HG12 ILE 26 3.167 5.584 7.317
216 HG13 ILE 26 HG13 ILE 26 4.601 5.483 8.332
217 HG21 ILE 26 HG21 ILE 26 6.506 4.015 7.627
218 HG22 ILE 26 HG22 ILE 26 6.552 4.681 5.997
219 HG23 ILE 26 HG23 ILE 26 6.338 2.945 6.234
220 HD11 ILE 26 HD11 ILE 26 4.331 6.795 5.640
221 HD12 ILE 26 HD12 ILE 26 5.876 6.541 6.452
222 HD13 ILE 26 HD13 ILE 26 4.649 7.567 7.197
223 H ILE 27 H ILE 27 5.328 3.257 3.238
224 HA ILE 27 HA ILE 27 4.825 0.426 3.794
225 HB ILE 27 HB ILE 27 4.702 -0.057 1.406
226 HG12 ILE 27 HG12 ILE 27 4.700 2.925 0.899
227 HG13 ILE 27 HG13 ILE 27 6.113 1.894 0.703
228 HG21 ILE 27 HG21 ILE 27 2.732 2.033 2.301
229 HG22 ILE 27 HG22 ILE 27 2.572 0.281 2.443
230 HG23 ILE 27 HG23 ILE 27 2.533 1.044 0.861
231 HD11 ILE 27 HD11 ILE 27 4.937 0.607 -1.000
232 HD12 ILE 27 HD12 ILE 27 5.036 2.314 -1.427
233 HD13 ILE 27 HD13 ILE 27 3.527 1.643 -0.809
234 H ARG 28 H ARG 28 6.372 -0.954 2.811
235 HA ARG 28 HA ARG 28 9.078 -0.146 3.139
236 HB2 ARG 28 HB2 ARG 28 7.991 -2.578 1.712
237 HB3 ARG 28 HB3 ARG 28 9.650 -2.359 2.243
238 HG2 ARG 28 HG2 ARG 28 8.841 -2.318 4.586
239 HG3 ARG 28 HG3 ARG 28 7.212 -2.648 3.993
240 HD2 ARG 28 HD2 ARG 28 8.303 -4.663 2.801
241 HD3 ARG 28 HD3 ARG 28 9.637 -4.403 3.923
242 HE ARG 28 HE ARG 28 7.282 -4.483 5.395
243 HH11 ARG 28 HH11 ARG 28 9.335 -6.667 3.507
244 HH12 ARG 28 HH12 ARG 28 8.734 -8.082 4.251
245 HH21 ARG 28 HH21 ARG 28 6.478 -6.457 6.410
246 HH22 ARG 28 HH22 ARG 28 7.108 -7.969 5.901
247 H ARG 29 H ARG 29 10.440 0.648 1.711
248 HA ARG 29 HA ARG 29 9.546 1.402 -0.947
249 HB2 ARG 29 HB2 ARG 29 10.859 2.972 0.272
250 HB3 ARG 29 HB3 ARG 29 12.102 1.779 0.604
251 HG2 ARG 29 HG2 ARG 29 12.452 1.711 -1.931
252 HG3 ARG 29 HG3 ARG 29 11.480 3.184 -1.975
253 HD2 ARG 29 HD2 ARG 29 12.991 4.256 -0.444
254 HD3 ARG 29 HD3 ARG 29 13.935 2.770 -0.314
255 HE ARG 29 HE ARG 29 13.855 3.454 -2.995
256 HH11 ARG 29 HH11 ARG 29 15.234 4.757 0.025
257 HH12 ARG 29 HH12 ARG 29 16.446 5.645 -0.759
258 HH21 ARG 29 HH21 ARG 29 15.549 4.611 -4.039
259 HH22 ARG 29 HH22 ARG 29 16.659 5.544 -3.143
260 H ARG 30 H ARG 30 10.051 0.626 -2.722
261 HA ARG 30 HA ARG 30 11.663 -1.830 -2.842
262 HB2 ARG 30 HB2 ARG 30 9.389 -0.900 -4.627
263 HB3 ARG 30 HB3 ARG 30 10.389 -2.294 -4.959
264 HG2 ARG 30 HG2 ARG 30 9.575 -3.388 -2.924
265 HG3 ARG 30 HG3 ARG 30 8.565 -1.981 -2.570
266 HD2 ARG 30 HD2 ARG 30 7.353 -2.314 -4.666
267 HD3 ARG 30 HD3 ARG 30 8.384 -3.680 -5.059
268 HE ARG 30 HE ARG 30 6.787 -3.816 -2.605
269 HH11 ARG 30 HH11 ARG 30 7.379 -4.972 -5.916
270 HH12 ARG 30 HH12 ARG 30 6.244 -6.232 -5.831
271 HH21 ARG 30 HH21 ARG 30 5.180 -5.475 -2.534
272 HH22 ARG 30 HH22 ARG 30 4.957 -6.554 -3.849
273 H LYS 31 H LYS 31 12.578 -2.015 -5.226
274 HA LYS 31 HA LYS 31 14.447 0.095 -5.487
275 HB2 LYS 31 HB2 LYS 31 13.774 -2.078 -7.444
276 HB3 LYS 31 HB3 LYS 31 15.203 -1.056 -7.501
277 HG2 LYS 31 HG2 LYS 31 16.002 -1.991 -5.417
278 HG3 LYS 31 HG3 LYS 31 14.544 -2.967 -5.263
279 HD2 LYS 31 HD2 LYS 31 16.501 -3.168 -7.553
280 HD3 LYS 31 HD3 LYS 31 16.512 -4.213 -6.133
281 HE2 LYS 31 HE2 LYS 31 14.349 -5.079 -6.677
282 HE3 LYS 31 HE3 LYS 31 14.150 -3.937 -7.999
283 HZ1 LYS 31 HZ1 LYS 31 16.218 -5.040 -8.952
284 HZ2 LYS 31 HZ2 LYS 31 14.791 -5.916 -9.011
285 HZ3 LYS 31 HZ3 LYS 31 15.950 -6.277 -7.838
286 H ASP 32 H ASP 32 11.561 -0.708 -7.280
287 HA ASP 32 HA ASP 32 12.015 1.429 -9.230
288 HB2 ASP 32 HB2 ASP 32 9.758 -0.581 -9.018
289 HB3 ASP 32 HB3 ASP 32 9.967 0.569 -10.329
290 H MET 33 H MET 33 11.254 1.728 -6.268
291 HA MET 33 HA MET 33 8.703 3.058 -6.551
292 HB2 MET 33 HB2 MET 33 9.055 1.373 -4.836
293 HB3 MET 33 HB3 MET 33 10.398 2.293 -4.196
294 HG2 MET 33 HG2 MET 33 9.033 3.968 -3.442
295 HG3 MET 33 HG3 MET 33 7.629 3.382 -4.347
296 HE1 MET 33 HE1 MET 33 6.697 0.112 -2.412
297 HE2 MET 33 HE2 MET 33 7.689 0.228 -3.858
298 HE3 MET 33 HE3 MET 33 6.237 1.215 -3.704
299 H LYS 34 H LYS 34 8.957 5.136 -7.253
300 HA LYS 34 HA LYS 34 11.085 6.777 -6.138
301 HB2 LYS 34 HB2 LYS 34 9.844 6.818 -8.884
302 HB3 LYS 34 HB3 LYS 34 11.164 7.815 -8.300
303 HG2 LYS 34 HG2 LYS 34 12.710 6.127 -8.529
304 HG3 LYS 34 HG3 LYS 34 11.474 4.913 -8.135
305 HD2 LYS 34 HD2 LYS 34 12.191 4.585 -10.410
306 HD3 LYS 34 HD3 LYS 34 10.532 5.160 -10.380
307 HE2 LYS 34 HE2 LYS 34 12.818 7.068 -10.760
308 HE3 LYS 34 HE3 LYS 34 12.168 6.120 -12.103
309 HZ1 LYS 34 HZ1 LYS 34 10.848 8.250 -10.555
310 HZ2 LYS 34 HZ2 LYS 34 9.936 7.082 -11.311
311 HZ3 LYS 34 HZ3 LYS 34 10.953 8.066 -12.229
312 H VAL 35 H VAL 35 10.422 9.037 -6.013
313 HA VAL 35 HA VAL 35 7.765 9.309 -4.988
314 HB VAL 35 HB VAL 35 9.734 11.544 -5.545
315 HG11 VAL 35 HG11 VAL 35 7.509 11.360 -3.516
316 HG12 VAL 35 HG12 VAL 35 7.424 12.260 -5.034
317 HG13 VAL 35 HG13 VAL 35 8.566 12.741 -3.779
318 HG21 VAL 35 HG21 VAL 35 9.413 10.012 -2.986
319 HG22 VAL 35 HG22 VAL 35 10.586 11.283 -3.340
320 HG23 VAL 35 HG23 VAL 35 10.698 9.721 -4.155
321 H GLY 36 H GLY 36 5.975 10.037 -5.963
322 HA2 GLY 36 HA2 GLY 36 4.965 11.683 -7.419
323 HA3 GLY 36 HA3 GLY 36 6.296 11.419 -8.535
324 H GLN 37 H GLN 37 6.087 8.477 -8.105
325 HA GLN 37 HA GLN 37 3.961 8.178 -10.054
326 HB2 GLN 37 HB2 GLN 37 5.027 5.948 -10.578
327 HB3 GLN 37 HB3 GLN 37 6.063 7.346 -10.818
328 HG2 GLN 37 HG2 GLN 37 7.008 6.856 -8.551
329 HG3 GLN 37 HG3 GLN 37 6.206 5.286 -8.702
330 HE21 GLN 37 HE21 GLN 37 7.084 3.772 -10.041
331 HE22 GLN 37 HE22 GLN 37 8.520 4.050 -10.944
332 H GLN 38 H GLN 38 2.377 6.702 -10.013
333 HA GLN 38 HA GLN 38 1.513 5.826 -7.383
334 HB2 GLN 38 HB2 GLN 38 0.001 6.848 -9.230
335 HB3 GLN 38 HB3 GLN 38 0.122 5.273 -10.001
336 HG2 GLN 38 HG2 GLN 38 -0.818 4.245 -7.949
337 HG3 GLN 38 HG3 GLN 38 -1.031 5.861 -7.280
338 HE21 GLN 38 HE21 GLN 38 -3.257 5.807 -7.172
339 HE22 GLN 38 HE22 GLN 38 -4.256 5.731 -8.575
340 H VAL 39 H VAL 39 2.080 3.941 -6.654
341 HA VAL 39 HA VAL 39 2.998 1.946 -8.595
342 HB VAL 39 HB VAL 39 4.551 1.089 -6.938
343 HG11 VAL 39 HG11 VAL 39 4.849 4.073 -7.171
344 HG12 VAL 39 HG12 VAL 39 5.328 2.898 -8.396
345 HG13 VAL 39 HG13 VAL 39 6.136 2.923 -6.821
346 HG21 VAL 39 HG21 VAL 39 4.936 2.265 -4.803
347 HG22 VAL 39 HG22 VAL 39 3.336 1.535 -4.898
348 HG23 VAL 39 HG23 VAL 39 3.527 3.277 -5.122
349 H SER 40 H SER 40 2.595 -0.222 -8.110
350 HA SER 40 HA SER 40 0.276 -0.663 -6.422
351 HB2 SER 40 HB2 SER 40 1.694 -2.688 -8.158
352 HB3 SER 40 HB3 SER 40 0.016 -2.694 -7.614
353 HG SER 40 HG SER 40 0.253 -0.487 -8.899
354 H PHE 41 H PHE 41 0.741 -1.209 -4.395
355 HA PHE 41 HA PHE 41 3.169 -2.791 -3.882
356 HB2 PHE 41 HB2 PHE 41 3.138 -1.816 -1.583
357 HB3 PHE 41 HB3 PHE 41 3.529 -0.658 -2.834
358 HD1 PHE 41 HD1 PHE 41 1.841 1.093 -3.426
359 HD2 PHE 41 HD2 PHE 41 1.175 -1.652 -0.240
360 HE1 PHE 41 HE1 PHE 41 0.033 2.519 -2.566
361 HE2 PHE 41 HE2 PHE 41 -0.637 -0.227 0.612
362 HZ PHE 41 HZ PHE 41 -1.206 1.853 -0.544
363 H GLU 42 H GLU 42 2.884 -4.082 -1.905
364 HA GLU 42 HA GLU 42 0.240 -5.322 -2.098
365 HB2 GLU 42 HB2 GLU 42 2.782 -6.262 -0.806
366 HB3 GLU 42 HB3 GLU 42 1.245 -7.102 -0.811
367 HG2 GLU 42 HG2 GLU 42 2.175 -6.349 -3.448
368 HG3 GLU 42 HG3 GLU 42 3.173 -7.553 -2.614
369 H ASN 43 H ASN 43 -0.706 -6.070 -0.159
370 HA ASN 43 HA ASN 43 -0.726 -4.207 1.988
371 HB2 ASN 43 HB2 ASN 43 -2.036 -6.802 1.430
372 HB3 ASN 43 HB3 ASN 43 -1.820 -6.431 3.138
373 HD21 ASN 43 HD21 ASN 43 -3.111 -5.049 0.107
374 HD22 ASN 43 HD22 ASN 43 -4.354 -4.144 0.912
375 H GLU 44 H GLU 44 1.206 -6.818 1.157
376 HA GLU 44 HA GLU 44 2.351 -7.397 3.715
377 HB2 GLU 44 HB2 GLU 44 3.313 -8.037 0.933
378 HB3 GLU 44 HB3 GLU 44 3.911 -8.757 2.419
379 HG2 GLU 44 HG2 GLU 44 1.671 -9.716 2.801
380 HG3 GLU 44 HG3 GLU 44 1.147 -9.023 1.269
381 H ASP 45 H ASP 45 2.743 -4.861 1.437
382 HA ASP 45 HA ASP 45 5.547 -4.339 2.119
383 HB2 ASP 45 HB2 ASP 45 3.609 -2.919 0.281
384 HB3 ASP 45 HB3 ASP 45 5.186 -2.267 0.679
385 H ILE 46 H ILE 46 2.441 -3.584 3.172
386 HA ILE 46 HA ILE 46 2.958 -0.886 3.920
387 HB ILE 46 HB ILE 46 0.690 -2.593 4.972
388 HG12 ILE 46 HG12 ILE 46 0.722 -0.956 2.423
389 HG13 ILE 46 HG13 ILE 46 0.805 -2.712 2.479
390 HG21 ILE 46 HG21 ILE 46 1.024 -0.445 6.060
391 HG22 ILE 46 HG22 ILE 46 -0.461 -0.429 5.110
392 HG23 ILE 46 HG23 ILE 46 0.988 0.378 4.498
393 HD11 ILE 46 HD11 ILE 46 -1.492 -0.999 3.417
394 HD12 ILE 46 HD12 ILE 46 -1.421 -2.755 3.529
395 HD13 ILE 46 HD13 ILE 46 -1.438 -1.971 1.948
396 H TYR 47 H TYR 47 3.945 -0.153 5.588
397 HA TYR 47 HA TYR 47 5.026 -1.827 7.632
398 HB2 TYR 47 HB2 TYR 47 5.168 0.954 6.779
399 HB3 TYR 47 HB3 TYR 47 5.274 0.775 8.539
400 HD1 TYR 47 HD1 TYR 47 6.967 0.746 5.436
401 HD2 TYR 47 HD2 TYR 47 7.113 -0.879 9.352
402 HE1 TYR 47 HE1 TYR 47 9.357 0.274 5.143
403 HE2 TYR 47 HE2 TYR 47 9.507 -1.363 9.067
404 HH TYR 47 HH TYR 47 11.043 -1.777 7.052
405 H ASN 48 H ASN 48 2.284 0.185 7.201
406 HA ASN 48 HA ASN 48 1.341 0.139 9.918
407 HB2 ASN 48 HB2 ASN 48 -0.146 0.656 7.303
408 HB3 ASN 48 HB3 ASN 48 -0.853 0.844 8.892
409 HD21 ASN 48 HD21 ASN 48 -0.393 2.647 10.072
410 HD22 ASN 48 HD22 ASN 48 0.452 4.014 9.424
411 H VAL 49 H VAL 49 1.309 -1.937 10.617
412 HA VAL 49 HA VAL 49 0.495 -4.109 8.983
413 HB VAL 49 HB VAL 49 0.866 -4.097 11.991
414 HG11 VAL 49 HG11 VAL 49 1.218 -6.513 11.748
415 HG12 VAL 49 HG12 VAL 49 0.897 -6.387 10.019
416 HG13 VAL 49 HG13 VAL 49 -0.385 -6.037 11.179
417 HG21 VAL 49 HG21 VAL 49 2.893 -3.340 10.869
418 HG22 VAL 49 HG22 VAL 49 2.851 -4.746 9.808
419 HG23 VAL 49 HG23 VAL 49 3.124 -4.956 11.539
420 H ARG 50 H ARG 50 -1.483 -4.205 8.355
421 HA ARG 50 HA ARG 50 -3.643 -3.876 10.296
422 HB2 ARG 50 HB2 ARG 50 -5.095 -3.790 8.192
423 HB3 ARG 50 HB3 ARG 50 -4.041 -2.416 8.472
424 HG2 ARG 50 HG2 ARG 50 -2.436 -3.349 6.851
425 HG3 ARG 50 HG3 ARG 50 -3.559 -4.671 6.535
426 HD2 ARG 50 HD2 ARG 50 -4.211 -1.753 6.168
427 HD3 ARG 50 HD3 ARG 50 -3.674 -2.818 4.873
428 HE ARG 50 HE ARG 50 -5.746 -4.165 5.792
429 HH11 ARG 50 HH11 ARG 50 -5.482 -0.678 5.074
430 HH12 ARG 50 HH12 ARG 50 -7.097 -0.524 4.592
431 HH21 ARG 50 HH21 ARG 50 -8.032 -3.886 5.111
432 HH22 ARG 50 HH22 ARG 50 -8.550 -2.341 4.625
433 H GLY 51 H GLY 51 -4.971 -5.585 10.745
434 HA2 GLY 51 HA2 GLY 51 -5.713 -7.736 9.440
435 HA3 GLY 51 HA3 GLY 51 -4.040 -8.153 9.794
436 H LYS 52 H LYS 52 -5.261 -9.900 10.940
437 HA LYS 52 HA LYS 52 -6.412 -9.066 13.446
438 HB2 LYS 52 HB2 LYS 52 -6.730 -11.549 13.818
439 HB3 LYS 52 HB3 LYS 52 -7.607 -10.858 12.464
440 HG2 LYS 52 HG2 LYS 52 -6.390 -12.031 10.922
441 HG3 LYS 52 HG3 LYS 52 -4.949 -12.072 11.935
442 HD2 LYS 52 HD2 LYS 52 -7.360 -13.530 12.874
443 HD3 LYS 52 HD3 LYS 52 -6.454 -14.228 11.536
444 HE2 LYS 52 HE2 LYS 52 -5.659 -15.180 13.625
445 HE3 LYS 52 HE3 LYS 52 -4.404 -14.158 12.943
446 HZ1 LYS 52 HZ1 LYS 52 -6.245 -13.293 15.132
447 HZ2 LYS 52 HZ2 LYS 52 -4.872 -12.474 14.545
448 HZ3 LYS 52 HZ3 LYS 52 -4.705 -13.922 15.348
Start of MODEL 20
1 H1 SER 0 H1 SER 0 -0.440 -9.365 -0.882
2 H2 SER 0 H2 SER 0 0.007 -10.910 -0.375
3 H3 SER 0 H3 SER 0 -1.222 -10.074 0.428
4 HA SER 0 HA SER 0 -1.339 -10.962 -2.368
5 HB2 SER 0 HB2 SER 0 -2.904 -11.947 0.015
6 HB3 SER 0 HB3 SER 0 -2.842 -12.659 -1.601
7 HG SER 0 HG SER 0 -0.937 -13.485 -1.213
8 H MET 1 H MET 1 -1.788 -8.225 -1.086
9 HA MET 1 HA MET 1 -4.453 -7.772 -2.109
10 HB2 MET 1 HB2 MET 1 -3.627 -6.770 0.632
11 HB3 MET 1 HB3 MET 1 -5.135 -6.434 -0.181
12 HG2 MET 1 HG2 MET 1 -5.955 -8.586 0.207
13 HG3 MET 1 HG3 MET 1 -4.332 -9.209 0.524
14 HE1 MET 1 HE1 MET 1 -5.958 -5.880 1.977
15 HE2 MET 1 HE2 MET 1 -6.704 -6.516 3.444
16 HE3 MET 1 HE3 MET 1 -7.282 -7.037 1.863
17 H ASN 2 H ASN 2 -3.093 -6.876 -3.722
18 HA ASN 2 HA ASN 2 -1.292 -4.763 -3.281
19 HB2 ASN 2 HB2 ASN 2 -2.782 -5.610 -5.754
20 HB3 ASN 2 HB3 ASN 2 -1.725 -4.205 -5.743
21 HD21 ASN 2 HD21 ASN 2 0.519 -4.551 -5.283
22 HD22 ASN 2 HD22 ASN 2 1.256 -6.076 -5.603
23 H ARG 3 H ARG 3 -1.474 -2.705 -3.130
24 HA ARG 3 HA ARG 3 -4.106 -1.387 -3.326
25 HB2 ARG 3 HB2 ARG 3 -2.958 -1.762 -0.991
26 HB3 ARG 3 HB3 ARG 3 -1.857 -0.508 -1.543
27 HG2 ARG 3 HG2 ARG 3 -3.332 0.760 -0.379
28 HG3 ARG 3 HG3 ARG 3 -4.104 0.801 -1.964
29 HD2 ARG 3 HD2 ARG 3 -5.488 -1.113 -1.286
30 HD3 ARG 3 HD3 ARG 3 -4.779 -1.036 0.323
31 HE ARG 3 HE ARG 3 -6.704 0.847 -0.830
32 HH11 ARG 3 HH11 ARG 3 -4.675 0.046 2.013
33 HH12 ARG 3 HH12 ARG 3 -5.457 1.178 3.014
34 HH21 ARG 3 HH21 ARG 3 -7.741 2.324 0.604
35 HH22 ARG 3 HH22 ARG 3 -7.165 2.587 2.184
36 H LEU 4 H LEU 4 -3.886 0.912 -4.044
37 HA LEU 4 HA LEU 4 -1.448 1.342 -5.665
38 HB2 LEU 4 HB2 LEU 4 -4.243 2.400 -6.092
39 HB3 LEU 4 HB3 LEU 4 -2.859 2.760 -7.095
40 HG LEU 4 HG LEU 4 -4.188 0.065 -6.789
41 HD11 LEU 4 HD11 LEU 4 -5.559 1.592 -8.043
42 HD12 LEU 4 HD12 LEU 4 -4.828 0.433 -9.153
43 HD13 LEU 4 HD13 LEU 4 -4.183 2.073 -9.031
44 HD21 LEU 4 HD21 LEU 4 -1.870 0.938 -8.517
45 HD22 LEU 4 HD22 LEU 4 -2.720 -0.601 -8.667
46 HD23 LEU 4 HD23 LEU 4 -1.824 -0.231 -7.193
47 H GLY 5 H GLY 5 -0.255 3.091 -5.234
48 HA2 GLY 5 HA2 GLY 5 -1.509 5.403 -4.050
49 HA3 GLY 5 HA3 GLY 5 -0.320 4.595 -3.032
50 H ILE 6 H ILE 6 -0.233 7.170 -3.952
51 HA ILE 6 HA ILE 6 1.803 7.198 -6.057
52 HB ILE 6 HB ILE 6 0.308 9.507 -4.758
53 HG12 ILE 6 HG12 ILE 6 -0.215 8.346 -7.487
54 HG13 ILE 6 HG13 ILE 6 -1.070 7.771 -6.063
55 HG21 ILE 6 HG21 ILE 6 2.436 10.153 -5.764
56 HG22 ILE 6 HG22 ILE 6 1.083 10.775 -6.709
57 HG23 ILE 6 HG23 ILE 6 1.974 9.361 -7.272
58 HD11 ILE 6 HD11 ILE 6 -2.346 9.425 -7.317
59 HD12 ILE 6 HD12 ILE 6 -1.043 10.593 -7.069
60 HD13 ILE 6 HD13 ILE 6 -1.962 9.987 -5.689
61 H ILE 7 H ILE 7 3.837 7.569 -5.559
62 HA ILE 7 HA ILE 7 4.648 7.636 -2.854
63 HB ILE 7 HB ILE 7 6.277 8.302 -5.316
64 HG12 ILE 7 HG12 ILE 7 5.311 6.002 -5.255
65 HG13 ILE 7 HG13 ILE 7 7.067 6.023 -5.225
66 HG21 ILE 7 HG21 ILE 7 7.246 9.221 -3.239
67 HG22 ILE 7 HG22 ILE 7 8.240 7.942 -3.932
68 HG23 ILE 7 HG23 ILE 7 7.226 7.604 -2.532
69 HD11 ILE 7 HD11 ILE 7 5.426 5.792 -2.718
70 HD12 ILE 7 HD12 ILE 7 7.133 5.413 -2.951
71 HD13 ILE 7 HD13 ILE 7 5.892 4.401 -3.681
72 H TYR 8 H TYR 8 4.233 9.166 -1.636
73 HA TYR 8 HA TYR 8 4.029 11.908 -2.486
74 HB2 TYR 8 HB2 TYR 8 2.505 10.691 -0.836
75 HB3 TYR 8 HB3 TYR 8 3.842 10.777 0.299
76 HD1 TYR 8 HD1 TYR 8 4.213 12.723 1.562
77 HD2 TYR 8 HD2 TYR 8 1.527 12.811 -1.722
78 HE1 TYR 8 HE1 TYR 8 3.445 14.938 2.268
79 HE2 TYR 8 HE2 TYR 8 0.741 15.026 -1.046
80 HH TYR 8 HH TYR 8 0.684 16.453 0.820
81 H GLU 9 H GLU 9 6.083 9.815 -0.531
82 HA GLU 9 HA GLU 9 8.347 11.543 -0.752
83 HB2 GLU 9 HB2 GLU 9 6.905 12.561 1.114
84 HB3 GLU 9 HB3 GLU 9 7.239 11.102 2.029
85 HG2 GLU 9 HG2 GLU 9 9.618 11.601 1.992
86 HG3 GLU 9 HG3 GLU 9 9.312 13.041 1.022
87 H ILE 10 H ILE 10 10.231 10.516 0.284
88 HA ILE 10 HA ILE 10 9.864 7.631 0.694
89 HB ILE 10 HB ILE 10 12.155 9.118 -0.633
90 HG12 ILE 10 HG12 ILE 10 10.120 8.723 -2.031
91 HG13 ILE 10 HG13 ILE 10 11.579 7.969 -2.670
92 HG21 ILE 10 HG21 ILE 10 11.946 6.156 -0.091
93 HG22 ILE 10 HG22 ILE 10 13.022 7.277 0.736
94 HG23 ILE 10 HG23 ILE 10 13.240 6.950 -0.988
95 HD11 ILE 10 HD11 ILE 10 9.678 6.495 -2.912
96 HD12 ILE 10 HD12 ILE 10 9.340 6.606 -1.186
97 HD13 ILE 10 HD13 ILE 10 10.825 5.832 -1.748
98 H GLN 11 H GLN 11 11.009 6.758 2.414
99 HA GLN 11 HA GLN 11 12.697 8.563 3.988
100 HB2 GLN 11 HB2 GLN 11 10.368 6.927 4.870
101 HB3 GLN 11 HB3 GLN 11 11.779 6.909 5.912
102 HG2 GLN 11 HG2 GLN 11 10.729 8.663 6.852
103 HG3 GLN 11 HG3 GLN 11 11.526 9.545 5.557
104 HE21 GLN 11 HE21 GLN 11 10.318 10.127 3.753
105 HE22 GLN 11 HE22 GLN 11 8.611 10.312 3.852
106 H GLY 12 H GLY 12 14.295 7.495 2.594
107 HA2 GLY 12 HA2 GLY 12 15.998 5.988 2.325
108 HA3 GLY 12 HA3 GLY 12 15.602 5.387 3.928
109 H MET 13 H MET 13 14.524 3.543 4.144
110 HA MET 13 HA MET 13 14.032 2.053 1.686
111 HB2 MET 13 HB2 MET 13 14.703 1.233 4.471
112 HB3 MET 13 HB3 MET 13 13.851 0.104 3.435
113 HG2 MET 13 HG2 MET 13 16.325 1.405 2.417
114 HG3 MET 13 HG3 MET 13 16.468 0.108 3.598
115 HE1 MET 13 HE1 MET 13 14.012 0.590 0.333
116 HE2 MET 13 HE2 MET 13 15.050 -0.293 -0.784
117 HE3 MET 13 HE3 MET 13 15.647 1.169 -0.006
118 H LYS 14 H LYS 14 12.326 3.944 3.578
119 HA LYS 14 HA LYS 14 9.889 2.306 3.394
120 HB2 LYS 14 HB2 LYS 14 10.273 4.780 5.089
121 HB3 LYS 14 HB3 LYS 14 8.953 3.629 5.169
122 HG2 LYS 14 HG2 LYS 14 10.521 1.916 5.990
123 HG3 LYS 14 HG3 LYS 14 11.811 3.112 5.959
124 HD2 LYS 14 HD2 LYS 14 10.537 4.489 7.565
125 HD3 LYS 14 HD3 LYS 14 9.298 3.229 7.618
126 HE2 LYS 14 HE2 LYS 14 11.033 1.627 8.336
127 HE3 LYS 14 HE3 LYS 14 12.184 2.967 8.415
128 HZ1 LYS 14 HZ1 LYS 14 10.898 3.949 10.194
129 HZ2 LYS 14 HZ2 LYS 14 11.212 2.341 10.564
130 HZ3 LYS 14 HZ3 LYS 14 9.682 2.781 10.023
131 H ALA 15 H ALA 15 8.022 3.455 2.638
132 HA ALA 15 HA ALA 15 8.578 5.961 1.228
133 HB1 ALA 15 HB1 ALA 15 8.780 4.174 -0.422
134 HB2 ALA 15 HB2 ALA 15 7.343 5.148 -0.732
135 HB3 ALA 15 HB3 ALA 15 7.189 3.565 0.022
136 H VAL 16 H VAL 16 6.880 7.332 1.110
137 HA VAL 16 HA VAL 16 4.506 6.645 2.697
138 HB VAL 16 HB VAL 16 5.486 9.367 1.729
139 HG11 VAL 16 HG11 VAL 16 3.695 10.331 3.095
140 HG12 VAL 16 HG12 VAL 16 3.137 8.711 3.517
141 HG13 VAL 16 HG13 VAL 16 3.034 9.270 1.851
142 HG21 VAL 16 HG21 VAL 16 5.348 8.266 4.521
143 HG22 VAL 16 HG22 VAL 16 5.895 9.869 4.055
144 HG23 VAL 16 HG23 VAL 16 6.834 8.443 3.575
145 H VAL 17 H VAL 17 2.931 5.909 1.499
146 HA VAL 17 HA VAL 17 2.677 6.963 -1.212
147 HB VAL 17 HB VAL 17 1.135 4.901 -1.533
148 HG11 VAL 17 HG11 VAL 17 3.291 5.282 -2.644
149 HG12 VAL 17 HG12 VAL 17 3.007 3.579 -2.288
150 HG13 VAL 17 HG13 VAL 17 4.104 4.524 -1.278
151 HG21 VAL 17 HG21 VAL 17 1.037 4.138 0.769
152 HG22 VAL 17 HG22 VAL 17 2.789 4.002 0.823
153 HG23 VAL 17 HG23 VAL 17 1.851 2.934 -0.225
154 H LEU 18 H LEU 18 1.122 8.208 -1.646
155 HA LEU 18 HA LEU 18 -1.132 8.457 0.159
156 HB2 LEU 18 HB2 LEU 18 -0.121 10.519 -0.628
157 HB3 LEU 18 HB3 LEU 18 -0.219 9.985 -2.287
158 HG LEU 18 HG LEU 18 -2.692 10.102 -2.157
159 HD11 LEU 18 HD11 LEU 18 -2.975 9.797 0.242
160 HD12 LEU 18 HD12 LEU 18 -3.745 11.288 -0.303
161 HD13 LEU 18 HD13 LEU 18 -2.192 11.352 0.535
162 HD21 LEU 18 HD21 LEU 18 -1.395 11.945 -3.061
163 HD22 LEU 18 HD22 LEU 18 -1.252 12.650 -1.447
164 HD23 LEU 18 HD23 LEU 18 -2.834 12.525 -2.225
165 H THR 19 H THR 19 -2.483 6.873 -0.183
166 HA THR 19 HA THR 19 -2.644 5.370 -2.556
167 HB THR 19 HB THR 19 -4.747 4.424 -1.495
168 HG1 THR 19 HG1 THR 19 -3.886 5.881 0.768
169 HG21 THR 19 HG21 THR 19 -2.565 3.373 -1.207
170 HG22 THR 19 HG22 THR 19 -3.491 3.277 0.294
171 HG23 THR 19 HG23 THR 19 -2.196 4.465 0.127
172 H SER 20 H SER 20 -4.607 5.049 -3.864
173 HA SER 20 HA SER 20 -5.553 7.425 -5.003
174 HB2 SER 20 HB2 SER 20 -7.125 5.683 -6.106
175 HB3 SER 20 HB3 SER 20 -5.382 5.541 -6.385
176 HG SER 20 HG SER 20 -6.824 3.672 -5.612
177 H GLU 21 H GLU 21 -6.416 5.845 -2.220
178 HA GLU 21 HA GLU 21 -9.191 6.697 -2.240
179 HB2 GLU 21 HB2 GLU 21 -7.712 4.901 -0.322
180 HB3 GLU 21 HB3 GLU 21 -9.445 5.207 -0.333
181 HG2 GLU 21 HG2 GLU 21 -9.736 4.095 -2.404
182 HG3 GLU 21 HG3 GLU 21 -8.000 4.045 -2.691
183 H GLY 22 H GLY 22 -6.270 7.960 -1.399
184 HA2 GLY 22 HA2 GLY 22 -5.981 10.069 -0.472
185 HA3 GLY 22 HA3 GLY 22 -7.570 9.964 0.257
186 H GLU 23 H GLU 23 -5.445 7.312 0.825
187 HA GLU 23 HA GLU 23 -5.038 8.314 3.561
188 HB2 GLU 23 HB2 GLU 23 -4.858 5.488 2.522
189 HB3 GLU 23 HB3 GLU 23 -4.685 5.977 4.194
190 HG2 GLU 23 HG2 GLU 23 -7.049 6.795 4.088
191 HG3 GLU 23 HG3 GLU 23 -7.156 6.045 2.495
192 H PHE 24 H PHE 24 -2.951 8.410 4.409
193 HA PHE 24 HA PHE 24 -0.757 7.970 2.505
194 HB2 PHE 24 HB2 PHE 24 -0.642 9.355 5.227
195 HB3 PHE 24 HB3 PHE 24 0.673 9.158 4.108
196 HD1 PHE 24 HD1 PHE 24 -2.590 10.823 4.524
197 HD2 PHE 24 HD2 PHE 24 1.077 10.669 2.382
198 HE1 PHE 24 HE1 PHE 24 -3.120 12.994 3.473
199 HE2 PHE 24 HE2 PHE 24 0.557 12.827 1.329
200 HZ PHE 24 HZ PHE 24 -1.541 13.994 1.875
201 H LEU 25 H LEU 25 0.143 6.073 2.589
202 HA LEU 25 HA LEU 25 0.183 4.622 5.153
203 HB2 LEU 25 HB2 LEU 25 -0.166 3.746 2.327
204 HB3 LEU 25 HB3 LEU 25 0.685 2.663 3.406
205 HG LEU 25 HG LEU 25 -1.327 2.614 4.873
206 HD11 LEU 25 HD11 LEU 25 -3.439 3.450 4.014
207 HD12 LEU 25 HD12 LEU 25 -2.605 4.172 2.641
208 HD13 LEU 25 HD13 LEU 25 -2.296 4.771 4.272
209 HD21 LEU 25 HD21 LEU 25 -0.933 0.919 3.163
210 HD22 LEU 25 HD22 LEU 25 -1.835 1.888 2.002
211 HD23 LEU 25 HD23 LEU 25 -2.652 1.214 3.416
212 H ILE 26 H ILE 26 2.101 3.575 5.765
213 HA ILE 26 HA ILE 26 4.509 4.554 4.409
214 HB ILE 26 HB ILE 26 4.312 3.273 7.155
215 HG12 ILE 26 HG12 ILE 26 3.026 5.367 7.174
216 HG13 ILE 26 HG13 ILE 26 4.487 5.524 8.140
217 HG21 ILE 26 HG21 ILE 26 6.531 3.115 6.199
218 HG22 ILE 26 HG22 ILE 26 6.551 4.296 7.506
219 HG23 ILE 26 HG23 ILE 26 6.532 4.840 5.832
220 HD11 ILE 26 HD11 ILE 26 5.543 6.734 6.279
221 HD12 ILE 26 HD12 ILE 26 4.083 7.535 6.858
222 HD13 ILE 26 HD13 ILE 26 4.042 6.601 5.362
223 H ILE 27 H ILE 27 5.377 3.111 3.115
224 HA ILE 27 HA ILE 27 4.977 0.255 3.731
225 HB ILE 27 HB ILE 27 4.874 -0.223 1.323
226 HG12 ILE 27 HG12 ILE 27 4.636 2.745 0.825
227 HG13 ILE 27 HG13 ILE 27 6.183 1.914 0.734
228 HG21 ILE 27 HG21 ILE 27 2.658 0.966 0.869
229 HG22 ILE 27 HG22 ILE 27 2.869 1.684 2.471
230 HG23 ILE 27 HG23 ILE 27 2.774 -0.067 2.291
231 HD11 ILE 27 HD11 ILE 27 3.750 1.328 -0.931
232 HD12 ILE 27 HD12 ILE 27 5.284 0.466 -1.021
233 HD13 ILE 27 HD13 ILE 27 5.204 2.175 -1.459
234 H ARG 28 H ARG 28 6.505 -1.109 2.600
235 HA ARG 28 HA ARG 28 9.239 -0.364 2.896
236 HB2 ARG 28 HB2 ARG 28 8.106 -2.638 1.245
237 HB3 ARG 28 HB3 ARG 28 9.748 -2.502 1.851
238 HG2 ARG 28 HG2 ARG 28 8.986 -2.817 4.110
239 HG3 ARG 28 HG3 ARG 28 7.306 -2.764 3.583
240 HD2 ARG 28 HD2 ARG 28 7.750 -4.776 2.182
241 HD3 ARG 28 HD3 ARG 28 9.357 -4.862 2.904
242 HE ARG 28 HE ARG 28 7.198 -4.771 4.806
243 HH11 ARG 28 HH11 ARG 28 9.071 -6.984 2.780
244 HH12 ARG 28 HH12 ARG 28 8.960 -8.285 3.865
245 HH21 ARG 28 HH21 ARG 28 7.001 -6.538 6.243
246 HH22 ARG 28 HH22 ARG 28 7.735 -8.037 5.898
247 H ARG 29 H ARG 29 10.486 0.669 1.446
248 HA ARG 29 HA ARG 29 9.299 1.378 -1.074
249 HB2 ARG 29 HB2 ARG 29 10.632 3.028 0.251
250 HB3 ARG 29 HB3 ARG 29 12.067 2.052 -0.072
251 HG2 ARG 29 HG2 ARG 29 11.145 2.334 -2.560
252 HG3 ARG 29 HG3 ARG 29 10.539 3.827 -1.855
253 HD2 ARG 29 HD2 ARG 29 12.796 4.391 -1.130
254 HD3 ARG 29 HD3 ARG 29 13.383 2.865 -1.818
255 HE ARG 29 HE ARG 29 12.237 3.895 -3.933
256 HH11 ARG 29 HH11 ARG 29 14.578 5.399 -1.718
257 HH12 ARG 29 HH12 ARG 29 14.964 6.663 -2.776
258 HH21 ARG 29 HH21 ARG 29 12.831 5.620 -5.415
259 HH22 ARG 29 HH22 ARG 29 14.007 6.764 -4.946
260 H ARG 30 H ARG 30 9.497 0.194 -2.788
261 HA ARG 30 HA ARG 30 11.595 -1.814 -2.974
262 HB2 ARG 30 HB2 ARG 30 9.303 -1.208 -4.882
263 HB3 ARG 30 HB3 ARG 30 10.365 -2.596 -4.976
264 HG2 ARG 30 HG2 ARG 30 9.437 -3.489 -2.917
265 HG3 ARG 30 HG3 ARG 30 8.424 -2.052 -2.721
266 HD2 ARG 30 HD2 ARG 30 7.346 -2.598 -4.904
267 HD3 ARG 30 HD3 ARG 30 8.283 -4.083 -4.953
268 HE ARG 30 HE ARG 30 6.875 -4.047 -2.535
269 HH11 ARG 30 HH11 ARG 30 6.144 -4.171 -6.012
270 HH12 ARG 30 HH12 ARG 30 4.750 -5.132 -5.850
271 HH21 ARG 30 HH21 ARG 30 4.919 -5.416 -2.302
272 HH22 ARG 30 HH22 ARG 30 4.052 -5.845 -3.713
273 H LYS 31 H LYS 31 12.502 -1.904 -5.367
274 HA LYS 31 HA LYS 31 13.982 0.523 -5.716
275 HB2 LYS 31 HB2 LYS 31 13.890 -1.922 -7.481
276 HB3 LYS 31 HB3 LYS 31 15.101 -0.653 -7.541
277 HG2 LYS 31 HG2 LYS 31 15.956 -1.252 -5.409
278 HG3 LYS 31 HG3 LYS 31 14.618 -2.363 -5.114
279 HD2 LYS 31 HD2 LYS 31 15.398 -3.592 -7.192
280 HD3 LYS 31 HD3 LYS 31 16.869 -2.626 -7.089
281 HE2 LYS 31 HE2 LYS 31 17.220 -4.769 -5.991
282 HE3 LYS 31 HE3 LYS 31 17.229 -3.475 -4.797
283 HZ1 LYS 31 HZ1 LYS 31 14.928 -5.294 -5.355
284 HZ2 LYS 31 HZ2 LYS 31 14.944 -4.049 -4.219
285 HZ3 LYS 31 HZ3 LYS 31 15.953 -5.355 -4.025
286 H ASP 32 H ASP 32 11.020 -0.407 -6.778
287 HA ASP 32 HA ASP 32 10.955 0.743 -9.428
288 HB2 ASP 32 HB2 ASP 32 9.479 -1.117 -8.648
289 HB3 ASP 32 HB3 ASP 32 8.676 0.018 -7.580
290 H MET 33 H MET 33 9.920 1.601 -6.224
291 HA MET 33 HA MET 33 8.264 3.730 -6.592
292 HB2 MET 33 HB2 MET 33 10.087 2.961 -4.365
293 HB3 MET 33 HB3 MET 33 9.130 4.427 -4.268
294 HG2 MET 33 HG2 MET 33 7.953 2.714 -3.129
295 HG3 MET 33 HG3 MET 33 7.099 3.045 -4.630
296 HE1 MET 33 HE1 MET 33 5.705 0.771 -4.498
297 HE2 MET 33 HE2 MET 33 6.471 0.550 -2.925
298 HE3 MET 33 HE3 MET 33 6.456 -0.772 -4.087
299 H LYS 34 H LYS 34 8.574 5.519 -7.717
300 HA LYS 34 HA LYS 34 10.944 7.140 -7.240
301 HB2 LYS 34 HB2 LYS 34 9.045 6.998 -9.591
302 HB3 LYS 34 HB3 LYS 34 10.359 8.146 -9.420
303 HG2 LYS 34 HG2 LYS 34 11.966 6.319 -9.500
304 HG3 LYS 34 HG3 LYS 34 10.646 5.157 -9.600
305 HD2 LYS 34 HD2 LYS 34 9.937 6.241 -11.718
306 HD3 LYS 34 HD3 LYS 34 11.371 7.260 -11.630
307 HE2 LYS 34 HE2 LYS 34 11.345 4.239 -11.798
308 HE3 LYS 34 HE3 LYS 34 11.759 5.341 -13.106
309 HZ1 LYS 34 HZ1 LYS 34 13.657 6.117 -11.746
310 HZ2 LYS 34 HZ2 LYS 34 13.719 4.478 -12.124
311 HZ3 LYS 34 HZ3 LYS 34 13.274 4.939 -10.582
312 H VAL 35 H VAL 35 10.446 9.269 -6.630
313 HA VAL 35 HA VAL 35 7.985 9.645 -5.285
314 HB VAL 35 HB VAL 35 9.915 11.866 -6.018
315 HG11 VAL 35 HG11 VAL 35 9.064 12.952 -4.007
316 HG12 VAL 35 HG12 VAL 35 8.004 11.578 -3.698
317 HG13 VAL 35 HG13 VAL 35 7.742 12.584 -5.119
318 HG21 VAL 35 HG21 VAL 35 9.991 10.044 -3.614
319 HG22 VAL 35 HG22 VAL 35 11.034 11.443 -3.880
320 HG23 VAL 35 HG23 VAL 35 11.153 10.040 -4.941
321 H GLY 36 H GLY 36 6.075 10.250 -6.023
322 HA2 GLY 36 HA2 GLY 36 4.769 11.898 -7.157
323 HA3 GLY 36 HA3 GLY 36 5.992 11.933 -8.417
324 H GLN 37 H GLN 37 6.017 8.864 -8.239
325 HA GLN 37 HA GLN 37 3.828 8.674 -10.141
326 HB2 GLN 37 HB2 GLN 37 4.916 6.902 -11.207
327 HB3 GLN 37 HB3 GLN 37 6.231 7.937 -10.692
328 HG2 GLN 37 HG2 GLN 37 6.608 6.429 -8.759
329 HG3 GLN 37 HG3 GLN 37 5.345 5.373 -9.383
330 HE21 GLN 37 HE21 GLN 37 6.807 3.614 -9.676
331 HE22 GLN 37 HE22 GLN 37 7.984 3.645 -10.916
332 H GLN 38 H GLN 38 2.388 6.933 -10.173
333 HA GLN 38 HA GLN 38 1.586 6.028 -7.540
334 HB2 GLN 38 HB2 GLN 38 -0.067 6.828 -9.280
335 HB3 GLN 38 HB3 GLN 38 0.322 5.388 -10.214
336 HG2 GLN 38 HG2 GLN 38 -0.350 4.070 -8.133
337 HG3 GLN 38 HG3 GLN 38 -1.049 5.578 -7.550
338 HE21 GLN 38 HE21 GLN 38 -2.860 6.432 -8.620
339 HE22 GLN 38 HE22 GLN 38 -3.826 5.452 -9.645
340 H VAL 39 H VAL 39 1.985 4.088 -6.775
341 HA VAL 39 HA VAL 39 3.207 2.141 -8.586
342 HB VAL 39 HB VAL 39 4.533 1.334 -6.628
343 HG11 VAL 39 HG11 VAL 39 5.037 4.220 -7.328
344 HG12 VAL 39 HG12 VAL 39 5.546 2.825 -8.279
345 HG13 VAL 39 HG13 VAL 39 6.216 3.086 -6.669
346 HG21 VAL 39 HG21 VAL 39 3.133 2.207 -4.834
347 HG22 VAL 39 HG22 VAL 39 3.549 3.855 -5.292
348 HG23 VAL 39 HG23 VAL 39 4.791 2.775 -4.660
349 H SER 40 H SER 40 2.865 -0.045 -7.990
350 HA SER 40 HA SER 40 0.409 -0.408 -6.457
351 HB2 SER 40 HB2 SER 40 0.609 -1.229 -8.921
352 HB3 SER 40 HB3 SER 40 1.679 -2.477 -8.275
353 HG SER 40 HG SER 40 -0.984 -1.982 -7.423
354 H PHE 41 H PHE 41 0.750 -1.070 -4.486
355 HA PHE 41 HA PHE 41 3.156 -2.644 -3.958
356 HB2 PHE 41 HB2 PHE 41 3.247 -1.604 -1.711
357 HB3 PHE 41 HB3 PHE 41 3.500 -0.442 -2.996
358 HD1 PHE 41 HD1 PHE 41 1.675 1.177 -3.544
359 HD2 PHE 41 HD2 PHE 41 1.448 -1.436 -0.199
360 HE1 PHE 41 HE1 PHE 41 -0.084 2.583 -2.566
361 HE2 PHE 41 HE2 PHE 41 -0.312 -0.031 0.784
362 HZ PHE 41 HZ PHE 41 -1.078 1.978 -0.402
363 H GLU 42 H GLU 42 2.768 -3.598 -1.606
364 HA GLU 42 HA GLU 42 0.167 -4.928 -1.824
365 HB2 GLU 42 HB2 GLU 42 2.884 -5.993 -1.251
366 HB3 GLU 42 HB3 GLU 42 1.461 -6.627 -0.443
367 HG2 GLU 42 HG2 GLU 42 1.123 -6.362 -3.284
368 HG3 GLU 42 HG3 GLU 42 2.274 -7.604 -2.742
369 H ASN 43 H ASN 43 -0.421 -5.958 0.165
370 HA ASN 43 HA ASN 43 -0.461 -4.011 2.307
371 HB2 ASN 43 HB2 ASN 43 -1.995 -6.467 1.725
372 HB3 ASN 43 HB3 ASN 43 -1.708 -6.163 3.428
373 HD21 ASN 43 HD21 ASN 43 -3.078 -4.730 0.496
374 HD22 ASN 43 HD22 ASN 43 -4.209 -3.730 1.332
375 H GLU 44 H GLU 44 1.167 -6.803 1.463
376 HA GLU 44 HA GLU 44 2.258 -7.354 4.057
377 HB2 GLU 44 HB2 GLU 44 3.126 -8.397 1.352
378 HB3 GLU 44 HB3 GLU 44 3.520 -9.084 2.926
379 HG2 GLU 44 HG2 GLU 44 1.143 -9.591 3.285
380 HG3 GLU 44 HG3 GLU 44 0.779 -8.922 1.698
381 H ASP 45 H ASP 45 2.751 -4.983 1.798
382 HA ASP 45 HA ASP 45 5.609 -4.674 2.410
383 HB2 ASP 45 HB2 ASP 45 3.847 -3.426 0.288
384 HB3 ASP 45 HB3 ASP 45 5.362 -2.684 0.760
385 H ILE 46 H ILE 46 2.620 -3.717 3.499
386 HA ILE 46 HA ILE 46 3.249 -0.993 4.050
387 HB ILE 46 HB ILE 46 0.988 -2.726 5.112
388 HG12 ILE 46 HG12 ILE 46 0.945 -0.679 2.894
389 HG13 ILE 46 HG13 ILE 46 1.096 -2.414 2.622
390 HG21 ILE 46 HG21 ILE 46 1.322 0.282 5.120
391 HG22 ILE 46 HG22 ILE 46 1.406 -0.775 6.530
392 HG23 ILE 46 HG23 ILE 46 -0.113 -0.599 5.652
393 HD11 ILE 46 HD11 ILE 46 -1.217 -0.998 3.919
394 HD12 ILE 46 HD12 ILE 46 -1.095 -2.731 3.659
395 HD13 ILE 46 HD13 ILE 46 -1.174 -1.637 2.276
396 H TYR 47 H TYR 47 4.281 -0.195 5.713
397 HA TYR 47 HA TYR 47 5.418 -1.990 7.654
398 HB2 TYR 47 HB2 TYR 47 5.942 0.748 6.710
399 HB3 TYR 47 HB3 TYR 47 6.345 0.452 8.409
400 HD1 TYR 47 HD1 TYR 47 7.312 -2.360 8.227
401 HD2 TYR 47 HD2 TYR 47 7.985 0.965 5.656
402 HE1 TYR 47 HE1 TYR 47 9.406 -3.365 7.491
403 HE2 TYR 47 HE2 TYR 47 10.099 -0.043 4.912
404 HH TYR 47 HH TYR 47 11.712 -1.643 5.651
405 H ASN 48 H ASN 48 2.803 0.146 7.427
406 HA ASN 48 HA ASN 48 2.371 0.551 10.221
407 HB2 ASN 48 HB2 ASN 48 0.333 0.414 7.950
408 HB3 ASN 48 HB3 ASN 48 -0.021 0.964 9.577
409 HD21 ASN 48 HD21 ASN 48 0.794 2.966 10.246
410 HD22 ASN 48 HD22 ASN 48 1.319 4.165 9.117
411 H VAL 49 H VAL 49 1.566 -0.911 11.683
412 HA VAL 49 HA VAL 49 1.745 -3.604 10.833
413 HB VAL 49 HB VAL 49 0.785 -2.765 13.572
414 HG11 VAL 49 HG11 VAL 49 1.753 -4.867 14.275
415 HG12 VAL 49 HG12 VAL 49 2.341 -5.174 12.646
416 HG13 VAL 49 HG13 VAL 49 0.608 -5.154 12.963
417 HG21 VAL 49 HG21 VAL 49 2.841 -1.535 13.062
418 HG22 VAL 49 HG22 VAL 49 3.638 -3.048 12.620
419 HG23 VAL 49 HG23 VAL 49 3.123 -2.777 14.282
420 H ARG 50 H ARG 50 0.244 -3.940 9.423
421 HA ARG 50 HA ARG 50 -2.130 -5.162 10.418
422 HB2 ARG 50 HB2 ARG 50 -3.021 -2.897 9.966
423 HB3 ARG 50 HB3 ARG 50 -2.326 -2.923 8.352
424 HG2 ARG 50 HG2 ARG 50 -3.805 -4.915 7.864
425 HG3 ARG 50 HG3 ARG 50 -4.583 -4.620 9.416
426 HD2 ARG 50 HD2 ARG 50 -4.411 -2.608 7.167
427 HD3 ARG 50 HD3 ARG 50 -5.792 -3.650 7.468
428 HE ARG 50 HE ARG 50 -5.455 -2.443 9.826
429 HH11 ARG 50 HH11 ARG 50 -5.665 -1.050 6.560
430 HH12 ARG 50 HH12 ARG 50 -6.456 0.365 7.072
431 HH21 ARG 50 HH21 ARG 50 -6.519 -0.479 10.510
432 HH22 ARG 50 HH22 ARG 50 -6.984 0.677 9.361
433 H GLY 51 H GLY 51 -2.267 -7.007 9.348
434 HA2 GLY 51 HA2 GLY 51 -2.196 -8.271 7.329
435 HA3 GLY 51 HA3 GLY 51 -0.907 -7.213 6.756
436 H LYS 52 H LYS 52 -1.561 -9.163 9.637
437 HA LYS 52 HA LYS 52 1.247 -9.936 9.567
438 HB2 LYS 52 HB2 LYS 52 0.857 -10.609 11.973
439 HB3 LYS 52 HB3 LYS 52 0.866 -8.884 11.646
440 HG2 LYS 52 HG2 LYS 52 -1.649 -8.987 11.623
441 HG3 LYS 52 HG3 LYS 52 -1.524 -10.643 12.210
442 HD2 LYS 52 HD2 LYS 52 -0.371 -8.218 13.583
443 HD3 LYS 52 HD3 LYS 52 -1.909 -8.962 14.001
444 HE2 LYS 52 HE2 LYS 52 0.780 -10.395 14.149
445 HE3 LYS 52 HE3 LYS 52 -0.025 -9.656 15.513
446 HZ1 LYS 52 HZ1 LYS 52 -0.398 -12.030 15.371
447 HZ2 LYS 52 HZ2 LYS 52 -1.174 -11.852 13.883
448 HZ3 LYS 52 HZ3 LYS 52 -1.838 -11.158 15.280
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