Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
634880 | 5z4b RC | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H MET 1 -17.104 0.351 1.911
2 HA MET 1 HA MET 1 -16.480 -0.061 -0.384
3 HB2 MET 1 HB2 MET 1 -14.851 2.077 -0.172
4 HB3 MET 1 HB3 MET 1 -13.649 0.835 0.112
5 HG2 MET 1 HG2 MET 1 -13.681 1.156 -2.201
6 HG3 MET 1 HG3 MET 1 -14.568 -0.352 -1.970
7 HE1 MET 1 HE1 MET 1 -15.930 1.481 -5.152
8 HE2 MET 1 HE2 MET 1 -14.453 0.753 -4.503
9 HE3 MET 1 HE3 MET 1 -15.969 -0.177 -4.510
10 H GLY 2 H GLY 2 -13.581 -0.302 1.992
11 HA2 GLY 2 HA2 GLY 2 -14.238 -2.755 2.937
12 HA3 GLY 2 HA3 GLY 2 -13.318 -3.040 1.425
13 H THR 3 H THR 3 -11.894 -3.980 3.220
14 HA THR 3 HA THR 3 -10.137 -1.921 4.379
15 HB THR 3 HB THR 3 -10.937 -3.226 6.139
16 HG1 THR 3 HG1 THR 3 -8.981 -3.287 6.758
17 HG21 THR 3 HG21 THR 3 -11.915 -5.148 4.955
18 HG22 THR 3 HG22 THR 3 -10.306 -5.780 4.637
19 HG23 THR 3 HG23 THR 3 -10.888 -5.646 6.310
20 H TYR 4 H TYR 4 -7.970 -1.932 3.752
21 HA TYR 4 HA TYR 4 -7.178 -3.761 1.542
22 HB2 TYR 4 HB2 TYR 4 -6.818 -0.762 1.630
23 HB3 TYR 4 HB3 TYR 4 -6.260 -1.839 0.374
24 HD1 TYR 4 HD1 TYR 4 -7.762 -2.574 -1.399
25 HD2 TYR 4 HD2 TYR 4 -9.356 -0.177 1.853
26 HE1 TYR 4 HE1 TYR 4 -9.777 -2.015 -2.744
27 HE2 TYR 4 HE2 TYR 4 -11.264 0.405 0.466
28 HH TYR 4 HH TYR 4 -11.554 -0.543 -2.931
29 H LYS 5 H LYS 5 -5.094 -4.695 1.912
30 HA LYS 5 HA LYS 5 -3.556 -3.502 4.170
31 HB2 LYS 5 HB2 LYS 5 -4.269 -5.943 4.102
32 HB3 LYS 5 HB3 LYS 5 -3.047 -6.139 2.834
33 HG2 LYS 5 HG2 LYS 5 -1.323 -5.212 4.370
34 HG3 LYS 5 HG3 LYS 5 -2.555 -5.135 5.660
35 HD2 LYS 5 HD2 LYS 5 -2.807 -7.586 5.537
36 HD3 LYS 5 HD3 LYS 5 -1.606 -7.655 4.241
37 HE2 LYS 5 HE2 LYS 5 0.003 -6.497 5.890
38 HE3 LYS 5 HE3 LYS 5 -1.202 -6.821 7.144
39 HZ1 LYS 5 HZ1 LYS 5 -0.934 -9.187 6.673
40 HZ2 LYS 5 HZ2 LYS 5 0.166 -8.861 5.500
41 HZ3 LYS 5 HZ3 LYS 5 0.512 -8.465 7.061
42 H LEU 6 H LEU 6 -1.597 -2.494 3.883
43 HA LEU 6 HA LEU 6 -0.320 -2.524 1.216
44 HB2 LEU 6 HB2 LEU 6 -1.728 -0.460 2.007
45 HB3 LEU 6 HB3 LEU 6 -0.243 -0.009 2.862
46 HG LEU 6 HG LEU 6 -0.579 -0.613 -0.130
47 HD11 LEU 6 HD11 LEU 6 -0.259 2.056 1.302
48 HD12 LEU 6 HD12 LEU 6 -0.443 1.804 -0.451
49 HD13 LEU 6 HD13 LEU 6 -1.766 1.391 0.654
50 HD21 LEU 6 HD21 LEU 6 1.818 0.440 1.401
51 HD22 LEU 6 HD22 LEU 6 1.746 -1.030 0.422
52 HD23 LEU 6 HD23 LEU 6 1.644 0.536 -0.368
53 H ILE 7 H ILE 7 1.742 -3.398 1.367
54 HA ILE 7 HA ILE 7 3.399 -2.811 3.681
55 HB ILE 7 HB ILE 7 2.962 -4.988 4.113
56 HG12 ILE 7 HG12 ILE 7 5.272 -5.358 2.155
57 HG13 ILE 7 HG13 ILE 7 5.462 -4.537 3.699
58 HG21 ILE 7 HG21 ILE 7 2.783 -6.819 2.430
59 HG22 ILE 7 HG22 ILE 7 1.521 -5.489 2.216
60 HG23 ILE 7 HG23 ILE 7 2.912 -5.651 1.204
61 HD11 ILE 7 HD11 ILE 7 4.599 -7.421 3.561
62 HD12 ILE 7 HD12 ILE 7 6.211 -6.862 3.778
63 HD13 ILE 7 HD13 ILE 7 5.010 -6.496 5.015
64 H LEU 8 H LEU 8 5.457 -2.053 3.283
65 HA LEU 8 HA LEU 8 6.330 -1.825 0.469
66 HB2 LEU 8 HB2 LEU 8 6.934 0.098 2.714
67 HB3 LEU 8 HB3 LEU 8 7.518 0.209 1.069
68 HG LEU 8 HG LEU 8 5.825 1.822 1.238
69 HD11 LEU 8 HD11 LEU 8 4.513 -0.625 -0.056
70 HD12 LEU 8 HD12 LEU 8 3.953 1.026 -0.241
71 HD13 LEU 8 HD13 LEU 8 5.527 0.605 -0.843
72 HD21 LEU 8 HD21 LEU 8 3.866 -0.112 2.504
73 HD22 LEU 8 HD22 LEU 8 4.828 1.101 3.358
74 HD23 LEU 8 HD23 LEU 8 3.650 1.617 2.171
75 H ASN 9 H ASN 9 8.479 -2.310 -0.003
76 HA ASN 9 HA ASN 9 10.136 -3.385 2.204
77 HB2 ASN 9 HB2 ASN 9 9.641 -4.771 -0.434
78 HB3 ASN 9 HB3 ASN 9 10.850 -5.233 0.743
79 HD21 ASN 9 HD21 ASN 9 7.126 -6.582 1.219
80 HD22 ASN 9 HD22 ASN 9 7.578 -5.585 -0.163
81 H GLY 10 H GLY 10 11.145 -1.139 1.987
82 HA2 GLY 10 HA2 GLY 10 12.670 -0.615 -0.410
83 HA3 GLY 10 HA3 GLY 10 12.820 0.206 1.137
84 H LYS 11 H LYS 11 15.081 -0.385 -0.286
85 HA LYS 11 HA LYS 11 16.338 -2.859 0.125
86 HB2 LYS 11 HB2 LYS 11 17.144 -1.000 -1.258
87 HB3 LYS 11 HB3 LYS 11 17.607 -0.080 0.175
88 HG2 LYS 11 HG2 LYS 11 19.355 -1.769 0.679
89 HG3 LYS 11 HG3 LYS 11 18.814 -2.740 -0.709
90 HD2 LYS 11 HD2 LYS 11 19.206 -0.643 -2.151
91 HD3 LYS 11 HD3 LYS 11 20.017 0.076 -0.766
92 HE2 LYS 11 HE2 LYS 11 20.814 -2.463 -2.260
93 HE3 LYS 11 HE3 LYS 11 21.563 -0.880 -2.426
94 HZ1 LYS 11 HZ1 LYS 11 22.931 -2.019 -1.025
95 HZ2 LYS 11 HZ2 LYS 11 22.091 -1.150 0.050
96 HZ3 LYS 11 HZ3 LYS 11 21.746 -2.768 -0.198
97 H THR 12 H THR 12 16.227 -0.079 2.307
98 HA THR 12 HA THR 12 17.049 -1.802 4.571
99 HB THR 12 HB THR 12 18.918 -0.438 3.861
100 HG1 THR 12 HG1 THR 12 17.674 0.070 6.313
101 HG21 THR 12 HG21 THR 12 17.271 2.013 4.612
102 HG22 THR 12 HG22 THR 12 18.981 1.962 4.137
103 HG23 THR 12 HG23 THR 12 17.740 1.556 2.958
104 H LEU 13 H LEU 13 14.249 -0.787 3.477
105 HA LEU 13 HA LEU 13 13.351 0.185 6.133
106 HB2 LEU 13 HB2 LEU 13 12.623 1.285 3.401
107 HB3 LEU 13 HB3 LEU 13 11.629 1.552 4.829
108 HG LEU 13 HG LEU 13 14.545 2.401 4.671
109 HD11 LEU 13 HD11 LEU 13 13.184 3.549 2.938
110 HD12 LEU 13 HD12 LEU 13 12.050 4.079 4.191
111 HD13 LEU 13 HD13 LEU 13 13.723 4.660 4.223
112 HD21 LEU 13 HD21 LEU 13 13.898 3.912 6.541
113 HD22 LEU 13 HD22 LEU 13 12.273 3.203 6.556
114 HD23 LEU 13 HD23 LEU 13 13.691 2.219 6.982
115 H LYS 14 H LYS 14 11.311 -0.508 6.743
116 HA LYS 14 HA LYS 14 9.780 -2.267 4.985
117 HB2 LYS 14 HB2 LYS 14 11.134 -3.236 7.545
118 HB3 LYS 14 HB3 LYS 14 9.589 -3.911 7.007
119 HG2 LYS 14 HG2 LYS 14 10.652 -4.277 4.725
120 HG3 LYS 14 HG3 LYS 14 12.218 -3.934 5.484
121 HD2 LYS 14 HD2 LYS 14 12.092 -5.893 6.845
122 HD3 LYS 14 HD3 LYS 14 10.345 -6.048 6.623
123 HE2 LYS 14 HE2 LYS 14 11.613 -7.712 5.275
124 HE3 LYS 14 HE3 LYS 14 10.546 -6.668 4.331
125 HZ1 LYS 14 HZ1 LYS 14 12.449 -5.359 3.703
126 HZ2 LYS 14 HZ2 LYS 14 13.461 -6.296 4.591
127 HZ3 LYS 14 HZ3 LYS 14 12.669 -6.929 3.280
128 H GLY 15 H GLY 15 7.684 -2.828 5.948
129 HA2 GLY 15 HA2 GLY 15 6.499 -1.822 8.209
130 HA3 GLY 15 HA3 GLY 15 6.322 -0.515 7.007
131 H GLU 16 H GLU 16 4.130 -2.178 8.159
132 HA GLU 16 HA GLU 16 2.908 -2.992 5.681
133 HB2 GLU 16 HB2 GLU 16 2.207 -5.124 6.275
134 HB3 GLU 16 HB3 GLU 16 3.954 -5.097 6.506
135 HG2 GLU 16 HG2 GLU 16 3.655 -4.999 8.947
136 HG3 GLU 16 HG3 GLU 16 1.886 -4.950 8.728
137 H THR 17 H THR 17 0.701 -2.482 5.739
138 HA THR 17 HA THR 17 -0.438 -1.528 8.328
139 HB THR 17 HB THR 17 0.268 -0.145 5.726
140 HG1 THR 17 HG1 THR 17 1.474 -0.353 7.913
141 HG21 THR 17 HG21 THR 17 -0.835 1.920 6.234
142 HG22 THR 17 HG22 THR 17 -2.013 0.632 6.089
143 HG23 THR 17 HG23 THR 17 -1.507 1.250 7.714
144 H THR 18 H THR 18 -2.738 -1.080 8.075
145 HA THR 18 HA THR 18 -4.111 -2.275 5.793
146 HB THR 18 HB THR 18 -3.744 -3.981 7.757
147 HG1 THR 18 HG1 THR 18 -5.601 -4.926 7.076
148 HG21 THR 18 HG21 THR 18 -5.491 -4.052 9.427
149 HG22 THR 18 HG22 THR 18 -4.654 -2.499 9.589
150 HG23 THR 18 HG23 THR 18 -6.245 -2.579 8.789
151 H THR 19 H THR 19 -5.990 -1.109 5.344
152 HA THR 19 HA THR 19 -6.697 1.139 7.120
153 HB THR 19 HB THR 19 -6.841 2.540 5.018
154 HG1 THR 19 HG1 THR 19 -4.878 0.740 4.086
155 HG21 THR 19 HG21 THR 19 -4.448 3.171 5.041
156 HG22 THR 19 HG22 THR 19 -5.099 2.951 6.679
157 HG23 THR 19 HG23 THR 19 -4.080 1.691 5.947
158 H GLU 20 H GLU 20 -8.788 2.108 6.406
159 HA GLU 20 HA GLU 20 -10.635 0.245 5.051
160 HB2 GLU 20 HB2 GLU 20 -10.835 0.064 7.546
161 HB3 GLU 20 HB3 GLU 20 -11.048 1.817 7.636
162 HG2 GLU 20 HG2 GLU 20 -13.163 1.638 6.355
163 HG3 GLU 20 HG3 GLU 20 -12.930 -0.109 6.203
164 H ALA 21 H ALA 21 -12.224 1.488 3.806
165 HA ALA 21 HA ALA 21 -11.982 4.429 3.885
166 HB1 ALA 21 HB1 ALA 21 -11.575 4.571 1.473
167 HB2 ALA 21 HB2 ALA 21 -10.269 3.642 2.220
168 HB3 ALA 21 HB3 ALA 21 -11.550 2.801 1.332
169 H VAL 22 H VAL 22 -13.819 5.443 3.254
170 HA VAL 22 HA VAL 22 -16.285 4.077 3.263
171 HB VAL 22 HB VAL 22 -17.205 6.324 2.632
172 HG11 VAL 22 HG11 VAL 22 -15.126 6.388 4.869
173 HG12 VAL 22 HG12 VAL 22 -16.590 7.400 4.716
174 HG13 VAL 22 HG13 VAL 22 -16.739 5.655 4.978
175 HG21 VAL 22 HG21 VAL 22 -14.280 7.260 2.637
176 HG22 VAL 22 HG22 VAL 22 -15.391 7.287 1.248
177 HG23 VAL 22 HG23 VAL 22 -15.708 8.298 2.646
178 H ASP 23 H ASP 23 -14.415 5.520 0.586
179 HA ASP 23 HA ASP 23 -15.662 3.700 -1.378
180 HB2 ASP 23 HB2 ASP 23 -16.936 5.695 -1.586
181 HB3 ASP 23 HB3 ASP 23 -15.516 6.715 -1.450
182 H ALA 24 H ALA 24 -14.043 3.387 -3.205
183 HA ALA 24 HA ALA 24 -11.436 3.188 -2.168
184 HB1 ALA 24 HB1 ALA 24 -10.801 2.312 -4.353
185 HB2 ALA 24 HB2 ALA 24 -12.261 1.581 -3.741
186 HB3 ALA 24 HB3 ALA 24 -12.376 2.804 -5.032
187 H ALA 25 H ALA 25 -12.721 6.024 -3.790
188 HA ALA 25 HA ALA 25 -10.344 6.916 -5.023
189 HB1 ALA 25 HB1 ALA 25 -12.604 8.084 -5.112
190 HB2 ALA 25 HB2 ALA 25 -12.191 8.804 -3.529
191 HB3 ALA 25 HB3 ALA 25 -11.179 9.125 -4.929
192 H THR 26 H THR 26 -11.311 7.367 -1.566
193 HA THR 26 HA THR 26 -8.968 8.843 -0.890
194 HB THR 26 HB THR 26 -10.601 7.105 1.002
195 HG1 THR 26 HG1 THR 26 -11.973 8.545 -0.060
196 HG21 THR 26 HG21 THR 26 -8.885 9.602 1.432
197 HG22 THR 26 HG22 THR 26 -9.897 8.844 2.673
198 HG23 THR 26 HG23 THR 26 -8.519 7.966 2.020
199 H ALA 27 H ALA 27 -9.589 5.316 -1.144
200 HA ALA 27 HA ALA 27 -7.271 4.495 0.312
201 HB1 ALA 27 HB1 ALA 27 -8.681 3.016 -1.953
202 HB2 ALA 27 HB2 ALA 27 -7.569 2.343 -0.743
203 HB3 ALA 27 HB3 ALA 27 -9.146 2.959 -0.229
204 H GLU 28 H GLU 28 -7.856 4.963 -3.246
205 HA GLU 28 HA GLU 28 -5.162 4.450 -3.980
206 HB2 GLU 28 HB2 GLU 28 -6.995 4.484 -5.601
207 HB3 GLU 28 HB3 GLU 28 -7.237 6.211 -5.337
208 HG2 GLU 28 HG2 GLU 28 -5.012 6.714 -6.251
209 HG3 GLU 28 HG3 GLU 28 -4.626 4.992 -6.354
210 H LYS 29 H LYS 29 -6.738 7.477 -2.983
211 HA LYS 29 HA LYS 29 -4.554 9.245 -3.493
212 HB2 LYS 29 HB2 LYS 29 -6.758 10.113 -3.104
213 HB3 LYS 29 HB3 LYS 29 -6.902 9.284 -1.557
214 HG2 LYS 29 HG2 LYS 29 -5.209 10.731 -0.538
215 HG3 LYS 29 HG3 LYS 29 -4.938 11.533 -2.095
216 HD2 LYS 29 HD2 LYS 29 -7.338 12.225 -2.095
217 HD3 LYS 29 HD3 LYS 29 -7.535 11.483 -0.487
218 HE2 LYS 29 HE2 LYS 29 -5.848 13.002 0.454
219 HE3 LYS 29 HE3 LYS 29 -5.500 13.640 -1.161
220 HZ1 LYS 29 HZ1 LYS 29 -7.675 14.292 0.588
221 HZ2 LYS 29 HZ2 LYS 29 -6.951 15.168 -0.609
222 HZ3 LYS 29 HZ3 LYS 29 -8.121 14.050 -0.977
223 H VAL 30 H VAL 30 -5.531 7.554 -0.465
224 HA VAL 30 HA VAL 30 -3.297 8.548 0.945
225 HB VAL 30 HB VAL 30 -5.556 7.564 1.836
226 HG11 VAL 30 HG11 VAL 30 -5.304 5.335 2.870
227 HG12 VAL 30 HG12 VAL 30 -5.358 5.241 1.122
228 HG13 VAL 30 HG13 VAL 30 -3.823 5.066 1.987
229 HG21 VAL 30 HG21 VAL 30 -4.501 7.358 4.018
230 HG22 VAL 30 HG22 VAL 30 -2.912 7.201 3.271
231 HG23 VAL 30 HG23 VAL 30 -3.850 8.709 3.130
232 H PHE 31 H PHE 31 -3.689 5.592 -1.107
233 HA PHE 31 HA PHE 31 -1.410 4.263 -0.255
234 HB2 PHE 31 HB2 PHE 31 -2.630 4.508 -3.020
235 HB3 PHE 31 HB3 PHE 31 -1.261 3.490 -2.688
236 HD1 PHE 31 HD1 PHE 31 -3.506 3.333 0.190
237 HD2 PHE 31 HD2 PHE 31 -2.920 1.957 -3.860
238 HE1 PHE 31 HE1 PHE 31 -4.958 1.399 0.638
239 HE2 PHE 31 HE2 PHE 31 -4.341 0.012 -3.397
240 HZ PHE 31 HZ PHE 31 -5.352 -0.304 -1.141
241 H LYS 32 H LYS 32 -1.434 6.954 -2.718
242 HA LYS 32 HA LYS 32 1.407 6.636 -3.199
243 HB2 LYS 32 HB2 LYS 32 0.043 7.803 -4.800
244 HB3 LYS 32 HB3 LYS 32 -0.413 9.045 -3.626
245 HG2 LYS 32 HG2 LYS 32 1.872 9.897 -3.560
246 HG3 LYS 32 HG3 LYS 32 2.457 8.553 -4.560
247 HD2 LYS 32 HD2 LYS 32 1.231 9.350 -6.487
248 HD3 LYS 32 HD3 LYS 32 0.384 10.569 -5.514
249 HE2 LYS 32 HE2 LYS 32 2.599 11.662 -5.046
250 HE3 LYS 32 HE3 LYS 32 3.372 10.490 -6.114
251 HZ1 LYS 32 HZ1 LYS 32 2.037 11.358 -7.938
252 HZ2 LYS 32 HZ2 LYS 32 1.296 12.439 -6.937
253 HZ3 LYS 32 HZ3 LYS 32 2.897 12.565 -7.256
254 H GLN 33 H GLN 33 -0.319 8.934 -1.012
255 HA GLN 33 HA GLN 33 2.102 10.071 0.012
256 HB2 GLN 33 HB2 GLN 33 0.135 11.298 0.358
257 HB3 GLN 33 HB3 GLN 33 -0.767 9.937 0.991
258 HG2 GLN 33 HG2 GLN 33 1.606 11.148 2.496
259 HG3 GLN 33 HG3 GLN 33 -0.023 11.781 2.655
260 HE21 GLN 33 HE21 GLN 33 -1.258 8.677 4.275
261 HE22 GLN 33 HE22 GLN 33 -1.578 9.384 2.700
262 H TYR 34 H TYR 34 0.026 7.485 1.308
263 HA TYR 34 HA TYR 34 1.293 7.034 3.693
264 HB2 TYR 34 HB2 TYR 34 -0.888 6.084 3.026
265 HB3 TYR 34 HB3 TYR 34 -0.058 4.918 1.964
266 HD1 TYR 34 HD1 TYR 34 1.094 2.973 2.991
267 HD2 TYR 34 HD2 TYR 34 -0.521 6.126 5.410
268 HE1 TYR 34 HE1 TYR 34 2.038 1.909 4.921
269 HE2 TYR 34 HE2 TYR 34 0.405 5.028 7.430
270 HH TYR 34 HH TYR 34 1.577 1.929 7.521
271 H ALA 35 H ALA 35 1.874 5.293 0.600
272 HA ALA 35 HA ALA 35 4.080 3.819 1.657
273 HB1 ALA 35 HB1 ALA 35 3.145 4.393 -1.170
274 HB2 ALA 35 HB2 ALA 35 4.284 3.130 -0.672
275 HB3 ALA 35 HB3 ALA 35 2.615 3.053 -0.086
276 H ASN 36 H ASN 36 3.915 6.879 -0.323
277 HA ASN 36 HA ASN 36 6.666 6.939 -0.857
278 HB2 ASN 36 HB2 ASN 36 4.911 8.314 -1.944
279 HB3 ASN 36 HB3 ASN 36 4.958 9.386 -0.521
280 HD21 ASN 36 HD21 ASN 36 8.216 9.085 -3.157
281 HD22 ASN 36 HD22 ASN 36 7.178 7.745 -2.890
282 H ASP 37 H ASP 37 5.075 7.843 2.153
283 HA ASP 37 HA ASP 37 7.300 9.333 3.260
284 HB2 ASP 37 HB2 ASP 37 4.792 9.170 4.033
285 HB3 ASP 37 HB3 ASP 37 5.332 7.738 4.912
286 H ASN 38 H ASN 38 6.822 6.042 2.600
287 HA ASN 38 HA ASN 38 8.705 4.952 4.590
288 HB2 ASN 38 HB2 ASN 38 6.344 4.017 3.800
289 HB3 ASN 38 HB3 ASN 38 7.296 3.318 2.486
290 HD21 ASN 38 HD21 ASN 38 6.906 0.972 5.451
291 HD22 ASN 38 HD22 ASN 38 5.826 2.264 5.012
292 H GLY 39 H GLY 39 9.293 6.768 2.131
293 HA2 GLY 39 HA2 GLY 39 10.908 7.135 0.613
294 HA3 GLY 39 HA3 GLY 39 11.865 5.939 1.500
295 H VAL 40 H VAL 40 8.887 5.334 -0.386
296 HA VAL 40 HA VAL 40 10.342 3.314 -1.906
297 HB VAL 40 HB VAL 40 8.142 2.538 -2.592
298 HG11 VAL 40 HG11 VAL 40 8.100 3.211 0.371
299 HG12 VAL 40 HG12 VAL 40 7.327 1.857 -0.470
300 HG13 VAL 40 HG13 VAL 40 9.092 1.913 -0.349
301 HG21 VAL 40 HG21 VAL 40 7.136 5.009 -1.176
302 HG22 VAL 40 HG22 VAL 40 6.872 4.585 -2.867
303 HG23 VAL 40 HG23 VAL 40 6.114 3.633 -1.598
304 H ASP 41 H ASP 41 10.539 2.996 -3.915
305 HA ASP 41 HA ASP 41 9.411 4.550 -6.040
306 HB2 ASP 41 HB2 ASP 41 11.773 5.575 -5.314
307 HB3 ASP 41 HB3 ASP 41 12.398 4.216 -6.258
308 H GLY 42 H GLY 42 8.314 2.582 -6.827
309 HA2 GLY 42 HA2 GLY 42 9.905 0.379 -7.658
310 HA3 GLY 42 HA3 GLY 42 9.183 -0.004 -6.095
311 H GLU 43 H GLU 43 8.254 -1.769 -7.483
312 HA GLU 43 HA GLU 43 5.877 -0.960 -9.021
313 HB2 GLU 43 HB2 GLU 43 5.935 -2.845 -10.272
314 HB3 GLU 43 HB3 GLU 43 7.588 -2.257 -10.277
315 HG2 GLU 43 HG2 GLU 43 8.347 -4.053 -8.894
316 HG3 GLU 43 HG3 GLU 43 6.712 -4.490 -8.389
317 H TRP 44 H TRP 44 3.912 -2.026 -8.765
318 HA TRP 44 HA TRP 44 3.406 -3.022 -6.024
319 HB2 TRP 44 HB2 TRP 44 1.796 -1.484 -8.097
320 HB3 TRP 44 HB3 TRP 44 1.087 -2.097 -6.633
321 HD1 TRP 44 HD1 TRP 44 4.164 0.145 -7.475
322 HE1 TRP 44 HE1 TRP 44 4.454 1.855 -5.635
323 HE3 TRP 44 HE3 TRP 44 0.090 -0.972 -4.578
324 HZ2 TRP 44 HZ2 TRP 44 2.850 3.031 -3.572
325 HZ3 TRP 44 HZ3 TRP 44 -0.529 0.508 -2.670
326 HH2 TRP 44 HH2 TRP 44 0.869 2.531 -2.166
327 H THR 45 H THR 45 2.506 -5.076 -5.728
328 HA THR 45 HA THR 45 1.247 -6.499 -8.010
329 HB THR 45 HB THR 45 1.974 -8.538 -6.663
330 HG1 THR 45 HG1 THR 45 3.977 -7.804 -5.368
331 HG21 THR 45 HG21 THR 45 3.154 -7.791 -8.709
332 HG22 THR 45 HG22 THR 45 4.185 -6.726 -7.732
333 HG23 THR 45 HG23 THR 45 4.277 -8.488 -7.537
334 H TYR 46 H TYR 46 -0.593 -8.076 -7.167
335 HA TYR 46 HA TYR 46 -1.832 -6.959 -4.715
336 HB2 TYR 46 HB2 TYR 46 -2.648 -5.655 -6.616
337 HB3 TYR 46 HB3 TYR 46 -3.170 -7.136 -7.417
338 HD1 TYR 46 HD1 TYR 46 -3.574 -5.491 -4.023
339 HD2 TYR 46 HD2 TYR 46 -5.451 -7.585 -7.306
340 HE1 TYR 46 HE1 TYR 46 -5.771 -5.405 -2.843
341 HE2 TYR 46 HE2 TYR 46 -7.640 -7.379 -6.196
342 HH TYR 46 HH TYR 46 -8.717 -6.812 -4.201
343 H ASP 47 H ASP 47 -3.059 -8.207 -3.497
344 HA ASP 47 HA ASP 47 -3.810 -10.973 -4.295
345 HB2 ASP 47 HB2 ASP 47 -2.068 -10.064 -2.081
346 HB3 ASP 47 HB3 ASP 47 -3.409 -11.068 -1.542
347 H ASP 48 H ASP 48 -5.986 -10.431 -4.697
348 HA ASP 48 HA ASP 48 -7.501 -8.546 -3.279
349 HB2 ASP 48 HB2 ASP 48 -7.992 -9.633 -5.555
350 HB3 ASP 48 HB3 ASP 48 -8.693 -10.962 -4.637
351 H ALA 49 H ALA 49 -6.834 -11.812 -2.272
352 HA ALA 49 HA ALA 49 -9.079 -12.356 -0.711
353 HB1 ALA 49 HB1 ALA 49 -7.226 -13.967 -1.156
354 HB2 ALA 49 HB2 ALA 49 -6.174 -13.041 -0.074
355 HB3 ALA 49 HB3 ALA 49 -7.598 -13.858 0.582
356 H THR 50 H THR 50 -6.234 -10.455 0.171
357 HA THR 50 HA THR 50 -7.570 -9.402 2.607
358 HB THR 50 HB THR 50 -6.123 -10.826 3.605
359 HG1 THR 50 HG1 THR 50 -5.056 -8.373 3.389
360 HG21 THR 50 HG21 THR 50 -4.177 -10.545 1.305
361 HG22 THR 50 HG22 THR 50 -3.766 -11.343 2.835
362 HG23 THR 50 HG23 THR 50 -5.077 -11.969 1.849
363 H LYS 51 H LYS 51 -7.077 -8.514 -0.393
364 HA LYS 51 HA LYS 51 -6.505 -6.960 -1.609
365 HB2 LYS 51 HB2 LYS 51 -7.715 -5.466 0.708
366 HB3 LYS 51 HB3 LYS 51 -7.485 -4.768 -0.921
367 HG2 LYS 51 HG2 LYS 51 -8.902 -6.994 -1.558
368 HG3 LYS 51 HG3 LYS 51 -9.438 -6.850 0.108
369 HD2 LYS 51 HD2 LYS 51 -10.221 -4.524 -0.361
370 HD3 LYS 51 HD3 LYS 51 -9.634 -4.673 -2.032
371 HE2 LYS 51 HE2 LYS 51 -11.126 -6.750 -2.227
372 HE3 LYS 51 HE3 LYS 51 -11.879 -6.241 -0.713
373 HZ1 LYS 51 HZ1 LYS 51 -12.449 -4.128 -1.894
374 HZ2 LYS 51 HZ2 LYS 51 -11.847 -4.763 -3.284
375 HZ3 LYS 51 HZ3 LYS 51 -13.139 -5.437 -2.548
376 H THR 52 H THR 52 -4.388 -8.023 -0.479
377 HA THR 52 HA THR 52 -2.678 -6.081 0.740
378 HB THR 52 HB THR 52 -2.054 -8.890 -0.202
379 HG1 THR 52 HG1 THR 52 -2.303 -9.290 2.046
380 HG21 THR 52 HG21 THR 52 -0.001 -7.516 0.128
381 HG22 THR 52 HG22 THR 52 -0.579 -7.044 1.736
382 HG23 THR 52 HG23 THR 52 -0.172 -8.742 1.402
383 H PHE 53 H PHE 53 -1.669 -4.628 -0.245
384 HA PHE 53 HA PHE 53 -0.824 -4.789 -3.086
385 HB2 PHE 53 HB2 PHE 53 -1.527 -2.533 -1.170
386 HB3 PHE 53 HB3 PHE 53 -0.540 -2.251 -2.588
387 HD1 PHE 53 HD1 PHE 53 -1.470 -2.608 -4.909
388 HD2 PHE 53 HD2 PHE 53 -3.928 -2.907 -1.376
389 HE1 PHE 53 HE1 PHE 53 -3.486 -2.233 -6.290
390 HE2 PHE 53 HE2 PHE 53 -5.953 -2.553 -2.776
391 HZ PHE 53 HZ PHE 53 -5.724 -2.158 -5.224
392 H THR 54 H THR 54 1.195 -5.557 -3.108
393 HA THR 54 HA THR 54 3.074 -4.928 -0.875
394 HB THR 54 HB THR 54 3.011 -7.239 -2.865
395 HG1 THR 54 HG1 THR 54 2.321 -8.434 -1.196
396 HG21 THR 54 HG21 THR 54 4.744 -8.268 -1.439
397 HG22 THR 54 HG22 THR 54 5.335 -6.765 -2.150
398 HG23 THR 54 HG23 THR 54 4.815 -6.795 -0.447
399 H VAL 55 H VAL 55 5.080 -4.084 -1.371
400 HA VAL 55 HA VAL 55 5.668 -3.434 -4.191
401 HB VAL 55 HB VAL 55 5.704 -1.588 -1.783
402 HG11 VAL 55 HG11 VAL 55 7.859 -1.242 -2.942
403 HG12 VAL 55 HG12 VAL 55 7.010 -1.059 -4.493
404 HG13 VAL 55 HG13 VAL 55 6.793 0.129 -3.195
405 HG21 VAL 55 HG21 VAL 55 3.582 -1.688 -3.105
406 HG22 VAL 55 HG22 VAL 55 4.368 -0.115 -3.247
407 HG23 VAL 55 HG23 VAL 55 4.512 -1.295 -4.570
408 H THR 56 H THR 56 7.763 -3.789 -4.707
409 HA THR 56 HA THR 56 9.651 -4.593 -2.567
410 HB THR 56 HB THR 56 9.184 -5.956 -5.239
411 HG1 THR 56 HG1 THR 56 8.586 -7.717 -3.878
412 HG21 THR 56 HG21 THR 56 10.805 -7.604 -4.456
413 HG22 THR 56 HG22 THR 56 11.557 -6.012 -4.469
414 HG23 THR 56 HG23 THR 56 11.020 -6.712 -2.923
415 H GLU 57 H GLU 57 11.380 -3.170 -2.631
416 HA GLU 57 HA GLU 57 11.781 -1.473 -4.999
417 HB2 GLU 57 HB2 GLU 57 12.074 -0.608 -2.651
418 HB3 GLU 57 HB3 GLU 57 13.404 -1.718 -2.423
419 HG2 GLU 57 HG2 GLU 57 14.369 -0.524 -4.612
420 HG3 GLU 57 HG3 GLU 57 13.275 0.766 -4.112
Start of MODEL 2
1 H1 MET 1 H MET 1 -15.593 1.424 2.737
2 HA MET 1 HA MET 1 -17.467 -0.406 1.406
3 HB2 MET 1 HB2 MET 1 -16.761 1.258 -0.087
4 HB3 MET 1 HB3 MET 1 -15.068 1.090 0.364
5 HG2 MET 1 HG2 MET 1 -15.020 -1.102 -0.780
6 HG3 MET 1 HG3 MET 1 -16.760 -0.977 -1.114
7 HE1 MET 1 HE1 MET 1 -14.419 -1.497 -3.262
8 HE2 MET 1 HE2 MET 1 -16.067 -1.325 -3.919
9 HE3 MET 1 HE3 MET 1 -14.743 -0.362 -4.591
10 H GLY 2 H GLY 2 -13.747 -0.449 2.173
11 HA2 GLY 2 HA2 GLY 2 -14.248 -2.986 3.404
12 HA3 GLY 2 HA3 GLY 2 -13.524 -3.139 1.794
13 H THR 3 H THR 3 -12.049 -4.144 3.630
14 HA THR 3 HA THR 3 -10.106 -2.184 4.690
15 HB THR 3 HB THR 3 -10.693 -3.750 6.375
16 HG1 THR 3 HG1 THR 3 -8.518 -3.587 6.428
17 HG21 THR 3 HG21 THR 3 -11.778 -5.527 5.134
18 HG22 THR 3 HG22 THR 3 -10.241 -6.000 4.371
19 HG23 THR 3 HG23 THR 3 -10.488 -6.211 6.125
20 H TYR 4 H TYR 4 -7.936 -2.251 3.968
21 HA TYR 4 HA TYR 4 -7.236 -4.000 1.699
22 HB2 TYR 4 HB2 TYR 4 -6.978 -0.960 1.746
23 HB3 TYR 4 HB3 TYR 4 -6.284 -2.019 0.524
24 HD1 TYR 4 HD1 TYR 4 -7.647 -2.958 -1.245
25 HD2 TYR 4 HD2 TYR 4 -9.545 -0.691 1.928
26 HE1 TYR 4 HE1 TYR 4 -9.800 -2.899 -2.529
27 HE2 TYR 4 HE2 TYR 4 -11.608 -0.687 0.707
28 HH TYR 4 HH TYR 4 -12.155 -2.629 -2.147
29 H LYS 5 H LYS 5 -5.080 -4.745 1.968
30 HA LYS 5 HA LYS 5 -3.710 -3.610 4.379
31 HB2 LYS 5 HB2 LYS 5 -4.331 -6.060 4.073
32 HB3 LYS 5 HB3 LYS 5 -2.987 -6.153 2.939
33 HG2 LYS 5 HG2 LYS 5 -1.409 -5.489 4.698
34 HG3 LYS 5 HG3 LYS 5 -2.762 -5.261 5.833
35 HD2 LYS 5 HD2 LYS 5 -3.392 -7.604 5.645
36 HD3 LYS 5 HD3 LYS 5 -2.120 -7.897 4.440
37 HE2 LYS 5 HE2 LYS 5 -0.379 -7.488 6.046
38 HE3 LYS 5 HE3 LYS 5 -1.539 -6.877 7.248
39 HZ1 LYS 5 HZ1 LYS 5 -1.558 -9.647 6.223
40 HZ2 LYS 5 HZ2 LYS 5 -0.839 -9.192 7.622
41 HZ3 LYS 5 HZ3 LYS 5 -2.476 -9.038 7.422
42 H LEU 6 H LEU 6 -1.696 -2.698 4.279
43 HA LEU 6 HA LEU 6 -0.474 -2.239 1.576
44 HB2 LEU 6 HB2 LEU 6 -1.215 -0.357 3.791
45 HB3 LEU 6 HB3 LEU 6 0.243 -0.001 2.880
46 HG LEU 6 HG LEU 6 -2.275 -0.626 1.330
47 HD11 LEU 6 HD11 LEU 6 -2.961 1.005 3.020
48 HD12 LEU 6 HD12 LEU 6 -1.610 2.073 2.570
49 HD13 LEU 6 HD13 LEU 6 -2.924 1.735 1.421
50 HD21 LEU 6 HD21 LEU 6 0.117 1.244 0.893
51 HD22 LEU 6 HD22 LEU 6 -0.108 -0.350 0.139
52 HD23 LEU 6 HD23 LEU 6 -1.223 0.974 -0.240
53 H ILE 7 H ILE 7 1.407 -3.361 1.518
54 HA ILE 7 HA ILE 7 3.340 -2.970 3.691
55 HB ILE 7 HB ILE 7 2.431 -5.282 3.751
56 HG12 ILE 7 HG12 ILE 7 5.377 -5.217 2.973
57 HG13 ILE 7 HG13 ILE 7 4.757 -4.575 4.481
58 HG21 ILE 7 HG21 ILE 7 3.947 -5.777 1.144
59 HG22 ILE 7 HG22 ILE 7 3.010 -6.954 2.069
60 HG23 ILE 7 HG23 ILE 7 2.198 -5.633 1.222
61 HD11 ILE 7 HD11 ILE 7 4.765 -7.454 3.578
62 HD12 ILE 7 HD12 ILE 7 5.514 -6.742 5.014
63 HD13 ILE 7 HD13 ILE 7 3.755 -6.900 4.940
64 H LEU 8 H LEU 8 5.235 -2.248 3.174
65 HA LEU 8 HA LEU 8 5.997 -1.906 0.326
66 HB2 LEU 8 HB2 LEU 8 6.521 -0.037 2.682
67 HB3 LEU 8 HB3 LEU 8 7.070 0.175 1.034
68 HG LEU 8 HG LEU 8 5.335 1.697 1.382
69 HD11 LEU 8 HD11 LEU 8 3.698 1.112 -0.362
70 HD12 LEU 8 HD12 LEU 8 5.327 0.608 -0.828
71 HD13 LEU 8 HD13 LEU 8 4.153 -0.590 -0.246
72 HD21 LEU 8 HD21 LEU 8 4.188 0.527 3.305
73 HD22 LEU 8 HD22 LEU 8 3.156 1.368 2.124
74 HD23 LEU 8 HD23 LEU 8 3.279 -0.392 2.093
75 H ASN 9 H ASN 9 8.121 -2.464 -0.141
76 HA ASN 9 HA ASN 9 9.843 -3.441 2.092
77 HB2 ASN 9 HB2 ASN 9 9.312 -4.787 -0.593
78 HB3 ASN 9 HB3 ASN 9 10.721 -5.121 0.410
79 HD21 ASN 9 HD21 ASN 9 7.313 -6.958 1.382
80 HD22 ASN 9 HD22 ASN 9 7.427 -6.038 -0.104
81 H GLY 10 H GLY 10 11.624 -2.243 2.181
82 HA2 GLY 10 HA2 GLY 10 12.751 -1.037 -0.274
83 HA3 GLY 10 HA3 GLY 10 12.833 -0.344 1.356
84 H LYS 11 H LYS 11 15.194 -0.700 -0.032
85 HA LYS 11 HA LYS 11 16.462 -3.177 0.194
86 HB2 LYS 11 HB2 LYS 11 17.305 -1.260 -1.042
87 HB3 LYS 11 HB3 LYS 11 17.561 -0.347 0.450
88 HG2 LYS 11 HG2 LYS 11 19.348 -1.886 1.129
89 HG3 LYS 11 HG3 LYS 11 18.976 -2.957 -0.220
90 HD2 LYS 11 HD2 LYS 11 20.932 -1.652 -0.794
91 HD3 LYS 11 HD3 LYS 11 19.582 -1.141 -1.823
92 HE2 LYS 11 HE2 LYS 11 19.201 0.814 -0.287
93 HE3 LYS 11 HE3 LYS 11 20.583 0.284 0.675
94 HZ1 LYS 11 HZ1 LYS 11 21.346 1.940 -0.747
95 HZ2 LYS 11 HZ2 LYS 11 21.939 0.560 -1.366
96 HZ3 LYS 11 HZ3 LYS 11 20.614 1.285 -2.075
97 H THR 12 H THR 12 16.407 -0.562 2.669
98 HA THR 12 HA THR 12 17.073 -2.618 4.695
99 HB THR 12 HB THR 12 19.013 -1.235 4.126
100 HG1 THR 12 HG1 THR 12 17.921 -1.424 6.674
101 HG21 THR 12 HG21 THR 12 17.735 0.937 3.843
102 HG22 THR 12 HG22 THR 12 17.632 1.037 5.610
103 HG23 THR 12 HG23 THR 12 19.212 1.034 4.790
104 H LEU 13 H LEU 13 14.500 -0.856 3.732
105 HA LEU 13 HA LEU 13 13.573 -0.403 6.523
106 HB2 LEU 13 HB2 LEU 13 12.985 1.380 4.122
107 HB3 LEU 13 HB3 LEU 13 12.280 1.506 5.724
108 HG LEU 13 HG LEU 13 15.015 1.648 6.268
109 HD11 LEU 13 HD11 LEU 13 15.952 3.294 4.756
110 HD12 LEU 13 HD12 LEU 13 15.440 1.883 3.810
111 HD13 LEU 13 HD13 LEU 13 14.448 3.353 3.807
112 HD21 LEU 13 HD21 LEU 13 14.566 4.020 6.731
113 HD22 LEU 13 HD22 LEU 13 13.034 3.924 5.833
114 HD23 LEU 13 HD23 LEU 13 13.262 2.993 7.330
115 H LYS 14 H LYS 14 11.314 -0.665 6.780
116 HA LYS 14 HA LYS 14 9.802 -1.883 4.560
117 HB2 LYS 14 HB2 LYS 14 10.329 -3.274 7.232
118 HB3 LYS 14 HB3 LYS 14 9.103 -3.772 6.072
119 HG2 LYS 14 HG2 LYS 14 10.991 -4.010 4.350
120 HG3 LYS 14 HG3 LYS 14 12.126 -3.845 5.701
121 HD2 LYS 14 HD2 LYS 14 9.951 -5.942 5.395
122 HD3 LYS 14 HD3 LYS 14 11.676 -6.198 5.112
123 HE2 LYS 14 HE2 LYS 14 12.228 -6.084 7.377
124 HE3 LYS 14 HE3 LYS 14 10.747 -5.226 7.827
125 HZ1 LYS 14 HZ1 LYS 14 10.847 -7.640 8.398
126 HZ2 LYS 14 HZ2 LYS 14 9.481 -7.156 7.610
127 HZ3 LYS 14 HZ3 LYS 14 10.656 -7.969 6.789
128 H GLY 15 H GLY 15 7.458 -2.117 5.158
129 HA2 GLY 15 HA2 GLY 15 6.509 -0.778 7.569
130 HA3 GLY 15 HA3 GLY 15 6.239 0.105 6.049
131 H GLU 16 H GLU 16 4.551 -1.859 8.064
132 HA GLU 16 HA GLU 16 3.027 -3.018 5.820
133 HB2 GLU 16 HB2 GLU 16 2.736 -5.130 6.863
134 HB3 GLU 16 HB3 GLU 16 4.452 -4.854 6.607
135 HG2 GLU 16 HG2 GLU 16 4.837 -4.461 8.964
136 HG3 GLU 16 HG3 GLU 16 3.106 -4.549 9.305
137 H THR 17 H THR 17 0.894 -2.465 5.996
138 HA THR 17 HA THR 17 -0.203 -2.100 8.717
139 HB THR 17 HB THR 17 0.978 0.041 8.135
140 HG1 THR 17 HG1 THR 17 -0.701 1.302 8.845
141 HG21 THR 17 HG21 THR 17 -1.241 0.444 6.077
142 HG22 THR 17 HG22 THR 17 0.045 1.573 6.520
143 HG23 THR 17 HG23 THR 17 0.456 0.085 5.681
144 H THR 18 H THR 18 -2.526 -1.023 8.304
145 HA THR 18 HA THR 18 -3.891 -2.389 6.079
146 HB THR 18 HB THR 18 -4.033 -3.827 8.131
147 HG1 THR 18 HG1 THR 18 -5.700 -4.342 7.082
148 HG21 THR 18 HG21 THR 18 -5.554 -3.175 9.946
149 HG22 THR 18 HG22 THR 18 -4.147 -2.094 9.896
150 HG23 THR 18 HG23 THR 18 -5.720 -1.550 9.270
151 H THR 19 H THR 19 -5.980 -1.379 5.661
152 HA THR 19 HA THR 19 -6.447 1.293 6.764
153 HB THR 19 HB THR 19 -6.567 2.190 4.406
154 HG1 THR 19 HG1 THR 19 -5.524 -0.319 3.861
155 HG21 THR 19 HG21 THR 19 -4.314 2.802 4.159
156 HG22 THR 19 HG22 THR 19 -4.663 2.753 5.895
157 HG23 THR 19 HG23 THR 19 -3.733 1.437 5.159
158 H GLU 20 H GLU 20 -8.503 2.133 5.994
159 HA GLU 20 HA GLU 20 -10.361 0.184 4.817
160 HB2 GLU 20 HB2 GLU 20 -10.677 0.052 7.219
161 HB3 GLU 20 HB3 GLU 20 -10.818 1.817 7.333
162 HG2 GLU 20 HG2 GLU 20 -12.898 1.838 6.139
163 HG3 GLU 20 HG3 GLU 20 -12.671 0.171 5.587
164 H ALA 21 H ALA 21 -12.047 1.324 3.549
165 HA ALA 21 HA ALA 21 -11.590 4.234 3.313
166 HB1 ALA 21 HB1 ALA 21 -11.550 2.359 0.911
167 HB2 ALA 21 HB2 ALA 21 -11.216 4.101 0.931
168 HB3 ALA 21 HB3 ALA 21 -10.080 2.995 1.681
169 H VAL 22 H VAL 22 -13.443 5.397 2.650
170 HA VAL 22 HA VAL 22 -15.968 4.065 3.074
171 HB VAL 22 HB VAL 22 -17.004 6.173 2.254
172 HG11 VAL 22 HG11 VAL 22 -14.925 6.547 4.435
173 HG12 VAL 22 HG12 VAL 22 -16.392 7.523 4.189
174 HG13 VAL 22 HG13 VAL 22 -16.541 5.813 4.615
175 HG21 VAL 22 HG21 VAL 22 -15.744 8.212 1.960
176 HG22 VAL 22 HG22 VAL 22 -14.211 7.361 2.135
177 HG23 VAL 22 HG23 VAL 22 -15.252 7.050 0.724
178 H ASP 23 H ASP 23 -14.080 5.061 0.273
179 HA ASP 23 HA ASP 23 -15.566 3.237 -1.531
180 HB2 ASP 23 HB2 ASP 23 -16.460 5.536 -1.865
181 HB3 ASP 23 HB3 ASP 23 -14.810 6.151 -2.052
182 H ALA 24 H ALA 24 -14.038 2.537 -3.317
183 HA ALA 24 HA ALA 24 -11.375 2.294 -2.328
184 HB1 ALA 24 HB1 ALA 24 -10.920 1.045 -4.365
185 HB2 ALA 24 HB2 ALA 24 -12.432 0.529 -3.633
186 HB3 ALA 24 HB3 ALA 24 -12.460 1.579 -5.073
187 H ALA 25 H ALA 25 -12.726 4.824 -4.335
188 HA ALA 25 HA ALA 25 -10.436 5.499 -5.842
189 HB1 ALA 25 HB1 ALA 25 -12.610 6.503 -6.273
190 HB2 ALA 25 HB2 ALA 25 -12.613 7.274 -4.673
191 HB3 ALA 25 HB3 ALA 25 -11.443 7.782 -5.905
192 H THR 26 H THR 26 -11.360 6.820 -2.571
193 HA THR 26 HA THR 26 -9.077 8.443 -2.404
194 HB THR 26 HB THR 26 -10.191 7.367 0.141
195 HG1 THR 26 HG1 THR 26 -11.632 9.055 -1.645
196 HG21 THR 26 HG21 THR 26 -9.696 10.201 -0.855
197 HG22 THR 26 HG22 THR 26 -10.085 9.712 0.812
198 HG23 THR 26 HG23 THR 26 -8.545 9.245 0.088
199 H ALA 27 H ALA 27 -9.295 4.972 -1.882
200 HA ALA 27 HA ALA 27 -7.043 4.650 -0.178
201 HB1 ALA 27 HB1 ALA 27 -7.976 2.782 -2.393
202 HB2 ALA 27 HB2 ALA 27 -6.986 2.360 -0.992
203 HB3 ALA 27 HB3 ALA 27 -8.676 2.838 -0.751
204 H GLU 28 H GLU 28 -7.359 4.971 -3.747
205 HA GLU 28 HA GLU 28 -4.691 4.515 -4.450
206 HB2 GLU 28 HB2 GLU 28 -6.694 4.628 -5.933
207 HB3 GLU 28 HB3 GLU 28 -6.680 6.386 -5.766
208 HG2 GLU 28 HG2 GLU 28 -4.447 6.484 -6.820
209 HG3 GLU 28 HG3 GLU 28 -4.395 4.716 -6.891
210 H LYS 29 H LYS 29 -6.176 7.405 -3.050
211 HA LYS 29 HA LYS 29 -3.940 9.160 -3.629
212 HB2 LYS 29 HB2 LYS 29 -6.159 9.457 -1.549
213 HB3 LYS 29 HB3 LYS 29 -4.961 10.672 -1.967
214 HG2 LYS 29 HG2 LYS 29 -5.799 10.663 -4.330
215 HG3 LYS 29 HG3 LYS 29 -7.042 9.487 -3.859
216 HD2 LYS 29 HD2 LYS 29 -8.029 11.671 -3.927
217 HD3 LYS 29 HD3 LYS 29 -7.938 11.157 -2.233
218 HE2 LYS 29 HE2 LYS 29 -5.852 12.515 -1.961
219 HE3 LYS 29 HE3 LYS 29 -5.967 13.006 -3.659
220 HZ1 LYS 29 HZ1 LYS 29 -7.983 13.558 -1.579
221 HZ2 LYS 29 HZ2 LYS 29 -6.883 14.651 -2.163
222 HZ3 LYS 29 HZ3 LYS 29 -8.074 14.042 -3.142
223 H VAL 30 H VAL 30 -5.051 7.361 -0.713
224 HA VAL 30 HA VAL 30 -2.872 8.227 0.884
225 HB VAL 30 HB VAL 30 -5.057 7.207 1.724
226 HG11 VAL 30 HG11 VAL 30 -3.497 4.598 1.532
227 HG12 VAL 30 HG12 VAL 30 -4.993 4.882 2.463
228 HG13 VAL 30 HG13 VAL 30 -5.035 4.993 0.705
229 HG21 VAL 30 HG21 VAL 30 -3.184 7.989 3.126
230 HG22 VAL 30 HG22 VAL 30 -2.417 6.398 2.998
231 HG23 VAL 30 HG23 VAL 30 -3.976 6.577 3.820
232 H PHE 31 H PHE 31 -3.140 5.534 -1.450
233 HA PHE 31 HA PHE 31 -0.886 4.057 -0.682
234 HB2 PHE 31 HB2 PHE 31 -1.859 4.778 -3.482
235 HB3 PHE 31 HB3 PHE 31 -0.682 3.538 -3.148
236 HD1 PHE 31 HD1 PHE 31 -2.728 2.880 -0.480
237 HD2 PHE 31 HD2 PHE 31 -2.865 2.861 -4.792
238 HE1 PHE 31 HE1 PHE 31 -4.593 1.259 -0.416
239 HE2 PHE 31 HE2 PHE 31 -4.773 1.280 -4.715
240 HZ PHE 31 HZ PHE 31 -5.664 0.519 -2.526
241 H LYS 32 H LYS 32 -0.948 7.056 -2.727
242 HA LYS 32 HA LYS 32 1.944 6.969 -3.028
243 HB2 LYS 32 HB2 LYS 32 0.262 8.095 -4.589
244 HB3 LYS 32 HB3 LYS 32 0.144 9.405 -3.412
245 HG2 LYS 32 HG2 LYS 32 2.590 9.804 -3.628
246 HG3 LYS 32 HG3 LYS 32 2.719 8.454 -4.756
247 HD2 LYS 32 HD2 LYS 32 1.099 10.993 -5.207
248 HD3 LYS 32 HD3 LYS 32 2.689 10.681 -5.887
249 HE2 LYS 32 HE2 LYS 32 0.205 8.993 -6.447
250 HE3 LYS 32 HE3 LYS 32 0.786 10.292 -7.489
251 HZ1 LYS 32 HZ1 LYS 32 2.454 7.921 -6.859
252 HZ2 LYS 32 HZ2 LYS 32 1.449 8.040 -8.153
253 HZ3 LYS 32 HZ3 LYS 32 2.716 9.063 -7.999
254 H GLN 33 H GLN 33 -0.257 8.966 -1.003
255 HA GLN 33 HA GLN 33 1.728 10.513 0.234
256 HB2 GLN 33 HB2 GLN 33 -0.691 10.957 0.216
257 HB3 GLN 33 HB3 GLN 33 -0.978 9.559 1.259
258 HG2 GLN 33 HG2 GLN 33 0.309 10.666 3.088
259 HG3 GLN 33 HG3 GLN 33 0.572 12.065 2.035
260 HE21 GLN 33 HE21 GLN 33 -3.001 11.607 3.982
261 HE22 GLN 33 HE22 GLN 33 -1.663 10.528 4.247
262 H TYR 34 H TYR 34 0.247 7.468 1.579
263 HA TYR 34 HA TYR 34 1.960 7.544 3.898
264 HB2 TYR 34 HB2 TYR 34 -0.056 6.424 4.213
265 HB3 TYR 34 HB3 TYR 34 0.070 5.521 2.696
266 HD1 TYR 34 HD1 TYR 34 0.441 3.261 2.913
267 HD2 TYR 34 HD2 TYR 34 2.182 5.909 5.817
268 HE1 TYR 34 HE1 TYR 34 1.619 1.333 3.978
269 HE2 TYR 34 HE2 TYR 34 3.332 4.012 6.894
270 HH TYR 34 HH TYR 34 3.914 1.755 6.659
271 H ALA 35 H ALA 35 2.056 5.572 0.812
272 HA ALA 35 HA ALA 35 4.329 4.139 1.692
273 HB1 ALA 35 HB1 ALA 35 3.674 4.713 -1.201
274 HB2 ALA 35 HB2 ALA 35 4.518 3.319 -0.492
275 HB3 ALA 35 HB3 ALA 35 2.796 3.516 -0.194
276 H ASN 36 H ASN 36 4.081 7.394 0.144
277 HA ASN 36 HA ASN 36 6.845 7.600 -0.463
278 HB2 ASN 36 HB2 ASN 36 5.244 9.187 -1.338
279 HB3 ASN 36 HB3 ASN 36 4.867 9.769 0.304
280 HD21 ASN 36 HD21 ASN 36 8.548 10.686 -1.412
281 HD22 ASN 36 HD22 ASN 36 7.637 9.302 -1.964
282 H ASP 37 H ASP 37 5.144 7.854 2.646
283 HA ASP 37 HA ASP 37 7.198 9.206 4.111
284 HB2 ASP 37 HB2 ASP 37 4.748 8.732 4.786
285 HB3 ASP 37 HB3 ASP 37 5.295 7.117 5.256
286 H ASN 38 H ASN 38 6.842 5.957 2.930
287 HA ASN 38 HA ASN 38 8.901 4.763 4.660
288 HB2 ASN 38 HB2 ASN 38 6.891 3.771 2.677
289 HB3 ASN 38 HB3 ASN 38 8.384 2.880 2.754
290 HD21 ASN 38 HD21 ASN 38 5.658 1.781 5.303
291 HD22 ASN 38 HD22 ASN 38 5.405 2.503 3.739
292 H GLY 39 H GLY 39 9.016 6.788 1.945
293 HA2 GLY 39 HA2 GLY 39 10.743 7.390 0.565
294 HA3 GLY 39 HA3 GLY 39 11.818 6.382 1.551
295 H VAL 40 H VAL 40 8.941 5.278 -0.157
296 HA VAL 40 HA VAL 40 10.272 3.093 -1.415
297 HB VAL 40 HB VAL 40 7.991 2.645 -2.279
298 HG11 VAL 40 HG11 VAL 40 7.941 3.573 0.602
299 HG12 VAL 40 HG12 VAL 40 6.810 2.449 -0.168
300 HG13 VAL 40 HG13 VAL 40 8.511 1.994 0.025
301 HG21 VAL 40 HG21 VAL 40 7.439 5.507 -1.370
302 HG22 VAL 40 HG22 VAL 40 7.049 4.730 -2.911
303 HG23 VAL 40 HG23 VAL 40 6.156 4.340 -1.442
304 H ASP 41 H ASP 41 10.648 2.588 -3.496
305 HA ASP 41 HA ASP 41 9.953 4.390 -5.713
306 HB2 ASP 41 HB2 ASP 41 12.215 5.054 -5.014
307 HB3 ASP 41 HB3 ASP 41 12.768 3.374 -5.114
308 H GLY 42 H GLY 42 8.333 2.700 -6.404
309 HA2 GLY 42 HA2 GLY 42 9.554 0.461 -7.701
310 HA3 GLY 42 HA3 GLY 42 8.864 -0.069 -6.167
311 H GLU 43 H GLU 43 7.795 -1.410 -7.791
312 HA GLU 43 HA GLU 43 5.516 -0.383 -9.309
313 HB2 GLU 43 HB2 GLU 43 5.470 -2.584 -10.301
314 HB3 GLU 43 HB3 GLU 43 7.121 -1.959 -10.348
315 HG2 GLU 43 HG2 GLU 43 7.527 -3.342 -8.191
316 HG3 GLU 43 HG3 GLU 43 5.974 -4.109 -8.531
317 H TRP 44 H TRP 44 3.374 -1.141 -8.958
318 HA TRP 44 HA TRP 44 2.854 -2.212 -6.228
319 HB2 TRP 44 HB2 TRP 44 1.314 -0.382 -8.086
320 HB3 TRP 44 HB3 TRP 44 0.596 -1.129 -6.662
321 HD1 TRP 44 HD1 TRP 44 3.807 0.953 -7.345
322 HE1 TRP 44 HE1 TRP 44 4.391 2.243 -5.313
323 HE3 TRP 44 HE3 TRP 44 -0.135 -0.451 -4.461
324 HZ2 TRP 44 HZ2 TRP 44 2.918 3.098 -2.812
325 HZ3 TRP 44 HZ3 TRP 44 -0.522 0.559 -2.254
326 HH2 TRP 44 HH2 TRP 44 1.035 2.337 -1.394
327 H THR 45 H THR 45 1.891 -4.097 -5.951
328 HA THR 45 HA THR 45 0.264 -5.295 -8.119
329 HB THR 45 HB THR 45 2.227 -6.734 -6.288
330 HG1 THR 45 HG1 THR 45 3.507 -6.828 -8.182
331 HG21 THR 45 HG21 THR 45 0.404 -8.171 -7.170
332 HG22 THR 45 HG22 THR 45 0.772 -7.631 -8.822
333 HG23 THR 45 HG23 THR 45 1.956 -8.586 -7.908
334 H TYR 46 H TYR 46 -1.477 -6.768 -7.193
335 HA TYR 46 HA TYR 46 -2.050 -6.292 -4.358
336 HB2 TYR 46 HB2 TYR 46 -3.221 -4.524 -5.270
337 HB3 TYR 46 HB3 TYR 46 -3.627 -5.354 -6.740
338 HD1 TYR 46 HD1 TYR 46 -4.623 -4.720 -3.291
339 HD2 TYR 46 HD2 TYR 46 -5.518 -6.948 -6.862
340 HE1 TYR 46 HE1 TYR 46 -6.875 -5.216 -2.401
341 HE2 TYR 46 HE2 TYR 46 -7.797 -7.434 -6.001
342 HH TYR 46 HH TYR 46 -8.877 -6.268 -2.784
343 H ASP 47 H ASP 47 -3.469 -7.743 -3.388
344 HA ASP 47 HA ASP 47 -4.285 -10.115 -4.914
345 HB2 ASP 47 HB2 ASP 47 -2.192 -10.853 -3.951
346 HB3 ASP 47 HB3 ASP 47 -2.727 -10.402 -2.335
347 H ASP 48 H ASP 48 -6.425 -10.427 -4.626
348 HA ASP 48 HA ASP 48 -7.942 -8.858 -2.809
349 HB2 ASP 48 HB2 ASP 48 -8.779 -9.690 -4.966
350 HB3 ASP 48 HB3 ASP 48 -8.748 -11.346 -4.346
351 H ALA 49 H ALA 49 -6.348 -11.915 -2.190
352 HA ALA 49 HA ALA 49 -8.117 -13.095 -0.415
353 HB1 ALA 49 HB1 ALA 49 -6.230 -14.220 0.601
354 HB2 ALA 49 HB2 ALA 49 -5.970 -14.114 -1.148
355 HB3 ALA 49 HB3 ALA 49 -5.101 -13.015 -0.041
356 H THR 50 H THR 50 -5.928 -10.401 0.279
357 HA THR 50 HA THR 50 -7.415 -9.952 2.818
358 HB THR 50 HB THR 50 -5.692 -10.307 4.103
359 HG1 THR 50 HG1 THR 50 -5.210 -8.131 3.792
360 HG21 THR 50 HG21 THR 50 -3.847 -10.669 1.705
361 HG22 THR 50 HG22 THR 50 -3.462 -11.048 3.391
362 HG23 THR 50 HG23 THR 50 -4.728 -11.959 2.567
363 H LYS 51 H LYS 51 -6.717 -8.772 -0.244
364 HA LYS 51 HA LYS 51 -7.074 -7.101 -1.365
365 HB2 LYS 51 HB2 LYS 51 -8.341 -5.888 1.105
366 HB3 LYS 51 HB3 LYS 51 -8.396 -5.163 -0.505
367 HG2 LYS 51 HG2 LYS 51 -9.525 -7.270 -1.339
368 HG3 LYS 51 HG3 LYS 51 -9.575 -7.852 0.325
369 HD2 LYS 51 HD2 LYS 51 -11.019 -6.050 1.013
370 HD3 LYS 51 HD3 LYS 51 -10.861 -5.223 -0.536
371 HE2 LYS 51 HE2 LYS 51 -12.130 -7.980 -0.152
372 HE3 LYS 51 HE3 LYS 51 -13.022 -6.453 -0.196
373 HZ1 LYS 51 HZ1 LYS 51 -12.123 -6.101 -2.442
374 HZ2 LYS 51 HZ2 LYS 51 -11.506 -7.654 -2.439
375 HZ3 LYS 51 HZ3 LYS 51 -13.113 -7.370 -2.362
376 H THR 52 H THR 52 -4.762 -7.832 -0.249
377 HA THR 52 HA THR 52 -3.285 -5.685 0.901
378 HB THR 52 HB THR 52 -2.966 -7.993 1.607
379 HG1 THR 52 HG1 THR 52 -0.695 -8.166 1.215
380 HG21 THR 52 HG21 THR 52 -3.442 -9.268 -0.407
381 HG22 THR 52 HG22 THR 52 -1.998 -8.586 -1.205
382 HG23 THR 52 HG23 THR 52 -1.840 -9.653 0.204
383 H PHE 53 H PHE 53 -1.625 -4.597 0.027
384 HA PHE 53 HA PHE 53 -1.181 -4.561 -2.890
385 HB2 PHE 53 HB2 PHE 53 -1.518 -2.307 -0.876
386 HB3 PHE 53 HB3 PHE 53 -0.520 -2.101 -2.308
387 HD1 PHE 53 HD1 PHE 53 -1.463 -2.326 -4.597
388 HD2 PHE 53 HD2 PHE 53 -3.979 -2.397 -1.095
389 HE1 PHE 53 HE1 PHE 53 -3.432 -1.825 -6.009
390 HE2 PHE 53 HE2 PHE 53 -5.955 -1.908 -2.520
391 HZ PHE 53 HZ PHE 53 -5.656 -1.584 -5.000
392 H THR 54 H THR 54 0.945 -4.894 -3.364
393 HA THR 54 HA THR 54 2.961 -4.927 -1.184
394 HB THR 54 HB THR 54 3.841 -6.905 -2.590
395 HG1 THR 54 HG1 THR 54 2.178 -7.920 -3.882
396 HG21 THR 54 HG21 THR 54 2.241 -8.534 -1.646
397 HG22 THR 54 HG22 THR 54 2.673 -7.304 -0.464
398 HG23 THR 54 HG23 THR 54 1.093 -7.236 -1.277
399 H VAL 55 H VAL 55 4.892 -3.968 -1.649
400 HA VAL 55 HA VAL 55 5.507 -3.098 -4.408
401 HB VAL 55 HB VAL 55 5.640 -1.432 -1.890
402 HG11 VAL 55 HG11 VAL 55 7.730 -1.065 -3.159
403 HG12 VAL 55 HG12 VAL 55 6.787 -0.802 -4.647
404 HG13 VAL 55 HG13 VAL 55 6.677 0.333 -3.279
405 HG21 VAL 55 HG21 VAL 55 3.441 -1.450 -3.113
406 HG22 VAL 55 HG22 VAL 55 4.235 0.117 -3.166
407 HG23 VAL 55 HG23 VAL 55 4.304 -0.947 -4.588
408 H THR 56 H THR 56 7.576 -3.641 -4.978
409 HA THR 56 HA THR 56 9.451 -4.380 -2.809
410 HB THR 56 HB THR 56 9.134 -5.911 -5.409
411 HG1 THR 56 HG1 THR 56 7.514 -6.718 -4.434
412 HG21 THR 56 HG21 THR 56 11.390 -5.969 -4.324
413 HG22 THR 56 HG22 THR 56 10.615 -6.543 -2.817
414 HG23 THR 56 HG23 THR 56 10.569 -7.533 -4.299
415 H GLU 57 H GLU 57 10.844 -2.762 -2.818
416 HA GLU 57 HA GLU 57 11.599 -1.122 -5.044
417 HB2 GLU 57 HB2 GLU 57 11.676 -0.468 -2.657
418 HB3 GLU 57 HB3 GLU 57 12.857 -1.743 -2.338
419 HG2 GLU 57 HG2 GLU 57 14.501 -0.561 -3.793
420 HG3 GLU 57 HG3 GLU 57 13.331 0.756 -3.996
Start of MODEL 3
1 H1 MET 1 H MET 1 -16.985 0.660 2.069
2 HA MET 1 HA MET 1 -16.858 -0.435 -0.072
3 HB2 MET 1 HB2 MET 1 -15.656 1.195 -1.310
4 HB3 MET 1 HB3 MET 1 -14.198 0.997 -0.312
5 HG2 MET 1 HG2 MET 1 -14.022 -1.366 -1.090
6 HG3 MET 1 HG3 MET 1 -15.442 -1.130 -2.104
7 HE1 MET 1 HE1 MET 1 -15.447 -0.173 -4.422
8 HE2 MET 1 HE2 MET 1 -15.256 1.436 -3.691
9 HE3 MET 1 HE3 MET 1 -14.222 0.945 -5.052
10 H GLY 2 H GLY 2 -13.547 -0.243 1.666
11 HA2 GLY 2 HA2 GLY 2 -14.084 -2.487 3.202
12 HA3 GLY 2 HA3 GLY 2 -13.436 -3.075 1.662
13 H THR 3 H THR 3 -12.058 -3.837 3.510
14 HA THR 3 HA THR 3 -10.077 -2.139 4.633
15 HB THR 3 HB THR 3 -10.786 -4.107 5.816
16 HG1 THR 3 HG1 THR 3 -8.695 -3.670 6.252
17 HG21 THR 3 HG21 THR 3 -11.407 -5.633 4.003
18 HG22 THR 3 HG22 THR 3 -9.712 -5.745 3.479
19 HG23 THR 3 HG23 THR 3 -10.196 -6.374 5.059
20 H TYR 4 H TYR 4 -7.804 -2.055 4.073
21 HA TYR 4 HA TYR 4 -7.000 -3.304 1.530
22 HB2 TYR 4 HB2 TYR 4 -7.075 -0.303 2.021
23 HB3 TYR 4 HB3 TYR 4 -5.900 -1.041 0.940
24 HD1 TYR 4 HD1 TYR 4 -6.707 -2.545 -0.948
25 HD2 TYR 4 HD2 TYR 4 -9.387 0.074 1.201
26 HE1 TYR 4 HE1 TYR 4 -8.353 -2.714 -2.795
27 HE2 TYR 4 HE2 TYR 4 -10.985 -0.014 -0.680
28 HH TYR 4 HH TYR 4 -11.556 -1.185 -2.676
29 H LYS 5 H LYS 5 -5.079 -4.300 1.946
30 HA LYS 5 HA LYS 5 -3.639 -3.430 4.424
31 HB2 LYS 5 HB2 LYS 5 -4.554 -5.724 4.221
32 HB3 LYS 5 HB3 LYS 5 -3.474 -6.025 2.862
33 HG2 LYS 5 HG2 LYS 5 -1.521 -5.776 4.328
34 HG3 LYS 5 HG3 LYS 5 -2.553 -5.278 5.679
35 HD2 LYS 5 HD2 LYS 5 -3.623 -7.434 5.814
36 HD3 LYS 5 HD3 LYS 5 -2.926 -7.943 4.278
37 HE2 LYS 5 HE2 LYS 5 -1.780 -9.081 6.032
38 HE3 LYS 5 HE3 LYS 5 -0.671 -7.970 5.236
39 HZ1 LYS 5 HZ1 LYS 5 -1.978 -7.459 7.843
40 HZ2 LYS 5 HZ2 LYS 5 -0.412 -7.934 7.587
41 HZ3 LYS 5 HZ3 LYS 5 -0.862 -6.483 7.105
42 H LEU 6 H LEU 6 -1.698 -2.360 4.198
43 HA LEU 6 HA LEU 6 -0.418 -2.226 1.477
44 HB2 LEU 6 HB2 LEU 6 -0.857 -0.171 3.650
45 HB3 LEU 6 HB3 LEU 6 0.345 0.071 2.399
46 HG LEU 6 HG LEU 6 -2.537 -0.521 1.654
47 HD11 LEU 6 HD11 LEU 6 -2.498 1.387 3.279
48 HD12 LEU 6 HD12 LEU 6 -1.383 2.251 2.200
49 HD13 LEU 6 HD13 LEU 6 -3.032 1.840 1.670
50 HD21 LEU 6 HD21 LEU 6 -0.305 1.069 0.295
51 HD22 LEU 6 HD22 LEU 6 -0.688 -0.621 -0.049
52 HD23 LEU 6 HD23 LEU 6 -1.882 0.611 -0.409
53 H ILE 7 H ILE 7 1.437 -3.243 1.521
54 HA ILE 7 HA ILE 7 3.359 -2.910 3.738
55 HB ILE 7 HB ILE 7 2.493 -5.251 3.686
56 HG12 ILE 7 HG12 ILE 7 5.412 -5.192 2.788
57 HG13 ILE 7 HG13 ILE 7 4.913 -4.567 4.331
58 HG21 ILE 7 HG21 ILE 7 2.222 -5.353 1.104
59 HG22 ILE 7 HG22 ILE 7 3.951 -5.601 1.035
60 HG23 ILE 7 HG23 ILE 7 2.932 -6.783 1.862
61 HD11 ILE 7 HD11 ILE 7 3.980 -6.808 4.943
62 HD12 ILE 7 HD12 ILE 7 4.621 -7.443 3.406
63 HD13 ILE 7 HD13 ILE 7 5.728 -6.810 4.630
64 H LEU 8 H LEU 8 5.328 -2.276 3.278
65 HA LEU 8 HA LEU 8 6.140 -1.806 0.463
66 HB2 LEU 8 HB2 LEU 8 6.586 -0.054 2.933
67 HB3 LEU 8 HB3 LEU 8 7.359 0.164 1.379
68 HG LEU 8 HG LEU 8 5.682 1.771 1.461
69 HD11 LEU 8 HD11 LEU 8 4.437 -0.484 -0.163
70 HD12 LEU 8 HD12 LEU 8 4.199 1.242 -0.411
71 HD13 LEU 8 HD13 LEU 8 5.788 0.508 -0.706
72 HD21 LEU 8 HD21 LEU 8 4.330 0.757 3.318
73 HD22 LEU 8 HD22 LEU 8 3.414 1.559 2.024
74 HD23 LEU 8 HD23 LEU 8 3.482 -0.204 2.093
75 H ASN 9 H ASN 9 8.077 -2.682 0.002
76 HA ASN 9 HA ASN 9 9.739 -3.794 2.207
77 HB2 ASN 9 HB2 ASN 9 9.118 -5.055 -0.480
78 HB3 ASN 9 HB3 ASN 9 10.166 -5.726 0.762
79 HD21 ASN 9 HD21 ASN 9 6.164 -6.316 0.897
80 HD22 ASN 9 HD22 ASN 9 6.874 -5.163 -0.252
81 H GLY 10 H GLY 10 10.805 -1.610 1.917
82 HA2 GLY 10 HA2 GLY 10 12.212 -1.058 -0.549
83 HA3 GLY 10 HA3 GLY 10 12.362 -0.230 1.005
84 H LYS 11 H LYS 11 14.630 -0.605 -0.306
85 HA LYS 11 HA LYS 11 16.015 -3.065 0.159
86 HB2 LYS 11 HB2 LYS 11 16.756 -1.380 -1.456
87 HB3 LYS 11 HB3 LYS 11 17.037 -0.209 -0.160
88 HG2 LYS 11 HG2 LYS 11 18.834 -1.727 0.756
89 HG3 LYS 11 HG3 LYS 11 18.561 -2.816 -0.612
90 HD2 LYS 11 HD2 LYS 11 19.145 -1.013 -2.182
91 HD3 LYS 11 HD3 LYS 11 19.320 0.136 -0.839
92 HE2 LYS 11 HE2 LYS 11 21.213 -1.105 0.056
93 HE3 LYS 11 HE3 LYS 11 20.998 -2.387 -1.153
94 HZ1 LYS 11 HZ1 LYS 11 22.733 -0.829 -1.789
95 HZ2 LYS 11 HZ2 LYS 11 21.503 -0.802 -2.874
96 HZ3 LYS 11 HZ3 LYS 11 21.689 0.421 -1.763
97 H THR 12 H THR 12 15.943 -0.013 2.072
98 HA THR 12 HA THR 12 16.937 -1.560 4.416
99 HB THR 12 HB THR 12 18.120 0.480 5.144
100 HG1 THR 12 HG1 THR 12 17.885 2.265 4.076
101 HG21 THR 12 HG21 THR 12 19.121 -0.175 2.365
102 HG22 THR 12 HG22 THR 12 20.029 0.020 3.874
103 HG23 THR 12 HG23 THR 12 19.086 -1.438 3.611
104 H LEU 13 H LEU 13 14.150 -0.275 3.296
105 HA LEU 13 HA LEU 13 13.258 0.570 6.011
106 HB2 LEU 13 HB2 LEU 13 12.469 1.677 3.287
107 HB3 LEU 13 HB3 LEU 13 11.707 2.127 4.807
108 HG LEU 13 HG LEU 13 14.657 2.614 4.179
109 HD11 LEU 13 HD11 LEU 13 13.154 3.844 2.623
110 HD12 LEU 13 HD12 LEU 13 12.366 4.600 4.025
111 HD13 LEU 13 HD13 LEU 13 14.084 4.900 3.688
112 HD21 LEU 13 HD21 LEU 13 14.172 2.565 6.597
113 HD22 LEU 13 HD22 LEU 13 14.523 4.208 6.064
114 HD23 LEU 13 HD23 LEU 13 12.842 3.724 6.368
115 H LYS 14 H LYS 14 11.235 -0.269 6.581
116 HA LYS 14 HA LYS 14 9.753 -1.813 4.572
117 HB2 LYS 14 HB2 LYS 14 11.565 -3.286 5.858
118 HB3 LYS 14 HB3 LYS 14 10.386 -3.246 7.179
119 HG2 LYS 14 HG2 LYS 14 8.661 -4.161 5.607
120 HG3 LYS 14 HG3 LYS 14 9.867 -4.127 4.310
121 HD2 LYS 14 HD2 LYS 14 11.281 -5.734 5.649
122 HD3 LYS 14 HD3 LYS 14 9.921 -5.860 6.801
123 HE2 LYS 14 HE2 LYS 14 8.433 -6.469 4.831
124 HE3 LYS 14 HE3 LYS 14 9.862 -6.455 3.802
125 HZ1 LYS 14 HZ1 LYS 14 9.427 -8.271 6.083
126 HZ2 LYS 14 HZ2 LYS 14 9.249 -8.657 4.490
127 HZ3 LYS 14 HZ3 LYS 14 10.740 -8.289 5.086
128 H GLY 15 H GLY 15 7.467 -2.088 5.199
129 HA2 GLY 15 HA2 GLY 15 6.599 -1.285 7.840
130 HA3 GLY 15 HA3 GLY 15 6.336 -0.015 6.626
131 H GLU 16 H GLU 16 4.287 -1.708 8.096
132 HA GLU 16 HA GLU 16 2.846 -2.428 5.721
133 HB2 GLU 16 HB2 GLU 16 2.251 -4.615 6.179
134 HB3 GLU 16 HB3 GLU 16 4.003 -4.570 6.249
135 HG2 GLU 16 HG2 GLU 16 4.106 -5.127 8.466
136 HG3 GLU 16 HG3 GLU 16 2.570 -4.370 8.877
137 H THR 17 H THR 17 0.601 -2.367 5.954
138 HA THR 17 HA THR 17 -0.504 -2.023 8.657
139 HB THR 17 HB THR 17 0.394 0.172 8.455
140 HG1 THR 17 HG1 THR 17 -1.367 1.398 8.608
141 HG21 THR 17 HG21 THR 17 0.858 0.279 6.047
142 HG22 THR 17 HG22 THR 17 -0.869 0.390 5.701
143 HG23 THR 17 HG23 THR 17 -0.052 1.697 6.577
144 H THR 18 H THR 18 -2.848 -1.316 8.503
145 HA THR 18 HA THR 18 -4.309 -2.349 6.209
146 HB THR 18 HB THR 18 -3.780 -4.208 7.941
147 HG1 THR 18 HG1 THR 18 -5.723 -5.115 7.569
148 HG21 THR 18 HG21 THR 18 -4.340 -2.883 9.988
149 HG22 THR 18 HG22 THR 18 -6.041 -2.860 9.482
150 HG23 THR 18 HG23 THR 18 -5.253 -4.397 9.863
151 H THR 19 H THR 19 -6.490 -1.436 6.269
152 HA THR 19 HA THR 19 -7.413 0.349 8.263
153 HB THR 19 HB THR 19 -5.534 1.705 7.176
154 HG1 THR 19 HG1 THR 19 -6.637 3.498 7.192
155 HG21 THR 19 HG21 THR 19 -5.886 0.975 4.807
156 HG22 THR 19 HG22 THR 19 -7.430 1.855 4.787
157 HG23 THR 19 HG23 THR 19 -5.916 2.738 5.012
158 H GLU 20 H GLU 20 -9.519 1.395 7.241
159 HA GLU 20 HA GLU 20 -10.608 -0.278 5.056
160 HB2 GLU 20 HB2 GLU 20 -11.456 -1.166 7.184
161 HB3 GLU 20 HB3 GLU 20 -11.963 0.457 7.673
162 HG2 GLU 20 HG2 GLU 20 -13.494 0.510 5.656
163 HG3 GLU 20 HG3 GLU 20 -13.024 -1.147 5.315
164 H ALA 21 H ALA 21 -11.377 0.935 3.447
165 HA ALA 21 HA ALA 21 -11.692 3.858 3.938
166 HB1 ALA 21 HB1 ALA 21 -10.699 2.423 1.442
167 HB2 ALA 21 HB2 ALA 21 -10.899 4.173 1.634
168 HB3 ALA 21 HB3 ALA 21 -9.687 3.317 2.604
169 H VAL 22 H VAL 22 -13.340 4.903 3.065
170 HA VAL 22 HA VAL 22 -15.781 3.604 2.593
171 HB VAL 22 HB VAL 22 -16.626 5.814 1.976
172 HG11 VAL 22 HG11 VAL 22 -14.733 5.962 4.364
173 HG12 VAL 22 HG12 VAL 22 -16.215 6.908 4.092
174 HG13 VAL 22 HG13 VAL 22 -16.317 5.163 4.356
175 HG21 VAL 22 HG21 VAL 22 -14.740 6.766 0.700
176 HG22 VAL 22 HG22 VAL 22 -15.174 7.814 2.046
177 HG23 VAL 22 HG23 VAL 22 -13.731 6.789 2.161
178 H ASP 23 H ASP 23 -13.224 4.606 0.265
179 HA ASP 23 HA ASP 23 -14.580 3.024 -1.792
180 HB2 ASP 23 HB2 ASP 23 -15.489 5.411 -1.907
181 HB3 ASP 23 HB3 ASP 23 -13.836 5.920 -2.299
182 H ALA 24 H ALA 24 -13.109 2.651 -3.651
183 HA ALA 24 HA ALA 24 -10.430 2.128 -2.872
184 HB1 ALA 24 HB1 ALA 24 -11.442 0.803 -4.622
185 HB2 ALA 24 HB2 ALA 24 -11.760 2.250 -5.616
186 HB3 ALA 24 HB3 ALA 24 -10.096 1.700 -5.331
187 H ALA 25 H ALA 25 -11.955 4.919 -4.562
188 HA ALA 25 HA ALA 25 -9.543 6.140 -5.413
189 HB1 ALA 25 HB1 ALA 25 -12.152 7.459 -4.562
190 HB2 ALA 25 HB2 ALA 25 -10.879 8.202 -5.552
191 HB3 ALA 25 HB3 ALA 25 -11.797 6.814 -6.173
192 H THR 26 H THR 26 -11.135 6.075 -2.251
193 HA THR 26 HA THR 26 -9.557 8.220 -1.066
194 HB THR 26 HB THR 26 -11.151 5.939 0.187
195 HG1 THR 26 HG1 THR 26 -12.304 7.490 -1.143
196 HG21 THR 26 HG21 THR 26 -9.547 6.904 1.816
197 HG22 THR 26 HG22 THR 26 -10.193 8.523 1.480
198 HG23 THR 26 HG23 THR 26 -11.219 7.264 2.219
199 H ALA 27 H ALA 27 -9.375 4.644 -1.201
200 HA ALA 27 HA ALA 27 -7.097 4.309 0.468
201 HB1 ALA 27 HB1 ALA 27 -8.697 2.508 -0.190
202 HB2 ALA 27 HB2 ALA 27 -8.047 2.549 -1.844
203 HB3 ALA 27 HB3 ALA 27 -7.015 2.075 -0.485
204 H GLU 28 H GLU 28 -7.439 4.500 -3.090
205 HA GLU 28 HA GLU 28 -4.835 4.348 -3.958
206 HB2 GLU 28 HB2 GLU 28 -6.862 4.320 -5.340
207 HB3 GLU 28 HB3 GLU 28 -7.205 5.993 -4.916
208 HG2 GLU 28 HG2 GLU 28 -5.066 6.648 -6.129
209 HG3 GLU 28 HG3 GLU 28 -4.964 4.968 -6.687
210 H LYS 29 H LYS 29 -6.473 7.209 -2.565
211 HA LYS 29 HA LYS 29 -4.350 9.023 -3.309
212 HB2 LYS 29 HB2 LYS 29 -6.820 9.521 -2.784
213 HB3 LYS 29 HB3 LYS 29 -6.369 9.488 -1.077
214 HG2 LYS 29 HG2 LYS 29 -4.730 11.310 -1.456
215 HG3 LYS 29 HG3 LYS 29 -5.029 11.202 -3.209
216 HD2 LYS 29 HD2 LYS 29 -7.521 11.628 -2.566
217 HD3 LYS 29 HD3 LYS 29 -6.875 12.258 -1.049
218 HE2 LYS 29 HE2 LYS 29 -6.004 14.129 -2.068
219 HE3 LYS 29 HE3 LYS 29 -5.479 13.228 -3.499
220 HZ1 LYS 29 HZ1 LYS 29 -7.224 14.770 -4.040
221 HZ2 LYS 29 HZ2 LYS 29 -7.683 13.214 -4.317
222 HZ3 LYS 29 HZ3 LYS 29 -8.283 13.995 -3.015
223 H VAL 30 H VAL 30 -5.204 7.342 -0.228
224 HA VAL 30 HA VAL 30 -2.975 8.462 1.169
225 HB VAL 30 HB VAL 30 -4.886 7.619 2.413
226 HG11 VAL 30 HG11 VAL 30 -3.952 4.838 1.657
227 HG12 VAL 30 HG12 VAL 30 -5.097 5.217 2.974
228 HG13 VAL 30 HG13 VAL 30 -5.530 5.603 1.300
229 HG21 VAL 30 HG21 VAL 30 -3.685 6.628 4.256
230 HG22 VAL 30 HG22 VAL 30 -2.690 7.875 3.492
231 HG23 VAL 30 HG23 VAL 30 -2.353 6.156 3.190
232 H PHE 31 H PHE 31 -3.340 5.598 -0.931
233 HA PHE 31 HA PHE 31 -1.015 4.201 -0.293
234 HB2 PHE 31 HB2 PHE 31 -2.188 4.776 -3.052
235 HB3 PHE 31 HB3 PHE 31 -0.916 3.639 -2.766
236 HD1 PHE 31 HD1 PHE 31 -3.197 3.211 -0.051
237 HD2 PHE 31 HD2 PHE 31 -2.658 2.407 -4.255
238 HE1 PHE 31 HE1 PHE 31 -4.825 1.352 0.089
239 HE2 PHE 31 HE2 PHE 31 -4.275 0.558 -4.108
240 HZ PHE 31 HZ PHE 31 -5.396 0.044 -1.924
241 H LYS 32 H LYS 32 -1.264 7.091 -2.518
242 HA LYS 32 HA LYS 32 1.527 6.956 -3.202
243 HB2 LYS 32 HB2 LYS 32 -0.100 8.178 -4.561
244 HB3 LYS 32 HB3 LYS 32 -0.415 9.315 -3.236
245 HG2 LYS 32 HG2 LYS 32 1.883 10.166 -3.359
246 HG3 LYS 32 HG3 LYS 32 2.316 8.923 -4.550
247 HD2 LYS 32 HD2 LYS 32 0.691 9.872 -6.129
248 HD3 LYS 32 HD3 LYS 32 0.252 11.137 -4.958
249 HE2 LYS 32 HE2 LYS 32 2.426 12.132 -5.082
250 HE3 LYS 32 HE3 LYS 32 3.124 10.708 -5.860
251 HZ1 LYS 32 HZ1 LYS 32 1.873 11.132 -7.800
252 HZ2 LYS 32 HZ2 LYS 32 1.111 12.456 -7.128
253 HZ3 LYS 32 HZ3 LYS 32 2.728 12.487 -7.429
254 H GLN 33 H GLN 33 -0.145 9.017 -0.762
255 HA GLN 33 HA GLN 33 2.302 10.216 0.097
256 HB2 GLN 33 HB2 GLN 33 0.348 11.418 0.392
257 HB3 GLN 33 HB3 GLN 33 -0.519 10.115 1.162
258 HG2 GLN 33 HG2 GLN 33 1.891 11.487 2.453
259 HG3 GLN 33 HG3 GLN 33 0.249 12.109 2.605
260 HE21 GLN 33 HE21 GLN 33 -0.761 8.962 4.434
261 HE22 GLN 33 HE22 GLN 33 -1.211 9.668 2.889
262 H TYR 34 H TYR 34 0.406 7.536 1.674
263 HA TYR 34 HA TYR 34 2.209 7.243 3.840
264 HB2 TYR 34 HB2 TYR 34 0.002 6.297 3.971
265 HB3 TYR 34 HB3 TYR 34 0.250 5.330 2.512
266 HD1 TYR 34 HD1 TYR 34 0.799 3.081 2.777
267 HD2 TYR 34 HD2 TYR 34 1.792 5.852 5.910
268 HE1 TYR 34 HE1 TYR 34 1.948 1.257 4.016
269 HE2 TYR 34 HE2 TYR 34 2.921 4.048 7.161
270 HH TYR 34 HH TYR 34 3.565 1.841 7.205
271 H ALA 35 H ALA 35 2.220 5.711 0.560
272 HA ALA 35 HA ALA 35 4.430 3.990 1.270
273 HB1 ALA 35 HB1 ALA 35 3.518 4.837 -1.498
274 HB2 ALA 35 HB2 ALA 35 4.428 3.392 -1.017
275 HB3 ALA 35 HB3 ALA 35 2.756 3.541 -0.526
276 H ASN 36 H ASN 36 4.145 7.226 -0.403
277 HA ASN 36 HA ASN 36 6.934 7.359 -0.974
278 HB2 ASN 36 HB2 ASN 36 5.268 8.834 -2.061
279 HB3 ASN 36 HB3 ASN 36 5.030 9.682 -0.519
280 HD21 ASN 36 HD21 ASN 36 8.753 10.001 -2.366
281 HD22 ASN 36 HD22 ASN 36 7.781 8.610 -2.705
282 H ASP 37 H ASP 37 5.113 8.169 1.985
283 HA ASP 37 HA ASP 37 7.222 9.515 3.379
284 HB2 ASP 37 HB2 ASP 37 4.872 9.608 4.075
285 HB3 ASP 37 HB3 ASP 37 4.851 7.867 4.360
286 H ASN 38 H ASN 38 6.597 6.172 2.652
287 HA ASN 38 HA ASN 38 8.461 5.004 4.579
288 HB2 ASN 38 HB2 ASN 38 6.352 4.084 2.743
289 HB3 ASN 38 HB3 ASN 38 7.799 3.134 2.542
290 HD21 ASN 38 HD21 ASN 38 5.303 2.022 5.315
291 HD22 ASN 38 HD22 ASN 38 4.952 3.347 4.236
292 H GLY 39 H GLY 39 9.011 6.841 1.839
293 HA2 GLY 39 HA2 GLY 39 10.800 7.194 0.498
294 HA3 GLY 39 HA3 GLY 39 11.725 6.118 1.559
295 H VAL 40 H VAL 40 8.900 5.136 -0.358
296 HA VAL 40 HA VAL 40 10.278 2.905 -1.521
297 HB VAL 40 HB VAL 40 8.051 2.489 -2.512
298 HG11 VAL 40 HG11 VAL 40 6.712 2.484 -0.414
299 HG12 VAL 40 HG12 VAL 40 8.325 1.745 -0.263
300 HG13 VAL 40 HG13 VAL 40 8.001 3.359 0.390
301 HG21 VAL 40 HG21 VAL 40 7.507 5.377 -1.728
302 HG22 VAL 40 HG22 VAL 40 7.168 4.536 -3.244
303 HG23 VAL 40 HG23 VAL 40 6.196 4.221 -1.831
304 H ASP 41 H ASP 41 10.840 2.396 -3.612
305 HA ASP 41 HA ASP 41 10.082 4.174 -5.799
306 HB2 ASP 41 HB2 ASP 41 12.281 4.997 -5.025
307 HB3 ASP 41 HB3 ASP 41 12.996 3.417 -5.383
308 H GLY 42 H GLY 42 8.587 2.142 -5.719
309 HA2 GLY 42 HA2 GLY 42 9.809 0.067 -7.459
310 HA3 GLY 42 HA3 GLY 42 9.071 -0.440 -5.946
311 H GLU 43 H GLU 43 7.945 -1.701 -7.661
312 HA GLU 43 HA GLU 43 5.673 -0.443 -9.027
313 HB2 GLU 43 HB2 GLU 43 5.525 -2.528 -10.286
314 HB3 GLU 43 HB3 GLU 43 7.088 -1.714 -10.481
315 HG2 GLU 43 HG2 GLU 43 8.189 -3.355 -9.058
316 HG3 GLU 43 HG3 GLU 43 6.651 -4.057 -8.566
317 H TRP 44 H TRP 44 3.551 -1.334 -8.828
318 HA TRP 44 HA TRP 44 3.039 -2.570 -6.183
319 HB2 TRP 44 HB2 TRP 44 1.377 -0.804 -8.019
320 HB3 TRP 44 HB3 TRP 44 0.816 -1.500 -6.504
321 HD1 TRP 44 HD1 TRP 44 3.946 0.654 -7.463
322 HE1 TRP 44 HE1 TRP 44 4.483 2.129 -5.549
323 HE3 TRP 44 HE3 TRP 44 -0.030 -0.513 -4.459
324 HZ2 TRP 44 HZ2 TRP 44 2.992 3.232 -3.219
325 HZ3 TRP 44 HZ3 TRP 44 -0.455 0.777 -2.389
326 HH2 TRP 44 HH2 TRP 44 1.064 2.641 -1.749
327 H THR 45 H THR 45 2.128 -4.533 -6.016
328 HA THR 45 HA THR 45 0.540 -5.661 -8.261
329 HB THR 45 HB THR 45 1.312 -7.865 -7.315
330 HG1 THR 45 HG1 THR 45 2.267 -7.735 -5.484
331 HG21 THR 45 HG21 THR 45 3.566 -6.055 -8.295
332 HG22 THR 45 HG22 THR 45 3.521 -7.828 -8.361
333 HG23 THR 45 HG23 THR 45 2.380 -6.882 -9.328
334 H TYR 46 H TYR 46 -1.234 -7.219 -7.385
335 HA TYR 46 HA TYR 46 -2.166 -6.362 -4.692
336 HB2 TYR 46 HB2 TYR 46 -3.179 -4.950 -6.419
337 HB3 TYR 46 HB3 TYR 46 -3.757 -6.373 -7.272
338 HD1 TYR 46 HD1 TYR 46 -3.871 -5.000 -3.758
339 HD2 TYR 46 HD2 TYR 46 -6.030 -6.861 -6.975
340 HE1 TYR 46 HE1 TYR 46 -5.958 -4.876 -2.423
341 HE2 TYR 46 HE2 TYR 46 -8.147 -6.623 -5.697
342 HH TYR 46 HH TYR 46 -9.012 -6.196 -3.535
343 H ASP 47 H ASP 47 -3.361 -7.710 -3.531
344 HA ASP 47 HA ASP 47 -4.128 -10.416 -4.480
345 HB2 ASP 47 HB2 ASP 47 -2.422 -9.642 -2.124
346 HB3 ASP 47 HB3 ASP 47 -3.600 -10.936 -1.905
347 H ASP 48 H ASP 48 -6.310 -9.931 -4.673
348 HA ASP 48 HA ASP 48 -7.714 -8.207 -2.899
349 HB2 ASP 48 HB2 ASP 48 -8.346 -8.852 -5.285
350 HB3 ASP 48 HB3 ASP 48 -8.955 -10.362 -4.625
351 H ALA 49 H ALA 49 -6.646 -11.365 -2.356
352 HA ALA 49 HA ALA 49 -8.698 -12.565 -0.860
353 HB1 ALA 49 HB1 ALA 49 -5.687 -12.769 -0.386
354 HB2 ALA 49 HB2 ALA 49 -6.926 -13.927 0.151
355 HB3 ALA 49 HB3 ALA 49 -6.613 -13.711 -1.577
356 H THR 50 H THR 50 -6.267 -10.212 0.187
357 HA THR 50 HA THR 50 -7.841 -9.699 2.652
358 HB THR 50 HB THR 50 -6.154 -10.864 3.616
359 HG1 THR 50 HG1 THR 50 -6.173 -8.759 4.506
360 HG21 THR 50 HG21 THR 50 -4.288 -9.794 1.510
361 HG22 THR 50 HG22 THR 50 -3.686 -10.570 2.995
362 HG23 THR 50 HG23 THR 50 -4.707 -11.466 1.863
363 H LYS 51 H LYS 51 -6.495 -8.404 -0.276
364 HA LYS 51 HA LYS 51 -6.825 -6.663 -1.315
365 HB2 LYS 51 HB2 LYS 51 -7.919 -5.315 1.149
366 HB3 LYS 51 HB3 LYS 51 -7.944 -4.687 -0.504
367 HG2 LYS 51 HG2 LYS 51 -9.231 -6.730 -1.220
368 HG3 LYS 51 HG3 LYS 51 -9.326 -7.248 0.453
369 HD2 LYS 51 HD2 LYS 51 -10.695 -5.456 1.092
370 HD3 LYS 51 HD3 LYS 51 -10.428 -4.558 -0.422
371 HE2 LYS 51 HE2 LYS 51 -11.714 -7.309 -0.264
372 HE3 LYS 51 HE3 LYS 51 -12.653 -5.824 -0.109
373 HZ1 LYS 51 HZ1 LYS 51 -12.658 -6.673 -2.343
374 HZ2 LYS 51 HZ2 LYS 51 -11.958 -5.194 -2.331
375 HZ3 LYS 51 HZ3 LYS 51 -11.035 -6.567 -2.483
376 H THR 52 H THR 52 -4.627 -7.724 -0.329
377 HA THR 52 HA THR 52 -2.751 -5.923 0.827
378 HB THR 52 HB THR 52 -2.923 -8.725 -0.192
379 HG1 THR 52 HG1 THR 52 -1.606 -8.009 2.137
380 HG21 THR 52 HG21 THR 52 -0.763 -8.202 -1.165
381 HG22 THR 52 HG22 THR 52 -0.216 -7.459 0.343
382 HG23 THR 52 HG23 THR 52 -0.557 -9.199 0.267
383 H PHE 53 H PHE 53 -1.821 -4.343 -0.216
384 HA PHE 53 HA PHE 53 -1.281 -4.509 -3.136
385 HB2 PHE 53 HB2 PHE 53 -1.867 -2.222 -1.241
386 HB3 PHE 53 HB3 PHE 53 -0.746 -1.963 -2.577
387 HD1 PHE 53 HD1 PHE 53 -1.476 -2.466 -4.965
388 HD2 PHE 53 HD2 PHE 53 -4.258 -2.351 -1.669
389 HE1 PHE 53 HE1 PHE 53 -3.351 -2.242 -6.559
390 HE2 PHE 53 HE2 PHE 53 -6.137 -2.125 -3.293
391 HZ PHE 53 HZ PHE 53 -5.686 -2.082 -5.729
392 H THR 54 H THR 54 0.869 -4.953 -3.521
393 HA THR 54 HA THR 54 2.760 -4.652 -1.224
394 HB THR 54 HB THR 54 2.468 -6.918 -3.232
395 HG1 THR 54 HG1 THR 54 1.951 -8.089 -1.396
396 HG21 THR 54 HG21 THR 54 4.465 -6.497 -0.967
397 HG22 THR 54 HG22 THR 54 4.205 -8.020 -1.832
398 HG23 THR 54 HG23 THR 54 4.826 -6.622 -2.701
399 H VAL 55 H VAL 55 4.723 -3.880 -1.604
400 HA VAL 55 HA VAL 55 5.615 -3.343 -4.362
401 HB VAL 55 HB VAL 55 5.660 -1.434 -2.005
402 HG11 VAL 55 HG11 VAL 55 6.903 -1.204 -4.778
403 HG12 VAL 55 HG12 VAL 55 6.744 0.150 -3.647
404 HG13 VAL 55 HG13 VAL 55 7.755 -1.226 -3.215
405 HG21 VAL 55 HG21 VAL 55 3.452 -1.537 -3.163
406 HG22 VAL 55 HG22 VAL 55 4.251 -0.001 -3.393
407 HG23 VAL 55 HG23 VAL 55 4.272 -1.196 -4.702
408 H THR 56 H THR 56 7.714 -3.968 -4.695
409 HA THR 56 HA THR 56 9.493 -4.312 -2.383
410 HB THR 56 HB THR 56 8.935 -6.371 -4.533
411 HG1 THR 56 HG1 THR 56 9.096 -7.647 -2.536
412 HG21 THR 56 HG21 THR 56 10.924 -7.587 -3.589
413 HG22 THR 56 HG22 THR 56 11.348 -6.150 -4.528
414 HG23 THR 56 HG23 THR 56 11.379 -6.088 -2.755
415 H GLU 57 H GLU 57 11.262 -3.167 -2.626
416 HA GLU 57 HA GLU 57 11.714 -1.587 -5.045
417 HB2 GLU 57 HB2 GLU 57 12.049 -0.729 -2.719
418 HB3 GLU 57 HB3 GLU 57 13.300 -1.954 -2.452
419 HG2 GLU 57 HG2 GLU 57 14.610 -0.884 -4.345
420 HG3 GLU 57 HG3 GLU 57 13.398 0.403 -4.381
Start of MODEL 4
1 H1 MET 1 H MET 1 -16.996 0.358 2.001
2 HA MET 1 HA MET 1 -16.933 -0.583 -0.220
3 HB2 MET 1 HB2 MET 1 -15.838 1.218 -1.349
4 HB3 MET 1 HB3 MET 1 -14.316 0.945 -0.471
5 HG2 MET 1 HG2 MET 1 -14.072 -1.244 -1.524
6 HG3 MET 1 HG3 MET 1 -15.665 -1.116 -2.268
7 HE1 MET 1 HE1 MET 1 -16.307 0.206 -4.200
8 HE2 MET 1 HE2 MET 1 -15.808 1.795 -3.594
9 HE3 MET 1 HE3 MET 1 -15.269 1.249 -5.191
10 H GLY 2 H GLY 2 -13.639 -0.355 1.622
11 HA2 GLY 2 HA2 GLY 2 -14.110 -2.838 2.776
12 HA3 GLY 2 HA3 GLY 2 -13.211 -3.103 1.275
13 H THR 3 H THR 3 -11.888 -3.917 3.281
14 HA THR 3 HA THR 3 -10.191 -1.801 4.376
15 HB THR 3 HB THR 3 -10.982 -3.384 6.017
16 HG1 THR 3 HG1 THR 3 -8.782 -2.548 6.002
17 HG21 THR 3 HG21 THR 3 -11.347 -5.401 4.658
18 HG22 THR 3 HG22 THR 3 -9.600 -5.557 4.385
19 HG23 THR 3 HG23 THR 3 -10.266 -5.737 6.029
20 H TYR 4 H TYR 4 -7.894 -1.754 3.895
21 HA TYR 4 HA TYR 4 -7.083 -3.448 1.588
22 HB2 TYR 4 HB2 TYR 4 -6.907 -0.419 1.800
23 HB3 TYR 4 HB3 TYR 4 -6.045 -1.392 0.613
24 HD1 TYR 4 HD1 TYR 4 -7.267 -2.674 -1.116
25 HD2 TYR 4 HD2 TYR 4 -9.432 -0.051 1.565
26 HE1 TYR 4 HE1 TYR 4 -9.241 -2.741 -2.619
27 HE2 TYR 4 HE2 TYR 4 -11.339 -0.077 0.052
28 HH TYR 4 HH TYR 4 -11.313 -1.656 -3.132
29 H LYS 5 H LYS 5 -5.069 -4.356 1.909
30 HA LYS 5 HA LYS 5 -3.647 -3.321 4.353
31 HB2 LYS 5 HB2 LYS 5 -4.399 -5.668 4.301
32 HB3 LYS 5 HB3 LYS 5 -3.325 -5.986 2.943
33 HG2 LYS 5 HG2 LYS 5 -1.372 -5.309 4.348
34 HG3 LYS 5 HG3 LYS 5 -2.501 -4.964 5.687
35 HD2 LYS 5 HD2 LYS 5 -3.208 -7.312 5.754
36 HD3 LYS 5 HD3 LYS 5 -2.176 -7.664 4.361
37 HE2 LYS 5 HE2 LYS 5 -1.108 -8.391 6.436
38 HE3 LYS 5 HE3 LYS 5 -0.162 -7.134 5.644
39 HZ1 LYS 5 HZ1 LYS 5 -1.883 -6.817 8.026
40 HZ2 LYS 5 HZ2 LYS 5 -0.228 -6.694 7.905
41 HZ3 LYS 5 HZ3 LYS 5 -1.176 -5.554 7.220
42 H LEU 6 H LEU 6 -1.658 -2.396 4.215
43 HA LEU 6 HA LEU 6 -0.379 -2.048 1.526
44 HB2 LEU 6 HB2 LEU 6 -0.885 -0.237 3.887
45 HB3 LEU 6 HB3 LEU 6 0.442 0.120 2.804
46 HG LEU 6 HG LEU 6 -2.389 -0.215 1.751
47 HD11 LEU 6 HD11 LEU 6 -2.395 1.494 3.561
48 HD12 LEU 6 HD12 LEU 6 -1.064 2.348 2.757
49 HD13 LEU 6 HD13 LEU 6 -2.655 2.215 1.979
50 HD21 LEU 6 HD21 LEU 6 0.131 1.226 0.774
51 HD22 LEU 6 HD22 LEU 6 -0.506 -0.301 0.149
52 HD23 LEU 6 HD23 LEU 6 -1.430 1.184 -0.083
53 H ILE 7 H ILE 7 1.405 -3.234 1.574
54 HA ILE 7 HA ILE 7 3.368 -3.037 3.803
55 HB ILE 7 HB ILE 7 2.495 -5.257 4.000
56 HG12 ILE 7 HG12 ILE 7 5.112 -5.522 2.445
57 HG13 ILE 7 HG13 ILE 7 5.011 -4.894 4.084
58 HG21 ILE 7 HG21 ILE 7 1.393 -5.532 1.822
59 HG22 ILE 7 HG22 ILE 7 2.972 -5.655 1.032
60 HG23 ILE 7 HG23 ILE 7 2.438 -6.909 2.150
61 HD11 ILE 7 HD11 ILE 7 3.951 -7.084 4.790
62 HD12 ILE 7 HD12 ILE 7 4.340 -7.708 3.166
63 HD13 ILE 7 HD13 ILE 7 5.637 -7.185 4.247
64 H LEU 8 H LEU 8 5.334 -2.428 3.318
65 HA LEU 8 HA LEU 8 6.119 -2.091 0.472
66 HB2 LEU 8 HB2 LEU 8 6.774 -0.366 2.910
67 HB3 LEU 8 HB3 LEU 8 7.384 -0.135 1.287
68 HG LEU 8 HG LEU 8 5.743 1.496 1.640
69 HD11 LEU 8 HD11 LEU 8 4.404 -0.662 -0.038
70 HD12 LEU 8 HD12 LEU 8 4.108 1.072 -0.146
71 HD13 LEU 8 HD13 LEU 8 5.689 0.404 -0.608
72 HD21 LEU 8 HD21 LEU 8 4.496 0.302 3.517
73 HD22 LEU 8 HD22 LEU 8 3.560 1.324 2.397
74 HD23 LEU 8 HD23 LEU 8 3.509 -0.430 2.238
75 H ASN 9 H ASN 9 8.056 -3.009 -0.078
76 HA ASN 9 HA ASN 9 9.846 -4.045 2.065
77 HB2 ASN 9 HB2 ASN 9 9.369 -5.314 -0.658
78 HB3 ASN 9 HB3 ASN 9 10.386 -5.904 0.631
79 HD21 ASN 9 HD21 ASN 9 6.462 -6.855 0.523
80 HD22 ASN 9 HD22 ASN 9 7.176 -5.689 -0.600
81 H GLY 10 H GLY 10 11.325 -2.344 2.033
82 HA2 GLY 10 HA2 GLY 10 12.411 -1.380 -0.551
83 HA3 GLY 10 HA3 GLY 10 12.539 -0.595 1.020
84 H LYS 11 H LYS 11 14.815 -0.795 -0.273
85 HA LYS 11 HA LYS 11 16.371 -3.184 0.003
86 HB2 LYS 11 HB2 LYS 11 17.026 -1.379 -1.449
87 HB3 LYS 11 HB3 LYS 11 17.030 -0.202 -0.130
88 HG2 LYS 11 HG2 LYS 11 19.010 -1.290 0.867
89 HG3 LYS 11 HG3 LYS 11 18.965 -2.512 -0.417
90 HD2 LYS 11 HD2 LYS 11 19.324 -0.732 -2.108
91 HD3 LYS 11 HD3 LYS 11 19.392 0.484 -0.811
92 HE2 LYS 11 HE2 LYS 11 21.374 -0.586 0.153
93 HE3 LYS 11 HE3 LYS 11 21.227 -1.936 -0.987
94 HZ1 LYS 11 HZ1 LYS 11 22.899 -0.462 -1.735
95 HZ2 LYS 11 HZ2 LYS 11 21.650 -0.387 -2.791
96 HZ3 LYS 11 HZ3 LYS 11 21.948 0.844 -1.694
97 H THR 12 H THR 12 16.090 -0.348 2.126
98 HA THR 12 HA THR 12 17.158 -1.942 4.385
99 HB THR 12 HB THR 12 18.021 0.603 4.988
100 HG1 THR 12 HG1 THR 12 17.758 1.572 3.039
101 HG21 THR 12 HG21 THR 12 19.465 -1.512 3.338
102 HG22 THR 12 HG22 THR 12 20.232 -0.229 4.294
103 HG23 THR 12 HG23 THR 12 19.325 -1.508 5.115
104 H LEU 13 H LEU 13 14.344 -0.616 3.329
105 HA LEU 13 HA LEU 13 13.431 0.021 6.109
106 HB2 LEU 13 HB2 LEU 13 12.667 1.233 3.422
107 HB3 LEU 13 HB3 LEU 13 11.828 1.587 4.922
108 HG LEU 13 HG LEU 13 14.807 2.126 4.700
109 HD11 LEU 13 HD11 LEU 13 13.770 3.177 2.725
110 HD12 LEU 13 HD12 LEU 13 12.589 3.992 3.772
111 HD13 LEU 13 HD13 LEU 13 14.320 4.382 3.895
112 HD21 LEU 13 HD21 LEU 13 13.693 2.282 6.924
113 HD22 LEU 13 HD22 LEU 13 14.330 3.830 6.358
114 HD23 LEU 13 HD23 LEU 13 12.588 3.508 6.263
115 H LYS 14 H LYS 14 11.612 -1.160 6.742
116 HA LYS 14 HA LYS 14 9.880 -2.310 4.632
117 HB2 LYS 14 HB2 LYS 14 11.591 -4.044 5.225
118 HB3 LYS 14 HB3 LYS 14 11.023 -3.998 6.906
119 HG2 LYS 14 HG2 LYS 14 8.749 -4.672 6.127
120 HG3 LYS 14 HG3 LYS 14 9.331 -4.673 4.452
121 HD2 LYS 14 HD2 LYS 14 10.929 -6.486 5.010
122 HD3 LYS 14 HD3 LYS 14 10.323 -6.487 6.686
123 HE2 LYS 14 HE2 LYS 14 8.016 -6.926 5.808
124 HE3 LYS 14 HE3 LYS 14 8.667 -6.999 4.169
125 HZ1 LYS 14 HZ1 LYS 14 9.309 -8.810 6.400
126 HZ2 LYS 14 HZ2 LYS 14 8.358 -9.175 5.138
127 HZ3 LYS 14 HZ3 LYS 14 9.983 -8.937 4.882
128 H GLY 15 H GLY 15 7.711 -2.196 5.216
129 HA2 GLY 15 HA2 GLY 15 6.916 -2.048 7.987
130 HA3 GLY 15 HA3 GLY 15 6.803 -0.490 7.151
131 H GLU 16 H GLU 16 4.517 -2.005 8.192
132 HA GLU 16 HA GLU 16 3.046 -2.145 5.704
133 HB2 GLU 16 HB2 GLU 16 2.077 -4.331 6.125
134 HB3 GLU 16 HB3 GLU 16 3.827 -4.472 5.977
135 HG2 GLU 16 HG2 GLU 16 4.074 -4.738 8.390
136 HG3 GLU 16 HG3 GLU 16 2.353 -4.411 8.643
137 H THR 17 H THR 17 0.718 -2.181 5.999
138 HA THR 17 HA THR 17 -0.324 -1.745 8.716
139 HB THR 17 HB THR 17 0.592 0.476 8.221
140 HG1 THR 17 HG1 THR 17 -1.120 1.599 8.781
141 HG21 THR 17 HG21 THR 17 0.444 0.463 5.732
142 HG22 THR 17 HG22 THR 17 -1.331 0.605 5.867
143 HG23 THR 17 HG23 THR 17 -0.278 1.902 6.451
144 H THR 18 H THR 18 -2.769 -1.146 8.465
145 HA THR 18 HA THR 18 -4.059 -2.241 6.109
146 HB THR 18 HB THR 18 -3.537 -4.195 7.659
147 HG1 THR 18 HG1 THR 18 -6.297 -3.901 7.235
148 HG21 THR 18 HG21 THR 18 -4.068 -3.155 9.833
149 HG22 THR 18 HG22 THR 18 -5.780 -3.051 9.371
150 HG23 THR 18 HG23 THR 18 -4.996 -4.635 9.539
151 H THR 19 H THR 19 -6.135 -1.250 5.889
152 HA THR 19 HA THR 19 -7.143 0.385 8.069
153 HB THR 19 HB THR 19 -5.238 1.659 7.105
154 HG1 THR 19 HG1 THR 19 -6.197 3.442 7.281
155 HG21 THR 19 HG21 THR 19 -5.246 1.000 4.783
156 HG22 THR 19 HG22 THR 19 -6.868 1.672 4.552
157 HG23 THR 19 HG23 THR 19 -5.488 2.752 4.889
158 H GLU 20 H GLU 20 -9.216 1.625 7.180
159 HA GLU 20 HA GLU 20 -10.576 -0.107 5.192
160 HB2 GLU 20 HB2 GLU 20 -11.206 -0.519 7.609
161 HB3 GLU 20 HB3 GLU 20 -11.871 1.126 7.645
162 HG2 GLU 20 HG2 GLU 20 -13.485 0.546 5.918
163 HG3 GLU 20 HG3 GLU 20 -12.657 -0.969 5.585
164 H ALA 21 H ALA 21 -11.901 0.944 3.649
165 HA ALA 21 HA ALA 21 -11.902 3.914 3.737
166 HB1 ALA 21 HB1 ALA 21 -11.185 2.220 1.300
167 HB2 ALA 21 HB2 ALA 21 -11.237 3.991 1.391
168 HB3 ALA 21 HB3 ALA 21 -10.003 3.092 2.284
169 H VAL 22 H VAL 22 -13.656 4.877 2.867
170 HA VAL 22 HA VAL 22 -16.053 3.374 2.500
171 HB VAL 22 HB VAL 22 -17.094 5.516 2.039
172 HG11 VAL 22 HG11 VAL 22 -15.094 5.807 4.323
173 HG12 VAL 22 HG12 VAL 22 -16.689 6.574 4.173
174 HG13 VAL 22 HG13 VAL 22 -16.570 4.828 4.386
175 HG21 VAL 22 HG21 VAL 22 -15.387 6.665 0.687
176 HG22 VAL 22 HG22 VAL 22 -15.828 7.635 2.093
177 HG23 VAL 22 HG23 VAL 22 -14.295 6.750 2.091
178 H ASP 23 H ASP 23 -13.601 4.658 0.226
179 HA ASP 23 HA ASP 23 -14.841 3.139 -1.964
180 HB2 ASP 23 HB2 ASP 23 -15.816 5.466 -2.013
181 HB3 ASP 23 HB3 ASP 23 -14.168 6.110 -2.079
182 H ALA 24 H ALA 24 -13.163 2.776 -3.706
183 HA ALA 24 HA ALA 24 -10.561 2.586 -2.507
184 HB1 ALA 24 HB1 ALA 24 -11.260 0.850 -3.938
185 HB2 ALA 24 HB2 ALA 24 -11.552 1.959 -5.283
186 HB3 ALA 24 HB3 ALA 24 -9.890 1.662 -4.721
187 H ALA 25 H ALA 25 -12.061 5.137 -4.513
188 HA ALA 25 HA ALA 25 -9.579 6.169 -5.487
189 HB1 ALA 25 HB1 ALA 25 -12.025 7.812 -4.767
190 HB2 ALA 25 HB2 ALA 25 -10.725 8.236 -5.882
191 HB3 ALA 25 HB3 ALA 25 -11.835 6.912 -6.294
192 H THR 26 H THR 26 -11.089 6.263 -2.322
193 HA THR 26 HA THR 26 -9.488 8.472 -1.248
194 HB THR 26 HB THR 26 -11.076 6.241 0.115
195 HG1 THR 26 HG1 THR 26 -12.077 7.914 -1.373
196 HG21 THR 26 HG21 THR 26 -9.504 7.318 1.693
197 HG22 THR 26 HG22 THR 26 -10.142 8.915 1.244
198 HG23 THR 26 HG23 THR 26 -11.180 7.722 2.067
199 H ALA 27 H ALA 27 -9.367 4.894 -1.376
200 HA ALA 27 HA ALA 27 -7.087 4.517 0.276
201 HB1 ALA 27 HB1 ALA 27 -8.725 2.733 -0.346
202 HB2 ALA 27 HB2 ALA 27 -8.083 2.751 -2.012
203 HB3 ALA 27 HB3 ALA 27 -7.047 2.285 -0.658
204 H GLU 28 H GLU 28 -7.450 4.725 -3.312
205 HA GLU 28 HA GLU 28 -4.809 4.526 -4.118
206 HB2 GLU 28 HB2 GLU 28 -6.808 4.622 -5.602
207 HB3 GLU 28 HB3 GLU 28 -7.043 6.315 -5.170
208 HG2 GLU 28 HG2 GLU 28 -4.616 6.650 -6.167
209 HG3 GLU 28 HG3 GLU 28 -4.905 5.092 -6.931
210 H LYS 29 H LYS 29 -6.526 7.457 -2.942
211 HA LYS 29 HA LYS 29 -4.323 9.186 -3.450
212 HB2 LYS 29 HB2 LYS 29 -6.808 9.787 -3.023
213 HB3 LYS 29 HB3 LYS 29 -6.396 9.711 -1.294
214 HG2 LYS 29 HG2 LYS 29 -4.503 11.338 -1.751
215 HG3 LYS 29 HG3 LYS 29 -5.055 11.437 -3.435
216 HD2 LYS 29 HD2 LYS 29 -7.317 12.164 -2.512
217 HD3 LYS 29 HD3 LYS 29 -6.513 12.242 -0.920
218 HE2 LYS 29 HE2 LYS 29 -4.888 13.861 -1.809
219 HE3 LYS 29 HE3 LYS 29 -5.612 13.728 -3.421
220 HZ1 LYS 29 HZ1 LYS 29 -6.355 15.665 -2.179
221 HZ2 LYS 29 HZ2 LYS 29 -7.596 14.699 -2.596
222 HZ3 LYS 29 HZ3 LYS 29 -7.080 14.686 -1.044
223 H VAL 30 H VAL 30 -5.351 7.513 -0.425
224 HA VAL 30 HA VAL 30 -3.176 8.654 1.050
225 HB VAL 30 HB VAL 30 -5.341 7.707 2.029
226 HG11 VAL 30 HG11 VAL 30 -3.733 5.099 2.027
227 HG12 VAL 30 HG12 VAL 30 -5.206 5.430 2.965
228 HG13 VAL 30 HG13 VAL 30 -5.282 5.409 1.212
229 HG21 VAL 30 HG21 VAL 30 -4.201 7.262 4.178
230 HG22 VAL 30 HG22 VAL 30 -2.649 7.053 3.356
231 HG23 VAL 30 HG23 VAL 30 -3.468 8.626 3.359
232 H PHE 31 H PHE 31 -3.452 5.700 -0.951
233 HA PHE 31 HA PHE 31 -1.154 4.353 -0.122
234 HB2 PHE 31 HB2 PHE 31 -2.258 4.723 -2.945
235 HB3 PHE 31 HB3 PHE 31 -1.015 3.589 -2.524
236 HD1 PHE 31 HD1 PHE 31 -3.203 3.332 0.219
237 HD2 PHE 31 HD2 PHE 31 -2.948 2.444 -3.985
238 HE1 PHE 31 HE1 PHE 31 -4.770 1.447 0.527
239 HE2 PHE 31 HE2 PHE 31 -4.551 0.587 -3.685
240 HZ PHE 31 HZ PHE 31 -5.432 0.050 -1.406
241 H LYS 32 H LYS 32 -1.370 7.046 -2.517
242 HA LYS 32 HA LYS 32 1.438 6.953 -3.161
243 HB2 LYS 32 HB2 LYS 32 -0.179 8.041 -4.619
244 HB3 LYS 32 HB3 LYS 32 -0.618 9.204 -3.354
245 HG2 LYS 32 HG2 LYS 32 1.604 10.218 -3.471
246 HG3 LYS 32 HG3 LYS 32 2.167 8.956 -4.590
247 HD2 LYS 32 HD2 LYS 32 0.502 9.688 -6.244
248 HD3 LYS 32 HD3 LYS 32 -0.087 10.949 -5.136
249 HE2 LYS 32 HE2 LYS 32 1.971 12.158 -5.251
250 HE3 LYS 32 HE3 LYS 32 2.825 10.785 -5.972
251 HZ1 LYS 32 HZ1 LYS 32 1.668 11.028 -7.956
252 HZ2 LYS 32 HZ2 LYS 32 0.632 12.171 -7.361
253 HZ3 LYS 32 HZ3 LYS 32 2.229 12.524 -7.578
254 H GLN 33 H GLN 33 -0.340 9.100 -0.856
255 HA GLN 33 HA GLN 33 2.047 10.427 -0.022
256 HB2 GLN 33 HB2 GLN 33 -0.043 11.474 0.357
257 HB3 GLN 33 HB3 GLN 33 -0.702 10.091 1.212
258 HG2 GLN 33 HG2 GLN 33 1.677 11.629 2.339
259 HG3 GLN 33 HG3 GLN 33 0.023 12.225 2.546
260 HE21 GLN 33 HE21 GLN 33 -0.981 9.485 4.732
261 HE22 GLN 33 HE22 GLN 33 -1.614 10.573 3.520
262 H TYR 34 H TYR 34 0.215 7.767 1.571
263 HA TYR 34 HA TYR 34 1.896 7.384 3.714
264 HB2 TYR 34 HB2 TYR 34 -0.345 6.390 3.463
265 HB3 TYR 34 HB3 TYR 34 0.251 5.314 2.198
266 HD1 TYR 34 HD1 TYR 34 1.226 3.195 2.801
267 HD2 TYR 34 HD2 TYR 34 0.832 6.330 5.730
268 HE1 TYR 34 HE1 TYR 34 2.247 1.715 4.480
269 HE2 TYR 34 HE2 TYR 34 1.831 4.861 7.443
270 HH TYR 34 HH TYR 34 3.082 2.901 7.772
271 H ALA 35 H ALA 35 2.069 5.592 0.565
272 HA ALA 35 HA ALA 35 4.325 4.069 1.434
273 HB1 ALA 35 HB1 ALA 35 3.512 4.696 -1.415
274 HB2 ALA 35 HB2 ALA 35 4.362 3.254 -0.792
275 HB3 ALA 35 HB3 ALA 35 2.681 3.499 -0.381
276 H ASN 36 H ASN 36 4.072 7.171 -0.473
277 HA ASN 36 HA ASN 36 6.883 7.354 -0.932
278 HB2 ASN 36 HB2 ASN 36 5.228 8.677 -2.174
279 HB3 ASN 36 HB3 ASN 36 4.841 9.577 -0.693
280 HD21 ASN 36 HD21 ASN 36 8.352 10.349 -2.688
281 HD22 ASN 36 HD22 ASN 36 7.681 8.764 -2.894
282 H ASP 37 H ASP 37 4.910 8.297 1.874
283 HA ASP 37 HA ASP 37 6.887 9.859 3.241
284 HB2 ASP 37 HB2 ASP 37 4.326 9.639 3.627
285 HB3 ASP 37 HB3 ASP 37 4.712 8.185 4.548
286 H ASN 38 H ASN 38 6.502 6.521 2.656
287 HA ASN 38 HA ASN 38 8.200 5.507 4.821
288 HB2 ASN 38 HB2 ASN 38 5.977 4.536 3.445
289 HB3 ASN 38 HB3 ASN 38 7.296 3.704 2.638
290 HD21 ASN 38 HD21 ASN 38 5.959 1.579 5.406
291 HD22 ASN 38 HD22 ASN 38 5.233 2.485 4.109
292 H GLY 39 H GLY 39 8.811 7.057 1.921
293 HA2 GLY 39 HA2 GLY 39 10.663 7.339 0.646
294 HA3 GLY 39 HA3 GLY 39 11.547 6.298 1.763
295 H VAL 40 H VAL 40 8.753 5.280 -0.214
296 HA VAL 40 HA VAL 40 10.236 3.029 -1.278
297 HB VAL 40 HB VAL 40 8.059 2.424 -2.240
298 HG11 VAL 40 HG11 VAL 40 6.745 2.323 -0.158
299 HG12 VAL 40 HG12 VAL 40 8.434 1.805 0.057
300 HG13 VAL 40 HG13 VAL 40 7.898 3.392 0.628
301 HG21 VAL 40 HG21 VAL 40 7.248 5.249 -1.448
302 HG22 VAL 40 HG22 VAL 40 7.118 4.472 -3.017
303 HG23 VAL 40 HG23 VAL 40 6.076 3.957 -1.722
304 H ASP 41 H ASP 41 10.706 2.476 -3.404
305 HA ASP 41 HA ASP 41 9.992 4.289 -5.579
306 HB2 ASP 41 HB2 ASP 41 12.243 4.992 -4.759
307 HB3 ASP 41 HB3 ASP 41 12.852 3.369 -5.100
308 H GLY 42 H GLY 42 8.420 2.531 -6.120
309 HA2 GLY 42 HA2 GLY 42 9.628 0.363 -7.558
310 HA3 GLY 42 HA3 GLY 42 8.981 -0.204 -6.026
311 H GLU 43 H GLU 43 7.949 -1.460 -7.843
312 HA GLU 43 HA GLU 43 5.530 -0.365 -9.077
313 HB2 GLU 43 HB2 GLU 43 5.565 -2.708 -10.172
314 HB3 GLU 43 HB3 GLU 43 6.716 -1.493 -10.701
315 HG2 GLU 43 HG2 GLU 43 8.531 -2.512 -9.440
316 HG3 GLU 43 HG3 GLU 43 7.409 -3.618 -8.643
317 H TRP 44 H TRP 44 3.496 -1.292 -8.817
318 HA TRP 44 HA TRP 44 3.048 -2.683 -6.245
319 HB2 TRP 44 HB2 TRP 44 1.423 -0.799 -7.958
320 HB3 TRP 44 HB3 TRP 44 0.796 -1.563 -6.512
321 HD1 TRP 44 HD1 TRP 44 3.999 0.563 -7.255
322 HE1 TRP 44 HE1 TRP 44 4.440 2.026 -5.273
323 HE3 TRP 44 HE3 TRP 44 -0.096 -0.586 -4.423
324 HZ2 TRP 44 HZ2 TRP 44 2.977 3.029 -3.003
325 HZ3 TRP 44 HZ3 TRP 44 -0.574 0.672 -2.338
326 HH2 TRP 44 HH2 TRP 44 0.970 2.483 -1.601
327 H THR 45 H THR 45 2.084 -4.585 -6.115
328 HA THR 45 HA THR 45 0.320 -5.657 -8.251
329 HB THR 45 HB THR 45 1.012 -7.876 -7.063
330 HG1 THR 45 HG1 THR 45 3.336 -6.383 -6.511
331 HG21 THR 45 HG21 THR 45 2.994 -6.401 -8.812
332 HG22 THR 45 HG22 THR 45 2.925 -8.182 -8.555
333 HG23 THR 45 HG23 THR 45 1.599 -7.348 -9.376
334 H TYR 46 H TYR 46 -1.517 -7.074 -7.259
335 HA TYR 46 HA TYR 46 -2.154 -6.321 -4.476
336 HB2 TYR 46 HB2 TYR 46 -3.244 -4.666 -5.793
337 HB3 TYR 46 HB3 TYR 46 -3.785 -5.846 -6.966
338 HD1 TYR 46 HD1 TYR 46 -4.259 -4.906 -3.369
339 HD2 TYR 46 HD2 TYR 46 -5.921 -6.764 -6.882
340 HE1 TYR 46 HE1 TYR 46 -6.502 -4.948 -2.294
341 HE2 TYR 46 HE2 TYR 46 -8.149 -6.816 -5.826
342 HH TYR 46 HH TYR 46 -9.248 -6.580 -3.541
343 H ASP 47 H ASP 47 -3.400 -7.761 -3.364
344 HA ASP 47 HA ASP 47 -4.263 -10.269 -4.700
345 HB2 ASP 47 HB2 ASP 47 -2.066 -10.126 -2.924
346 HB3 ASP 47 HB3 ASP 47 -3.396 -10.731 -1.949
347 H ASP 48 H ASP 48 -6.460 -10.049 -4.629
348 HA ASP 48 HA ASP 48 -7.865 -8.386 -2.841
349 HB2 ASP 48 HB2 ASP 48 -8.579 -9.260 -5.137
350 HB3 ASP 48 HB3 ASP 48 -9.054 -10.753 -4.314
351 H ALA 49 H ALA 49 -6.595 -11.450 -2.230
352 HA ALA 49 HA ALA 49 -8.417 -12.694 -0.525
353 HB1 ALA 49 HB1 ALA 49 -5.369 -12.624 -0.433
354 HB2 ALA 49 HB2 ALA 49 -6.373 -13.799 0.425
355 HB3 ALA 49 HB3 ALA 49 -6.382 -13.772 -1.344
356 H THR 50 H THR 50 -5.915 -10.249 0.330
357 HA THR 50 HA THR 50 -7.477 -9.645 2.755
358 HB THR 50 HB THR 50 -6.112 -10.376 4.216
359 HG1 THR 50 HG1 THR 50 -5.016 -8.307 3.857
360 HG21 THR 50 HG21 THR 50 -4.096 -11.158 2.081
361 HG22 THR 50 HG22 THR 50 -4.082 -11.677 3.775
362 HG23 THR 50 HG23 THR 50 -5.402 -12.179 2.730
363 H LYS 51 H LYS 51 -6.659 -8.489 -0.132
364 HA LYS 51 HA LYS 51 -6.691 -6.794 -1.193
365 HB2 LYS 51 HB2 LYS 51 -7.818 -5.552 1.319
366 HB3 LYS 51 HB3 LYS 51 -7.842 -4.790 -0.284
367 HG2 LYS 51 HG2 LYS 51 -9.086 -6.781 -1.174
368 HG3 LYS 51 HG3 LYS 51 -9.142 -7.465 0.444
369 HD2 LYS 51 HD2 LYS 51 -10.514 -5.713 1.269
370 HD3 LYS 51 HD3 LYS 51 -10.389 -4.770 -0.236
371 HE2 LYS 51 HE2 LYS 51 -11.560 -7.560 0.053
372 HE3 LYS 51 HE3 LYS 51 -12.530 -6.091 0.186
373 HZ1 LYS 51 HZ1 LYS 51 -12.598 -7.070 -2.034
374 HZ2 LYS 51 HZ2 LYS 51 -11.975 -5.554 -2.099
375 HZ3 LYS 51 HZ3 LYS 51 -11.009 -6.889 -2.228
376 H THR 52 H THR 52 -4.433 -7.758 -0.025
377 HA THR 52 HA THR 52 -2.654 -5.837 0.989
378 HB THR 52 HB THR 52 -1.931 -8.439 -0.369
379 HG1 THR 52 HG1 THR 52 -2.581 -9.566 1.348
380 HG21 THR 52 HG21 THR 52 -0.083 -7.116 0.572
381 HG22 THR 52 HG22 THR 52 -0.911 -7.036 2.144
382 HG23 THR 52 HG23 THR 52 -0.325 -8.590 1.523
383 H PHE 53 H PHE 53 -1.513 -4.399 -0.031
384 HA PHE 53 HA PHE 53 -0.982 -4.591 -2.942
385 HB2 PHE 53 HB2 PHE 53 -1.385 -2.311 -0.986
386 HB3 PHE 53 HB3 PHE 53 -0.367 -2.079 -2.394
387 HD1 PHE 53 HD1 PHE 53 -1.287 -2.422 -4.725
388 HD2 PHE 53 HD2 PHE 53 -3.829 -2.452 -1.238
389 HE1 PHE 53 HE1 PHE 53 -3.243 -2.019 -6.163
390 HE2 PHE 53 HE2 PHE 53 -5.802 -2.089 -2.710
391 HZ PHE 53 HZ PHE 53 -5.495 -1.853 -5.184
392 H THR 54 H THR 54 1.009 -5.492 -3.221
393 HA THR 54 HA THR 54 3.037 -5.169 -1.053
394 HB THR 54 HB THR 54 3.159 -7.312 -3.185
395 HG1 THR 54 HG1 THR 54 1.166 -7.533 -2.194
396 HG21 THR 54 HG21 THR 54 4.097 -7.267 -0.270
397 HG22 THR 54 HG22 THR 54 4.422 -8.532 -1.478
398 HG23 THR 54 HG23 THR 54 5.131 -6.930 -1.670
399 H VAL 55 H VAL 55 4.994 -4.242 -1.548
400 HA VAL 55 HA VAL 55 5.587 -3.481 -4.349
401 HB VAL 55 HB VAL 55 5.572 -1.739 -1.855
402 HG11 VAL 55 HG11 VAL 55 6.940 -1.118 -4.509
403 HG12 VAL 55 HG12 VAL 55 6.684 0.029 -3.173
404 HG13 VAL 55 HG13 VAL 55 7.752 -1.348 -2.940
405 HG21 VAL 55 HG21 VAL 55 3.480 -1.785 -3.223
406 HG22 VAL 55 HG22 VAL 55 4.271 -0.205 -3.239
407 HG23 VAL 55 HG23 VAL 55 4.436 -1.287 -4.639
408 H THR 56 H THR 56 7.697 -3.961 -4.854
409 HA THR 56 HA THR 56 9.591 -4.472 -2.665
410 HB THR 56 HB THR 56 9.231 -6.265 -5.083
411 HG1 THR 56 HG1 THR 56 8.981 -7.521 -2.742
412 HG21 THR 56 HG21 THR 56 10.915 -7.667 -3.965
413 HG22 THR 56 HG22 THR 56 11.583 -6.061 -4.292
414 HG23 THR 56 HG23 THR 56 11.066 -6.482 -2.643
415 H GLU 57 H GLU 57 10.871 -2.786 -2.832
416 HA GLU 57 HA GLU 57 11.374 -1.114 -5.086
417 HB2 GLU 57 HB2 GLU 57 11.802 -0.515 -2.692
418 HB3 GLU 57 HB3 GLU 57 13.040 -1.752 -2.613
419 HG2 GLU 57 HG2 GLU 57 14.262 -0.433 -4.479
420 HG3 GLU 57 HG3 GLU 57 13.163 0.892 -4.061
Start of MODEL 5
1 H1 MET 1 H MET 1 -17.170 1.336 2.346
2 HA MET 1 HA MET 1 -17.135 0.196 0.270
3 HB2 MET 1 HB2 MET 1 -15.695 1.945 -0.767
4 HB3 MET 1 HB3 MET 1 -14.276 1.232 0.010
5 HG2 MET 1 HG2 MET 1 -14.292 0.427 -2.237
6 HG3 MET 1 HG3 MET 1 -14.859 -0.930 -1.244
7 HE1 MET 1 HE1 MET 1 -17.490 1.839 -3.846
8 HE2 MET 1 HE2 MET 1 -16.085 2.306 -2.864
9 HE3 MET 1 HE3 MET 1 -15.845 1.413 -4.381
10 H GLY 2 H GLY 2 -13.681 -0.110 1.265
11 HA2 GLY 2 HA2 GLY 2 -14.313 -2.642 2.658
12 HA3 GLY 2 HA3 GLY 2 -13.222 -2.676 1.289
13 H THR 3 H THR 3 -11.931 -3.636 3.208
14 HA THR 3 HA THR 3 -10.134 -1.497 4.237
15 HB THR 3 HB THR 3 -11.019 -2.761 6.106
16 HG1 THR 3 HG1 THR 3 -8.767 -2.325 6.090
17 HG21 THR 3 HG21 THR 3 -11.793 -4.802 4.977
18 HG22 THR 3 HG22 THR 3 -10.115 -5.264 4.629
19 HG23 THR 3 HG23 THR 3 -10.690 -5.210 6.306
20 H TYR 4 H TYR 4 -7.916 -1.729 3.883
21 HA TYR 4 HA TYR 4 -7.174 -3.609 1.708
22 HB2 TYR 4 HB2 TYR 4 -6.777 -0.589 1.677
23 HB3 TYR 4 HB3 TYR 4 -6.167 -1.713 0.469
24 HD1 TYR 4 HD1 TYR 4 -7.851 -2.923 -1.011
25 HD2 TYR 4 HD2 TYR 4 -9.040 0.153 1.714
26 HE1 TYR 4 HE1 TYR 4 -9.975 -2.760 -2.190
27 HE2 TYR 4 HE2 TYR 4 -11.237 0.334 0.513
28 HH TYR 4 HH TYR 4 -12.103 -1.804 -2.183
29 H LYS 5 H LYS 5 -5.417 -4.698 2.310
30 HA LYS 5 HA LYS 5 -3.620 -3.658 4.347
31 HB2 LYS 5 HB2 LYS 5 -4.520 -6.111 3.920
32 HB3 LYS 5 HB3 LYS 5 -3.125 -6.234 2.840
33 HG2 LYS 5 HG2 LYS 5 -1.638 -5.610 4.774
34 HG3 LYS 5 HG3 LYS 5 -3.071 -5.462 5.804
35 HD2 LYS 5 HD2 LYS 5 -3.589 -7.879 5.337
36 HD3 LYS 5 HD3 LYS 5 -2.057 -7.989 4.435
37 HE2 LYS 5 HE2 LYS 5 -0.761 -7.447 6.404
38 HE3 LYS 5 HE3 LYS 5 -2.210 -7.000 7.314
39 HZ1 LYS 5 HZ1 LYS 5 -2.907 -9.308 7.260
40 HZ2 LYS 5 HZ2 LYS 5 -1.604 -9.741 6.358
41 HZ3 LYS 5 HZ3 LYS 5 -1.394 -9.217 7.901
42 H LEU 6 H LEU 6 -1.304 -3.479 4.244
43 HA LEU 6 HA LEU 6 -0.118 -3.015 1.595
44 HB2 LEU 6 HB2 LEU 6 -1.172 -0.938 3.276
45 HB3 LEU 6 HB3 LEU 6 0.584 -0.835 3.369
46 HG LEU 6 HG LEU 6 -0.759 -0.986 0.664
47 HD11 LEU 6 HD11 LEU 6 -1.959 0.885 1.463
48 HD12 LEU 6 HD12 LEU 6 -0.621 1.420 2.500
49 HD13 LEU 6 HD13 LEU 6 -0.516 1.634 0.751
50 HD21 LEU 6 HD21 LEU 6 1.909 -0.381 1.790
51 HD22 LEU 6 HD22 LEU 6 1.458 -1.016 0.199
52 HD23 LEU 6 HD23 LEU 6 1.379 0.733 0.510
53 H ILE 7 H ILE 7 2.026 -3.609 1.560
54 HA ILE 7 HA ILE 7 3.676 -3.285 3.918
55 HB ILE 7 HB ILE 7 3.068 -5.516 4.397
56 HG12 ILE 7 HG12 ILE 7 5.636 -5.766 2.785
57 HG13 ILE 7 HG13 ILE 7 5.510 -5.103 4.420
58 HG21 ILE 7 HG21 ILE 7 1.840 -6.273 2.521
59 HG22 ILE 7 HG22 ILE 7 3.203 -6.019 1.409
60 HG23 ILE 7 HG23 ILE 7 3.252 -7.348 2.564
61 HD11 ILE 7 HD11 ILE 7 4.931 -7.971 3.579
62 HD12 ILE 7 HD12 ILE 7 6.257 -7.377 4.588
63 HD13 ILE 7 HD13 ILE 7 4.592 -7.311 5.198
64 H LEU 8 H LEU 8 5.470 -2.241 3.298
65 HA LEU 8 HA LEU 8 6.036 -1.974 0.442
66 HB2 LEU 8 HB2 LEU 8 7.221 -0.641 2.924
67 HB3 LEU 8 HB3 LEU 8 7.575 -0.182 1.261
68 HG LEU 8 HG LEU 8 6.018 1.431 2.013
69 HD11 LEU 8 HD11 LEU 8 4.464 -0.728 0.516
70 HD12 LEU 8 HD12 LEU 8 3.835 0.903 0.832
71 HD13 LEU 8 HD13 LEU 8 5.268 0.696 -0.179
72 HD21 LEU 8 HD21 LEU 8 5.390 -0.259 3.988
73 HD22 LEU 8 HD22 LEU 8 4.343 1.101 3.548
74 HD23 LEU 8 HD23 LEU 8 3.963 -0.534 2.965
75 H ASN 9 H ASN 9 8.279 -2.212 -0.383
76 HA ASN 9 HA ASN 9 10.179 -3.635 1.401
77 HB2 ASN 9 HB2 ASN 9 9.278 -5.100 -0.474
78 HB3 ASN 9 HB3 ASN 9 9.989 -3.973 -1.624
79 HD21 ASN 9 HD21 ASN 9 13.291 -5.225 -1.133
80 HD22 ASN 9 HD22 ASN 9 12.352 -3.871 -1.752
81 H GLY 10 H GLY 10 11.934 -2.390 1.854
82 HA2 GLY 10 HA2 GLY 10 12.908 -0.425 -0.155
83 HA3 GLY 10 HA3 GLY 10 12.566 0.104 1.480
84 H LYS 11 H LYS 11 15.084 0.198 0.087
85 HA LYS 11 HA LYS 11 16.929 -1.764 0.578
86 HB2 LYS 11 HB2 LYS 11 17.266 0.446 -0.607
87 HB3 LYS 11 HB3 LYS 11 17.493 1.209 0.971
88 HG2 LYS 11 HG2 LYS 11 19.430 -0.416 1.357
89 HG3 LYS 11 HG3 LYS 11 19.176 -1.012 -0.293
90 HD2 LYS 11 HD2 LYS 11 19.542 1.340 -1.128
91 HD3 LYS 11 HD3 LYS 11 19.952 1.815 0.539
92 HE2 LYS 11 HE2 LYS 11 21.715 -0.013 0.539
93 HE3 LYS 11 HE3 LYS 11 21.373 -0.277 -1.177
94 HZ1 LYS 11 HZ1 LYS 11 22.067 1.976 -1.633
95 HZ2 LYS 11 HZ2 LYS 11 22.291 2.302 -0.040
96 HZ3 LYS 11 HZ3 LYS 11 23.269 1.222 -0.800
97 H THR 12 H THR 12 16.357 0.817 3.046
98 HA THR 12 HA THR 12 17.966 -0.732 4.992
99 HB THR 12 HB THR 12 17.832 1.506 6.266
100 HG1 THR 12 HG1 THR 12 17.397 3.279 4.902
101 HG21 THR 12 HG21 THR 12 19.284 1.430 3.588
102 HG22 THR 12 HG22 THR 12 19.605 2.579 4.903
103 HG23 THR 12 HG23 THR 12 19.900 0.848 5.147
104 H LEU 13 H LEU 13 14.713 0.385 4.291
105 HA LEU 13 HA LEU 13 13.870 -0.072 7.102
106 HB2 LEU 13 HB2 LEU 13 14.279 2.361 6.462
107 HB3 LEU 13 HB3 LEU 13 13.002 2.198 5.259
108 HG LEU 13 HG LEU 13 11.345 1.783 7.050
109 HD11 LEU 13 HD11 LEU 13 12.520 0.752 8.847
110 HD12 LEU 13 HD12 LEU 13 13.772 2.013 8.861
111 HD13 LEU 13 HD13 LEU 13 12.150 2.379 9.456
112 HD21 LEU 13 HD21 LEU 13 13.054 4.263 7.067
113 HD22 LEU 13 HD22 LEU 13 11.407 4.033 6.459
114 HD23 LEU 13 HD23 LEU 13 11.701 4.119 8.209
115 H LYS 14 H LYS 14 11.936 -1.138 7.350
116 HA LYS 14 HA LYS 14 10.232 -1.502 4.928
117 HB2 LYS 14 HB2 LYS 14 11.463 -3.507 6.747
118 HB3 LYS 14 HB3 LYS 14 9.767 -3.809 6.356
119 HG2 LYS 14 HG2 LYS 14 10.318 -3.794 3.941
120 HG3 LYS 14 HG3 LYS 14 11.970 -3.271 4.303
121 HD2 LYS 14 HD2 LYS 14 12.460 -5.382 5.409
122 HD3 LYS 14 HD3 LYS 14 10.759 -5.895 5.267
123 HE2 LYS 14 HE2 LYS 14 10.919 -5.870 2.812
124 HE3 LYS 14 HE3 LYS 14 12.569 -5.241 2.896
125 HZ1 LYS 14 HZ1 LYS 14 12.495 -7.650 2.522
126 HZ2 LYS 14 HZ2 LYS 14 13.271 -7.293 3.924
127 HZ3 LYS 14 HZ3 LYS 14 11.736 -7.876 3.963
128 H GLY 15 H GLY 15 7.976 -2.574 5.663
129 HA2 GLY 15 HA2 GLY 15 6.858 -2.047 8.184
130 HA3 GLY 15 HA3 GLY 15 6.543 -0.632 7.201
131 H GLU 16 H GLU 16 4.636 -2.538 8.316
132 HA GLU 16 HA GLU 16 3.097 -3.066 5.857
133 HB2 GLU 16 HB2 GLU 16 2.343 -5.201 6.702
134 HB3 GLU 16 HB3 GLU 16 4.109 -5.225 6.626
135 HG2 GLU 16 HG2 GLU 16 3.981 -4.554 9.165
136 HG3 GLU 16 HG3 GLU 16 2.293 -5.082 9.051
137 H THR 17 H THR 17 0.778 -2.937 6.266
138 HA THR 17 HA THR 17 -0.382 -2.262 8.784
139 HB THR 17 HB THR 17 0.898 -0.093 8.089
140 HG1 THR 17 HG1 THR 17 -0.834 1.108 8.910
141 HG21 THR 17 HG21 THR 17 -0.170 1.376 6.521
142 HG22 THR 17 HG22 THR 17 0.029 -0.176 5.686
143 HG23 THR 17 HG23 THR 17 -1.554 0.286 6.343
144 H THR 18 H THR 18 -2.713 -1.476 8.404
145 HA THR 18 HA THR 18 -3.800 -2.103 5.720
146 HB THR 18 HB THR 18 -4.253 -3.953 7.464
147 HG1 THR 18 HG1 THR 18 -6.704 -3.513 6.891
148 HG21 THR 18 HG21 THR 18 -6.223 -3.490 8.955
149 HG22 THR 18 HG22 THR 18 -4.746 -2.628 9.432
150 HG23 THR 18 HG23 THR 18 -6.041 -1.765 8.584
151 H THR 19 H THR 19 -5.914 -1.053 5.357
152 HA THR 19 HA THR 19 -6.529 1.287 7.065
153 HB THR 19 HB THR 19 -6.785 2.748 5.181
154 HG1 THR 19 HG1 THR 19 -6.359 1.963 3.070
155 HG21 THR 19 HG21 THR 19 -4.445 2.607 5.922
156 HG22 THR 19 HG22 THR 19 -4.173 1.231 4.836
157 HG23 THR 19 HG23 THR 19 -4.529 2.833 4.157
158 H GLU 20 H GLU 20 -8.739 2.088 6.705
159 HA GLU 20 HA GLU 20 -10.615 0.256 5.347
160 HB2 GLU 20 HB2 GLU 20 -10.778 -0.402 7.640
161 HB3 GLU 20 HB3 GLU 20 -10.740 1.269 8.213
162 HG2 GLU 20 HG2 GLU 20 -12.982 1.669 7.300
163 HG3 GLU 20 HG3 GLU 20 -12.984 0.076 6.526
164 H ALA 21 H ALA 21 -11.959 1.430 3.994
165 HA ALA 21 HA ALA 21 -11.517 4.372 3.993
166 HB1 ALA 21 HB1 ALA 21 -11.762 2.644 1.503
167 HB2 ALA 21 HB2 ALA 21 -11.057 4.269 1.663
168 HB3 ALA 21 HB3 ALA 21 -10.197 2.867 2.317
169 H VAL 22 H VAL 22 -13.195 5.671 3.214
170 HA VAL 22 HA VAL 22 -15.886 4.612 3.568
171 HB VAL 22 HB VAL 22 -16.539 7.046 3.321
172 HG11 VAL 22 HG11 VAL 22 -14.466 6.510 5.488
173 HG12 VAL 22 HG12 VAL 22 -15.702 7.780 5.495
174 HG13 VAL 22 HG13 VAL 22 -16.189 6.080 5.568
175 HG21 VAL 22 HG21 VAL 22 -14.625 7.779 1.931
176 HG22 VAL 22 HG22 VAL 22 -14.865 8.786 3.370
177 HG23 VAL 22 HG23 VAL 22 -13.550 7.602 3.338
178 H ASP 23 H ASP 23 -13.735 5.533 0.962
179 HA ASP 23 HA ASP 23 -15.586 4.393 -1.002
180 HB2 ASP 23 HB2 ASP 23 -15.786 6.999 -0.877
181 HB3 ASP 23 HB3 ASP 23 -14.183 7.005 -1.613
182 H ALA 24 H ALA 24 -14.377 3.853 -3.035
183 HA ALA 24 HA ALA 24 -11.820 2.635 -2.453
184 HB1 ALA 24 HB1 ALA 24 -13.341 1.385 -3.788
185 HB2 ALA 24 HB2 ALA 24 -13.685 2.808 -4.859
186 HB3 ALA 24 HB3 ALA 24 -12.111 1.967 -4.914
187 H ALA 25 H ALA 25 -12.863 5.690 -3.687
188 HA ALA 25 HA ALA 25 -10.532 6.284 -5.315
189 HB1 ALA 25 HB1 ALA 25 -12.607 7.300 -5.970
190 HB2 ALA 25 HB2 ALA 25 -12.941 7.869 -4.321
191 HB3 ALA 25 HB3 ALA 25 -11.637 8.610 -5.262
192 H THR 26 H THR 26 -11.622 6.895 -1.978
193 HA THR 26 HA THR 26 -9.488 8.538 -1.069
194 HB THR 26 HB THR 26 -10.883 6.418 0.592
195 HG1 THR 26 HG1 THR 26 -11.928 8.995 0.268
196 HG21 THR 26 HG21 THR 26 -10.794 8.266 2.323
197 HG22 THR 26 HG22 THR 26 -9.212 7.630 1.829
198 HG23 THR 26 HG23 THR 26 -9.781 9.185 1.192
199 H ALA 27 H ALA 27 -9.911 4.973 -1.015
200 HA ALA 27 HA ALA 27 -7.403 4.267 0.054
201 HB1 ALA 27 HB1 ALA 27 -9.359 2.747 -0.130
202 HB2 ALA 27 HB2 ALA 27 -9.209 2.757 -1.901
203 HB3 ALA 27 HB3 ALA 27 -7.927 2.039 -0.911
204 H GLU 28 H GLU 28 -8.428 4.524 -3.397
205 HA GLU 28 HA GLU 28 -6.061 3.853 -4.695
206 HB2 GLU 28 HB2 GLU 28 -8.478 5.546 -5.291
207 HB3 GLU 28 HB3 GLU 28 -7.115 5.604 -6.414
208 HG2 GLU 28 HG2 GLU 28 -7.284 3.116 -6.686
209 HG3 GLU 28 HG3 GLU 28 -8.665 3.111 -5.578
210 H LYS 29 H LYS 29 -7.145 7.028 -3.397
211 HA LYS 29 HA LYS 29 -4.748 8.414 -4.123
212 HB2 LYS 29 HB2 LYS 29 -7.056 8.989 -2.245
213 HB3 LYS 29 HB3 LYS 29 -5.676 10.088 -2.326
214 HG2 LYS 29 HG2 LYS 29 -7.219 9.193 -4.815
215 HG3 LYS 29 HG3 LYS 29 -7.725 10.580 -3.834
216 HD2 LYS 29 HD2 LYS 29 -5.492 11.625 -4.191
217 HD3 LYS 29 HD3 LYS 29 -5.026 10.240 -5.211
218 HE2 LYS 29 HE2 LYS 29 -6.854 10.726 -6.777
219 HE3 LYS 29 HE3 LYS 29 -7.453 12.019 -5.732
220 HZ1 LYS 29 HZ1 LYS 29 -6.195 13.256 -7.130
221 HZ2 LYS 29 HZ2 LYS 29 -4.968 12.845 -6.118
222 HZ3 LYS 29 HZ3 LYS 29 -5.170 12.034 -7.531
223 H VAL 30 H VAL 30 -5.622 6.868 -1.007
224 HA VAL 30 HA VAL 30 -3.597 7.779 0.612
225 HB VAL 30 HB VAL 30 -5.315 5.329 0.557
226 HG11 VAL 30 HG11 VAL 30 -3.028 5.521 2.586
227 HG12 VAL 30 HG12 VAL 30 -4.268 4.226 2.473
228 HG13 VAL 30 HG13 VAL 30 -3.067 4.414 1.187
229 HG21 VAL 30 HG21 VAL 30 -6.056 6.137 2.709
230 HG22 VAL 30 HG22 VAL 30 -4.762 7.317 2.824
231 HG23 VAL 30 HG23 VAL 30 -6.098 7.505 1.557
232 H PHE 31 H PHE 31 -3.517 4.961 -1.623
233 HA PHE 31 HA PHE 31 -1.225 3.686 -0.864
234 HB2 PHE 31 HB2 PHE 31 -2.139 4.216 -3.724
235 HB3 PHE 31 HB3 PHE 31 -1.057 2.927 -3.217
236 HD1 PHE 31 HD1 PHE 31 -2.751 2.401 -0.549
237 HD2 PHE 31 HD2 PHE 31 -3.753 2.725 -4.731
238 HE1 PHE 31 HE1 PHE 31 -4.771 1.009 -0.175
239 HE2 PHE 31 HE2 PHE 31 -5.776 1.334 -4.351
240 HZ PHE 31 HZ PHE 31 -6.287 0.476 -2.074
241 H LYS 32 H LYS 32 -1.342 6.435 -3.175
242 HA LYS 32 HA LYS 32 1.490 6.513 -3.538
243 HB2 LYS 32 HB2 LYS 32 -0.815 8.331 -4.265
244 HB3 LYS 32 HB3 LYS 32 0.844 8.875 -4.539
245 HG2 LYS 32 HG2 LYS 32 1.130 6.568 -5.784
246 HG3 LYS 32 HG3 LYS 32 -0.639 6.500 -5.731
247 HD2 LYS 32 HD2 LYS 32 -0.758 8.671 -6.920
248 HD3 LYS 32 HD3 LYS 32 1.021 8.744 -6.959
249 HE2 LYS 32 HE2 LYS 32 1.095 6.636 -8.253
250 HE3 LYS 32 HE3 LYS 32 -0.667 6.504 -8.174
251 HZ1 LYS 32 HZ1 LYS 32 0.857 8.636 -9.561
252 HZ2 LYS 32 HZ2 LYS 32 -0.015 7.441 -10.277
253 HZ3 LYS 32 HZ3 LYS 32 -0.784 8.613 -9.421
254 H GLN 33 H GLN 33 -0.529 8.186 -1.155
255 HA GLN 33 HA GLN 33 1.556 10.081 -0.411
256 HB2 GLN 33 HB2 GLN 33 -0.656 10.907 -0.280
257 HB3 GLN 33 HB3 GLN 33 -1.274 9.430 0.470
258 HG2 GLN 33 HG2 GLN 33 0.782 11.007 1.995
259 HG3 GLN 33 HG3 GLN 33 -0.843 11.690 1.865
260 HE21 GLN 33 HE21 GLN 33 -2.181 8.741 3.688
261 HE22 GLN 33 HE22 GLN 33 -2.538 9.492 2.132
262 H TYR 34 H TYR 34 0.084 7.059 0.866
263 HA TYR 34 HA TYR 34 1.203 7.069 3.438
264 HB2 TYR 34 HB2 TYR 34 -0.588 5.575 2.903
265 HB3 TYR 34 HB3 TYR 34 0.305 4.853 1.570
266 HD1 TYR 34 HD1 TYR 34 1.238 2.720 1.964
267 HD2 TYR 34 HD2 TYR 34 0.683 5.445 5.270
268 HE1 TYR 34 HE1 TYR 34 2.117 1.001 3.517
269 HE2 TYR 34 HE2 TYR 34 1.587 3.709 6.836
270 HH TYR 34 HH TYR 34 2.641 0.488 5.696
271 H ALA 35 H ALA 35 2.501 5.325 0.532
272 HA ALA 35 HA ALA 35 4.604 4.118 2.092
273 HB1 ALA 35 HB1 ALA 35 4.024 4.141 -0.911
274 HB2 ALA 35 HB2 ALA 35 5.179 3.063 -0.094
275 HB3 ALA 35 HB3 ALA 35 3.446 2.929 0.256
276 H ASN 36 H ASN 36 4.289 7.017 0.180
277 HA ASN 36 HA ASN 36 7.029 7.509 -0.447
278 HB2 ASN 36 HB2 ASN 36 5.184 8.624 -1.638
279 HB3 ASN 36 HB3 ASN 36 4.618 9.359 -0.122
280 HD21 ASN 36 HD21 ASN 36 7.894 10.909 -2.085
281 HD22 ASN 36 HD22 ASN 36 7.408 9.247 -2.403
282 H ASP 37 H ASP 37 5.157 7.830 2.521
283 HA ASP 37 HA ASP 37 7.062 9.382 4.032
284 HB2 ASP 37 HB2 ASP 37 4.516 9.016 4.424
285 HB3 ASP 37 HB3 ASP 37 4.981 7.459 5.109
286 H ASN 38 H ASN 38 6.778 6.053 2.996
287 HA ASN 38 HA ASN 38 8.650 5.033 5.033
288 HB2 ASN 38 HB2 ASN 38 6.386 3.928 4.055
289 HB3 ASN 38 HB3 ASN 38 7.509 3.316 2.845
290 HD21 ASN 38 HD21 ASN 38 7.176 0.882 5.721
291 HD22 ASN 38 HD22 ASN 38 6.031 1.643 4.600
292 H GLY 39 H GLY 39 8.731 6.423 1.903
293 HA2 GLY 39 HA2 GLY 39 10.484 6.827 0.483
294 HA3 GLY 39 HA3 GLY 39 11.559 6.010 1.601
295 H VAL 40 H VAL 40 9.137 5.454 -0.937
296 HA VAL 40 HA VAL 40 10.376 2.849 -1.635
297 HB VAL 40 HB VAL 40 8.135 2.180 -2.502
298 HG11 VAL 40 HG11 VAL 40 7.953 2.962 0.444
299 HG12 VAL 40 HG12 VAL 40 7.105 1.641 -0.404
300 HG13 VAL 40 HG13 VAL 40 8.843 1.525 -0.182
301 HG21 VAL 40 HG21 VAL 40 6.946 4.563 -1.071
302 HG22 VAL 40 HG22 VAL 40 7.317 4.576 -2.805
303 HG23 VAL 40 HG23 VAL 40 6.143 3.414 -2.167
304 H ASP 41 H ASP 41 10.813 2.456 -3.809
305 HA ASP 41 HA ASP 41 9.933 4.278 -5.923
306 HB2 ASP 41 HB2 ASP 41 12.160 5.120 -4.922
307 HB3 ASP 41 HB3 ASP 41 12.882 3.651 -5.576
308 H GLY 42 H GLY 42 8.934 1.768 -5.462
309 HA2 GLY 42 HA2 GLY 42 10.440 -0.102 -7.230
310 HA3 GLY 42 HA3 GLY 42 9.406 -0.591 -5.903
311 H GLU 43 H GLU 43 7.782 -1.711 -6.814
312 HA GLU 43 HA GLU 43 5.985 -0.479 -8.767
313 HB2 GLU 43 HB2 GLU 43 6.123 -2.303 -10.323
314 HB3 GLU 43 HB3 GLU 43 7.761 -1.677 -10.095
315 HG2 GLU 43 HG2 GLU 43 8.202 -3.576 -8.497
316 HG3 GLU 43 HG3 GLU 43 6.576 -4.191 -8.834
317 H TRP 44 H TRP 44 3.909 -1.789 -8.851
318 HA TRP 44 HA TRP 44 3.400 -2.690 -6.060
319 HB2 TRP 44 HB2 TRP 44 2.091 -0.541 -7.734
320 HB3 TRP 44 HB3 TRP 44 1.190 -1.340 -6.450
321 HD1 TRP 44 HD1 TRP 44 4.756 0.199 -6.665
322 HE1 TRP 44 HE1 TRP 44 5.106 1.787 -4.693
323 HE3 TRP 44 HE3 TRP 44 0.201 -0.338 -4.389
324 HZ2 TRP 44 HZ2 TRP 44 3.577 2.758 -2.426
325 HZ3 TRP 44 HZ3 TRP 44 -0.332 0.949 -2.338
326 HH2 TRP 44 HH2 TRP 44 1.340 2.494 -1.349
327 H THR 45 H THR 45 2.058 -4.383 -5.756
328 HA THR 45 HA THR 45 0.601 -5.559 -8.064
329 HB THR 45 HB THR 45 2.452 -6.990 -6.115
330 HG1 THR 45 HG1 THR 45 3.508 -6.139 -7.884
331 HG21 THR 45 HG21 THR 45 0.408 -8.347 -6.476
332 HG22 THR 45 HG22 THR 45 0.636 -8.203 -8.232
333 HG23 THR 45 HG23 THR 45 1.830 -9.072 -7.252
334 H TYR 46 H TYR 46 -1.416 -6.182 -7.624
335 HA TYR 46 HA TYR 46 -2.364 -5.916 -4.820
336 HB2 TYR 46 HB2 TYR 46 -3.335 -4.317 -6.401
337 HB3 TYR 46 HB3 TYR 46 -3.799 -5.620 -7.488
338 HD1 TYR 46 HD1 TYR 46 -4.226 -4.728 -3.830
339 HD2 TYR 46 HD2 TYR 46 -6.054 -6.176 -7.456
340 HE1 TYR 46 HE1 TYR 46 -6.425 -4.813 -2.678
341 HE2 TYR 46 HE2 TYR 46 -8.304 -6.181 -6.349
342 HH TYR 46 HH TYR 46 -9.437 -5.443 -4.403
343 H ASP 47 H ASP 47 -3.376 -7.567 -3.781
344 HA ASP 47 HA ASP 47 -4.433 -9.893 -5.267
345 HB2 ASP 47 HB2 ASP 47 -2.532 -9.894 -2.901
346 HB3 ASP 47 HB3 ASP 47 -3.614 -11.249 -3.217
347 H ASP 48 H ASP 48 -6.512 -10.314 -4.690
348 HA ASP 48 HA ASP 48 -7.911 -8.418 -3.019
349 HB2 ASP 48 HB2 ASP 48 -8.651 -9.267 -5.292
350 HB3 ASP 48 HB3 ASP 48 -8.947 -10.837 -4.547
351 H ALA 49 H ALA 49 -6.287 -11.320 -2.377
352 HA ALA 49 HA ALA 49 -7.999 -12.945 -0.917
353 HB1 ALA 49 HB1 ALA 49 -5.015 -12.374 -0.613
354 HB2 ALA 49 HB2 ALA 49 -5.849 -13.719 0.195
355 HB3 ALA 49 HB3 ALA 49 -5.773 -13.664 -1.574
356 H THR 50 H THR 50 -5.778 -10.457 0.505
357 HA THR 50 HA THR 50 -7.951 -9.703 2.390
358 HB THR 50 HB THR 50 -6.249 -10.600 3.798
359 HG1 THR 50 HG1 THR 50 -5.697 -7.825 3.583
360 HG21 THR 50 HG21 THR 50 -4.260 -10.929 2.688
361 HG22 THR 50 HG22 THR 50 -4.357 -9.378 1.832
362 HG23 THR 50 HG23 THR 50 -3.855 -9.421 3.531
363 H LYS 51 H LYS 51 -7.317 -8.876 -0.383
364 HA LYS 51 HA LYS 51 -7.021 -7.007 -1.661
365 HB2 LYS 51 HB2 LYS 51 -8.214 -5.632 0.788
366 HB3 LYS 51 HB3 LYS 51 -8.169 -4.960 -0.846
367 HG2 LYS 51 HG2 LYS 51 -9.660 -6.776 -1.635
368 HG3 LYS 51 HG3 LYS 51 -9.537 -7.584 -0.064
369 HD2 LYS 51 HD2 LYS 51 -10.673 -5.695 1.025
370 HD3 LYS 51 HD3 LYS 51 -10.729 -4.814 -0.522
371 HE2 LYS 51 HE2 LYS 51 -11.986 -7.559 -0.054
372 HE3 LYS 51 HE3 LYS 51 -12.879 -6.037 0.084
373 HZ1 LYS 51 HZ1 LYS 51 -11.437 -6.807 -2.384
374 HZ2 LYS 51 HZ2 LYS 51 -13.012 -7.195 -2.129
375 HZ3 LYS 51 HZ3 LYS 51 -12.560 -5.618 -2.209
376 H THR 52 H THR 52 -4.604 -7.757 -0.733
377 HA THR 52 HA THR 52 -3.272 -5.551 0.702
378 HB THR 52 HB THR 52 -3.019 -8.010 1.363
379 HG1 THR 52 HG1 THR 52 -0.716 -7.728 1.593
380 HG21 THR 52 HG21 THR 52 -1.371 -8.075 -1.199
381 HG22 THR 52 HG22 THR 52 -1.280 -9.284 0.099
382 HG23 THR 52 HG23 THR 52 -2.788 -9.068 -0.808
383 H PHE 53 H PHE 53 -1.595 -4.360 -0.120
384 HA PHE 53 HA PHE 53 -0.854 -4.786 -2.969
385 HB2 PHE 53 HB2 PHE 53 -0.928 -2.267 -1.260
386 HB3 PHE 53 HB3 PHE 53 -0.130 -2.342 -2.825
387 HD1 PHE 53 HD1 PHE 53 -1.440 -2.220 -4.875
388 HD2 PHE 53 HD2 PHE 53 -3.400 -2.647 -1.057
389 HE1 PHE 53 HE1 PHE 53 -3.633 -1.782 -5.951
390 HE2 PHE 53 HE2 PHE 53 -5.593 -2.210 -2.140
391 HZ PHE 53 HZ PHE 53 -5.713 -1.780 -4.584
392 H THR 54 H THR 54 1.099 -5.650 -3.276
393 HA THR 54 HA THR 54 3.173 -5.497 -1.154
394 HB THR 54 HB THR 54 4.140 -7.471 -2.527
395 HG1 THR 54 HG1 THR 54 2.743 -7.191 -4.308
396 HG21 THR 54 HG21 THR 54 3.079 -7.788 -0.300
397 HG22 THR 54 HG22 THR 54 1.495 -7.913 -1.091
398 HG23 THR 54 HG23 THR 54 2.740 -9.134 -1.404
399 H VAL 55 H VAL 55 4.971 -4.414 -1.518
400 HA VAL 55 HA VAL 55 5.556 -3.382 -4.233
401 HB VAL 55 HB VAL 55 6.080 -2.251 -1.467
402 HG11 VAL 55 HG11 VAL 55 7.303 -1.200 -4.052
403 HG12 VAL 55 HG12 VAL 55 7.359 -0.415 -2.464
404 HG13 VAL 55 HG13 VAL 55 8.187 -1.960 -2.711
405 HG21 VAL 55 HG21 VAL 55 3.952 -1.574 -2.222
406 HG22 VAL 55 HG22 VAL 55 5.025 -0.201 -2.541
407 HG23 VAL 55 HG23 VAL 55 4.530 -1.254 -3.873
408 H THR 56 H THR 56 7.390 -4.032 -5.232
409 HA THR 56 HA THR 56 9.667 -5.069 -3.618
410 HB THR 56 HB THR 56 8.804 -5.886 -6.424
411 HG1 THR 56 HG1 THR 56 8.402 -7.841 -5.460
412 HG21 THR 56 HG21 THR 56 10.697 -7.692 -5.815
413 HG22 THR 56 HG22 THR 56 11.073 -6.166 -6.640
414 HG23 THR 56 HG23 THR 56 11.338 -6.319 -4.894
415 H GLU 57 H GLU 57 11.261 -3.650 -3.560
416 HA GLU 57 HA GLU 57 11.833 -1.723 -5.712
417 HB2 GLU 57 HB2 GLU 57 11.541 -1.097 -3.240
418 HB3 GLU 57 HB3 GLU 57 13.026 -1.995 -2.919
419 HG2 GLU 57 HG2 GLU 57 13.980 -0.381 -4.847
420 HG3 GLU 57 HG3 GLU 57 12.610 0.619 -4.358
Start of MODEL 6
1 H1 MET 1 H MET 1 -17.010 0.308 2.736
2 HA MET 1 HA MET 1 -17.155 -0.467 0.430
3 HB2 MET 1 HB2 MET 1 -15.986 1.271 -0.636
4 HB3 MET 1 HB3 MET 1 -14.471 0.920 0.208
5 HG2 MET 1 HG2 MET 1 -14.170 -1.106 -1.027
6 HG3 MET 1 HG3 MET 1 -15.832 -1.091 -1.615
7 HE1 MET 1 HE1 MET 1 -16.755 0.242 -3.559
8 HE2 MET 1 HE2 MET 1 -16.437 1.789 -2.742
9 HE3 MET 1 HE3 MET 1 -15.885 1.540 -4.406
10 H GLY 2 H GLY 2 -13.785 -0.646 2.061
11 HA2 GLY 2 HA2 GLY 2 -14.371 -3.256 3.021
12 HA3 GLY 2 HA3 GLY 2 -13.381 -3.282 1.547
13 H THR 3 H THR 3 -11.968 -4.226 3.388
14 HA THR 3 HA THR 3 -10.333 -2.098 4.586
15 HB THR 3 HB THR 3 -11.213 -3.306 6.382
16 HG1 THR 3 HG1 THR 3 -9.154 -3.166 6.867
17 HG21 THR 3 HG21 THR 3 -12.179 -5.256 5.319
18 HG22 THR 3 HG22 THR 3 -10.574 -5.874 4.903
19 HG23 THR 3 HG23 THR 3 -11.069 -5.779 6.598
20 H TYR 4 H TYR 4 -8.101 -2.244 4.142
21 HA TYR 4 HA TYR 4 -7.291 -4.162 2.056
22 HB2 TYR 4 HB2 TYR 4 -6.818 -1.148 2.026
23 HB3 TYR 4 HB3 TYR 4 -6.272 -2.272 0.801
24 HD1 TYR 4 HD1 TYR 4 -7.445 -2.219 -1.232
25 HD2 TYR 4 HD2 TYR 4 -9.598 -1.045 2.351
26 HE1 TYR 4 HE1 TYR 4 -9.411 -1.512 -2.582
27 HE2 TYR 4 HE2 TYR 4 -11.486 -0.422 1.023
28 HH TYR 4 HH TYR 4 -12.038 0.308 -1.169
29 H LYS 5 H LYS 5 -4.931 -4.341 1.785
30 HA LYS 5 HA LYS 5 -3.478 -3.449 4.279
31 HB2 LYS 5 HB2 LYS 5 -4.238 -5.820 4.224
32 HB3 LYS 5 HB3 LYS 5 -3.149 -6.121 2.874
33 HG2 LYS 5 HG2 LYS 5 -1.227 -5.884 4.226
34 HG3 LYS 5 HG3 LYS 5 -2.084 -4.945 5.467
35 HD2 LYS 5 HD2 LYS 5 -3.311 -6.831 6.253
36 HD3 LYS 5 HD3 LYS 5 -2.817 -7.827 4.882
37 HE2 LYS 5 HE2 LYS 5 -0.467 -7.771 5.659
38 HE3 LYS 5 HE3 LYS 5 -0.938 -6.754 7.036
39 HZ1 LYS 5 HZ1 LYS 5 -2.299 -8.527 7.843
40 HZ2 LYS 5 HZ2 LYS 5 -1.988 -9.481 6.550
41 HZ3 LYS 5 HZ3 LYS 5 -0.776 -9.104 7.614
42 H LEU 6 H LEU 6 -1.636 -2.254 3.914
43 HA LEU 6 HA LEU 6 -0.445 -2.327 1.168
44 HB2 LEU 6 HB2 LEU 6 -1.901 -0.274 2.028
45 HB3 LEU 6 HB3 LEU 6 -0.398 0.213 2.782
46 HG LEU 6 HG LEU 6 -0.697 -0.458 -0.166
47 HD11 LEU 6 HD11 LEU 6 -2.124 1.443 0.401
48 HD12 LEU 6 HD12 LEU 6 -0.729 2.288 1.097
49 HD13 LEU 6 HD13 LEU 6 -0.763 1.877 -0.635
50 HD21 LEU 6 HD21 LEU 6 1.474 1.064 1.311
51 HD22 LEU 6 HD22 LEU 6 1.635 -0.572 0.635
52 HD23 LEU 6 HD23 LEU 6 1.403 0.792 -0.441
53 H ILE 7 H ILE 7 1.459 -3.360 1.339
54 HA ILE 7 HA ILE 7 3.363 -2.694 3.520
55 HB ILE 7 HB ILE 7 2.546 -4.894 3.976
56 HG12 ILE 7 HG12 ILE 7 5.165 -5.304 2.466
57 HG13 ILE 7 HG13 ILE 7 5.045 -4.529 4.043
58 HG21 ILE 7 HG21 ILE 7 3.033 -5.690 1.079
59 HG22 ILE 7 HG22 ILE 7 2.498 -6.774 2.372
60 HG23 ILE 7 HG23 ILE 7 1.451 -5.470 1.844
61 HD11 ILE 7 HD11 ILE 7 4.025 -6.657 4.957
62 HD12 ILE 7 HD12 ILE 7 4.400 -7.429 3.393
63 HD13 ILE 7 HD13 ILE 7 5.709 -6.789 4.402
64 H LEU 8 H LEU 8 5.283 -2.171 3.089
65 HA LEU 8 HA LEU 8 6.254 -2.066 0.284
66 HB2 LEU 8 HB2 LEU 8 6.723 -0.122 2.560
67 HB3 LEU 8 HB3 LEU 8 7.434 -0.012 0.964
68 HG LEU 8 HG LEU 8 5.777 1.622 1.085
69 HD11 LEU 8 HD11 LEU 8 4.489 -0.718 -0.383
70 HD12 LEU 8 HD12 LEU 8 4.167 0.992 -0.703
71 HD13 LEU 8 HD13 LEU 8 5.764 0.314 -1.046
72 HD21 LEU 8 HD21 LEU 8 4.558 0.672 3.069
73 HD22 LEU 8 HD22 LEU 8 3.613 1.530 1.839
74 HD23 LEU 8 HD23 LEU 8 3.581 -0.238 1.915
75 H ASN 9 H ASN 9 8.146 -3.101 0.018
76 HA ASN 9 HA ASN 9 9.780 -3.784 2.446
77 HB2 ASN 9 HB2 ASN 9 9.443 -5.410 -0.100
78 HB3 ASN 9 HB3 ASN 9 10.506 -5.762 1.258
79 HD21 ASN 9 HD21 ASN 9 6.641 -6.893 1.408
80 HD22 ASN 9 HD22 ASN 9 7.262 -5.931 0.069
81 H GLY 10 H GLY 10 11.043 -1.910 2.285
82 HA2 GLY 10 HA2 GLY 10 12.363 -1.104 -0.150
83 HA3 GLY 10 HA3 GLY 10 12.553 -0.424 1.462
84 H LYS 11 H LYS 11 14.789 -0.590 0.172
85 HA LYS 11 HA LYS 11 16.314 -2.961 0.102
86 HB2 LYS 11 HB2 LYS 11 16.787 -0.715 -0.844
87 HB3 LYS 11 HB3 LYS 11 17.172 -0.109 0.761
88 HG2 LYS 11 HG2 LYS 11 19.130 -1.685 0.818
89 HG3 LYS 11 HG3 LYS 11 18.694 -2.183 -0.842
90 HD2 LYS 11 HD2 LYS 11 18.734 0.333 -1.431
91 HD3 LYS 11 HD3 LYS 11 19.529 0.586 0.131
92 HE2 LYS 11 HE2 LYS 11 21.366 -0.912 -0.572
93 HE3 LYS 11 HE3 LYS 11 20.543 -1.219 -2.110
94 HZ1 LYS 11 HZ1 LYS 11 20.770 1.103 -2.652
95 HZ2 LYS 11 HZ2 LYS 11 21.531 1.436 -1.223
96 HZ3 LYS 11 HZ3 LYS 11 22.262 0.465 -2.299
97 H THR 12 H THR 12 15.998 -0.594 2.765
98 HA THR 12 HA THR 12 16.901 -2.690 4.697
99 HB THR 12 HB THR 12 18.618 -0.896 4.120
100 HG1 THR 12 HG1 THR 12 18.327 -2.120 6.286
101 HG21 THR 12 HG21 THR 12 16.820 0.857 5.861
102 HG22 THR 12 HG22 THR 12 18.367 1.288 5.145
103 HG23 THR 12 HG23 THR 12 16.969 1.024 4.095
104 H LEU 13 H LEU 13 14.475 -0.356 3.850
105 HA LEU 13 HA LEU 13 13.375 -0.303 6.591
106 HB2 LEU 13 HB2 LEU 13 14.030 1.790 5.328
107 HB3 LEU 13 HB3 LEU 13 12.786 1.373 4.139
108 HG LEU 13 HG LEU 13 11.083 1.512 6.033
109 HD11 LEU 13 HD11 LEU 13 13.418 2.868 7.462
110 HD12 LEU 13 HD12 LEU 13 11.739 2.790 8.034
111 HD13 LEU 13 HD13 LEU 13 12.704 1.320 7.933
112 HD21 LEU 13 HD21 LEU 13 11.239 4.072 6.039
113 HD22 LEU 13 HD22 LEU 13 12.743 3.906 5.136
114 HD23 LEU 13 HD23 LEU 13 11.218 3.295 4.459
115 H LYS 14 H LYS 14 11.603 -1.325 7.047
116 HA LYS 14 HA LYS 14 9.790 -2.274 4.861
117 HB2 LYS 14 HB2 LYS 14 11.120 -3.974 6.390
118 HB3 LYS 14 HB3 LYS 14 9.843 -3.593 7.563
119 HG2 LYS 14 HG2 LYS 14 8.189 -4.106 5.588
120 HG3 LYS 14 HG3 LYS 14 9.594 -4.776 4.769
121 HD2 LYS 14 HD2 LYS 14 8.365 -5.714 7.397
122 HD3 LYS 14 HD3 LYS 14 8.279 -6.509 5.822
123 HE2 LYS 14 HE2 LYS 14 10.836 -6.668 5.886
124 HE3 LYS 14 HE3 LYS 14 10.734 -6.132 7.570
125 HZ1 LYS 14 HZ1 LYS 14 10.717 -8.431 7.710
126 HZ2 LYS 14 HZ2 LYS 14 9.081 -8.121 7.730
127 HZ3 LYS 14 HZ3 LYS 14 9.830 -8.641 6.365
128 H GLY 15 H GLY 15 7.463 -2.262 5.406
129 HA2 GLY 15 HA2 GLY 15 6.448 -0.968 7.752
130 HA3 GLY 15 HA3 GLY 15 6.421 0.080 6.315
131 H GLU 16 H GLU 16 4.244 -1.586 7.895
132 HA GLU 16 HA GLU 16 2.837 -2.470 5.497
133 HB2 GLU 16 HB2 GLU 16 2.168 -4.600 6.568
134 HB3 GLU 16 HB3 GLU 16 3.846 -4.546 6.055
135 HG2 GLU 16 HG2 GLU 16 4.682 -4.871 8.122
136 HG3 GLU 16 HG3 GLU 16 3.519 -3.816 8.909
137 H THR 17 H THR 17 0.785 -1.745 5.583
138 HA THR 17 HA THR 17 -0.392 -1.264 8.307
139 HB THR 17 HB THR 17 0.672 0.800 7.327
140 HG1 THR 17 HG1 THR 17 -0.875 2.067 7.958
141 HG21 THR 17 HG21 THR 17 0.031 0.434 4.957
142 HG22 THR 17 HG22 THR 17 -1.673 0.717 5.381
143 HG23 THR 17 HG23 THR 17 -0.487 2.012 5.556
144 H THR 18 H THR 18 -2.767 -0.818 8.128
145 HA THR 18 HA THR 18 -4.094 -1.978 5.856
146 HB THR 18 HB THR 18 -3.593 -3.943 7.270
147 HG1 THR 18 HG1 THR 18 -5.628 -3.574 6.024
148 HG21 THR 18 HG21 THR 18 -4.697 -4.309 9.404
149 HG22 THR 18 HG22 THR 18 -3.672 -2.870 9.530
150 HG23 THR 18 HG23 THR 18 -5.435 -2.700 9.358
151 H THR 19 H THR 19 -6.202 -1.105 5.637
152 HA THR 19 HA THR 19 -7.181 0.684 7.765
153 HB THR 19 HB THR 19 -7.399 2.521 5.980
154 HG1 THR 19 HG1 THR 19 -5.370 0.964 4.728
155 HG21 THR 19 HG21 THR 19 -4.507 1.927 6.685
156 HG22 THR 19 HG22 THR 19 -5.232 3.486 6.261
157 HG23 THR 19 HG23 THR 19 -5.687 2.688 7.778
158 H GLU 20 H GLU 20 -9.338 1.495 7.267
159 HA GLU 20 HA GLU 20 -10.927 -0.087 5.312
160 HB2 GLU 20 HB2 GLU 20 -11.476 -0.837 7.541
161 HB3 GLU 20 HB3 GLU 20 -11.499 0.827 8.161
162 HG2 GLU 20 HG2 GLU 20 -13.494 1.347 6.784
163 HG3 GLU 20 HG3 GLU 20 -13.454 -0.276 6.090
164 H ALA 21 H ALA 21 -12.116 1.232 3.899
165 HA ALA 21 HA ALA 21 -12.452 4.083 4.624
166 HB1 ALA 21 HB1 ALA 21 -11.706 4.710 2.284
167 HB2 ALA 21 HB2 ALA 21 -10.419 4.173 3.378
168 HB3 ALA 21 HB3 ALA 21 -11.033 3.071 2.130
169 H VAL 22 H VAL 22 -14.014 5.154 3.423
170 HA VAL 22 HA VAL 22 -16.397 3.688 3.027
171 HB VAL 22 HB VAL 22 -17.246 5.921 2.160
172 HG11 VAL 22 HG11 VAL 22 -15.906 5.748 4.886
173 HG12 VAL 22 HG12 VAL 22 -17.203 6.900 4.414
174 HG13 VAL 22 HG13 VAL 22 -17.518 5.174 4.438
175 HG21 VAL 22 HG21 VAL 22 -14.503 6.971 3.038
176 HG22 VAL 22 HG22 VAL 22 -15.108 6.932 1.361
177 HG23 VAL 22 HG23 VAL 22 -15.914 7.923 2.564
178 H ASP 23 H ASP 23 -14.121 5.102 0.581
179 HA ASP 23 HA ASP 23 -15.261 3.273 -1.443
180 HB2 ASP 23 HB2 ASP 23 -16.381 5.478 -1.677
181 HB3 ASP 23 HB3 ASP 23 -14.787 6.254 -1.797
182 H ALA 24 H ALA 24 -13.715 3.050 -3.312
183 HA ALA 24 HA ALA 24 -11.053 2.593 -2.403
184 HB1 ALA 24 HB1 ALA 24 -10.588 2.138 -4.804
185 HB2 ALA 24 HB2 ALA 24 -11.962 1.245 -4.155
186 HB3 ALA 24 HB3 ALA 24 -12.240 2.670 -5.203
187 H ALA 25 H ALA 25 -12.548 5.415 -4.049
188 HA ALA 25 HA ALA 25 -10.141 6.672 -4.863
189 HB1 ALA 25 HB1 ALA 25 -12.346 7.433 -5.574
190 HB2 ALA 25 HB2 ALA 25 -12.761 7.901 -3.914
191 HB3 ALA 25 HB3 ALA 25 -11.475 8.770 -4.786
192 H THR 26 H THR 26 -11.683 6.564 -1.633
193 HA THR 26 HA THR 26 -9.995 8.601 -0.472
194 HB THR 26 HB THR 26 -11.702 6.354 0.656
195 HG1 THR 26 HG1 THR 26 -12.206 9.115 0.807
196 HG21 THR 26 HG21 THR 26 -10.352 8.606 2.196
197 HG22 THR 26 HG22 THR 26 -11.667 7.564 2.820
198 HG23 THR 26 HG23 THR 26 -10.104 6.867 2.405
199 H ALA 27 H ALA 27 -9.699 5.096 -0.986
200 HA ALA 27 HA ALA 27 -7.362 4.783 0.689
201 HB1 ALA 27 HB1 ALA 27 -8.944 2.946 0.356
202 HB2 ALA 27 HB2 ALA 27 -8.629 2.969 -1.397
203 HB3 ALA 27 HB3 ALA 27 -7.349 2.499 -0.270
204 H GLU 28 H GLU 28 -8.014 5.434 -2.726
205 HA GLU 28 HA GLU 28 -5.489 4.914 -3.844
206 HB2 GLU 28 HB2 GLU 28 -7.749 5.323 -4.933
207 HB3 GLU 28 HB3 GLU 28 -7.518 7.047 -4.634
208 HG2 GLU 28 HG2 GLU 28 -5.451 6.970 -6.049
209 HG3 GLU 28 HG3 GLU 28 -5.775 5.247 -6.381
210 H LYS 29 H LYS 29 -6.691 7.757 -2.083
211 HA LYS 29 HA LYS 29 -4.521 9.525 -2.777
212 HB2 LYS 29 HB2 LYS 29 -6.412 9.516 -0.385
213 HB3 LYS 29 HB3 LYS 29 -5.271 10.823 -0.756
214 HG2 LYS 29 HG2 LYS 29 -6.340 11.150 -2.950
215 HG3 LYS 29 HG3 LYS 29 -7.452 9.822 -2.630
216 HD2 LYS 29 HD2 LYS 29 -8.449 11.028 -0.744
217 HD3 LYS 29 HD3 LYS 29 -7.311 12.393 -0.996
218 HE2 LYS 29 HE2 LYS 29 -8.110 12.673 -3.295
219 HE3 LYS 29 HE3 LYS 29 -9.128 11.244 -3.159
220 HZ1 LYS 29 HZ1 LYS 29 -10.466 12.416 -1.512
221 HZ2 LYS 29 HZ2 LYS 29 -9.553 13.772 -1.699
222 HZ3 LYS 29 HZ3 LYS 29 -10.426 13.140 -2.967
223 H VAL 30 H VAL 30 -5.130 7.531 0.149
224 HA VAL 30 HA VAL 30 -2.599 8.071 1.299
225 HB VAL 30 HB VAL 30 -4.483 7.399 2.663
226 HG11 VAL 30 HG11 VAL 30 -4.056 4.607 1.534
227 HG12 VAL 30 HG12 VAL 30 -5.012 4.988 2.969
228 HG13 VAL 30 HG13 VAL 30 -5.525 5.632 1.398
229 HG21 VAL 30 HG21 VAL 30 -3.263 6.112 4.261
230 HG22 VAL 30 HG22 VAL 30 -2.165 5.477 3.021
231 HG23 VAL 30 HG23 VAL 30 -2.130 7.200 3.456
232 H PHE 31 H PHE 31 -3.616 5.611 -1.097
233 HA PHE 31 HA PHE 31 -1.489 3.836 -0.839
234 HB2 PHE 31 HB2 PHE 31 -3.364 3.450 -2.342
235 HB3 PHE 31 HB3 PHE 31 -3.004 4.885 -3.258
236 HD1 PHE 31 HD1 PHE 31 -0.704 4.955 -4.609
237 HD2 PHE 31 HD2 PHE 31 -2.795 1.387 -3.326
238 HE1 PHE 31 HE1 PHE 31 0.394 3.676 -6.378
239 HE2 PHE 31 HE2 PHE 31 -1.798 0.157 -5.220
240 HZ PHE 31 HZ PHE 31 -0.199 1.278 -6.746
241 H LYS 32 H LYS 32 -1.552 6.926 -2.720
242 HA LYS 32 HA LYS 32 1.270 6.609 -3.358
243 HB2 LYS 32 HB2 LYS 32 -0.235 7.821 -4.886
244 HB3 LYS 32 HB3 LYS 32 -0.507 9.068 -3.641
245 HG2 LYS 32 HG2 LYS 32 1.964 9.579 -3.670
246 HG3 LYS 32 HG3 LYS 32 2.178 8.347 -4.939
247 HD2 LYS 32 HD2 LYS 32 0.646 9.623 -6.408
248 HD3 LYS 32 HD3 LYS 32 0.427 10.823 -5.109
249 HE2 LYS 32 HE2 LYS 32 2.742 11.459 -5.189
250 HE3 LYS 32 HE3 LYS 32 3.123 10.168 -6.344
251 HZ1 LYS 32 HZ1 LYS 32 2.772 12.416 -7.356
252 HZ2 LYS 32 HZ2 LYS 32 1.774 11.239 -7.975
253 HZ3 LYS 32 HZ3 LYS 32 1.204 12.340 -6.908
254 H GLN 33 H GLN 33 -0.574 8.751 -1.149
255 HA GLN 33 HA GLN 33 1.580 10.222 -0.171
256 HB2 GLN 33 HB2 GLN 33 -0.825 10.727 0.028
257 HB3 GLN 33 HB3 GLN 33 -1.004 9.425 1.199
258 HG2 GLN 33 HG2 GLN 33 0.428 10.602 2.779
259 HG3 GLN 33 HG3 GLN 33 0.733 11.877 1.601
260 HE21 GLN 33 HE21 GLN 33 -2.739 11.841 3.799
261 HE22 GLN 33 HE22 GLN 33 -1.671 10.495 3.857
262 H TYR 34 H TYR 34 0.222 7.225 1.440
263 HA TYR 34 HA TYR 34 2.141 7.368 3.570
264 HB2 TYR 34 HB2 TYR 34 0.174 6.164 4.027
265 HB3 TYR 34 HB3 TYR 34 0.264 5.249 2.530
266 HD1 TYR 34 HD1 TYR 34 0.703 3.012 2.754
267 HD2 TYR 34 HD2 TYR 34 2.525 5.772 5.524
268 HE1 TYR 34 HE1 TYR 34 1.978 1.139 3.805
269 HE2 TYR 34 HE2 TYR 34 3.763 3.930 6.572
270 HH TYR 34 HH TYR 34 4.372 1.686 6.394
271 H ALA 35 H ALA 35 2.034 5.342 0.578
272 HA ALA 35 HA ALA 35 4.492 4.055 1.118
273 HB1 ALA 35 HB1 ALA 35 3.268 4.640 -1.606
274 HB2 ALA 35 HB2 ALA 35 4.345 3.281 -1.164
275 HB3 ALA 35 HB3 ALA 35 2.717 3.342 -0.503
276 H ASN 36 H ASN 36 3.853 7.068 -0.793
277 HA ASN 36 HA ASN 36 6.546 7.387 -1.633
278 HB2 ASN 36 HB2 ASN 36 4.666 8.675 -2.605
279 HB3 ASN 36 HB3 ASN 36 4.453 9.536 -1.070
280 HD21 ASN 36 HD21 ASN 36 7.963 10.284 -3.187
281 HD22 ASN 36 HD22 ASN 36 7.379 8.663 -3.115
282 H ASP 37 H ASP 37 4.848 8.435 1.327
283 HA ASP 37 HA ASP 37 6.970 10.025 2.416
284 HB2 ASP 37 HB2 ASP 37 4.508 9.969 3.078
285 HB3 ASP 37 HB3 ASP 37 4.855 8.491 3.975
286 H ASN 38 H ASN 38 6.321 6.622 2.324
287 HA ASN 38 HA ASN 38 8.275 5.794 4.286
288 HB2 ASN 38 HB2 ASN 38 6.010 4.731 3.773
289 HB3 ASN 38 HB3 ASN 38 6.762 4.090 2.309
290 HD21 ASN 38 HD21 ASN 38 7.253 1.182 4.221
291 HD22 ASN 38 HD22 ASN 38 6.204 2.046 3.116
292 H GLY 39 H GLY 39 8.766 7.103 1.322
293 HA2 GLY 39 HA2 GLY 39 10.574 7.201 -0.059
294 HA3 GLY 39 HA3 GLY 39 11.436 6.171 1.061
295 H VAL 40 H VAL 40 8.495 5.268 -0.854
296 HA VAL 40 HA VAL 40 9.898 2.897 -1.734
297 HB VAL 40 HB VAL 40 7.832 2.297 -2.842
298 HG11 VAL 40 HG11 VAL 40 6.360 2.418 -0.829
299 HG12 VAL 40 HG12 VAL 40 7.981 1.716 -0.571
300 HG13 VAL 40 HG13 VAL 40 7.595 3.348 -0.002
301 HG21 VAL 40 HG21 VAL 40 6.990 4.350 -3.767
302 HG22 VAL 40 HG22 VAL 40 5.801 3.708 -2.681
303 HG23 VAL 40 HG23 VAL 40 6.818 5.078 -2.171
304 H ASP 41 H ASP 41 10.766 2.371 -3.623
305 HA ASP 41 HA ASP 41 10.248 3.939 -6.005
306 HB2 ASP 41 HB2 ASP 41 12.226 5.050 -4.919
307 HB3 ASP 41 HB3 ASP 41 13.136 3.564 -5.179
308 H GLY 42 H GLY 42 9.014 1.783 -5.985
309 HA2 GLY 42 HA2 GLY 42 10.592 -0.205 -7.472
310 HA3 GLY 42 HA3 GLY 42 9.904 -0.748 -5.936
311 H GLU 43 H GLU 43 9.032 -2.188 -7.704
312 HA GLU 43 HA GLU 43 6.755 -1.275 -9.275
313 HB2 GLU 43 HB2 GLU 43 6.666 -3.574 -10.102
314 HB3 GLU 43 HB3 GLU 43 8.252 -2.847 -10.350
315 HG2 GLU 43 HG2 GLU 43 9.276 -4.183 -8.681
316 HG3 GLU 43 HG3 GLU 43 7.739 -4.624 -7.936
317 H TRP 44 H TRP 44 4.626 -2.098 -9.003
318 HA TRP 44 HA TRP 44 3.992 -2.955 -6.230
319 HB2 TRP 44 HB2 TRP 44 2.438 -1.361 -8.300
320 HB3 TRP 44 HB3 TRP 44 1.787 -1.900 -6.754
321 HD1 TRP 44 HD1 TRP 44 5.003 0.109 -7.769
322 HE1 TRP 44 HE1 TRP 44 5.496 1.742 -5.935
323 HE3 TRP 44 HE3 TRP 44 1.003 -0.802 -4.698
324 HZ2 TRP 44 HZ2 TRP 44 3.862 3.198 -3.918
325 HZ3 TRP 44 HZ3 TRP 44 0.487 0.742 -2.846
326 HH2 TRP 44 HH2 TRP 44 1.839 2.778 -2.503
327 H THR 45 H THR 45 2.372 -4.562 -5.904
328 HA THR 45 HA THR 45 1.251 -6.023 -8.183
329 HB THR 45 HB THR 45 1.768 -8.145 -6.814
330 HG1 THR 45 HG1 THR 45 4.028 -6.671 -6.003
331 HG21 THR 45 HG21 THR 45 2.724 -7.741 -9.030
332 HG22 THR 45 HG22 THR 45 4.059 -6.827 -8.290
333 HG23 THR 45 HG23 THR 45 3.877 -8.558 -7.962
334 H TYR 46 H TYR 46 -0.696 -7.325 -7.396
335 HA TYR 46 HA TYR 46 -1.756 -6.253 -4.839
336 HB2 TYR 46 HB2 TYR 46 -2.606 -4.897 -6.673
337 HB3 TYR 46 HB3 TYR 46 -3.121 -6.340 -7.546
338 HD1 TYR 46 HD1 TYR 46 -3.549 -4.790 -4.128
339 HD2 TYR 46 HD2 TYR 46 -5.404 -6.914 -7.399
340 HE1 TYR 46 HE1 TYR 46 -5.697 -4.795 -2.910
341 HE2 TYR 46 HE2 TYR 46 -7.586 -6.792 -6.232
342 HH TYR 46 HH TYR 46 -8.657 -6.249 -4.149
343 H ASP 47 H ASP 47 -3.228 -7.509 -3.752
344 HA ASP 47 HA ASP 47 -3.790 -10.258 -4.671
345 HB2 ASP 47 HB2 ASP 47 -1.897 -9.651 -2.712
346 HB3 ASP 47 HB3 ASP 47 -3.287 -10.057 -1.756
347 H ASP 48 H ASP 48 -6.057 -9.916 -5.029
348 HA ASP 48 HA ASP 48 -7.539 -8.103 -3.443
349 HB2 ASP 48 HB2 ASP 48 -8.135 -8.978 -5.775
350 HB3 ASP 48 HB3 ASP 48 -8.813 -10.376 -4.944
351 H ALA 49 H ALA 49 -6.538 -11.210 -2.463
352 HA ALA 49 HA ALA 49 -8.691 -12.163 -1.001
353 HB1 ALA 49 HB1 ALA 49 -7.055 -13.348 0.386
354 HB2 ALA 49 HB2 ALA 49 -6.565 -13.386 -1.309
355 HB3 ALA 49 HB3 ALA 49 -5.757 -12.278 -0.186
356 H THR 50 H THR 50 -6.174 -9.910 0.247
357 HA THR 50 HA THR 50 -8.185 -8.869 2.156
358 HB THR 50 HB THR 50 -6.557 -10.530 3.149
359 HG1 THR 50 HG1 THR 50 -7.163 -8.039 4.282
360 HG21 THR 50 HG21 THR 50 -4.461 -9.787 2.286
361 HG22 THR 50 HG22 THR 50 -4.640 -8.190 3.053
362 HG23 THR 50 HG23 THR 50 -4.464 -9.653 4.048
363 H LYS 51 H LYS 51 -6.855 -8.112 -0.633
364 HA LYS 51 HA LYS 51 -6.408 -6.553 -1.804
365 HB2 LYS 51 HB2 LYS 51 -7.539 -4.607 0.183
366 HB3 LYS 51 HB3 LYS 51 -7.460 -4.474 -1.552
367 HG2 LYS 51 HG2 LYS 51 -8.986 -6.519 -1.676
368 HG3 LYS 51 HG3 LYS 51 -9.159 -6.421 0.078
369 HD2 LYS 51 HD2 LYS 51 -10.141 -4.203 -0.070
370 HD3 LYS 51 HD3 LYS 51 -9.939 -4.178 -1.837
371 HE2 LYS 51 HE2 LYS 51 -11.449 -6.411 -0.407
372 HE3 LYS 51 HE3 LYS 51 -12.247 -4.887 -0.860
373 HZ1 LYS 51 HZ1 LYS 51 -12.456 -6.653 -2.531
374 HZ2 LYS 51 HZ2 LYS 51 -11.831 -5.258 -3.097
375 HZ3 LYS 51 HZ3 LYS 51 -10.848 -6.565 -2.864
376 H THR 52 H THR 52 -4.388 -7.667 -0.780
377 HA THR 52 HA THR 52 -2.626 -5.933 0.698
378 HB THR 52 HB THR 52 -1.773 -8.330 -0.935
379 HG1 THR 52 HG1 THR 52 -2.186 -9.639 0.651
380 HG21 THR 52 HG21 THR 52 0.053 -6.973 -0.032
381 HG22 THR 52 HG22 THR 52 -0.672 -7.009 1.590
382 HG23 THR 52 HG23 THR 52 -0.017 -8.483 0.850
383 H PHE 53 H PHE 53 -1.114 -4.587 -0.209
384 HA PHE 53 HA PHE 53 -0.663 -4.567 -3.155
385 HB2 PHE 53 HB2 PHE 53 -0.779 -2.296 -1.153
386 HB3 PHE 53 HB3 PHE 53 -0.142 -2.131 -2.777
387 HD1 PHE 53 HD1 PHE 53 -1.672 -2.423 -4.780
388 HD2 PHE 53 HD2 PHE 53 -3.158 -2.200 -0.729
389 HE1 PHE 53 HE1 PHE 53 -3.905 -1.768 -5.627
390 HE2 PHE 53 HE2 PHE 53 -5.371 -1.517 -1.587
391 HZ PHE 53 HZ PHE 53 -5.761 -1.301 -4.035
392 H THR 54 H THR 54 1.455 -5.243 -3.447
393 HA THR 54 HA THR 54 3.311 -4.949 -1.122
394 HB THR 54 HB THR 54 3.457 -7.148 -3.194
395 HG1 THR 54 HG1 THR 54 2.824 -8.455 -1.350
396 HG21 THR 54 HG21 THR 54 4.761 -6.775 -0.456
397 HG22 THR 54 HG22 THR 54 5.012 -8.154 -1.561
398 HG23 THR 54 HG23 THR 54 5.578 -6.585 -2.024
399 H VAL 55 H VAL 55 5.271 -4.120 -1.515
400 HA VAL 55 HA VAL 55 6.121 -3.500 -4.274
401 HB VAL 55 HB VAL 55 5.909 -1.684 -1.894
402 HG11 VAL 55 HG11 VAL 55 7.790 -1.233 -4.245
403 HG12 VAL 55 HG12 VAL 55 7.320 0.011 -3.067
404 HG13 VAL 55 HG13 VAL 55 8.246 -1.387 -2.529
405 HG21 VAL 55 HG21 VAL 55 4.138 -1.700 -3.729
406 HG22 VAL 55 HG22 VAL 55 4.917 -0.136 -3.458
407 HG23 VAL 55 HG23 VAL 55 5.409 -1.158 -4.835
408 H THR 56 H THR 56 8.219 -3.990 -4.610
409 HA THR 56 HA THR 56 9.953 -4.707 -2.351
410 HB THR 56 HB THR 56 10.777 -6.475 -4.191
411 HG1 THR 56 HG1 THR 56 9.321 -6.377 -5.752
412 HG21 THR 56 HG21 THR 56 10.096 -7.047 -1.893
413 HG22 THR 56 HG22 THR 56 8.380 -6.887 -2.336
414 HG23 THR 56 HG23 THR 56 9.373 -8.177 -3.048
415 H GLU 57 H GLU 57 11.560 -3.268 -2.398
416 HA GLU 57 HA GLU 57 11.939 -1.435 -4.646
417 HB2 GLU 57 HB2 GLU 57 12.283 -0.897 -2.183
418 HB3 GLU 57 HB3 GLU 57 13.716 -1.928 -2.199
419 HG2 GLU 57 HG2 GLU 57 14.566 -0.418 -4.105
420 HG3 GLU 57 HG3 GLU 57 13.221 0.661 -3.734
Start of MODEL 7
1 H1 MET 1 H MET 1 -17.472 0.036 2.407
2 HA MET 1 HA MET 1 -17.188 -0.754 0.177
3 HB2 MET 1 HB2 MET 1 -16.015 1.128 -0.730
4 HB3 MET 1 HB3 MET 1 -14.588 0.784 0.261
5 HG2 MET 1 HG2 MET 1 -14.281 -1.372 -0.904
6 HG3 MET 1 HG3 MET 1 -15.750 -1.097 -1.848
7 HE1 MET 1 HE1 MET 1 -15.657 1.780 -2.999
8 HE2 MET 1 HE2 MET 1 -14.713 1.487 -4.478
9 HE3 MET 1 HE3 MET 1 -15.913 0.293 -3.939
10 H GLY 2 H GLY 2 -13.888 -0.727 1.929
11 HA2 GLY 2 HA2 GLY 2 -14.376 -3.297 3.044
12 HA3 GLY 2 HA3 GLY 2 -13.482 -3.407 1.520
13 H THR 3 H THR 3 -11.970 -4.334 3.263
14 HA THR 3 HA THR 3 -10.352 -2.220 4.515
15 HB THR 3 HB THR 3 -11.128 -4.107 5.915
16 HG1 THR 3 HG1 THR 3 -9.037 -2.950 6.155
17 HG21 THR 3 HG21 THR 3 -10.960 -5.949 4.196
18 HG22 THR 3 HG22 THR 3 -9.193 -5.864 4.336
19 HG23 THR 3 HG23 THR 3 -10.181 -6.327 5.735
20 H TYR 4 H TYR 4 -8.123 -1.980 3.966
21 HA TYR 4 HA TYR 4 -7.160 -3.484 1.584
22 HB2 TYR 4 HB2 TYR 4 -7.390 -0.505 2.014
23 HB3 TYR 4 HB3 TYR 4 -6.087 -1.182 1.057
24 HD1 TYR 4 HD1 TYR 4 -6.429 -2.337 -1.018
25 HD2 TYR 4 HD2 TYR 4 -9.785 -0.589 1.080
26 HE1 TYR 4 HE1 TYR 4 -7.830 -2.595 -3.045
27 HE2 TYR 4 HE2 TYR 4 -11.158 -0.786 -0.984
28 HH TYR 4 HH TYR 4 -11.240 -2.261 -3.053
29 H LYS 5 H LYS 5 -5.153 -4.407 1.900
30 HA LYS 5 HA LYS 5 -3.680 -3.360 4.302
31 HB2 LYS 5 HB2 LYS 5 -4.341 -5.806 4.173
32 HB3 LYS 5 HB3 LYS 5 -3.147 -5.980 2.883
33 HG2 LYS 5 HG2 LYS 5 -1.417 -5.004 4.452
34 HG3 LYS 5 HG3 LYS 5 -2.664 -4.973 5.712
35 HD2 LYS 5 HD2 LYS 5 -2.840 -7.459 5.576
36 HD3 LYS 5 HD3 LYS 5 -1.532 -7.455 4.357
37 HE2 LYS 5 HE2 LYS 5 -0.140 -6.108 6.018
38 HE3 LYS 5 HE3 LYS 5 -1.400 -6.386 7.222
39 HZ1 LYS 5 HZ1 LYS 5 0.480 -7.876 7.363
40 HZ2 LYS 5 HZ2 LYS 5 -0.903 -8.749 7.087
41 HZ3 LYS 5 HZ3 LYS 5 0.214 -8.464 5.880
42 H LEU 6 H LEU 6 -1.762 -2.251 4.050
43 HA LEU 6 HA LEU 6 -0.538 -2.235 1.325
44 HB2 LEU 6 HB2 LEU 6 -1.983 -0.190 2.252
45 HB3 LEU 6 HB3 LEU 6 -0.438 0.289 2.944
46 HG LEU 6 HG LEU 6 -0.799 -0.495 0.013
47 HD11 LEU 6 HD11 LEU 6 -2.352 1.297 0.404
48 HD12 LEU 6 HD12 LEU 6 -1.102 2.264 1.219
49 HD13 LEU 6 HD13 LEU 6 -0.966 1.886 -0.518
50 HD21 LEU 6 HD21 LEU 6 1.289 1.250 1.360
51 HD22 LEU 6 HD22 LEU 6 1.533 -0.435 0.834
52 HD23 LEU 6 HD23 LEU 6 1.224 0.823 -0.355
53 H ILE 7 H ILE 7 1.307 -3.292 1.443
54 HA ILE 7 HA ILE 7 3.221 -2.818 3.656
55 HB ILE 7 HB ILE 7 2.335 -4.986 3.934
56 HG12 ILE 7 HG12 ILE 7 4.930 -5.484 2.415
57 HG13 ILE 7 HG13 ILE 7 4.859 -4.697 3.993
58 HG21 ILE 7 HG21 ILE 7 1.242 -5.394 1.793
59 HG22 ILE 7 HG22 ILE 7 2.819 -5.599 1.007
60 HG23 ILE 7 HG23 ILE 7 2.254 -6.760 2.215
61 HD11 ILE 7 HD11 ILE 7 3.677 -6.714 4.911
62 HD12 ILE 7 HD12 ILE 7 3.979 -7.536 3.369
63 HD13 ILE 7 HD13 ILE 7 5.333 -7.018 4.368
64 H LEU 8 H LEU 8 5.182 -2.256 3.265
65 HA LEU 8 HA LEU 8 6.148 -1.971 0.475
66 HB2 LEU 8 HB2 LEU 8 6.575 -0.097 2.834
67 HB3 LEU 8 HB3 LEU 8 7.387 0.006 1.299
68 HG LEU 8 HG LEU 8 5.792 1.709 1.296
69 HD11 LEU 8 HD11 LEU 8 4.495 -0.506 -0.336
70 HD12 LEU 8 HD12 LEU 8 4.297 1.234 -0.576
71 HD13 LEU 8 HD13 LEU 8 5.870 0.490 -0.865
72 HD21 LEU 8 HD21 LEU 8 4.386 0.811 3.147
73 HD22 LEU 8 HD22 LEU 8 3.513 1.590 1.819
74 HD23 LEU 8 HD23 LEU 8 3.529 -0.180 1.953
75 H ASN 9 H ASN 9 8.294 -2.490 0.098
76 HA ASN 9 HA ASN 9 9.947 -3.527 2.356
77 HB2 ASN 9 HB2 ASN 9 9.858 -4.418 -0.572
78 HB3 ASN 9 HB3 ASN 9 11.156 -4.784 0.537
79 HD21 ASN 9 HD21 ASN 9 7.657 -6.880 0.844
80 HD22 ASN 9 HD22 ASN 9 7.777 -5.448 -0.211
81 H GLY 10 H GLY 10 11.600 -1.995 2.597
82 HA2 GLY 10 HA2 GLY 10 12.105 -0.028 0.428
83 HA3 GLY 10 HA3 GLY 10 12.537 0.114 2.145
84 H LYS 11 H LYS 11 14.792 0.588 1.274
85 HA LYS 11 HA LYS 11 16.192 -1.557 -0.151
86 HB2 LYS 11 HB2 LYS 11 17.151 0.638 -0.312
87 HB3 LYS 11 HB3 LYS 11 17.097 0.893 1.437
88 HG2 LYS 11 HG2 LYS 11 18.838 -0.798 1.787
89 HG3 LYS 11 HG3 LYS 11 18.898 -1.136 0.050
90 HD2 LYS 11 HD2 LYS 11 19.813 1.082 -0.372
91 HD3 LYS 11 HD3 LYS 11 19.530 1.569 1.322
92 HE2 LYS 11 HE2 LYS 11 21.092 -0.128 2.133
93 HE3 LYS 11 HE3 LYS 11 21.267 -0.790 0.506
94 HZ1 LYS 11 HZ1 LYS 11 23.127 0.547 1.054
95 HZ2 LYS 11 HZ2 LYS 11 22.319 1.224 -0.187
96 HZ3 LYS 11 HZ3 LYS 11 22.200 1.891 1.325
97 H THR 12 H THR 12 16.188 -0.474 3.294
98 HA THR 12 HA THR 12 16.834 -3.259 4.064
99 HB THR 12 HB THR 12 18.815 -1.844 4.126
100 HG1 THR 12 HG1 THR 12 17.831 -2.937 6.525
101 HG21 THR 12 HG21 THR 12 19.151 -0.204 5.913
102 HG22 THR 12 HG22 THR 12 17.956 0.336 4.732
103 HG23 THR 12 HG23 THR 12 17.421 -0.267 6.313
104 H LEU 13 H LEU 13 14.809 -0.469 4.621
105 HA LEU 13 HA LEU 13 13.734 -1.623 7.107
106 HB2 LEU 13 HB2 LEU 13 14.407 0.714 7.053
107 HB3 LEU 13 HB3 LEU 13 13.327 1.012 5.682
108 HG LEU 13 HG LEU 13 11.358 0.583 7.099
109 HD11 LEU 13 HD11 LEU 13 12.261 -0.987 8.748
110 HD12 LEU 13 HD12 LEU 13 13.394 0.244 9.355
111 HD13 LEU 13 HD13 LEU 13 11.640 0.439 9.574
112 HD21 LEU 13 HD21 LEU 13 11.512 2.630 8.391
113 HD22 LEU 13 HD22 LEU 13 13.292 2.567 8.378
114 HD23 LEU 13 HD23 LEU 13 12.391 2.856 6.878
115 H LYS 14 H LYS 14 11.889 -2.648 7.190
116 HA LYS 14 HA LYS 14 9.989 -2.677 4.877
117 HB2 LYS 14 HB2 LYS 14 10.689 -4.714 7.049
118 HB3 LYS 14 HB3 LYS 14 9.325 -4.895 5.949
119 HG2 LYS 14 HG2 LYS 14 10.910 -4.632 4.006
120 HG3 LYS 14 HG3 LYS 14 12.258 -4.634 5.158
121 HD2 LYS 14 HD2 LYS 14 11.623 -6.918 5.875
122 HD3 LYS 14 HD3 LYS 14 10.290 -6.907 4.682
123 HE2 LYS 14 HE2 LYS 14 11.948 -6.399 2.886
124 HE3 LYS 14 HE3 LYS 14 13.252 -6.519 4.062
125 HZ1 LYS 14 HZ1 LYS 14 11.421 -8.746 3.403
126 HZ2 LYS 14 HZ2 LYS 14 12.829 -8.492 2.668
127 HZ3 LYS 14 HZ3 LYS 14 12.835 -8.805 4.308
128 H GLY 15 H GLY 15 7.761 -2.377 5.235
129 HA2 GLY 15 HA2 GLY 15 6.765 -1.941 7.962
130 HA3 GLY 15 HA3 GLY 15 6.783 -0.559 6.877
131 H GLU 16 H GLU 16 4.414 -1.862 8.050
132 HA GLU 16 HA GLU 16 2.913 -2.233 5.590
133 HB2 GLU 16 HB2 GLU 16 1.987 -4.398 6.124
134 HB3 GLU 16 HB3 GLU 16 3.744 -4.512 6.002
135 HG2 GLU 16 HG2 GLU 16 3.887 -4.513 8.503
136 HG3 GLU 16 HG3 GLU 16 2.119 -4.481 8.575
137 H THR 17 H THR 17 0.660 -2.002 5.801
138 HA THR 17 HA THR 17 -0.409 -1.522 8.512
139 HB THR 17 HB THR 17 0.634 0.611 7.865
140 HG1 THR 17 HG1 THR 17 -0.971 1.749 8.611
141 HG21 THR 17 HG21 THR 17 -0.342 1.990 6.069
142 HG22 THR 17 HG22 THR 17 0.383 0.514 5.427
143 HG23 THR 17 HG23 THR 17 -1.373 0.631 5.556
144 H THR 18 H THR 18 -2.794 -0.907 8.304
145 HA THR 18 HA THR 18 -4.199 -2.143 6.061
146 HB THR 18 HB THR 18 -3.595 -3.912 7.779
147 HG1 THR 18 HG1 THR 18 -5.529 -4.874 7.661
148 HG21 THR 18 HG21 THR 18 -3.921 -2.645 9.845
149 HG22 THR 18 HG22 THR 18 -5.662 -2.480 9.505
150 HG23 THR 18 HG23 THR 18 -4.957 -4.071 9.817
151 H THR 19 H THR 19 -6.577 -1.520 6.218
152 HA THR 19 HA THR 19 -7.434 0.468 8.109
153 HB THR 19 HB THR 19 -5.907 1.895 6.812
154 HG1 THR 19 HG1 THR 19 -7.845 2.848 7.415
155 HG21 THR 19 HG21 THR 19 -7.479 1.141 4.309
156 HG22 THR 19 HG22 THR 19 -6.137 2.295 4.439
157 HG23 THR 19 HG23 THR 19 -5.834 0.587 4.689
158 H GLU 20 H GLU 20 -9.658 1.320 7.343
159 HA GLU 20 HA GLU 20 -11.043 -0.511 5.490
160 HB2 GLU 20 HB2 GLU 20 -11.516 -1.275 7.807
161 HB3 GLU 20 HB3 GLU 20 -12.047 0.368 8.233
162 HG2 GLU 20 HG2 GLU 20 -13.814 0.227 6.469
163 HG3 GLU 20 HG3 GLU 20 -13.249 -1.385 6.030
164 H ALA 21 H ALA 21 -11.953 0.761 3.923
165 HA ALA 21 HA ALA 21 -12.380 3.647 4.585
166 HB1 ALA 21 HB1 ALA 21 -10.420 3.404 3.183
167 HB2 ALA 21 HB2 ALA 21 -11.331 2.433 2.015
168 HB3 ALA 21 HB3 ALA 21 -11.737 4.149 2.264
169 H VAL 22 H VAL 22 -14.088 4.692 3.723
170 HA VAL 22 HA VAL 22 -16.462 3.091 3.359
171 HB VAL 22 HB VAL 22 -17.545 5.312 2.971
172 HG11 VAL 22 HG11 VAL 22 -15.871 5.008 5.504
173 HG12 VAL 22 HG12 VAL 22 -17.320 6.018 5.318
174 HG13 VAL 22 HG13 VAL 22 -17.461 4.272 5.172
175 HG21 VAL 22 HG21 VAL 22 -16.384 7.375 3.550
176 HG22 VAL 22 HG22 VAL 22 -14.833 6.530 3.659
177 HG23 VAL 22 HG23 VAL 22 -15.689 6.669 2.102
178 H ASP 23 H ASP 23 -14.343 4.971 1.241
179 HA ASP 23 HA ASP 23 -15.522 3.714 -1.201
180 HB2 ASP 23 HB2 ASP 23 -16.412 6.036 -0.676
181 HB3 ASP 23 HB3 ASP 23 -14.761 6.638 -0.744
182 H ALA 24 H ALA 24 -13.897 3.768 -3.030
183 HA ALA 24 HA ALA 24 -11.201 3.298 -2.060
184 HB1 ALA 24 HB1 ALA 24 -12.037 1.809 -3.723
185 HB2 ALA 24 HB2 ALA 24 -12.359 3.160 -4.854
186 HB3 ALA 24 HB3 ALA 24 -10.700 2.729 -4.373
187 H ALA 25 H ALA 25 -12.757 6.199 -3.358
188 HA ALA 25 HA ALA 25 -10.602 7.372 -4.679
189 HB1 ALA 25 HB1 ALA 25 -12.658 8.711 -2.859
190 HB2 ALA 25 HB2 ALA 25 -11.629 9.537 -4.049
191 HB3 ALA 25 HB3 ALA 25 -12.834 8.367 -4.595
192 H THR 26 H THR 26 -11.273 7.629 -1.138
193 HA THR 26 HA THR 26 -8.955 9.095 -0.531
194 HB THR 26 HB THR 26 -10.150 7.145 1.437
195 HG1 THR 26 HG1 THR 26 -12.011 7.916 1.302
196 HG21 THR 26 HG21 THR 26 -10.045 9.119 2.939
197 HG22 THR 26 HG22 THR 26 -8.461 8.735 2.249
198 HG23 THR 26 HG23 THR 26 -9.401 10.103 1.607
199 H ALA 27 H ALA 27 -9.404 5.658 -1.122
200 HA ALA 27 HA ALA 27 -6.954 4.772 0.099
201 HB1 ALA 27 HB1 ALA 27 -7.519 2.617 -0.775
202 HB2 ALA 27 HB2 ALA 27 -9.020 3.345 -0.192
203 HB3 ALA 27 HB3 ALA 27 -8.661 3.289 -1.941
204 H GLU 28 H GLU 28 -8.057 5.676 -3.211
205 HA GLU 28 HA GLU 28 -5.685 4.926 -4.605
206 HB2 GLU 28 HB2 GLU 28 -8.002 5.495 -5.563
207 HB3 GLU 28 HB3 GLU 28 -7.581 7.200 -5.324
208 HG2 GLU 28 HG2 GLU 28 -5.539 6.813 -6.779
209 HG3 GLU 28 HG3 GLU 28 -6.086 5.164 -7.042
210 H LYS 29 H LYS 29 -6.637 7.728 -2.748
211 HA LYS 29 HA LYS 29 -4.429 9.462 -3.439
212 HB2 LYS 29 HB2 LYS 29 -6.673 10.175 -2.591
213 HB3 LYS 29 HB3 LYS 29 -6.294 9.492 -1.018
214 HG2 LYS 29 HG2 LYS 29 -4.466 11.059 -0.686
215 HG3 LYS 29 HG3 LYS 29 -4.628 11.657 -2.346
216 HD2 LYS 29 HD2 LYS 29 -6.941 12.436 -1.843
217 HD3 LYS 29 HD3 LYS 29 -6.751 11.851 -0.169
218 HE2 LYS 29 HE2 LYS 29 -4.662 13.351 -0.080
219 HE3 LYS 29 HE3 LYS 29 -5.246 14.092 -1.582
220 HZ1 LYS 29 HZ1 LYS 29 -7.301 14.637 -0.352
221 HZ2 LYS 29 HZ2 LYS 29 -6.660 13.973 1.009
222 HZ3 LYS 29 HZ3 LYS 29 -5.951 15.310 0.339
223 H VAL 30 H VAL 30 -5.175 7.421 -0.554
224 HA VAL 30 HA VAL 30 -2.737 7.946 0.725
225 HB VAL 30 HB VAL 30 -4.927 6.948 1.711
226 HG11 VAL 30 HG11 VAL 30 -3.341 4.366 1.347
227 HG12 VAL 30 HG12 VAL 30 -4.817 4.603 2.294
228 HG13 VAL 30 HG13 VAL 30 -4.864 4.746 0.533
229 HG21 VAL 30 HG21 VAL 30 -3.645 6.236 3.679
230 HG22 VAL 30 HG22 VAL 30 -2.163 6.132 2.708
231 HG23 VAL 30 HG23 VAL 30 -2.960 7.704 2.977
232 H PHE 31 H PHE 31 -3.523 5.554 -1.773
233 HA PHE 31 HA PHE 31 -1.408 3.760 -1.520
234 HB2 PHE 31 HB2 PHE 31 -3.262 3.589 -3.126
235 HB3 PHE 31 HB3 PHE 31 -2.677 4.977 -4.006
236 HD1 PHE 31 HD1 PHE 31 -0.069 4.669 -4.955
237 HD2 PHE 31 HD2 PHE 31 -2.940 1.526 -4.157
238 HE1 PHE 31 HE1 PHE 31 1.067 3.204 -6.566
239 HE2 PHE 31 HE2 PHE 31 -1.867 0.136 -5.866
240 HZ PHE 31 HZ PHE 31 0.150 0.964 -7.088
241 H LYS 32 H LYS 32 -1.408 6.997 -3.166
242 HA LYS 32 HA LYS 32 1.438 6.717 -3.796
243 HB2 LYS 32 HB2 LYS 32 -0.096 7.970 -5.245
244 HB3 LYS 32 HB3 LYS 32 -0.442 9.117 -3.939
245 HG2 LYS 32 HG2 LYS 32 1.893 9.874 -3.918
246 HG3 LYS 32 HG3 LYS 32 2.338 8.609 -5.086
247 HD2 LYS 32 HD2 LYS 32 0.821 9.599 -6.734
248 HD3 LYS 32 HD3 LYS 32 0.401 10.899 -5.594
249 HE2 LYS 32 HE2 LYS 32 2.609 11.807 -5.664
250 HE3 LYS 32 HE3 LYS 32 3.258 10.348 -6.432
251 HZ1 LYS 32 HZ1 LYS 32 2.193 10.826 -8.409
252 HZ2 LYS 32 HZ2 LYS 32 1.292 12.069 -7.764
253 HZ3 LYS 32 HZ3 LYS 32 2.915 12.233 -7.959
254 H GLN 33 H GLN 33 -0.450 8.744 -1.535
255 HA GLN 33 HA GLN 33 1.612 10.197 -0.419
256 HB2 GLN 33 HB2 GLN 33 -0.778 10.619 -0.173
257 HB3 GLN 33 HB3 GLN 33 -0.977 9.143 0.765
258 HG2 GLN 33 HG2 GLN 33 0.450 10.134 2.587
259 HG3 GLN 33 HG3 GLN 33 0.483 11.641 1.655
260 HE21 GLN 33 HE21 GLN 33 -2.703 10.871 4.005
261 HE22 GLN 33 HE22 GLN 33 -1.319 9.813 4.011
262 H TYR 34 H TYR 34 0.318 7.141 1.170
263 HA TYR 34 HA TYR 34 2.273 7.428 3.263
264 HB2 TYR 34 HB2 TYR 34 0.390 6.338 3.899
265 HB3 TYR 34 HB3 TYR 34 0.264 5.358 2.458
266 HD1 TYR 34 HD1 TYR 34 0.823 3.135 2.543
267 HD2 TYR 34 HD2 TYR 34 2.556 5.801 5.440
268 HE1 TYR 34 HE1 TYR 34 1.830 1.196 3.710
269 HE2 TYR 34 HE2 TYR 34 3.580 3.895 6.618
270 HH TYR 34 HH TYR 34 3.043 0.502 5.537
271 H ALA 35 H ALA 35 2.205 5.365 0.356
272 HA ALA 35 HA ALA 35 4.606 3.981 0.852
273 HB1 ALA 35 HB1 ALA 35 3.254 4.792 -1.759
274 HB2 ALA 35 HB2 ALA 35 4.479 3.534 -1.588
275 HB3 ALA 35 HB3 ALA 35 2.927 3.334 -0.767
276 H ASN 36 H ASN 36 4.083 7.132 -0.916
277 HA ASN 36 HA ASN 36 6.916 7.373 -1.433
278 HB2 ASN 36 HB2 ASN 36 5.378 8.295 -2.838
279 HB3 ASN 36 HB3 ASN 36 4.607 9.287 -1.564
280 HD21 ASN 36 HD21 ASN 36 8.357 10.483 -2.930
281 HD22 ASN 36 HD22 ASN 36 8.008 8.790 -2.829
282 H ASP 37 H ASP 37 4.857 8.304 1.336
283 HA ASP 37 HA ASP 37 6.823 10.019 2.578
284 HB2 ASP 37 HB2 ASP 37 4.362 9.994 3.078
285 HB3 ASP 37 HB3 ASP 37 4.559 8.416 3.849
286 H ASN 38 H ASN 38 6.472 6.652 2.140
287 HA ASN 38 HA ASN 38 8.282 5.716 4.259
288 HB2 ASN 38 HB2 ASN 38 6.076 4.663 3.579
289 HB3 ASN 38 HB3 ASN 38 6.822 4.175 2.069
290 HD21 ASN 38 HD21 ASN 38 6.654 1.405 4.622
291 HD22 ASN 38 HD22 ASN 38 5.536 2.661 4.162
292 H GLY 39 H GLY 39 8.571 7.154 1.219
293 HA2 GLY 39 HA2 GLY 39 10.268 7.557 -0.193
294 HA3 GLY 39 HA3 GLY 39 11.354 6.811 0.972
295 H VAL 40 H VAL 40 8.666 5.201 -0.807
296 HA VAL 40 HA VAL 40 10.583 3.179 -1.729
297 HB VAL 40 HB VAL 40 8.705 1.825 -2.142
298 HG11 VAL 40 HG11 VAL 40 9.286 2.330 0.281
299 HG12 VAL 40 HG12 VAL 40 7.923 3.471 0.278
300 HG13 VAL 40 HG13 VAL 40 7.640 1.757 -0.017
301 HG21 VAL 40 HG21 VAL 40 6.970 4.338 -1.924
302 HG22 VAL 40 HG22 VAL 40 7.145 3.275 -3.311
303 HG23 VAL 40 HG23 VAL 40 6.359 2.647 -1.879
304 H ASP 41 H ASP 41 11.140 2.644 -3.803
305 HA ASP 41 HA ASP 41 9.715 3.961 -6.020
306 HB2 ASP 41 HB2 ASP 41 11.822 5.299 -5.238
307 HB3 ASP 41 HB3 ASP 41 12.708 4.046 -6.113
308 H GLY 42 H GLY 42 8.896 1.752 -5.741
309 HA2 GLY 42 HA2 GLY 42 10.433 -0.159 -7.441
310 HA3 GLY 42 HA3 GLY 42 9.727 -0.696 -5.918
311 H GLU 43 H GLU 43 8.865 -2.139 -7.610
312 HA GLU 43 HA GLU 43 6.558 -1.274 -9.191
313 HB2 GLU 43 HB2 GLU 43 6.556 -3.515 -10.108
314 HB3 GLU 43 HB3 GLU 43 8.141 -2.767 -10.288
315 HG2 GLU 43 HG2 GLU 43 9.115 -4.175 -8.598
316 HG3 GLU 43 HG3 GLU 43 7.532 -4.683 -7.995
317 H TRP 44 H TRP 44 4.458 -2.180 -8.927
318 HA TRP 44 HA TRP 44 3.885 -3.111 -6.166
319 HB2 TRP 44 HB2 TRP 44 2.225 -1.606 -8.210
320 HB3 TRP 44 HB3 TRP 44 1.622 -2.189 -6.663
321 HD1 TRP 44 HD1 TRP 44 4.718 -0.012 -7.682
322 HE1 TRP 44 HE1 TRP 44 5.136 1.633 -5.876
323 HE3 TRP 44 HE3 TRP 44 0.767 -1.119 -4.607
324 HZ2 TRP 44 HZ2 TRP 44 3.536 2.924 -3.754
325 HZ3 TRP 44 HZ3 TRP 44 0.239 0.357 -2.695
326 HH2 TRP 44 HH2 TRP 44 1.583 2.392 -2.279
327 H THR 45 H THR 45 2.350 -4.750 -5.792
328 HA THR 45 HA THR 45 1.237 -6.318 -8.022
329 HB THR 45 HB THR 45 1.776 -8.353 -6.504
330 HG1 THR 45 HG1 THR 45 4.029 -6.798 -5.812
331 HG21 THR 45 HG21 THR 45 2.737 -8.068 -8.751
332 HG22 THR 45 HG22 THR 45 4.044 -7.075 -8.069
333 HG23 THR 45 HG23 THR 45 3.907 -8.785 -7.630
334 H TYR 46 H TYR 46 -0.766 -7.516 -7.220
335 HA TYR 46 HA TYR 46 -1.756 -6.487 -4.638
336 HB2 TYR 46 HB2 TYR 46 -2.496 -4.864 -6.289
337 HB3 TYR 46 HB3 TYR 46 -3.115 -6.149 -7.327
338 HD1 TYR 46 HD1 TYR 46 -3.481 -4.910 -3.767
339 HD2 TYR 46 HD2 TYR 46 -5.403 -6.653 -7.219
340 HE1 TYR 46 HE1 TYR 46 -5.676 -4.822 -2.610
341 HE2 TYR 46 HE2 TYR 46 -7.588 -6.522 -6.066
342 HH TYR 46 HH TYR 46 -8.677 -6.057 -3.975
343 H ASP 47 H ASP 47 -3.215 -7.748 -3.620
344 HA ASP 47 HA ASP 47 -4.121 -10.302 -4.855
345 HB2 ASP 47 HB2 ASP 47 -2.713 -9.882 -2.206
346 HB3 ASP 47 HB3 ASP 47 -3.818 -11.245 -2.471
347 H ASP 48 H ASP 48 -6.338 -9.797 -5.022
348 HA ASP 48 HA ASP 48 -7.662 -8.001 -3.284
349 HB2 ASP 48 HB2 ASP 48 -8.364 -8.726 -5.636
350 HB3 ASP 48 HB3 ASP 48 -9.042 -10.170 -4.886
351 H ALA 49 H ALA 49 -6.746 -11.179 -2.661
352 HA ALA 49 HA ALA 49 -8.771 -12.260 -1.093
353 HB1 ALA 49 HB1 ALA 49 -5.745 -12.482 -0.735
354 HB2 ALA 49 HB2 ALA 49 -6.945 -13.578 -0.019
355 HB3 ALA 49 HB3 ALA 49 -6.768 -13.494 -1.779
356 H THR 50 H THR 50 -6.080 -10.133 0.054
357 HA THR 50 HA THR 50 -7.777 -9.329 2.358
358 HB THR 50 HB THR 50 -4.773 -9.718 2.552
359 HG1 THR 50 HG1 THR 50 -5.387 -11.758 2.348
360 HG21 THR 50 HG21 THR 50 -5.284 -9.847 4.985
361 HG22 THR 50 HG22 THR 50 -5.734 -8.282 4.315
362 HG23 THR 50 HG23 THR 50 -6.991 -9.495 4.646
363 H LYS 51 H LYS 51 -6.766 -8.299 -0.561
364 HA LYS 51 HA LYS 51 -6.434 -6.633 -1.644
365 HB2 LYS 51 HB2 LYS 51 -7.627 -5.173 0.695
366 HB3 LYS 51 HB3 LYS 51 -7.454 -4.550 -0.961
367 HG2 LYS 51 HG2 LYS 51 -8.874 -6.695 -1.586
368 HG3 LYS 51 HG3 LYS 51 -9.269 -6.697 0.133
369 HD2 LYS 51 HD2 LYS 51 -10.006 -4.252 -0.158
370 HD3 LYS 51 HD3 LYS 51 -9.810 -4.472 -1.889
371 HE2 LYS 51 HE2 LYS 51 -11.436 -6.473 -0.319
372 HE3 LYS 51 HE3 LYS 51 -12.145 -4.885 -0.665
373 HZ1 LYS 51 HZ1 LYS 51 -12.548 -6.666 -2.363
374 HZ2 LYS 51 HZ2 LYS 51 -11.968 -5.218 -2.931
375 HZ3 LYS 51 HZ3 LYS 51 -10.981 -6.527 -2.811
376 H THR 52 H THR 52 -4.334 -7.754 -0.426
377 HA THR 52 HA THR 52 -2.659 -5.786 0.829
378 HB THR 52 HB THR 52 -1.898 -8.548 -0.129
379 HG1 THR 52 HG1 THR 52 -3.333 -9.102 1.240
380 HG21 THR 52 HG21 THR 52 0.014 -7.144 0.535
381 HG22 THR 52 HG22 THR 52 -0.783 -6.754 2.076
382 HG23 THR 52 HG23 THR 52 -0.264 -8.420 1.726
383 H PHE 53 H PHE 53 -1.605 -4.312 -0.236
384 HA PHE 53 HA PHE 53 -0.803 -4.672 -3.084
385 HB2 PHE 53 HB2 PHE 53 -0.956 -2.285 -1.197
386 HB3 PHE 53 HB3 PHE 53 -0.129 -2.225 -2.738
387 HD1 PHE 53 HD1 PHE 53 -1.521 -2.879 -4.876
388 HD2 PHE 53 HD2 PHE 53 -3.227 -1.621 -1.113
389 HE1 PHE 53 HE1 PHE 53 -3.562 -2.098 -6.057
390 HE2 PHE 53 HE2 PHE 53 -5.232 -0.795 -2.307
391 HZ PHE 53 HZ PHE 53 -5.405 -1.024 -4.772
392 H THR 54 H THR 54 1.397 -5.143 -3.373
393 HA THR 54 HA THR 54 3.213 -4.782 -1.041
394 HB THR 54 HB THR 54 3.061 -7.142 -2.938
395 HG1 THR 54 HG1 THR 54 2.285 -8.225 -1.154
396 HG21 THR 54 HG21 THR 54 4.844 -6.675 -0.495
397 HG22 THR 54 HG22 THR 54 4.720 -8.195 -1.423
398 HG23 THR 54 HG23 THR 54 5.388 -6.763 -2.186
399 H VAL 55 H VAL 55 5.266 -4.049 -1.484
400 HA VAL 55 HA VAL 55 5.981 -3.402 -4.271
401 HB VAL 55 HB VAL 55 5.946 -1.660 -1.811
402 HG11 VAL 55 HG11 VAL 55 8.250 -1.349 -2.593
403 HG12 VAL 55 HG12 VAL 55 7.687 -1.142 -4.268
404 HG13 VAL 55 HG13 VAL 55 7.286 0.061 -3.012
405 HG21 VAL 55 HG21 VAL 55 5.238 -1.151 -4.728
406 HG22 VAL 55 HG22 VAL 55 4.059 -1.622 -3.493
407 HG23 VAL 55 HG23 VAL 55 4.903 -0.073 -3.349
408 H THR 56 H THR 56 8.093 -3.763 -4.831
409 HA THR 56 HA THR 56 9.918 -4.808 -2.743
410 HB THR 56 HB THR 56 10.754 -6.302 -4.614
411 HG1 THR 56 HG1 THR 56 9.833 -5.584 -6.425
412 HG21 THR 56 HG21 THR 56 7.883 -6.780 -3.693
413 HG22 THR 56 HG22 THR 56 9.031 -7.995 -4.282
414 HG23 THR 56 HG23 THR 56 9.350 -7.158 -2.753
415 H GLU 57 H GLU 57 11.293 -3.115 -2.433
416 HA GLU 57 HA GLU 57 12.104 -1.272 -4.547
417 HB2 GLU 57 HB2 GLU 57 11.728 -0.535 -2.221
418 HB3 GLU 57 HB3 GLU 57 12.846 -1.770 -1.638
419 HG2 GLU 57 HG2 GLU 57 14.053 0.163 -1.422
420 HG3 GLU 57 HG3 GLU 57 14.712 -0.518 -2.881
Start of MODEL 8
1 H1 MET 1 H MET 1 -16.906 0.569 2.115
2 HA MET 1 HA MET 1 -16.935 0.085 -0.240
3 HB2 MET 1 HB2 MET 1 -15.415 2.106 -0.686
4 HB3 MET 1 HB3 MET 1 -14.049 1.036 -0.399
5 HG2 MET 1 HG2 MET 1 -14.618 1.155 -2.798
6 HG3 MET 1 HG3 MET 1 -14.880 -0.475 -2.177
7 HE1 MET 1 HE1 MET 1 -18.256 2.523 -3.325
8 HE2 MET 1 HE2 MET 1 -17.274 2.810 -1.881
9 HE3 MET 1 HE3 MET 1 -16.517 2.825 -3.496
10 H GLY 2 H GLY 2 -13.617 -0.298 1.435
11 HA2 GLY 2 HA2 GLY 2 -14.262 -2.943 2.131
12 HA3 GLY 2 HA3 GLY 2 -13.247 -2.883 0.672
13 H THR 3 H THR 3 -11.958 -4.057 2.554
14 HA THR 3 HA THR 3 -10.317 -2.049 3.932
15 HB THR 3 HB THR 3 -11.396 -3.627 5.445
16 HG1 THR 3 HG1 THR 3 -9.166 -2.806 5.680
17 HG21 THR 3 HG21 THR 3 -11.525 -5.646 3.965
18 HG22 THR 3 HG22 THR 3 -9.761 -5.824 4.090
19 HG23 THR 3 HG23 THR 3 -10.784 -5.990 5.533
20 H TYR 4 H TYR 4 -8.117 -1.980 3.463
21 HA TYR 4 HA TYR 4 -7.075 -3.846 1.443
22 HB2 TYR 4 HB2 TYR 4 -6.815 -0.844 1.156
23 HB3 TYR 4 HB3 TYR 4 -6.350 -2.081 0.003
24 HD1 TYR 4 HD1 TYR 4 -7.835 -2.575 -1.820
25 HD2 TYR 4 HD2 TYR 4 -9.406 -0.529 1.627
26 HE1 TYR 4 HE1 TYR 4 -9.969 -2.136 -3.027
27 HE2 TYR 4 HE2 TYR 4 -11.453 0.041 0.342
28 HH TYR 4 HH TYR 4 -12.115 -1.187 -2.905
29 H LYS 5 H LYS 5 -5.059 -4.453 1.811
30 HA LYS 5 HA LYS 5 -3.659 -3.266 4.148
31 HB2 LYS 5 HB2 LYS 5 -4.365 -5.649 4.076
32 HB3 LYS 5 HB3 LYS 5 -3.278 -5.904 2.726
33 HG2 LYS 5 HG2 LYS 5 -1.360 -5.204 4.268
34 HG3 LYS 5 HG3 LYS 5 -2.550 -5.189 5.594
35 HD2 LYS 5 HD2 LYS 5 -3.114 -7.534 5.165
36 HD3 LYS 5 HD3 LYS 5 -2.017 -7.565 3.767
37 HE2 LYS 5 HE2 LYS 5 -0.119 -6.988 5.401
38 HE3 LYS 5 HE3 LYS 5 -1.287 -7.318 6.711
39 HZ1 LYS 5 HZ1 LYS 5 -0.268 -9.184 4.662
40 HZ2 LYS 5 HZ2 LYS 5 -0.185 -9.343 6.295
41 HZ3 LYS 5 HZ3 LYS 5 -1.621 -9.515 5.530
42 H LEU 6 H LEU 6 -1.680 -2.289 3.989
43 HA LEU 6 HA LEU 6 -0.313 -2.208 1.352
44 HB2 LEU 6 HB2 LEU 6 -1.641 -0.115 2.678
45 HB3 LEU 6 HB3 LEU 6 0.045 0.231 2.954
46 HG LEU 6 HG LEU 6 -1.042 -0.468 0.206
47 HD11 LEU 6 HD11 LEU 6 -2.306 1.459 1.050
48 HD12 LEU 6 HD12 LEU 6 -0.800 2.318 1.419
49 HD13 LEU 6 HD13 LEU 6 -1.224 1.918 -0.269
50 HD21 LEU 6 HD21 LEU 6 1.414 1.099 1.066
51 HD22 LEU 6 HD22 LEU 6 1.420 -0.575 0.496
52 HD23 LEU 6 HD23 LEU 6 0.948 0.725 -0.599
53 H ILE 7 H ILE 7 1.624 -3.189 1.439
54 HA ILE 7 HA ILE 7 3.495 -2.623 3.661
55 HB ILE 7 HB ILE 7 3.097 -4.938 3.957
56 HG12 ILE 7 HG12 ILE 7 5.475 -5.029 2.037
57 HG13 ILE 7 HG13 ILE 7 5.599 -4.286 3.613
58 HG21 ILE 7 HG21 ILE 7 1.847 -5.500 2.004
59 HG22 ILE 7 HG22 ILE 7 3.253 -5.316 0.961
60 HG23 ILE 7 HG23 ILE 7 3.144 -6.649 2.128
61 HD11 ILE 7 HD11 ILE 7 5.043 -7.212 3.074
62 HD12 ILE 7 HD12 ILE 7 6.492 -6.460 3.749
63 HD13 ILE 7 HD13 ILE 7 4.989 -6.455 4.685
64 H LEU 8 H LEU 8 5.407 -1.883 3.194
65 HA LEU 8 HA LEU 8 6.237 -1.540 0.352
66 HB2 LEU 8 HB2 LEU 8 6.514 0.406 2.688
67 HB3 LEU 8 HB3 LEU 8 7.419 0.515 1.208
68 HG LEU 8 HG LEU 8 5.767 2.083 0.907
69 HD11 LEU 8 HD11 LEU 8 4.495 -0.359 -0.397
70 HD12 LEU 8 HD12 LEU 8 4.271 1.314 -0.872
71 HD13 LEU 8 HD13 LEU 8 5.861 0.564 -1.058
72 HD21 LEU 8 HD21 LEU 8 3.610 0.200 1.901
73 HD22 LEU 8 HD22 LEU 8 4.417 1.445 2.879
74 HD23 LEU 8 HD23 LEU 8 3.460 1.922 1.477
75 H ASN 9 H ASN 9 8.236 -2.551 -0.074
76 HA ASN 9 HA ASN 9 9.812 -3.349 2.300
77 HB2 ASN 9 HB2 ASN 9 9.855 -4.218 -0.615
78 HB3 ASN 9 HB3 ASN 9 11.044 -4.691 0.565
79 HD21 ASN 9 HD21 ASN 9 7.670 -6.835 0.446
80 HD22 ASN 9 HD22 ASN 9 8.116 -5.680 -0.828
81 H GLY 10 H GLY 10 11.981 -2.649 2.394
82 HA2 GLY 10 HA2 GLY 10 12.939 -0.636 0.471
83 HA3 GLY 10 HA3 GLY 10 12.896 -0.293 2.221
84 H LYS 11 H LYS 11 15.346 -0.330 0.984
85 HA LYS 11 HA LYS 11 16.716 -2.776 0.816
86 HB2 LYS 11 HB2 LYS 11 17.622 -0.696 0.011
87 HB3 LYS 11 HB3 LYS 11 17.554 0.053 1.608
88 HG2 LYS 11 HG2 LYS 11 19.355 -1.427 2.424
89 HG3 LYS 11 HG3 LYS 11 19.398 -2.234 0.840
90 HD2 LYS 11 HD2 LYS 11 19.888 -0.007 -0.207
91 HD3 LYS 11 HD3 LYS 11 19.992 0.709 1.407
92 HE2 LYS 11 HE2 LYS 11 22.004 -0.359 1.913
93 HE3 LYS 11 HE3 LYS 11 21.609 -1.762 0.906
94 HZ1 LYS 11 HZ1 LYS 11 21.948 -0.330 -1.047
95 HZ2 LYS 11 HZ2 LYS 11 22.578 0.844 -0.077
96 HZ3 LYS 11 HZ3 LYS 11 23.299 -0.647 -0.212
97 H THR 12 H THR 12 16.354 -0.633 3.668
98 HA THR 12 HA THR 12 16.989 -2.918 5.444
99 HB THR 12 HB THR 12 18.977 -1.654 5.324
100 HG1 THR 12 HG1 THR 12 17.481 -1.524 7.618
101 HG21 THR 12 HG21 THR 12 18.238 0.481 4.452
102 HG22 THR 12 HG22 THR 12 17.343 0.826 5.950
103 HG23 THR 12 HG23 THR 12 19.122 0.717 5.956
104 H LEU 13 H LEU 13 14.443 -1.073 4.464
105 HA LEU 13 HA LEU 13 13.300 -0.963 7.220
106 HB2 LEU 13 HB2 LEU 13 13.946 1.267 5.965
107 HB3 LEU 13 HB3 LEU 13 12.591 0.879 4.913
108 HG LEU 13 HG LEU 13 11.165 0.756 7.091
109 HD11 LEU 13 HD11 LEU 13 13.140 0.689 8.667
110 HD12 LEU 13 HD12 LEU 13 13.556 2.333 8.162
111 HD13 LEU 13 HD13 LEU 13 12.019 2.013 9.000
112 HD21 LEU 13 HD21 LEU 13 10.886 3.219 7.149
113 HD22 LEU 13 HD22 LEU 13 12.386 3.408 6.211
114 HD23 LEU 13 HD23 LEU 13 10.983 2.606 5.486
115 H LYS 14 H LYS 14 11.191 -1.643 7.447
116 HA LYS 14 HA LYS 14 9.614 -2.475 5.106
117 HB2 LYS 14 HB2 LYS 14 10.578 -4.362 7.297
118 HB3 LYS 14 HB3 LYS 14 9.071 -4.653 6.414
119 HG2 LYS 14 HG2 LYS 14 10.278 -4.581 4.263
120 HG3 LYS 14 HG3 LYS 14 11.813 -4.354 5.123
121 HD2 LYS 14 HD2 LYS 14 11.615 -6.525 6.188
122 HD3 LYS 14 HD3 LYS 14 10.000 -6.773 5.464
123 HE2 LYS 14 HE2 LYS 14 10.863 -6.834 3.254
124 HE3 LYS 14 HE3 LYS 14 12.415 -6.161 3.743
125 HZ1 LYS 14 HZ1 LYS 14 11.439 -8.837 4.505
126 HZ2 LYS 14 HZ2 LYS 14 12.477 -8.507 3.284
127 HZ3 LYS 14 HZ3 LYS 14 12.942 -8.199 4.833
128 H GLY 15 H GLY 15 7.353 -2.500 5.537
129 HA2 GLY 15 HA2 GLY 15 6.331 -2.020 8.206
130 HA3 GLY 15 HA3 GLY 15 6.212 -0.643 7.083
131 H GLU 16 H GLU 16 4.017 -2.439 8.208
132 HA GLU 16 HA GLU 16 2.704 -3.042 5.664
133 HB2 GLU 16 HB2 GLU 16 2.064 -5.310 6.392
134 HB3 GLU 16 HB3 GLU 16 3.781 -5.117 6.072
135 HG2 GLU 16 HG2 GLU 16 4.205 -4.992 8.553
136 HG3 GLU 16 HG3 GLU 16 2.508 -5.433 8.800
137 H THR 17 H THR 17 0.826 -1.965 5.797
138 HA THR 17 HA THR 17 -0.547 -1.902 8.474
139 HB THR 17 HB THR 17 0.669 0.216 7.870
140 HG1 THR 17 HG1 THR 17 -0.856 1.439 8.723
141 HG21 THR 17 HG21 THR 17 -0.393 1.771 6.313
142 HG22 THR 17 HG22 THR 17 0.111 0.312 5.451
143 HG23 THR 17 HG23 THR 17 -1.600 0.560 5.853
144 H THR 18 H THR 18 -2.931 -1.067 8.120
145 HA THR 18 HA THR 18 -4.140 -2.023 5.681
146 HB THR 18 HB THR 18 -3.895 -4.100 7.190
147 HG1 THR 18 HG1 THR 18 -6.074 -4.707 6.568
148 HG21 THR 18 HG21 THR 18 -4.638 -3.008 9.338
149 HG22 THR 18 HG22 THR 18 -6.270 -2.850 8.649
150 HG23 THR 18 HG23 THR 18 -5.572 -4.458 8.906
151 H THR 19 H THR 19 -6.449 -1.388 5.605
152 HA THR 19 HA THR 19 -7.418 0.437 7.647
153 HB THR 19 HB THR 19 -5.707 1.769 6.311
154 HG1 THR 19 HG1 THR 19 -7.361 3.438 5.681
155 HG21 THR 19 HG21 THR 19 -7.695 1.770 4.042
156 HG22 THR 19 HG22 THR 19 -6.042 2.419 4.073
157 HG23 THR 19 HG23 THR 19 -6.330 0.662 4.050
158 H GLU 20 H GLU 20 -9.573 1.316 6.899
159 HA GLU 20 HA GLU 20 -10.948 -0.230 4.839
160 HB2 GLU 20 HB2 GLU 20 -11.477 -1.266 7.111
161 HB3 GLU 20 HB3 GLU 20 -12.141 0.318 7.590
162 HG2 GLU 20 HG2 GLU 20 -13.665 0.200 5.560
163 HG3 GLU 20 HG3 GLU 20 -13.022 -1.410 5.222
164 H ALA 21 H ALA 21 -12.342 1.279 3.682
165 HA ALA 21 HA ALA 21 -12.502 3.995 4.838
166 HB1 ALA 21 HB1 ALA 21 -10.455 4.099 3.436
167 HB2 ALA 21 HB2 ALA 21 -11.401 3.538 2.017
168 HB3 ALA 21 HB3 ALA 21 -11.777 5.082 2.797
169 H VAL 22 H VAL 22 -14.066 5.271 4.041
170 HA VAL 22 HA VAL 22 -16.530 4.142 3.471
171 HB VAL 22 HB VAL 22 -17.230 6.466 2.918
172 HG11 VAL 22 HG11 VAL 22 -15.379 6.429 5.329
173 HG12 VAL 22 HG12 VAL 22 -16.858 7.393 5.085
174 HG13 VAL 22 HG13 VAL 22 -16.964 5.641 5.288
175 HG21 VAL 22 HG21 VAL 22 -15.618 8.346 3.210
176 HG22 VAL 22 HG22 VAL 22 -14.267 7.206 3.236
177 HG23 VAL 22 HG23 VAL 22 -15.259 7.402 1.773
178 H ASP 23 H ASP 23 -14.233 5.630 1.111
179 HA ASP 23 HA ASP 23 -15.518 4.094 -1.087
180 HB2 ASP 23 HB2 ASP 23 -16.355 6.417 -1.065
181 HB3 ASP 23 HB3 ASP 23 -14.677 6.997 -1.109
182 H ALA 24 H ALA 24 -13.971 3.801 -2.900
183 HA ALA 24 HA ALA 24 -11.343 3.189 -1.924
184 HB1 ALA 24 HB1 ALA 24 -12.303 1.745 -3.542
185 HB2 ALA 24 HB2 ALA 24 -12.467 3.077 -4.736
186 HB3 ALA 24 HB3 ALA 24 -10.865 2.487 -4.232
187 H ALA 25 H ALA 25 -12.657 6.176 -3.259
188 HA ALA 25 HA ALA 25 -10.284 7.241 -4.385
189 HB1 ALA 25 HB1 ALA 25 -12.572 8.613 -2.897
190 HB2 ALA 25 HB2 ALA 25 -11.322 9.454 -3.844
191 HB3 ALA 25 HB3 ALA 25 -12.446 8.340 -4.640
192 H THR 26 H THR 26 -11.398 7.067 -0.985
193 HA THR 26 HA THR 26 -9.292 8.635 0.176
194 HB THR 26 HB THR 26 -10.982 6.336 1.239
195 HG1 THR 26 HG1 THR 26 -11.960 8.468 0.718
196 HG21 THR 26 HG21 THR 26 -10.399 7.100 3.536
197 HG22 THR 26 HG22 THR 26 -8.998 6.460 2.678
198 HG23 THR 26 HG23 THR 26 -9.199 8.219 2.846
199 H ALA 27 H ALA 27 -9.554 5.197 -0.760
200 HA ALA 27 HA ALA 27 -7.058 4.395 0.382
201 HB1 ALA 27 HB1 ALA 27 -7.421 2.305 -0.754
202 HB2 ALA 27 HB2 ALA 27 -8.968 2.857 -0.065
203 HB3 ALA 27 HB3 ALA 27 -8.645 3.011 -1.813
204 H GLU 28 H GLU 28 -8.059 5.564 -2.895
205 HA GLU 28 HA GLU 28 -5.542 5.088 -4.159
206 HB2 GLU 28 HB2 GLU 28 -7.649 5.601 -5.412
207 HB3 GLU 28 HB3 GLU 28 -7.554 7.277 -4.827
208 HG2 GLU 28 HG2 GLU 28 -5.250 7.431 -5.860
209 HG3 GLU 28 HG3 GLU 28 -5.478 5.826 -6.550
210 H LYS 29 H LYS 29 -6.838 7.868 -2.339
211 HA LYS 29 HA LYS 29 -4.557 9.559 -2.727
212 HB2 LYS 29 HB2 LYS 29 -6.761 10.392 -2.047
213 HB3 LYS 29 HB3 LYS 29 -6.657 9.522 -0.505
214 HG2 LYS 29 HG2 LYS 29 -4.705 10.858 0.160
215 HG3 LYS 29 HG3 LYS 29 -4.676 11.652 -1.423
216 HD2 LYS 29 HD2 LYS 29 -6.871 12.688 -0.961
217 HD3 LYS 29 HD3 LYS 29 -6.940 11.846 0.615
218 HE2 LYS 29 HE2 LYS 29 -4.790 12.916 1.261
219 HE3 LYS 29 HE3 LYS 29 -4.746 13.775 -0.281
220 HZ1 LYS 29 HZ1 LYS 29 -5.551 15.166 1.451
221 HZ2 LYS 29 HZ2 LYS 29 -6.743 14.931 0.368
222 HZ3 LYS 29 HZ3 LYS 29 -6.776 14.148 1.844
223 H VAL 30 H VAL 30 -5.432 7.425 0.091
224 HA VAL 30 HA VAL 30 -3.009 8.025 1.430
225 HB VAL 30 HB VAL 30 -5.171 6.954 2.368
226 HG11 VAL 30 HG11 VAL 30 -3.624 4.376 1.923
227 HG12 VAL 30 HG12 VAL 30 -5.169 4.588 2.764
228 HG13 VAL 30 HG13 VAL 30 -5.070 4.849 1.016
229 HG21 VAL 30 HG21 VAL 30 -3.930 6.106 4.310
230 HG22 VAL 30 HG22 VAL 30 -2.432 6.072 3.360
231 HG23 VAL 30 HG23 VAL 30 -3.231 7.616 3.711
232 H PHE 31 H PHE 31 -3.701 5.601 -1.088
233 HA PHE 31 HA PHE 31 -1.410 4.007 -0.853
234 HB2 PHE 31 HB2 PHE 31 -3.234 3.414 -2.231
235 HB3 PHE 31 HB3 PHE 31 -3.149 4.875 -3.182
236 HD1 PHE 31 HD1 PHE 31 -0.548 5.080 -4.442
237 HD2 PHE 31 HD2 PHE 31 -2.978 1.607 -3.594
238 HE1 PHE 31 HE1 PHE 31 0.596 3.839 -6.200
239 HE2 PHE 31 HE2 PHE 31 -1.869 0.404 -5.439
240 HZ PHE 31 HZ PHE 31 -0.054 1.507 -6.723
241 H LYS 32 H LYS 32 -1.821 7.194 -2.477
242 HA LYS 32 HA LYS 32 0.894 7.077 -3.506
243 HB2 LYS 32 HB2 LYS 32 -1.055 8.356 -4.482
244 HB3 LYS 32 HB3 LYS 32 -0.808 9.579 -3.242
245 HG2 LYS 32 HG2 LYS 32 1.376 10.126 -4.102
246 HG3 LYS 32 HG3 LYS 32 1.467 8.622 -5.033
247 HD2 LYS 32 HD2 LYS 32 -0.412 9.359 -6.445
248 HD3 LYS 32 HD3 LYS 32 -0.450 10.914 -5.609
249 HE2 LYS 32 HE2 LYS 32 1.788 11.469 -6.401
250 HE3 LYS 32 HE3 LYS 32 2.020 9.822 -7.024
251 HZ1 LYS 32 HZ1 LYS 32 0.279 10.192 -8.596
252 HZ2 LYS 32 HZ2 LYS 32 0.019 11.729 -8.054
253 HZ3 LYS 32 HZ3 LYS 32 1.439 11.332 -8.796
254 H GLN 33 H GLN 33 -0.672 8.983 -0.867
255 HA GLN 33 HA GLN 33 1.759 10.178 -0.044
256 HB2 GLN 33 HB2 GLN 33 -0.322 11.153 0.512
257 HB3 GLN 33 HB3 GLN 33 -0.913 9.713 1.321
258 HG2 GLN 33 HG2 GLN 33 1.545 11.117 2.422
259 HG3 GLN 33 HG3 GLN 33 -0.042 11.812 2.708
260 HE21 GLN 33 HE21 GLN 33 -1.188 9.083 4.800
261 HE22 GLN 33 HE22 GLN 33 -1.784 10.255 3.623
262 H TYR 34 H TYR 34 0.085 7.352 1.568
263 HA TYR 34 HA TYR 34 2.039 7.032 3.524
264 HB2 TYR 34 HB2 TYR 34 -0.132 5.980 3.622
265 HB3 TYR 34 HB3 TYR 34 0.222 4.985 2.210
266 HD1 TYR 34 HD1 TYR 34 1.153 2.873 2.434
267 HD2 TYR 34 HD2 TYR 34 1.377 5.623 5.734
268 HE1 TYR 34 HE1 TYR 34 2.125 1.074 3.853
269 HE2 TYR 34 HE2 TYR 34 2.376 3.840 7.150
270 HH TYR 34 HH TYR 34 3.757 1.624 6.720
271 H ALA 35 H ALA 35 1.970 5.468 0.282
272 HA ALA 35 HA ALA 35 4.391 4.004 0.853
273 HB1 ALA 35 HB1 ALA 35 2.990 4.615 -1.763
274 HB2 ALA 35 HB2 ALA 35 4.305 3.456 -1.552
275 HB3 ALA 35 HB3 ALA 35 2.755 3.180 -0.723
276 H ASN 36 H ASN 36 3.809 7.025 -1.143
277 HA ASN 36 HA ASN 36 6.583 7.142 -1.859
278 HB2 ASN 36 HB2 ASN 36 4.993 8.261 -3.168
279 HB3 ASN 36 HB3 ASN 36 4.430 9.251 -1.786
280 HD21 ASN 36 HD21 ASN 36 8.185 10.119 -3.302
281 HD22 ASN 36 HD22 ASN 36 7.603 8.503 -3.473
282 H ASP 37 H ASP 37 4.816 8.370 0.989
283 HA ASP 37 HA ASP 37 6.937 10.005 2.010
284 HB2 ASP 37 HB2 ASP 37 4.524 10.171 2.570
285 HB3 ASP 37 HB3 ASP 37 4.619 8.611 3.408
286 H ASN 38 H ASN 38 6.507 6.610 1.790
287 HA ASN 38 HA ASN 38 8.248 5.819 4.018
288 HB2 ASN 38 HB2 ASN 38 6.115 4.647 3.036
289 HB3 ASN 38 HB3 ASN 38 7.187 4.067 1.785
290 HD21 ASN 38 HD21 ASN 38 6.615 1.777 4.879
291 HD22 ASN 38 HD22 ASN 38 5.688 3.208 4.537
292 H GLY 39 H GLY 39 8.727 7.119 0.890
293 HA2 GLY 39 HA2 GLY 39 10.708 7.457 -0.237
294 HA3 GLY 39 HA3 GLY 39 11.536 6.408 0.904
295 H VAL 40 H VAL 40 8.753 5.513 -1.266
296 HA VAL 40 HA VAL 40 10.532 3.411 -2.397
297 HB VAL 40 HB VAL 40 8.679 2.029 -2.628
298 HG11 VAL 40 HG11 VAL 40 9.391 2.478 -0.231
299 HG12 VAL 40 HG12 VAL 40 7.999 3.598 -0.130
300 HG13 VAL 40 HG13 VAL 40 7.736 1.875 -0.450
301 HG21 VAL 40 HG21 VAL 40 6.847 4.423 -2.157
302 HG22 VAL 40 HG22 VAL 40 6.977 3.475 -3.634
303 HG23 VAL 40 HG23 VAL 40 6.321 2.717 -2.194
304 H ASP 41 H ASP 41 10.794 3.024 -4.519
305 HA ASP 41 HA ASP 41 9.169 4.361 -6.534
306 HB2 ASP 41 HB2 ASP 41 11.054 5.974 -6.119
307 HB3 ASP 41 HB3 ASP 41 12.178 4.748 -6.730
308 H GLY 42 H GLY 42 8.597 1.949 -6.245
309 HA2 GLY 42 HA2 GLY 42 10.249 0.304 -8.107
310 HA3 GLY 42 HA3 GLY 42 9.747 -0.319 -6.539
311 H GLU 43 H GLU 43 8.809 -2.018 -7.901
312 HA GLU 43 HA GLU 43 6.341 -1.291 -9.369
313 HB2 GLU 43 HB2 GLU 43 6.402 -3.410 -10.415
314 HB3 GLU 43 HB3 GLU 43 7.937 -2.586 -10.631
315 HG2 GLU 43 HG2 GLU 43 9.039 -4.055 -9.037
316 HG3 GLU 43 HG3 GLU 43 7.494 -4.760 -8.540
317 H TRP 44 H TRP 44 4.354 -2.203 -8.977
318 HA TRP 44 HA TRP 44 3.936 -3.271 -6.245
319 HB2 TRP 44 HB2 TRP 44 2.172 -1.652 -8.112
320 HB3 TRP 44 HB3 TRP 44 1.690 -2.250 -6.538
321 HD1 TRP 44 HD1 TRP 44 4.794 -0.106 -7.672
322 HE1 TRP 44 HE1 TRP 44 5.156 1.717 -5.996
323 HE3 TRP 44 HE3 TRP 44 0.784 -1.051 -4.648
324 HZ2 TRP 44 HZ2 TRP 44 3.609 2.965 -3.857
325 HZ3 TRP 44 HZ3 TRP 44 0.200 0.529 -2.833
326 HH2 TRP 44 HH2 TRP 44 1.551 2.561 -2.462
327 H THR 45 H THR 45 2.613 -5.039 -5.871
328 HA THR 45 HA THR 45 1.299 -6.430 -8.152
329 HB THR 45 HB THR 45 1.829 -8.542 -6.762
330 HG1 THR 45 HG1 THR 45 2.654 -7.847 -4.919
331 HG21 THR 45 HG21 THR 45 2.884 -8.101 -8.924
332 HG22 THR 45 HG22 THR 45 4.095 -7.060 -8.161
333 HG23 THR 45 HG23 THR 45 4.057 -8.798 -7.796
334 H TYR 46 H TYR 46 -0.554 -7.912 -7.293
335 HA TYR 46 HA TYR 46 -1.782 -6.707 -4.854
336 HB2 TYR 46 HB2 TYR 46 -2.649 -5.582 -6.836
337 HB3 TYR 46 HB3 TYR 46 -3.030 -7.129 -7.591
338 HD1 TYR 46 HD1 TYR 46 -3.647 -5.501 -4.233
339 HD2 TYR 46 HD2 TYR 46 -5.359 -7.529 -7.650
340 HE1 TYR 46 HE1 TYR 46 -5.856 -5.479 -3.151
341 HE2 TYR 46 HE2 TYR 46 -7.576 -7.526 -6.541
342 HH TYR 46 HH TYR 46 -8.699 -7.116 -4.397
343 H ASP 47 H ASP 47 -2.808 -8.071 -3.513
344 HA ASP 47 HA ASP 47 -3.433 -10.882 -4.271
345 HB2 ASP 47 HB2 ASP 47 -1.652 -9.832 -2.129
346 HB3 ASP 47 HB3 ASP 47 -2.842 -11.039 -1.602
347 H ASP 48 H ASP 48 -5.615 -10.653 -4.475
348 HA ASP 48 HA ASP 48 -7.199 -8.764 -3.140
349 HB2 ASP 48 HB2 ASP 48 -7.724 -9.977 -5.275
350 HB3 ASP 48 HB3 ASP 48 -8.193 -11.380 -4.299
351 H ALA 49 H ALA 49 -6.114 -11.784 -1.706
352 HA ALA 49 HA ALA 49 -8.285 -12.447 -0.126
353 HB1 ALA 49 HB1 ALA 49 -5.340 -12.503 0.668
354 HB2 ALA 49 HB2 ALA 49 -6.652 -13.385 1.477
355 HB3 ALA 49 HB3 ALA 49 -6.238 -13.778 -0.201
356 H THR 50 H THR 50 -5.874 -9.916 0.644
357 HA THR 50 HA THR 50 -7.774 -8.776 2.627
358 HB THR 50 HB THR 50 -4.849 -8.420 3.140
359 HG1 THR 50 HG1 THR 50 -4.658 -10.311 4.191
360 HG21 THR 50 HG21 THR 50 -6.579 -7.318 4.537
361 HG22 THR 50 HG22 THR 50 -7.231 -8.905 4.974
362 HG23 THR 50 HG23 THR 50 -5.596 -8.441 5.471
363 H LYS 51 H LYS 51 -6.855 -8.403 -0.382
364 HA LYS 51 HA LYS 51 -6.446 -6.954 -1.829
365 HB2 LYS 51 HB2 LYS 51 -7.792 -4.923 -0.042
366 HB3 LYS 51 HB3 LYS 51 -7.618 -4.864 -1.789
367 HG2 LYS 51 HG2 LYS 51 -8.919 -7.086 -1.824
368 HG3 LYS 51 HG3 LYS 51 -9.252 -6.814 -0.112
369 HD2 LYS 51 HD2 LYS 51 -10.351 -4.668 -0.639
370 HD3 LYS 51 HD3 LYS 51 -10.040 -4.911 -2.367
371 HE2 LYS 51 HE2 LYS 51 -11.609 -6.840 -0.591
372 HE3 LYS 51 HE3 LYS 51 -12.354 -5.586 -1.592
373 HZ1 LYS 51 HZ1 LYS 51 -12.347 -7.708 -2.685
374 HZ2 LYS 51 HZ2 LYS 51 -11.409 -6.647 -3.538
375 HZ3 LYS 51 HZ3 LYS 51 -10.718 -7.829 -2.653
376 H THR 52 H THR 52 -4.505 -7.753 -0.590
377 HA THR 52 HA THR 52 -2.688 -6.030 0.715
378 HB THR 52 HB THR 52 -2.488 -8.768 -0.578
379 HG1 THR 52 HG1 THR 52 -3.059 -9.609 1.385
380 HG21 THR 52 HG21 THR 52 -0.274 -7.885 0.181
381 HG22 THR 52 HG22 THR 52 -0.928 -7.811 1.829
382 HG23 THR 52 HG23 THR 52 -0.794 -9.358 1.011
383 H PHE 53 H PHE 53 -1.513 -4.557 -0.337
384 HA PHE 53 HA PHE 53 -0.618 -5.063 -3.133
385 HB2 PHE 53 HB2 PHE 53 -0.952 -2.533 -1.490
386 HB3 PHE 53 HB3 PHE 53 0.013 -2.598 -2.956
387 HD1 PHE 53 HD1 PHE 53 -0.978 -2.651 -5.164
388 HD2 PHE 53 HD2 PHE 53 -3.464 -2.999 -1.643
389 HE1 PHE 53 HE1 PHE 53 -2.982 -2.175 -6.525
390 HE2 PHE 53 HE2 PHE 53 -5.465 -2.524 -3.022
391 HZ PHE 53 HZ PHE 53 -5.223 -2.072 -5.459
392 H THR 54 H THR 54 1.585 -5.329 -3.432
393 HA THR 54 HA THR 54 3.367 -4.940 -1.110
394 HB THR 54 HB THR 54 3.707 -7.331 -2.929
395 HG1 THR 54 HG1 THR 54 1.890 -7.915 -2.156
396 HG21 THR 54 HG21 THR 54 4.602 -6.767 -0.056
397 HG22 THR 54 HG22 THR 54 4.935 -8.237 -0.972
398 HG23 THR 54 HG23 THR 54 5.621 -6.702 -1.505
399 H VAL 55 H VAL 55 5.397 -4.215 -1.645
400 HA VAL 55 HA VAL 55 5.830 -3.410 -4.456
401 HB VAL 55 HB VAL 55 5.974 -1.902 -1.869
402 HG11 VAL 55 HG11 VAL 55 8.333 -1.694 -2.505
403 HG12 VAL 55 HG12 VAL 55 7.882 -1.274 -4.169
404 HG13 VAL 55 HG13 VAL 55 7.492 -0.185 -2.803
405 HG21 VAL 55 HG21 VAL 55 5.409 -1.127 -4.750
406 HG22 VAL 55 HG22 VAL 55 4.173 -1.614 -3.583
407 HG23 VAL 55 HG23 VAL 55 5.096 -0.120 -3.318
408 H THR 56 H THR 56 7.787 -3.746 -5.333
409 HA THR 56 HA THR 56 9.812 -5.115 -3.627
410 HB THR 56 HB THR 56 8.962 -5.532 -6.511
411 HG1 THR 56 HG1 THR 56 8.609 -7.527 -5.817
412 HG21 THR 56 HG21 THR 56 11.516 -6.474 -5.129
413 HG22 THR 56 HG22 THR 56 10.840 -7.203 -6.605
414 HG23 THR 56 HG23 THR 56 11.368 -5.524 -6.614
415 H GLU 57 H GLU 57 11.080 -3.522 -3.013
416 HA GLU 57 HA GLU 57 11.989 -1.428 -4.904
417 HB2 GLU 57 HB2 GLU 57 11.018 -0.904 -2.589
418 HB3 GLU 57 HB3 GLU 57 12.391 -1.788 -1.911
419 HG2 GLU 57 HG2 GLU 57 13.251 0.291 -1.759
420 HG3 GLU 57 HG3 GLU 57 13.843 -0.082 -3.370
Start of MODEL 9
1 H1 MET 1 H MET 1 -16.286 1.446 1.102
2 HA MET 1 HA MET 1 -16.970 -0.711 0.348
3 HB2 MET 1 HB2 MET 1 -15.627 0.693 -1.222
4 HB3 MET 1 HB3 MET 1 -14.188 -0.239 -0.762
5 HG2 MET 1 HG2 MET 1 -15.360 -2.324 -1.467
6 HG3 MET 1 HG3 MET 1 -16.766 -1.371 -1.944
7 HE1 MET 1 HE1 MET 1 -15.522 0.510 -5.123
8 HE2 MET 1 HE2 MET 1 -16.895 0.155 -4.048
9 HE3 MET 1 HE3 MET 1 -15.543 1.154 -3.468
10 H GLY 2 H GLY 2 -13.654 -0.864 1.916
11 HA2 GLY 2 HA2 GLY 2 -14.242 -3.142 3.370
12 HA3 GLY 2 HA3 GLY 2 -13.473 -3.652 1.851
13 H THR 3 H THR 3 -11.917 -4.212 3.840
14 HA THR 3 HA THR 3 -10.087 -1.950 4.350
15 HB THR 3 HB THR 3 -10.819 -3.298 6.286
16 HG1 THR 3 HG1 THR 3 -8.966 -2.691 6.946
17 HG21 THR 3 HG21 THR 3 -11.011 -5.531 5.181
18 HG22 THR 3 HG22 THR 3 -9.235 -5.592 5.054
19 HG23 THR 3 HG23 THR 3 -10.019 -5.549 6.648
20 H TYR 4 H TYR 4 -7.984 -2.029 3.551
21 HA TYR 4 HA TYR 4 -7.236 -4.188 1.671
22 HB2 TYR 4 HB2 TYR 4 -6.916 -1.230 1.198
23 HB3 TYR 4 HB3 TYR 4 -6.374 -2.499 0.120
24 HD1 TYR 4 HD1 TYR 4 -7.842 -3.157 -1.693
25 HD2 TYR 4 HD2 TYR 4 -9.460 -0.975 1.651
26 HE1 TYR 4 HE1 TYR 4 -10.002 -2.889 -2.887
27 HE2 TYR 4 HE2 TYR 4 -11.563 -0.638 0.410
28 HH TYR 4 HH TYR 4 -12.067 -1.811 -2.898
29 H LYS 5 H LYS 5 -4.998 -4.717 1.812
30 HA LYS 5 HA LYS 5 -3.654 -3.365 4.136
31 HB2 LYS 5 HB2 LYS 5 -4.226 -5.914 3.948
32 HB3 LYS 5 HB3 LYS 5 -2.758 -5.976 2.972
33 HG2 LYS 5 HG2 LYS 5 -1.392 -5.255 4.812
34 HG3 LYS 5 HG3 LYS 5 -2.817 -4.780 5.767
35 HD2 LYS 5 HD2 LYS 5 -3.592 -7.081 5.900
36 HD3 LYS 5 HD3 LYS 5 -2.266 -7.634 4.868
37 HE2 LYS 5 HE2 LYS 5 -1.628 -6.125 7.407
38 HE3 LYS 5 HE3 LYS 5 -2.187 -7.801 7.546
39 HZ1 LYS 5 HZ1 LYS 5 0.335 -7.347 7.296
40 HZ2 LYS 5 HZ2 LYS 5 -0.344 -8.597 6.453
41 HZ3 LYS 5 HZ3 LYS 5 0.003 -7.197 5.708
42 H LEU 6 H LEU 6 -1.713 -2.269 3.827
43 HA LEU 6 HA LEU 6 -0.507 -2.335 1.090
44 HB2 LEU 6 HB2 LEU 6 -1.992 -0.326 1.705
45 HB3 LEU 6 HB3 LEU 6 -0.660 0.210 2.723
46 HG LEU 6 HG LEU 6 -0.310 -0.491 -0.230
47 HD11 LEU 6 HD11 LEU 6 -2.062 1.196 -0.083
48 HD12 LEU 6 HD12 LEU 6 -1.042 2.198 0.982
49 HD13 LEU 6 HD13 LEU 6 -0.579 1.919 -0.711
50 HD21 LEU 6 HD21 LEU 6 1.279 1.359 1.610
51 HD22 LEU 6 HD22 LEU 6 1.773 -0.265 1.073
52 HD23 LEU 6 HD23 LEU 6 1.619 1.026 -0.099
53 H ILE 7 H ILE 7 1.329 -3.387 1.338
54 HA ILE 7 HA ILE 7 3.223 -2.826 3.545
55 HB ILE 7 HB ILE 7 2.307 -5.011 3.852
56 HG12 ILE 7 HG12 ILE 7 5.034 -5.483 2.579
57 HG13 ILE 7 HG13 ILE 7 4.821 -4.648 4.115
58 HG21 ILE 7 HG21 ILE 7 3.032 -5.594 0.957
59 HG22 ILE 7 HG22 ILE 7 2.518 -6.831 2.078
60 HG23 ILE 7 HG23 ILE 7 1.406 -5.527 1.633
61 HD11 ILE 7 HD11 ILE 7 4.071 -7.536 3.526
62 HD12 ILE 7 HD12 ILE 7 5.342 -6.936 4.596
63 HD13 ILE 7 HD13 ILE 7 3.644 -6.677 5.025
64 H LEU 8 H LEU 8 5.228 -2.343 3.161
65 HA LEU 8 HA LEU 8 6.192 -2.149 0.354
66 HB2 LEU 8 HB2 LEU 8 6.844 -0.356 2.730
67 HB3 LEU 8 HB3 LEU 8 7.487 -0.214 1.112
68 HG LEU 8 HG LEU 8 5.943 1.512 1.382
69 HD11 LEU 8 HD11 LEU 8 4.439 -0.596 -0.222
70 HD12 LEU 8 HD12 LEU 8 4.296 1.155 -0.388
71 HD13 LEU 8 HD13 LEU 8 5.814 0.355 -0.819
72 HD21 LEU 8 HD21 LEU 8 4.678 0.526 3.315
73 HD22 LEU 8 HD22 LEU 8 3.733 1.448 2.119
74 HD23 LEU 8 HD23 LEU 8 3.678 -0.319 2.142
75 H ASN 9 H ASN 9 8.280 -2.875 -0.014
76 HA ASN 9 HA ASN 9 9.858 -3.937 2.248
77 HB2 ASN 9 HB2 ASN 9 9.562 -5.186 -0.516
78 HB3 ASN 9 HB3 ASN 9 10.657 -5.684 0.743
79 HD21 ASN 9 HD21 ASN 9 6.728 -6.881 0.715
80 HD22 ASN 9 HD22 ASN 9 7.339 -5.606 -0.337
81 H GLY 10 H GLY 10 11.420 -2.361 2.322
82 HA2 GLY 10 HA2 GLY 10 12.353 -1.048 -0.162
83 HA3 GLY 10 HA3 GLY 10 12.570 -0.497 1.501
84 H LYS 11 H LYS 11 14.839 -0.452 0.320
85 HA LYS 11 HA LYS 11 16.344 -2.876 0.052
86 HB2 LYS 11 HB2 LYS 11 16.906 -0.504 -0.730
87 HB3 LYS 11 HB3 LYS 11 17.382 -0.134 0.926
88 HG2 LYS 11 HG2 LYS 11 19.042 -2.025 0.756
89 HG3 LYS 11 HG3 LYS 11 18.595 -2.182 -0.956
90 HD2 LYS 11 HD2 LYS 11 19.261 0.302 -1.194
91 HD3 LYS 11 HD3 LYS 11 19.938 0.165 0.446
92 HE2 LYS 11 HE2 LYS 11 21.193 -1.906 -0.438
93 HE3 LYS 11 HE3 LYS 11 20.714 -1.396 -2.052
94 HZ1 LYS 11 HZ1 LYS 11 22.941 -0.648 -1.351
95 HZ2 LYS 11 HZ2 LYS 11 21.986 0.639 -1.725
96 HZ3 LYS 11 HZ3 LYS 11 22.294 0.231 -0.155
97 H THR 12 H THR 12 16.029 -0.585 2.742
98 HA THR 12 HA THR 12 16.768 -2.699 4.699
99 HB THR 12 HB THR 12 18.484 -0.812 4.188
100 HG1 THR 12 HG1 THR 12 17.704 -1.856 6.626
101 HG21 THR 12 HG21 THR 12 16.738 1.039 4.446
102 HG22 THR 12 HG22 THR 12 16.796 0.728 6.189
103 HG23 THR 12 HG23 THR 12 18.246 1.252 5.319
104 H LEU 13 H LEU 13 14.492 -0.280 3.694
105 HA LEU 13 HA LEU 13 13.211 0.057 6.297
106 HB2 LEU 13 HB2 LEU 13 12.336 0.966 3.525
107 HB3 LEU 13 HB3 LEU 13 11.710 1.542 5.062
108 HG LEU 13 HG LEU 13 14.511 2.031 3.962
109 HD11 LEU 13 HD11 LEU 13 12.156 3.928 4.311
110 HD12 LEU 13 HD12 LEU 13 13.771 4.350 3.706
111 HD13 LEU 13 HD13 LEU 13 12.735 3.265 2.772
112 HD21 LEU 13 HD21 LEU 13 14.578 1.945 6.419
113 HD22 LEU 13 HD22 LEU 13 14.772 3.602 5.853
114 HD23 LEU 13 HD23 LEU 13 13.210 3.080 6.513
115 H LYS 14 H LYS 14 11.164 -0.738 6.813
116 HA LYS 14 HA LYS 14 9.683 -2.326 4.840
117 HB2 LYS 14 HB2 LYS 14 10.881 -3.536 7.375
118 HB3 LYS 14 HB3 LYS 14 9.361 -4.141 6.687
119 HG2 LYS 14 HG2 LYS 14 10.506 -4.402 4.471
120 HG3 LYS 14 HG3 LYS 14 12.049 -4.000 5.252
121 HD2 LYS 14 HD2 LYS 14 11.977 -5.971 6.612
122 HD3 LYS 14 HD3 LYS 14 10.298 -6.307 6.161
123 HE2 LYS 14 HE2 LYS 14 10.945 -6.633 3.817
124 HE3 LYS 14 HE3 LYS 14 12.605 -6.133 4.170
125 HZ1 LYS 14 HZ1 LYS 14 12.398 -8.497 4.023
126 HZ2 LYS 14 HZ2 LYS 14 12.842 -8.071 5.558
127 HZ3 LYS 14 HZ3 LYS 14 11.295 -8.546 5.252
128 H GLY 15 H GLY 15 7.423 -2.324 5.268
129 HA2 GLY 15 HA2 GLY 15 6.420 -1.437 7.825
130 HA3 GLY 15 HA3 GLY 15 6.399 -0.155 6.598
131 H GLU 16 H GLU 16 4.078 -1.521 7.879
132 HA GLU 16 HA GLU 16 2.676 -2.126 5.413
133 HB2 GLU 16 HB2 GLU 16 1.758 -4.242 6.172
134 HB3 GLU 16 HB3 GLU 16 3.508 -4.330 5.995
135 HG2 GLU 16 HG2 GLU 16 3.769 -4.113 8.467
136 HG3 GLU 16 HG3 GLU 16 2.004 -4.087 8.628
137 H THR 17 H THR 17 0.470 -1.773 5.551
138 HA THR 17 HA THR 17 -0.682 -1.043 8.177
139 HB THR 17 HB THR 17 0.471 1.026 7.337
140 HG1 THR 17 HG1 THR 17 -1.024 2.035 8.299
141 HG21 THR 17 HG21 THR 17 0.120 0.644 4.899
142 HG22 THR 17 HG22 THR 17 -1.612 0.943 5.097
143 HG23 THR 17 HG23 THR 17 -0.441 2.236 5.420
144 H THR 18 H THR 18 -3.108 -0.193 7.548
145 HA THR 18 HA THR 18 -4.142 -1.599 5.268
146 HB THR 18 HB THR 18 -3.868 -3.185 7.349
147 HG1 THR 18 HG1 THR 18 -5.961 -3.067 5.538
148 HG21 THR 18 HG21 THR 18 -6.529 -1.945 8.077
149 HG22 THR 18 HG22 THR 18 -5.790 -3.382 8.799
150 HG23 THR 18 HG23 THR 18 -5.019 -1.796 9.008
151 H THR 19 H THR 19 -6.330 -0.758 4.728
152 HA THR 19 HA THR 19 -7.187 1.593 6.341
153 HB THR 19 HB THR 19 -6.854 1.691 3.336
154 HG1 THR 19 HG1 THR 19 -4.974 2.437 5.325
155 HG21 THR 19 HG21 THR 19 -7.170 3.875 5.431
156 HG22 THR 19 HG22 THR 19 -6.938 4.128 3.684
157 HG23 THR 19 HG23 THR 19 -8.407 3.341 4.275
158 H GLU 20 H GLU 20 -9.321 1.452 6.735
159 HA GLU 20 HA GLU 20 -11.105 0.183 4.703
160 HB2 GLU 20 HB2 GLU 20 -11.211 -1.130 6.723
161 HB3 GLU 20 HB3 GLU 20 -11.479 0.317 7.723
162 HG2 GLU 20 HG2 GLU 20 -13.634 0.718 6.662
163 HG3 GLU 20 HG3 GLU 20 -13.306 -0.478 5.409
164 H ALA 21 H ALA 21 -12.004 1.766 3.558
165 HA ALA 21 HA ALA 21 -12.731 4.323 4.895
166 HB1 ALA 21 HB1 ALA 21 -12.121 5.440 2.791
167 HB2 ALA 21 HB2 ALA 21 -10.718 4.602 3.480
168 HB3 ALA 21 HB3 ALA 21 -11.575 3.901 2.093
169 H VAL 22 H VAL 22 -14.241 5.537 3.184
170 HA VAL 22 HA VAL 22 -16.669 4.022 3.097
171 HB VAL 22 HB VAL 22 -17.538 6.052 1.936
172 HG11 VAL 22 HG11 VAL 22 -15.961 6.670 4.447
173 HG12 VAL 22 HG12 VAL 22 -17.469 7.426 3.860
174 HG13 VAL 22 HG13 VAL 22 -17.473 5.749 4.397
175 HG21 VAL 22 HG21 VAL 22 -15.547 6.935 0.752
176 HG22 VAL 22 HG22 VAL 22 -16.120 8.121 1.912
177 HG23 VAL 22 HG23 VAL 22 -14.690 7.170 2.295
178 H ASP 23 H ASP 23 -14.367 5.093 0.554
179 HA ASP 23 HA ASP 23 -15.220 2.890 -1.191
180 HB2 ASP 23 HB2 ASP 23 -16.677 4.588 -1.935
181 HB3 ASP 23 HB3 ASP 23 -15.482 5.855 -1.751
182 H ALA 24 H ALA 24 -13.577 2.750 -3.051
183 HA ALA 24 HA ALA 24 -10.949 2.625 -1.938
184 HB1 ALA 24 HB1 ALA 24 -10.294 1.925 -4.206
185 HB2 ALA 24 HB2 ALA 24 -11.706 1.046 -3.597
186 HB3 ALA 24 HB3 ALA 24 -11.913 2.350 -4.810
187 H ALA 25 H ALA 25 -12.560 5.228 -3.836
188 HA ALA 25 HA ALA 25 -10.186 6.491 -4.708
189 HB1 ALA 25 HB1 ALA 25 -11.540 8.533 -4.906
190 HB2 ALA 25 HB2 ALA 25 -12.375 7.115 -5.564
191 HB3 ALA 25 HB3 ALA 25 -12.850 7.766 -3.987
192 H THR 26 H THR 26 -11.657 6.469 -1.475
193 HA THR 26 HA THR 26 -10.101 8.687 -0.440
194 HB THR 26 HB THR 26 -11.656 6.404 0.814
195 HG1 THR 26 HG1 THR 26 -12.891 8.005 -0.129
196 HG21 THR 26 HG21 THR 26 -9.968 6.925 2.474
197 HG22 THR 26 HG22 THR 26 -10.175 8.667 2.228
198 HG23 THR 26 HG23 THR 26 -11.473 7.699 2.967
199 H ALA 27 H ALA 27 -9.617 5.178 -0.778
200 HA ALA 27 HA ALA 27 -7.253 5.080 0.863
201 HB1 ALA 27 HB1 ALA 27 -8.789 3.163 0.470
202 HB2 ALA 27 HB2 ALA 27 -8.247 3.106 -1.229
203 HB3 ALA 27 HB3 ALA 27 -7.095 2.805 0.080
204 H GLU 28 H GLU 28 -7.948 5.671 -2.578
205 HA GLU 28 HA GLU 28 -5.378 5.352 -3.653
206 HB2 GLU 28 HB2 GLU 28 -7.536 5.644 -4.904
207 HB3 GLU 28 HB3 GLU 28 -7.491 7.370 -4.514
208 HG2 GLU 28 HG2 GLU 28 -5.334 7.584 -5.716
209 HG3 GLU 28 HG3 GLU 28 -5.358 5.856 -6.076
210 H LYS 29 H LYS 29 -6.726 8.035 -1.811
211 HA LYS 29 HA LYS 29 -4.764 10.035 -2.384
212 HB2 LYS 29 HB2 LYS 29 -6.391 9.652 0.165
213 HB3 LYS 29 HB3 LYS 29 -5.607 11.143 -0.335
214 HG2 LYS 29 HG2 LYS 29 -7.148 11.380 -2.219
215 HG3 LYS 29 HG3 LYS 29 -7.801 9.768 -1.929
216 HD2 LYS 29 HD2 LYS 29 -8.596 10.585 0.344
217 HD3 LYS 29 HD3 LYS 29 -8.191 12.231 -0.208
218 HE2 LYS 29 HE2 LYS 29 -9.693 11.902 -2.188
219 HE3 LYS 29 HE3 LYS 29 -10.033 10.265 -1.668
220 HZ1 LYS 29 HZ1 LYS 29 -11.012 11.321 0.419
221 HZ2 LYS 29 HZ2 LYS 29 -10.920 12.762 -0.388
222 HZ3 LYS 29 HZ3 LYS 29 -11.834 11.551 -0.956
223 H VAL 30 H VAL 30 -5.054 7.774 0.380
224 HA VAL 30 HA VAL 30 -2.497 8.432 1.461
225 HB VAL 30 HB VAL 30 -4.335 7.702 2.873
226 HG11 VAL 30 HG11 VAL 30 -4.772 5.257 3.170
227 HG12 VAL 30 HG12 VAL 30 -5.366 5.902 1.637
228 HG13 VAL 30 HG13 VAL 30 -3.859 4.946 1.695
229 HG21 VAL 30 HG21 VAL 30 -3.048 6.427 4.426
230 HG22 VAL 30 HG22 VAL 30 -1.947 5.857 3.155
231 HG23 VAL 30 HG23 VAL 30 -1.969 7.576 3.618
232 H PHE 31 H PHE 31 -3.555 6.040 -0.927
233 HA PHE 31 HA PHE 31 -1.495 4.177 -0.876
234 HB2 PHE 31 HB2 PHE 31 -3.492 4.147 -2.388
235 HB3 PHE 31 HB3 PHE 31 -2.827 5.484 -3.278
236 HD1 PHE 31 HD1 PHE 31 -0.580 5.175 -4.576
237 HD2 PHE 31 HD2 PHE 31 -3.014 1.928 -3.065
238 HE1 PHE 31 HE1 PHE 31 0.434 3.644 -6.210
239 HE2 PHE 31 HE2 PHE 31 -2.044 0.435 -4.774
240 HZ PHE 31 HZ PHE 31 -0.311 1.284 -6.344
241 H LYS 32 H LYS 32 -1.538 7.425 -2.504
242 HA LYS 32 HA LYS 32 1.211 7.085 -3.422
243 HB2 LYS 32 HB2 LYS 32 -0.385 8.406 -4.677
244 HB3 LYS 32 HB3 LYS 32 -0.662 9.483 -3.301
245 HG2 LYS 32 HG2 LYS 32 1.684 10.288 -3.430
246 HG3 LYS 32 HG3 LYS 32 1.994 9.160 -4.775
247 HD2 LYS 32 HD2 LYS 32 0.229 10.265 -6.092
248 HD3 LYS 32 HD3 LYS 32 -0.089 11.384 -4.749
249 HE2 LYS 32 HE2 LYS 32 2.031 12.452 -5.012
250 HE3 LYS 32 HE3 LYS 32 2.643 11.135 -6.040
251 HZ1 LYS 32 HZ1 LYS 32 0.427 12.925 -6.772
252 HZ2 LYS 32 HZ2 LYS 32 1.980 13.076 -7.319
253 HZ3 LYS 32 HZ3 LYS 32 1.090 11.750 -7.728
254 H GLN 33 H GLN 33 -0.315 9.182 -0.880
255 HA GLN 33 HA GLN 33 2.119 10.326 -0.084
256 HB2 GLN 33 HB2 GLN 33 0.044 11.328 0.474
257 HB3 GLN 33 HB3 GLN 33 -0.505 9.938 1.400
258 HG2 GLN 33 HG2 GLN 33 1.952 11.542 2.226
259 HG3 GLN 33 HG3 GLN 33 0.333 12.060 2.663
260 HE21 GLN 33 HE21 GLN 33 -0.198 9.157 4.892
261 HE22 GLN 33 HE22 GLN 33 -1.064 10.082 3.692
262 H TYR 34 H TYR 34 0.505 7.549 1.734
263 HA TYR 34 HA TYR 34 2.636 7.517 3.590
264 HB2 TYR 34 HB2 TYR 34 0.759 6.465 4.366
265 HB3 TYR 34 HB3 TYR 34 0.481 5.566 2.891
266 HD1 TYR 34 HD1 TYR 34 0.868 3.272 2.973
267 HD2 TYR 34 HD2 TYR 34 3.244 5.875 5.464
268 HE1 TYR 34 HE1 TYR 34 2.020 1.303 3.929
269 HE2 TYR 34 HE2 TYR 34 4.409 3.934 6.416
270 HH TYR 34 HH TYR 34 3.437 0.573 5.681
271 H ALA 35 H ALA 35 2.239 5.442 0.695
272 HA ALA 35 HA ALA 35 4.634 4.024 1.068
273 HB1 ALA 35 HB1 ALA 35 3.269 4.724 -1.562
274 HB2 ALA 35 HB2 ALA 35 4.352 3.355 -1.233
275 HB3 ALA 35 HB3 ALA 35 2.779 3.412 -0.452
276 H ASN 36 H ASN 36 4.098 7.061 -0.910
277 HA ASN 36 HA ASN 36 6.811 7.336 -1.638
278 HB2 ASN 36 HB2 ASN 36 4.996 8.620 -2.694
279 HB3 ASN 36 HB3 ASN 36 4.748 9.520 -1.182
280 HD21 ASN 36 HD21 ASN 36 8.318 10.035 -3.181
281 HD22 ASN 36 HD22 ASN 36 7.251 8.766 -3.693
282 H ASP 37 H ASP 37 5.168 8.336 1.345
283 HA ASP 37 HA ASP 37 7.294 9.934 2.420
284 HB2 ASP 37 HB2 ASP 37 4.864 10.095 2.965
285 HB3 ASP 37 HB3 ASP 37 4.948 8.519 3.773
286 H ASN 38 H ASN 38 6.545 6.541 2.358
287 HA ASN 38 HA ASN 38 8.423 5.693 4.415
288 HB2 ASN 38 HB2 ASN 38 6.178 4.686 3.919
289 HB3 ASN 38 HB3 ASN 38 6.836 4.081 2.396
290 HD21 ASN 38 HD21 ASN 38 6.944 1.157 4.472
291 HD22 ASN 38 HD22 ASN 38 5.810 2.193 3.637
292 H GLY 39 H GLY 39 9.182 7.118 1.686
293 HA2 GLY 39 HA2 GLY 39 10.950 7.150 0.245
294 HA3 GLY 39 HA3 GLY 39 11.780 6.104 1.414
295 H VAL 40 H VAL 40 8.891 5.230 -0.543
296 HA VAL 40 HA VAL 40 10.190 2.801 -1.457
297 HB VAL 40 HB VAL 40 8.023 2.385 -2.518
298 HG11 VAL 40 HG11 VAL 40 8.153 1.751 -0.244
299 HG12 VAL 40 HG12 VAL 40 7.876 3.392 0.346
300 HG13 VAL 40 HG13 VAL 40 6.581 2.537 -0.489
301 HG21 VAL 40 HG21 VAL 40 7.523 5.320 -1.964
302 HG22 VAL 40 HG22 VAL 40 7.260 4.390 -3.435
303 HG23 VAL 40 HG23 VAL 40 6.176 4.196 -2.075
304 H ASP 41 H ASP 41 10.784 2.207 -3.490
305 HA ASP 41 HA ASP 41 10.373 3.994 -5.776
306 HB2 ASP 41 HB2 ASP 41 12.634 4.524 -4.662
307 HB3 ASP 41 HB3 ASP 41 13.171 2.947 -5.205
308 H GLY 42 H GLY 42 8.873 2.304 -6.698
309 HA2 GLY 42 HA2 GLY 42 10.123 0.066 -7.814
310 HA3 GLY 42 HA3 GLY 42 9.500 -0.476 -6.251
311 H GLU 43 H GLU 43 8.547 -1.856 -7.950
312 HA GLU 43 HA GLU 43 6.139 -0.980 -9.332
313 HB2 GLU 43 HB2 GLU 43 6.131 -3.206 -10.304
314 HB3 GLU 43 HB3 GLU 43 7.653 -2.385 -10.591
315 HG2 GLU 43 HG2 GLU 43 8.889 -3.890 -9.372
316 HG3 GLU 43 HG3 GLU 43 7.616 -4.184 -8.193
317 H TRP 44 H TRP 44 4.092 -1.962 -8.998
318 HA TRP 44 HA TRP 44 3.667 -2.967 -6.224
319 HB2 TRP 44 HB2 TRP 44 1.917 -1.388 -8.139
320 HB3 TRP 44 HB3 TRP 44 1.376 -2.038 -6.602
321 HD1 TRP 44 HD1 TRP 44 4.463 0.184 -7.597
322 HE1 TRP 44 HE1 TRP 44 4.914 1.730 -5.714
323 HE3 TRP 44 HE3 TRP 44 0.620 -1.118 -4.485
324 HZ2 TRP 44 HZ2 TRP 44 3.154 3.060 -3.596
325 HZ3 TRP 44 HZ3 TRP 44 0.080 0.279 -2.515
326 HH2 TRP 44 HH2 TRP 44 1.296 2.417 -2.123
327 H THR 45 H THR 45 2.395 -4.763 -5.840
328 HA THR 45 HA THR 45 1.107 -6.216 -8.074
329 HB THR 45 HB THR 45 1.828 -8.320 -6.817
330 HG1 THR 45 HG1 THR 45 3.971 -6.700 -5.941
331 HG21 THR 45 HG21 THR 45 2.766 -7.720 -9.017
332 HG22 THR 45 HG22 THR 45 4.026 -6.755 -8.222
333 HG23 THR 45 HG23 THR 45 3.967 -8.506 -7.982
334 H TYR 46 H TYR 46 -0.692 -7.690 -7.120
335 HA TYR 46 HA TYR 46 -1.665 -6.646 -4.521
336 HB2 TYR 46 HB2 TYR 46 -2.600 -5.220 -6.268
337 HB3 TYR 46 HB3 TYR 46 -3.128 -6.645 -7.163
338 HD1 TYR 46 HD1 TYR 46 -3.491 -5.236 -3.670
339 HD2 TYR 46 HD2 TYR 46 -5.402 -7.160 -7.035
340 HE1 TYR 46 HE1 TYR 46 -5.673 -5.172 -2.487
341 HE2 TYR 46 HE2 TYR 46 -7.590 -6.982 -5.896
342 HH TYR 46 HH TYR 46 -8.631 -6.512 -3.811
343 H ASP 47 H ASP 47 -2.996 -7.950 -3.376
344 HA ASP 47 HA ASP 47 -3.679 -10.662 -4.384
345 HB2 ASP 47 HB2 ASP 47 -2.152 -9.855 -1.929
346 HB3 ASP 47 HB3 ASP 47 -3.390 -11.093 -1.720
347 H ASP 48 H ASP 48 -5.878 -10.193 -4.771
348 HA ASP 48 HA ASP 48 -7.433 -8.502 -3.102
349 HB2 ASP 48 HB2 ASP 48 -7.906 -9.243 -5.507
350 HB3 ASP 48 HB3 ASP 48 -8.580 -10.717 -4.814
351 H ALA 49 H ALA 49 -6.471 -11.803 -2.575
352 HA ALA 49 HA ALA 49 -8.583 -12.812 -1.056
353 HB1 ALA 49 HB1 ALA 49 -5.588 -13.258 -0.687
354 HB2 ALA 49 HB2 ALA 49 -6.877 -14.287 -0.034
355 HB3 ALA 49 HB3 ALA 49 -6.664 -14.158 -1.782
356 H THR 50 H THR 50 -6.020 -10.604 -0.084
357 HA THR 50 HA THR 50 -7.380 -10.093 2.502
358 HB THR 50 HB THR 50 -5.736 -11.430 3.271
359 HG1 THR 50 HG1 THR 50 -5.518 -9.317 4.218
360 HG21 THR 50 HG21 THR 50 -3.855 -10.439 1.124
361 HG22 THR 50 HG22 THR 50 -3.306 -11.366 2.546
362 HG23 THR 50 HG23 THR 50 -4.458 -12.078 1.428
363 H LYS 51 H LYS 51 -6.427 -8.772 -0.496
364 HA LYS 51 HA LYS 51 -6.537 -7.022 -1.461
365 HB2 LYS 51 HB2 LYS 51 -7.873 -5.948 1.023
366 HB3 LYS 51 HB3 LYS 51 -7.722 -5.080 -0.526
367 HG2 LYS 51 HG2 LYS 51 -8.821 -7.244 -1.530
368 HG3 LYS 51 HG3 LYS 51 -9.250 -7.617 0.140
369 HD2 LYS 51 HD2 LYS 51 -10.506 -5.481 0.297
370 HD3 LYS 51 HD3 LYS 51 -10.028 -5.093 -1.379
371 HE2 LYS 51 HE2 LYS 51 -11.106 -7.150 -2.188
372 HE3 LYS 51 HE3 LYS 51 -11.579 -7.569 -0.536
373 HZ1 LYS 51 HZ1 LYS 51 -12.936 -5.550 -0.511
374 HZ2 LYS 51 HZ2 LYS 51 -12.551 -5.236 -2.093
375 HZ3 LYS 51 HZ3 LYS 51 -13.390 -6.573 -1.696
376 H THR 52 H THR 52 -4.303 -8.039 -0.258
377 HA THR 52 HA THR 52 -2.721 -5.919 0.829
378 HB THR 52 HB THR 52 -2.025 -8.769 0.080
379 HG1 THR 52 HG1 THR 52 -2.372 -9.044 2.338
380 HG21 THR 52 HG21 THR 52 -0.630 -6.759 1.901
381 HG22 THR 52 HG22 THR 52 -0.187 -8.475 1.713
382 HG23 THR 52 HG23 THR 52 -0.000 -7.364 0.356
383 H PHE 53 H PHE 53 -1.772 -4.458 -0.325
384 HA PHE 53 HA PHE 53 -0.943 -4.858 -3.142
385 HB2 PHE 53 HB2 PHE 53 -1.169 -2.456 -1.266
386 HB3 PHE 53 HB3 PHE 53 -0.347 -2.378 -2.810
387 HD1 PHE 53 HD1 PHE 53 -1.584 -2.609 -4.952
388 HD2 PHE 53 HD2 PHE 53 -3.617 -2.464 -1.142
389 HE1 PHE 53 HE1 PHE 53 -3.686 -1.973 -6.093
390 HE2 PHE 53 HE2 PHE 53 -5.714 -1.815 -2.301
391 HZ PHE 53 HZ PHE 53 -5.747 -1.551 -4.769
392 H THR 54 H THR 54 1.257 -5.413 -3.409
393 HA THR 54 HA THR 54 3.080 -4.878 -1.110
394 HB THR 54 HB THR 54 3.105 -7.272 -2.957
395 HG1 THR 54 HG1 THR 54 2.235 -8.352 -1.207
396 HG21 THR 54 HG21 THR 54 4.560 -6.826 -0.310
397 HG22 THR 54 HG22 THR 54 4.699 -8.224 -1.411
398 HG23 THR 54 HG23 THR 54 5.329 -6.657 -1.896
399 H VAL 55 H VAL 55 5.097 -4.145 -1.539
400 HA VAL 55 HA VAL 55 5.889 -3.501 -4.309
401 HB VAL 55 HB VAL 55 5.633 -1.699 -1.900
402 HG11 VAL 55 HG11 VAL 55 7.433 -1.146 -4.305
403 HG12 VAL 55 HG12 VAL 55 6.971 0.041 -3.067
404 HG13 VAL 55 HG13 VAL 55 7.957 -1.328 -2.614
405 HG21 VAL 55 HG21 VAL 55 5.036 -1.220 -4.839
406 HG22 VAL 55 HG22 VAL 55 3.831 -1.862 -3.697
407 HG23 VAL 55 HG23 VAL 55 4.486 -0.258 -3.434
408 H THR 56 H THR 56 8.042 -3.796 -4.706
409 HA THR 56 HA THR 56 9.811 -4.500 -2.456
410 HB THR 56 HB THR 56 9.585 -5.945 -5.128
411 HG1 THR 56 HG1 THR 56 9.126 -7.723 -3.644
412 HG21 THR 56 HG21 THR 56 11.939 -5.797 -4.287
413 HG22 THR 56 HG22 THR 56 11.405 -6.469 -2.729
414 HG23 THR 56 HG23 THR 56 11.321 -7.441 -4.218
415 H GLU 57 H GLU 57 11.631 -3.365 -2.485
416 HA GLU 57 HA GLU 57 12.175 -1.448 -4.712
417 HB2 GLU 57 HB2 GLU 57 12.224 -0.731 -2.248
418 HB3 GLU 57 HB3 GLU 57 13.610 -1.802 -2.026
419 HG2 GLU 57 HG2 GLU 57 14.744 -0.470 -3.908
420 HG3 GLU 57 HG3 GLU 57 13.409 0.676 -3.787
Start of MODEL 10
1 H1 MET 1 H MET 1 -15.943 1.614 1.853
2 HA MET 1 HA MET 1 -16.667 -0.333 0.739
3 HB2 MET 1 HB2 MET 1 -15.316 1.267 -0.638
4 HB3 MET 1 HB3 MET 1 -13.904 0.225 -0.389
5 HG2 MET 1 HG2 MET 1 -15.190 -1.670 -1.402
6 HG3 MET 1 HG3 MET 1 -16.532 -0.559 -1.703
7 HE1 MET 1 HE1 MET 1 -15.245 1.693 -4.547
8 HE2 MET 1 HE2 MET 1 -16.683 1.026 -3.728
9 HE3 MET 1 HE3 MET 1 -15.503 1.989 -2.813
10 H GLY 2 H GLY 2 -13.391 -0.888 2.279
11 HA2 GLY 2 HA2 GLY 2 -14.026 -3.475 3.032
12 HA3 GLY 2 HA3 GLY 2 -13.101 -3.549 1.514
13 H THR 3 H THR 3 -11.697 -4.640 3.265
14 HA THR 3 HA THR 3 -9.923 -2.700 4.633
15 HB THR 3 HB THR 3 -10.696 -4.120 6.258
16 HG1 THR 3 HG1 THR 3 -8.864 -4.716 6.892
17 HG21 THR 3 HG21 THR 3 -11.954 -5.790 4.978
18 HG22 THR 3 HG22 THR 3 -10.435 -6.556 4.450
19 HG23 THR 3 HG23 THR 3 -10.907 -6.562 6.162
20 H TYR 4 H TYR 4 -8.178 -2.189 3.502
21 HA TYR 4 HA TYR 4 -7.068 -4.026 1.454
22 HB2 TYR 4 HB2 TYR 4 -6.899 -1.012 1.595
23 HB3 TYR 4 HB3 TYR 4 -6.276 -2.042 0.311
24 HD1 TYR 4 HD1 TYR 4 -7.720 -2.678 -1.539
25 HD2 TYR 4 HD2 TYR 4 -9.405 -0.809 1.960
26 HE1 TYR 4 HE1 TYR 4 -9.917 -2.515 -2.674
27 HE2 TYR 4 HE2 TYR 4 -11.586 -0.679 0.847
28 HH TYR 4 HH TYR 4 -12.112 -1.632 -2.535
29 H LYS 5 H LYS 5 -4.922 -4.690 1.674
30 HA LYS 5 HA LYS 5 -3.582 -3.505 4.099
31 HB2 LYS 5 HB2 LYS 5 -3.603 -6.232 2.885
32 HB3 LYS 5 HB3 LYS 5 -2.081 -5.664 3.600
33 HG2 LYS 5 HG2 LYS 5 -3.404 -4.993 5.659
34 HG3 LYS 5 HG3 LYS 5 -4.814 -5.805 4.976
35 HD2 LYS 5 HD2 LYS 5 -3.946 -7.905 5.378
36 HD3 LYS 5 HD3 LYS 5 -2.270 -7.386 5.089
37 HE2 LYS 5 HE2 LYS 5 -2.277 -6.147 7.225
38 HE3 LYS 5 HE3 LYS 5 -3.912 -6.755 7.573
39 HZ1 LYS 5 HZ1 LYS 5 -2.031 -8.004 8.574
40 HZ2 LYS 5 HZ2 LYS 5 -3.050 -8.944 7.673
41 HZ3 LYS 5 HZ3 LYS 5 -1.578 -8.499 7.078
42 H LEU 6 H LEU 6 -1.718 -2.442 4.032
43 HA LEU 6 HA LEU 6 -0.435 -2.136 1.353
44 HB2 LEU 6 HB2 LEU 6 -1.844 -0.186 2.788
45 HB3 LEU 6 HB3 LEU 6 -0.170 0.189 3.177
46 HG LEU 6 HG LEU 6 -1.260 -0.257 0.390
47 HD11 LEU 6 HD11 LEU 6 -2.290 1.731 1.304
48 HD12 LEU 6 HD12 LEU 6 -0.737 2.354 1.872
49 HD13 LEU 6 HD13 LEU 6 -1.061 2.208 0.130
50 HD21 LEU 6 HD21 LEU 6 1.424 0.855 1.308
51 HD22 LEU 6 HD22 LEU 6 1.153 -0.675 0.466
52 HD23 LEU 6 HD23 LEU 6 0.851 0.840 -0.371
53 H ILE 7 H ILE 7 1.414 -3.245 1.450
54 HA ILE 7 HA ILE 7 3.290 -2.767 3.664
55 HB ILE 7 HB ILE 7 2.462 -4.956 4.012
56 HG12 ILE 7 HG12 ILE 7 5.085 -5.352 2.503
57 HG13 ILE 7 HG13 ILE 7 4.950 -4.680 4.127
58 HG21 ILE 7 HG21 ILE 7 2.908 -5.568 1.071
59 HG22 ILE 7 HG22 ILE 7 2.377 -6.734 2.289
60 HG23 ILE 7 HG23 ILE 7 1.339 -5.381 1.873
61 HD11 ILE 7 HD11 ILE 7 4.266 -7.507 3.253
62 HD12 ILE 7 HD12 ILE 7 5.511 -6.970 4.381
63 HD13 ILE 7 HD13 ILE 7 3.806 -6.843 4.840
64 H LEU 8 H LEU 8 5.327 -2.204 3.199
65 HA LEU 8 HA LEU 8 6.126 -2.119 0.319
66 HB2 LEU 8 HB2 LEU 8 6.780 -0.104 2.510
67 HB3 LEU 8 HB3 LEU 8 7.425 -0.112 0.893
68 HG LEU 8 HG LEU 8 5.794 1.585 0.975
69 HD11 LEU 8 HD11 LEU 8 4.430 -0.749 -0.440
70 HD12 LEU 8 HD12 LEU 8 4.083 0.956 -0.700
71 HD13 LEU 8 HD13 LEU 8 5.655 0.310 -1.149
72 HD21 LEU 8 HD21 LEU 8 4.586 0.684 2.997
73 HD22 LEU 8 HD22 LEU 8 3.632 1.533 1.766
74 HD23 LEU 8 HD23 LEU 8 3.576 -0.239 1.863
75 H ASN 9 H ASN 9 8.221 -2.933 -0.137
76 HA ASN 9 HA ASN 9 9.787 -3.812 2.248
77 HB2 ASN 9 HB2 ASN 9 9.471 -5.401 -0.311
78 HB3 ASN 9 HB3 ASN 9 10.493 -5.792 1.063
79 HD21 ASN 9 HD21 ASN 9 6.667 -6.960 1.107
80 HD22 ASN 9 HD22 ASN 9 7.365 -6.090 -0.254
81 H GLY 10 H GLY 10 11.191 -1.997 2.164
82 HA2 GLY 10 HA2 GLY 10 12.801 -1.648 -0.274
83 HA3 GLY 10 HA3 GLY 10 12.615 -0.516 1.064
84 H LYS 11 H LYS 11 15.111 -0.903 0.322
85 HA LYS 11 HA LYS 11 16.631 -3.077 1.274
86 HB2 LYS 11 HB2 LYS 11 17.609 -1.370 -0.098
87 HB3 LYS 11 HB3 LYS 11 17.214 -0.090 1.046
88 HG2 LYS 11 HG2 LYS 11 18.937 -0.959 2.612
89 HG3 LYS 11 HG3 LYS 11 19.294 -2.270 1.467
90 HD2 LYS 11 HD2 LYS 11 19.755 -0.469 -0.262
91 HD3 LYS 11 HD3 LYS 11 19.638 0.727 1.030
92 HE2 LYS 11 HE2 LYS 11 21.546 -0.303 2.207
93 HE3 LYS 11 HE3 LYS 11 21.560 -1.635 1.038
94 HZ1 LYS 11 HZ1 LYS 11 23.226 -0.210 0.318
95 HZ2 LYS 11 HZ2 LYS 11 22.005 0.067 -0.692
96 HZ3 LYS 11 HZ3 LYS 11 22.322 1.163 0.519
97 H THR 12 H THR 12 15.738 -0.115 2.992
98 HA THR 12 HA THR 12 16.246 -1.464 5.594
99 HB THR 12 HB THR 12 18.077 0.141 4.960
100 HG1 THR 12 HG1 THR 12 17.692 1.356 7.082
101 HG21 THR 12 HG21 THR 12 16.724 1.916 3.868
102 HG22 THR 12 HG22 THR 12 16.004 2.315 5.452
103 HG23 THR 12 HG23 THR 12 17.736 2.531 5.179
104 H LEU 13 H LEU 13 14.261 0.698 3.641
105 HA LEU 13 HA LEU 13 12.464 1.419 5.777
106 HB2 LEU 13 HB2 LEU 13 12.225 1.822 2.771
107 HB3 LEU 13 HB3 LEU 13 11.377 2.696 4.040
108 HG LEU 13 HG LEU 13 14.399 2.784 3.597
109 HD11 LEU 13 HD11 LEU 13 12.453 4.955 2.849
110 HD12 LEU 13 HD12 LEU 13 14.192 4.884 2.545
111 HD13 LEU 13 HD13 LEU 13 13.104 3.771 1.699
112 HD21 LEU 13 HD21 LEU 13 13.753 3.335 5.929
113 HD22 LEU 13 HD22 LEU 13 14.347 4.766 5.068
114 HD23 LEU 13 HD23 LEU 13 12.607 4.540 5.314
115 H LYS 14 H LYS 14 10.885 0.029 6.498
116 HA LYS 14 HA LYS 14 9.288 -1.422 4.485
117 HB2 LYS 14 HB2 LYS 14 10.540 -2.835 6.896
118 HB3 LYS 14 HB3 LYS 14 9.281 -3.482 5.848
119 HG2 LYS 14 HG2 LYS 14 10.947 -3.141 3.903
120 HG3 LYS 14 HG3 LYS 14 12.181 -2.922 5.156
121 HD2 LYS 14 HD2 LYS 14 11.545 -5.150 6.107
122 HD3 LYS 14 HD3 LYS 14 10.349 -5.346 4.813
123 HE2 LYS 14 HE2 LYS 14 12.073 -5.298 3.109
124 HE3 LYS 14 HE3 LYS 14 13.322 -4.898 4.293
125 HZ1 LYS 14 HZ1 LYS 14 13.193 -7.262 3.632
126 HZ2 LYS 14 HZ2 LYS 14 13.114 -7.044 5.259
127 HZ3 LYS 14 HZ3 LYS 14 11.749 -7.390 4.438
128 H GLY 15 H GLY 15 7.186 -2.082 5.366
129 HA2 GLY 15 HA2 GLY 15 6.316 -1.512 7.983
130 HA3 GLY 15 HA3 GLY 15 5.929 -0.122 6.935
131 H GLU 16 H GLU 16 4.030 -2.095 8.149
132 HA GLU 16 HA GLU 16 2.627 -2.887 5.698
133 HB2 GLU 16 HB2 GLU 16 2.162 -5.101 6.499
134 HB3 GLU 16 HB3 GLU 16 3.877 -4.864 6.241
135 HG2 GLU 16 HG2 GLU 16 4.298 -4.761 8.645
136 HG3 GLU 16 HG3 GLU 16 2.557 -4.847 8.979
137 H THR 17 H THR 17 0.538 -2.257 5.843
138 HA THR 17 HA THR 17 -0.672 -1.957 8.565
139 HB THR 17 HB THR 17 0.505 0.140 7.957
140 HG1 THR 17 HG1 THR 17 -1.012 1.409 8.695
141 HG21 THR 17 HG21 THR 17 0.217 0.070 5.520
142 HG22 THR 17 HG22 THR 17 -1.530 0.317 5.682
143 HG23 THR 17 HG23 THR 17 -0.358 1.567 6.163
144 H THR 18 H THR 18 -3.036 -1.007 8.165
145 HA THR 18 HA THR 18 -4.370 -2.448 5.957
146 HB THR 18 HB THR 18 -4.441 -3.933 7.855
147 HG1 THR 18 HG1 THR 18 -7.026 -2.799 7.674
148 HG21 THR 18 HG21 THR 18 -5.673 -3.439 9.921
149 HG22 THR 18 HG22 THR 18 -4.220 -2.437 9.775
150 HG23 THR 18 HG23 THR 18 -5.823 -1.742 9.446
151 H THR 19 H THR 19 -6.032 -1.300 5.093
152 HA THR 19 HA THR 19 -6.663 1.387 6.192
153 HB THR 19 HB THR 19 -6.466 0.590 3.283
154 HG1 THR 19 HG1 THR 19 -4.376 1.494 4.960
155 HG21 THR 19 HG21 THR 19 -6.405 3.283 4.685
156 HG22 THR 19 HG22 THR 19 -6.120 3.031 2.948
157 HG23 THR 19 HG23 THR 19 -7.695 2.643 3.654
158 H GLU 20 H GLU 20 -8.778 1.706 6.507
159 HA GLU 20 HA GLU 20 -10.820 0.404 4.821
160 HB2 GLU 20 HB2 GLU 20 -11.094 -0.812 6.864
161 HB3 GLU 20 HB3 GLU 20 -10.848 0.637 7.866
162 HG2 GLU 20 HG2 GLU 20 -12.939 1.604 7.189
163 HG3 GLU 20 HG3 GLU 20 -13.099 0.497 5.827
164 H ALA 21 H ALA 21 -12.242 1.974 4.069
165 HA ALA 21 HA ALA 21 -12.370 4.618 5.273
166 HB1 ALA 21 HB1 ALA 21 -11.790 5.777 3.169
167 HB2 ALA 21 HB2 ALA 21 -10.424 4.789 3.702
168 HB3 ALA 21 HB3 ALA 21 -11.458 4.219 2.373
169 H VAL 22 H VAL 22 -13.964 5.869 3.545
170 HA VAL 22 HA VAL 22 -16.387 4.276 3.577
171 HB VAL 22 HB VAL 22 -17.407 6.306 2.545
172 HG11 VAL 22 HG11 VAL 22 -15.749 6.703 5.075
173 HG12 VAL 22 HG12 VAL 22 -17.116 7.729 4.562
174 HG13 VAL 22 HG13 VAL 22 -17.371 6.036 4.951
175 HG21 VAL 22 HG21 VAL 22 -15.606 7.310 1.274
176 HG22 VAL 22 HG22 VAL 22 -16.062 8.421 2.552
177 HG23 VAL 22 HG23 VAL 22 -14.575 7.470 2.709
178 H ASP 23 H ASP 23 -14.285 5.572 0.923
179 HA ASP 23 HA ASP 23 -15.296 3.441 -0.891
180 HB2 ASP 23 HB2 ASP 23 -16.477 5.636 -1.236
181 HB3 ASP 23 HB3 ASP 23 -14.900 6.395 -1.511
182 H ALA 24 H ALA 24 -13.674 3.047 -2.706
183 HA ALA 24 HA ALA 24 -10.997 3.091 -1.663
184 HB1 ALA 24 HB1 ALA 24 -12.066 2.266 -4.382
185 HB2 ALA 24 HB2 ALA 24 -11.762 1.228 -2.991
186 HB3 ALA 24 HB3 ALA 24 -10.399 2.028 -3.813
187 H ALA 25 H ALA 25 -12.823 5.416 -3.592
188 HA ALA 25 HA ALA 25 -10.586 6.658 -4.889
189 HB1 ALA 25 HB1 ALA 25 -12.115 8.642 -5.034
190 HB2 ALA 25 HB2 ALA 25 -12.833 7.134 -5.629
191 HB3 ALA 25 HB3 ALA 25 -13.292 7.784 -4.029
192 H THR 26 H THR 26 -12.074 7.080 -1.642
193 HA THR 26 HA THR 26 -10.581 9.408 -0.903
194 HB THR 26 HB THR 26 -11.680 7.222 0.929
195 HG1 THR 26 HG1 THR 26 -13.487 9.021 0.783
196 HG21 THR 26 HG21 THR 26 -10.415 8.999 2.086
197 HG22 THR 26 HG22 THR 26 -11.429 10.239 1.318
198 HG23 THR 26 HG23 THR 26 -12.132 9.089 2.480
199 H ALA 27 H ALA 27 -9.959 5.948 -0.857
200 HA ALA 27 HA ALA 27 -7.619 5.999 0.817
201 HB1 ALA 27 HB1 ALA 27 -9.248 4.128 0.724
202 HB2 ALA 27 HB2 ALA 27 -8.757 3.825 -0.961
203 HB3 ALA 27 HB3 ALA 27 -7.602 3.608 0.371
204 H GLU 28 H GLU 28 -8.201 6.242 -2.694
205 HA GLU 28 HA GLU 28 -5.724 5.429 -3.682
206 HB2 GLU 28 HB2 GLU 28 -7.807 6.118 -4.983
207 HB3 GLU 28 HB3 GLU 28 -7.338 7.796 -4.700
208 HG2 GLU 28 HG2 GLU 28 -5.101 7.216 -5.824
209 HG3 GLU 28 HG3 GLU 28 -5.788 5.652 -6.247
210 H LYS 29 H LYS 29 -6.574 8.436 -2.104
211 HA LYS 29 HA LYS 29 -4.176 9.906 -2.788
212 HB2 LYS 29 HB2 LYS 29 -6.182 10.209 -0.514
213 HB3 LYS 29 HB3 LYS 29 -4.867 11.363 -0.826
214 HG2 LYS 29 HG2 LYS 29 -5.723 11.868 -3.028
215 HG3 LYS 29 HG3 LYS 29 -6.952 10.598 -2.924
216 HD2 LYS 29 HD2 LYS 29 -8.138 11.747 -1.194
217 HD3 LYS 29 HD3 LYS 29 -6.871 13.006 -1.071
218 HE2 LYS 29 HE2 LYS 29 -7.303 13.722 -3.361
219 HE3 LYS 29 HE3 LYS 29 -8.417 12.377 -3.623
220 HZ1 LYS 29 HZ1 LYS 29 -9.882 13.340 -1.967
221 HZ2 LYS 29 HZ2 LYS 29 -8.866 14.636 -1.782
222 HZ3 LYS 29 HZ3 LYS 29 -9.626 14.377 -3.203
223 H VAL 30 H VAL 30 -5.124 8.119 0.182
224 HA VAL 30 HA VAL 30 -2.571 8.430 1.376
225 HB VAL 30 HB VAL 30 -4.897 7.831 2.436
226 HG11 VAL 30 HG11 VAL 30 -5.007 5.501 3.245
227 HG12 VAL 30 HG12 VAL 30 -5.230 5.585 1.511
228 HG13 VAL 30 HG13 VAL 30 -3.670 5.049 2.178
229 HG21 VAL 30 HG21 VAL 30 -3.754 7.184 4.459
230 HG22 VAL 30 HG22 VAL 30 -2.283 6.750 3.557
231 HG23 VAL 30 HG23 VAL 30 -2.839 8.438 3.635
232 H PHE 31 H PHE 31 -3.849 6.025 -0.885
233 HA PHE 31 HA PHE 31 -1.959 3.980 -0.647
234 HB2 PHE 31 HB2 PHE 31 -4.041 4.033 -2.030
235 HB3 PHE 31 HB3 PHE 31 -3.282 5.146 -3.110
236 HD1 PHE 31 HD1 PHE 31 -0.977 4.228 -4.306
237 HD2 PHE 31 HD2 PHE 31 -4.295 1.907 -2.810
238 HE1 PHE 31 HE1 PHE 31 -0.560 2.491 -6.011
239 HE2 PHE 31 HE2 PHE 31 -3.860 0.189 -4.505
240 HZ PHE 31 HZ PHE 31 -1.999 0.468 -6.127
241 H LYS 32 H LYS 32 -1.758 7.054 -2.568
242 HA LYS 32 HA LYS 32 0.936 6.401 -3.478
243 HB2 LYS 32 HB2 LYS 32 -0.597 7.778 -4.833
244 HB3 LYS 32 HB3 LYS 32 -0.643 9.011 -3.567
245 HG2 LYS 32 HG2 LYS 32 1.754 9.471 -3.872
246 HG3 LYS 32 HG3 LYS 32 1.888 8.156 -5.056
247 HD2 LYS 32 HD2 LYS 32 0.407 9.341 -6.605
248 HD3 LYS 32 HD3 LYS 32 0.093 10.593 -5.389
249 HE2 LYS 32 HE2 LYS 32 2.509 11.190 -5.382
250 HE3 LYS 32 HE3 LYS 32 2.788 10.010 -6.668
251 HZ1 LYS 32 HZ1 LYS 32 1.015 12.368 -6.862
252 HZ2 LYS 32 HZ2 LYS 32 2.500 12.256 -7.541
253 HZ3 LYS 32 HZ3 LYS 32 1.272 11.284 -8.065
254 H GLN 33 H GLN 33 -0.417 8.750 -1.068
255 HA GLN 33 HA GLN 33 2.085 9.791 -0.302
256 HB2 GLN 33 HB2 GLN 33 0.043 10.910 0.228
257 HB3 GLN 33 HB3 GLN 33 -0.541 9.578 1.211
258 HG2 GLN 33 HG2 GLN 33 2.052 11.011 1.941
259 HG3 GLN 33 HG3 GLN 33 0.499 11.730 2.329
260 HE21 GLN 33 HE21 GLN 33 -0.392 9.106 4.747
261 HE22 GLN 33 HE22 GLN 33 -1.115 9.958 3.419
262 H TYR 34 H TYR 34 0.278 7.156 1.457
263 HA TYR 34 HA TYR 34 2.135 6.848 3.502
264 HB2 TYR 34 HB2 TYR 34 -0.075 5.870 3.558
265 HB3 TYR 34 HB3 TYR 34 0.282 4.851 2.163
266 HD1 TYR 34 HD1 TYR 34 1.321 2.774 2.382
267 HD2 TYR 34 HD2 TYR 34 1.162 5.432 5.741
268 HE1 TYR 34 HE1 TYR 34 2.233 0.964 3.801
269 HE2 TYR 34 HE2 TYR 34 2.166 3.652 7.199
270 HH TYR 34 HH TYR 34 2.862 0.345 5.964
271 H ALA 35 H ALA 35 2.190 5.368 0.256
272 HA ALA 35 HA ALA 35 4.496 3.722 0.842
273 HB1 ALA 35 HB1 ALA 35 3.243 4.546 -1.800
274 HB2 ALA 35 HB2 ALA 35 4.391 3.211 -1.526
275 HB3 ALA 35 HB3 ALA 35 2.782 3.129 -0.806
276 H ASN 36 H ASN 36 4.004 6.820 -0.987
277 HA ASN 36 HA ASN 36 6.747 7.165 -1.671
278 HB2 ASN 36 HB2 ASN 36 5.006 8.291 -2.782
279 HB3 ASN 36 HB3 ASN 36 4.443 9.070 -1.290
280 HD21 ASN 36 HD21 ASN 36 7.893 10.622 -2.973
281 HD22 ASN 36 HD22 ASN 36 7.677 8.899 -3.111
282 H ASP 37 H ASP 37 4.940 8.074 1.268
283 HA ASP 37 HA ASP 37 6.987 9.615 2.543
284 HB2 ASP 37 HB2 ASP 37 4.558 9.670 3.093
285 HB3 ASP 37 HB3 ASP 37 4.673 8.039 3.749
286 H ASN 38 H ASN 38 6.364 6.201 2.131
287 HA ASN 38 HA ASN 38 8.140 5.225 4.247
288 HB2 ASN 38 HB2 ASN 38 6.178 4.080 2.406
289 HB3 ASN 38 HB3 ASN 38 7.682 3.218 2.265
290 HD21 ASN 38 HD21 ASN 38 5.258 2.176 5.184
291 HD22 ASN 38 HD22 ASN 38 4.801 3.372 3.976
292 H GLY 39 H GLY 39 8.623 6.718 1.208
293 HA2 GLY 39 HA2 GLY 39 10.562 7.168 0.078
294 HA3 GLY 39 HA3 GLY 39 11.444 6.116 1.174
295 H VAL 40 H VAL 40 8.634 4.955 -0.737
296 HA VAL 40 HA VAL 40 10.394 2.950 -1.854
297 HB VAL 40 HB VAL 40 8.499 1.846 -2.635
298 HG11 VAL 40 HG11 VAL 40 8.941 2.013 -0.126
299 HG12 VAL 40 HG12 VAL 40 7.565 3.140 -0.070
300 HG13 VAL 40 HG13 VAL 40 7.345 1.483 -0.658
301 HG21 VAL 40 HG21 VAL 40 6.820 4.341 -2.158
302 HG22 VAL 40 HG22 VAL 40 7.171 3.583 -3.714
303 HG23 VAL 40 HG23 VAL 40 6.203 2.701 -2.542
304 H ASP 41 H ASP 41 10.965 2.482 -3.835
305 HA ASP 41 HA ASP 41 10.076 4.020 -6.134
306 HB2 ASP 41 HB2 ASP 41 12.081 5.291 -5.411
307 HB3 ASP 41 HB3 ASP 41 13.051 3.807 -5.508
308 H GLY 42 H GLY 42 8.974 1.779 -5.950
309 HA2 GLY 42 HA2 GLY 42 10.615 -0.212 -7.411
310 HA3 GLY 42 HA3 GLY 42 9.879 -0.695 -5.879
311 H GLU 43 H GLU 43 9.031 -2.266 -7.580
312 HA GLU 43 HA GLU 43 6.748 -1.279 -9.150
313 HB2 GLU 43 HB2 GLU 43 6.655 -3.463 -10.158
314 HB3 GLU 43 HB3 GLU 43 8.237 -2.721 -10.361
315 HG2 GLU 43 HG2 GLU 43 9.291 -4.244 -8.878
316 HG3 GLU 43 HG3 GLU 43 7.761 -4.728 -8.127
317 H TRP 44 H TRP 44 4.665 -2.043 -8.894
318 HA TRP 44 HA TRP 44 4.017 -3.040 -6.173
319 HB2 TRP 44 HB2 TRP 44 2.531 -1.374 -8.237
320 HB3 TRP 44 HB3 TRP 44 1.847 -1.893 -6.715
321 HD1 TRP 44 HD1 TRP 44 5.195 -0.042 -7.598
322 HE1 TRP 44 HE1 TRP 44 5.577 1.795 -5.967
323 HE3 TRP 44 HE3 TRP 44 0.848 -0.476 -4.908
324 HZ2 TRP 44 HZ2 TRP 44 3.951 3.328 -4.067
325 HZ3 TRP 44 HZ3 TRP 44 0.257 1.278 -3.261
326 HH2 TRP 44 HH2 TRP 44 1.736 3.193 -2.885
327 H THR 45 H THR 45 2.612 -4.745 -5.847
328 HA THR 45 HA THR 45 1.382 -6.166 -8.147
329 HB THR 45 HB THR 45 1.846 -8.249 -6.799
330 HG1 THR 45 HG1 THR 45 2.315 -7.286 -4.798
331 HG21 THR 45 HG21 THR 45 3.230 -7.705 -8.753
332 HG22 THR 45 HG22 THR 45 4.322 -6.737 -7.738
333 HG23 THR 45 HG23 THR 45 4.191 -8.488 -7.494
334 H TYR 46 H TYR 46 -0.459 -7.690 -7.183
335 HA TYR 46 HA TYR 46 -1.683 -6.462 -4.786
336 HB2 TYR 46 HB2 TYR 46 -2.558 -5.243 -6.740
337 HB3 TYR 46 HB3 TYR 46 -3.003 -6.772 -7.494
338 HD1 TYR 46 HD1 TYR 46 -3.459 -5.358 -4.020
339 HD2 TYR 46 HD2 TYR 46 -5.349 -6.977 -7.557
340 HE1 TYR 46 HE1 TYR 46 -5.649 -5.229 -2.910
341 HE2 TYR 46 HE2 TYR 46 -7.560 -6.782 -6.459
342 HH TYR 46 HH TYR 46 -8.605 -6.458 -4.308
343 H ASP 47 H ASP 47 -3.019 -7.825 -3.594
344 HA ASP 47 HA ASP 47 -3.547 -10.580 -4.556
345 HB2 ASP 47 HB2 ASP 47 -1.724 -9.868 -2.413
346 HB3 ASP 47 HB3 ASP 47 -3.117 -10.701 -1.729
347 H ASP 48 H ASP 48 -5.749 -10.121 -4.980
348 HA ASP 48 HA ASP 48 -7.323 -8.375 -3.428
349 HB2 ASP 48 HB2 ASP 48 -7.728 -9.119 -5.786
350 HB3 ASP 48 HB3 ASP 48 -8.387 -10.630 -5.153
351 H ALA 49 H ALA 49 -6.651 -11.782 -2.718
352 HA ALA 49 HA ALA 49 -8.982 -12.388 -1.279
353 HB1 ALA 49 HB1 ALA 49 -6.137 -13.280 -0.664
354 HB2 ALA 49 HB2 ALA 49 -7.625 -14.055 -0.092
355 HB3 ALA 49 HB3 ALA 49 -7.247 -14.049 -1.823
356 H THR 50 H THR 50 -6.217 -10.471 -0.247
357 HA THR 50 HA THR 50 -7.638 -9.710 2.255
358 HB THR 50 HB THR 50 -6.107 -11.110 3.147
359 HG1 THR 50 HG1 THR 50 -5.688 -8.751 3.691
360 HG21 THR 50 HG21 THR 50 -4.089 -10.369 1.004
361 HG22 THR 50 HG22 THR 50 -3.712 -11.363 2.437
362 HG23 THR 50 HG23 THR 50 -4.897 -11.919 1.279
363 H LYS 51 H LYS 51 -6.485 -8.648 -0.716
364 HA LYS 51 HA LYS 51 -6.303 -6.929 -1.780
365 HB2 LYS 51 HB2 LYS 51 -7.707 -5.574 0.504
366 HB3 LYS 51 HB3 LYS 51 -7.446 -4.877 -1.115
367 HG2 LYS 51 HG2 LYS 51 -8.683 -7.050 -1.916
368 HG3 LYS 51 HG3 LYS 51 -9.159 -7.219 -0.223
369 HD2 LYS 51 HD2 LYS 51 -10.182 -4.897 -0.355
370 HD3 LYS 51 HD3 LYS 51 -9.779 -4.901 -2.096
371 HE2 LYS 51 HE2 LYS 51 -10.997 -7.127 -2.247
372 HE3 LYS 51 HE3 LYS 51 -11.589 -6.843 -0.600
373 HZ1 LYS 51 HZ1 LYS 51 -12.698 -4.834 -1.464
374 HZ2 LYS 51 HZ2 LYS 51 -12.126 -5.160 -2.982
375 HZ3 LYS 51 HZ3 LYS 51 -13.177 -6.170 -2.233
376 H THR 52 H THR 52 -4.183 -7.955 -0.437
377 HA THR 52 HA THR 52 -2.588 -5.911 0.787
378 HB THR 52 HB THR 52 -1.877 -8.722 -0.115
379 HG1 THR 52 HG1 THR 52 -2.255 -9.098 2.164
380 HG21 THR 52 HG21 THR 52 -0.595 -6.924 2.004
381 HG22 THR 52 HG22 THR 52 -0.133 -8.595 1.591
382 HG23 THR 52 HG23 THR 52 0.110 -7.299 0.415
383 H PHE 53 H PHE 53 -1.548 -4.425 -0.300
384 HA PHE 53 HA PHE 53 -0.660 -4.851 -3.109
385 HB2 PHE 53 HB2 PHE 53 -1.299 -2.425 -1.398
386 HB3 PHE 53 HB3 PHE 53 -0.293 -2.286 -2.822
387 HD1 PHE 53 HD1 PHE 53 -1.144 -2.554 -5.096
388 HD2 PHE 53 HD2 PHE 53 -3.706 -2.943 -1.641
389 HE1 PHE 53 HE1 PHE 53 -3.139 -2.212 -6.535
390 HE2 PHE 53 HE2 PHE 53 -5.681 -2.628 -3.081
391 HZ PHE 53 HZ PHE 53 -5.399 -2.185 -5.520
392 H THR 54 H THR 54 1.380 -5.692 -3.068
393 HA THR 54 HA THR 54 3.252 -4.816 -0.963
394 HB THR 54 HB THR 54 3.350 -7.323 -2.674
395 HG1 THR 54 HG1 THR 54 2.384 -8.323 -0.980
396 HG21 THR 54 HG21 THR 54 4.778 -6.494 -0.107
397 HG22 THR 54 HG22 THR 54 4.843 -8.114 -0.822
398 HG23 THR 54 HG23 THR 54 5.532 -6.750 -1.705
399 H VAL 55 H VAL 55 5.308 -4.133 -1.471
400 HA VAL 55 HA VAL 55 5.922 -3.517 -4.294
401 HB VAL 55 HB VAL 55 6.092 -1.736 -1.876
402 HG11 VAL 55 HG11 VAL 55 7.751 -1.390 -4.414
403 HG12 VAL 55 HG12 VAL 55 7.478 -0.133 -3.196
404 HG13 VAL 55 HG13 VAL 55 8.376 -1.586 -2.759
405 HG21 VAL 55 HG21 VAL 55 5.306 -1.305 -4.789
406 HG22 VAL 55 HG22 VAL 55 4.144 -1.636 -3.478
407 HG23 VAL 55 HG23 VAL 55 5.078 -0.134 -3.470
408 H THR 56 H THR 56 7.964 -3.994 -4.926
409 HA THR 56 HA THR 56 9.754 -5.247 -2.912
410 HB THR 56 HB THR 56 9.325 -6.195 -5.767
411 HG1 THR 56 HG1 THR 56 7.412 -6.565 -4.853
412 HG21 THR 56 HG21 THR 56 11.439 -6.869 -4.579
413 HG22 THR 56 HG22 THR 56 10.439 -7.644 -3.324
414 HG23 THR 56 HG23 THR 56 10.384 -8.218 -5.007
415 H GLU 57 H GLU 57 11.419 -3.809 -2.711
416 HA GLU 57 HA GLU 57 12.329 -2.084 -4.875
417 HB2 GLU 57 HB2 GLU 57 12.398 -1.645 -2.358
418 HB3 GLU 57 HB3 GLU 57 13.746 -2.784 -2.261
419 HG2 GLU 57 HG2 GLU 57 14.952 -1.247 -3.934
420 HG3 GLU 57 HG3 GLU 57 13.622 -0.107 -3.723
Start of MODEL 11
1 H1 MET 1 H MET 1 -16.462 1.477 1.173
2 HA MET 1 HA MET 1 -16.718 -0.579 -0.009
3 HB2 MET 1 HB2 MET 1 -14.889 1.178 -0.628
4 HB3 MET 1 HB3 MET 1 -13.740 -0.090 -0.238
5 HG2 MET 1 HG2 MET 1 -14.777 -1.574 -1.893
6 HG3 MET 1 HG3 MET 1 -16.134 -0.460 -2.075
7 HE1 MET 1 HE1 MET 1 -15.553 -1.218 -4.610
8 HE2 MET 1 HE2 MET 1 -16.373 0.342 -4.399
9 HE3 MET 1 HE3 MET 1 -15.029 0.195 -5.554
10 H GLY 2 H GLY 2 -13.657 -0.807 2.037
11 HA2 GLY 2 HA2 GLY 2 -14.375 -3.151 3.332
12 HA3 GLY 2 HA3 GLY 2 -13.467 -3.574 1.863
13 H THR 3 H THR 3 -12.102 -4.361 3.743
14 HA THR 3 HA THR 3 -10.248 -2.331 4.831
15 HB THR 3 HB THR 3 -11.122 -3.842 6.470
16 HG1 THR 3 HG1 THR 3 -8.993 -3.491 6.761
17 HG21 THR 3 HG21 THR 3 -11.928 -5.740 5.093
18 HG22 THR 3 HG22 THR 3 -10.258 -6.210 4.748
19 HG23 THR 3 HG23 THR 3 -10.889 -6.287 6.405
20 H TYR 4 H TYR 4 -8.139 -2.237 4.057
21 HA TYR 4 HA TYR 4 -7.222 -4.202 2.033
22 HB2 TYR 4 HB2 TYR 4 -6.974 -1.186 1.888
23 HB3 TYR 4 HB3 TYR 4 -6.296 -2.317 0.733
24 HD1 TYR 4 HD1 TYR 4 -7.489 -2.709 -1.295
25 HD2 TYR 4 HD2 TYR 4 -9.571 -1.084 2.114
26 HE1 TYR 4 HE1 TYR 4 -9.495 -2.347 -2.689
27 HE2 TYR 4 HE2 TYR 4 -11.590 -0.781 0.737
28 HH TYR 4 HH TYR 4 -11.694 -1.567 -2.745
29 H LYS 5 H LYS 5 -4.868 -4.312 1.826
30 HA LYS 5 HA LYS 5 -3.490 -3.137 4.248
31 HB2 LYS 5 HB2 LYS 5 -3.635 -5.925 3.253
32 HB3 LYS 5 HB3 LYS 5 -2.012 -5.357 3.673
33 HG2 LYS 5 HG2 LYS 5 -2.880 -4.638 5.899
34 HG3 LYS 5 HG3 LYS 5 -4.460 -5.326 5.499
35 HD2 LYS 5 HD2 LYS 5 -3.649 -7.533 5.555
36 HD3 LYS 5 HD3 LYS 5 -1.966 -7.038 5.269
37 HE2 LYS 5 HE2 LYS 5 -1.803 -6.038 7.480
38 HE3 LYS 5 HE3 LYS 5 -3.501 -6.436 7.826
39 HZ1 LYS 5 HZ1 LYS 5 -1.805 -8.036 8.716
40 HZ2 LYS 5 HZ2 LYS 5 -2.982 -8.719 7.767
41 HZ3 LYS 5 HZ3 LYS 5 -1.458 -8.475 7.195
42 H LEU 6 H LEU 6 -1.483 -2.159 3.974
43 HA LEU 6 HA LEU 6 -0.366 -2.148 1.229
44 HB2 LEU 6 HB2 LEU 6 -1.749 -0.052 1.954
45 HB3 LEU 6 HB3 LEU 6 -0.300 0.402 2.842
46 HG LEU 6 HG LEU 6 -0.253 -0.397 -0.113
47 HD11 LEU 6 HD11 LEU 6 -1.868 1.378 0.060
48 HD12 LEU 6 HD12 LEU 6 -0.756 2.372 1.027
49 HD13 LEU 6 HD13 LEU 6 -0.385 1.996 -0.675
50 HD21 LEU 6 HD21 LEU 6 1.614 1.427 1.470
51 HD22 LEU 6 HD22 LEU 6 1.950 -0.258 0.983
52 HD23 LEU 6 HD23 LEU 6 1.754 0.980 -0.234
53 H ILE 7 H ILE 7 1.464 -3.245 1.402
54 HA ILE 7 HA ILE 7 3.357 -2.768 3.607
55 HB ILE 7 HB ILE 7 2.362 -4.916 3.987
56 HG12 ILE 7 HG12 ILE 7 5.026 -5.494 2.607
57 HG13 ILE 7 HG13 ILE 7 4.879 -4.745 4.187
58 HG21 ILE 7 HG21 ILE 7 3.056 -5.812 1.167
59 HG22 ILE 7 HG22 ILE 7 2.180 -6.726 2.396
60 HG23 ILE 7 HG23 ILE 7 1.436 -5.308 1.668
61 HD11 ILE 7 HD11 ILE 7 4.036 -7.561 3.433
62 HD12 ILE 7 HD12 ILE 7 5.319 -7.065 4.539
63 HD13 ILE 7 HD13 ILE 7 3.624 -6.800 4.986
64 H LEU 8 H LEU 8 5.364 -2.365 3.149
65 HA LEU 8 HA LEU 8 6.199 -2.190 0.304
66 HB2 LEU 8 HB2 LEU 8 7.013 -0.436 2.653
67 HB3 LEU 8 HB3 LEU 8 7.518 -0.265 0.986
68 HG LEU 8 HG LEU 8 5.992 1.461 1.487
69 HD11 LEU 8 HD11 LEU 8 4.432 -0.564 -0.166
70 HD12 LEU 8 HD12 LEU 8 4.280 1.195 -0.229
71 HD13 LEU 8 HD13 LEU 8 5.766 0.419 -0.781
72 HD21 LEU 8 HD21 LEU 8 4.868 0.341 3.424
73 HD22 LEU 8 HD22 LEU 8 3.873 1.377 2.363
74 HD23 LEU 8 HD23 LEU 8 3.758 -0.380 2.256
75 H ASN 9 H ASN 9 8.236 -2.930 -0.236
76 HA ASN 9 HA ASN 9 9.921 -4.094 1.919
77 HB2 ASN 9 HB2 ASN 9 9.350 -5.451 -0.737
78 HB3 ASN 9 HB3 ASN 9 10.554 -5.933 0.434
79 HD21 ASN 9 HD21 ASN 9 6.863 -7.315 0.954
80 HD22 ASN 9 HD22 ASN 9 7.367 -6.460 -0.501
81 H GLY 10 H GLY 10 11.162 -2.176 1.854
82 HA2 GLY 10 HA2 GLY 10 12.588 -1.499 -0.632
83 HA3 GLY 10 HA3 GLY 10 12.586 -0.597 0.888
84 H LYS 11 H LYS 11 14.973 -1.144 -0.370
85 HA LYS 11 HA LYS 11 16.320 -3.522 0.355
86 HB2 LYS 11 HB2 LYS 11 17.172 -1.993 -1.230
87 HB3 LYS 11 HB3 LYS 11 17.264 -0.670 -0.060
88 HG2 LYS 11 HG2 LYS 11 19.162 -1.771 1.066
89 HG3 LYS 11 HG3 LYS 11 19.027 -3.163 -0.044
90 HD2 LYS 11 HD2 LYS 11 19.321 -1.630 -1.971
91 HD3 LYS 11 HD3 LYS 11 19.462 -0.253 -0.864
92 HE2 LYS 11 HE2 LYS 11 21.546 -1.136 0.022
93 HE3 LYS 11 HE3 LYS 11 21.395 -2.603 -0.972
94 HZ1 LYS 11 HZ1 LYS 11 22.843 -0.886 -1.956
95 HZ2 LYS 11 HZ2 LYS 11 21.593 -1.310 -2.924
96 HZ3 LYS 11 HZ3 LYS 11 21.534 0.118 -2.123
97 H THR 12 H THR 12 16.140 -0.495 2.282
98 HA THR 12 HA THR 12 16.839 -2.131 4.629
99 HB THR 12 HB THR 12 18.855 -0.977 3.892
100 HG1 THR 12 HG1 THR 12 17.774 -1.138 6.295
101 HG21 THR 12 HG21 THR 12 17.923 1.143 3.074
102 HG22 THR 12 HG22 THR 12 17.454 1.596 4.728
103 HG23 THR 12 HG23 THR 12 19.169 1.409 4.292
104 H LEU 13 H LEU 13 14.258 -0.854 3.371
105 HA LEU 13 HA LEU 13 13.286 0.245 5.963
106 HB2 LEU 13 HB2 LEU 13 12.576 1.267 3.187
107 HB3 LEU 13 HB3 LEU 13 11.922 1.853 4.726
108 HG LEU 13 HG LEU 13 14.861 2.094 3.934
109 HD11 LEU 13 HD11 LEU 13 12.670 4.189 3.738
110 HD12 LEU 13 HD12 LEU 13 14.392 4.430 3.407
111 HD13 LEU 13 HD13 LEU 13 13.436 3.358 2.372
112 HD21 LEU 13 HD21 LEU 13 14.428 2.203 6.392
113 HD22 LEU 13 HD22 LEU 13 14.985 3.731 5.735
114 HD23 LEU 13 HD23 LEU 13 13.260 3.509 6.118
115 H LYS 14 H LYS 14 11.272 -0.558 6.551
116 HA LYS 14 HA LYS 14 9.666 -2.085 4.572
117 HB2 LYS 14 HB2 LYS 14 10.930 -3.291 7.069
118 HB3 LYS 14 HB3 LYS 14 9.352 -3.837 6.499
119 HG2 LYS 14 HG2 LYS 14 10.415 -4.187 4.204
120 HG3 LYS 14 HG3 LYS 14 11.987 -4.010 5.001
121 HD2 LYS 14 HD2 LYS 14 11.526 -5.947 6.431
122 HD3 LYS 14 HD3 LYS 14 9.837 -5.995 5.885
123 HE2 LYS 14 HE2 LYS 14 10.737 -6.294 3.510
124 HE3 LYS 14 HE3 LYS 14 12.320 -6.580 4.236
125 HZ1 LYS 14 HZ1 LYS 14 11.141 -8.607 3.788
126 HZ2 LYS 14 HZ2 LYS 14 11.312 -8.465 5.422
127 HZ3 LYS 14 HZ3 LYS 14 9.856 -8.148 4.704
128 H GLY 15 H GLY 15 7.426 -2.402 5.261
129 HA2 GLY 15 HA2 GLY 15 6.480 -1.364 7.772
130 HA3 GLY 15 HA3 GLY 15 6.278 -0.219 6.427
131 H GLU 16 H GLU 16 4.193 -1.853 7.970
132 HA GLU 16 HA GLU 16 2.743 -2.784 5.599
133 HB2 GLU 16 HB2 GLU 16 2.175 -4.918 6.603
134 HB3 GLU 16 HB3 GLU 16 3.873 -4.785 6.231
135 HG2 GLU 16 HG2 GLU 16 4.522 -5.258 8.311
136 HG3 GLU 16 HG3 GLU 16 3.417 -4.114 9.043
137 H THR 17 H THR 17 0.819 -1.727 5.687
138 HA THR 17 HA THR 17 -0.447 -1.450 8.392
139 HB THR 17 HB THR 17 0.748 0.673 7.701
140 HG1 THR 17 HG1 THR 17 -0.808 1.819 8.678
141 HG21 THR 17 HG21 THR 17 -0.033 0.536 5.265
142 HG22 THR 17 HG22 THR 17 -1.644 1.017 5.828
143 HG23 THR 17 HG23 THR 17 -0.267 2.103 6.053
144 H THR 18 H THR 18 -2.784 -0.514 8.038
145 HA THR 18 HA THR 18 -4.078 -1.791 5.752
146 HB THR 18 HB THR 18 -4.026 -3.502 7.557
147 HG1 THR 18 HG1 THR 18 -5.857 -3.186 6.080
148 HG21 THR 18 HG21 THR 18 -5.347 -3.263 9.591
149 HG22 THR 18 HG22 THR 18 -4.088 -2.022 9.561
150 HG23 THR 18 HG23 THR 18 -5.767 -1.589 9.182
151 H THR 19 H THR 19 -6.190 -0.904 5.301
152 HA THR 19 HA THR 19 -7.040 1.405 6.889
153 HB THR 19 HB THR 19 -6.436 1.643 3.928
154 HG1 THR 19 HG1 THR 19 -4.949 2.720 6.091
155 HG21 THR 19 HG21 THR 19 -7.340 3.648 6.014
156 HG22 THR 19 HG22 THR 19 -6.711 4.114 4.406
157 HG23 THR 19 HG23 THR 19 -8.188 3.162 4.540
158 H GLU 20 H GLU 20 -9.196 1.655 6.793
159 HA GLU 20 HA GLU 20 -10.877 0.079 4.929
160 HB2 GLU 20 HB2 GLU 20 -11.057 -0.728 7.288
161 HB3 GLU 20 HB3 GLU 20 -11.357 0.934 7.823
162 HG2 GLU 20 HG2 GLU 20 -13.384 0.857 6.134
163 HG3 GLU 20 HG3 GLU 20 -13.154 -0.886 6.193
164 H ALA 21 H ALA 21 -12.049 1.515 3.602
165 HA ALA 21 HA ALA 21 -12.612 4.203 4.638
166 HB1 ALA 21 HB1 ALA 21 -11.735 5.313 2.641
167 HB2 ALA 21 HB2 ALA 21 -10.430 4.461 3.481
168 HB3 ALA 21 HB3 ALA 21 -11.138 3.775 2.000
169 H VAL 22 H VAL 22 -14.085 5.338 3.220
170 HA VAL 22 HA VAL 22 -16.378 3.864 2.687
171 HB VAL 22 HB VAL 22 -17.297 5.922 1.837
172 HG11 VAL 22 HG11 VAL 22 -15.410 6.627 4.118
173 HG12 VAL 22 HG12 VAL 22 -17.011 7.307 3.751
174 HG13 VAL 22 HG13 VAL 22 -16.873 5.639 4.297
175 HG21 VAL 22 HG21 VAL 22 -15.536 6.813 0.391
176 HG22 VAL 22 HG22 VAL 22 -15.934 8.000 1.624
177 HG23 VAL 22 HG23 VAL 22 -14.454 7.039 1.788
178 H ASP 23 H ASP 23 -13.826 4.907 0.339
179 HA ASP 23 HA ASP 23 -14.790 2.895 -1.588
180 HB2 ASP 23 HB2 ASP 23 -15.999 5.107 -2.018
181 HB3 ASP 23 HB3 ASP 23 -14.386 5.744 -2.401
182 H ALA 24 H ALA 24 -13.200 2.636 -3.377
183 HA ALA 24 HA ALA 24 -10.503 2.554 -2.446
184 HB1 ALA 24 HB1 ALA 24 -10.041 1.933 -4.836
185 HB2 ALA 24 HB2 ALA 24 -11.285 0.939 -4.063
186 HB3 ALA 24 HB3 ALA 24 -11.747 2.228 -5.212
187 H ALA 25 H ALA 25 -12.370 4.890 -4.440
188 HA ALA 25 HA ALA 25 -10.268 6.497 -5.391
189 HB1 ALA 25 HB1 ALA 25 -12.003 8.309 -5.427
190 HB2 ALA 25 HB2 ALA 25 -12.594 6.777 -6.102
191 HB3 ALA 25 HB3 ALA 25 -13.077 7.282 -4.468
192 H THR 26 H THR 26 -11.897 6.588 -2.217
193 HA THR 26 HA THR 26 -10.526 8.936 -1.256
194 HB THR 26 HB THR 26 -12.272 6.760 -0.075
195 HG1 THR 26 HG1 THR 26 -13.448 8.332 -1.056
196 HG21 THR 26 HG21 THR 26 -12.341 8.052 2.063
197 HG22 THR 26 HG22 THR 26 -10.786 7.251 1.786
198 HG23 THR 26 HG23 THR 26 -10.944 8.985 1.492
199 H ALA 27 H ALA 27 -9.843 5.435 -1.172
200 HA ALA 27 HA ALA 27 -7.664 5.664 0.722
201 HB1 ALA 27 HB1 ALA 27 -8.956 3.629 0.602
202 HB2 ALA 27 HB2 ALA 27 -8.558 3.441 -1.120
203 HB3 ALA 27 HB3 ALA 27 -7.291 3.286 0.096
204 H GLU 28 H GLU 28 -7.938 5.753 -2.834
205 HA GLU 28 HA GLU 28 -5.337 5.139 -3.538
206 HB2 GLU 28 HB2 GLU 28 -7.414 5.651 -4.985
207 HB3 GLU 28 HB3 GLU 28 -6.928 7.348 -4.869
208 HG2 GLU 28 HG2 GLU 28 -4.614 6.551 -5.742
209 HG3 GLU 28 HG3 GLU 28 -5.379 4.993 -6.064
210 H LYS 29 H LYS 29 -6.504 8.113 -2.043
211 HA LYS 29 HA LYS 29 -4.190 9.726 -2.553
212 HB2 LYS 29 HB2 LYS 29 -6.086 9.860 -0.154
213 HB3 LYS 29 HB3 LYS 29 -4.947 11.108 -0.693
214 HG2 LYS 29 HG2 LYS 29 -6.201 11.070 -2.924
215 HG3 LYS 29 HG3 LYS 29 -7.470 10.154 -2.102
216 HD2 LYS 29 HD2 LYS 29 -7.823 12.000 -0.519
217 HD3 LYS 29 HD3 LYS 29 -6.414 12.868 -1.180
218 HE2 LYS 29 HE2 LYS 29 -7.547 12.851 -3.431
219 HE3 LYS 29 HE3 LYS 29 -9.000 12.208 -2.661
220 HZ1 LYS 29 HZ1 LYS 29 -9.141 14.227 -1.368
221 HZ2 LYS 29 HZ2 LYS 29 -7.678 14.758 -1.951
222 HZ3 LYS 29 HZ3 LYS 29 -8.975 14.618 -2.957
223 H VAL 30 H VAL 30 -5.098 7.614 0.223
224 HA VAL 30 HA VAL 30 -2.650 8.114 1.598
225 HB VAL 30 HB VAL 30 -4.901 7.220 2.572
226 HG11 VAL 30 HG11 VAL 30 -4.831 4.822 3.197
227 HG12 VAL 30 HG12 VAL 30 -5.077 5.006 1.476
228 HG13 VAL 30 HG13 VAL 30 -3.476 4.561 2.088
229 HG21 VAL 30 HG21 VAL 30 -3.642 6.349 4.514
230 HG22 VAL 30 HG22 VAL 30 -2.171 6.238 3.510
231 HG23 VAL 30 HG23 VAL 30 -2.924 7.817 3.856
232 H PHE 31 H PHE 31 -3.605 5.742 -0.886
233 HA PHE 31 HA PHE 31 -1.470 3.944 -0.613
234 HB2 PHE 31 HB2 PHE 31 -3.325 3.531 -2.111
235 HB3 PHE 31 HB3 PHE 31 -3.006 4.974 -3.025
236 HD1 PHE 31 HD1 PHE 31 -0.548 5.057 -4.270
237 HD2 PHE 31 HD2 PHE 31 -2.838 1.538 -3.216
238 HE1 PHE 31 HE1 PHE 31 0.597 3.789 -6.019
239 HE2 PHE 31 HE2 PHE 31 -1.799 0.338 -5.103
240 HZ PHE 31 HZ PHE 31 -0.080 1.451 -6.510
241 H LYS 32 H LYS 32 -1.599 7.048 -2.419
242 HA LYS 32 HA LYS 32 1.201 6.807 -3.170
243 HB2 LYS 32 HB2 LYS 32 -0.539 7.968 -4.528
244 HB3 LYS 32 HB3 LYS 32 -0.621 9.248 -3.307
245 HG2 LYS 32 HG2 LYS 32 1.686 9.895 -3.742
246 HG3 LYS 32 HG3 LYS 32 1.950 8.471 -4.768
247 HD2 LYS 32 HD2 LYS 32 0.291 9.283 -6.379
248 HD3 LYS 32 HD3 LYS 32 -0.054 10.688 -5.360
249 HE2 LYS 32 HE2 LYS 32 2.257 11.509 -5.670
250 HE3 LYS 32 HE3 LYS 32 2.640 10.075 -6.639
251 HZ1 LYS 32 HZ1 LYS 32 0.593 12.073 -7.366
252 HZ2 LYS 32 HZ2 LYS 32 2.097 11.949 -8.054
253 HZ3 LYS 32 HZ3 LYS 32 1.024 10.739 -8.244
254 H GLN 33 H GLN 33 -0.548 8.881 -0.780
255 HA GLN 33 HA GLN 33 1.743 10.257 0.109
256 HB2 GLN 33 HB2 GLN 33 -0.447 11.032 0.629
257 HB3 GLN 33 HB3 GLN 33 -0.890 9.545 1.463
258 HG2 GLN 33 HG2 GLN 33 1.404 11.218 2.535
259 HG3 GLN 33 HG3 GLN 33 -0.263 11.734 2.785
260 HE21 GLN 33 HE21 GLN 33 -1.148 9.012 4.982
261 HE22 GLN 33 HE22 GLN 33 -1.791 10.032 3.702
262 H TYR 34 H TYR 34 0.266 7.330 1.741
263 HA TYR 34 HA TYR 34 2.255 7.338 3.755
264 HB2 TYR 34 HB2 TYR 34 0.326 6.165 4.281
265 HB3 TYR 34 HB3 TYR 34 0.276 5.325 2.743
266 HD1 TYR 34 HD1 TYR 34 0.595 3.094 2.820
267 HD2 TYR 34 HD2 TYR 34 2.787 5.574 5.569
268 HE1 TYR 34 HE1 TYR 34 1.704 1.069 3.766
269 HE2 TYR 34 HE2 TYR 34 3.880 3.596 6.522
270 HH TYR 34 HH TYR 34 3.090 0.260 5.366
271 H ALA 35 H ALA 35 2.118 5.415 0.706
272 HA ALA 35 HA ALA 35 4.524 4.039 1.227
273 HB1 ALA 35 HB1 ALA 35 3.275 4.786 -1.447
274 HB2 ALA 35 HB2 ALA 35 4.407 3.457 -1.133
275 HB3 ALA 35 HB3 ALA 35 2.798 3.414 -0.404
276 H ASN 36 H ASN 36 4.040 7.102 -0.684
277 HA ASN 36 HA ASN 36 6.830 7.401 -1.227
278 HB2 ASN 36 HB2 ASN 36 5.147 8.475 -2.503
279 HB3 ASN 36 HB3 ASN 36 4.570 9.387 -1.083
280 HD21 ASN 36 HD21 ASN 36 7.832 10.765 -3.101
281 HD22 ASN 36 HD22 ASN 36 7.152 9.217 -3.556
282 H ASP 37 H ASP 37 4.868 8.407 1.616
283 HA ASP 37 HA ASP 37 6.901 10.058 2.800
284 HB2 ASP 37 HB2 ASP 37 4.420 10.048 3.300
285 HB3 ASP 37 HB3 ASP 37 4.655 8.548 4.206
286 H ASN 38 H ASN 38 6.351 6.643 2.588
287 HA ASN 38 HA ASN 38 8.141 5.815 4.735
288 HB2 ASN 38 HB2 ASN 38 5.997 4.676 3.688
289 HB3 ASN 38 HB3 ASN 38 7.131 4.037 2.508
290 HD21 ASN 38 HD21 ASN 38 6.377 1.583 5.216
291 HD22 ASN 38 HD22 ASN 38 5.544 2.433 3.949
292 H GLY 39 H GLY 39 8.624 7.147 1.661
293 HA2 GLY 39 HA2 GLY 39 10.528 7.579 0.503
294 HA3 GLY 39 HA3 GLY 39 11.435 6.557 1.618
295 H VAL 40 H VAL 40 8.668 5.206 -0.200
296 HA VAL 40 HA VAL 40 10.499 3.271 -1.303
297 HB VAL 40 HB VAL 40 8.617 2.076 -2.030
298 HG11 VAL 40 HG11 VAL 40 9.013 2.312 0.474
299 HG12 VAL 40 HG12 VAL 40 7.634 3.456 0.465
300 HG13 VAL 40 HG13 VAL 40 7.417 1.787 -0.063
301 HG21 VAL 40 HG21 VAL 40 6.916 4.568 -1.618
302 HG22 VAL 40 HG22 VAL 40 7.234 3.756 -3.151
303 HG23 VAL 40 HG23 VAL 40 6.297 2.909 -1.938
304 H ASP 41 H ASP 41 10.959 2.680 -3.242
305 HA ASP 41 HA ASP 41 10.060 4.063 -5.638
306 HB2 ASP 41 HB2 ASP 41 12.182 5.232 -5.070
307 HB3 ASP 41 HB3 ASP 41 13.025 3.672 -5.013
308 H GLY 42 H GLY 42 9.037 2.185 -6.551
309 HA2 GLY 42 HA2 GLY 42 10.501 -0.087 -7.230
310 HA3 GLY 42 HA3 GLY 42 9.733 -0.487 -5.692
311 H GLU 43 H GLU 43 8.912 -2.089 -7.473
312 HA GLU 43 HA GLU 43 6.592 -1.140 -9.035
313 HB2 GLU 43 HB2 GLU 43 6.590 -3.400 -9.974
314 HB3 GLU 43 HB3 GLU 43 8.122 -2.587 -10.197
315 HG2 GLU 43 HG2 GLU 43 9.291 -4.135 -9.011
316 HG3 GLU 43 HG3 GLU 43 8.078 -4.214 -7.737
317 H TRP 44 H TRP 44 4.485 -1.963 -8.781
318 HA TRP 44 HA TRP 44 3.847 -2.976 -6.057
319 HB2 TRP 44 HB2 TRP 44 2.321 -1.329 -8.118
320 HB3 TRP 44 HB3 TRP 44 1.638 -1.877 -6.603
321 HD1 TRP 44 HD1 TRP 44 4.867 0.150 -7.545
322 HE1 TRP 44 HE1 TRP 44 5.329 1.771 -5.650
323 HE3 TRP 44 HE3 TRP 44 0.763 -0.697 -4.573
324 HZ2 TRP 44 HZ2 TRP 44 3.782 3.140 -3.633
325 HZ3 TRP 44 HZ3 TRP 44 0.320 0.773 -2.648
326 HH2 TRP 44 HH2 TRP 44 1.750 2.740 -2.212
327 H THR 45 H THR 45 2.501 -4.737 -5.722
328 HA THR 45 HA THR 45 1.170 -6.126 -7.980
329 HB THR 45 HB THR 45 1.797 -8.243 -6.614
330 HG1 THR 45 HG1 THR 45 4.067 -6.690 -5.920
331 HG21 THR 45 HG21 THR 45 2.624 -7.821 -8.887
332 HG22 THR 45 HG22 THR 45 3.971 -6.872 -8.228
333 HG23 THR 45 HG23 THR 45 3.847 -8.606 -7.876
334 H TYR 46 H TYR 46 -0.742 -7.512 -7.100
335 HA TYR 46 HA TYR 46 -1.664 -6.553 -4.435
336 HB2 TYR 46 HB2 TYR 46 -2.538 -5.008 -6.111
337 HB3 TYR 46 HB3 TYR 46 -3.134 -6.357 -7.076
338 HD1 TYR 46 HD1 TYR 46 -3.469 -5.064 -3.534
339 HD2 TYR 46 HD2 TYR 46 -5.446 -6.725 -7.000
340 HE1 TYR 46 HE1 TYR 46 -5.653 -4.866 -2.391
341 HE2 TYR 46 HE2 TYR 46 -7.633 -6.458 -5.877
342 HH TYR 46 HH TYR 46 -8.698 -6.011 -3.786
343 H ASP 47 H ASP 47 -3.068 -7.851 -3.333
344 HA ASP 47 HA ASP 47 -3.888 -10.482 -4.466
345 HB2 ASP 47 HB2 ASP 47 -2.216 -9.977 -2.041
346 HB3 ASP 47 HB3 ASP 47 -3.582 -11.048 -1.818
347 H ASP 48 H ASP 48 -6.018 -9.833 -4.789
348 HA ASP 48 HA ASP 48 -7.460 -8.104 -3.056
349 HB2 ASP 48 HB2 ASP 48 -7.959 -8.697 -5.498
350 HB3 ASP 48 HB3 ASP 48 -8.666 -10.191 -4.895
351 H ALA 49 H ALA 49 -6.663 -11.423 -2.764
352 HA ALA 49 HA ALA 49 -8.816 -12.465 -1.293
353 HB1 ALA 49 HB1 ALA 49 -5.851 -13.128 -0.964
354 HB2 ALA 49 HB2 ALA 49 -7.229 -14.159 -0.519
355 HB3 ALA 49 HB3 ALA 49 -6.928 -13.786 -2.220
356 H THR 50 H THR 50 -6.301 -10.292 -0.269
357 HA THR 50 HA THR 50 -7.486 -10.132 2.458
358 HB THR 50 HB THR 50 -5.542 -11.381 2.802
359 HG1 THR 50 HG1 THR 50 -5.723 -9.472 4.114
360 HG21 THR 50 HG21 THR 50 -4.111 -9.522 0.872
361 HG22 THR 50 HG22 THR 50 -3.269 -10.683 1.936
362 HG23 THR 50 HG23 THR 50 -4.376 -11.248 0.694
363 H LYS 51 H LYS 51 -6.128 -8.475 -0.388
364 HA LYS 51 HA LYS 51 -6.525 -6.757 -1.352
365 HB2 LYS 51 HB2 LYS 51 -7.970 -5.714 1.068
366 HB3 LYS 51 HB3 LYS 51 -7.736 -4.829 -0.457
367 HG2 LYS 51 HG2 LYS 51 -8.798 -6.898 -1.572
368 HG3 LYS 51 HG3 LYS 51 -9.212 -7.434 0.046
369 HD2 LYS 51 HD2 LYS 51 -10.575 -5.389 0.389
370 HD3 LYS 51 HD3 LYS 51 -10.131 -4.831 -1.250
371 HE2 LYS 51 HE2 LYS 51 -11.040 -6.914 -2.217
372 HE3 LYS 51 HE3 LYS 51 -11.483 -7.485 -0.599
373 HZ1 LYS 51 HZ1 LYS 51 -13.069 -5.637 -0.469
374 HZ2 LYS 51 HZ2 LYS 51 -12.638 -5.158 -2.000
375 HZ3 LYS 51 HZ3 LYS 51 -13.343 -6.609 -1.741
376 H THR 52 H THR 52 -4.301 -7.788 -0.001
377 HA THR 52 HA THR 52 -2.731 -5.647 1.059
378 HB THR 52 HB THR 52 -2.039 -8.506 0.312
379 HG1 THR 52 HG1 THR 52 -2.118 -8.655 2.645
380 HG21 THR 52 HG21 THR 52 -0.503 -6.478 1.998
381 HG22 THR 52 HG22 THR 52 -0.076 -8.187 1.778
382 HG23 THR 52 HG23 THR 52 0.010 -7.086 0.402
383 H PHE 53 H PHE 53 -1.496 -4.345 -0.039
384 HA PHE 53 HA PHE 53 -0.899 -4.710 -2.930
385 HB2 PHE 53 HB2 PHE 53 -1.233 -2.316 -1.063
386 HB3 PHE 53 HB3 PHE 53 -0.349 -2.176 -2.551
387 HD1 PHE 53 HD1 PHE 53 -1.454 -2.426 -4.764
388 HD2 PHE 53 HD2 PHE 53 -3.673 -2.392 -1.067
389 HE1 PHE 53 HE1 PHE 53 -3.513 -1.816 -6.005
390 HE2 PHE 53 HE2 PHE 53 -5.718 -1.730 -2.315
391 HZ PHE 53 HZ PHE 53 -5.639 -1.444 -4.782
392 H THR 54 H THR 54 1.179 -5.628 -3.037
393 HA THR 54 HA THR 54 3.100 -4.978 -0.862
394 HB THR 54 HB THR 54 3.325 -7.172 -2.931
395 HG1 THR 54 HG1 THR 54 2.794 -8.518 -1.083
396 HG21 THR 54 HG21 THR 54 4.695 -6.730 -0.239
397 HG22 THR 54 HG22 THR 54 4.933 -8.133 -1.290
398 HG23 THR 54 HG23 THR 54 5.447 -6.555 -1.845
399 H VAL 55 H VAL 55 5.097 -4.078 -1.392
400 HA VAL 55 HA VAL 55 5.507 -3.237 -4.209
401 HB VAL 55 HB VAL 55 5.718 -1.720 -1.663
402 HG11 VAL 55 HG11 VAL 55 7.729 -1.242 -3.901
403 HG12 VAL 55 HG12 VAL 55 7.397 -0.124 -2.541
404 HG13 VAL 55 HG13 VAL 55 8.126 -1.702 -2.242
405 HG21 VAL 55 HG21 VAL 55 5.361 -0.946 -4.574
406 HG22 VAL 55 HG22 VAL 55 4.034 -1.326 -3.460
407 HG23 VAL 55 HG23 VAL 55 5.050 0.096 -3.157
408 H THR 56 H THR 56 7.443 -3.692 -5.092
409 HA THR 56 HA THR 56 9.386 -5.179 -3.413
410 HB THR 56 HB THR 56 8.645 -5.849 -6.288
411 HG1 THR 56 HG1 THR 56 6.835 -6.383 -5.292
412 HG21 THR 56 HG21 THR 56 10.841 -6.654 -5.452
413 HG22 THR 56 HG22 THR 56 10.003 -7.498 -4.115
414 HG23 THR 56 HG23 THR 56 9.715 -7.963 -5.809
415 H GLU 57 H GLU 57 11.068 -3.700 -3.226
416 HA GLU 57 HA GLU 57 11.686 -1.743 -5.272
417 HB2 GLU 57 HB2 GLU 57 12.208 -1.424 -2.888
418 HB3 GLU 57 HB3 GLU 57 13.286 -2.828 -2.904
419 HG2 GLU 57 HG2 GLU 57 14.762 -1.703 -4.543
420 HG3 GLU 57 HG3 GLU 57 13.693 -0.299 -4.559
Start of MODEL 12
1 H1 MET 1 H MET 1 -16.631 0.509 2.399
2 HA MET 1 HA MET 1 -16.629 -0.326 0.100
3 HB2 MET 1 HB2 MET 1 -15.153 1.679 -0.595
4 HB3 MET 1 HB3 MET 1 -13.787 0.695 -0.136
5 HG2 MET 1 HG2 MET 1 -14.285 0.473 -2.534
6 HG3 MET 1 HG3 MET 1 -14.574 -1.056 -1.708
7 HE1 MET 1 HE1 MET 1 -17.079 2.186 -2.025
8 HE2 MET 1 HE2 MET 1 -16.155 2.018 -3.546
9 HE3 MET 1 HE3 MET 1 -17.892 1.657 -3.507
10 H GLY 2 H GLY 2 -13.358 -0.299 1.968
11 HA2 GLY 2 HA2 GLY 2 -14.036 -2.655 3.243
12 HA3 GLY 2 HA3 GLY 2 -13.117 -3.067 1.769
13 H THR 3 H THR 3 -11.754 -3.846 3.710
14 HA THR 3 HA THR 3 -10.035 -1.681 4.720
15 HB THR 3 HB THR 3 -10.931 -3.101 6.468
16 HG1 THR 3 HG1 THR 3 -8.717 -2.295 6.407
17 HG21 THR 3 HG21 THR 3 -11.267 -5.226 5.231
18 HG22 THR 3 HG22 THR 3 -9.514 -5.459 5.157
19 HG23 THR 3 HG23 THR 3 -10.357 -5.457 6.726
20 H TYR 4 H TYR 4 -7.886 -1.611 3.954
21 HA TYR 4 HA TYR 4 -7.148 -3.594 1.875
22 HB2 TYR 4 HB2 TYR 4 -6.635 -0.605 1.908
23 HB3 TYR 4 HB3 TYR 4 -6.141 -1.728 0.661
24 HD1 TYR 4 HD1 TYR 4 -7.745 -2.510 -1.051
25 HD2 TYR 4 HD2 TYR 4 -9.139 0.028 2.179
26 HE1 TYR 4 HE1 TYR 4 -9.860 -2.075 -2.264
27 HE2 TYR 4 HE2 TYR 4 -11.165 0.500 0.926
28 HH TYR 4 HH TYR 4 -12.197 -1.416 -1.662
29 H LYS 5 H LYS 5 -4.977 -4.404 1.962
30 HA LYS 5 HA LYS 5 -3.511 -3.419 4.408
31 HB2 LYS 5 HB2 LYS 5 -3.703 -6.052 3.035
32 HB3 LYS 5 HB3 LYS 5 -2.144 -5.603 3.753
33 HG2 LYS 5 HG2 LYS 5 -3.271 -5.118 5.905
34 HG3 LYS 5 HG3 LYS 5 -4.834 -5.627 5.216
35 HD2 LYS 5 HD2 LYS 5 -4.095 -7.879 4.978
36 HD3 LYS 5 HD3 LYS 5 -2.398 -7.410 5.154
37 HE2 LYS 5 HE2 LYS 5 -3.000 -6.675 7.539
38 HE3 LYS 5 HE3 LYS 5 -4.496 -7.611 7.315
39 HZ1 LYS 5 HZ1 LYS 5 -2.983 -9.528 6.748
40 HZ2 LYS 5 HZ2 LYS 5 -1.705 -8.609 7.203
41 HZ3 LYS 5 HZ3 LYS 5 -2.864 -9.011 8.297
42 H LEU 6 H LEU 6 -1.546 -2.548 4.336
43 HA LEU 6 HA LEU 6 -0.332 -1.980 1.650
44 HB2 LEU 6 HB2 LEU 6 -1.277 -0.269 3.866
45 HB3 LEU 6 HB3 LEU 6 0.403 0.046 3.511
46 HG LEU 6 HG LEU 6 -1.588 -0.032 1.244
47 HD11 LEU 6 HD11 LEU 6 -2.663 1.475 2.725
48 HD12 LEU 6 HD12 LEU 6 -1.143 2.210 3.252
49 HD13 LEU 6 HD13 LEU 6 -1.747 2.498 1.611
50 HD21 LEU 6 HD21 LEU 6 1.012 1.523 1.738
51 HD22 LEU 6 HD22 LEU 6 0.871 0.046 0.790
52 HD23 LEU 6 HD23 LEU 6 0.073 1.517 0.236
53 H ILE 7 H ILE 7 1.485 -3.268 1.572
54 HA ILE 7 HA ILE 7 3.455 -3.147 3.770
55 HB ILE 7 HB ILE 7 2.482 -5.336 3.906
56 HG12 ILE 7 HG12 ILE 7 5.141 -5.656 2.438
57 HG13 ILE 7 HG13 ILE 7 5.023 -4.980 4.055
58 HG21 ILE 7 HG21 ILE 7 1.547 -5.472 1.568
59 HG22 ILE 7 HG22 ILE 7 3.183 -5.838 0.999
60 HG23 ILE 7 HG23 ILE 7 2.357 -6.940 2.113
61 HD11 ILE 7 HD11 ILE 7 4.226 -7.790 3.227
62 HD12 ILE 7 HD12 ILE 7 5.583 -7.311 4.245
63 HD13 ILE 7 HD13 ILE 7 3.920 -7.105 4.836
64 H LEU 8 H LEU 8 5.341 -2.385 3.235
65 HA LEU 8 HA LEU 8 6.010 -2.072 0.346
66 HB2 LEU 8 HB2 LEU 8 6.604 -0.185 2.647
67 HB3 LEU 8 HB3 LEU 8 7.134 -0.004 1.011
68 HG LEU 8 HG LEU 8 5.361 1.517 1.345
69 HD11 LEU 8 HD11 LEU 8 4.222 -0.822 -0.256
70 HD12 LEU 8 HD12 LEU 8 3.679 0.843 -0.350
71 HD13 LEU 8 HD13 LEU 8 5.314 0.440 -0.873
72 HD21 LEU 8 HD21 LEU 8 3.316 -0.546 2.099
73 HD22 LEU 8 HD22 LEU 8 4.310 0.283 3.319
74 HD23 LEU 8 HD23 LEU 8 3.272 1.212 2.225
75 H ASN 9 H ASN 9 8.171 -2.480 -0.304
76 HA ASN 9 HA ASN 9 10.038 -3.485 1.776
77 HB2 ASN 9 HB2 ASN 9 9.704 -4.506 -1.080
78 HB3 ASN 9 HB3 ASN 9 11.043 -4.862 -0.032
79 HD21 ASN 9 HD21 ASN 9 7.872 -6.668 1.703
80 HD22 ASN 9 HD22 ASN 9 8.149 -4.931 1.854
81 H GLY 10 H GLY 10 11.797 -2.205 1.788
82 HA2 GLY 10 HA2 GLY 10 12.681 -0.695 -0.601
83 HA3 GLY 10 HA3 GLY 10 12.465 0.108 0.969
84 H LYS 11 H LYS 11 15.033 0.073 -0.123
85 HA LYS 11 HA LYS 11 16.625 -2.134 0.424
86 HB2 LYS 11 HB2 LYS 11 17.108 0.073 -0.760
87 HB3 LYS 11 HB3 LYS 11 17.443 0.786 0.808
88 HG2 LYS 11 HG2 LYS 11 19.383 -0.612 1.100
89 HG3 LYS 11 HG3 LYS 11 18.900 -1.685 -0.232
90 HD2 LYS 11 HD2 LYS 11 19.196 0.006 -1.871
91 HD3 LYS 11 HD3 LYS 11 19.424 1.285 -0.658
92 HE2 LYS 11 HE2 LYS 11 21.545 0.382 0.011
93 HE3 LYS 11 HE3 LYS 11 21.285 -1.093 -0.946
94 HZ1 LYS 11 HZ1 LYS 11 22.751 0.499 -2.025
95 HZ2 LYS 11 HZ2 LYS 11 21.427 0.146 -2.932
96 HZ3 LYS 11 HZ3 LYS 11 21.533 1.596 -2.146
97 H THR 12 H THR 12 16.103 0.594 2.732
98 HA THR 12 HA THR 12 16.716 -1.301 4.907
99 HB THR 12 HB THR 12 18.621 0.212 4.442
100 HG1 THR 12 HG1 THR 12 17.788 -0.716 6.639
101 HG21 THR 12 HG21 THR 12 17.338 2.315 4.018
102 HG22 THR 12 HG22 THR 12 16.879 2.358 5.735
103 HG23 THR 12 HG23 THR 12 18.588 2.499 5.255
104 H LEU 13 H LEU 13 14.277 0.359 3.542
105 HA LEU 13 HA LEU 13 12.883 0.913 6.110
106 HB2 LEU 13 HB2 LEU 13 12.458 2.126 3.346
107 HB3 LEU 13 HB3 LEU 13 11.547 2.519 4.797
108 HG LEU 13 HG LEU 13 14.539 3.026 4.421
109 HD11 LEU 13 HD11 LEU 13 13.194 4.465 2.947
110 HD12 LEU 13 HD12 LEU 13 12.265 5.031 4.350
111 HD13 LEU 13 HD13 LEU 13 13.999 5.388 4.224
112 HD21 LEU 13 HD21 LEU 13 13.991 2.747 6.775
113 HD22 LEU 13 HD22 LEU 13 14.303 4.452 6.440
114 HD23 LEU 13 HD23 LEU 13 12.629 3.884 6.632
115 H LYS 14 H LYS 14 11.436 -0.652 6.537
116 HA LYS 14 HA LYS 14 9.828 -1.798 4.340
117 HB2 LYS 14 HB2 LYS 14 11.817 -3.351 4.771
118 HB3 LYS 14 HB3 LYS 14 11.232 -3.537 6.426
119 HG2 LYS 14 HG2 LYS 14 9.018 -4.363 5.445
120 HG3 LYS 14 HG3 LYS 14 9.789 -4.318 3.856
121 HD2 LYS 14 HD2 LYS 14 11.402 -6.023 4.597
122 HD3 LYS 14 HD3 LYS 14 10.677 -6.005 6.232
123 HE2 LYS 14 HE2 LYS 14 8.460 -6.611 5.222
124 HE3 LYS 14 HE3 LYS 14 9.233 -6.697 3.629
125 HZ1 LYS 14 HZ1 LYS 14 9.070 -8.863 4.531
126 HZ2 LYS 14 HZ2 LYS 14 10.647 -8.445 4.515
127 HZ3 LYS 14 HZ3 LYS 14 9.798 -8.420 5.952
128 H GLY 15 H GLY 15 7.712 -2.484 5.161
129 HA2 GLY 15 HA2 GLY 15 7.118 -2.762 7.867
130 HA3 GLY 15 HA3 GLY 15 6.812 -1.075 7.446
131 H GLU 16 H GLU 16 4.649 -2.581 8.225
132 HA GLU 16 HA GLU 16 3.120 -2.690 5.766
133 HB2 GLU 16 HB2 GLU 16 2.157 -4.882 6.246
134 HB3 GLU 16 HB3 GLU 16 3.902 -5.014 6.015
135 HG2 GLU 16 HG2 GLU 16 4.294 -5.265 8.392
136 HG3 GLU 16 HG3 GLU 16 2.609 -4.905 8.772
137 H THR 17 H THR 17 0.874 -2.512 6.064
138 HA THR 17 HA THR 17 -0.157 -2.254 8.805
139 HB THR 17 HB THR 17 1.038 -0.089 8.247
140 HG1 THR 17 HG1 THR 17 -0.198 0.147 9.814
141 HG21 THR 17 HG21 THR 17 -0.076 1.593 6.914
142 HG22 THR 17 HG22 THR 17 0.389 0.229 5.897
143 HG23 THR 17 HG23 THR 17 -1.313 0.443 6.388
144 H THR 18 H THR 18 -2.521 -1.049 8.377
145 HA THR 18 HA THR 18 -3.867 -2.226 6.077
146 HB THR 18 HB THR 18 -3.828 -3.973 7.881
147 HG1 THR 18 HG1 THR 18 -6.368 -2.986 7.151
148 HG21 THR 18 HG21 THR 18 -5.286 -3.812 9.812
149 HG22 THR 18 HG22 THR 18 -4.043 -2.551 9.879
150 HG23 THR 18 HG23 THR 18 -5.702 -2.134 9.411
151 H THR 19 H THR 19 -5.795 -1.031 5.589
152 HA THR 19 HA THR 19 -6.422 1.331 7.250
153 HB THR 19 HB THR 19 -6.301 2.734 5.272
154 HG1 THR 19 HG1 THR 19 -5.500 1.759 3.278
155 HG21 THR 19 HG21 THR 19 -3.958 2.830 4.743
156 HG22 THR 19 HG22 THR 19 -4.107 2.386 6.450
157 HG23 THR 19 HG23 THR 19 -3.695 1.153 5.239
158 H GLU 20 H GLU 20 -8.488 2.346 6.285
159 HA GLU 20 HA GLU 20 -10.352 0.455 5.012
160 HB2 GLU 20 HB2 GLU 20 -10.958 2.125 7.458
161 HB3 GLU 20 HB3 GLU 20 -12.155 1.255 6.515
162 HG2 GLU 20 HG2 GLU 20 -11.389 -0.875 7.216
163 HG3 GLU 20 HG3 GLU 20 -9.856 -0.234 7.848
164 H ALA 21 H ALA 21 -11.991 1.661 3.711
165 HA ALA 21 HA ALA 21 -11.806 4.584 3.724
166 HB1 ALA 21 HB1 ALA 21 -11.370 4.757 1.330
167 HB2 ALA 21 HB2 ALA 21 -10.014 3.937 2.109
168 HB3 ALA 21 HB3 ALA 21 -11.216 2.992 1.197
169 H VAL 22 H VAL 22 -13.740 5.529 2.935
170 HA VAL 22 HA VAL 22 -16.030 3.791 2.892
171 HB VAL 22 HB VAL 22 -17.341 5.792 2.357
172 HG11 VAL 22 HG11 VAL 22 -15.389 6.203 4.644
173 HG12 VAL 22 HG12 VAL 22 -17.023 6.884 4.492
174 HG13 VAL 22 HG13 VAL 22 -16.810 5.142 4.679
175 HG21 VAL 22 HG21 VAL 22 -14.700 7.313 2.449
176 HG22 VAL 22 HG22 VAL 22 -15.806 7.152 1.048
177 HG23 VAL 22 HG23 VAL 22 -16.312 8.036 2.486
178 H ASP 23 H ASP 23 -14.004 5.237 0.316
179 HA ASP 23 HA ASP 23 -15.338 3.477 -1.669
180 HB2 ASP 23 HB2 ASP 23 -16.115 5.905 -1.683
181 HB3 ASP 23 HB3 ASP 23 -14.460 6.350 -2.097
182 H ALA 24 H ALA 24 -13.778 3.012 -3.445
183 HA ALA 24 HA ALA 24 -11.095 2.571 -2.434
184 HB1 ALA 24 HB1 ALA 24 -12.290 2.220 -5.217
185 HB2 ALA 24 HB2 ALA 24 -10.663 1.713 -4.719
186 HB3 ALA 24 HB3 ALA 24 -12.079 0.963 -3.963
187 H ALA 25 H ALA 25 -12.738 5.147 -4.074
188 HA ALA 25 HA ALA 25 -10.773 6.444 -5.527
189 HB1 ALA 25 HB1 ALA 25 -13.161 7.092 -5.435
190 HB2 ALA 25 HB2 ALA 25 -12.948 7.691 -3.773
191 HB3 ALA 25 HB3 ALA 25 -12.108 8.475 -5.126
192 H THR 26 H THR 26 -11.420 6.855 -1.972
193 HA THR 26 HA THR 26 -9.121 8.631 -1.685
194 HB THR 26 HB THR 26 -10.725 7.224 0.481
195 HG1 THR 26 HG1 THR 26 -11.032 9.711 -0.838
196 HG21 THR 26 HG21 THR 26 -10.079 9.167 1.889
197 HG22 THR 26 HG22 THR 26 -8.667 8.230 1.386
198 HG23 THR 26 HG23 THR 26 -9.037 9.767 0.577
199 H ALA 27 H ALA 27 -9.754 5.124 -1.260
200 HA ALA 27 HA ALA 27 -7.439 4.512 0.241
201 HB1 ALA 27 HB1 ALA 27 -8.721 2.761 -1.906
202 HB2 ALA 27 HB2 ALA 27 -7.708 2.239 -0.551
203 HB3 ALA 27 HB3 ALA 27 -9.314 2.907 -0.235
204 H GLU 28 H GLU 28 -7.978 4.580 -3.298
205 HA GLU 28 HA GLU 28 -5.443 4.017 -4.224
206 HB2 GLU 28 HB2 GLU 28 -7.592 4.102 -5.452
207 HB3 GLU 28 HB3 GLU 28 -7.508 5.872 -5.435
208 HG2 GLU 28 HG2 GLU 28 -5.487 5.819 -6.810
209 HG3 GLU 28 HG3 GLU 28 -5.371 4.061 -6.637
210 H LYS 29 H LYS 29 -6.668 7.107 -3.025
211 HA LYS 29 HA LYS 29 -4.342 8.666 -3.930
212 HB2 LYS 29 HB2 LYS 29 -6.730 9.273 -2.131
213 HB3 LYS 29 HB3 LYS 29 -5.419 10.425 -2.428
214 HG2 LYS 29 HG2 LYS 29 -5.846 10.482 -4.783
215 HG3 LYS 29 HG3 LYS 29 -6.975 9.123 -4.701
216 HD2 LYS 29 HD2 LYS 29 -8.605 10.413 -3.503
217 HD3 LYS 29 HD3 LYS 29 -7.481 11.786 -3.321
218 HE2 LYS 29 HE2 LYS 29 -7.314 11.968 -5.777
219 HE3 LYS 29 HE3 LYS 29 -8.476 10.645 -5.962
220 HZ1 LYS 29 HZ1 LYS 29 -9.046 13.278 -4.711
221 HZ2 LYS 29 HZ2 LYS 29 -9.522 12.762 -6.208
222 HZ3 LYS 29 HZ3 LYS 29 -10.105 12.039 -4.849
223 H VAL 30 H VAL 30 -5.591 7.548 -0.728
224 HA VAL 30 HA VAL 30 -3.322 8.488 0.626
225 HB VAL 30 HB VAL 30 -5.603 7.852 1.622
226 HG11 VAL 30 HG11 VAL 30 -4.123 5.237 2.147
227 HG12 VAL 30 HG12 VAL 30 -5.702 5.728 2.798
228 HG13 VAL 30 HG13 VAL 30 -5.529 5.429 1.062
229 HG21 VAL 30 HG21 VAL 30 -4.572 7.656 3.850
230 HG22 VAL 30 HG22 VAL 30 -3.000 7.255 3.120
231 HG23 VAL 30 HG23 VAL 30 -3.727 8.850 2.868
232 H PHE 31 H PHE 31 -3.754 5.425 -1.179
233 HA PHE 31 HA PHE 31 -1.624 3.968 -0.077
234 HB2 PHE 31 HB2 PHE 31 -2.325 4.305 -3.025
235 HB3 PHE 31 HB3 PHE 31 -1.304 3.055 -2.365
236 HD1 PHE 31 HD1 PHE 31 -3.367 2.467 0.075
237 HD2 PHE 31 HD2 PHE 31 -3.557 2.641 -4.227
238 HE1 PHE 31 HE1 PHE 31 -5.324 0.950 0.091
239 HE2 PHE 31 HE2 PHE 31 -5.524 1.159 -4.202
240 HZ PHE 31 HZ PHE 31 -6.458 0.356 -2.040
241 H LYS 32 H LYS 32 -1.494 6.545 -2.605
242 HA LYS 32 HA LYS 32 1.356 6.355 -3.017
243 HB2 LYS 32 HB2 LYS 32 -0.235 7.380 -4.626
244 HB3 LYS 32 HB3 LYS 32 -0.626 8.649 -3.472
245 HG2 LYS 32 HG2 LYS 32 1.694 9.493 -3.591
246 HG3 LYS 32 HG3 LYS 32 2.117 8.168 -4.707
247 HD2 LYS 32 HD2 LYS 32 0.484 8.997 -6.345
248 HD3 LYS 32 HD3 LYS 32 -0.025 10.277 -5.220
249 HE2 LYS 32 HE2 LYS 32 2.254 11.240 -5.264
250 HE3 LYS 32 HE3 LYS 32 2.782 9.959 -6.361
251 HZ1 LYS 32 HZ1 LYS 32 0.725 11.988 -6.918
252 HZ2 LYS 32 HZ2 LYS 32 2.223 11.952 -7.572
253 HZ3 LYS 32 HZ3 LYS 32 1.140 10.769 -7.969
254 H GLN 33 H GLN 33 -0.646 8.597 -1.091
255 HA GLN 33 HA GLN 33 1.436 10.193 -0.045
256 HB2 GLN 33 HB2 GLN 33 -0.971 10.744 0.016
257 HB3 GLN 33 HB3 GLN 33 -1.277 9.388 1.104
258 HG2 GLN 33 HG2 GLN 33 0.155 10.497 2.835
259 HG3 GLN 33 HG3 GLN 33 0.336 11.881 1.757
260 HE21 GLN 33 HE21 GLN 33 -3.000 11.526 4.067
261 HE22 GLN 33 HE22 GLN 33 -1.790 10.292 4.107
262 H TYR 34 H TYR 34 -0.155 7.336 1.414
263 HA TYR 34 HA TYR 34 1.424 7.264 3.735
264 HB2 TYR 34 HB2 TYR 34 -0.815 6.243 3.542
265 HB3 TYR 34 HB3 TYR 34 -0.185 5.051 2.389
266 HD1 TYR 34 HD1 TYR 34 0.979 3.108 3.185
267 HD2 TYR 34 HD2 TYR 34 0.177 6.387 5.809
268 HE1 TYR 34 HE1 TYR 34 2.294 1.961 4.925
269 HE2 TYR 34 HE2 TYR 34 1.474 5.244 7.633
270 HH TYR 34 HH TYR 34 3.409 3.645 7.696
271 H ALA 35 H ALA 35 1.665 5.170 0.746
272 HA ALA 35 HA ALA 35 3.848 3.695 1.746
273 HB1 ALA 35 HB1 ALA 35 3.209 4.359 -1.152
274 HB2 ALA 35 HB2 ALA 35 4.227 3.031 -0.573
275 HB3 ALA 35 HB3 ALA 35 2.504 3.022 -0.195
276 H ASN 36 H ASN 36 3.815 6.863 0.060
277 HA ASN 36 HA ASN 36 6.560 7.060 -0.460
278 HB2 ASN 36 HB2 ASN 36 4.846 8.608 -1.317
279 HB3 ASN 36 HB3 ASN 36 4.691 9.319 0.297
280 HD21 ASN 36 HD21 ASN 36 8.209 9.922 -1.857
281 HD22 ASN 36 HD22 ASN 36 7.199 8.553 -2.231
282 H ASP 37 H ASP 37 4.924 7.384 2.685
283 HA ASP 37 HA ASP 37 6.905 8.799 4.124
284 HB2 ASP 37 HB2 ASP 37 4.634 8.245 4.972
285 HB3 ASP 37 HB3 ASP 37 5.101 6.524 5.062
286 H ASN 38 H ASN 38 6.817 5.473 3.010
287 HA ASN 38 HA ASN 38 9.084 4.604 4.677
288 HB2 ASN 38 HB2 ASN 38 7.142 3.274 2.811
289 HB3 ASN 38 HB3 ASN 38 8.725 2.528 2.995
290 HD21 ASN 38 HD21 ASN 38 6.153 1.330 5.576
291 HD22 ASN 38 HD22 ASN 38 5.852 1.836 3.919
292 H GLY 39 H GLY 39 9.097 6.683 2.115
293 HA2 GLY 39 HA2 GLY 39 10.703 7.260 0.563
294 HA3 GLY 39 HA3 GLY 39 11.830 6.304 1.551
295 H VAL 40 H VAL 40 8.979 5.057 -0.034
296 HA VAL 40 HA VAL 40 10.352 2.885 -1.235
297 HB VAL 40 HB VAL 40 8.060 2.307 -2.000
298 HG11 VAL 40 HG11 VAL 40 7.049 2.107 0.161
299 HG12 VAL 40 HG12 VAL 40 8.796 1.815 0.315
300 HG13 VAL 40 HG13 VAL 40 8.086 3.367 0.826
301 HG21 VAL 40 HG21 VAL 40 7.350 5.114 -1.018
302 HG22 VAL 40 HG22 VAL 40 7.048 4.405 -2.614
303 HG23 VAL 40 HG23 VAL 40 6.165 3.836 -1.206
304 H ASP 41 H ASP 41 10.692 2.255 -3.174
305 HA ASP 41 HA ASP 41 9.944 3.718 -5.591
306 HB2 ASP 41 HB2 ASP 41 12.240 4.493 -4.853
307 HB3 ASP 41 HB3 ASP 41 12.798 2.817 -4.983
308 H GLY 42 H GLY 42 9.087 1.981 -7.023
309 HA2 GLY 42 HA2 GLY 42 10.081 -0.452 -7.483
310 HA3 GLY 42 HA3 GLY 42 9.279 -0.744 -5.929
311 H GLU 43 H GLU 43 8.354 -2.172 -7.880
312 HA GLU 43 HA GLU 43 6.097 -0.921 -9.252
313 HB2 GLU 43 HB2 GLU 43 5.836 -2.890 -10.500
314 HB3 GLU 43 HB3 GLU 43 7.541 -2.465 -10.521
315 HG2 GLU 43 HG2 GLU 43 7.999 -4.235 -8.834
316 HG3 GLU 43 HG3 GLU 43 6.281 -4.673 -8.841
317 H TRP 44 H TRP 44 3.921 -1.602 -8.998
318 HA TRP 44 HA TRP 44 3.328 -2.690 -6.311
319 HB2 TRP 44 HB2 TRP 44 1.877 -0.818 -8.181
320 HB3 TRP 44 HB3 TRP 44 1.211 -1.409 -6.669
321 HD1 TRP 44 HD1 TRP 44 4.638 0.307 -7.536
322 HE1 TRP 44 HE1 TRP 44 5.211 1.859 -5.665
323 HE3 TRP 44 HE3 TRP 44 0.416 -0.184 -4.634
324 HZ2 TRP 44 HZ2 TRP 44 3.611 3.533 -3.805
325 HZ3 TRP 44 HZ3 TRP 44 -0.047 1.484 -2.911
326 HH2 TRP 44 HH2 TRP 44 1.501 3.372 -2.503
327 H THR 45 H THR 45 2.312 -4.526 -6.092
328 HA THR 45 HA THR 45 0.622 -5.692 -8.241
329 HB THR 45 HB THR 45 2.236 -7.243 -6.183
330 HG1 THR 45 HG1 THR 45 3.739 -6.167 -7.408
331 HG21 THR 45 HG21 THR 45 2.021 -9.108 -7.754
332 HG22 THR 45 HG22 THR 45 0.424 -8.507 -7.293
333 HG23 THR 45 HG23 THR 45 1.106 -8.085 -8.879
334 H TYR 46 H TYR 46 -1.301 -6.922 -7.256
335 HA TYR 46 HA TYR 46 -1.855 -6.255 -4.415
336 HB2 TYR 46 HB2 TYR 46 -2.828 -4.447 -5.537
337 HB3 TYR 46 HB3 TYR 46 -3.413 -5.414 -6.849
338 HD1 TYR 46 HD1 TYR 46 -3.940 -4.814 -3.185
339 HD2 TYR 46 HD2 TYR 46 -5.651 -6.157 -6.906
340 HE1 TYR 46 HE1 TYR 46 -6.198 -4.636 -2.211
341 HE2 TYR 46 HE2 TYR 46 -7.917 -5.992 -5.930
342 HH TYR 46 HH TYR 46 -9.104 -5.788 -3.646
343 H ASP 47 H ASP 47 -3.264 -7.573 -3.346
344 HA ASP 47 HA ASP 47 -4.225 -10.095 -4.632
345 HB2 ASP 47 HB2 ASP 47 -2.708 -9.651 -2.058
346 HB3 ASP 47 HB3 ASP 47 -3.909 -10.941 -2.167
347 H ASP 48 H ASP 48 -6.364 -9.403 -4.866
348 HA ASP 48 HA ASP 48 -7.714 -7.725 -3.033
349 HB2 ASP 48 HB2 ASP 48 -8.487 -8.142 -5.362
350 HB3 ASP 48 HB3 ASP 48 -8.969 -9.776 -4.888
351 H ALA 49 H ALA 49 -7.178 -11.162 -2.843
352 HA ALA 49 HA ALA 49 -9.269 -11.959 -1.159
353 HB1 ALA 49 HB1 ALA 49 -7.644 -13.480 -2.213
354 HB2 ALA 49 HB2 ALA 49 -6.370 -12.916 -1.102
355 HB3 ALA 49 HB3 ALA 49 -7.780 -13.795 -0.474
356 H THR 50 H THR 50 -6.292 -10.264 -0.250
357 HA THR 50 HA THR 50 -7.336 -9.874 2.518
358 HB THR 50 HB THR 50 -5.651 -11.442 2.803
359 HG1 THR 50 HG1 THR 50 -4.770 -8.855 3.237
360 HG21 THR 50 HG21 THR 50 -3.977 -9.990 0.732
361 HG22 THR 50 HG22 THR 50 -3.338 -11.232 1.832
362 HG23 THR 50 HG23 THR 50 -4.598 -11.647 0.676
363 H LYS 51 H LYS 51 -6.743 -8.310 -0.378
364 HA LYS 51 HA LYS 51 -6.563 -6.503 -1.201
365 HB2 LYS 51 HB2 LYS 51 -7.658 -5.575 1.452
366 HB3 LYS 51 HB3 LYS 51 -7.494 -4.534 0.005
367 HG2 LYS 51 HG2 LYS 51 -8.839 -6.203 -1.276
368 HG3 LYS 51 HG3 LYS 51 -9.137 -7.083 0.223
369 HD2 LYS 51 HD2 LYS 51 -10.536 -5.454 1.092
370 HD3 LYS 51 HD3 LYS 51 -9.863 -4.157 0.094
371 HE2 LYS 51 HE2 LYS 51 -12.177 -4.897 -0.522
372 HE3 LYS 51 HE3 LYS 51 -11.012 -4.917 -1.856
373 HZ1 LYS 51 HZ1 LYS 51 -10.940 -7.162 -1.871
374 HZ2 LYS 51 HZ2 LYS 51 -11.494 -7.355 -0.306
375 HZ3 LYS 51 HZ3 LYS 51 -12.521 -6.943 -1.518
376 H THR 52 H THR 52 -4.300 -7.732 0.058
377 HA THR 52 HA THR 52 -2.574 -5.709 1.087
378 HB THR 52 HB THR 52 -2.018 -8.519 0.056
379 HG1 THR 52 HG1 THR 52 -2.023 -8.814 2.430
380 HG21 THR 52 HG21 THR 52 -0.431 -6.711 1.936
381 HG22 THR 52 HG22 THR 52 -0.031 -8.396 1.524
382 HG23 THR 52 HG23 THR 52 0.042 -7.144 0.282
383 H PHE 53 H PHE 53 -1.381 -4.344 0.006
384 HA PHE 53 HA PHE 53 -0.958 -4.625 -2.935
385 HB2 PHE 53 HB2 PHE 53 -1.088 -2.270 -1.017
386 HB3 PHE 53 HB3 PHE 53 -0.440 -2.147 -2.645
387 HD1 PHE 53 HD1 PHE 53 -1.802 -2.283 -4.641
388 HD2 PHE 53 HD2 PHE 53 -3.533 -2.461 -0.688
389 HE1 PHE 53 HE1 PHE 53 -4.037 -1.818 -5.591
390 HE2 PHE 53 HE2 PHE 53 -5.743 -1.955 -1.648
391 HZ PHE 53 HZ PHE 53 -6.012 -1.628 -4.111
392 H THR 54 H THR 54 1.026 -5.579 -3.178
393 HA THR 54 HA THR 54 3.148 -5.185 -1.151
394 HB THR 54 HB THR 54 4.109 -7.161 -2.348
395 HG1 THR 54 HG1 THR 54 3.044 -6.643 -4.355
396 HG21 THR 54 HG21 THR 54 2.569 -8.837 -1.604
397 HG22 THR 54 HG22 THR 54 2.461 -7.510 -0.451
398 HG23 THR 54 HG23 THR 54 1.191 -7.724 -1.676
399 H VAL 55 H VAL 55 5.157 -4.285 -1.694
400 HA VAL 55 HA VAL 55 5.617 -3.377 -4.474
401 HB VAL 55 HB VAL 55 5.726 -1.778 -1.928
402 HG11 VAL 55 HG11 VAL 55 7.300 -1.079 -4.459
403 HG12 VAL 55 HG12 VAL 55 7.057 -0.036 -3.048
404 HG13 VAL 55 HG13 VAL 55 8.011 -1.495 -2.879
405 HG21 VAL 55 HG21 VAL 55 3.762 -1.713 -3.539
406 HG22 VAL 55 HG22 VAL 55 4.560 -0.157 -3.354
407 HG23 VAL 55 HG23 VAL 55 4.900 -1.152 -4.795
408 H THR 56 H THR 56 7.699 -3.654 -5.227
409 HA THR 56 HA THR 56 9.614 -4.945 -3.356
410 HB THR 56 HB THR 56 10.186 -6.459 -5.256
411 HG1 THR 56 HG1 THR 56 9.237 -5.138 -6.875
412 HG21 THR 56 HG21 THR 56 8.657 -7.214 -3.452
413 HG22 THR 56 HG22 THR 56 7.261 -6.647 -4.405
414 HG23 THR 56 HG23 THR 56 8.287 -7.946 -5.023
415 H GLU 57 H GLU 57 11.163 -3.347 -3.108
416 HA GLU 57 HA GLU 57 11.882 -1.560 -5.296
417 HB2 GLU 57 HB2 GLU 57 12.075 -0.949 -2.852
418 HB3 GLU 57 HB3 GLU 57 13.305 -2.188 -2.669
419 HG2 GLU 57 HG2 GLU 57 14.481 -0.792 -4.660
420 HG3 GLU 57 HG3 GLU 57 13.465 0.501 -4.029
Start of MODEL 13
1 H1 MET 1 H MET 1 -16.953 1.184 2.654
2 HA MET 1 HA MET 1 -17.122 0.014 0.453
3 HB2 MET 1 HB2 MET 1 -15.511 1.582 -0.632
4 HB3 MET 1 HB3 MET 1 -14.189 0.844 0.282
5 HG2 MET 1 HG2 MET 1 -14.279 -0.039 -2.009
6 HG3 MET 1 HG3 MET 1 -14.649 -1.325 -0.841
7 HE1 MET 1 HE1 MET 1 -16.347 1.489 -3.082
8 HE2 MET 1 HE2 MET 1 -15.580 0.257 -4.107
9 HE3 MET 1 HE3 MET 1 -17.348 0.429 -4.107
10 H GLY 2 H GLY 2 -13.735 -0.612 1.371
11 HA2 GLY 2 HA2 GLY 2 -14.492 -2.170 3.735
12 HA3 GLY 2 HA3 GLY 2 -13.833 -3.105 2.409
13 H THR 3 H THR 3 -11.974 -3.724 3.497
14 HA THR 3 HA THR 3 -10.056 -1.628 4.385
15 HB THR 3 HB THR 3 -10.917 -3.047 6.237
16 HG1 THR 3 HG1 THR 3 -8.741 -2.303 6.218
17 HG21 THR 3 HG21 THR 3 -11.434 -5.138 5.111
18 HG22 THR 3 HG22 THR 3 -9.738 -5.338 4.622
19 HG23 THR 3 HG23 THR 3 -10.186 -5.442 6.335
20 H TYR 4 H TYR 4 -7.804 -2.078 4.042
21 HA TYR 4 HA TYR 4 -7.146 -4.072 1.969
22 HB2 TYR 4 HB2 TYR 4 -6.348 -1.168 1.619
23 HB3 TYR 4 HB3 TYR 4 -6.226 -2.479 0.455
24 HD1 TYR 4 HD1 TYR 4 -8.379 -3.391 -0.595
25 HD2 TYR 4 HD2 TYR 4 -8.316 0.140 1.890
26 HE1 TYR 4 HE1 TYR 4 -10.619 -2.762 -1.441
27 HE2 TYR 4 HE2 TYR 4 -10.575 0.764 1.037
28 HH TYR 4 HH TYR 4 -12.387 -1.290 -1.248
29 H LYS 5 H LYS 5 -5.238 -5.030 2.343
30 HA LYS 5 HA LYS 5 -3.482 -3.930 4.434
31 HB2 LYS 5 HB2 LYS 5 -4.370 -6.472 3.867
32 HB3 LYS 5 HB3 LYS 5 -2.751 -6.517 3.157
33 HG2 LYS 5 HG2 LYS 5 -2.024 -5.474 5.497
34 HG3 LYS 5 HG3 LYS 5 -3.607 -6.052 6.033
35 HD2 LYS 5 HD2 LYS 5 -2.880 -8.330 4.971
36 HD3 LYS 5 HD3 LYS 5 -1.235 -7.646 5.037
37 HE2 LYS 5 HE2 LYS 5 -1.628 -7.129 7.485
38 HE3 LYS 5 HE3 LYS 5 -3.168 -7.993 7.379
39 HZ1 LYS 5 HZ1 LYS 5 -2.049 -10.009 6.984
40 HZ2 LYS 5 HZ2 LYS 5 -0.611 -9.285 6.651
41 HZ3 LYS 5 HZ3 LYS 5 -1.181 -9.307 8.192
42 H LEU 6 H LEU 6 -1.205 -3.663 4.304
43 HA LEU 6 HA LEU 6 -0.080 -3.241 1.607
44 HB2 LEU 6 HB2 LEU 6 -0.845 -1.187 3.624
45 HB3 LEU 6 HB3 LEU 6 0.789 -1.014 2.991
46 HG LEU 6 HG LEU 6 -1.407 -1.372 0.981
47 HD11 LEU 6 HD11 LEU 6 -2.543 0.268 2.316
48 HD12 LEU 6 HD12 LEU 6 -1.032 1.137 2.660
49 HD13 LEU 6 HD13 LEU 6 -1.725 1.192 1.038
50 HD21 LEU 6 HD21 LEU 6 1.106 0.334 1.157
51 HD22 LEU 6 HD22 LEU 6 0.917 -1.183 0.262
52 HD23 LEU 6 HD23 LEU 6 0.020 0.265 -0.248
53 H ILE 7 H ILE 7 2.205 -3.469 1.541
54 HA ILE 7 HA ILE 7 3.771 -3.156 3.954
55 HB ILE 7 HB ILE 7 3.330 -5.461 4.283
56 HG12 ILE 7 HG12 ILE 7 6.021 -5.375 2.867
57 HG13 ILE 7 HG13 ILE 7 5.708 -4.750 4.492
58 HG21 ILE 7 HG21 ILE 7 2.408 -5.940 1.985
59 HG22 ILE 7 HG22 ILE 7 4.077 -6.088 1.397
60 HG23 ILE 7 HG23 ILE 7 3.473 -7.215 2.608
61 HD11 ILE 7 HD11 ILE 7 5.570 -7.647 3.580
62 HD12 ILE 7 HD12 ILE 7 6.666 -6.911 4.760
63 HD13 ILE 7 HD13 ILE 7 4.944 -7.081 5.149
64 H LEU 8 H LEU 8 5.386 -1.828 3.340
65 HA LEU 8 HA LEU 8 6.285 -1.697 0.561
66 HB2 LEU 8 HB2 LEU 8 7.132 -0.178 3.073
67 HB3 LEU 8 HB3 LEU 8 7.627 0.214 1.429
68 HG LEU 8 HG LEU 8 5.928 1.780 1.957
69 HD11 LEU 8 HD11 LEU 8 4.354 -0.415 0.539
70 HD12 LEU 8 HD12 LEU 8 4.122 1.342 0.420
71 HD13 LEU 8 HD13 LEU 8 5.563 0.598 -0.278
72 HD21 LEU 8 HD21 LEU 8 3.757 -0.072 2.688
73 HD22 LEU 8 HD22 LEU 8 5.113 -0.091 3.825
74 HD23 LEU 8 HD23 LEU 8 4.280 1.437 3.469
75 H ASN 9 H ASN 9 8.265 -2.418 -0.198
76 HA ASN 9 HA ASN 9 10.306 -3.318 1.766
77 HB2 ASN 9 HB2 ASN 9 9.641 -4.557 -0.949
78 HB3 ASN 9 HB3 ASN 9 11.040 -4.980 0.029
79 HD21 ASN 9 HD21 ASN 9 7.364 -6.530 0.835
80 HD22 ASN 9 HD22 ASN 9 7.575 -5.320 -0.425
81 H GLY 10 H GLY 10 11.383 -1.278 1.758
82 HA2 GLY 10 HA2 GLY 10 12.809 -0.637 -0.783
83 HA3 GLY 10 HA3 GLY 10 12.530 0.497 0.524
84 H LYS 11 H LYS 11 14.984 0.567 -0.098
85 HA LYS 11 HA LYS 11 16.733 -1.519 0.156
86 HB2 LYS 11 HB2 LYS 11 17.279 0.726 -0.744
87 HB3 LYS 11 HB3 LYS 11 17.310 1.387 0.895
88 HG2 LYS 11 HG2 LYS 11 19.287 0.053 1.438
89 HG3 LYS 11 HG3 LYS 11 19.086 -0.923 -0.027
90 HD2 LYS 11 HD2 LYS 11 19.592 1.031 -1.432
91 HD3 LYS 11 HD3 LYS 11 19.712 2.060 0.017
92 HE2 LYS 11 HE2 LYS 11 21.533 0.512 0.866
93 HE3 LYS 11 HE3 LYS 11 21.481 -0.329 -0.687
94 HZ1 LYS 11 HZ1 LYS 11 23.220 1.333 -0.681
95 HZ2 LYS 11 HZ2 LYS 11 22.067 1.780 -1.761
96 HZ3 LYS 11 HZ3 LYS 11 22.159 2.533 -0.304
97 H THR 12 H THR 12 16.022 0.646 2.948
98 HA THR 12 HA THR 12 16.550 -1.588 4.805
99 HB THR 12 HB THR 12 18.659 -0.451 4.892
100 HG1 THR 12 HG1 THR 12 17.212 0.793 6.965
101 HG21 THR 12 HG21 THR 12 18.912 1.965 5.241
102 HG22 THR 12 HG22 THR 12 18.009 1.650 3.745
103 HG23 THR 12 HG23 THR 12 17.150 2.171 5.207
104 H LEU 13 H LEU 13 14.133 -0.368 3.729
105 HA LEU 13 HA LEU 13 12.958 0.846 6.158
106 HB2 LEU 13 HB2 LEU 13 12.835 1.917 3.301
107 HB3 LEU 13 HB3 LEU 13 11.800 2.486 4.607
108 HG LEU 13 HG LEU 13 14.832 2.650 4.765
109 HD11 LEU 13 HD11 LEU 13 13.719 3.961 2.768
110 HD12 LEU 13 HD12 LEU 13 13.086 5.016 4.048
111 HD13 LEU 13 HD13 LEU 13 14.830 4.831 3.847
112 HD21 LEU 13 HD21 LEU 13 13.719 2.824 6.902
113 HD22 LEU 13 HD22 LEU 13 14.265 4.441 6.427
114 HD23 LEU 13 HD23 LEU 13 12.551 4.001 6.262
115 H LYS 14 H LYS 14 11.597 -0.791 6.700
116 HA LYS 14 HA LYS 14 9.626 -1.654 4.634
117 HB2 LYS 14 HB2 LYS 14 10.824 -3.453 6.785
118 HB3 LYS 14 HB3 LYS 14 9.746 -3.943 5.474
119 HG2 LYS 14 HG2 LYS 14 11.614 -3.096 3.872
120 HG3 LYS 14 HG3 LYS 14 12.633 -2.961 5.314
121 HD2 LYS 14 HD2 LYS 14 12.229 -5.387 5.783
122 HD3 LYS 14 HD3 LYS 14 11.292 -5.492 4.270
123 HE2 LYS 14 HE2 LYS 14 13.160 -5.281 2.925
124 HE3 LYS 14 HE3 LYS 14 14.012 -4.250 4.081
125 HZ1 LYS 14 HZ1 LYS 14 15.175 -6.205 4.255
126 HZ2 LYS 14 HZ2 LYS 14 14.077 -6.452 5.454
127 HZ3 LYS 14 HZ3 LYS 14 13.874 -7.176 3.993
128 H GLY 15 H GLY 15 7.861 -3.167 6.018
129 HA2 GLY 15 HA2 GLY 15 6.701 -2.825 8.310
130 HA3 GLY 15 HA3 GLY 15 6.565 -1.158 7.789
131 H GLU 16 H GLU 16 4.609 -3.473 8.323
132 HA GLU 16 HA GLU 16 2.972 -3.260 5.854
133 HB2 GLU 16 HB2 GLU 16 2.043 -5.390 6.388
134 HB3 GLU 16 HB3 GLU 16 3.797 -5.575 6.488
135 HG2 GLU 16 HG2 GLU 16 3.467 -5.147 9.052
136 HG3 GLU 16 HG3 GLU 16 1.754 -5.467 8.729
137 H THR 17 H THR 17 0.527 -3.414 6.507
138 HA THR 17 HA THR 17 -0.393 -2.203 8.913
139 HB THR 17 HB THR 17 0.957 -0.300 7.712
140 HG1 THR 17 HG1 THR 17 -0.693 1.161 8.380
141 HG21 THR 17 HG21 THR 17 -0.563 1.021 6.154
142 HG22 THR 17 HG22 THR 17 0.135 -0.473 5.452
143 HG23 THR 17 HG23 THR 17 -1.548 -0.217 5.809
144 H THR 18 H THR 18 -2.685 -1.702 8.793
145 HA THR 18 HA THR 18 -4.103 -2.614 6.341
146 HB THR 18 HB THR 18 -4.550 -4.204 8.135
147 HG1 THR 18 HG1 THR 18 -6.691 -4.080 7.967
148 HG21 THR 18 HG21 THR 18 -5.097 -3.704 10.317
149 HG22 THR 18 HG22 THR 18 -4.079 -2.297 9.954
150 HG23 THR 18 HG23 THR 18 -5.846 -2.154 9.888
151 H THR 19 H THR 19 -5.710 -1.326 5.560
152 HA THR 19 HA THR 19 -6.221 1.291 6.874
153 HB THR 19 HB THR 19 -6.283 2.266 4.537
154 HG1 THR 19 HG1 THR 19 -5.601 -0.337 3.998
155 HG21 THR 19 HG21 THR 19 -3.917 2.662 4.364
156 HG22 THR 19 HG22 THR 19 -4.293 2.517 6.093
157 HG23 THR 19 HG23 THR 19 -3.543 1.160 5.232
158 H GLU 20 H GLU 20 -8.254 2.251 6.328
159 HA GLU 20 HA GLU 20 -10.281 0.510 5.056
160 HB2 GLU 20 HB2 GLU 20 -10.313 1.854 7.762
161 HB3 GLU 20 HB3 GLU 20 -11.825 1.589 6.890
162 HG2 GLU 20 HG2 GLU 20 -11.457 -0.832 6.911
163 HG3 GLU 20 HG3 GLU 20 -9.826 -0.613 7.571
164 H ALA 21 H ALA 21 -12.057 1.779 4.120
165 HA ALA 21 HA ALA 21 -11.765 4.641 3.746
166 HB1 ALA 21 HB1 ALA 21 -11.066 4.661 1.492
167 HB2 ALA 21 HB2 ALA 21 -10.030 3.402 2.198
168 HB3 ALA 21 HB3 ALA 21 -11.454 2.943 1.251
169 H VAL 22 H VAL 22 -13.575 5.552 2.672
170 HA VAL 22 HA VAL 22 -16.020 3.950 2.823
171 HB VAL 22 HB VAL 22 -17.121 6.221 2.443
172 HG11 VAL 22 HG11 VAL 22 -15.322 6.115 4.895
173 HG12 VAL 22 HG12 VAL 22 -16.848 6.995 4.711
174 HG13 VAL 22 HG13 VAL 22 -16.851 5.226 4.724
175 HG21 VAL 22 HG21 VAL 22 -14.250 7.142 2.557
176 HG22 VAL 22 HG22 VAL 22 -15.517 7.558 1.390
177 HG23 VAL 22 HG23 VAL 22 -15.590 8.209 3.035
178 H ASP 23 H ASP 23 -14.084 5.765 0.432
179 HA ASP 23 HA ASP 23 -15.318 4.206 -1.756
180 HB2 ASP 23 HB2 ASP 23 -16.204 6.603 -1.629
181 HB3 ASP 23 HB3 ASP 23 -14.557 7.142 -1.955
182 H ALA 24 H ALA 24 -13.800 4.061 -3.657
183 HA ALA 24 HA ALA 24 -11.236 3.180 -2.561
184 HB1 ALA 24 HB1 ALA 24 -12.737 2.767 -5.241
185 HB2 ALA 24 HB2 ALA 24 -11.136 2.042 -4.828
186 HB3 ALA 24 HB3 ALA 24 -12.524 1.585 -3.866
187 H ALA 25 H ALA 25 -12.478 5.847 -4.390
188 HA ALA 25 HA ALA 25 -10.129 6.717 -5.746
189 HB1 ALA 25 HB1 ALA 25 -12.360 7.586 -6.277
190 HB2 ALA 25 HB2 ALA 25 -12.540 8.232 -4.631
191 HB3 ALA 25 HB3 ALA 25 -11.331 8.926 -5.722
192 H THR 26 H THR 26 -11.445 7.503 -2.479
193 HA THR 26 HA THR 26 -9.386 8.983 -1.351
194 HB THR 26 HB THR 26 -10.794 6.687 0.056
195 HG1 THR 26 HG1 THR 26 -12.430 8.249 0.449
196 HG21 THR 26 HG21 THR 26 -10.494 7.888 2.053
197 HG22 THR 26 HG22 THR 26 -8.962 8.151 1.197
198 HG23 THR 26 HG23 THR 26 -10.203 9.416 1.201
199 H ALA 27 H ALA 27 -9.636 5.392 -1.375
200 HA ALA 27 HA ALA 27 -7.246 4.886 0.020
201 HB1 ALA 27 HB1 ALA 27 -8.900 3.212 -1.925
202 HB2 ALA 27 HB2 ALA 27 -7.564 2.557 -0.954
203 HB3 ALA 27 HB3 ALA 27 -8.998 3.215 -0.150
204 H GLU 28 H GLU 28 -7.883 4.989 -3.520
205 HA GLU 28 HA GLU 28 -5.411 4.245 -4.552
206 HB2 GLU 28 HB2 GLU 28 -7.436 4.516 -5.881
207 HB3 GLU 28 HB3 GLU 28 -7.492 6.248 -5.534
208 HG2 GLU 28 HG2 GLU 28 -5.815 6.730 -7.069
209 HG3 GLU 28 HG3 GLU 28 -5.002 5.176 -6.824
210 H LYS 29 H LYS 29 -6.547 7.454 -3.410
211 HA LYS 29 HA LYS 29 -4.054 8.753 -4.082
212 HB2 LYS 29 HB2 LYS 29 -6.492 9.660 -2.494
213 HB3 LYS 29 HB3 LYS 29 -5.133 10.722 -2.876
214 HG2 LYS 29 HG2 LYS 29 -5.589 10.452 -5.291
215 HG3 LYS 29 HG3 LYS 29 -6.791 9.197 -4.947
216 HD2 LYS 29 HD2 LYS 29 -8.017 11.018 -3.563
217 HD3 LYS 29 HD3 LYS 29 -6.951 12.177 -4.398
218 HE2 LYS 29 HE2 LYS 29 -7.724 11.360 -6.587
219 HE3 LYS 29 HE3 LYS 29 -8.710 10.116 -5.809
220 HZ1 LYS 29 HZ1 LYS 29 -9.117 13.032 -5.444
221 HZ2 LYS 29 HZ2 LYS 29 -9.993 12.095 -6.471
222 HZ3 LYS 29 HZ3 LYS 29 -10.078 11.835 -4.851
223 H VAL 30 H VAL 30 -5.222 7.289 -1.096
224 HA VAL 30 HA VAL 30 -3.257 8.199 0.700
225 HB VAL 30 HB VAL 30 -5.281 6.081 0.604
226 HG11 VAL 30 HG11 VAL 30 -2.739 5.440 2.159
227 HG12 VAL 30 HG12 VAL 30 -4.303 4.634 2.367
228 HG13 VAL 30 HG13 VAL 30 -3.445 4.498 0.825
229 HG21 VAL 30 HG21 VAL 30 -5.622 6.644 2.919
230 HG22 VAL 30 HG22 VAL 30 -4.075 7.515 2.993
231 HG23 VAL 30 HG23 VAL 30 -5.405 8.159 2.001
232 H PHE 31 H PHE 31 -3.211 5.586 -1.732
233 HA PHE 31 HA PHE 31 -0.994 4.126 -0.904
234 HB2 PHE 31 HB2 PHE 31 -2.016 4.727 -3.712
235 HB3 PHE 31 HB3 PHE 31 -0.833 3.483 -3.337
236 HD1 PHE 31 HD1 PHE 31 -2.370 2.821 -0.569
237 HD2 PHE 31 HD2 PHE 31 -3.549 3.112 -4.707
238 HE1 PHE 31 HE1 PHE 31 -4.280 1.297 -0.134
239 HE2 PHE 31 HE2 PHE 31 -5.460 1.589 -4.266
240 HZ PHE 31 HZ PHE 31 -5.830 0.682 -1.980
241 H LYS 32 H LYS 32 -1.099 7.157 -2.755
242 HA LYS 32 HA LYS 32 1.777 7.084 -3.265
243 HB2 LYS 32 HB2 LYS 32 -0.054 7.912 -4.868
244 HB3 LYS 32 HB3 LYS 32 -0.135 9.374 -3.878
245 HG2 LYS 32 HG2 LYS 32 2.254 9.842 -4.388
246 HG3 LYS 32 HG3 LYS 32 2.390 8.288 -5.226
247 HD2 LYS 32 HD2 LYS 32 0.332 9.305 -6.628
248 HD3 LYS 32 HD3 LYS 32 1.069 10.838 -6.098
249 HE2 LYS 32 HE2 LYS 32 3.250 10.137 -7.004
250 HE3 LYS 32 HE3 LYS 32 2.591 8.558 -7.450
251 HZ1 LYS 32 HZ1 LYS 32 1.538 11.096 -8.553
252 HZ2 LYS 32 HZ2 LYS 32 2.719 10.228 -9.293
253 HZ3 LYS 32 HZ3 LYS 32 1.227 9.573 -9.087
254 H GLN 33 H GLN 33 -0.170 8.421 -0.727
255 HA GLN 33 HA GLN 33 1.923 10.289 0.156
256 HB2 GLN 33 HB2 GLN 33 -0.366 11.047 0.317
257 HB3 GLN 33 HB3 GLN 33 -0.875 9.559 1.125
258 HG2 GLN 33 HG2 GLN 33 0.969 10.380 2.921
259 HG3 GLN 33 HG3 GLN 33 0.555 11.955 2.232
260 HE21 GLN 33 HE21 GLN 33 -2.553 9.985 4.042
261 HE22 GLN 33 HE22 GLN 33 -1.485 9.028 3.014
262 H TYR 34 H TYR 34 0.097 7.475 1.544
263 HA TYR 34 HA TYR 34 1.451 7.194 3.922
264 HB2 TYR 34 HB2 TYR 34 -0.462 5.880 3.645
265 HB3 TYR 34 HB3 TYR 34 0.050 5.270 2.077
266 HD1 TYR 34 HD1 TYR 34 0.830 3.048 1.987
267 HD2 TYR 34 HD2 TYR 34 1.139 5.239 5.686
268 HE1 TYR 34 HE1 TYR 34 1.757 1.027 3.093
269 HE2 TYR 34 HE2 TYR 34 2.080 3.212 6.801
270 HH TYR 34 HH TYR 34 2.367 0.897 6.589
271 H ALA 35 H ALA 35 2.458 5.778 0.767
272 HA ALA 35 HA ALA 35 4.480 4.095 1.987
273 HB1 ALA 35 HB1 ALA 35 3.754 4.664 -0.926
274 HB2 ALA 35 HB2 ALA 35 4.837 3.364 -0.367
275 HB3 ALA 35 HB3 ALA 35 3.114 3.330 0.071
276 H ASN 36 H ASN 36 4.442 7.023 -0.078
277 HA ASN 36 HA ASN 36 7.118 7.511 -0.519
278 HB2 ASN 36 HB2 ASN 36 5.297 8.899 -1.421
279 HB3 ASN 36 HB3 ASN 36 4.883 9.462 0.195
280 HD21 ASN 36 HD21 ASN 36 7.977 11.139 -1.893
281 HD22 ASN 36 HD22 ASN 36 7.222 9.657 -2.471
282 H ASP 37 H ASP 37 5.327 7.853 2.546
283 HA ASP 37 HA ASP 37 7.269 9.347 4.021
284 HB2 ASP 37 HB2 ASP 37 4.804 9.228 4.489
285 HB3 ASP 37 HB3 ASP 37 5.007 7.544 4.971
286 H ASN 38 H ASN 38 7.014 6.015 3.059
287 HA ASN 38 HA ASN 38 8.862 5.062 5.165
288 HB2 ASN 38 HB2 ASN 38 6.564 3.933 4.393
289 HB3 ASN 38 HB3 ASN 38 7.569 3.274 3.105
290 HD21 ASN 38 HD21 ASN 38 7.408 1.035 6.187
291 HD22 ASN 38 HD22 ASN 38 6.145 1.873 5.291
292 H GLY 39 H GLY 39 8.824 6.154 1.888
293 HA2 GLY 39 HA2 GLY 39 10.701 6.638 0.607
294 HA3 GLY 39 HA3 GLY 39 11.690 5.632 1.644
295 H VAL 40 H VAL 40 9.242 5.535 -0.926
296 HA VAL 40 HA VAL 40 10.141 2.839 -1.781
297 HB VAL 40 HB VAL 40 7.822 2.340 -2.436
298 HG11 VAL 40 HG11 VAL 40 6.757 2.488 -0.011
299 HG12 VAL 40 HG12 VAL 40 8.119 1.408 -0.353
300 HG13 VAL 40 HG13 VAL 40 8.410 2.960 0.444
301 HG21 VAL 40 HG21 VAL 40 6.820 4.789 -0.996
302 HG22 VAL 40 HG22 VAL 40 7.224 4.843 -2.721
303 HG23 VAL 40 HG23 VAL 40 5.968 3.735 -2.148
304 H ASP 41 H ASP 41 10.489 2.562 -3.975
305 HA ASP 41 HA ASP 41 9.309 4.373 -5.947
306 HB2 ASP 41 HB2 ASP 41 11.538 5.361 -5.420
307 HB3 ASP 41 HB3 ASP 41 12.301 3.819 -5.806
308 H GLY 42 H GLY 42 8.069 2.172 -5.858
309 HA2 GLY 42 HA2 GLY 42 9.617 -0.070 -7.084
310 HA3 GLY 42 HA3 GLY 42 8.492 -0.281 -5.759
311 H GLU 43 H GLU 43 6.915 -1.530 -6.621
312 HA GLU 43 HA GLU 43 5.253 -0.624 -8.828
313 HB2 GLU 43 HB2 GLU 43 5.639 -2.531 -10.236
314 HB3 GLU 43 HB3 GLU 43 7.206 -1.772 -9.935
315 HG2 GLU 43 HG2 GLU 43 7.569 -3.532 -8.109
316 HG3 GLU 43 HG3 GLU 43 6.092 -4.320 -8.688
317 H TRP 44 H TRP 44 3.184 -1.735 -8.756
318 HA TRP 44 HA TRP 44 2.727 -2.668 -5.968
319 HB2 TRP 44 HB2 TRP 44 1.278 -0.684 -7.736
320 HB3 TRP 44 HB3 TRP 44 0.461 -1.448 -6.377
321 HD1 TRP 44 HD1 TRP 44 3.847 0.395 -6.895
322 HE1 TRP 44 HE1 TRP 44 4.186 2.077 -4.987
323 HE3 TRP 44 HE3 TRP 44 -0.416 -0.548 -4.219
324 HZ2 TRP 44 HZ2 TRP 44 2.754 2.959 -2.637
325 HZ3 TRP 44 HZ3 TRP 44 -0.912 0.746 -2.165
326 HH2 TRP 44 HH2 TRP 44 0.657 2.496 -1.363
327 H THR 45 H THR 45 1.702 -4.551 -5.665
328 HA THR 45 HA THR 45 0.373 -5.900 -7.957
329 HB THR 45 HB THR 45 2.380 -7.154 -6.039
330 HG1 THR 45 HG1 THR 45 3.258 -5.765 -7.687
331 HG21 THR 45 HG21 THR 45 2.246 -9.039 -7.807
332 HG22 THR 45 HG22 THR 45 0.902 -8.889 -6.658
333 HG23 THR 45 HG23 THR 45 0.727 -8.275 -8.313
334 H TYR 46 H TYR 46 -1.601 -6.555 -7.464
335 HA TYR 46 HA TYR 46 -2.447 -6.411 -4.631
336 HB2 TYR 46 HB2 TYR 46 -3.543 -4.909 -6.265
337 HB3 TYR 46 HB3 TYR 46 -4.035 -6.298 -7.226
338 HD1 TYR 46 HD1 TYR 46 -4.335 -4.869 -3.745
339 HD2 TYR 46 HD2 TYR 46 -6.150 -7.236 -6.857
340 HE1 TYR 46 HE1 TYR 46 -6.445 -4.956 -2.438
341 HE2 TYR 46 HE2 TYR 46 -8.274 -7.327 -5.549
342 HH TYR 46 HH TYR 46 -9.364 -6.653 -3.672
343 H ASP 47 H ASP 47 -2.635 -8.298 -3.541
344 HA ASP 47 HA ASP 47 -3.870 -10.665 -4.803
345 HB2 ASP 47 HB2 ASP 47 -2.507 -10.152 -2.134
346 HB3 ASP 47 HB3 ASP 47 -3.410 -11.627 -2.477
347 H ASP 48 H ASP 48 -6.042 -10.812 -4.763
348 HA ASP 48 HA ASP 48 -7.708 -8.846 -3.487
349 HB2 ASP 48 HB2 ASP 48 -8.062 -9.816 -5.779
350 HB3 ASP 48 HB3 ASP 48 -8.417 -11.372 -5.031
351 H ALA 49 H ALA 49 -6.259 -11.692 -2.347
352 HA ALA 49 HA ALA 49 -8.400 -13.033 -1.029
353 HB1 ALA 49 HB1 ALA 49 -6.270 -14.123 -1.671
354 HB2 ALA 49 HB2 ALA 49 -5.379 -13.078 -0.541
355 HB3 ALA 49 HB3 ALA 49 -6.540 -14.264 0.081
356 H THR 50 H THR 50 -5.645 -11.304 0.540
357 HA THR 50 HA THR 50 -7.457 -10.235 2.633
358 HB THR 50 HB THR 50 -5.685 -11.136 3.809
359 HG1 THR 50 HG1 THR 50 -4.956 -8.530 3.014
360 HG21 THR 50 HG21 THR 50 -3.972 -10.534 1.384
361 HG22 THR 50 HG22 THR 50 -3.251 -10.902 2.965
362 HG23 THR 50 HG23 THR 50 -4.298 -12.091 2.168
363 H LYS 51 H LYS 51 -7.037 -9.385 -0.286
364 HA LYS 51 HA LYS 51 -6.745 -7.480 -1.522
365 HB2 LYS 51 HB2 LYS 51 -7.823 -6.092 0.971
366 HB3 LYS 51 HB3 LYS 51 -7.935 -5.511 -0.695
367 HG2 LYS 51 HG2 LYS 51 -9.249 -7.737 -1.145
368 HG3 LYS 51 HG3 LYS 51 -9.319 -7.887 0.618
369 HD2 LYS 51 HD2 LYS 51 -10.666 -5.973 0.856
370 HD3 LYS 51 HD3 LYS 51 -10.187 -5.321 -0.730
371 HE2 LYS 51 HE2 LYS 51 -11.317 -7.396 -1.758
372 HE3 LYS 51 HE3 LYS 51 -12.000 -7.707 -0.157
373 HZ1 LYS 51 HZ1 LYS 51 -13.021 -5.485 -0.263
374 HZ2 LYS 51 HZ2 LYS 51 -12.441 -5.269 -1.784
375 HZ3 LYS 51 HZ3 LYS 51 -13.547 -6.446 -1.490
376 H THR 52 H THR 52 -4.302 -8.258 -0.638
377 HA THR 52 HA THR 52 -2.942 -6.117 0.846
378 HB THR 52 HB THR 52 -2.071 -8.863 -0.139
379 HG1 THR 52 HG1 THR 52 -2.579 -9.447 1.804
380 HG21 THR 52 HG21 THR 52 -0.470 -6.795 1.426
381 HG22 THR 52 HG22 THR 52 -0.023 -8.503 1.241
382 HG23 THR 52 HG23 THR 52 -0.098 -7.447 -0.181
383 H PHE 53 H PHE 53 -1.796 -4.540 -0.076
384 HA PHE 53 HA PHE 53 -0.779 -4.865 -2.837
385 HB2 PHE 53 HB2 PHE 53 -1.041 -2.468 -0.979
386 HB3 PHE 53 HB3 PHE 53 -0.177 -2.405 -2.507
387 HD1 PHE 53 HD1 PHE 53 -1.453 -2.576 -4.665
388 HD2 PHE 53 HD2 PHE 53 -3.453 -2.607 -0.844
389 HE1 PHE 53 HE1 PHE 53 -3.624 -2.166 -5.797
390 HE2 PHE 53 HE2 PHE 53 -5.624 -2.200 -1.981
391 HZ PHE 53 HZ PHE 53 -5.712 -1.983 -4.457
392 H THR 54 H THR 54 1.013 -6.151 -2.731
393 HA THR 54 HA THR 54 3.184 -5.610 -0.810
394 HB THR 54 HB THR 54 2.799 -7.745 -2.949
395 HG1 THR 54 HG1 THR 54 1.709 -8.522 -1.333
396 HG21 THR 54 HG21 THR 54 4.814 -8.816 -2.140
397 HG22 THR 54 HG22 THR 54 5.219 -7.149 -2.597
398 HG23 THR 54 HG23 THR 54 5.023 -7.579 -0.887
399 H VAL 55 H VAL 55 4.734 -4.240 -1.253
400 HA VAL 55 HA VAL 55 5.226 -3.388 -4.052
401 HB VAL 55 HB VAL 55 5.278 -1.855 -1.438
402 HG11 VAL 55 HG11 VAL 55 6.665 -1.069 -4.021
403 HG12 VAL 55 HG12 VAL 55 6.117 0.117 -2.824
404 HG13 VAL 55 HG13 VAL 55 7.321 -1.096 -2.369
405 HG21 VAL 55 HG21 VAL 55 3.129 -1.917 -2.605
406 HG22 VAL 55 HG22 VAL 55 3.818 -0.284 -2.604
407 HG23 VAL 55 HG23 VAL 55 3.886 -1.264 -4.077
408 H THR 56 H THR 56 7.153 -3.946 -4.883
409 HA THR 56 HA THR 56 9.519 -4.240 -3.100
410 HB THR 56 HB THR 56 10.489 -5.543 -5.054
411 HG1 THR 56 HG1 THR 56 9.148 -5.030 -6.698
412 HG21 THR 56 HG21 THR 56 9.628 -6.748 -3.073
413 HG22 THR 56 HG22 THR 56 7.998 -6.735 -3.777
414 HG23 THR 56 HG23 THR 56 9.300 -7.643 -4.569
415 H GLU 57 H GLU 57 11.126 -2.786 -3.332
416 HA GLU 57 HA GLU 57 11.467 -1.033 -5.641
417 HB2 GLU 57 HB2 GLU 57 11.849 -0.576 -3.072
418 HB3 GLU 57 HB3 GLU 57 13.367 -1.441 -3.314
419 HG2 GLU 57 HG2 GLU 57 13.613 0.313 -5.337
420 HG3 GLU 57 HG3 GLU 57 12.470 1.237 -4.360
Start of MODEL 14
1 H1 MET 1 H MET 1 -16.525 0.633 2.076
2 HA MET 1 HA MET 1 -16.383 -0.068 -0.226
3 HB2 MET 1 HB2 MET 1 -14.760 1.786 -0.798
4 HB3 MET 1 HB3 MET 1 -13.458 0.794 -0.167
5 HG2 MET 1 HG2 MET 1 -13.700 0.530 -2.604
6 HG3 MET 1 HG3 MET 1 -14.041 -0.987 -1.779
7 HE1 MET 1 HE1 MET 1 -16.522 2.209 -2.345
8 HE2 MET 1 HE2 MET 1 -15.508 2.050 -3.807
9 HE3 MET 1 HE3 MET 1 -17.241 1.674 -3.872
10 H GLY 2 H GLY 2 -13.004 -0.719 1.130
11 HA2 GLY 2 HA2 GLY 2 -14.008 -2.981 2.585
12 HA3 GLY 2 HA3 GLY 2 -13.111 -3.359 1.084
13 H THR 3 H THR 3 -12.018 -4.077 3.535
14 HA THR 3 HA THR 3 -10.230 -1.956 4.390
15 HB THR 3 HB THR 3 -11.084 -3.498 6.036
16 HG1 THR 3 HG1 THR 3 -8.975 -2.634 6.254
17 HG21 THR 3 HG21 THR 3 -11.326 -5.579 4.708
18 HG22 THR 3 HG22 THR 3 -9.562 -5.737 4.631
19 HG23 THR 3 HG23 THR 3 -10.404 -5.842 6.192
20 H TYR 4 H TYR 4 -7.892 -1.937 3.814
21 HA TYR 4 HA TYR 4 -7.137 -3.916 1.724
22 HB2 TYR 4 HB2 TYR 4 -6.651 -0.923 1.541
23 HB3 TYR 4 HB3 TYR 4 -6.038 -2.145 0.443
24 HD1 TYR 4 HD1 TYR 4 -7.719 -3.442 -1.065
25 HD2 TYR 4 HD2 TYR 4 -8.822 0.102 1.127
26 HE1 TYR 4 HE1 TYR 4 -9.690 -3.129 -2.517
27 HE2 TYR 4 HE2 TYR 4 -10.727 0.440 -0.324
28 HH TYR 4 HH TYR 4 -11.312 -1.391 -3.240
29 H LYS 5 H LYS 5 -5.025 -4.726 1.986
30 HA LYS 5 HA LYS 5 -3.651 -3.610 4.438
31 HB2 LYS 5 HB2 LYS 5 -3.835 -6.271 3.122
32 HB3 LYS 5 HB3 LYS 5 -2.196 -5.781 3.524
33 HG2 LYS 5 HG2 LYS 5 -3.112 -5.275 5.895
34 HG3 LYS 5 HG3 LYS 5 -4.531 -6.206 5.396
35 HD2 LYS 5 HD2 LYS 5 -3.435 -8.142 5.803
36 HD3 LYS 5 HD3 LYS 5 -2.149 -7.704 4.678
37 HE2 LYS 5 HE2 LYS 5 -1.167 -6.257 6.564
38 HE3 LYS 5 HE3 LYS 5 -2.281 -7.082 7.652
39 HZ1 LYS 5 HZ1 LYS 5 -1.218 -9.174 7.013
40 HZ2 LYS 5 HZ2 LYS 5 -0.202 -8.369 5.984
41 HZ3 LYS 5 HZ3 LYS 5 -0.091 -8.079 7.575
42 H LEU 6 H LEU 6 -1.596 -2.709 4.241
43 HA LEU 6 HA LEU 6 -0.486 -2.431 1.499
44 HB2 LEU 6 HB2 LEU 6 -1.699 -0.340 2.911
45 HB3 LEU 6 HB3 LEU 6 0.033 -0.071 3.185
46 HG LEU 6 HG LEU 6 -1.255 -0.520 0.446
47 HD11 LEU 6 HD11 LEU 6 -2.025 1.578 1.431
48 HD12 LEU 6 HD12 LEU 6 -0.354 2.082 1.735
49 HD13 LEU 6 HD13 LEU 6 -0.934 1.867 0.067
50 HD21 LEU 6 HD21 LEU 6 1.540 0.461 1.171
51 HD22 LEU 6 HD22 LEU 6 1.166 -1.144 0.506
52 HD23 LEU 6 HD23 LEU 6 0.890 0.285 -0.464
53 H ILE 7 H ILE 7 1.399 -3.494 1.474
54 HA ILE 7 HA ILE 7 3.322 -3.291 3.736
55 HB ILE 7 HB ILE 7 2.293 -5.501 3.798
56 HG12 ILE 7 HG12 ILE 7 5.094 -5.851 2.638
57 HG13 ILE 7 HG13 ILE 7 4.798 -5.091 4.194
58 HG21 ILE 7 HG21 ILE 7 1.691 -5.664 1.329
59 HG22 ILE 7 HG22 ILE 7 3.376 -6.083 1.017
60 HG23 ILE 7 HG23 ILE 7 2.382 -7.128 2.029
61 HD11 ILE 7 HD11 ILE 7 3.977 -7.931 3.495
62 HD12 ILE 7 HD12 ILE 7 5.330 -7.436 4.533
63 HD13 ILE 7 HD13 ILE 7 3.661 -7.092 5.011
64 H LEU 8 H LEU 8 5.203 -2.511 3.259
65 HA LEU 8 HA LEU 8 6.013 -2.320 0.390
66 HB2 LEU 8 HB2 LEU 8 6.679 -0.423 2.655
67 HB3 LEU 8 HB3 LEU 8 7.150 -0.261 0.983
68 HG LEU 8 HG LEU 8 5.485 1.335 1.369
69 HD11 LEU 8 HD11 LEU 8 4.144 -0.984 -0.086
70 HD12 LEU 8 HD12 LEU 8 3.688 0.717 -0.215
71 HD13 LEU 8 HD13 LEU 8 5.275 0.180 -0.787
72 HD21 LEU 8 HD21 LEU 8 3.407 -0.634 2.314
73 HD22 LEU 8 HD22 LEU 8 4.494 0.203 3.430
74 HD23 LEU 8 HD23 LEU 8 3.419 1.136 2.388
75 H ASN 9 H ASN 9 8.054 -2.952 -0.126
76 HA ASN 9 HA ASN 9 9.870 -3.726 2.105
77 HB2 ASN 9 HB2 ASN 9 8.983 -5.381 -0.220
78 HB3 ASN 9 HB3 ASN 9 10.670 -5.481 0.279
79 HD21 ASN 9 HD21 ASN 9 7.840 -7.084 2.723
80 HD22 ASN 9 HD22 ASN 9 7.466 -6.416 1.159
81 H GLY 10 H GLY 10 10.432 -1.424 1.796
82 HA2 GLY 10 HA2 GLY 10 11.786 -0.567 -0.580
83 HA3 GLY 10 HA3 GLY 10 11.843 0.184 1.027
84 H LYS 11 H LYS 11 14.169 -0.062 -0.533
85 HA LYS 11 HA LYS 11 15.730 -2.391 -0.102
86 HB2 LYS 11 HB2 LYS 11 16.423 -0.807 -1.669
87 HB3 LYS 11 HB3 LYS 11 16.418 0.526 -0.498
88 HG2 LYS 11 HG2 LYS 11 18.419 -0.528 0.613
89 HG3 LYS 11 HG3 LYS 11 18.410 -1.791 -0.650
90 HD2 LYS 11 HD2 LYS 11 18.600 -0.031 -2.369
91 HD3 LYS 11 HD3 LYS 11 18.573 1.225 -1.114
92 HE2 LYS 11 HE2 LYS 11 20.690 0.179 -0.169
93 HE3 LYS 11 HE3 LYS 11 20.723 -0.864 -1.597
94 HZ1 LYS 11 HZ1 LYS 11 22.058 0.983 -2.067
95 HZ2 LYS 11 HZ2 LYS 11 20.653 1.265 -2.916
96 HZ3 LYS 11 HZ3 LYS 11 20.973 2.076 -1.526
97 H THR 12 H THR 12 15.550 0.562 1.998
98 HA THR 12 HA THR 12 16.689 -1.181 4.108
99 HB THR 12 HB THR 12 18.169 0.583 2.901
100 HG1 THR 12 HG1 THR 12 18.332 -0.751 5.125
101 HG21 THR 12 HG21 THR 12 18.445 2.660 4.065
102 HG22 THR 12 HG22 THR 12 16.822 2.553 3.374
103 HG23 THR 12 HG23 THR 12 17.061 2.307 5.122
104 H LEU 13 H LEU 13 13.891 0.597 3.402
105 HA LEU 13 HA LEU 13 13.213 0.554 6.281
106 HB2 LEU 13 HB2 LEU 13 12.540 2.717 4.262
107 HB3 LEU 13 HB3 LEU 13 11.662 2.479 5.746
108 HG LEU 13 HG LEU 13 14.463 2.558 6.456
109 HD11 LEU 13 HD11 LEU 13 14.854 3.770 4.344
110 HD12 LEU 13 HD12 LEU 13 13.606 4.949 4.774
111 HD13 LEU 13 HD13 LEU 13 15.088 4.821 5.751
112 HD21 LEU 13 HD21 LEU 13 12.572 3.179 7.916
113 HD22 LEU 13 HD22 LEU 13 13.780 4.466 7.808
114 HD23 LEU 13 HD23 LEU 13 12.271 4.610 6.902
115 H LYS 14 H LYS 14 11.288 -0.386 6.659
116 HA LYS 14 HA LYS 14 9.579 -1.227 4.369
117 HB2 LYS 14 HB2 LYS 14 10.693 -3.105 6.496
118 HB3 LYS 14 HB3 LYS 14 9.588 -3.552 5.194
119 HG2 LYS 14 HG2 LYS 14 11.359 -3.042 3.534
120 HG3 LYS 14 HG3 LYS 14 12.486 -2.643 4.843
121 HD2 LYS 14 HD2 LYS 14 12.445 -4.864 5.724
122 HD3 LYS 14 HD3 LYS 14 11.089 -5.329 4.686
123 HE2 LYS 14 HE2 LYS 14 12.579 -4.760 2.678
124 HE3 LYS 14 HE3 LYS 14 13.914 -4.560 3.825
125 HZ1 LYS 14 HZ1 LYS 14 14.057 -6.701 3.054
126 HZ2 LYS 14 HZ2 LYS 14 13.363 -6.909 4.534
127 HZ3 LYS 14 HZ3 LYS 14 12.450 -7.027 3.158
128 H GLY 15 H GLY 15 7.493 -2.221 5.197
129 HA2 GLY 15 HA2 GLY 15 6.766 -2.075 7.914
130 HA3 GLY 15 HA3 GLY 15 6.259 -0.585 7.124
131 H GLU 16 H GLU 16 4.212 -2.087 8.083
132 HA GLU 16 HA GLU 16 2.855 -2.850 5.714
133 HB2 GLU 16 HB2 GLU 16 2.221 -5.026 6.117
134 HB3 GLU 16 HB3 GLU 16 3.964 -5.028 6.297
135 HG2 GLU 16 HG2 GLU 16 3.853 -5.527 8.585
136 HG3 GLU 16 HG3 GLU 16 2.222 -4.899 8.766
137 H THR 17 H THR 17 0.654 -2.468 5.897
138 HA THR 17 HA THR 17 -0.416 -2.023 8.662
139 HB THR 17 HB THR 17 0.566 0.116 7.912
140 HG1 THR 17 HG1 THR 17 -1.107 1.315 8.528
141 HG21 THR 17 HG21 THR 17 -0.537 1.413 6.105
142 HG22 THR 17 HG22 THR 17 0.291 -0.011 5.492
143 HG23 THR 17 HG23 THR 17 -1.481 -0.010 5.651
144 H THR 18 H THR 18 -2.812 -1.381 8.431
145 HA THR 18 HA THR 18 -4.259 -2.808 6.321
146 HB THR 18 HB THR 18 -3.883 -3.902 8.888
147 HG1 THR 18 HG1 THR 18 -4.947 -5.440 8.096
148 HG21 THR 18 HG21 THR 18 -6.077 -3.989 9.950
149 HG22 THR 18 HG22 THR 18 -5.484 -2.323 9.933
150 HG23 THR 18 HG23 THR 18 -6.738 -2.842 8.780
151 H THR 19 H THR 19 -6.223 -1.632 5.828
152 HA THR 19 HA THR 19 -6.677 0.838 7.439
153 HB THR 19 HB THR 19 -6.539 2.135 5.317
154 HG1 THR 19 HG1 THR 19 -5.644 -0.350 4.241
155 HG21 THR 19 HG21 THR 19 -4.117 2.135 4.973
156 HG22 THR 19 HG22 THR 19 -4.492 2.026 6.702
157 HG23 THR 19 HG23 THR 19 -3.931 0.610 5.787
158 H GLU 20 H GLU 20 -8.690 2.006 6.831
159 HA GLU 20 HA GLU 20 -10.798 0.390 5.460
160 HB2 GLU 20 HB2 GLU 20 -10.978 2.011 8.022
161 HB3 GLU 20 HB3 GLU 20 -12.367 1.439 7.085
162 HG2 GLU 20 HG2 GLU 20 -11.504 -0.926 7.387
163 HG3 GLU 20 HG3 GLU 20 -10.321 -0.283 8.539
164 H ALA 21 H ALA 21 -12.219 1.748 4.090
165 HA ALA 21 HA ALA 21 -12.001 4.635 4.249
166 HB1 ALA 21 HB1 ALA 21 -11.410 4.792 1.758
167 HB2 ALA 21 HB2 ALA 21 -10.082 4.425 2.848
168 HB3 ALA 21 HB3 ALA 21 -10.832 3.124 1.873
169 H VAL 22 H VAL 22 -13.736 5.619 3.293
170 HA VAL 22 HA VAL 22 -16.108 4.156 2.866
171 HB VAL 22 HB VAL 22 -17.030 6.275 1.977
172 HG11 VAL 22 HG11 VAL 22 -15.460 6.726 4.522
173 HG12 VAL 22 HG12 VAL 22 -16.989 7.464 4.036
174 HG13 VAL 22 HG13 VAL 22 -16.930 5.737 4.424
175 HG21 VAL 22 HG21 VAL 22 -14.214 7.401 2.422
176 HG22 VAL 22 HG22 VAL 22 -15.117 7.345 0.883
177 HG23 VAL 22 HG23 VAL 22 -15.681 8.360 2.204
178 H ASP 23 H ASP 23 -13.837 5.542 0.418
179 HA ASP 23 HA ASP 23 -15.009 3.708 -1.614
180 HB2 ASP 23 HB2 ASP 23 -15.895 6.094 -1.651
181 HB3 ASP 23 HB3 ASP 23 -14.257 6.621 -2.024
182 H ALA 24 H ALA 24 -13.455 3.322 -3.362
183 HA ALA 24 HA ALA 24 -10.758 2.935 -2.410
184 HB1 ALA 24 HB1 ALA 24 -11.974 2.654 -5.200
185 HB2 ALA 24 HB2 ALA 24 -10.375 2.079 -4.688
186 HB3 ALA 24 HB3 ALA 24 -11.835 1.360 -3.983
187 H ALA 25 H ALA 25 -12.474 5.472 -4.117
188 HA ALA 25 HA ALA 25 -10.447 6.769 -5.545
189 HB1 ALA 25 HB1 ALA 25 -12.841 7.400 -5.629
190 HB2 ALA 25 HB2 ALA 25 -12.772 7.972 -3.952
191 HB3 ALA 25 HB3 ALA 25 -11.853 8.804 -5.221
192 H THR 26 H THR 26 -11.415 7.338 -2.103
193 HA THR 26 HA THR 26 -9.339 9.206 -1.578
194 HB THR 26 HB THR 26 -10.755 7.487 0.493
195 HG1 THR 26 HG1 THR 26 -12.494 8.856 0.339
196 HG21 THR 26 HG21 THR 26 -10.797 9.672 1.744
197 HG22 THR 26 HG22 THR 26 -9.159 9.125 1.379
198 HG23 THR 26 HG23 THR 26 -9.893 10.428 0.417
199 H ALA 27 H ALA 27 -9.556 5.669 -1.264
200 HA ALA 27 HA ALA 27 -7.174 5.311 0.260
201 HB1 ALA 27 HB1 ALA 27 -8.530 3.355 -1.643
202 HB2 ALA 27 HB2 ALA 27 -7.374 2.965 -0.356
203 HB3 ALA 27 HB3 ALA 27 -8.970 3.606 0.065
204 H GLU 28 H GLU 28 -7.792 5.325 -3.279
205 HA GLU 28 HA GLU 28 -5.326 4.474 -4.227
206 HB2 GLU 28 HB2 GLU 28 -7.476 4.884 -5.467
207 HB3 GLU 28 HB3 GLU 28 -7.156 6.614 -5.370
208 HG2 GLU 28 HG2 GLU 28 -5.084 6.255 -6.726
209 HG3 GLU 28 HG3 GLU 28 -5.469 4.528 -6.816
210 H LYS 29 H LYS 29 -6.289 7.749 -3.201
211 HA LYS 29 HA LYS 29 -3.732 8.948 -3.897
212 HB2 LYS 29 HB2 LYS 29 -6.093 9.953 -2.242
213 HB3 LYS 29 HB3 LYS 29 -4.650 10.916 -2.603
214 HG2 LYS 29 HG2 LYS 29 -5.015 10.590 -5.030
215 HG3 LYS 29 HG3 LYS 29 -6.473 9.647 -4.688
216 HD2 LYS 29 HD2 LYS 29 -7.497 11.636 -3.629
217 HD3 LYS 29 HD3 LYS 29 -6.038 12.586 -4.027
218 HE2 LYS 29 HE2 LYS 29 -6.315 12.091 -6.405
219 HE3 LYS 29 HE3 LYS 29 -7.677 11.026 -6.074
220 HZ1 LYS 29 HZ1 LYS 29 -7.654 13.917 -5.522
221 HZ2 LYS 29 HZ2 LYS 29 -8.317 13.228 -6.858
222 HZ3 LYS 29 HZ3 LYS 29 -8.957 12.902 -5.379
223 H VAL 30 H VAL 30 -5.189 7.733 -0.815
224 HA VAL 30 HA VAL 30 -2.956 8.692 0.698
225 HB VAL 30 HB VAL 30 -5.293 7.999 1.589
226 HG11 VAL 30 HG11 VAL 30 -3.851 5.380 2.104
227 HG12 VAL 30 HG12 VAL 30 -5.477 5.867 2.651
228 HG13 VAL 30 HG13 VAL 30 -5.162 5.576 0.938
229 HG21 VAL 30 HG21 VAL 30 -4.313 7.690 3.841
230 HG22 VAL 30 HG22 VAL 30 -2.720 7.386 3.107
231 HG23 VAL 30 HG23 VAL 30 -3.499 8.977 2.941
232 H PHE 31 H PHE 31 -3.531 5.663 -1.144
233 HA PHE 31 HA PHE 31 -1.461 4.101 -0.058
234 HB2 PHE 31 HB2 PHE 31 -2.467 4.416 -2.927
235 HB3 PHE 31 HB3 PHE 31 -1.282 3.223 -2.460
236 HD1 PHE 31 HD1 PHE 31 -3.629 3.254 0.254
237 HD2 PHE 31 HD2 PHE 31 -3.108 2.007 -3.856
238 HE1 PHE 31 HE1 PHE 31 -5.328 1.507 0.556
239 HE2 PHE 31 HE2 PHE 31 -4.788 0.266 -3.544
240 HZ PHE 31 HZ PHE 31 -5.934 -0.006 -1.323
241 H LYS 32 H LYS 32 -1.209 6.606 -2.659
242 HA LYS 32 HA LYS 32 1.598 6.135 -3.049
243 HB2 LYS 32 HB2 LYS 32 0.171 7.198 -4.732
244 HB3 LYS 32 HB3 LYS 32 -0.082 8.609 -3.691
245 HG2 LYS 32 HG2 LYS 32 2.222 9.264 -3.872
246 HG3 LYS 32 HG3 LYS 32 2.697 7.693 -4.548
247 HD2 LYS 32 HD2 LYS 32 1.429 8.126 -6.579
248 HD3 LYS 32 HD3 LYS 32 0.878 9.704 -5.948
249 HE2 LYS 32 HE2 LYS 32 3.178 10.528 -5.914
250 HE3 LYS 32 HE3 LYS 32 3.801 8.932 -6.298
251 HZ1 LYS 32 HZ1 LYS 32 2.220 10.608 -8.141
252 HZ2 LYS 32 HZ2 LYS 32 3.808 10.310 -8.200
253 HZ3 LYS 32 HZ3 LYS 32 2.709 9.084 -8.471
254 H GLN 33 H GLN 33 -0.156 8.615 -1.150
255 HA GLN 33 HA GLN 33 2.078 9.991 -0.121
256 HB2 GLN 33 HB2 GLN 33 -0.128 10.889 0.044
257 HB3 GLN 33 HB3 GLN 33 -0.752 9.459 0.871
258 HG2 GLN 33 HG2 GLN 33 0.480 10.009 2.916
259 HG3 GLN 33 HG3 GLN 33 1.234 11.391 2.121
260 HE21 GLN 33 HE21 GLN 33 -2.584 11.640 3.626
261 HE22 GLN 33 HE22 GLN 33 -1.449 10.362 3.991
262 H TYR 34 H TYR 34 0.244 7.300 1.358
263 HA TYR 34 HA TYR 34 1.681 7.083 3.721
264 HB2 TYR 34 HB2 TYR 34 -0.505 6.018 3.324
265 HB3 TYR 34 HB3 TYR 34 0.211 4.918 2.155
266 HD1 TYR 34 HD1 TYR 34 1.391 2.914 2.896
267 HD2 TYR 34 HD2 TYR 34 0.313 6.000 5.682
268 HE1 TYR 34 HE1 TYR 34 2.246 1.514 4.744
269 HE2 TYR 34 HE2 TYR 34 1.223 4.631 7.562
270 HH TYR 34 HH TYR 34 2.319 2.672 8.139
271 H ALA 35 H ALA 35 2.058 5.161 0.694
272 HA ALA 35 HA ALA 35 4.279 3.699 1.684
273 HB1 ALA 35 HB1 ALA 35 3.557 4.298 -1.192
274 HB2 ALA 35 HB2 ALA 35 4.442 2.883 -0.550
275 HB3 ALA 35 HB3 ALA 35 2.730 3.075 -0.181
276 H ASN 36 H ASN 36 4.113 6.783 -0.215
277 HA ASN 36 HA ASN 36 6.885 6.968 -0.733
278 HB2 ASN 36 HB2 ASN 36 5.198 8.396 -1.829
279 HB3 ASN 36 HB3 ASN 36 4.963 9.265 -0.309
280 HD21 ASN 36 HD21 ASN 36 8.631 9.610 -2.257
281 HD22 ASN 36 HD22 ASN 36 7.581 8.309 -2.694
282 H ASP 37 H ASP 37 5.082 7.768 2.224
283 HA ASP 37 HA ASP 37 7.186 9.237 3.532
284 HB2 ASP 37 HB2 ASP 37 4.905 9.285 4.369
285 HB3 ASP 37 HB3 ASP 37 4.912 7.540 4.622
286 H ASN 38 H ASN 38 6.663 5.826 2.966
287 HA ASN 38 HA ASN 38 8.660 4.859 4.861
288 HB2 ASN 38 HB2 ASN 38 6.408 3.802 3.952
289 HB3 ASN 38 HB3 ASN 38 7.443 3.226 2.647
290 HD21 ASN 38 HD21 ASN 38 7.040 0.549 5.167
291 HD22 ASN 38 HD22 ASN 38 6.088 1.473 4.074
292 H GLY 39 H GLY 39 8.992 6.566 2.057
293 HA2 GLY 39 HA2 GLY 39 10.684 7.036 0.674
294 HA3 GLY 39 HA3 GLY 39 11.739 5.985 1.615
295 H VAL 40 H VAL 40 8.768 5.014 -0.137
296 HA VAL 40 HA VAL 40 10.234 2.905 -1.471
297 HB VAL 40 HB VAL 40 8.057 2.280 -2.386
298 HG11 VAL 40 HG11 VAL 40 6.897 1.815 -0.319
299 HG12 VAL 40 HG12 VAL 40 8.642 1.551 -0.128
300 HG13 VAL 40 HG13 VAL 40 7.881 3.003 0.548
301 HG21 VAL 40 HG21 VAL 40 7.162 4.964 -1.270
302 HG22 VAL 40 HG22 VAL 40 7.000 4.361 -2.917
303 HG23 VAL 40 HG23 VAL 40 6.034 3.659 -1.643
304 H ASP 41 H ASP 41 10.577 2.523 -3.488
305 HA ASP 41 HA ASP 41 9.872 4.277 -5.716
306 HB2 ASP 41 HB2 ASP 41 12.148 4.992 -4.840
307 HB3 ASP 41 HB3 ASP 41 12.746 3.370 -5.196
308 H GLY 42 H GLY 42 8.419 2.488 -6.500
309 HA2 GLY 42 HA2 GLY 42 9.728 0.171 -7.483
310 HA3 GLY 42 HA3 GLY 42 8.940 -0.236 -5.955
311 H GLU 43 H GLU 43 7.930 -1.701 -7.718
312 HA GLU 43 HA GLU 43 5.656 -0.452 -9.104
313 HB2 GLU 43 HB2 GLU 43 5.493 -2.319 -10.496
314 HB3 GLU 43 HB3 GLU 43 7.160 -1.773 -10.507
315 HG2 GLU 43 HG2 GLU 43 7.798 -3.628 -8.987
316 HG3 GLU 43 HG3 GLU 43 6.114 -4.180 -8.961
317 H TRP 44 H TRP 44 3.544 -1.300 -8.923
318 HA TRP 44 HA TRP 44 3.023 -2.485 -6.266
319 HB2 TRP 44 HB2 TRP 44 1.398 -0.729 -8.122
320 HB3 TRP 44 HB3 TRP 44 0.756 -1.467 -6.660
321 HD1 TRP 44 HD1 TRP 44 4.025 0.590 -7.335
322 HE1 TRP 44 HE1 TRP 44 4.501 1.988 -5.343
323 HE3 TRP 44 HE3 TRP 44 -0.160 -0.493 -4.581
324 HZ2 TRP 44 HZ2 TRP 44 3.015 3.005 -3.037
325 HZ3 TRP 44 HZ3 TRP 44 -0.621 0.736 -2.481
326 HH2 TRP 44 HH2 TRP 44 0.976 2.484 -1.690
327 H THR 45 H THR 45 2.059 -4.291 -5.957
328 HA THR 45 HA THR 45 0.576 -5.738 -8.078
329 HB THR 45 HB THR 45 2.379 -6.969 -5.932
330 HG1 THR 45 HG1 THR 45 3.774 -5.955 -7.285
331 HG21 THR 45 HG21 THR 45 2.272 -8.973 -7.363
332 HG22 THR 45 HG22 THR 45 0.651 -8.487 -6.886
333 HG23 THR 45 HG23 THR 45 1.231 -8.118 -8.527
334 H TYR 46 H TYR 46 -1.183 -7.142 -7.031
335 HA TYR 46 HA TYR 46 -1.843 -6.371 -4.240
336 HB2 TYR 46 HB2 TYR 46 -2.968 -4.785 -5.617
337 HB3 TYR 46 HB3 TYR 46 -3.458 -5.994 -6.760
338 HD1 TYR 46 HD1 TYR 46 -3.956 -5.178 -3.116
339 HD2 TYR 46 HD2 TYR 46 -5.685 -6.602 -6.802
340 HE1 TYR 46 HE1 TYR 46 -6.212 -5.119 -2.094
341 HE2 TYR 46 HE2 TYR 46 -7.935 -6.636 -5.743
342 HH TYR 46 HH TYR 46 -9.046 -6.540 -3.640
343 H ASP 47 H ASP 47 -2.860 -7.913 -3.087
344 HA ASP 47 HA ASP 47 -3.543 -10.560 -4.305
345 HB2 ASP 47 HB2 ASP 47 -2.200 -9.777 -1.680
346 HB3 ASP 47 HB3 ASP 47 -3.160 -11.247 -1.798
347 H ASP 48 H ASP 48 -5.695 -9.959 -4.678
348 HA ASP 48 HA ASP 48 -7.327 -8.383 -3.050
349 HB2 ASP 48 HB2 ASP 48 -7.785 -9.031 -5.408
350 HB3 ASP 48 HB3 ASP 48 -8.184 -10.663 -4.863
351 H ALA 49 H ALA 49 -6.608 -11.786 -2.717
352 HA ALA 49 HA ALA 49 -8.679 -12.654 -1.080
353 HB1 ALA 49 HB1 ALA 49 -7.002 -14.097 -2.064
354 HB2 ALA 49 HB2 ALA 49 -5.724 -13.417 -1.021
355 HB3 ALA 49 HB3 ALA 49 -7.044 -14.362 -0.314
356 H THR 50 H THR 50 -5.885 -10.705 -0.163
357 HA THR 50 HA THR 50 -6.895 -10.467 2.634
358 HB THR 50 HB THR 50 -5.051 -11.900 2.756
359 HG1 THR 50 HG1 THR 50 -4.376 -9.263 3.402
360 HG21 THR 50 HG21 THR 50 -3.632 -10.102 0.769
361 HG22 THR 50 HG22 THR 50 -2.770 -11.287 1.793
362 HG23 THR 50 HG23 THR 50 -3.988 -11.813 0.642
363 H LYS 51 H LYS 51 -6.466 -8.823 -0.254
364 HA LYS 51 HA LYS 51 -6.559 -7.012 -1.071
365 HB2 LYS 51 HB2 LYS 51 -7.658 -6.145 1.610
366 HB3 LYS 51 HB3 LYS 51 -7.709 -5.191 0.113
367 HG2 LYS 51 HG2 LYS 51 -8.878 -7.104 -1.021
368 HG3 LYS 51 HG3 LYS 51 -9.000 -7.915 0.547
369 HD2 LYS 51 HD2 LYS 51 -10.408 -6.200 1.423
370 HD3 LYS 51 HD3 LYS 51 -10.152 -5.156 -0.016
371 HE2 LYS 51 HE2 LYS 51 -11.253 -6.900 -1.402
372 HE3 LYS 51 HE3 LYS 51 -11.469 -7.886 0.046
373 HZ1 LYS 51 HZ1 LYS 51 -12.820 -6.045 0.973
374 HZ2 LYS 51 HZ2 LYS 51 -12.743 -5.295 -0.525
375 HZ3 LYS 51 HZ3 LYS 51 -13.446 -6.760 -0.367
376 H THR 52 H THR 52 -4.169 -8.010 0.231
377 HA THR 52 HA THR 52 -2.600 -5.863 1.185
378 HB THR 52 HB THR 52 -1.811 -8.616 0.220
379 HG1 THR 52 HG1 THR 52 -2.124 -9.207 2.312
380 HG21 THR 52 HG21 THR 52 -0.448 -6.688 2.160
381 HG22 THR 52 HG22 THR 52 0.074 -8.350 1.802
382 HG23 THR 52 HG23 THR 52 0.119 -7.127 0.532
383 H PHE 53 H PHE 53 -1.576 -4.395 0.091
384 HA PHE 53 HA PHE 53 -1.069 -4.613 -2.825
385 HB2 PHE 53 HB2 PHE 53 -1.430 -2.337 -0.844
386 HB3 PHE 53 HB3 PHE 53 -0.491 -2.088 -2.311
387 HD1 PHE 53 HD1 PHE 53 -1.498 -2.441 -4.559
388 HD2 PHE 53 HD2 PHE 53 -3.882 -2.584 -0.969
389 HE1 PHE 53 HE1 PHE 53 -3.544 -2.267 -5.917
390 HE2 PHE 53 HE2 PHE 53 -5.941 -2.389 -2.344
391 HZ PHE 53 HZ PHE 53 -5.763 -2.243 -4.845
392 H THR 54 H THR 54 0.866 -5.533 -3.082
393 HA THR 54 HA THR 54 2.977 -5.219 -1.032
394 HB THR 54 HB THR 54 2.545 -7.288 -3.235
395 HG1 THR 54 HG1 THR 54 2.297 -8.286 -0.791
396 HG21 THR 54 HG21 THR 54 4.163 -8.652 -1.965
397 HG22 THR 54 HG22 THR 54 4.907 -7.153 -2.531
398 HG23 THR 54 HG23 THR 54 4.386 -7.298 -0.831
399 H VAL 55 H VAL 55 4.907 -4.283 -1.527
400 HA VAL 55 HA VAL 55 5.582 -3.576 -4.333
401 HB VAL 55 HB VAL 55 5.688 -1.799 -1.874
402 HG11 VAL 55 HG11 VAL 55 6.888 -1.293 -4.639
403 HG12 VAL 55 HG12 VAL 55 6.783 -0.114 -3.314
404 HG13 VAL 55 HG13 VAL 55 7.799 -1.525 -3.125
405 HG21 VAL 55 HG21 VAL 55 3.499 -1.796 -3.062
406 HG22 VAL 55 HG22 VAL 55 4.329 -0.254 -3.242
407 HG23 VAL 55 HG23 VAL 55 4.339 -1.409 -4.587
408 H THR 56 H THR 56 7.707 -4.110 -4.829
409 HA THR 56 HA THR 56 9.563 -4.786 -2.629
410 HB THR 56 HB THR 56 10.352 -6.609 -4.231
411 HG1 THR 56 HG1 THR 56 9.331 -6.236 -6.112
412 HG21 THR 56 HG21 THR 56 9.024 -7.088 -2.191
413 HG22 THR 56 HG22 THR 56 7.527 -6.920 -3.155
414 HG23 THR 56 HG23 THR 56 8.669 -8.217 -3.512
415 H GLU 57 H GLU 57 11.291 -3.418 -2.746
416 HA GLU 57 HA GLU 57 11.628 -1.618 -4.978
417 HB2 GLU 57 HB2 GLU 57 12.338 -1.218 -2.575
418 HB3 GLU 57 HB3 GLU 57 13.677 -2.331 -2.815
419 HG2 GLU 57 HG2 GLU 57 14.682 -0.964 -4.498
420 HG3 GLU 57 HG3 GLU 57 13.232 0.011 -4.714
Start of MODEL 15
1 H1 MET 1 H MET 1 -16.794 0.821 3.210
2 HA MET 1 HA MET 1 -16.964 -0.258 1.052
3 HB2 MET 1 HB2 MET 1 -15.604 1.388 -0.168
4 HB3 MET 1 HB3 MET 1 -14.132 0.731 0.546
5 HG2 MET 1 HG2 MET 1 -14.525 -0.128 -1.711
6 HG3 MET 1 HG3 MET 1 -14.634 -1.436 -0.538
7 HE1 MET 1 HE1 MET 1 -17.319 1.377 -1.739
8 HE2 MET 1 HE2 MET 1 -16.356 0.831 -3.132
9 HE3 MET 1 HE3 MET 1 -18.077 0.415 -3.021
10 H GLY 2 H GLY 2 -13.554 -0.308 2.513
11 HA2 GLY 2 HA2 GLY 2 -14.119 -2.590 4.030
12 HA3 GLY 2 HA3 GLY 2 -13.452 -3.068 2.441
13 H THR 3 H THR 3 -11.832 -3.856 4.067
14 HA THR 3 HA THR 3 -9.916 -1.861 4.988
15 HB THR 3 HB THR 3 -10.540 -3.628 6.513
16 HG1 THR 3 HG1 THR 3 -8.365 -3.025 6.599
17 HG21 THR 3 HG21 THR 3 -11.161 -5.414 4.841
18 HG22 THR 3 HG22 THR 3 -9.434 -5.688 4.563
19 HG23 THR 3 HG23 THR 3 -10.141 -5.966 6.172
20 H TYR 4 H TYR 4 -7.819 -1.714 4.127
21 HA TYR 4 HA TYR 4 -7.153 -3.221 1.662
22 HB2 TYR 4 HB2 TYR 4 -6.879 -0.235 2.125
23 HB3 TYR 4 HB3 TYR 4 -6.253 -1.117 0.744
24 HD1 TYR 4 HD1 TYR 4 -7.739 -1.924 -1.038
25 HD2 TYR 4 HD2 TYR 4 -9.368 0.170 2.371
26 HE1 TYR 4 HE1 TYR 4 -9.896 -1.646 -2.227
27 HE2 TYR 4 HE2 TYR 4 -11.499 0.446 1.187
28 HH TYR 4 HH TYR 4 -12.092 -0.967 -2.058
29 H LYS 5 H LYS 5 -5.084 -4.196 1.931
30 HA LYS 5 HA LYS 5 -3.582 -3.214 4.330
31 HB2 LYS 5 HB2 LYS 5 -4.462 -5.580 4.049
32 HB3 LYS 5 HB3 LYS 5 -3.164 -5.816 2.880
33 HG2 LYS 5 HG2 LYS 5 -1.509 -5.248 4.649
34 HG3 LYS 5 HG3 LYS 5 -2.849 -4.957 5.787
35 HD2 LYS 5 HD2 LYS 5 -3.584 -7.293 5.606
36 HD3 LYS 5 HD3 LYS 5 -2.300 -7.614 4.421
37 HE2 LYS 5 HE2 LYS 5 -0.628 -6.837 6.183
38 HE3 LYS 5 HE3 LYS 5 -1.966 -6.848 7.350
39 HZ1 LYS 5 HZ1 LYS 5 -2.251 -9.246 6.747
40 HZ2 LYS 5 HZ2 LYS 5 -0.911 -9.148 5.816
41 HZ3 LYS 5 HZ3 LYS 5 -0.801 -8.919 7.437
42 H LEU 6 H LEU 6 -1.584 -2.342 4.205
43 HA LEU 6 HA LEU 6 -0.289 -1.986 1.525
44 HB2 LEU 6 HB2 LEU 6 -0.734 -0.100 3.851
45 HB3 LEU 6 HB3 LEU 6 0.558 0.195 2.698
46 HG LEU 6 HG LEU 6 -2.315 -0.178 1.782
47 HD11 LEU 6 HD11 LEU 6 -1.917 1.813 3.491
48 HD12 LEU 6 HD12 LEU 6 -1.131 2.578 2.110
49 HD13 LEU 6 HD13 LEU 6 -2.820 2.079 1.994
50 HD21 LEU 6 HD21 LEU 6 0.166 1.162 0.597
51 HD22 LEU 6 HD22 LEU 6 -0.550 -0.368 0.077
52 HD23 LEU 6 HD23 LEU 6 -1.444 1.130 -0.181
53 H ILE 7 H ILE 7 1.474 -3.216 1.501
54 HA ILE 7 HA ILE 7 3.420 -3.156 3.744
55 HB ILE 7 HB ILE 7 2.496 -5.351 3.812
56 HG12 ILE 7 HG12 ILE 7 5.054 -5.612 2.149
57 HG13 ILE 7 HG13 ILE 7 5.032 -5.089 3.825
58 HG21 ILE 7 HG21 ILE 7 1.382 -5.410 1.580
59 HG22 ILE 7 HG22 ILE 7 2.960 -5.689 0.832
60 HG23 ILE 7 HG23 ILE 7 2.282 -6.889 1.926
61 HD11 ILE 7 HD11 ILE 7 4.223 -7.795 2.785
62 HD12 ILE 7 HD12 ILE 7 5.611 -7.391 3.800
63 HD13 ILE 7 HD13 ILE 7 3.969 -7.261 4.464
64 H LEU 8 H LEU 8 5.321 -2.468 3.321
65 HA LEU 8 HA LEU 8 6.170 -2.131 0.477
66 HB2 LEU 8 HB2 LEU 8 6.783 -0.396 2.903
67 HB3 LEU 8 HB3 LEU 8 7.423 -0.170 1.290
68 HG LEU 8 HG LEU 8 5.784 1.464 1.553
69 HD11 LEU 8 HD11 LEU 8 4.463 -0.769 -0.045
70 HD12 LEU 8 HD12 LEU 8 4.045 0.924 -0.141
71 HD13 LEU 8 HD13 LEU 8 5.651 0.393 -0.659
72 HD21 LEU 8 HD21 LEU 8 3.607 -0.463 2.359
73 HD22 LEU 8 HD22 LEU 8 4.594 0.466 3.512
74 HD23 LEU 8 HD23 LEU 8 3.581 1.299 2.321
75 H ASN 9 H ASN 9 8.208 -2.832 -0.034
76 HA ASN 9 HA ASN 9 9.873 -3.967 2.137
77 HB2 ASN 9 HB2 ASN 9 9.516 -5.210 -0.602
78 HB3 ASN 9 HB3 ASN 9 10.500 -5.806 0.713
79 HD21 ASN 9 HD21 ASN 9 6.600 -6.833 0.511
80 HD22 ASN 9 HD22 ASN 9 7.365 -5.744 -0.655
81 H GLY 10 H GLY 10 10.541 -1.600 1.918
82 HA2 GLY 10 HA2 GLY 10 11.904 -0.699 -0.432
83 HA3 GLY 10 HA3 GLY 10 11.925 0.015 1.189
84 H LYS 11 H LYS 11 14.185 -0.173 -0.418
85 HA LYS 11 HA LYS 11 15.822 -2.450 0.131
86 HB2 LYS 11 HB2 LYS 11 16.288 -0.994 -1.702
87 HB3 LYS 11 HB3 LYS 11 16.424 0.429 -0.653
88 HG2 LYS 11 HG2 LYS 11 18.494 -0.326 0.275
89 HG3 LYS 11 HG3 LYS 11 18.337 -1.930 -0.485
90 HD2 LYS 11 HD2 LYS 11 18.657 -1.044 -2.670
91 HD3 LYS 11 HD3 LYS 11 18.460 0.632 -2.108
92 HE2 LYS 11 HE2 LYS 11 20.527 0.614 -0.914
93 HE3 LYS 11 HE3 LYS 11 20.664 -1.148 -1.051
94 HZ1 LYS 11 HZ1 LYS 11 22.105 0.040 -2.574
95 HZ2 LYS 11 HZ2 LYS 11 21.066 -0.987 -3.319
96 HZ3 LYS 11 HZ3 LYS 11 20.779 0.630 -3.394
97 H THR 12 H THR 12 15.194 0.474 2.048
98 HA THR 12 HA THR 12 16.991 -0.640 4.144
99 HB THR 12 HB THR 12 17.878 1.315 2.866
100 HG1 THR 12 HG1 THR 12 18.428 0.716 5.082
101 HG21 THR 12 HG21 THR 12 17.075 3.540 3.316
102 HG22 THR 12 HG22 THR 12 15.744 2.598 2.649
103 HG23 THR 12 HG23 THR 12 15.803 2.929 4.394
104 H LEU 13 H LEU 13 13.716 0.359 3.449
105 HA LEU 13 HA LEU 13 13.074 0.145 6.346
106 HB2 LEU 13 HB2 LEU 13 12.140 2.064 4.192
107 HB3 LEU 13 HB3 LEU 13 11.070 1.668 5.519
108 HG LEU 13 HG LEU 13 13.890 2.619 6.114
109 HD11 LEU 13 HD11 LEU 13 12.919 4.286 4.601
110 HD12 LEU 13 HD12 LEU 13 11.459 4.369 5.589
111 HD13 LEU 13 HD13 LEU 13 13.023 4.918 6.248
112 HD21 LEU 13 HD21 LEU 13 12.506 1.669 7.964
113 HD22 LEU 13 HD22 LEU 13 12.824 3.396 8.185
114 HD23 LEU 13 HD23 LEU 13 11.232 2.861 7.612
115 H LYS 14 H LYS 14 11.382 -1.209 6.812
116 HA LYS 14 HA LYS 14 9.665 -2.185 4.615
117 HB2 LYS 14 HB2 LYS 14 11.196 -4.059 6.486
118 HB3 LYS 14 HB3 LYS 14 9.889 -4.510 5.399
119 HG2 LYS 14 HG2 LYS 14 11.391 -3.478 3.510
120 HG3 LYS 14 HG3 LYS 14 12.698 -3.643 4.681
121 HD2 LYS 14 HD2 LYS 14 12.146 -6.071 4.905
122 HD3 LYS 14 HD3 LYS 14 10.824 -5.865 3.742
123 HE2 LYS 14 HE2 LYS 14 12.433 -5.163 1.997
124 HE3 LYS 14 HE3 LYS 14 13.766 -5.337 3.143
125 HZ1 LYS 14 HZ1 LYS 14 11.995 -7.598 2.383
126 HZ2 LYS 14 HZ2 LYS 14 13.439 -7.269 1.653
127 HZ3 LYS 14 HZ3 LYS 14 13.403 -7.666 3.217
128 H GLY 15 H GLY 15 7.597 -2.777 5.314
129 HA2 GLY 15 HA2 GLY 15 6.895 -3.210 8.028
130 HA3 GLY 15 HA3 GLY 15 6.538 -1.528 7.562
131 H GLU 16 H GLU 16 4.389 -3.016 8.230
132 HA GLU 16 HA GLU 16 2.918 -3.220 5.733
133 HB2 GLU 16 HB2 GLU 16 1.899 -5.391 6.349
134 HB3 GLU 16 HB3 GLU 16 3.582 -5.497 5.853
135 HG2 GLU 16 HG2 GLU 16 4.338 -6.220 7.887
136 HG3 GLU 16 HG3 GLU 16 3.112 -5.360 8.805
137 H THR 17 H THR 17 0.910 -2.353 5.977
138 HA THR 17 HA THR 17 -0.236 -2.235 8.714
139 HB THR 17 HB THR 17 1.118 -0.123 8.107
140 HG1 THR 17 HG1 THR 17 -0.054 0.002 9.820
141 HG21 THR 17 HG21 THR 17 -0.099 1.639 6.958
142 HG22 THR 17 HG22 THR 17 0.295 0.320 5.851
143 HG23 THR 17 HG23 THR 17 -1.368 0.517 6.464
144 H THR 18 H THR 18 -2.546 -1.181 8.515
145 HA THR 18 HA THR 18 -3.959 -2.059 6.108
146 HB THR 18 HB THR 18 -3.588 -3.978 7.756
147 HG1 THR 18 HG1 THR 18 -5.490 -4.814 7.413
148 HG21 THR 18 HG21 THR 18 -5.051 -4.168 9.673
149 HG22 THR 18 HG22 THR 18 -3.997 -2.766 9.847
150 HG23 THR 18 HG23 THR 18 -5.711 -2.548 9.398
151 H THR 19 H THR 19 -5.969 -0.901 5.885
152 HA THR 19 HA THR 19 -6.877 0.911 7.983
153 HB THR 19 HB THR 19 -6.794 2.849 6.325
154 HG1 THR 19 HG1 THR 19 -4.827 1.197 5.093
155 HG21 THR 19 HG21 THR 19 -4.616 3.603 6.897
156 HG22 THR 19 HG22 THR 19 -5.221 2.657 8.263
157 HG23 THR 19 HG23 THR 19 -4.011 1.962 7.155
158 H GLU 20 H GLU 20 -8.858 2.101 7.164
159 HA GLU 20 HA GLU 20 -10.521 0.430 5.340
160 HB2 GLU 20 HB2 GLU 20 -11.234 2.178 7.746
161 HB3 GLU 20 HB3 GLU 20 -12.412 1.587 6.579
162 HG2 GLU 20 HG2 GLU 20 -11.687 -0.776 7.183
163 HG3 GLU 20 HG3 GLU 20 -10.817 -0.058 8.555
164 H ALA 21 H ALA 21 -11.854 1.611 3.828
165 HA ALA 21 HA ALA 21 -11.547 4.551 3.704
166 HB1 ALA 21 HB1 ALA 21 -11.059 4.479 1.301
167 HB2 ALA 21 HB2 ALA 21 -9.789 3.624 2.197
168 HB3 ALA 21 HB3 ALA 21 -11.038 2.708 1.326
169 H VAL 22 H VAL 22 -13.395 5.561 2.841
170 HA VAL 22 HA VAL 22 -15.843 4.173 3.043
171 HB VAL 22 HB VAL 22 -16.869 6.212 2.092
172 HG11 VAL 22 HG11 VAL 22 -14.768 6.796 4.213
173 HG12 VAL 22 HG12 VAL 22 -16.289 7.674 3.911
174 HG13 VAL 22 HG13 VAL 22 -16.336 5.998 4.499
175 HG21 VAL 22 HG21 VAL 22 -14.005 7.241 1.778
176 HG22 VAL 22 HG22 VAL 22 -15.235 7.007 0.505
177 HG23 VAL 22 HG23 VAL 22 -15.465 8.237 1.739
178 H ASP 23 H ASP 23 -13.937 5.052 0.170
179 HA ASP 23 HA ASP 23 -15.049 2.900 -1.452
180 HB2 ASP 23 HB2 ASP 23 -16.644 4.623 -1.994
181 HB3 ASP 23 HB3 ASP 23 -15.379 5.831 -2.197
182 H ALA 24 H ALA 24 -13.600 2.618 -3.345
183 HA ALA 24 HA ALA 24 -10.900 2.687 -2.651
184 HB1 ALA 24 HB1 ALA 24 -12.157 2.436 -5.411
185 HB2 ALA 24 HB2 ALA 24 -10.511 1.957 -4.950
186 HB3 ALA 24 HB3 ALA 24 -11.900 1.109 -4.249
187 H ALA 25 H ALA 25 -12.785 5.292 -4.141
188 HA ALA 25 HA ALA 25 -10.798 6.634 -5.566
189 HB1 ALA 25 HB1 ALA 25 -13.195 7.282 -5.528
190 HB2 ALA 25 HB2 ALA 25 -13.007 7.890 -3.874
191 HB3 ALA 25 HB3 ALA 25 -12.138 8.660 -5.216
192 H THR 26 H THR 26 -11.345 6.702 -2.047
193 HA THR 26 HA THR 26 -9.231 8.700 -1.593
194 HB THR 26 HB THR 26 -10.644 6.925 0.439
195 HG1 THR 26 HG1 THR 26 -11.347 9.560 -0.333
196 HG21 THR 26 HG21 THR 26 -10.161 8.775 2.027
197 HG22 THR 26 HG22 THR 26 -8.681 8.043 1.397
198 HG23 THR 26 HG23 THR 26 -9.227 9.612 0.763
199 H ALA 27 H ALA 27 -9.653 5.163 -1.414
200 HA ALA 27 HA ALA 27 -7.276 4.511 -0.069
201 HB1 ALA 27 HB1 ALA 27 -8.658 2.813 -2.178
202 HB2 ALA 27 HB2 ALA 27 -7.659 2.279 -0.817
203 HB3 ALA 27 HB3 ALA 27 -9.240 2.989 -0.503
204 H GLU 28 H GLU 28 -7.926 4.678 -3.630
205 HA GLU 28 HA GLU 28 -5.392 3.971 -4.499
206 HB2 GLU 28 HB2 GLU 28 -7.516 4.281 -5.815
207 HB3 GLU 28 HB3 GLU 28 -7.200 6.026 -5.827
208 HG2 GLU 28 HG2 GLU 28 -5.056 5.635 -6.987
209 HG3 GLU 28 HG3 GLU 28 -5.282 3.883 -6.870
210 H LYS 29 H LYS 29 -6.467 7.122 -3.328
211 HA LYS 29 HA LYS 29 -4.014 8.533 -4.068
212 HB2 LYS 29 HB2 LYS 29 -6.335 9.251 -2.219
213 HB3 LYS 29 HB3 LYS 29 -4.954 10.308 -2.535
214 HG2 LYS 29 HG2 LYS 29 -5.482 10.380 -4.931
215 HG3 LYS 29 HG3 LYS 29 -6.838 9.258 -4.700
216 HD2 LYS 29 HD2 LYS 29 -8.010 10.815 -3.299
217 HD3 LYS 29 HD3 LYS 29 -6.630 11.915 -3.232
218 HE2 LYS 29 HE2 LYS 29 -6.818 12.532 -5.514
219 HE3 LYS 29 HE3 LYS 29 -7.960 11.228 -5.872
220 HZ1 LYS 29 HZ1 LYS 29 -8.662 13.287 -3.897
221 HZ2 LYS 29 HZ2 LYS 29 -8.905 13.562 -5.502
222 HZ3 LYS 29 HZ3 LYS 29 -9.645 12.305 -4.778
223 H VAL 30 H VAL 30 -5.407 7.248 -0.961
224 HA VAL 30 HA VAL 30 -3.190 8.054 0.563
225 HB VAL 30 HB VAL 30 -5.482 7.176 1.406
226 HG11 VAL 30 HG11 VAL 30 -3.906 4.591 1.708
227 HG12 VAL 30 HG12 VAL 30 -5.512 4.958 2.357
228 HG13 VAL 30 HG13 VAL 30 -5.278 4.815 0.620
229 HG21 VAL 30 HG21 VAL 30 -4.489 6.812 3.625
230 HG22 VAL 30 HG22 VAL 30 -2.889 6.537 2.907
231 HG23 VAL 30 HG23 VAL 30 -3.654 8.133 2.803
232 H PHE 31 H PHE 31 -3.589 5.163 -1.508
233 HA PHE 31 HA PHE 31 -1.422 3.678 -0.512
234 HB2 PHE 31 HB2 PHE 31 -2.328 4.054 -3.393
235 HB3 PHE 31 HB3 PHE 31 -1.278 2.781 -2.832
236 HD1 PHE 31 HD1 PHE 31 -3.322 2.669 -0.122
237 HD2 PHE 31 HD2 PHE 31 -3.606 2.152 -4.405
238 HE1 PHE 31 HE1 PHE 31 -5.292 1.242 0.186
239 HE2 PHE 31 HE2 PHE 31 -5.595 0.739 -4.080
240 HZ PHE 31 HZ PHE 31 -6.447 0.273 -1.782
241 H LYS 32 H LYS 32 -1.308 6.388 -2.939
242 HA LYS 32 HA LYS 32 1.567 6.112 -3.202
243 HB2 LYS 32 HB2 LYS 32 0.145 7.177 -4.948
244 HB3 LYS 32 HB3 LYS 32 -0.190 8.535 -3.856
245 HG2 LYS 32 HG2 LYS 32 2.232 9.088 -3.779
246 HG3 LYS 32 HG3 LYS 32 2.590 7.649 -4.749
247 HD2 LYS 32 HD2 LYS 32 1.177 8.639 -6.582
248 HD3 LYS 32 HD3 LYS 32 1.085 10.148 -5.644
249 HE2 LYS 32 HE2 LYS 32 3.496 10.424 -5.737
250 HE3 LYS 32 HE3 LYS 32 3.716 8.768 -6.311
251 HZ1 LYS 32 HZ1 LYS 32 2.553 10.971 -7.895
252 HZ2 LYS 32 HZ2 LYS 32 3.992 10.249 -8.096
253 HZ3 LYS 32 HZ3 LYS 32 2.614 9.388 -8.377
254 H GLN 33 H GLN 33 -0.522 8.390 -1.397
255 HA GLN 33 HA GLN 33 1.493 9.968 -0.251
256 HB2 GLN 33 HB2 GLN 33 -0.896 10.502 -0.280
257 HB3 GLN 33 HB3 GLN 33 -1.253 9.118 0.756
258 HG2 GLN 33 HG2 GLN 33 0.049 10.186 2.608
259 HG3 GLN 33 HG3 GLN 33 0.299 11.601 1.569
260 HE21 GLN 33 HE21 GLN 33 -3.150 11.239 3.651
261 HE22 GLN 33 HE22 GLN 33 -1.899 10.036 3.797
262 H TYR 34 H TYR 34 -0.090 7.066 1.187
263 HA TYR 34 HA TYR 34 1.427 7.065 3.578
264 HB2 TYR 34 HB2 TYR 34 -0.733 5.925 3.402
265 HB3 TYR 34 HB3 TYR 34 -0.101 4.834 2.158
266 HD1 TYR 34 HD1 TYR 34 0.984 2.788 2.797
267 HD2 TYR 34 HD2 TYR 34 0.425 5.951 5.653
268 HE1 TYR 34 HE1 TYR 34 2.151 1.438 4.442
269 HE2 TYR 34 HE2 TYR 34 1.687 4.625 7.363
270 HH TYR 34 HH TYR 34 2.900 2.650 7.779
271 H ALA 35 H ALA 35 1.756 5.008 0.577
272 HA ALA 35 HA ALA 35 4.005 3.610 1.510
273 HB1 ALA 35 HB1 ALA 35 3.346 4.363 -1.364
274 HB2 ALA 35 HB2 ALA 35 4.347 3.011 -0.803
275 HB3 ALA 35 HB3 ALA 35 2.623 3.002 -0.460
276 H ASN 36 H ASN 36 3.822 6.775 -0.183
277 HA ASN 36 HA ASN 36 6.575 7.161 -0.637
278 HB2 ASN 36 HB2 ASN 36 5.048 8.650 -1.640
279 HB3 ASN 36 HB3 ASN 36 4.290 9.060 -0.095
280 HD21 ASN 36 HD21 ASN 36 7.948 10.734 -1.013
281 HD22 ASN 36 HD22 ASN 36 7.418 9.271 -1.838
282 H ASP 37 H ASP 37 4.745 7.512 2.423
283 HA ASP 37 HA ASP 37 6.731 8.999 3.831
284 HB2 ASP 37 HB2 ASP 37 4.313 8.626 4.508
285 HB3 ASP 37 HB3 ASP 37 4.762 6.987 4.986
286 H ASN 38 H ASN 38 6.511 5.655 2.943
287 HA ASN 38 HA ASN 38 8.488 4.617 4.832
288 HB2 ASN 38 HB2 ASN 38 6.343 3.518 3.944
289 HB3 ASN 38 HB3 ASN 38 7.173 3.292 2.443
290 HD21 ASN 38 HD21 ASN 38 7.344 0.478 5.155
291 HD22 ASN 38 HD22 ASN 38 6.529 1.999 5.499
292 H GLY 39 H GLY 39 8.798 6.612 2.178
293 HA2 GLY 39 HA2 GLY 39 10.559 7.227 0.871
294 HA3 GLY 39 HA3 GLY 39 11.592 6.183 1.860
295 H VAL 40 H VAL 40 8.807 5.241 -0.147
296 HA VAL 40 HA VAL 40 10.315 3.123 -1.376
297 HB VAL 40 HB VAL 40 8.101 2.528 -2.343
298 HG11 VAL 40 HG11 VAL 40 6.932 2.175 -0.202
299 HG12 VAL 40 HG12 VAL 40 8.646 1.704 -0.141
300 HG13 VAL 40 HG13 VAL 40 8.108 3.218 0.601
301 HG21 VAL 40 HG21 VAL 40 7.321 5.260 -1.258
302 HG22 VAL 40 HG22 VAL 40 6.996 4.563 -2.846
303 HG23 VAL 40 HG23 VAL 40 6.136 3.999 -1.410
304 H ASP 41 H ASP 41 10.776 2.674 -3.412
305 HA ASP 41 HA ASP 41 9.966 4.333 -5.686
306 HB2 ASP 41 HB2 ASP 41 12.170 5.209 -4.863
307 HB3 ASP 41 HB3 ASP 41 12.892 3.647 -5.269
308 H GLY 42 H GLY 42 8.571 2.476 -6.273
309 HA2 GLY 42 HA2 GLY 42 10.020 0.325 -7.569
310 HA3 GLY 42 HA3 GLY 42 9.295 -0.221 -6.062
311 H GLU 43 H GLU 43 8.376 -1.663 -7.711
312 HA GLU 43 HA GLU 43 6.144 -0.760 -9.369
313 HB2 GLU 43 HB2 GLU 43 6.138 -2.919 -10.316
314 HB3 GLU 43 HB3 GLU 43 7.779 -2.310 -10.362
315 HG2 GLU 43 HG2 GLU 43 8.540 -3.901 -8.779
316 HG3 GLU 43 HG3 GLU 43 6.928 -4.210 -8.148
317 H TRP 44 H TRP 44 4.007 -1.641 -9.164
318 HA TRP 44 HA TRP 44 3.363 -2.553 -6.405
319 HB2 TRP 44 HB2 TRP 44 1.827 -0.877 -8.401
320 HB3 TRP 44 HB3 TRP 44 1.101 -1.597 -6.973
321 HD1 TRP 44 HD1 TRP 44 4.353 0.470 -7.460
322 HE1 TRP 44 HE1 TRP 44 4.700 1.876 -5.453
323 HE3 TRP 44 HE3 TRP 44 0.022 -0.622 -5.005
324 HZ2 TRP 44 HZ2 TRP 44 3.029 2.890 -3.210
325 HZ3 TRP 44 HZ3 TRP 44 -0.526 0.491 -2.852
326 HH2 TRP 44 HH2 TRP 44 0.993 2.236 -1.943
327 H THR 45 H THR 45 2.333 -4.344 -6.062
328 HA THR 45 HA THR 45 1.000 -5.903 -8.205
329 HB THR 45 HB THR 45 2.587 -6.952 -5.811
330 HG1 THR 45 HG1 THR 45 3.996 -6.012 -7.273
331 HG21 THR 45 HG21 THR 45 2.549 -9.105 -7.060
332 HG22 THR 45 HG22 THR 45 0.922 -8.582 -6.610
333 HG23 THR 45 HG23 THR 45 1.496 -8.371 -8.286
334 H TYR 46 H TYR 46 -0.933 -7.162 -7.248
335 HA TYR 46 HA TYR 46 -1.826 -6.122 -4.606
336 HB2 TYR 46 HB2 TYR 46 -2.770 -4.653 -6.283
337 HB3 TYR 46 HB3 TYR 46 -3.300 -6.024 -7.239
338 HD1 TYR 46 HD1 TYR 46 -3.672 -4.847 -3.669
339 HD2 TYR 46 HD2 TYR 46 -5.604 -6.441 -7.191
340 HE1 TYR 46 HE1 TYR 46 -5.865 -4.657 -2.559
341 HE2 TYR 46 HE2 TYR 46 -7.790 -6.272 -6.074
342 HH TYR 46 HH TYR 46 -8.858 -5.905 -3.915
343 H ASP 47 H ASP 47 -3.101 -7.476 -3.437
344 HA ASP 47 HA ASP 47 -3.883 -10.144 -4.489
345 HB2 ASP 47 HB2 ASP 47 -1.854 -9.607 -2.552
346 HB3 ASP 47 HB3 ASP 47 -3.237 -10.179 -1.642
347 H ASP 48 H ASP 48 -6.047 -9.559 -4.782
348 HA ASP 48 HA ASP 48 -7.506 -7.764 -3.172
349 HB2 ASP 48 HB2 ASP 48 -8.134 -8.534 -5.493
350 HB3 ASP 48 HB3 ASP 48 -8.729 -10.031 -4.767
351 H ALA 49 H ALA 49 -7.018 -11.185 -2.692
352 HA ALA 49 HA ALA 49 -9.126 -11.835 -1.003
353 HB1 ALA 49 HB1 ALA 49 -7.499 -13.439 -1.846
354 HB2 ALA 49 HB2 ALA 49 -6.208 -12.704 -0.865
355 HB3 ALA 49 HB3 ALA 49 -7.541 -13.556 -0.082
356 H THR 50 H THR 50 -6.226 -9.990 -0.165
357 HA THR 50 HA THR 50 -7.339 -9.380 2.526
358 HB THR 50 HB THR 50 -5.756 -10.940 3.090
359 HG1 THR 50 HG1 THR 50 -4.838 -8.368 3.331
360 HG21 THR 50 HG21 THR 50 -3.969 -9.915 0.875
361 HG22 THR 50 HG22 THR 50 -3.385 -10.985 2.182
362 HG23 THR 50 HG23 THR 50 -4.657 -11.524 1.086
363 H LYS 51 H LYS 51 -6.867 -8.078 -0.426
364 HA LYS 51 HA LYS 51 -6.468 -6.319 -1.402
365 HB2 LYS 51 HB2 LYS 51 -7.618 -5.158 1.133
366 HB3 LYS 51 HB3 LYS 51 -7.372 -4.241 -0.379
367 HG2 LYS 51 HG2 LYS 51 -8.692 -6.348 -1.401
368 HG3 LYS 51 HG3 LYS 51 -9.315 -6.466 0.238
369 HD2 LYS 51 HD2 LYS 51 -10.288 -4.233 0.078
370 HD3 LYS 51 HD3 LYS 51 -9.451 -3.941 -1.472
371 HE2 LYS 51 HE2 LYS 51 -10.691 -5.674 -2.591
372 HE3 LYS 51 HE3 LYS 51 -11.369 -6.243 -1.065
373 HZ1 LYS 51 HZ1 LYS 51 -12.624 -4.246 -0.884
374 HZ2 LYS 51 HZ2 LYS 51 -12.062 -3.663 -2.348
375 HZ3 LYS 51 HZ3 LYS 51 -12.973 -5.045 -2.236
376 H THR 52 H THR 52 -4.325 -7.529 -0.229
377 HA THR 52 HA THR 52 -2.435 -5.703 0.918
378 HB THR 52 HB THR 52 -2.351 -8.546 -0.139
379 HG1 THR 52 HG1 THR 52 -2.338 -8.973 2.072
380 HG21 THR 52 HG21 THR 52 -0.148 -7.004 1.274
381 HG22 THR 52 HG22 THR 52 -0.180 -8.776 1.085
382 HG23 THR 52 HG23 THR 52 -0.065 -7.741 -0.337
383 H PHE 53 H PHE 53 -1.422 -4.201 -0.151
384 HA PHE 53 HA PHE 53 -0.776 -4.525 -3.042
385 HB2 PHE 53 HB2 PHE 53 -1.161 -2.145 -1.197
386 HB3 PHE 53 HB3 PHE 53 -0.253 -1.999 -2.688
387 HD1 PHE 53 HD1 PHE 53 -1.357 -2.510 -4.914
388 HD2 PHE 53 HD2 PHE 53 -3.584 -2.245 -1.224
389 HE1 PHE 53 HE1 PHE 53 -3.462 -2.193 -6.201
390 HE2 PHE 53 HE2 PHE 53 -5.671 -1.942 -2.522
391 HZ PHE 53 HZ PHE 53 -5.608 -1.883 -5.010
392 H THR 54 H THR 54 1.236 -5.459 -3.175
393 HA THR 54 HA THR 54 3.245 -4.842 -1.076
394 HB THR 54 HB THR 54 3.308 -7.062 -3.149
395 HG1 THR 54 HG1 THR 54 1.560 -7.479 -2.031
396 HG21 THR 54 HG21 THR 54 4.782 -8.180 -1.513
397 HG22 THR 54 HG22 THR 54 5.476 -6.645 -2.042
398 HG23 THR 54 HG23 THR 54 4.686 -6.764 -0.446
399 H VAL 55 H VAL 55 5.245 -4.034 -1.585
400 HA VAL 55 HA VAL 55 5.874 -3.308 -4.390
401 HB VAL 55 HB VAL 55 5.945 -1.584 -1.896
402 HG11 VAL 55 HG11 VAL 55 7.261 -1.004 -4.586
403 HG12 VAL 55 HG12 VAL 55 7.071 0.154 -3.242
404 HG13 VAL 55 HG13 VAL 55 8.104 -1.254 -3.037
405 HG21 VAL 55 HG21 VAL 55 3.816 -1.643 -3.250
406 HG22 VAL 55 HG22 VAL 55 4.582 -0.068 -3.260
407 HG23 VAL 55 HG23 VAL 55 4.758 -1.130 -4.673
408 H THR 56 H THR 56 8.012 -3.743 -4.920
409 HA THR 56 HA THR 56 9.810 -4.752 -2.793
410 HB THR 56 HB THR 56 10.494 -6.434 -4.593
411 HG1 THR 56 HG1 THR 56 9.488 -5.690 -6.379
412 HG21 THR 56 HG21 THR 56 9.190 -7.103 -2.613
413 HG22 THR 56 HG22 THR 56 7.674 -6.672 -3.445
414 HG23 THR 56 HG23 THR 56 8.681 -7.992 -4.058
415 H GLU 57 H GLU 57 11.428 -3.244 -2.672
416 HA GLU 57 HA GLU 57 12.170 -1.671 -5.050
417 HB2 GLU 57 HB2 GLU 57 12.256 -0.933 -2.575
418 HB3 GLU 57 HB3 GLU 57 13.735 -1.856 -2.440
419 HG2 GLU 57 HG2 GLU 57 14.796 -0.555 -4.234
420 HG3 GLU 57 HG3 GLU 57 13.303 0.350 -4.492
Start of MODEL 16
1 H1 MET 1 H MET 1 -16.832 0.814 2.834
2 HA MET 1 HA MET 1 -16.970 -0.223 0.636
3 HB2 MET 1 HB2 MET 1 -15.662 1.594 -0.454
4 HB3 MET 1 HB3 MET 1 -14.179 0.854 0.136
5 HG2 MET 1 HG2 MET 1 -14.578 0.098 -2.122
6 HG3 MET 1 HG3 MET 1 -14.950 -1.263 -1.063
7 HE1 MET 1 HE1 MET 1 -16.998 2.014 -2.339
8 HE2 MET 1 HE2 MET 1 -16.160 1.250 -3.712
9 HE3 MET 1 HE3 MET 1 -17.929 1.205 -3.611
10 H GLY 2 H GLY 2 -13.409 -0.345 1.756
11 HA2 GLY 2 HA2 GLY 2 -14.111 -2.644 3.355
12 HA3 GLY 2 HA3 GLY 2 -13.241 -2.982 1.841
13 H THR 3 H THR 3 -11.757 -3.824 3.535
14 HA THR 3 HA THR 3 -10.037 -1.760 4.749
15 HB THR 3 HB THR 3 -10.813 -3.339 6.365
16 HG1 THR 3 HG1 THR 3 -8.591 -2.778 6.454
17 HG21 THR 3 HG21 THR 3 -11.442 -5.253 4.928
18 HG22 THR 3 HG22 THR 3 -9.723 -5.606 4.654
19 HG23 THR 3 HG23 THR 3 -10.426 -5.738 6.286
20 H TYR 4 H TYR 4 -7.848 -1.697 4.020
21 HA TYR 4 HA TYR 4 -7.164 -3.422 1.687
22 HB2 TYR 4 HB2 TYR 4 -6.768 -0.423 1.956
23 HB3 TYR 4 HB3 TYR 4 -6.278 -1.416 0.595
24 HD1 TYR 4 HD1 TYR 4 -7.979 -2.306 -0.995
25 HD2 TYR 4 HD2 TYR 4 -9.226 0.226 2.290
26 HE1 TYR 4 HE1 TYR 4 -10.203 -1.946 -2.072
27 HE2 TYR 4 HE2 TYR 4 -11.363 0.584 1.208
28 HH TYR 4 HH TYR 4 -12.410 -1.352 -1.529
29 H LYS 5 H LYS 5 -5.151 -4.479 2.033
30 HA LYS 5 HA LYS 5 -3.610 -3.426 4.386
31 HB2 LYS 5 HB2 LYS 5 -4.457 -5.793 4.253
32 HB3 LYS 5 HB3 LYS 5 -3.340 -6.056 2.914
33 HG2 LYS 5 HG2 LYS 5 -1.481 -5.260 4.537
34 HG3 LYS 5 HG3 LYS 5 -2.717 -5.373 5.810
35 HD2 LYS 5 HD2 LYS 5 -3.064 -7.790 5.160
36 HD3 LYS 5 HD3 LYS 5 -1.727 -7.600 3.990
37 HE2 LYS 5 HE2 LYS 5 -0.288 -6.800 5.921
38 HE3 LYS 5 HE3 LYS 5 -1.590 -7.295 7.012
39 HZ1 LYS 5 HZ1 LYS 5 -1.323 -9.542 6.211
40 HZ2 LYS 5 HZ2 LYS 5 -0.135 -9.061 5.138
41 HZ3 LYS 5 HZ3 LYS 5 0.134 -8.938 6.737
42 H LEU 6 H LEU 6 -1.611 -2.473 4.115
43 HA LEU 6 HA LEU 6 -0.347 -2.527 1.396
44 HB2 LEU 6 HB2 LEU 6 -1.557 -0.383 2.568
45 HB3 LEU 6 HB3 LEU 6 0.086 -0.133 3.134
46 HG LEU 6 HG LEU 6 -0.635 -0.626 0.212
47 HD11 LEU 6 HD11 LEU 6 -1.836 1.362 0.987
48 HD12 LEU 6 HD12 LEU 6 -0.340 2.044 1.658
49 HD13 LEU 6 HD13 LEU 6 -0.516 1.805 -0.101
50 HD21 LEU 6 HD21 LEU 6 1.801 0.674 1.489
51 HD22 LEU 6 HD22 LEU 6 1.754 -0.953 0.759
52 HD23 LEU 6 HD23 LEU 6 1.514 0.468 -0.252
53 H ILE 7 H ILE 7 1.563 -3.599 1.420
54 HA ILE 7 HA ILE 7 3.438 -3.323 3.687
55 HB ILE 7 HB ILE 7 2.344 -5.567 3.658
56 HG12 ILE 7 HG12 ILE 7 5.302 -5.806 2.943
57 HG13 ILE 7 HG13 ILE 7 4.713 -5.177 4.468
58 HG21 ILE 7 HG21 ILE 7 2.164 -5.793 1.109
59 HG22 ILE 7 HG22 ILE 7 3.879 -6.150 1.098
60 HG23 ILE 7 HG23 ILE 7 2.752 -7.214 1.946
61 HD11 ILE 7 HD11 ILE 7 4.284 -8.001 3.451
62 HD12 ILE 7 HD12 ILE 7 5.301 -7.477 4.797
63 HD13 ILE 7 HD13 ILE 7 3.535 -7.341 4.915
64 H LEU 8 H LEU 8 5.473 -2.762 3.257
65 HA LEU 8 HA LEU 8 6.256 -2.422 0.386
66 HB2 LEU 8 HB2 LEU 8 6.996 -0.664 2.769
67 HB3 LEU 8 HB3 LEU 8 7.554 -0.475 1.122
68 HG LEU 8 HG LEU 8 5.957 1.196 1.521
69 HD11 LEU 8 HD11 LEU 8 4.584 -0.946 -0.156
70 HD12 LEU 8 HD12 LEU 8 4.220 0.774 -0.197
71 HD13 LEU 8 HD13 LEU 8 5.803 0.212 -0.728
72 HD21 LEU 8 HD21 LEU 8 3.720 -0.697 2.206
73 HD22 LEU 8 HD22 LEU 8 4.781 -0.022 3.446
74 HD23 LEU 8 HD23 LEU 8 3.836 1.058 2.413
75 H ASN 9 H ASN 9 8.244 -3.246 -0.197
76 HA ASN 9 HA ASN 9 9.981 -4.387 1.953
77 HB2 ASN 9 HB2 ASN 9 9.543 -5.405 -0.884
78 HB3 ASN 9 HB3 ASN 9 10.835 -5.911 0.176
79 HD21 ASN 9 HD21 ASN 9 7.021 -7.310 0.827
80 HD22 ASN 9 HD22 ASN 9 7.340 -5.971 -0.259
81 H GLY 10 H GLY 10 10.684 -2.034 2.037
82 HA2 GLY 10 HA2 GLY 10 12.052 -0.986 -0.294
83 HA3 GLY 10 HA3 GLY 10 11.946 -0.262 1.310
84 H LYS 11 H LYS 11 14.247 -0.359 -0.214
85 HA LYS 11 HA LYS 11 16.066 -2.476 0.427
86 HB2 LYS 11 HB2 LYS 11 16.414 -0.963 -1.458
87 HB3 LYS 11 HB3 LYS 11 16.489 0.440 -0.377
88 HG2 LYS 11 HG2 LYS 11 18.583 -0.279 0.562
89 HG3 LYS 11 HG3 LYS 11 18.493 -1.836 -0.288
90 HD2 LYS 11 HD2 LYS 11 18.756 -0.746 -2.441
91 HD3 LYS 11 HD3 LYS 11 18.667 0.867 -1.688
92 HE2 LYS 11 HE2 LYS 11 20.739 0.578 -0.531
93 HE3 LYS 11 HE3 LYS 11 20.741 -1.169 -0.827
94 HZ1 LYS 11 HZ1 LYS 11 22.312 0.008 -2.218
95 HZ2 LYS 11 HZ2 LYS 11 21.205 -0.813 -3.089
96 HZ3 LYS 11 HZ3 LYS 11 21.082 0.814 -2.991
97 H THR 12 H THR 12 15.286 0.622 2.072
98 HA THR 12 HA THR 12 16.960 -0.335 4.350
99 HB THR 12 HB THR 12 17.995 1.438 2.945
100 HG1 THR 12 HG1 THR 12 18.473 1.027 5.170
101 HG21 THR 12 HG21 THR 12 17.345 3.764 3.214
102 HG22 THR 12 HG22 THR 12 16.024 2.858 2.468
103 HG23 THR 12 HG23 THR 12 15.940 3.300 4.188
104 H LEU 13 H LEU 13 13.758 0.712 3.436
105 HA LEU 13 HA LEU 13 13.018 0.747 6.326
106 HB2 LEU 13 HB2 LEU 13 12.105 2.509 4.039
107 HB3 LEU 13 HB3 LEU 13 11.183 2.363 5.529
108 HG LEU 13 HG LEU 13 14.107 3.211 5.568
109 HD11 LEU 13 HD11 LEU 13 12.989 4.742 4.082
110 HD12 LEU 13 HD12 LEU 13 11.665 4.968 5.230
111 HD13 LEU 13 HD13 LEU 13 13.298 5.549 5.638
112 HD21 LEU 13 HD21 LEU 13 13.203 2.546 7.733
113 HD22 LEU 13 HD22 LEU 13 13.448 4.291 7.698
114 HD23 LEU 13 HD23 LEU 13 11.806 3.637 7.521
115 H LYS 14 H LYS 14 11.214 -0.452 6.849
116 HA LYS 14 HA LYS 14 9.592 -1.619 4.658
117 HB2 LYS 14 HB2 LYS 14 10.965 -3.260 6.836
118 HB3 LYS 14 HB3 LYS 14 9.764 -3.863 5.695
119 HG2 LYS 14 HG2 LYS 14 11.335 -3.262 3.802
120 HG3 LYS 14 HG3 LYS 14 12.571 -2.889 5.031
121 HD2 LYS 14 HD2 LYS 14 12.196 -5.210 5.979
122 HD3 LYS 14 HD3 LYS 14 11.132 -5.530 4.592
123 HE2 LYS 14 HE2 LYS 14 13.032 -5.055 3.050
124 HE3 LYS 14 HE3 LYS 14 14.078 -4.782 4.459
125 HZ1 LYS 14 HZ1 LYS 14 12.645 -7.300 3.870
126 HZ2 LYS 14 HZ2 LYS 14 14.239 -7.040 3.586
127 HZ3 LYS 14 HZ3 LYS 14 13.658 -7.043 5.148
128 H GLY 15 H GLY 15 7.597 -2.617 5.452
129 HA2 GLY 15 HA2 GLY 15 6.726 -2.665 8.090
130 HA3 GLY 15 HA3 GLY 15 6.291 -1.074 7.432
131 H GLU 16 H GLU 16 4.262 -2.748 8.162
132 HA GLU 16 HA GLU 16 2.911 -3.312 5.657
133 HB2 GLU 16 HB2 GLU 16 2.133 -5.449 6.198
134 HB3 GLU 16 HB3 GLU 16 3.877 -5.536 6.442
135 HG2 GLU 16 HG2 GLU 16 3.654 -5.551 8.830
136 HG3 GLU 16 HG3 GLU 16 1.929 -5.180 8.736
137 H THR 17 H THR 17 0.755 -2.609 5.831
138 HA THR 17 HA THR 17 -0.257 -2.087 8.571
139 HB THR 17 HB THR 17 1.021 -0.063 7.886
140 HG1 THR 17 HG1 THR 17 -0.513 1.323 8.554
141 HG21 THR 17 HG21 THR 17 0.037 1.431 6.188
142 HG22 THR 17 HG22 THR 17 0.659 -0.054 5.474
143 HG23 THR 17 HG23 THR 17 -1.097 0.170 5.694
144 H THR 18 H THR 18 -2.551 -1.115 8.376
145 HA THR 18 HA THR 18 -4.082 -2.180 6.116
146 HB THR 18 HB THR 18 -3.663 -3.987 7.870
147 HG1 THR 18 HG1 THR 18 -5.581 -4.814 7.620
148 HG21 THR 18 HG21 THR 18 -5.068 -4.028 9.871
149 HG22 THR 18 HG22 THR 18 -3.968 -2.647 9.918
150 HG23 THR 18 HG23 THR 18 -5.689 -2.414 9.517
151 H THR 19 H THR 19 -5.995 -0.972 5.833
152 HA THR 19 HA THR 19 -6.868 0.929 7.840
153 HB THR 19 HB THR 19 -6.774 2.866 6.346
154 HG1 THR 19 HG1 THR 19 -5.089 1.370 4.651
155 HG21 THR 19 HG21 THR 19 -4.437 3.447 6.354
156 HG22 THR 19 HG22 THR 19 -4.840 2.606 7.853
157 HG23 THR 19 HG23 THR 19 -3.950 1.753 6.570
158 H GLU 20 H GLU 20 -8.888 2.103 6.906
159 HA GLU 20 HA GLU 20 -10.423 0.359 5.054
160 HB2 GLU 20 HB2 GLU 20 -11.416 1.769 7.551
161 HB3 GLU 20 HB3 GLU 20 -12.412 0.825 6.444
162 HG2 GLU 20 HG2 GLU 20 -11.443 -1.243 7.148
163 HG3 GLU 20 HG3 GLU 20 -10.106 -0.441 7.997
164 H ALA 21 H ALA 21 -11.968 1.609 3.700
165 HA ALA 21 HA ALA 21 -11.839 4.557 3.955
166 HB1 ALA 21 HB1 ALA 21 -11.334 4.807 1.541
167 HB2 ALA 21 HB2 ALA 21 -10.002 4.017 2.401
168 HB3 ALA 21 HB3 ALA 21 -11.115 3.054 1.397
169 H VAL 22 H VAL 22 -13.623 5.634 3.038
170 HA VAL 22 HA VAL 22 -16.086 4.286 2.983
171 HB VAL 22 HB VAL 22 -16.992 6.372 1.925
172 HG11 VAL 22 HG11 VAL 22 -15.227 6.912 4.322
173 HG12 VAL 22 HG12 VAL 22 -16.718 7.751 3.860
174 HG13 VAL 22 HG13 VAL 22 -16.790 6.062 4.387
175 HG21 VAL 22 HG21 VAL 22 -14.099 7.355 2.053
176 HG22 VAL 22 HG22 VAL 22 -15.149 7.230 0.617
177 HG23 VAL 22 HG23 VAL 22 -15.519 8.390 1.880
178 H ASP 23 H ASP 23 -14.053 5.322 0.220
179 HA ASP 23 HA ASP 23 -15.150 3.234 -1.526
180 HB2 ASP 23 HB2 ASP 23 -16.629 4.971 -2.152
181 HB3 ASP 23 HB3 ASP 23 -15.364 6.189 -2.112
182 H ALA 24 H ALA 24 -13.656 2.923 -3.350
183 HA ALA 24 HA ALA 24 -10.985 2.916 -2.478
184 HB1 ALA 24 HB1 ALA 24 -10.471 2.090 -4.757
185 HB2 ALA 24 HB2 ALA 24 -12.157 2.398 -5.224
186 HB3 ALA 24 HB3 ALA 24 -11.764 1.210 -3.941
187 H ALA 25 H ALA 25 -12.686 5.574 -4.109
188 HA ALA 25 HA ALA 25 -10.564 6.787 -5.434
189 HB1 ALA 25 HB1 ALA 25 -12.898 7.629 -5.452
190 HB2 ALA 25 HB2 ALA 25 -12.721 8.191 -3.784
191 HB3 ALA 25 HB3 ALA 25 -11.739 8.917 -5.078
192 H THR 26 H THR 26 -11.415 7.182 -1.983
193 HA THR 26 HA THR 26 -9.208 8.892 -1.288
194 HB THR 26 HB THR 26 -10.813 7.000 0.494
195 HG1 THR 26 HG1 THR 26 -11.867 9.096 0.967
196 HG21 THR 26 HG21 THR 26 -10.253 8.552 2.321
197 HG22 THR 26 HG22 THR 26 -8.797 7.845 1.652
198 HG23 THR 26 HG23 THR 26 -9.249 9.515 1.225
199 H ALA 27 H ALA 27 -9.604 5.349 -1.386
200 HA ALA 27 HA ALA 27 -7.221 4.719 0.058
201 HB1 ALA 27 HB1 ALA 27 -8.713 3.063 -2.004
202 HB2 ALA 27 HB2 ALA 27 -7.553 2.467 -0.798
203 HB3 ALA 27 HB3 ALA 27 -9.105 3.132 -0.267
204 H GLU 28 H GLU 28 -7.926 4.885 -3.501
205 HA GLU 28 HA GLU 28 -5.399 4.257 -4.443
206 HB2 GLU 28 HB2 GLU 28 -7.513 4.438 -5.711
207 HB3 GLU 28 HB3 GLU 28 -7.414 6.198 -5.613
208 HG2 GLU 28 HG2 GLU 28 -5.303 6.146 -6.915
209 HG3 GLU 28 HG3 GLU 28 -5.345 4.381 -6.925
210 H LYS 29 H LYS 29 -6.537 7.329 -3.165
211 HA LYS 29 HA LYS 29 -4.176 8.884 -3.878
212 HB2 LYS 29 HB2 LYS 29 -6.380 9.389 -1.812
213 HB3 LYS 29 HB3 LYS 29 -5.153 10.569 -2.281
214 HG2 LYS 29 HG2 LYS 29 -6.029 10.735 -4.524
215 HG3 LYS 29 HG3 LYS 29 -6.999 9.289 -4.304
216 HD2 LYS 29 HD2 LYS 29 -8.334 10.539 -2.541
217 HD3 LYS 29 HD3 LYS 29 -7.517 12.015 -3.100
218 HE2 LYS 29 HE2 LYS 29 -8.320 11.556 -5.417
219 HE3 LYS 29 HE3 LYS 29 -9.090 10.071 -4.853
220 HZ1 LYS 29 HZ1 LYS 29 -9.832 12.812 -4.080
221 HZ2 LYS 29 HZ2 LYS 29 -10.687 11.773 -5.016
222 HZ3 LYS 29 HZ3 LYS 29 -10.498 11.452 -3.408
223 H VAL 30 H VAL 30 -5.418 7.405 -0.827
224 HA VAL 30 HA VAL 30 -3.179 8.137 0.695
225 HB VAL 30 HB VAL 30 -5.544 7.156 1.439
226 HG11 VAL 30 HG11 VAL 30 -3.752 4.754 1.935
227 HG12 VAL 30 HG12 VAL 30 -5.414 5.000 2.507
228 HG13 VAL 30 HG13 VAL 30 -5.094 4.783 0.785
229 HG21 VAL 30 HG21 VAL 30 -4.596 6.965 3.709
230 HG22 VAL 30 HG22 VAL 30 -2.948 6.903 3.026
231 HG23 VAL 30 HG23 VAL 30 -3.948 8.359 2.849
232 H PHE 31 H PHE 31 -3.611 5.333 -1.486
233 HA PHE 31 HA PHE 31 -1.547 3.723 -0.505
234 HB2 PHE 31 HB2 PHE 31 -2.208 4.331 -3.421
235 HB3 PHE 31 HB3 PHE 31 -1.278 2.958 -2.856
236 HD1 PHE 31 HD1 PHE 31 -3.611 2.706 -0.408
237 HD2 PHE 31 HD2 PHE 31 -3.373 2.567 -4.728
238 HE1 PHE 31 HE1 PHE 31 -5.520 1.150 -0.481
239 HE2 PHE 31 HE2 PHE 31 -5.321 1.044 -4.777
240 HZ PHE 31 HZ PHE 31 -6.373 0.312 -2.658
241 H LYS 32 H LYS 32 -1.227 6.465 -2.875
242 HA LYS 32 HA LYS 32 1.643 6.064 -2.993
243 HB2 LYS 32 HB2 LYS 32 0.405 7.014 -4.862
244 HB3 LYS 32 HB3 LYS 32 -0.054 8.434 -3.905
245 HG2 LYS 32 HG2 LYS 32 2.121 9.311 -3.906
246 HG3 LYS 32 HG3 LYS 32 2.885 7.725 -4.135
247 HD2 LYS 32 HD2 LYS 32 2.158 7.585 -6.408
248 HD3 LYS 32 HD3 LYS 32 1.242 9.108 -6.282
249 HE2 LYS 32 HE2 LYS 32 3.172 10.427 -6.145
250 HE3 LYS 32 HE3 LYS 32 4.197 9.067 -5.657
251 HZ1 LYS 32 HZ1 LYS 32 2.935 9.119 -8.308
252 HZ2 LYS 32 HZ2 LYS 32 4.425 9.829 -7.998
253 HZ3 LYS 32 HZ3 LYS 32 4.186 8.207 -7.782
254 H GLN 33 H GLN 33 -0.460 8.404 -1.313
255 HA GLN 33 HA GLN 33 1.522 10.025 -0.165
256 HB2 GLN 33 HB2 GLN 33 -0.858 10.553 -0.171
257 HB3 GLN 33 HB3 GLN 33 -1.225 9.105 0.764
258 HG2 GLN 33 HG2 GLN 33 0.047 10.077 2.712
259 HG3 GLN 33 HG3 GLN 33 0.206 11.575 1.789
260 HE21 GLN 33 HE21 GLN 33 -3.182 10.882 3.817
261 HE22 GLN 33 HE22 GLN 33 -1.817 9.796 3.950
262 H TYR 34 H TYR 34 -0.050 7.086 1.233
263 HA TYR 34 HA TYR 34 1.467 7.105 3.626
264 HB2 TYR 34 HB2 TYR 34 -0.702 5.943 3.398
265 HB3 TYR 34 HB3 TYR 34 -0.002 4.815 2.229
266 HD1 TYR 34 HD1 TYR 34 1.351 2.931 2.975
267 HD2 TYR 34 HD2 TYR 34 0.233 6.074 5.689
268 HE1 TYR 34 HE1 TYR 34 2.532 1.744 4.796
269 HE2 TYR 34 HE2 TYR 34 1.443 4.903 7.537
270 HH TYR 34 HH TYR 34 3.061 3.282 7.954
271 H ALA 35 H ALA 35 1.788 4.990 0.671
272 HA ALA 35 HA ALA 35 4.022 3.603 1.643
273 HB1 ALA 35 HB1 ALA 35 3.323 4.255 -1.241
274 HB2 ALA 35 HB2 ALA 35 4.386 2.953 -0.667
275 HB3 ALA 35 HB3 ALA 35 2.672 2.901 -0.265
276 H ASN 36 H ASN 36 3.894 6.741 -0.070
277 HA ASN 36 HA ASN 36 6.639 7.078 -0.576
278 HB2 ASN 36 HB2 ASN 36 5.105 8.598 -1.539
279 HB3 ASN 36 HB3 ASN 36 4.418 9.038 0.031
280 HD21 ASN 36 HD21 ASN 36 8.140 10.523 -0.953
281 HD22 ASN 36 HD22 ASN 36 7.465 9.183 -1.870
282 H ASP 37 H ASP 37 4.926 7.299 2.565
283 HA ASP 37 HA ASP 37 6.938 8.807 3.898
284 HB2 ASP 37 HB2 ASP 37 4.539 8.312 4.655
285 HB3 ASP 37 HB3 ASP 37 5.145 6.747 5.218
286 H ASN 38 H ASN 38 6.828 5.455 2.923
287 HA ASN 38 HA ASN 38 9.010 4.545 4.704
288 HB2 ASN 38 HB2 ASN 38 7.223 3.270 2.648
289 HB3 ASN 38 HB3 ASN 38 8.808 2.573 2.869
290 HD21 ASN 38 HD21 ASN 38 5.943 1.338 5.278
291 HD22 ASN 38 HD22 ASN 38 5.682 2.324 3.872
292 H GLY 39 H GLY 39 9.011 6.683 2.153
293 HA2 GLY 39 HA2 GLY 39 10.586 7.424 0.686
294 HA3 GLY 39 HA3 GLY 39 11.778 6.488 1.613
295 H VAL 40 H VAL 40 8.956 5.212 -0.084
296 HA VAL 40 HA VAL 40 10.491 3.218 -1.424
297 HB VAL 40 HB VAL 40 8.276 2.471 -2.243
298 HG11 VAL 40 HG11 VAL 40 7.267 2.002 -0.105
299 HG12 VAL 40 HG12 VAL 40 9.032 1.879 0.040
300 HG13 VAL 40 HG13 VAL 40 8.180 3.313 0.659
301 HG21 VAL 40 HG21 VAL 40 7.380 5.185 -1.210
302 HG22 VAL 40 HG22 VAL 40 7.039 4.425 -2.764
303 HG23 VAL 40 HG23 VAL 40 6.264 3.848 -1.281
304 H ASP 41 H ASP 41 10.790 2.748 -3.423
305 HA ASP 41 HA ASP 41 10.017 4.375 -5.741
306 HB2 ASP 41 HB2 ASP 41 12.250 5.138 -4.847
307 HB3 ASP 41 HB3 ASP 41 12.882 3.512 -5.121
308 H GLY 42 H GLY 42 8.756 2.610 -6.832
309 HA2 GLY 42 HA2 GLY 42 10.036 0.347 -7.722
310 HA3 GLY 42 HA3 GLY 42 9.401 -0.138 -6.148
311 H GLU 43 H GLU 43 8.500 -1.569 -8.009
312 HA GLU 43 HA GLU 43 6.073 -0.686 -9.338
313 HB2 GLU 43 HB2 GLU 43 6.027 -2.961 -10.238
314 HB3 GLU 43 HB3 GLU 43 7.477 -2.077 -10.643
315 HG2 GLU 43 HG2 GLU 43 8.867 -3.394 -9.258
316 HG3 GLU 43 HG3 GLU 43 7.518 -4.015 -8.317
317 H TRP 44 H TRP 44 4.003 -1.630 -9.014
318 HA TRP 44 HA TRP 44 3.539 -2.663 -6.265
319 HB2 TRP 44 HB2 TRP 44 1.845 -0.979 -8.150
320 HB3 TRP 44 HB3 TRP 44 1.269 -1.660 -6.639
321 HD1 TRP 44 HD1 TRP 44 4.469 0.431 -7.457
322 HE1 TRP 44 HE1 TRP 44 4.932 1.896 -5.489
323 HE3 TRP 44 HE3 TRP 44 0.356 -0.665 -4.649
324 HZ2 TRP 44 HZ2 TRP 44 3.286 3.134 -3.338
325 HZ3 TRP 44 HZ3 TRP 44 -0.121 0.626 -2.589
326 HH2 TRP 44 HH2 TRP 44 1.298 2.525 -1.950
327 H THR 45 H THR 45 2.108 -4.329 -5.902
328 HA THR 45 HA THR 45 0.826 -5.789 -8.133
329 HB THR 45 HB THR 45 2.531 -6.988 -5.886
330 HG1 THR 45 HG1 THR 45 3.689 -6.145 -7.795
331 HG21 THR 45 HG21 THR 45 2.174 -9.138 -7.155
332 HG22 THR 45 HG22 THR 45 0.699 -8.517 -6.406
333 HG23 THR 45 HG23 THR 45 0.972 -8.309 -8.155
334 H TYR 46 H TYR 46 -1.108 -7.055 -7.224
335 HA TYR 46 HA TYR 46 -1.890 -6.285 -4.479
336 HB2 TYR 46 HB2 TYR 46 -2.872 -4.597 -5.830
337 HB3 TYR 46 HB3 TYR 46 -3.409 -5.739 -7.025
338 HD1 TYR 46 HD1 TYR 46 -3.851 -4.956 -3.390
339 HD2 TYR 46 HD2 TYR 46 -5.646 -6.528 -6.979
340 HE1 TYR 46 HE1 TYR 46 -6.063 -4.953 -2.287
341 HE2 TYR 46 HE2 TYR 46 -7.856 -6.578 -5.860
342 HH TYR 46 HH TYR 46 -9.000 -6.300 -3.680
343 H ASP 47 H ASP 47 -3.088 -7.715 -3.413
344 HA ASP 47 HA ASP 47 -4.041 -10.254 -4.621
345 HB2 ASP 47 HB2 ASP 47 -2.050 -9.798 -2.450
346 HB3 ASP 47 HB3 ASP 47 -3.339 -10.926 -2.039
347 H ASP 48 H ASP 48 -6.158 -9.643 -4.709
348 HA ASP 48 HA ASP 48 -7.602 -8.083 -2.922
349 HB2 ASP 48 HB2 ASP 48 -8.261 -8.749 -5.257
350 HB3 ASP 48 HB3 ASP 48 -8.744 -10.320 -4.617
351 H ALA 49 H ALA 49 -6.890 -11.514 -2.425
352 HA ALA 49 HA ALA 49 -9.076 -12.177 -0.800
353 HB1 ALA 49 HB1 ALA 49 -7.423 -13.814 -1.577
354 HB2 ALA 49 HB2 ALA 49 -6.185 -13.113 -0.506
355 HB3 ALA 49 HB3 ALA 49 -7.617 -13.914 0.174
356 H THR 50 H THR 50 -6.195 -10.370 0.078
357 HA THR 50 HA THR 50 -7.361 -9.707 2.737
358 HB THR 50 HB THR 50 -5.771 -11.215 3.369
359 HG1 THR 50 HG1 THR 50 -4.819 -8.665 3.478
360 HG21 THR 50 HG21 THR 50 -4.039 -10.371 1.043
361 HG22 THR 50 HG22 THR 50 -3.432 -11.367 2.399
362 HG23 THR 50 HG23 THR 50 -4.753 -11.936 1.380
363 H LYS 51 H LYS 51 -6.953 -8.430 -0.198
364 HA LYS 51 HA LYS 51 -6.596 -6.708 -1.228
365 HB2 LYS 51 HB2 LYS 51 -7.653 -5.467 1.322
366 HB3 LYS 51 HB3 LYS 51 -7.558 -4.646 -0.261
367 HG2 LYS 51 HG2 LYS 51 -8.849 -6.706 -1.176
368 HG3 LYS 51 HG3 LYS 51 -9.201 -7.098 0.498
369 HD2 LYS 51 HD2 LYS 51 -10.512 -5.127 0.785
370 HD3 LYS 51 HD3 LYS 51 -9.949 -4.424 -0.763
371 HE2 LYS 51 HE2 LYS 51 -11.093 -6.155 -2.008
372 HE3 LYS 51 HE3 LYS 51 -11.358 -7.091 -0.530
373 HZ1 LYS 51 HZ1 LYS 51 -12.864 -5.407 0.252
374 HZ2 LYS 51 HZ2 LYS 51 -12.651 -4.507 -1.118
375 HZ3 LYS 51 HZ3 LYS 51 -13.341 -5.994 -1.202
376 H THR 52 H THR 52 -4.444 -7.887 -0.158
377 HA THR 52 HA THR 52 -2.496 -6.158 0.971
378 HB THR 52 HB THR 52 -2.632 -8.933 -0.203
379 HG1 THR 52 HG1 THR 52 -2.441 -9.410 2.001
380 HG21 THR 52 HG21 THR 52 -0.151 -7.845 1.180
381 HG22 THR 52 HG22 THR 52 -0.447 -9.501 0.644
382 HG23 THR 52 HG23 THR 52 -0.267 -8.211 -0.553
383 H PHE 53 H PHE 53 -1.529 -4.600 -0.086
384 HA PHE 53 HA PHE 53 -0.912 -4.842 -2.979
385 HB2 PHE 53 HB2 PHE 53 -1.143 -2.485 -1.073
386 HB3 PHE 53 HB3 PHE 53 -0.386 -2.373 -2.655
387 HD1 PHE 53 HD1 PHE 53 -1.652 -2.552 -4.734
388 HD2 PHE 53 HD2 PHE 53 -3.608 -2.721 -0.888
389 HE1 PHE 53 HE1 PHE 53 -3.810 -1.970 -5.805
390 HE2 PHE 53 HE2 PHE 53 -5.751 -2.092 -1.957
391 HZ PHE 53 HZ PHE 53 -5.837 -1.672 -4.439
392 H THR 54 H THR 54 1.260 -5.131 -3.416
393 HA THR 54 HA THR 54 3.197 -4.864 -1.180
394 HB THR 54 HB THR 54 3.087 -7.136 -3.200
395 HG1 THR 54 HG1 THR 54 2.681 -8.313 -1.194
396 HG21 THR 54 HG21 THR 54 4.743 -8.169 -1.566
397 HG22 THR 54 HG22 THR 54 5.366 -6.813 -2.504
398 HG23 THR 54 HG23 THR 54 4.898 -6.574 -0.810
399 H VAL 55 H VAL 55 5.205 -4.125 -1.722
400 HA VAL 55 HA VAL 55 5.828 -3.389 -4.513
401 HB VAL 55 HB VAL 55 5.847 -1.672 -2.035
402 HG11 VAL 55 HG11 VAL 55 7.424 -1.079 -4.585
403 HG12 VAL 55 HG12 VAL 55 7.127 0.064 -3.260
404 HG13 VAL 55 HG13 VAL 55 8.112 -1.354 -2.966
405 HG21 VAL 55 HG21 VAL 55 3.898 -1.775 -3.766
406 HG22 VAL 55 HG22 VAL 55 4.534 -0.185 -3.350
407 HG23 VAL 55 HG23 VAL 55 5.021 -0.977 -4.867
408 H THR 56 H THR 56 7.887 -3.766 -5.095
409 HA THR 56 HA THR 56 9.830 -4.757 -3.075
410 HB THR 56 HB THR 56 10.545 -6.315 -4.953
411 HG1 THR 56 HG1 THR 56 9.367 -5.179 -6.585
412 HG21 THR 56 HG21 THR 56 9.210 -7.097 -3.014
413 HG22 THR 56 HG22 THR 56 7.711 -6.734 -3.896
414 HG23 THR 56 HG23 THR 56 8.816 -7.979 -4.500
415 H GLU 57 H GLU 57 11.382 -3.214 -2.954
416 HA GLU 57 HA GLU 57 11.974 -1.329 -5.077
417 HB2 GLU 57 HB2 GLU 57 12.238 -1.082 -2.533
418 HB3 GLU 57 HB3 GLU 57 13.698 -2.044 -2.663
419 HG2 GLU 57 HG2 GLU 57 14.802 -0.414 -4.037
420 HG3 GLU 57 HG3 GLU 57 13.316 0.493 -4.287
Start of MODEL 17
1 H1 MET 1 H MET 1 -16.998 1.108 3.224
2 HA MET 1 HA MET 1 -17.219 0.086 1.035
3 HB2 MET 1 HB2 MET 1 -15.921 1.535 -0.274
4 HB3 MET 1 HB3 MET 1 -14.448 1.235 0.658
5 HG2 MET 1 HG2 MET 1 -14.351 0.127 -1.508
6 HG3 MET 1 HG3 MET 1 -14.368 -1.062 -0.221
7 HE1 MET 1 HE1 MET 1 -17.133 1.023 -2.208
8 HE2 MET 1 HE2 MET 1 -15.991 0.326 -3.382
9 HE3 MET 1 HE3 MET 1 -17.669 -0.240 -3.328
10 H GLY 2 H GLY 2 -13.775 -0.314 2.250
11 HA2 GLY 2 HA2 GLY 2 -14.483 -2.568 3.821
12 HA3 GLY 2 HA3 GLY 2 -13.804 -3.052 2.250
13 H THR 3 H THR 3 -12.067 -3.898 3.771
14 HA THR 3 HA THR 3 -10.185 -1.772 4.481
15 HB THR 3 HB THR 3 -10.854 -3.017 6.407
16 HG1 THR 3 HG1 THR 3 -8.665 -2.416 6.171
17 HG21 THR 3 HG21 THR 3 -11.571 -5.151 5.437
18 HG22 THR 3 HG22 THR 3 -9.897 -5.530 4.973
19 HG23 THR 3 HG23 THR 3 -10.343 -5.412 6.693
20 H TYR 4 H TYR 4 -8.049 -1.876 3.838
21 HA TYR 4 HA TYR 4 -7.282 -3.852 1.777
22 HB2 TYR 4 HB2 TYR 4 -7.034 -0.834 1.503
23 HB3 TYR 4 HB3 TYR 4 -6.415 -2.033 0.382
24 HD1 TYR 4 HD1 TYR 4 -7.843 -2.846 -1.425
25 HD2 TYR 4 HD2 TYR 4 -9.611 -0.654 1.857
26 HE1 TYR 4 HE1 TYR 4 -10.044 -2.847 -2.585
27 HE2 TYR 4 HE2 TYR 4 -11.799 -0.782 0.754
28 HH TYR 4 HH TYR 4 -12.394 -2.602 -2.252
29 H LYS 5 H LYS 5 -5.114 -4.517 2.006
30 HA LYS 5 HA LYS 5 -3.718 -3.379 4.391
31 HB2 LYS 5 HB2 LYS 5 -4.377 -5.727 4.320
32 HB3 LYS 5 HB3 LYS 5 -3.400 -5.983 2.888
33 HG2 LYS 5 HG2 LYS 5 -1.341 -5.496 4.223
34 HG3 LYS 5 HG3 LYS 5 -2.370 -5.259 5.665
35 HD2 LYS 5 HD2 LYS 5 -3.270 -7.540 5.418
36 HD3 LYS 5 HD3 LYS 5 -2.288 -7.782 3.963
37 HE2 LYS 5 HE2 LYS 5 -0.236 -7.433 5.444
38 HE3 LYS 5 HE3 LYS 5 -1.338 -7.496 6.834
39 HZ1 LYS 5 HZ1 LYS 5 -0.437 -9.663 6.367
40 HZ2 LYS 5 HZ2 LYS 5 -2.043 -9.713 6.012
41 HZ3 LYS 5 HZ3 LYS 5 -0.915 -9.600 4.801
42 H LEU 6 H LEU 6 -1.718 -2.441 4.259
43 HA LEU 6 HA LEU 6 -0.450 -2.115 1.558
44 HB2 LEU 6 HB2 LEU 6 -0.908 -0.072 3.748
45 HB3 LEU 6 HB3 LEU 6 0.249 0.172 2.440
46 HG LEU 6 HG LEU 6 -2.628 -0.505 1.795
47 HD11 LEU 6 HD11 LEU 6 -2.588 1.455 3.369
48 HD12 LEU 6 HD12 LEU 6 -1.607 2.336 2.193
49 HD13 LEU 6 HD13 LEU 6 -3.258 1.800 1.778
50 HD21 LEU 6 HD21 LEU 6 -0.708 1.284 0.262
51 HD22 LEU 6 HD22 LEU 6 -0.615 -0.467 0.132
52 HD23 LEU 6 HD23 LEU 6 -2.108 0.346 -0.334
53 H ILE 7 H ILE 7 1.325 -3.261 1.617
54 HA ILE 7 HA ILE 7 3.292 -3.008 3.835
55 HB ILE 7 HB ILE 7 2.270 -5.127 4.086
56 HG12 ILE 7 HG12 ILE 7 4.859 -5.813 2.655
57 HG13 ILE 7 HG13 ILE 7 4.821 -4.907 4.163
58 HG21 ILE 7 HG21 ILE 7 2.221 -6.897 2.314
59 HG22 ILE 7 HG22 ILE 7 1.199 -5.507 1.947
60 HG23 ILE 7 HG23 ILE 7 2.764 -5.687 1.140
61 HD11 ILE 7 HD11 ILE 7 3.515 -6.773 5.238
62 HD12 ILE 7 HD12 ILE 7 3.791 -7.725 3.768
63 HD13 ILE 7 HD13 ILE 7 5.162 -7.193 4.752
64 H LEU 8 H LEU 8 5.314 -2.509 3.355
65 HA LEU 8 HA LEU 8 6.101 -2.192 0.504
66 HB2 LEU 8 HB2 LEU 8 6.803 -0.350 2.817
67 HB3 LEU 8 HB3 LEU 8 7.377 -0.224 1.174
68 HG LEU 8 HG LEU 8 5.781 1.451 1.408
69 HD11 LEU 8 HD11 LEU 8 4.441 -0.854 -0.058
70 HD12 LEU 8 HD12 LEU 8 3.862 0.801 -0.108
71 HD13 LEU 8 HD13 LEU 8 5.459 0.410 -0.745
72 HD21 LEU 8 HD21 LEU 8 4.673 0.580 3.469
73 HD22 LEU 8 HD22 LEU 8 3.629 1.365 2.278
74 HD23 LEU 8 HD23 LEU 8 3.620 -0.397 2.417
75 H ASN 9 H ASN 9 8.208 -2.750 -0.076
76 HA ASN 9 HA ASN 9 9.956 -3.916 2.021
77 HB2 ASN 9 HB2 ASN 9 9.558 -5.022 -0.777
78 HB3 ASN 9 HB3 ASN 9 10.616 -5.649 0.466
79 HD21 ASN 9 HD21 ASN 9 6.808 -6.867 0.133
80 HD22 ASN 9 HD22 ASN 9 7.457 -5.548 -0.804
81 H GLY 10 H GLY 10 11.627 -2.441 2.128
82 HA2 GLY 10 HA2 GLY 10 12.742 -1.312 -0.388
83 HA3 GLY 10 HA3 GLY 10 12.783 -0.565 1.214
84 H LYS 11 H LYS 11 15.156 -0.537 0.302
85 HA LYS 11 HA LYS 11 16.657 -3.022 0.459
86 HB2 LYS 11 HB2 LYS 11 17.336 -1.052 -0.890
87 HB3 LYS 11 HB3 LYS 11 17.613 -0.119 0.590
88 HG2 LYS 11 HG2 LYS 11 19.420 -1.644 1.257
89 HG3 LYS 11 HG3 LYS 11 19.050 -2.702 -0.117
90 HD2 LYS 11 HD2 LYS 11 19.638 -0.892 -1.692
91 HD3 LYS 11 HD3 LYS 11 20.073 0.162 -0.342
92 HE2 LYS 11 HE2 LYS 11 21.370 -2.545 -0.953
93 HE3 LYS 11 HE3 LYS 11 22.006 -0.988 -1.484
94 HZ1 LYS 11 HZ1 LYS 11 23.152 -1.546 0.463
95 HZ2 LYS 11 HZ2 LYS 11 22.162 -0.347 0.888
96 HZ3 LYS 11 HZ3 LYS 11 21.798 -1.903 1.316
97 H THR 12 H THR 12 16.287 -0.226 2.732
98 HA THR 12 HA THR 12 17.100 -2.025 4.924
99 HB THR 12 HB THR 12 19.011 -0.772 4.374
100 HG1 THR 12 HG1 THR 12 17.669 -0.183 6.730
101 HG21 THR 12 HG21 THR 12 19.223 1.632 4.578
102 HG22 THR 12 HG22 THR 12 18.140 1.210 3.276
103 HG23 THR 12 HG23 THR 12 17.466 1.799 4.822
104 H LEU 13 H LEU 13 14.468 -0.525 3.705
105 HA LEU 13 HA LEU 13 13.362 0.007 6.417
106 HB2 LEU 13 HB2 LEU 13 12.912 1.512 3.804
107 HB3 LEU 13 HB3 LEU 13 11.883 1.695 5.218
108 HG LEU 13 HG LEU 13 14.862 2.342 5.197
109 HD11 LEU 13 HD11 LEU 13 13.660 3.863 3.725
110 HD12 LEU 13 HD12 LEU 13 12.407 4.131 4.952
111 HD13 LEU 13 HD13 LEU 13 14.063 4.699 5.247
112 HD21 LEU 13 HD21 LEU 13 14.342 3.524 7.302
113 HD22 LEU 13 HD22 LEU 13 12.674 2.930 7.245
114 HD23 LEU 13 HD23 LEU 13 14.040 1.801 7.453
115 H LYS 14 H LYS 14 11.317 -0.665 6.778
116 HA LYS 14 HA LYS 14 9.729 -1.977 4.654
117 HB2 LYS 14 HB2 LYS 14 10.909 -3.340 7.105
118 HB3 LYS 14 HB3 LYS 14 9.312 -3.800 6.531
119 HG2 LYS 14 HG2 LYS 14 10.293 -4.159 4.234
120 HG3 LYS 14 HG3 LYS 14 11.908 -3.981 4.949
121 HD2 LYS 14 HD2 LYS 14 11.561 -5.926 6.362
122 HD3 LYS 14 HD3 LYS 14 9.829 -5.941 5.997
123 HE2 LYS 14 HE2 LYS 14 10.455 -6.319 3.548
124 HE3 LYS 14 HE3 LYS 14 12.108 -6.611 4.104
125 HZ1 LYS 14 HZ1 LYS 14 10.779 -8.644 3.858
126 HZ2 LYS 14 HZ2 LYS 14 11.236 -8.455 5.438
127 HZ3 LYS 14 HZ3 LYS 14 9.699 -8.092 4.935
128 H GLY 15 H GLY 15 7.507 -2.480 5.511
129 HA2 GLY 15 HA2 GLY 15 6.540 -1.363 7.919
130 HA3 GLY 15 HA3 GLY 15 6.214 -0.235 6.599
131 H GLU 16 H GLU 16 4.169 -1.639 8.023
132 HA GLU 16 HA GLU 16 2.773 -2.832 5.833
133 HB2 GLU 16 HB2 GLU 16 2.301 -4.993 6.852
134 HB3 GLU 16 HB3 GLU 16 4.001 -4.817 6.437
135 HG2 GLU 16 HG2 GLU 16 4.580 -4.427 8.805
136 HG3 GLU 16 HG3 GLU 16 2.874 -4.590 9.256
137 H THR 17 H THR 17 0.687 -2.226 6.047
138 HA THR 17 HA THR 17 -0.436 -1.958 8.768
139 HB THR 17 HB THR 17 0.710 0.249 8.170
140 HG1 THR 17 HG1 THR 17 -0.957 1.439 8.971
141 HG21 THR 17 HG21 THR 17 0.078 0.310 5.766
142 HG22 THR 17 HG22 THR 17 -1.630 0.520 6.209
143 HG23 THR 17 HG23 THR 17 -0.456 1.758 6.644
144 H THR 18 H THR 18 -2.753 -0.932 8.322
145 HA THR 18 HA THR 18 -4.006 -2.161 5.980
146 HB THR 18 HB THR 18 -3.968 -3.577 8.272
147 HG1 THR 18 HG1 THR 18 -5.478 -4.740 7.387
148 HG21 THR 18 HG21 THR 18 -6.084 -3.443 9.450
149 HG22 THR 18 HG22 THR 18 -5.231 -1.893 9.586
150 HG23 THR 18 HG23 THR 18 -6.607 -2.067 8.473
151 H THR 19 H THR 19 -6.225 -1.234 5.713
152 HA THR 19 HA THR 19 -6.602 1.433 6.945
153 HB THR 19 HB THR 19 -7.000 2.330 4.609
154 HG1 THR 19 HG1 THR 19 -5.868 -0.167 3.917
155 HG21 THR 19 HG21 THR 19 -4.678 2.725 3.960
156 HG22 THR 19 HG22 THR 19 -4.930 2.938 5.686
157 HG23 THR 19 HG23 THR 19 -4.129 1.469 5.093
158 H GLU 20 H GLU 20 -8.762 2.165 6.676
159 HA GLU 20 HA GLU 20 -10.793 0.346 5.542
160 HB2 GLU 20 HB2 GLU 20 -10.877 -0.001 7.966
161 HB3 GLU 20 HB3 GLU 20 -10.815 1.747 8.254
162 HG2 GLU 20 HG2 GLU 20 -13.001 2.026 7.103
163 HG3 GLU 20 HG3 GLU 20 -13.042 0.294 6.752
164 H ALA 21 H ALA 21 -11.781 1.620 3.921
165 HA ALA 21 HA ALA 21 -11.770 4.568 4.330
166 HB1 ALA 21 HB1 ALA 21 -11.164 4.846 1.942
167 HB2 ALA 21 HB2 ALA 21 -9.875 4.078 2.890
168 HB3 ALA 21 HB3 ALA 21 -10.896 3.094 1.826
169 H VAL 22 H VAL 22 -13.354 5.700 3.187
170 HA VAL 22 HA VAL 22 -15.927 4.553 3.194
171 HB VAL 22 HB VAL 22 -16.607 6.664 2.021
172 HG11 VAL 22 HG11 VAL 22 -14.790 7.078 4.429
173 HG12 VAL 22 HG12 VAL 22 -16.124 8.126 3.897
174 HG13 VAL 22 HG13 VAL 22 -16.470 6.492 4.471
175 HG21 VAL 22 HG21 VAL 22 -13.634 7.397 2.133
176 HG22 VAL 22 HG22 VAL 22 -14.638 7.237 0.672
177 HG23 VAL 22 HG23 VAL 22 -14.970 8.517 1.823
178 H ASP 23 H ASP 23 -13.728 5.259 0.421
179 HA ASP 23 HA ASP 23 -15.061 3.202 -1.213
180 HB2 ASP 23 HB2 ASP 23 -16.334 5.153 -1.765
181 HB3 ASP 23 HB3 ASP 23 -14.876 6.152 -1.821
182 H ALA 24 H ALA 24 -13.739 2.705 -3.121
183 HA ALA 24 HA ALA 24 -10.968 2.482 -2.413
184 HB1 ALA 24 HB1 ALA 24 -10.739 1.415 -4.590
185 HB2 ALA 24 HB2 ALA 24 -12.036 0.715 -3.623
186 HB3 ALA 24 HB3 ALA 24 -12.427 1.816 -4.987
187 H ALA 25 H ALA 25 -12.707 4.996 -4.298
188 HA ALA 25 HA ALA 25 -10.433 5.889 -5.762
189 HB1 ALA 25 HB1 ALA 25 -12.755 6.697 -6.185
190 HB2 ALA 25 HB2 ALA 25 -12.716 7.571 -4.636
191 HB3 ALA 25 HB3 ALA 25 -11.621 8.034 -5.941
192 H THR 26 H THR 26 -11.401 6.366 -2.388
193 HA THR 26 HA THR 26 -9.513 8.501 -1.789
194 HB THR 26 HB THR 26 -11.063 6.537 -0.032
195 HG1 THR 26 HG1 THR 26 -11.839 8.524 -1.602
196 HG21 THR 26 HG21 THR 26 -9.874 9.242 0.710
197 HG22 THR 26 HG22 THR 26 -10.902 8.221 1.742
198 HG23 THR 26 HG23 THR 26 -9.299 7.656 1.274
199 H ALA 27 H ALA 27 -9.593 4.951 -1.571
200 HA ALA 27 HA ALA 27 -7.193 4.599 -0.090
201 HB1 ALA 27 HB1 ALA 27 -8.612 2.737 -2.026
202 HB2 ALA 27 HB2 ALA 27 -7.450 2.267 -0.781
203 HB3 ALA 27 HB3 ALA 27 -9.014 2.924 -0.300
204 H GLU 28 H GLU 28 -7.940 4.491 -3.607
205 HA GLU 28 HA GLU 28 -5.468 3.846 -4.630
206 HB2 GLU 28 HB2 GLU 28 -7.755 4.156 -5.730
207 HB3 GLU 28 HB3 GLU 28 -7.350 5.869 -5.901
208 HG2 GLU 28 HG2 GLU 28 -5.380 5.251 -7.270
209 HG3 GLU 28 HG3 GLU 28 -5.713 3.535 -7.000
210 H LYS 29 H LYS 29 -6.524 6.939 -3.404
211 HA LYS 29 HA LYS 29 -4.178 8.463 -4.285
212 HB2 LYS 29 HB2 LYS 29 -6.430 9.154 -2.348
213 HB3 LYS 29 HB3 LYS 29 -5.172 10.271 -2.892
214 HG2 LYS 29 HG2 LYS 29 -5.947 10.129 -5.204
215 HG3 LYS 29 HG3 LYS 29 -7.104 8.866 -4.793
216 HD2 LYS 29 HD2 LYS 29 -8.233 10.524 -3.209
217 HD3 LYS 29 HD3 LYS 29 -7.134 11.745 -3.856
218 HE2 LYS 29 HE2 LYS 29 -9.111 12.050 -5.084
219 HE3 LYS 29 HE3 LYS 29 -8.003 11.208 -6.166
220 HZ1 LYS 29 HZ1 LYS 29 -10.229 10.014 -4.623
221 HZ2 LYS 29 HZ2 LYS 29 -10.165 10.191 -6.253
222 HZ3 LYS 29 HZ3 LYS 29 -9.164 9.121 -5.465
223 H VAL 30 H VAL 30 -5.428 7.280 -1.073
224 HA VAL 30 HA VAL 30 -3.211 8.162 0.355
225 HB VAL 30 HB VAL 30 -5.416 7.247 1.308
226 HG11 VAL 30 HG11 VAL 30 -3.790 4.690 1.641
227 HG12 VAL 30 HG12 VAL 30 -5.403 5.055 2.286
228 HG13 VAL 30 HG13 VAL 30 -5.169 4.852 0.548
229 HG21 VAL 30 HG21 VAL 30 -3.569 8.222 2.640
230 HG22 VAL 30 HG22 VAL 30 -4.344 6.892 3.497
231 HG23 VAL 30 HG23 VAL 30 -2.770 6.635 2.738
232 H PHE 31 H PHE 31 -3.417 5.157 -1.572
233 HA PHE 31 HA PHE 31 -1.224 3.804 -0.490
234 HB2 PHE 31 HB2 PHE 31 -1.894 4.124 -3.446
235 HB3 PHE 31 HB3 PHE 31 -0.959 2.826 -2.740
236 HD1 PHE 31 HD1 PHE 31 -3.146 2.664 -0.270
237 HD2 PHE 31 HD2 PHE 31 -3.259 2.452 -4.577
238 HE1 PHE 31 HE1 PHE 31 -5.217 1.327 -0.147
239 HE2 PHE 31 HE2 PHE 31 -5.353 1.127 -4.435
240 HZ PHE 31 HZ PHE 31 -6.347 0.591 -2.235
241 H LYS 32 H LYS 32 -1.193 6.473 -2.858
242 HA LYS 32 HA LYS 32 1.643 6.411 -3.319
243 HB2 LYS 32 HB2 LYS 32 -0.359 8.671 -3.770
244 HB3 LYS 32 HB3 LYS 32 1.247 8.502 -4.498
245 HG2 LYS 32 HG2 LYS 32 0.553 6.445 -5.646
246 HG3 LYS 32 HG3 LYS 32 -1.071 6.568 -4.937
247 HD2 LYS 32 HD2 LYS 32 -1.367 8.765 -6.082
248 HD3 LYS 32 HD3 LYS 32 0.227 8.569 -6.815
249 HE2 LYS 32 HE2 LYS 32 -1.271 7.816 -8.467
250 HE3 LYS 32 HE3 LYS 32 -0.572 6.355 -7.765
251 HZ1 LYS 32 HZ1 LYS 32 -3.234 7.499 -7.201
252 HZ2 LYS 32 HZ2 LYS 32 -2.912 6.126 -8.029
253 HZ3 LYS 32 HZ3 LYS 32 -2.646 6.200 -6.386
254 H GLN 33 H GLN 33 -0.399 8.146 -0.966
255 HA GLN 33 HA GLN 33 1.783 9.917 -0.120
256 HB2 GLN 33 HB2 GLN 33 -0.492 10.691 0.056
257 HB3 GLN 33 HB3 GLN 33 -1.008 9.278 0.948
258 HG2 GLN 33 HG2 GLN 33 1.148 11.023 2.164
259 HG3 GLN 33 HG3 GLN 33 -0.510 11.602 2.168
260 HE21 GLN 33 HE21 GLN 33 -1.758 8.994 4.393
261 HE22 GLN 33 HE22 GLN 33 -2.205 10.177 3.173
262 H TYR 34 H TYR 34 -0.001 7.164 1.285
263 HA TYR 34 HA TYR 34 1.320 6.850 3.659
264 HB2 TYR 34 HB2 TYR 34 -0.735 5.688 3.152
265 HB3 TYR 34 HB3 TYR 34 0.014 4.806 1.815
266 HD1 TYR 34 HD1 TYR 34 0.886 2.639 2.216
267 HD2 TYR 34 HD2 TYR 34 0.365 5.401 5.452
268 HE1 TYR 34 HE1 TYR 34 1.948 1.000 3.782
269 HE2 TYR 34 HE2 TYR 34 1.590 3.831 7.003
270 HH TYR 34 HH TYR 34 3.435 1.863 6.525
271 H ALA 35 H ALA 35 2.077 5.044 0.624
272 HA ALA 35 HA ALA 35 4.304 3.714 1.807
273 HB1 ALA 35 HB1 ALA 35 3.754 4.252 -1.129
274 HB2 ALA 35 HB2 ALA 35 4.722 2.941 -0.405
275 HB3 ALA 35 HB3 ALA 35 2.971 2.966 -0.167
276 H ASN 36 H ASN 36 4.043 6.796 0.010
277 HA ASN 36 HA ASN 36 6.785 7.144 -0.560
278 HB2 ASN 36 HB2 ASN 36 5.287 8.570 -1.629
279 HB3 ASN 36 HB3 ASN 36 4.484 9.042 -0.124
280 HD21 ASN 36 HD21 ASN 36 8.176 10.714 -0.984
281 HD22 ASN 36 HD22 ASN 36 7.643 9.259 -1.805
282 H ASP 37 H ASP 37 5.055 7.592 2.535
283 HA ASP 37 HA ASP 37 7.111 9.094 3.854
284 HB2 ASP 37 HB2 ASP 37 4.714 8.677 4.651
285 HB3 ASP 37 HB3 ASP 37 5.249 7.051 5.110
286 H ASN 38 H ASN 38 6.781 5.750 3.024
287 HA ASN 38 HA ASN 38 8.834 4.703 4.826
288 HB2 ASN 38 HB2 ASN 38 6.551 3.657 3.890
289 HB3 ASN 38 HB3 ASN 38 7.587 3.175 2.561
290 HD21 ASN 38 HD21 ASN 38 7.260 0.551 5.307
291 HD22 ASN 38 HD22 ASN 38 6.148 1.880 5.087
292 H GLY 39 H GLY 39 8.949 6.583 2.093
293 HA2 GLY 39 HA2 GLY 39 10.547 7.144 0.616
294 HA3 GLY 39 HA3 GLY 39 11.674 6.120 1.517
295 H VAL 40 H VAL 40 8.681 5.128 -0.285
296 HA VAL 40 HA VAL 40 10.299 3.060 -1.603
297 HB VAL 40 HB VAL 40 8.232 2.164 -2.403
298 HG11 VAL 40 HG11 VAL 40 7.226 1.566 -0.363
299 HG12 VAL 40 HG12 VAL 40 8.926 1.824 0.010
300 HG13 VAL 40 HG13 VAL 40 7.727 3.068 0.431
301 HG21 VAL 40 HG21 VAL 40 6.055 3.108 -2.035
302 HG22 VAL 40 HG22 VAL 40 6.770 4.577 -1.290
303 HG23 VAL 40 HG23 VAL 40 6.986 4.208 -3.006
304 H ASP 41 H ASP 41 10.641 2.774 -3.757
305 HA ASP 41 HA ASP 41 9.587 4.690 -5.660
306 HB2 ASP 41 HB2 ASP 41 11.802 5.687 -4.860
307 HB3 ASP 41 HB3 ASP 41 12.600 4.328 -5.671
308 H GLY 42 H GLY 42 8.430 2.549 -5.711
309 HA2 GLY 42 HA2 GLY 42 9.736 0.822 -7.747
310 HA3 GLY 42 HA3 GLY 42 9.221 0.074 -6.239
311 H GLU 43 H GLU 43 8.207 -1.143 -7.949
312 HA GLU 43 HA GLU 43 5.807 -0.290 -9.330
313 HB2 GLU 43 HB2 GLU 43 5.854 -2.693 -10.073
314 HB3 GLU 43 HB3 GLU 43 7.235 -1.720 -10.581
315 HG2 GLU 43 HG2 GLU 43 8.720 -2.774 -9.081
316 HG3 GLU 43 HG3 GLU 43 7.430 -3.381 -8.051
317 H TRP 44 H TRP 44 3.787 -1.275 -9.055
318 HA TRP 44 HA TRP 44 3.270 -2.358 -6.333
319 HB2 TRP 44 HB2 TRP 44 1.604 -0.546 -8.117
320 HB3 TRP 44 HB3 TRP 44 0.977 -1.350 -6.683
321 HD1 TRP 44 HD1 TRP 44 4.064 0.912 -7.400
322 HE1 TRP 44 HE1 TRP 44 4.594 2.212 -5.350
323 HE3 TRP 44 HE3 TRP 44 0.162 -0.638 -4.492
324 HZ2 TRP 44 HZ2 TRP 44 3.238 2.902 -2.837
325 HZ3 TRP 44 HZ3 TRP 44 -0.172 0.331 -2.226
326 HH2 TRP 44 HH2 TRP 44 1.343 2.102 -1.393
327 H THR 45 H THR 45 1.944 -4.052 -6.048
328 HA THR 45 HA THR 45 0.380 -5.174 -8.266
329 HB THR 45 HB THR 45 1.192 -7.478 -7.219
330 HG1 THR 45 HG1 THR 45 2.673 -6.680 -5.761
331 HG21 THR 45 HG21 THR 45 1.362 -6.761 -9.599
332 HG22 THR 45 HG22 THR 45 2.897 -5.952 -9.234
333 HG23 THR 45 HG23 THR 45 2.725 -7.715 -9.054
334 H TYR 46 H TYR 46 -1.403 -6.525 -7.440
335 HA TYR 46 HA TYR 46 -2.031 -6.041 -4.579
336 HB2 TYR 46 HB2 TYR 46 -3.135 -4.284 -5.753
337 HB3 TYR 46 HB3 TYR 46 -3.682 -5.350 -7.015
338 HD1 TYR 46 HD1 TYR 46 -4.087 -4.620 -3.382
339 HD2 TYR 46 HD2 TYR 46 -5.772 -6.524 -6.864
340 HE1 TYR 46 HE1 TYR 46 -6.252 -4.875 -2.209
341 HE2 TYR 46 HE2 TYR 46 -7.937 -6.793 -5.679
342 HH TYR 46 HH TYR 46 -9.040 -6.572 -3.466
343 H ASP 47 H ASP 47 -3.015 -7.643 -3.577
344 HA ASP 47 HA ASP 47 -4.056 -9.966 -5.089
345 HB2 ASP 47 HB2 ASP 47 -1.804 -10.476 -4.284
346 HB3 ASP 47 HB3 ASP 47 -2.287 -10.086 -2.630
347 H ASP 48 H ASP 48 -6.117 -9.865 -4.795
348 HA ASP 48 HA ASP 48 -7.539 -8.444 -2.843
349 HB2 ASP 48 HB2 ASP 48 -8.196 -9.138 -5.216
350 HB3 ASP 48 HB3 ASP 48 -8.642 -10.697 -4.529
351 H ALA 49 H ALA 49 -6.087 -11.572 -2.348
352 HA ALA 49 HA ALA 49 -8.052 -12.855 -0.845
353 HB1 ALA 49 HB1 ALA 49 -5.820 -13.808 -1.527
354 HB2 ALA 49 HB2 ALA 49 -5.082 -12.912 -0.188
355 HB3 ALA 49 HB3 ALA 49 -6.293 -14.168 0.142
356 H THR 50 H THR 50 -5.850 -10.316 0.147
357 HA THR 50 HA THR 50 -7.363 -9.916 2.674
358 HB THR 50 HB THR 50 -5.611 -10.754 3.772
359 HG1 THR 50 HG1 THR 50 -5.475 -8.581 4.310
360 HG21 THR 50 HG21 THR 50 -3.228 -10.770 3.044
361 HG22 THR 50 HG22 THR 50 -4.299 -11.649 1.956
362 HG23 THR 50 HG23 THR 50 -3.728 -10.027 1.506
363 H LYS 51 H LYS 51 -6.376 -8.606 -0.338
364 HA LYS 51 HA LYS 51 -6.721 -6.891 -1.371
365 HB2 LYS 51 HB2 LYS 51 -7.961 -5.650 1.111
366 HB3 LYS 51 HB3 LYS 51 -7.975 -4.984 -0.524
367 HG2 LYS 51 HG2 LYS 51 -9.046 -7.313 -1.155
368 HG3 LYS 51 HG3 LYS 51 -9.387 -7.433 0.571
369 HD2 LYS 51 HD2 LYS 51 -10.708 -5.358 0.488
370 HD3 LYS 51 HD3 LYS 51 -10.255 -5.118 -1.218
371 HE2 LYS 51 HE2 LYS 51 -11.304 -7.285 -1.799
372 HE3 LYS 51 HE3 LYS 51 -11.803 -7.498 -0.119
373 HZ1 LYS 51 HZ1 LYS 51 -13.178 -5.484 -0.374
374 HZ2 LYS 51 HZ2 LYS 51 -12.719 -5.341 -1.945
375 HZ3 LYS 51 HZ3 LYS 51 -13.578 -6.646 -1.447
376 H THR 52 H THR 52 -4.393 -7.764 -0.363
377 HA THR 52 HA THR 52 -2.954 -5.573 0.835
378 HB THR 52 HB THR 52 -2.804 -7.909 1.614
379 HG1 THR 52 HG1 THR 52 -0.368 -6.685 0.859
380 HG21 THR 52 HG21 THR 52 -2.675 -9.043 -0.597
381 HG22 THR 52 HG22 THR 52 -1.014 -8.433 -0.779
382 HG23 THR 52 HG23 THR 52 -1.417 -9.525 0.549
383 H PHE 53 H PHE 53 -1.665 -4.218 -0.123
384 HA PHE 53 HA PHE 53 -1.022 -4.496 -3.014
385 HB2 PHE 53 HB2 PHE 53 -1.157 -2.140 -1.102
386 HB3 PHE 53 HB3 PHE 53 -0.450 -2.048 -2.711
387 HD1 PHE 53 HD1 PHE 53 -1.861 -2.282 -4.747
388 HD2 PHE 53 HD2 PHE 53 -3.591 -2.276 -0.790
389 HE1 PHE 53 HE1 PHE 53 -4.107 -1.880 -5.722
390 HE2 PHE 53 HE2 PHE 53 -5.820 -1.858 -1.781
391 HZ PHE 53 HZ PHE 53 -6.082 -1.640 -4.244
392 H THR 54 H THR 54 1.208 -4.702 -3.478
393 HA THR 54 HA THR 54 3.072 -4.446 -1.180
394 HB THR 54 HB THR 54 3.131 -6.791 -3.097
395 HG1 THR 54 HG1 THR 54 2.284 -7.904 -1.137
396 HG21 THR 54 HG21 THR 54 4.527 -7.781 -1.306
397 HG22 THR 54 HG22 THR 54 5.245 -6.312 -1.938
398 HG23 THR 54 HG23 THR 54 4.408 -6.281 -0.366
399 H VAL 55 H VAL 55 5.120 -3.718 -1.671
400 HA VAL 55 HA VAL 55 5.790 -3.079 -4.491
401 HB VAL 55 HB VAL 55 6.043 -1.391 -1.975
402 HG11 VAL 55 HG11 VAL 55 8.153 -1.139 -3.215
403 HG12 VAL 55 HG12 VAL 55 7.252 -0.815 -4.713
404 HG13 VAL 55 HG13 VAL 55 7.186 0.318 -3.337
405 HG21 VAL 55 HG21 VAL 55 3.857 -1.233 -3.206
406 HG22 VAL 55 HG22 VAL 55 4.783 0.278 -3.234
407 HG23 VAL 55 HG23 VAL 55 4.770 -0.774 -4.665
408 H THR 56 H THR 56 7.868 -3.632 -5.002
409 HA THR 56 HA THR 56 9.675 -4.537 -2.846
410 HB THR 56 HB THR 56 9.302 -5.968 -5.500
411 HG1 THR 56 HG1 THR 56 7.426 -6.241 -4.396
412 HG21 THR 56 HG21 THR 56 10.510 -7.775 -4.358
413 HG22 THR 56 HG22 THR 56 11.482 -6.291 -4.337
414 HG23 THR 56 HG23 THR 56 10.612 -6.805 -2.868
415 H GLU 57 H GLU 57 11.223 -2.962 -2.859
416 HA GLU 57 HA GLU 57 11.900 -1.484 -5.284
417 HB2 GLU 57 HB2 GLU 57 12.076 -0.696 -2.797
418 HB3 GLU 57 HB3 GLU 57 13.590 -1.582 -2.740
419 HG2 GLU 57 HG2 GLU 57 14.433 -0.274 -4.686
420 HG3 GLU 57 HG3 GLU 57 12.900 0.606 -4.757
Start of MODEL 18
1 H1 MET 1 H MET 1 -16.821 0.712 2.506
2 HA MET 1 HA MET 1 -16.742 0.194 0.158
3 HB2 MET 1 HB2 MET 1 -14.687 2.093 0.082
4 HB3 MET 1 HB3 MET 1 -13.847 0.591 -0.216
5 HG2 MET 1 HG2 MET 1 -14.687 1.493 -2.330
6 HG3 MET 1 HG3 MET 1 -15.486 -0.029 -1.938
7 HE1 MET 1 HE1 MET 1 -16.488 1.768 -4.154
8 HE2 MET 1 HE2 MET 1 -17.477 0.371 -3.686
9 HE3 MET 1 HE3 MET 1 -18.236 1.962 -3.872
10 H GLY 2 H GLY 2 -13.633 -0.267 2.142
11 HA2 GLY 2 HA2 GLY 2 -14.292 -2.761 2.982
12 HA3 GLY 2 HA3 GLY 2 -13.465 -2.981 1.405
13 H THR 3 H THR 3 -11.999 -4.047 3.104
14 HA THR 3 HA THR 3 -10.194 -2.090 4.325
15 HB THR 3 HB THR 3 -10.810 -3.683 5.940
16 HG1 THR 3 HG1 THR 3 -8.611 -3.366 5.926
17 HG21 THR 3 HG21 THR 3 -11.807 -5.457 4.592
18 HG22 THR 3 HG22 THR 3 -10.225 -5.886 3.916
19 HG23 THR 3 HG23 THR 3 -10.556 -6.123 5.656
20 H TYR 4 H TYR 4 -8.003 -2.026 3.689
21 HA TYR 4 HA TYR 4 -7.206 -3.622 1.310
22 HB2 TYR 4 HB2 TYR 4 -6.944 -0.603 1.623
23 HB3 TYR 4 HB3 TYR 4 -6.347 -1.563 0.284
24 HD1 TYR 4 HD1 TYR 4 -7.915 -2.495 -1.418
25 HD2 TYR 4 HD2 TYR 4 -9.425 -0.040 1.827
26 HE1 TYR 4 HE1 TYR 4 -10.063 -2.223 -2.596
27 HE2 TYR 4 HE2 TYR 4 -11.509 0.268 0.627
28 HH TYR 4 HH TYR 4 -12.275 -1.533 -2.316
29 H LYS 5 H LYS 5 -5.127 -4.518 1.717
30 HA LYS 5 HA LYS 5 -3.757 -3.399 4.143
31 HB2 LYS 5 HB2 LYS 5 -4.527 -5.780 4.052
32 HB3 LYS 5 HB3 LYS 5 -3.310 -6.059 2.811
33 HG2 LYS 5 HG2 LYS 5 -1.527 -5.342 4.412
34 HG3 LYS 5 HG3 LYS 5 -2.792 -5.031 5.633
35 HD2 LYS 5 HD2 LYS 5 -3.517 -7.428 5.419
36 HD3 LYS 5 HD3 LYS 5 -2.136 -7.691 4.332
37 HE2 LYS 5 HE2 LYS 5 -0.580 -7.072 6.136
38 HE3 LYS 5 HE3 LYS 5 -1.942 -6.732 7.211
39 HZ1 LYS 5 HZ1 LYS 5 -2.560 -9.062 7.078
40 HZ2 LYS 5 HZ2 LYS 5 -1.329 -9.367 6.032
41 HZ3 LYS 5 HZ3 LYS 5 -0.971 -8.910 7.554
42 H LEU 6 H LEU 6 -1.743 -2.443 3.984
43 HA LEU 6 HA LEU 6 -0.433 -2.499 1.309
44 HB2 LEU 6 HB2 LEU 6 -1.778 -0.297 2.235
45 HB3 LEU 6 HB3 LEU 6 -0.143 0.045 2.790
46 HG LEU 6 HG LEU 6 -1.013 -0.614 -0.061
47 HD11 LEU 6 HD11 LEU 6 -1.708 1.588 0.862
48 HD12 LEU 6 HD12 LEU 6 -0.006 1.954 1.184
49 HD13 LEU 6 HD13 LEU 6 -0.569 1.734 -0.490
50 HD21 LEU 6 HD21 LEU 6 1.335 -1.372 0.276
51 HD22 LEU 6 HD22 LEU 6 1.287 0.061 -0.731
52 HD23 LEU 6 HD23 LEU 6 1.729 0.211 0.978
53 H ILE 7 H ILE 7 1.463 -3.501 1.541
54 HA ILE 7 HA ILE 7 3.259 -2.954 3.840
55 HB ILE 7 HB ILE 7 2.500 -5.184 4.173
56 HG12 ILE 7 HG12 ILE 7 5.118 -5.550 2.661
57 HG13 ILE 7 HG13 ILE 7 5.027 -4.725 4.211
58 HG21 ILE 7 HG21 ILE 7 2.505 -6.974 2.469
59 HG22 ILE 7 HG22 ILE 7 1.445 -5.650 1.998
60 HG23 ILE 7 HG23 ILE 7 3.039 -5.805 1.253
61 HD11 ILE 7 HD11 ILE 7 4.040 -6.785 5.237
62 HD12 ILE 7 HD12 ILE 7 4.291 -7.632 3.690
63 HD13 ILE 7 HD13 ILE 7 5.679 -7.010 4.595
64 H LEU 8 H LEU 8 5.225 -2.244 3.360
65 HA LEU 8 HA LEU 8 6.022 -2.097 0.495
66 HB2 LEU 8 HB2 LEU 8 6.638 -0.170 2.777
67 HB3 LEU 8 HB3 LEU 8 7.165 -0.038 1.118
68 HG LEU 8 HG LEU 8 5.470 1.541 1.388
69 HD11 LEU 8 HD11 LEU 8 4.046 -0.794 0.032
70 HD12 LEU 8 HD12 LEU 8 3.744 0.929 -0.219
71 HD13 LEU 8 HD13 LEU 8 5.268 0.217 -0.738
72 HD21 LEU 8 HD21 LEU 8 4.460 0.543 3.471
73 HD22 LEU 8 HD22 LEU 8 3.363 1.346 2.332
74 HD23 LEU 8 HD23 LEU 8 3.430 -0.422 2.418
75 H ASN 9 H ASN 9 8.065 -2.739 0.013
76 HA ASN 9 HA ASN 9 9.834 -3.592 2.238
77 HB2 ASN 9 HB2 ASN 9 9.515 -5.000 -0.425
78 HB3 ASN 9 HB3 ASN 9 10.591 -5.455 0.879
79 HD21 ASN 9 HD21 ASN 9 6.720 -6.699 0.848
80 HD22 ASN 9 HD22 ASN 9 7.368 -5.594 -0.362
81 H GLY 10 H GLY 10 10.983 -1.626 2.213
82 HA2 GLY 10 HA2 GLY 10 12.134 -0.515 -0.209
83 HA3 GLY 10 HA3 GLY 10 12.416 -0.029 1.468
84 H LYS 11 H LYS 11 14.679 -0.101 -0.000
85 HA LYS 11 HA LYS 11 15.972 -2.638 -0.241
86 HB2 LYS 11 HB2 LYS 11 16.675 -0.525 -1.292
87 HB3 LYS 11 HB3 LYS 11 17.120 0.156 0.273
88 HG2 LYS 11 HG2 LYS 11 18.882 -1.641 0.467
89 HG3 LYS 11 HG3 LYS 11 18.400 -2.208 -1.151
90 HD2 LYS 11 HD2 LYS 11 18.808 0.269 -1.886
91 HD3 LYS 11 HD3 LYS 11 19.689 0.443 -0.369
92 HE2 LYS 11 HE2 LYS 11 20.234 -1.570 -2.593
93 HE3 LYS 11 HE3 LYS 11 21.143 -0.079 -2.320
94 HZ1 LYS 11 HZ1 LYS 11 22.313 -1.906 -1.398
95 HZ2 LYS 11 HZ2 LYS 11 21.813 -0.973 -0.163
96 HZ3 LYS 11 HZ3 LYS 11 21.025 -2.394 -0.480
97 H THR 12 H THR 12 16.156 -0.193 2.412
98 HA THR 12 HA THR 12 16.967 -2.384 4.203
99 HB THR 12 HB THR 12 18.897 -1.043 3.494
100 HG1 THR 12 HG1 THR 12 18.146 -1.749 5.970
101 HG21 THR 12 HG21 THR 12 17.701 1.170 5.202
102 HG22 THR 12 HG22 THR 12 19.336 1.118 4.497
103 HG23 THR 12 HG23 THR 12 17.923 1.206 3.439
104 H LEU 13 H LEU 13 14.395 -0.543 3.600
105 HA LEU 13 HA LEU 13 13.660 -0.333 6.483
106 HB2 LEU 13 HB2 LEU 13 13.317 1.611 4.180
107 HB3 LEU 13 HB3 LEU 13 12.125 1.589 5.469
108 HG LEU 13 HG LEU 13 15.065 1.789 6.186
109 HD11 LEU 13 HD11 LEU 13 14.652 3.545 4.505
110 HD12 LEU 13 HD12 LEU 13 13.292 4.154 5.466
111 HD13 LEU 13 HD13 LEU 13 14.950 4.220 6.113
112 HD21 LEU 13 HD21 LEU 13 14.145 3.002 8.124
113 HD22 LEU 13 HD22 LEU 13 12.504 2.867 7.469
114 HD23 LEU 13 HD23 LEU 13 13.383 1.410 7.988
115 H LYS 14 H LYS 14 11.500 -0.903 6.935
116 HA LYS 14 HA LYS 14 9.794 -1.901 4.745
117 HB2 LYS 14 HB2 LYS 14 10.914 -3.566 7.049
118 HB3 LYS 14 HB3 LYS 14 9.328 -3.919 6.338
119 HG2 LYS 14 HG2 LYS 14 10.357 -4.137 4.126
120 HG3 LYS 14 HG3 LYS 14 11.970 -3.869 4.821
121 HD2 LYS 14 HD2 LYS 14 11.762 -5.899 6.162
122 HD3 LYS 14 HD3 LYS 14 10.064 -6.102 5.653
123 HE2 LYS 14 HE2 LYS 14 10.803 -6.252 3.281
124 HE3 LYS 14 HE3 LYS 14 12.488 -6.129 3.800
125 HZ1 LYS 14 HZ1 LYS 14 12.146 -8.186 5.055
126 HZ2 LYS 14 HZ2 LYS 14 10.585 -8.271 4.499
127 HZ3 LYS 14 HZ3 LYS 14 11.836 -8.384 3.438
128 H GLY 15 H GLY 15 7.580 -1.800 5.300
129 HA2 GLY 15 HA2 GLY 15 6.704 -1.232 7.997
130 HA3 GLY 15 HA3 GLY 15 6.671 0.187 6.926
131 H GLU 16 H GLU 16 4.333 -1.388 8.077
132 HA GLU 16 HA GLU 16 2.964 -1.735 5.541
133 HB2 GLU 16 HB2 GLU 16 2.106 -3.942 6.094
134 HB3 GLU 16 HB3 GLU 16 3.867 -4.012 6.023
135 HG2 GLU 16 HG2 GLU 16 4.048 -4.105 8.436
136 HG3 GLU 16 HG3 GLU 16 2.321 -3.774 8.642
137 H THR 17 H THR 17 0.657 -1.998 5.809
138 HA THR 17 HA THR 17 -0.454 -1.391 8.463
139 HB THR 17 HB THR 17 0.401 0.812 7.487
140 HG1 THR 17 HG1 THR 17 -1.026 1.732 8.600
141 HG21 THR 17 HG21 THR 17 -0.361 0.365 5.126
142 HG22 THR 17 HG22 THR 17 -2.039 0.581 5.681
143 HG23 THR 17 HG23 THR 17 -0.894 1.920 5.775
144 H THR 18 H THR 18 -2.891 -1.057 8.199
145 HA THR 18 HA THR 18 -4.128 -2.384 5.932
146 HB THR 18 HB THR 18 -3.493 -4.171 7.643
147 HG1 THR 18 HG1 THR 18 -5.587 -5.093 7.502
148 HG21 THR 18 HG21 THR 18 -4.864 -4.473 9.623
149 HG22 THR 18 HG22 THR 18 -3.993 -2.937 9.736
150 HG23 THR 18 HG23 THR 18 -5.721 -2.949 9.319
151 H THR 19 H THR 19 -6.192 -1.373 5.642
152 HA THR 19 HA THR 19 -7.136 0.456 7.734
153 HB THR 19 HB THR 19 -7.271 2.312 6.071
154 HG1 THR 19 HG1 THR 19 -5.351 0.949 4.511
155 HG21 THR 19 HG21 THR 19 -5.009 3.107 6.161
156 HG22 THR 19 HG22 THR 19 -5.391 2.277 7.684
157 HG23 THR 19 HG23 THR 19 -4.370 1.485 6.465
158 H GLU 20 H GLU 20 -9.230 1.407 7.033
159 HA GLU 20 HA GLU 20 -10.814 -0.229 5.167
160 HB2 GLU 20 HB2 GLU 20 -11.232 -1.012 7.473
161 HB3 GLU 20 HB3 GLU 20 -11.616 0.641 7.984
162 HG2 GLU 20 HG2 GLU 20 -13.560 0.703 6.534
163 HG3 GLU 20 HG3 GLU 20 -13.072 -0.794 5.728
164 H ALA 21 H ALA 21 -11.402 1.217 3.587
165 HA ALA 21 HA ALA 21 -11.505 4.123 4.268
166 HB1 ALA 21 HB1 ALA 21 -10.982 4.485 1.894
167 HB2 ALA 21 HB2 ALA 21 -9.736 3.487 2.666
168 HB3 ALA 21 HB3 ALA 21 -10.954 2.736 1.608
169 H VAL 22 H VAL 22 -13.159 5.356 3.514
170 HA VAL 22 HA VAL 22 -15.757 4.268 3.410
171 HB VAL 22 HB VAL 22 -16.441 6.569 2.693
172 HG11 VAL 22 HG11 VAL 22 -14.493 6.500 5.035
173 HG12 VAL 22 HG12 VAL 22 -15.830 7.643 4.787
174 HG13 VAL 22 HG13 VAL 22 -16.180 5.934 5.066
175 HG21 VAL 22 HG21 VAL 22 -13.463 7.244 2.812
176 HG22 VAL 22 HG22 VAL 22 -14.511 7.335 1.376
177 HG23 VAL 22 HG23 VAL 22 -14.799 8.400 2.741
178 H ASP 23 H ASP 23 -13.666 5.427 0.707
179 HA ASP 23 HA ASP 23 -15.161 3.729 -1.187
180 HB2 ASP 23 HB2 ASP 23 -16.251 5.759 -1.567
181 HB3 ASP 23 HB3 ASP 23 -14.781 6.699 -1.359
182 H ALA 24 H ALA 24 -13.800 3.319 -3.122
183 HA ALA 24 HA ALA 24 -11.121 2.735 -2.317
184 HB1 ALA 24 HB1 ALA 24 -10.863 1.740 -4.461
185 HB2 ALA 24 HB2 ALA 24 -12.440 1.307 -3.821
186 HB3 ALA 24 HB3 ALA 24 -12.323 2.558 -5.096
187 H ALA 25 H ALA 25 -12.439 5.652 -3.929
188 HA ALA 25 HA ALA 25 -9.865 6.361 -5.069
189 HB1 ALA 25 HB1 ALA 25 -12.020 7.338 -5.840
190 HB2 ALA 25 HB2 ALA 25 -12.103 8.280 -4.344
191 HB3 ALA 25 HB3 ALA 25 -10.755 8.525 -5.457
192 H THR 26 H THR 26 -11.377 6.649 -1.875
193 HA THR 26 HA THR 26 -9.529 8.601 -0.801
194 HB THR 26 HB THR 26 -11.181 6.409 0.536
195 HG1 THR 26 HG1 THR 26 -12.254 8.246 -0.685
196 HG21 THR 26 HG21 THR 26 -9.891 8.865 1.784
197 HG22 THR 26 HG22 THR 26 -10.972 7.704 2.598
198 HG23 THR 26 HG23 THR 26 -9.383 7.183 2.040
199 H ALA 27 H ALA 27 -9.639 5.024 -1.085
200 HA ALA 27 HA ALA 27 -7.234 4.487 0.320
201 HB1 ALA 27 HB1 ALA 27 -8.532 2.869 -1.901
202 HB2 ALA 27 HB2 ALA 27 -7.314 2.299 -0.744
203 HB3 ALA 27 HB3 ALA 27 -8.923 2.760 -0.169
204 H GLU 28 H GLU 28 -7.906 5.054 -3.178
205 HA GLU 28 HA GLU 28 -5.349 4.723 -4.237
206 HB2 GLU 28 HB2 GLU 28 -7.409 5.092 -5.570
207 HB3 GLU 28 HB3 GLU 28 -7.495 6.746 -4.982
208 HG2 GLU 28 HG2 GLU 28 -5.188 7.108 -6.100
209 HG3 GLU 28 HG3 GLU 28 -5.476 5.571 -6.898
210 H LYS 29 H LYS 29 -6.712 7.642 -2.630
211 HA LYS 29 HA LYS 29 -4.418 9.283 -3.123
212 HB2 LYS 29 HB2 LYS 29 -6.688 10.100 -2.534
213 HB3 LYS 29 HB3 LYS 29 -6.478 9.511 -0.878
214 HG2 LYS 29 HG2 LYS 29 -4.584 11.047 -0.531
215 HG3 LYS 29 HG3 LYS 29 -4.635 11.526 -2.232
216 HD2 LYS 29 HD2 LYS 29 -7.066 12.270 -1.792
217 HD3 LYS 29 HD3 LYS 29 -6.690 12.058 -0.067
218 HE2 LYS 29 HE2 LYS 29 -4.682 13.618 -0.512
219 HE3 LYS 29 HE3 LYS 29 -5.412 13.957 -2.086
220 HZ1 LYS 29 HZ1 LYS 29 -6.533 14.480 0.582
221 HZ2 LYS 29 HZ2 LYS 29 -6.065 15.596 -0.530
222 HZ3 LYS 29 HZ3 LYS 29 -7.417 14.691 -0.806
223 H VAL 30 H VAL 30 -5.371 7.436 -0.154
224 HA VAL 30 HA VAL 30 -2.975 8.169 1.195
225 HB VAL 30 HB VAL 30 -5.102 7.341 2.263
226 HG11 VAL 30 HG11 VAL 30 -3.878 4.582 1.837
227 HG12 VAL 30 HG12 VAL 30 -5.270 4.982 2.864
228 HG13 VAL 30 HG13 VAL 30 -5.383 5.189 1.115
229 HG21 VAL 30 HG21 VAL 30 -3.921 6.518 4.226
230 HG22 VAL 30 HG22 VAL 30 -2.468 6.184 3.261
231 HG23 VAL 30 HG23 VAL 30 -3.030 7.853 3.491
232 H PHE 31 H PHE 31 -3.650 5.536 -1.107
233 HA PHE 31 HA PHE 31 -1.406 3.936 -0.668
234 HB2 PHE 31 HB2 PHE 31 -2.806 4.578 -3.274
235 HB3 PHE 31 HB3 PHE 31 -1.549 3.383 -3.097
236 HD1 PHE 31 HD1 PHE 31 -3.252 2.899 -0.080
237 HD2 PHE 31 HD2 PHE 31 -3.817 2.450 -4.339
238 HE1 PHE 31 HE1 PHE 31 -4.790 1.020 0.320
239 HE2 PHE 31 HE2 PHE 31 -5.370 0.586 -3.929
240 HZ PHE 31 HZ PHE 31 -5.833 -0.168 -1.595
241 H LYS 32 H LYS 32 -1.598 7.044 -2.557
242 HA LYS 32 HA LYS 32 1.226 6.721 -3.330
243 HB2 LYS 32 HB2 LYS 32 -0.338 7.949 -4.767
244 HB3 LYS 32 HB3 LYS 32 -0.613 9.142 -3.487
245 HG2 LYS 32 HG2 LYS 32 1.753 9.837 -3.620
246 HG3 LYS 32 HG3 LYS 32 2.085 8.560 -4.811
247 HD2 LYS 32 HD2 LYS 32 0.533 9.616 -6.406
248 HD3 LYS 32 HD3 LYS 32 0.102 10.841 -5.192
249 HE2 LYS 32 HE2 LYS 32 2.519 11.534 -5.123
250 HE3 LYS 32 HE3 LYS 32 2.839 10.424 -6.466
251 HZ1 LYS 32 HZ1 LYS 32 1.201 11.704 -7.759
252 HZ2 LYS 32 HZ2 LYS 32 1.007 12.736 -6.481
253 HZ3 LYS 32 HZ3 LYS 32 2.444 12.663 -7.255
254 H GLN 33 H GLN 33 -0.505 8.887 -0.999
255 HA GLN 33 HA GLN 33 1.854 10.167 -0.143
256 HB2 GLN 33 HB2 GLN 33 -0.298 11.105 0.240
257 HB3 GLN 33 HB3 GLN 33 -0.827 9.749 1.225
258 HG2 GLN 33 HG2 GLN 33 1.530 11.482 2.074
259 HG3 GLN 33 HG3 GLN 33 -0.120 12.004 2.372
260 HE21 GLN 33 HE21 GLN 33 -0.755 9.317 4.788
261 HE22 GLN 33 HE22 GLN 33 -1.602 10.194 3.545
262 H TYR 34 H TYR 34 0.266 7.420 1.716
263 HA TYR 34 HA TYR 34 2.290 7.543 3.682
264 HB2 TYR 34 HB2 TYR 34 0.462 6.489 4.469
265 HB3 TYR 34 HB3 TYR 34 0.144 5.598 3.000
266 HD1 TYR 34 HD1 TYR 34 0.469 3.278 3.077
267 HD2 TYR 34 HD2 TYR 34 2.865 5.810 5.620
268 HE1 TYR 34 HE1 TYR 34 1.559 1.266 4.057
269 HE2 TYR 34 HE2 TYR 34 3.973 3.829 6.556
270 HH TYR 34 HH TYR 34 4.015 1.485 6.645
271 H ALA 35 H ALA 35 2.121 5.268 0.934
272 HA ALA 35 HA ALA 35 4.545 3.960 1.476
273 HB1 ALA 35 HB1 ALA 35 3.257 4.487 -1.235
274 HB2 ALA 35 HB2 ALA 35 4.393 3.183 -0.821
275 HB3 ALA 35 HB3 ALA 35 2.780 3.195 -0.098
276 H ASN 36 H ASN 36 3.949 6.968 -0.496
277 HA ASN 36 HA ASN 36 6.695 7.154 -1.285
278 HB2 ASN 36 HB2 ASN 36 4.872 8.363 -2.425
279 HB3 ASN 36 HB3 ASN 36 4.630 9.364 -0.979
280 HD21 ASN 36 HD21 ASN 36 8.209 9.890 -2.987
281 HD22 ASN 36 HD22 ASN 36 7.728 8.266 -2.652
282 H ASP 37 H ASP 37 4.921 8.330 1.596
283 HA ASP 37 HA ASP 37 7.066 9.926 2.649
284 HB2 ASP 37 HB2 ASP 37 4.609 10.040 3.261
285 HB3 ASP 37 HB3 ASP 37 4.816 8.543 4.171
286 H ASN 38 H ASN 38 6.337 6.545 2.609
287 HA ASN 38 HA ASN 38 8.211 5.699 4.670
288 HB2 ASN 38 HB2 ASN 38 5.957 4.644 4.028
289 HB3 ASN 38 HB3 ASN 38 6.785 3.986 2.609
290 HD21 ASN 38 HD21 ASN 38 6.675 1.235 4.993
291 HD22 ASN 38 HD22 ASN 38 5.553 2.206 4.104
292 H GLY 39 H GLY 39 8.650 6.887 1.560
293 HA2 GLY 39 HA2 GLY 39 10.466 7.078 0.256
294 HA3 GLY 39 HA3 GLY 39 11.389 6.116 1.394
295 H VAL 40 H VAL 40 8.497 5.029 -0.528
296 HA VAL 40 HA VAL 40 10.060 2.723 -1.429
297 HB VAL 40 HB VAL 40 8.028 1.958 -2.463
298 HG11 VAL 40 HG11 VAL 40 7.513 3.142 0.294
299 HG12 VAL 40 HG12 VAL 40 6.590 1.876 -0.506
300 HG13 VAL 40 HG13 VAL 40 8.293 1.594 -0.086
301 HG21 VAL 40 HG21 VAL 40 6.761 4.648 -1.830
302 HG22 VAL 40 HG22 VAL 40 7.080 3.974 -3.434
303 HG23 VAL 40 HG23 VAL 40 5.910 3.185 -2.406
304 H ASP 41 H ASP 41 10.726 2.217 -3.480
305 HA ASP 41 HA ASP 41 10.262 4.056 -5.720
306 HB2 ASP 41 HB2 ASP 41 12.344 4.808 -4.493
307 HB3 ASP 41 HB3 ASP 41 13.098 3.279 -4.923
308 H GLY 42 H GLY 42 8.801 2.019 -5.892
309 HA2 GLY 42 HA2 GLY 42 10.206 0.002 -7.503
310 HA3 GLY 42 HA3 GLY 42 9.483 -0.610 -6.017
311 H GLU 43 H GLU 43 8.281 -1.966 -7.510
312 HA GLU 43 HA GLU 43 6.005 -0.689 -8.871
313 HB2 GLU 43 HB2 GLU 43 5.866 -2.554 -10.340
314 HB3 GLU 43 HB3 GLU 43 7.455 -1.805 -10.456
315 HG2 GLU 43 HG2 GLU 43 8.469 -3.604 -9.182
316 HG3 GLU 43 HG3 GLU 43 6.885 -4.308 -8.814
317 H TRP 44 H TRP 44 3.981 -1.588 -8.690
318 HA TRP 44 HA TRP 44 3.436 -2.853 -6.099
319 HB2 TRP 44 HB2 TRP 44 1.839 -1.210 -8.098
320 HB3 TRP 44 HB3 TRP 44 1.161 -1.854 -6.624
321 HD1 TRP 44 HD1 TRP 44 4.348 0.309 -7.391
322 HE1 TRP 44 HE1 TRP 44 4.751 1.846 -5.496
323 HE3 TRP 44 HE3 TRP 44 0.150 -0.704 -4.658
324 HZ2 TRP 44 HZ2 TRP 44 3.172 2.995 -3.284
325 HZ3 TRP 44 HZ3 TRP 44 -0.414 0.681 -2.677
326 HH2 TRP 44 HH2 TRP 44 1.114 2.522 -1.972
327 H THR 45 H THR 45 2.427 -4.740 -5.821
328 HA THR 45 HA THR 45 1.257 -6.255 -8.101
329 HB THR 45 HB THR 45 1.971 -8.257 -6.765
330 HG1 THR 45 HG1 THR 45 3.718 -6.505 -5.364
331 HG21 THR 45 HG21 THR 45 3.300 -7.529 -8.693
332 HG22 THR 45 HG22 THR 45 4.264 -6.456 -7.659
333 HG23 THR 45 HG23 THR 45 4.331 -8.218 -7.429
334 H TYR 46 H TYR 46 -0.609 -7.779 -7.281
335 HA TYR 46 HA TYR 46 -1.858 -6.700 -4.802
336 HB2 TYR 46 HB2 TYR 46 -2.687 -5.382 -6.698
337 HB3 TYR 46 HB3 TYR 46 -3.194 -6.863 -7.509
338 HD1 TYR 46 HD1 TYR 46 -3.616 -5.237 -4.126
339 HD2 TYR 46 HD2 TYR 46 -5.507 -7.302 -7.417
340 HE1 TYR 46 HE1 TYR 46 -5.774 -5.171 -2.925
341 HE2 TYR 46 HE2 TYR 46 -7.691 -7.111 -6.283
342 HH TYR 46 HH TYR 46 -8.776 -6.548 -4.246
343 H ASP 47 H ASP 47 -3.169 -7.999 -3.628
344 HA ASP 47 HA ASP 47 -3.894 -10.711 -4.598
345 HB2 ASP 47 HB2 ASP 47 -2.392 -10.073 -2.053
346 HB3 ASP 47 HB3 ASP 47 -3.479 -11.455 -2.155
347 H ASP 48 H ASP 48 -6.092 -10.158 -4.905
348 HA ASP 48 HA ASP 48 -7.557 -8.378 -3.282
349 HB2 ASP 48 HB2 ASP 48 -8.166 -9.246 -5.618
350 HB3 ASP 48 HB3 ASP 48 -8.793 -10.686 -4.812
351 H ALA 49 H ALA 49 -6.809 -11.710 -2.702
352 HA ALA 49 HA ALA 49 -8.943 -12.503 -1.079
353 HB1 ALA 49 HB1 ALA 49 -7.138 -14.011 -1.893
354 HB2 ALA 49 HB2 ALA 49 -5.977 -13.207 -0.811
355 HB3 ALA 49 HB3 ALA 49 -7.334 -14.124 -0.133
356 H THR 50 H THR 50 -6.399 -10.313 -0.332
357 HA THR 50 HA THR 50 -7.432 -9.902 2.431
358 HB THR 50 HB THR 50 -5.540 -11.017 3.020
359 HG1 THR 50 HG1 THR 50 -5.196 -8.955 3.807
360 HG21 THR 50 HG21 THR 50 -4.093 -10.020 0.522
361 HG22 THR 50 HG22 THR 50 -3.340 -10.976 1.819
362 HG23 THR 50 HG23 THR 50 -4.634 -11.672 0.863
363 H LYS 51 H LYS 51 -6.420 -8.589 -0.643
364 HA LYS 51 HA LYS 51 -6.655 -6.845 -1.691
365 HB2 LYS 51 HB2 LYS 51 -7.944 -5.575 0.734
366 HB3 LYS 51 HB3 LYS 51 -7.826 -4.859 -0.880
367 HG2 LYS 51 HG2 LYS 51 -9.037 -6.915 -1.778
368 HG3 LYS 51 HG3 LYS 51 -9.305 -7.419 -0.115
369 HD2 LYS 51 HD2 LYS 51 -10.717 -5.575 0.346
370 HD3 LYS 51 HD3 LYS 51 -10.280 -4.723 -1.143
371 HE2 LYS 51 HE2 LYS 51 -11.630 -7.460 -1.141
372 HE3 LYS 51 HE3 LYS 51 -12.548 -5.953 -0.994
373 HZ1 LYS 51 HZ1 LYS 51 -11.614 -5.224 -3.097
374 HZ2 LYS 51 HZ2 LYS 51 -10.878 -6.693 -3.315
375 HZ3 LYS 51 HZ3 LYS 51 -12.513 -6.566 -3.254
376 H THR 52 H THR 52 -4.441 -7.906 -0.483
377 HA THR 52 HA THR 52 -2.827 -5.865 0.745
378 HB THR 52 HB THR 52 -2.152 -8.668 -0.204
379 HG1 THR 52 HG1 THR 52 -3.337 -8.526 1.805
380 HG21 THR 52 HG21 THR 52 -0.118 -7.158 -0.263
381 HG22 THR 52 HG22 THR 52 -0.446 -6.713 1.416
382 HG23 THR 52 HG23 THR 52 -0.007 -8.384 0.974
383 H PHE 53 H PHE 53 -1.420 -4.614 -0.185
384 HA PHE 53 HA PHE 53 -0.812 -4.738 -3.083
385 HB2 PHE 53 HB2 PHE 53 -1.432 -2.464 -1.169
386 HB3 PHE 53 HB3 PHE 53 -0.431 -2.196 -2.577
387 HD1 PHE 53 HD1 PHE 53 -1.359 -2.395 -4.882
388 HD2 PHE 53 HD2 PHE 53 -3.848 -2.823 -1.383
389 HE1 PHE 53 HE1 PHE 53 -3.362 -1.897 -6.253
390 HE2 PHE 53 HE2 PHE 53 -5.858 -2.360 -2.777
391 HZ PHE 53 HZ PHE 53 -5.602 -1.824 -5.189
392 H THR 54 H THR 54 1.262 -5.552 -3.107
393 HA THR 54 HA THR 54 3.088 -4.859 -0.882
394 HB THR 54 HB THR 54 3.165 -7.301 -2.690
395 HG1 THR 54 HG1 THR 54 2.754 -8.200 -0.415
396 HG21 THR 54 HG21 THR 54 4.864 -8.132 -1.185
397 HG22 THR 54 HG22 THR 54 5.400 -6.556 -1.737
398 HG23 THR 54 HG23 THR 54 4.703 -6.710 -0.117
399 H VAL 55 H VAL 55 5.096 -4.090 -1.429
400 HA VAL 55 HA VAL 55 5.718 -3.510 -4.259
401 HB VAL 55 HB VAL 55 5.741 -1.604 -1.890
402 HG11 VAL 55 HG11 VAL 55 7.857 -1.244 -3.037
403 HG12 VAL 55 HG12 VAL 55 7.035 -1.195 -4.618
404 HG13 VAL 55 HG13 VAL 55 6.762 0.090 -3.420
405 HG21 VAL 55 HG21 VAL 55 3.598 -1.752 -3.177
406 HG22 VAL 55 HG22 VAL 55 4.380 -0.176 -3.323
407 HG23 VAL 55 HG23 VAL 55 4.516 -1.356 -4.655
408 H THR 56 H THR 56 7.867 -3.943 -4.706
409 HA THR 56 HA THR 56 9.682 -4.410 -2.432
410 HB THR 56 HB THR 56 9.464 -6.216 -4.863
411 HG1 THR 56 HG1 THR 56 8.881 -7.616 -2.827
412 HG21 THR 56 HG21 THR 56 11.004 -7.650 -3.562
413 HG22 THR 56 HG22 THR 56 11.736 -6.078 -3.893
414 HG23 THR 56 HG23 THR 56 11.082 -6.425 -2.276
415 H GLU 57 H GLU 57 11.318 -3.036 -2.538
416 HA GLU 57 HA GLU 57 11.735 -1.295 -4.815
417 HB2 GLU 57 HB2 GLU 57 12.220 -0.843 -2.285
418 HB3 GLU 57 HB3 GLU 57 13.678 -1.807 -2.509
419 HG2 GLU 57 HG2 GLU 57 14.247 -0.249 -4.451
420 HG3 GLU 57 HG3 GLU 57 12.890 0.770 -3.933
Start of MODEL 19
1 H1 MET 1 H MET 1 -17.382 0.814 2.167
2 HA MET 1 HA MET 1 -17.131 -0.162 -0.083
3 HB2 MET 1 HB2 MET 1 -15.262 1.800 -0.361
4 HB3 MET 1 HB3 MET 1 -14.203 0.419 -0.060
5 HG2 MET 1 HG2 MET 1 -14.482 0.656 -2.446
6 HG3 MET 1 HG3 MET 1 -15.387 -0.786 -1.946
7 HE1 MET 1 HE1 MET 1 -15.874 0.844 -4.843
8 HE2 MET 1 HE2 MET 1 -16.449 -0.736 -4.274
9 HE3 MET 1 HE3 MET 1 -17.616 0.468 -4.861
10 H GLY 2 H GLY 2 -13.866 -0.425 1.408
11 HA2 GLY 2 HA2 GLY 2 -14.695 -2.420 3.348
12 HA3 GLY 2 HA3 GLY 2 -13.861 -3.131 1.982
13 H THR 3 H THR 3 -12.330 -3.781 3.698
14 HA THR 3 HA THR 3 -10.408 -1.705 4.579
15 HB THR 3 HB THR 3 -11.073 -3.145 6.379
16 HG1 THR 3 HG1 THR 3 -8.824 -2.787 6.185
17 HG21 THR 3 HG21 THR 3 -12.056 -5.026 5.159
18 HG22 THR 3 HG22 THR 3 -10.455 -5.499 4.556
19 HG23 THR 3 HG23 THR 3 -10.820 -5.615 6.288
20 H TYR 4 H TYR 4 -8.337 -1.629 3.877
21 HA TYR 4 HA TYR 4 -7.473 -3.631 1.848
22 HB2 TYR 4 HB2 TYR 4 -7.038 -0.617 1.812
23 HB3 TYR 4 HB3 TYR 4 -6.329 -1.753 0.674
24 HD1 TYR 4 HD1 TYR 4 -7.932 -3.136 -0.877
25 HD2 TYR 4 HD2 TYR 4 -9.201 0.269 1.545
26 HE1 TYR 4 HE1 TYR 4 -10.052 -2.928 -2.206
27 HE2 TYR 4 HE2 TYR 4 -11.281 0.444 0.211
28 HH TYR 4 HH TYR 4 -12.693 -0.860 -1.294
29 H LYS 5 H LYS 5 -5.476 -4.476 2.075
30 HA LYS 5 HA LYS 5 -3.826 -3.489 4.337
31 HB2 LYS 5 HB2 LYS 5 -4.740 -5.954 3.972
32 HB3 LYS 5 HB3 LYS 5 -3.312 -6.119 2.943
33 HG2 LYS 5 HG2 LYS 5 -1.917 -5.341 4.939
34 HG3 LYS 5 HG3 LYS 5 -3.405 -5.329 5.898
35 HD2 LYS 5 HD2 LYS 5 -3.709 -7.745 5.480
36 HD3 LYS 5 HD3 LYS 5 -2.239 -7.761 4.475
37 HE2 LYS 5 HE2 LYS 5 -1.118 -6.676 6.620
38 HE3 LYS 5 HE3 LYS 5 -2.508 -7.364 7.470
39 HZ1 LYS 5 HZ1 LYS 5 -1.885 -9.540 6.668
40 HZ2 LYS 5 HZ2 LYS 5 -0.647 -8.932 5.774
41 HZ3 LYS 5 HZ3 LYS 5 -0.581 -8.868 7.413
42 H LEU 6 H LEU 6 -1.466 -3.454 4.240
43 HA LEU 6 HA LEU 6 -0.312 -2.847 1.608
44 HB2 LEU 6 HB2 LEU 6 -1.290 -0.866 3.539
45 HB3 LEU 6 HB3 LEU 6 0.440 -0.679 3.258
46 HG LEU 6 HG LEU 6 -1.443 -0.867 0.898
47 HD11 LEU 6 HD11 LEU 6 -2.422 0.916 2.310
48 HD12 LEU 6 HD12 LEU 6 -0.823 1.675 2.471
49 HD13 LEU 6 HD13 LEU 6 -1.617 1.626 0.894
50 HD21 LEU 6 HD21 LEU 6 1.227 0.506 1.394
51 HD22 LEU 6 HD22 LEU 6 0.969 -0.998 0.496
52 HD23 LEU 6 HD23 LEU 6 0.330 0.533 -0.140
53 H ILE 7 H ILE 7 1.906 -3.239 1.562
54 HA ILE 7 HA ILE 7 3.487 -2.827 3.955
55 HB ILE 7 HB ILE 7 2.961 -5.165 4.270
56 HG12 ILE 7 HG12 ILE 7 5.805 -4.786 3.259
57 HG13 ILE 7 HG13 ILE 7 5.197 -4.499 4.896
58 HG21 ILE 7 HG21 ILE 7 3.659 -6.902 2.550
59 HG22 ILE 7 HG22 ILE 7 2.276 -5.896 2.075
60 HG23 ILE 7 HG23 ILE 7 3.868 -5.574 1.392
61 HD11 ILE 7 HD11 ILE 7 6.381 -6.623 4.859
62 HD12 ILE 7 HD12 ILE 7 4.654 -6.921 5.097
63 HD13 ILE 7 HD13 ILE 7 5.380 -7.198 3.502
64 H LEU 8 H LEU 8 5.334 -1.761 3.384
65 HA LEU 8 HA LEU 8 6.195 -1.755 0.563
66 HB2 LEU 8 HB2 LEU 8 7.188 -0.105 2.931
67 HB3 LEU 8 HB3 LEU 8 7.517 0.191 1.226
68 HG LEU 8 HG LEU 8 5.898 1.808 1.801
69 HD11 LEU 8 HD11 LEU 8 4.069 -0.414 0.820
70 HD12 LEU 8 HD12 LEU 8 3.968 1.331 0.508
71 HD13 LEU 8 HD13 LEU 8 5.252 0.378 -0.253
72 HD21 LEU 8 HD21 LEU 8 5.368 0.347 3.973
73 HD22 LEU 8 HD22 LEU 8 4.254 1.595 3.392
74 HD23 LEU 8 HD23 LEU 8 3.944 -0.115 3.017
75 H ASN 9 H ASN 9 8.173 -2.573 -0.092
76 HA ASN 9 HA ASN 9 10.069 -3.573 1.964
77 HB2 ASN 9 HB2 ASN 9 9.208 -4.901 -0.642
78 HB3 ASN 9 HB3 ASN 9 10.681 -5.347 0.212
79 HD21 ASN 9 HD21 ASN 9 7.014 -6.569 1.553
80 HD22 ASN 9 HD22 ASN 9 7.131 -5.360 0.280
81 H GLY 10 H GLY 10 11.833 -2.258 1.912
82 HA2 GLY 10 HA2 GLY 10 12.812 -1.253 -0.723
83 HA3 GLY 10 HA3 GLY 10 12.921 -0.343 0.769
84 H LYS 11 H LYS 11 15.213 -0.523 -0.446
85 HA LYS 11 HA LYS 11 16.911 -2.676 -0.011
86 HB2 LYS 11 HB2 LYS 11 17.355 -0.471 -1.227
87 HB3 LYS 11 HB3 LYS 11 17.745 0.234 0.345
88 HG2 LYS 11 HG2 LYS 11 19.632 -1.316 0.600
89 HG3 LYS 11 HG3 LYS 11 19.088 -2.267 -0.792
90 HD2 LYS 11 HD2 LYS 11 19.606 -0.451 -2.315
91 HD3 LYS 11 HD3 LYS 11 19.941 0.655 -0.958
92 HE2 LYS 11 HE2 LYS 11 21.481 -1.913 -1.572
93 HE3 LYS 11 HE3 LYS 11 22.031 -0.287 -1.991
94 HZ1 LYS 11 HZ1 LYS 11 22.999 -1.080 0.096
95 HZ2 LYS 11 HZ2 LYS 11 22.079 0.255 0.359
96 HZ3 LYS 11 HZ3 LYS 11 21.506 -1.227 0.773
97 H THR 12 H THR 12 16.419 -0.049 2.410
98 HA THR 12 HA THR 12 16.992 -1.976 4.583
99 HB THR 12 HB THR 12 19.079 -0.721 4.274
100 HG1 THR 12 HG1 THR 12 17.720 0.427 6.470
101 HG21 THR 12 HG21 THR 12 17.398 1.794 4.657
102 HG22 THR 12 HG22 THR 12 19.171 1.719 4.594
103 HG23 THR 12 HG23 THR 12 18.213 1.297 3.161
104 H LEU 13 H LEU 13 14.495 -1.132 3.508
105 HA LEU 13 HA LEU 13 13.368 0.464 5.724
106 HB2 LEU 13 HB2 LEU 13 13.472 1.124 2.794
107 HB3 LEU 13 HB3 LEU 13 11.949 1.440 3.623
108 HG LEU 13 HG LEU 13 14.626 2.564 4.548
109 HD11 LEU 13 HD11 LEU 13 14.177 3.568 2.376
110 HD12 LEU 13 HD12 LEU 13 12.473 3.832 2.800
111 HD13 LEU 13 HD13 LEU 13 13.735 4.756 3.620
112 HD21 LEU 13 HD21 LEU 13 13.112 4.133 5.804
113 HD22 LEU 13 HD22 LEU 13 11.738 3.135 5.305
114 HD23 LEU 13 HD23 LEU 13 13.004 2.442 6.341
115 H LYS 14 H LYS 14 11.185 -0.024 6.168
116 HA LYS 14 HA LYS 14 9.702 -2.049 4.720
117 HB2 LYS 14 HB2 LYS 14 11.859 -2.998 6.234
118 HB3 LYS 14 HB3 LYS 14 10.466 -3.281 7.282
119 HG2 LYS 14 HG2 LYS 14 9.352 -4.492 5.356
120 HG3 LYS 14 HG3 LYS 14 10.797 -4.186 4.377
121 HD2 LYS 14 HD2 LYS 14 12.155 -5.449 6.071
122 HD3 LYS 14 HD3 LYS 14 10.647 -5.828 6.941
123 HE2 LYS 14 HE2 LYS 14 9.747 -6.975 4.964
124 HE3 LYS 14 HE3 LYS 14 11.153 -6.501 4.004
125 HZ1 LYS 14 HZ1 LYS 14 12.499 -7.809 5.663
126 HZ2 LYS 14 HZ2 LYS 14 11.092 -8.408 6.265
127 HZ3 LYS 14 HZ3 LYS 14 11.513 -8.716 4.707
128 H GLY 15 H GLY 15 7.698 -2.762 5.754
129 HA2 GLY 15 HA2 GLY 15 6.661 -2.399 8.184
130 HA3 GLY 15 HA3 GLY 15 6.577 -0.751 7.598
131 H GLU 16 H GLU 16 4.429 -2.662 8.323
132 HA GLU 16 HA GLU 16 2.864 -2.770 5.809
133 HB2 GLU 16 HB2 GLU 16 2.089 -4.949 6.337
134 HB3 GLU 16 HB3 GLU 16 3.845 -5.024 6.514
135 HG2 GLU 16 HG2 GLU 16 3.491 -4.693 9.025
136 HG3 GLU 16 HG3 GLU 16 1.753 -4.867 8.725
137 H THR 17 H THR 17 0.451 -2.864 6.391
138 HA THR 17 HA THR 17 -0.549 -1.858 8.843
139 HB THR 17 HB THR 17 0.655 0.164 7.882
140 HG1 THR 17 HG1 THR 17 -0.960 1.421 8.547
141 HG21 THR 17 HG21 THR 17 0.307 -0.072 5.501
142 HG22 THR 17 HG22 THR 17 -1.454 -0.139 5.716
143 HG23 THR 17 HG23 THR 17 -0.576 1.369 6.039
144 H THR 18 H THR 18 -2.886 -1.173 8.531
145 HA THR 18 HA THR 18 -4.198 -2.174 6.079
146 HB THR 18 HB THR 18 -4.273 -3.900 8.025
147 HG1 THR 18 HG1 THR 18 -5.726 -4.356 6.567
148 HG21 THR 18 HG21 THR 18 -6.251 -3.468 9.573
149 HG22 THR 18 HG22 THR 18 -4.785 -2.528 9.920
150 HG23 THR 18 HG23 THR 18 -6.151 -1.764 9.087
151 H THR 19 H THR 19 -6.289 -1.235 5.723
152 HA THR 19 HA THR 19 -6.927 1.228 7.237
153 HB THR 19 HB THR 19 -7.418 2.304 4.963
154 HG1 THR 19 HG1 THR 19 -5.551 0.374 4.068
155 HG21 THR 19 HG21 THR 19 -5.009 2.930 4.537
156 HG22 THR 19 HG22 THR 19 -5.531 3.126 6.222
157 HG23 THR 19 HG23 THR 19 -4.542 1.729 5.756
158 H GLU 20 H GLU 20 -9.161 1.995 6.765
159 HA GLU 20 HA GLU 20 -10.837 0.227 5.095
160 HB2 GLU 20 HB2 GLU 20 -11.358 -0.260 7.449
161 HB3 GLU 20 HB3 GLU 20 -11.600 1.459 7.781
162 HG2 GLU 20 HG2 GLU 20 -13.623 1.517 6.515
163 HG3 GLU 20 HG3 GLU 20 -13.237 0.005 5.677
164 H ALA 21 H ALA 21 -11.979 1.391 3.572
165 HA ALA 21 HA ALA 21 -11.738 4.352 3.615
166 HB1 ALA 21 HB1 ALA 21 -11.222 4.153 1.136
167 HB2 ALA 21 HB2 ALA 21 -9.945 3.515 2.193
168 HB3 ALA 21 HB3 ALA 21 -11.048 2.399 1.371
169 H VAL 22 H VAL 22 -13.386 5.482 2.558
170 HA VAL 22 HA VAL 22 -15.977 4.181 2.555
171 HB VAL 22 HB VAL 22 -16.900 6.406 2.347
172 HG11 VAL 22 HG11 VAL 22 -14.507 6.726 4.195
173 HG12 VAL 22 HG12 VAL 22 -16.101 7.493 4.315
174 HG13 VAL 22 HG13 VAL 22 -15.940 5.754 4.598
175 HG21 VAL 22 HG21 VAL 22 -14.097 7.357 1.693
176 HG22 VAL 22 HG22 VAL 22 -15.521 7.383 0.640
177 HG23 VAL 22 HG23 VAL 22 -15.463 8.434 2.064
178 H ASP 23 H ASP 23 -13.690 5.487 0.169
179 HA ASP 23 HA ASP 23 -15.035 3.929 -1.944
180 HB2 ASP 23 HB2 ASP 23 -15.525 6.515 -1.984
181 HB3 ASP 23 HB3 ASP 23 -13.856 6.649 -2.533
182 H ALA 24 H ALA 24 -13.528 3.212 -3.597
183 HA ALA 24 HA ALA 24 -10.899 2.529 -2.691
184 HB1 ALA 24 HB1 ALA 24 -10.701 1.493 -4.926
185 HB2 ALA 24 HB2 ALA 24 -12.285 1.112 -4.245
186 HB3 ALA 24 HB3 ALA 24 -12.144 2.374 -5.479
187 H ALA 25 H ALA 25 -12.204 5.357 -4.179
188 HA ALA 25 HA ALA 25 -9.850 6.410 -5.425
189 HB1 ALA 25 HB1 ALA 25 -12.255 7.153 -5.795
190 HB2 ALA 25 HB2 ALA 25 -12.204 7.919 -4.192
191 HB3 ALA 25 HB3 ALA 25 -11.117 8.481 -5.472
192 H THR 26 H THR 26 -11.168 6.513 -2.108
193 HA THR 26 HA THR 26 -9.315 8.385 -0.988
194 HB THR 26 HB THR 26 -11.023 6.207 0.284
195 HG1 THR 26 HG1 THR 26 -12.016 8.405 0.933
196 HG21 THR 26 HG21 THR 26 -9.673 8.565 1.660
197 HG22 THR 26 HG22 THR 26 -10.702 7.327 2.409
198 HG23 THR 26 HG23 THR 26 -9.115 6.883 1.752
199 H ALA 27 H ALA 27 -9.502 4.798 -0.677
200 HA ALA 27 HA ALA 27 -7.003 4.144 0.253
201 HB1 ALA 27 HB1 ALA 27 -8.214 2.698 -2.122
202 HB2 ALA 27 HB2 ALA 27 -7.412 2.017 -0.690
203 HB3 ALA 27 HB3 ALA 27 -9.043 2.693 -0.550
204 H GLU 28 H GLU 28 -7.837 4.919 -3.167
205 HA GLU 28 HA GLU 28 -5.277 4.469 -4.296
206 HB2 GLU 28 HB2 GLU 28 -7.366 4.440 -5.570
207 HB3 GLU 28 HB3 GLU 28 -7.669 6.139 -5.192
208 HG2 GLU 28 HG2 GLU 28 -5.767 6.832 -6.554
209 HG3 GLU 28 HG3 GLU 28 -5.238 5.152 -6.746
210 H LYS 29 H LYS 29 -6.837 7.332 -2.821
211 HA LYS 29 HA LYS 29 -4.636 9.101 -3.263
212 HB2 LYS 29 HB2 LYS 29 -6.996 9.763 -2.695
213 HB3 LYS 29 HB3 LYS 29 -6.722 9.212 -1.038
214 HG2 LYS 29 HG2 LYS 29 -4.735 10.895 -1.006
215 HG3 LYS 29 HG3 LYS 29 -5.375 11.501 -2.542
216 HD2 LYS 29 HD2 LYS 29 -7.490 12.097 -1.486
217 HD3 LYS 29 HD3 LYS 29 -6.984 11.332 0.042
218 HE2 LYS 29 HE2 LYS 29 -5.104 12.934 0.235
219 HE3 LYS 29 HE3 LYS 29 -5.555 13.675 -1.305
220 HZ1 LYS 29 HZ1 LYS 29 -7.144 13.697 1.196
221 HZ2 LYS 29 HZ2 LYS 29 -6.448 14.989 0.457
222 HZ3 LYS 29 HZ3 LYS 29 -7.724 14.232 -0.248
223 H VAL 30 H VAL 30 -5.286 6.937 -0.503
224 HA VAL 30 HA VAL 30 -3.185 7.726 1.183
225 HB VAL 30 HB VAL 30 -4.808 5.201 0.881
226 HG11 VAL 30 HG11 VAL 30 -2.352 5.463 2.659
227 HG12 VAL 30 HG12 VAL 30 -3.703 4.384 3.028
228 HG13 VAL 30 HG13 VAL 30 -2.790 4.164 1.530
229 HG21 VAL 30 HG21 VAL 30 -5.553 5.769 3.160
230 HG22 VAL 30 HG22 VAL 30 -4.518 7.199 3.147
231 HG23 VAL 30 HG23 VAL 30 -5.850 7.002 2.102
232 H PHE 31 H PHE 31 -3.258 5.376 -1.521
233 HA PHE 31 HA PHE 31 -0.975 3.910 -1.004
234 HB2 PHE 31 HB2 PHE 31 -2.130 4.787 -3.687
235 HB3 PHE 31 HB3 PHE 31 -0.947 3.504 -3.483
236 HD1 PHE 31 HD1 PHE 31 -2.500 2.747 -0.671
237 HD2 PHE 31 HD2 PHE 31 -3.600 3.131 -4.823
238 HE1 PHE 31 HE1 PHE 31 -4.409 1.204 -0.308
239 HE2 PHE 31 HE2 PHE 31 -5.511 1.587 -4.455
240 HZ PHE 31 HZ PHE 31 -5.920 0.625 -2.198
241 H LYS 32 H LYS 32 -1.174 6.973 -2.864
242 HA LYS 32 HA LYS 32 1.646 7.077 -3.378
243 HB2 LYS 32 HB2 LYS 32 -0.285 8.143 -4.703
244 HB3 LYS 32 HB3 LYS 32 -0.275 9.437 -3.497
245 HG2 LYS 32 HG2 LYS 32 2.048 10.006 -4.111
246 HG3 LYS 32 HG3 LYS 32 2.160 8.562 -5.130
247 HD2 LYS 32 HD2 LYS 32 0.388 9.477 -6.611
248 HD3 LYS 32 HD3 LYS 32 0.294 10.931 -5.583
249 HE2 LYS 32 HE2 LYS 32 2.622 11.493 -6.069
250 HE3 LYS 32 HE3 LYS 32 2.855 9.970 -6.939
251 HZ1 LYS 32 HZ1 LYS 32 1.213 10.745 -8.570
252 HZ2 LYS 32 HZ2 LYS 32 1.057 12.175 -7.776
253 HZ3 LYS 32 HZ3 LYS 32 2.488 11.782 -8.480
254 H GLN 33 H GLN 33 -0.289 8.619 -0.792
255 HA GLN 33 HA GLN 33 1.864 10.301 0.134
256 HB2 GLN 33 HB2 GLN 33 -0.433 10.996 0.413
257 HB3 GLN 33 HB3 GLN 33 -0.864 9.485 1.225
258 HG2 GLN 33 HG2 GLN 33 1.285 11.157 2.491
259 HG3 GLN 33 HG3 GLN 33 -0.372 11.776 2.562
260 HE21 GLN 33 HE21 GLN 33 -1.369 8.799 4.538
261 HE22 GLN 33 HE22 GLN 33 -1.950 9.552 3.049
262 H TYR 34 H TYR 34 0.308 7.249 1.321
263 HA TYR 34 HA TYR 34 1.623 7.187 3.809
264 HB2 TYR 34 HB2 TYR 34 -0.315 5.890 3.634
265 HB3 TYR 34 HB3 TYR 34 0.160 5.189 2.094
266 HD1 TYR 34 HD1 TYR 34 1.051 2.990 2.066
267 HD2 TYR 34 HD2 TYR 34 1.168 5.295 5.713
268 HE1 TYR 34 HE1 TYR 34 1.968 1.023 3.276
269 HE2 TYR 34 HE2 TYR 34 2.102 3.321 6.927
270 HH TYR 34 HH TYR 34 2.732 1.141 6.787
271 H ALA 35 H ALA 35 2.613 5.768 0.671
272 HA ALA 35 HA ALA 35 4.661 4.086 1.905
273 HB1 ALA 35 HB1 ALA 35 3.872 4.479 -1.021
274 HB2 ALA 35 HB2 ALA 35 4.869 3.162 -0.363
275 HB3 ALA 35 HB3 ALA 35 3.155 3.271 0.070
276 H ASN 36 H ASN 36 4.481 6.909 -0.292
277 HA ASN 36 HA ASN 36 7.234 7.351 -0.717
278 HB2 ASN 36 HB2 ASN 36 5.374 8.445 -1.975
279 HB3 ASN 36 HB3 ASN 36 4.936 9.353 -0.532
280 HD21 ASN 36 HD21 ASN 36 8.304 10.397 -2.668
281 HD22 ASN 36 HD22 ASN 36 7.710 8.742 -2.765
282 H ASP 37 H ASP 37 5.222 7.903 2.131
283 HA ASP 37 HA ASP 37 7.089 9.541 3.610
284 HB2 ASP 37 HB2 ASP 37 4.567 9.485 3.894
285 HB3 ASP 37 HB3 ASP 37 4.739 7.871 4.581
286 H ASN 38 H ASN 38 6.551 6.099 3.048
287 HA ASN 38 HA ASN 38 8.508 5.286 5.092
288 HB2 ASN 38 HB2 ASN 38 6.172 4.127 4.251
289 HB3 ASN 38 HB3 ASN 38 7.319 3.300 3.203
290 HD21 ASN 38 HD21 ASN 38 6.953 1.248 6.255
291 HD22 ASN 38 HD22 ASN 38 5.943 1.720 4.893
292 H GLY 39 H GLY 39 8.475 6.291 1.804
293 HA2 GLY 39 HA2 GLY 39 10.368 6.867 0.617
294 HA3 GLY 39 HA3 GLY 39 11.365 6.012 1.776
295 H VAL 40 H VAL 40 9.185 5.563 -0.992
296 HA VAL 40 HA VAL 40 10.385 2.919 -1.602
297 HB VAL 40 HB VAL 40 8.195 2.157 -2.389
298 HG11 VAL 40 HG11 VAL 40 7.793 3.266 0.412
299 HG12 VAL 40 HG12 VAL 40 7.054 1.829 -0.315
300 HG13 VAL 40 HG13 VAL 40 8.786 1.838 0.046
301 HG21 VAL 40 HG21 VAL 40 7.043 4.794 -1.430
302 HG22 VAL 40 HG22 VAL 40 7.290 4.336 -3.123
303 HG23 VAL 40 HG23 VAL 40 6.138 3.430 -2.130
304 H ASP 41 H ASP 41 10.685 2.435 -3.817
305 HA ASP 41 HA ASP 41 10.003 4.351 -5.915
306 HB2 ASP 41 HB2 ASP 41 12.184 5.158 -4.987
307 HB3 ASP 41 HB3 ASP 41 12.885 3.572 -5.305
308 H GLY 42 H GLY 42 8.665 2.137 -5.877
309 HA2 GLY 42 HA2 GLY 42 10.131 0.045 -7.420
310 HA3 GLY 42 HA3 GLY 42 9.111 -0.359 -6.054
311 H GLU 43 H GLU 43 7.278 -1.285 -6.752
312 HA GLU 43 HA GLU 43 5.615 -0.251 -8.878
313 HB2 GLU 43 HB2 GLU 43 5.869 -2.193 -10.345
314 HB3 GLU 43 HB3 GLU 43 7.402 -1.326 -10.202
315 HG2 GLU 43 HG2 GLU 43 8.061 -3.066 -8.428
316 HG3 GLU 43 HG3 GLU 43 6.605 -3.960 -8.896
317 H TRP 44 H TRP 44 3.542 -1.409 -8.877
318 HA TRP 44 HA TRP 44 3.089 -2.449 -6.126
319 HB2 TRP 44 HB2 TRP 44 1.592 -0.436 -7.825
320 HB3 TRP 44 HB3 TRP 44 0.825 -1.236 -6.461
321 HD1 TRP 44 HD1 TRP 44 4.161 0.686 -7.037
322 HE1 TRP 44 HE1 TRP 44 4.521 2.377 -5.080
323 HE3 TRP 44 HE3 TRP 44 -0.002 -0.414 -4.256
324 HZ2 TRP 44 HZ2 TRP 44 3.130 3.125 -2.687
325 HZ3 TRP 44 HZ3 TRP 44 -0.468 0.822 -2.158
326 HH2 TRP 44 HH2 TRP 44 1.087 2.588 -1.363
327 H THR 45 H THR 45 2.139 -4.366 -5.915
328 HA THR 45 HA THR 45 0.372 -5.443 -8.043
329 HB THR 45 HB THR 45 1.336 -7.677 -7.704
330 HG1 THR 45 HG1 THR 45 3.011 -7.988 -6.349
331 HG21 THR 45 HG21 THR 45 2.386 -5.982 -9.387
332 HG22 THR 45 HG22 THR 45 3.723 -5.900 -8.221
333 HG23 THR 45 HG23 THR 45 3.294 -7.450 -8.970
334 H TYR 46 H TYR 46 -0.949 -7.339 -7.134
335 HA TYR 46 HA TYR 46 -1.983 -6.525 -4.482
336 HB2 TYR 46 HB2 TYR 46 -2.981 -4.991 -6.132
337 HB3 TYR 46 HB3 TYR 46 -3.515 -6.354 -7.106
338 HD1 TYR 46 HD1 TYR 46 -3.829 -4.935 -3.621
339 HD2 TYR 46 HD2 TYR 46 -5.694 -7.158 -6.808
340 HE1 TYR 46 HE1 TYR 46 -5.977 -4.918 -2.367
341 HE2 TYR 46 HE2 TYR 46 -7.869 -7.114 -5.565
342 HH TYR 46 HH TYR 46 -8.979 -6.296 -3.750
343 H ASP 47 H ASP 47 -3.060 -8.107 -3.380
344 HA ASP 47 HA ASP 47 -3.870 -10.615 -4.738
345 HB2 ASP 47 HB2 ASP 47 -2.333 -10.239 -2.142
346 HB3 ASP 47 HB3 ASP 47 -3.221 -11.717 -2.516
347 H ASP 48 H ASP 48 -6.043 -10.900 -4.521
348 HA ASP 48 HA ASP 48 -7.553 -8.829 -3.155
349 HB2 ASP 48 HB2 ASP 48 -7.956 -9.469 -5.525
350 HB3 ASP 48 HB3 ASP 48 -8.384 -11.100 -5.007
351 H ALA 49 H ALA 49 -6.163 -11.203 -1.696
352 HA ALA 49 HA ALA 49 -8.380 -12.845 -0.710
353 HB1 ALA 49 HB1 ALA 49 -6.195 -13.864 -1.330
354 HB2 ALA 49 HB2 ALA 49 -5.383 -12.877 -0.095
355 HB3 ALA 49 HB3 ALA 49 -6.559 -14.110 0.393
356 H THR 50 H THR 50 -5.829 -10.742 0.764
357 HA THR 50 HA THR 50 -7.824 -9.816 2.771
358 HB THR 50 HB THR 50 -5.807 -11.018 3.727
359 HG1 THR 50 HG1 THR 50 -6.647 -8.444 4.267
360 HG21 THR 50 HG21 THR 50 -4.158 -8.574 3.098
361 HG22 THR 50 HG22 THR 50 -3.643 -10.213 3.548
362 HG23 THR 50 HG23 THR 50 -4.250 -9.892 1.913
363 H LYS 51 H LYS 51 -6.967 -9.062 -0.120
364 HA LYS 51 HA LYS 51 -6.557 -7.189 -1.367
365 HB2 LYS 51 HB2 LYS 51 -7.836 -5.682 0.955
366 HB3 LYS 51 HB3 LYS 51 -7.770 -5.168 -0.735
367 HG2 LYS 51 HG2 LYS 51 -9.074 -7.439 -1.178
368 HG3 LYS 51 HG3 LYS 51 -9.386 -7.390 0.565
369 HD2 LYS 51 HD2 LYS 51 -10.365 -5.101 0.286
370 HD3 LYS 51 HD3 LYS 51 -10.123 -5.246 -1.473
371 HE2 LYS 51 HE2 LYS 51 -11.614 -7.402 0.054
372 HE3 LYS 51 HE3 LYS 51 -12.454 -5.914 -0.399
373 HZ1 LYS 51 HZ1 LYS 51 -12.303 -6.426 -2.617
374 HZ2 LYS 51 HZ2 LYS 51 -10.947 -7.341 -2.466
375 HZ3 LYS 51 HZ3 LYS 51 -12.400 -7.952 -2.010
376 H THR 52 H THR 52 -4.255 -8.011 -0.230
377 HA THR 52 HA THR 52 -2.774 -5.814 0.981
378 HB THR 52 HB THR 52 -2.099 -8.594 -0.008
379 HG1 THR 52 HG1 THR 52 -1.348 -8.648 2.212
380 HG21 THR 52 HG21 THR 52 -0.132 -7.456 -0.710
381 HG22 THR 52 HG22 THR 52 -0.151 -6.386 0.707
382 HG23 THR 52 HG23 THR 52 0.251 -8.102 0.897
383 H PHE 53 H PHE 53 -1.687 -4.235 -0.043
384 HA PHE 53 HA PHE 53 -0.949 -4.585 -2.892
385 HB2 PHE 53 HB2 PHE 53 -1.091 -2.186 -1.035
386 HB3 PHE 53 HB3 PHE 53 -0.228 -2.119 -2.565
387 HD1 PHE 53 HD1 PHE 53 -1.530 -2.373 -4.731
388 HD2 PHE 53 HD2 PHE 53 -3.480 -2.176 -0.889
389 HE1 PHE 53 HE1 PHE 53 -3.698 -1.924 -5.852
390 HE2 PHE 53 HE2 PHE 53 -5.648 -1.731 -2.017
391 HZ PHE 53 HZ PHE 53 -5.760 -1.607 -4.498
392 H THR 54 H THR 54 0.902 -5.694 -3.133
393 HA THR 54 HA THR 54 3.145 -5.478 -1.249
394 HB THR 54 HB THR 54 2.776 -7.109 -3.796
395 HG1 THR 54 HG1 THR 54 2.758 -8.795 -2.091
396 HG21 THR 54 HG21 THR 54 4.709 -8.460 -2.665
397 HG22 THR 54 HG22 THR 54 5.104 -6.991 -3.577
398 HG23 THR 54 HG23 THR 54 5.040 -6.943 -1.807
399 H VAL 55 H VAL 55 4.825 -4.194 -1.501
400 HA VAL 55 HA VAL 55 5.399 -2.967 -4.141
401 HB VAL 55 HB VAL 55 5.430 -1.710 -1.378
402 HG11 VAL 55 HG11 VAL 55 7.572 -1.072 -2.385
403 HG12 VAL 55 HG12 VAL 55 6.745 -0.582 -3.874
404 HG13 VAL 55 HG13 VAL 55 6.464 0.318 -2.377
405 HG21 VAL 55 HG21 VAL 55 3.299 -1.530 -2.512
406 HG22 VAL 55 HG22 VAL 55 4.087 0.057 -2.457
407 HG23 VAL 55 HG23 VAL 55 4.078 -0.867 -3.967
408 H THR 56 H THR 56 7.269 -3.731 -4.935
409 HA THR 56 HA THR 56 9.597 -4.084 -3.112
410 HB THR 56 HB THR 56 9.020 -5.415 -5.791
411 HG1 THR 56 HG1 THR 56 8.854 -7.244 -4.573
412 HG21 THR 56 HG21 THR 56 11.118 -6.751 -5.217
413 HG22 THR 56 HG22 THR 56 11.384 -5.072 -5.721
414 HG23 THR 56 HG23 THR 56 11.471 -5.506 -4.005
415 H GLU 57 H GLU 57 10.967 -2.444 -3.219
416 HA GLU 57 HA GLU 57 11.281 -0.533 -5.330
417 HB2 GLU 57 HB2 GLU 57 11.652 -0.120 -2.896
418 HB3 GLU 57 HB3 GLU 57 12.994 -1.266 -2.905
419 HG2 GLU 57 HG2 GLU 57 14.146 0.241 -4.601
420 HG3 GLU 57 HG3 GLU 57 12.822 1.388 -4.398
Start of MODEL 20
1 H1 MET 1 H MET 1 -16.660 0.040 0.591
2 HA MET 1 HA MET 1 -16.704 -1.742 -1.136
3 HB2 MET 1 HB2 MET 1 -14.937 -0.653 -2.505
4 HB3 MET 1 HB3 MET 1 -13.728 -1.081 -1.289
5 HG2 MET 1 HG2 MET 1 -13.815 -2.605 -3.305
6 HG3 MET 1 HG3 MET 1 -14.004 -3.437 -1.748
7 HE1 MET 1 HE1 MET 1 -17.323 -2.535 -4.834
8 HE2 MET 1 HE2 MET 1 -15.959 -1.485 -4.401
9 HE3 MET 1 HE3 MET 1 -15.673 -2.957 -5.353
10 H GLY 2 H GLY 2 -13.557 -1.616 0.688
11 HA2 GLY 2 HA2 GLY 2 -14.734 -2.998 2.971
12 HA3 GLY 2 HA3 GLY 2 -13.648 -3.997 2.026
13 H THR 3 H THR 3 -11.730 -4.139 2.977
14 HA THR 3 HA THR 3 -10.434 -1.755 4.192
15 HB THR 3 HB THR 3 -11.080 -2.938 6.118
16 HG1 THR 3 HG1 THR 3 -8.708 -2.686 5.734
17 HG21 THR 3 HG21 THR 3 -10.323 -5.559 4.756
18 HG22 THR 3 HG22 THR 3 -10.948 -5.367 6.407
19 HG23 THR 3 HG23 THR 3 -11.974 -4.965 5.018
20 H TYR 4 H TYR 4 -8.312 -1.488 3.736
21 HA TYR 4 HA TYR 4 -7.145 -3.384 1.761
22 HB2 TYR 4 HB2 TYR 4 -6.801 -0.375 2.085
23 HB3 TYR 4 HB3 TYR 4 -5.898 -1.362 0.944
24 HD1 TYR 4 HD1 TYR 4 -7.458 -2.854 -0.685
25 HD2 TYR 4 HD2 TYR 4 -8.738 0.686 1.417
26 HE1 TYR 4 HE1 TYR 4 -9.346 -2.596 -2.281
27 HE2 TYR 4 HE2 TYR 4 -10.638 0.945 -0.176
28 HH TYR 4 HH TYR 4 -11.367 0.258 -2.376
29 H LYS 5 H LYS 5 -5.490 -4.574 2.513
30 HA LYS 5 HA LYS 5 -3.704 -3.511 4.583
31 HB2 LYS 5 HB2 LYS 5 -4.523 -6.086 3.706
32 HB3 LYS 5 HB3 LYS 5 -2.786 -6.005 3.390
33 HG2 LYS 5 HG2 LYS 5 -2.637 -5.096 5.862
34 HG3 LYS 5 HG3 LYS 5 -4.299 -5.685 6.013
35 HD2 LYS 5 HD2 LYS 5 -3.529 -7.955 5.311
36 HD3 LYS 5 HD3 LYS 5 -1.857 -7.341 5.239
37 HE2 LYS 5 HE2 LYS 5 -1.867 -6.821 7.609
38 HE3 LYS 5 HE3 LYS 5 -3.604 -7.134 7.733
39 HZ1 LYS 5 HZ1 LYS 5 -2.177 -8.977 8.547
40 HZ2 LYS 5 HZ2 LYS 5 -3.209 -9.449 7.360
41 HZ3 LYS 5 HZ3 LYS 5 -1.620 -9.217 7.018
42 H LEU 6 H LEU 6 -1.416 -3.251 4.447
43 HA LEU 6 HA LEU 6 -0.344 -2.646 1.764
44 HB2 LEU 6 HB2 LEU 6 -1.427 -0.720 3.582
45 HB3 LEU 6 HB3 LEU 6 0.325 -0.547 3.662
46 HG LEU 6 HG LEU 6 -1.054 -0.585 0.968
47 HD11 LEU 6 HD11 LEU 6 -2.257 1.259 1.612
48 HD12 LEU 6 HD12 LEU 6 -1.227 1.562 3.028
49 HD13 LEU 6 HD13 LEU 6 -0.704 2.101 1.429
50 HD21 LEU 6 HD21 LEU 6 1.402 0.927 1.913
51 HD22 LEU 6 HD22 LEU 6 1.473 -0.735 1.302
52 HD23 LEU 6 HD23 LEU 6 0.906 0.574 0.244
53 H ILE 7 H ILE 7 1.859 -3.018 1.608
54 HA ILE 7 HA ILE 7 3.567 -2.923 3.959
55 HB ILE 7 HB ILE 7 2.933 -5.215 4.136
56 HG12 ILE 7 HG12 ILE 7 5.605 -5.274 2.691
57 HG13 ILE 7 HG13 ILE 7 5.379 -4.629 4.322
58 HG21 ILE 7 HG21 ILE 7 2.006 -5.422 1.769
59 HG22 ILE 7 HG22 ILE 7 3.667 -5.742 1.231
60 HG23 ILE 7 HG23 ILE 7 2.887 -6.841 2.365
61 HD11 ILE 7 HD11 ILE 7 4.552 -6.850 5.086
62 HD12 ILE 7 HD12 ILE 7 4.804 -7.482 3.453
63 HD13 ILE 7 HD13 ILE 7 6.197 -6.940 4.408
64 H LEU 8 H LEU 8 5.553 -2.082 3.411
65 HA LEU 8 HA LEU 8 6.267 -1.888 0.543
66 HB2 LEU 8 HB2 LEU 8 7.377 -0.390 2.962
67 HB3 LEU 8 HB3 LEU 8 7.739 -0.058 1.272
68 HG LEU 8 HG LEU 8 6.214 1.636 1.930
69 HD11 LEU 8 HD11 LEU 8 4.441 -0.499 0.651
70 HD12 LEU 8 HD12 LEU 8 4.178 1.257 0.627
71 HD13 LEU 8 HD13 LEU 8 5.547 0.563 -0.246
72 HD21 LEU 8 HD21 LEU 8 5.490 -0.044 3.944
73 HD22 LEU 8 HD22 LEU 8 4.607 1.433 3.524
74 HD23 LEU 8 HD23 LEU 8 4.041 -0.138 2.919
75 H ASN 9 H ASN 9 8.334 -2.579 -0.160
76 HA ASN 9 HA ASN 9 10.157 -3.821 1.818
77 HB2 ASN 9 HB2 ASN 9 9.302 -4.970 -0.878
78 HB3 ASN 9 HB3 ASN 9 10.717 -5.527 0.007
79 HD21 ASN 9 HD21 ASN 9 6.950 -6.655 1.127
80 HD22 ASN 9 HD22 ASN 9 7.173 -5.394 -0.080
81 H GLY 10 H GLY 10 11.587 -2.060 1.862
82 HA2 GLY 10 HA2 GLY 10 12.940 -1.367 -0.705
83 HA3 GLY 10 HA3 GLY 10 12.849 -0.318 0.696
84 H LYS 11 H LYS 11 15.264 -0.535 -0.184
85 HA LYS 11 HA LYS 11 16.798 -2.812 0.439
86 HB2 LYS 11 HB2 LYS 11 17.557 -1.080 -1.104
87 HB3 LYS 11 HB3 LYS 11 17.627 0.115 0.197
88 HG2 LYS 11 HG2 LYS 11 19.431 -1.299 1.290
89 HG3 LYS 11 HG3 LYS 11 19.321 -2.421 -0.075
90 HD2 LYS 11 HD2 LYS 11 19.905 -0.508 -1.611
91 HD3 LYS 11 HD3 LYS 11 20.162 0.506 -0.168
92 HE2 LYS 11 HE2 LYS 11 22.330 -0.294 -0.598
93 HE3 LYS 11 HE3 LYS 11 21.739 -1.414 0.635
94 HZ1 LYS 11 HZ1 LYS 11 21.301 -3.036 -1.034
95 HZ2 LYS 11 HZ2 LYS 11 21.571 -1.985 -2.266
96 HZ3 LYS 11 HZ3 LYS 11 22.824 -2.484 -1.327
97 H THR 12 H THR 12 16.570 0.142 2.494
98 HA THR 12 HA THR 12 17.287 -1.505 4.867
99 HB THR 12 HB THR 12 19.176 -0.082 4.494
100 HG1 THR 12 HG1 THR 12 17.341 0.698 6.441
101 HG21 THR 12 HG21 THR 12 18.888 2.442 4.326
102 HG22 THR 12 HG22 THR 12 18.393 1.519 2.893
103 HG23 THR 12 HG23 THR 12 17.168 2.143 4.013
104 H LEU 13 H LEU 13 14.659 -0.895 3.636
105 HA LEU 13 HA LEU 13 13.378 0.700 5.762
106 HB2 LEU 13 HB2 LEU 13 13.350 1.261 2.767
107 HB3 LEU 13 HB3 LEU 13 12.101 1.875 3.846
108 HG LEU 13 HG LEU 13 15.005 2.484 4.433
109 HD11 LEU 13 HD11 LEU 13 14.671 3.146 2.051
110 HD12 LEU 13 HD12 LEU 13 13.235 4.078 2.525
111 HD13 LEU 13 HD13 LEU 13 14.830 4.570 3.102
112 HD21 LEU 13 HD21 LEU 13 13.945 4.544 5.386
113 HD22 LEU 13 HD22 LEU 13 12.358 3.884 4.962
114 HD23 LEU 13 HD23 LEU 13 13.378 3.043 6.150
115 H LYS 14 H LYS 14 11.425 -0.118 6.340
116 HA LYS 14 HA LYS 14 9.897 -1.888 4.566
117 HB2 LYS 14 HB2 LYS 14 11.912 -2.961 6.275
118 HB3 LYS 14 HB3 LYS 14 10.363 -3.400 7.002
119 HG2 LYS 14 HG2 LYS 14 9.674 -4.306 4.707
120 HG3 LYS 14 HG3 LYS 14 11.311 -3.933 4.141
121 HD2 LYS 14 HD2 LYS 14 12.291 -5.514 5.673
122 HD3 LYS 14 HD3 LYS 14 10.744 -5.730 6.532
123 HE2 LYS 14 HE2 LYS 14 9.730 -6.640 4.437
124 HE3 LYS 14 HE3 LYS 14 11.285 -6.460 3.612
125 HZ1 LYS 14 HZ1 LYS 14 10.839 -8.179 5.989
126 HZ2 LYS 14 HZ2 LYS 14 10.907 -8.726 4.441
127 HZ3 LYS 14 HZ3 LYS 14 12.239 -8.058 5.134
128 H GLY 15 H GLY 15 8.054 -3.058 6.016
129 HA2 GLY 15 HA2 GLY 15 6.927 -2.456 8.288
130 HA3 GLY 15 HA3 GLY 15 6.711 -0.887 7.537
131 H GLU 16 H GLU 16 4.654 -2.694 8.474
132 HA GLU 16 HA GLU 16 3.052 -3.048 6.018
133 HB2 GLU 16 HB2 GLU 16 2.190 -5.166 6.903
134 HB3 GLU 16 HB3 GLU 16 3.932 -5.271 6.627
135 HG2 GLU 16 HG2 GLU 16 4.291 -4.898 9.092
136 HG3 GLU 16 HG3 GLU 16 2.533 -4.873 9.310
137 H THR 17 H THR 17 0.750 -2.820 6.450
138 HA THR 17 HA THR 17 -0.306 -1.992 8.989
139 HB THR 17 HB THR 17 0.996 0.069 8.352
140 HG1 THR 17 HG1 THR 17 -0.616 1.303 9.030
141 HG21 THR 17 HG21 THR 17 0.829 0.031 5.918
142 HG22 THR 17 HG22 THR 17 -0.941 0.133 6.008
143 HG23 THR 17 HG23 THR 17 0.055 1.502 6.539
144 H THR 18 H THR 18 -2.566 -0.862 8.476
145 HA THR 18 HA THR 18 -3.931 -2.045 6.165
146 HB THR 18 HB THR 18 -3.921 -3.855 7.908
147 HG1 THR 18 HG1 THR 18 -5.989 -4.293 7.513
148 HG21 THR 18 HG21 THR 18 -5.332 -3.579 9.924
149 HG22 THR 18 HG22 THR 18 -3.939 -2.479 9.948
150 HG23 THR 18 HG23 THR 18 -5.549 -1.863 9.532
151 H THR 19 H THR 19 -6.159 -1.242 5.977
152 HA THR 19 HA THR 19 -6.635 1.394 7.182
153 HB THR 19 HB THR 19 -6.625 2.522 4.978
154 HG1 THR 19 HG1 THR 19 -5.502 0.066 4.105
155 HG21 THR 19 HG21 THR 19 -3.882 1.278 5.195
156 HG22 THR 19 HG22 THR 19 -4.344 2.959 4.859
157 HG23 THR 19 HG23 THR 19 -4.496 2.309 6.501
158 H GLU 20 H GLU 20 -8.714 2.245 6.650
159 HA GLU 20 HA GLU 20 -10.588 0.448 5.213
160 HB2 GLU 20 HB2 GLU 20 -10.826 1.913 7.839
161 HB3 GLU 20 HB3 GLU 20 -12.273 1.656 6.858
162 HG2 GLU 20 HG2 GLU 20 -11.808 -0.817 6.914
163 HG3 GLU 20 HG3 GLU 20 -10.409 -0.497 7.952
164 H ALA 21 H ALA 21 -12.047 1.525 3.820
165 HA ALA 21 HA ALA 21 -11.992 4.431 3.531
166 HB1 ALA 21 HB1 ALA 21 -10.884 2.540 1.404
167 HB2 ALA 21 HB2 ALA 21 -11.337 4.228 1.084
168 HB3 ALA 21 HB3 ALA 21 -10.025 3.866 2.218
169 H VAL 22 H VAL 22 -13.844 5.201 2.593
170 HA VAL 22 HA VAL 22 -16.118 3.450 2.381
171 HB VAL 22 HB VAL 22 -17.372 5.547 1.889
172 HG11 VAL 22 HG11 VAL 22 -15.515 5.772 4.293
173 HG12 VAL 22 HG12 VAL 22 -16.997 6.708 4.039
174 HG13 VAL 22 HG13 VAL 22 -17.092 4.952 4.240
175 HG21 VAL 22 HG21 VAL 22 -14.621 6.717 1.664
176 HG22 VAL 22 HG22 VAL 22 -16.063 6.990 0.672
177 HG23 VAL 22 HG23 VAL 22 -15.950 7.730 2.275
178 H ASP 23 H ASP 23 -14.029 5.225 0.105
179 HA ASP 23 HA ASP 23 -15.193 3.760 -2.193
180 HB2 ASP 23 HB2 ASP 23 -15.732 6.367 -1.821
181 HB3 ASP 23 HB3 ASP 23 -14.129 6.545 -2.535
182 H ALA 24 H ALA 24 -13.610 3.572 -4.005
183 HA ALA 24 HA ALA 24 -11.056 2.633 -3.132
184 HB1 ALA 24 HB1 ALA 24 -10.729 2.450 -5.691
185 HB2 ALA 24 HB2 ALA 24 -12.087 1.539 -5.001
186 HB3 ALA 24 HB3 ALA 24 -12.387 3.072 -5.835
187 H ALA 25 H ALA 25 -12.216 5.696 -4.469
188 HA ALA 25 HA ALA 25 -9.724 6.870 -5.185
189 HB1 ALA 25 HB1 ALA 25 -12.312 8.210 -4.262
190 HB2 ALA 25 HB2 ALA 25 -11.026 8.947 -5.242
191 HB3 ALA 25 HB3 ALA 25 -12.009 7.637 -5.919
192 H THR 26 H THR 26 -11.660 6.988 -2.154
193 HA THR 26 HA THR 26 -10.060 8.529 -0.487
194 HB THR 26 HB THR 26 -11.471 5.942 0.281
195 HG1 THR 26 HG1 THR 26 -12.575 8.530 0.400
196 HG21 THR 26 HG21 THR 26 -10.234 6.705 2.176
197 HG22 THR 26 HG22 THR 26 -10.646 8.400 1.853
198 HG23 THR 26 HG23 THR 26 -11.895 7.275 2.420
199 H ALA 27 H ALA 27 -9.852 4.963 -0.900
200 HA ALA 27 HA ALA 27 -7.517 4.502 0.579
201 HB1 ALA 27 HB1 ALA 27 -8.147 2.903 -1.905
202 HB2 ALA 27 HB2 ALA 27 -7.676 2.336 -0.288
203 HB3 ALA 27 HB3 ALA 27 -9.325 2.916 -0.573
204 H GLU 28 H GLU 28 -7.820 4.986 -2.995
205 HA GLU 28 HA GLU 28 -5.177 4.490 -3.711
206 HB2 GLU 28 HB2 GLU 28 -7.156 4.604 -5.215
207 HB3 GLU 28 HB3 GLU 28 -7.215 6.358 -5.006
208 HG2 GLU 28 HG2 GLU 28 -4.860 6.444 -5.988
209 HG3 GLU 28 HG3 GLU 28 -5.015 4.714 -6.330
210 H LYS 29 H LYS 29 -6.755 7.539 -2.686
211 HA LYS 29 HA LYS 29 -4.489 9.203 -3.160
212 HB2 LYS 29 HB2 LYS 29 -7.088 9.480 -1.653
213 HB3 LYS 29 HB3 LYS 29 -5.852 10.729 -1.452
214 HG2 LYS 29 HG2 LYS 29 -5.908 11.211 -3.858
215 HG3 LYS 29 HG3 LYS 29 -6.877 9.760 -4.166
216 HD2 LYS 29 HD2 LYS 29 -8.796 10.708 -3.057
217 HD3 LYS 29 HD3 LYS 29 -7.831 12.064 -2.419
218 HE2 LYS 29 HE2 LYS 29 -7.392 12.847 -4.732
219 HE3 LYS 29 HE3 LYS 29 -8.321 11.490 -5.382
220 HZ1 LYS 29 HZ1 LYS 29 -9.522 13.468 -3.539
221 HZ2 LYS 29 HZ2 LYS 29 -9.532 13.678 -5.168
222 HZ3 LYS 29 HZ3 LYS 29 -10.302 12.388 -4.505
223 H VAL 30 H VAL 30 -5.345 7.366 -0.252
224 HA VAL 30 HA VAL 30 -3.198 8.279 1.389
225 HB VAL 30 HB VAL 30 -5.136 5.998 1.423
226 HG11 VAL 30 HG11 VAL 30 -2.599 5.934 3.108
227 HG12 VAL 30 HG12 VAL 30 -4.038 4.934 3.370
228 HG13 VAL 30 HG13 VAL 30 -3.097 4.745 1.884
229 HG21 VAL 30 HG21 VAL 30 -5.765 6.822 3.540
230 HG22 VAL 30 HG22 VAL 30 -4.265 7.748 3.724
231 HG23 VAL 30 HG23 VAL 30 -5.484 8.275 2.553
232 H PHE 31 H PHE 31 -3.487 5.790 -1.146
233 HA PHE 31 HA PHE 31 -1.373 4.116 -0.369
234 HB2 PHE 31 HB2 PHE 31 -2.700 4.660 -3.052
235 HB3 PHE 31 HB3 PHE 31 -1.475 3.417 -2.840
236 HD1 PHE 31 HD1 PHE 31 -2.893 3.224 0.239
237 HD2 PHE 31 HD2 PHE 31 -4.047 2.618 -3.871
238 HE1 PHE 31 HE1 PHE 31 -4.719 1.711 0.974
239 HE2 PHE 31 HE2 PHE 31 -5.875 1.107 -3.131
240 HZ PHE 31 HZ PHE 31 -6.213 0.654 -0.710
241 H LYS 32 H LYS 32 -1.373 6.912 -2.603
242 HA LYS 32 HA LYS 32 1.457 6.625 -3.177
243 HB2 LYS 32 HB2 LYS 32 -0.712 8.591 -3.950
244 HB3 LYS 32 HB3 LYS 32 0.977 8.947 -4.333
245 HG2 LYS 32 HG2 LYS 32 1.117 6.850 -5.652
246 HG3 LYS 32 HG3 LYS 32 -0.504 6.384 -5.110
247 HD2 LYS 32 HD2 LYS 32 -1.408 8.452 -6.233
248 HD3 LYS 32 HD3 LYS 32 0.226 8.758 -6.875
249 HE2 LYS 32 HE2 LYS 32 0.223 6.593 -8.033
250 HE3 LYS 32 HE3 LYS 32 -1.334 6.167 -7.310
251 HZ1 LYS 32 HZ1 LYS 32 -1.602 6.977 -9.572
252 HZ2 LYS 32 HZ2 LYS 32 -2.336 8.011 -8.527
253 HZ3 LYS 32 HZ3 LYS 32 -0.891 8.413 -9.197
254 H GLN 33 H GLN 33 -0.239 8.261 -0.633
255 HA GLN 33 HA GLN 33 1.914 10.125 -0.010
256 HB2 GLN 33 HB2 GLN 33 -0.485 10.648 0.372
257 HB3 GLN 33 HB3 GLN 33 -0.610 9.288 1.496
258 HG2 GLN 33 HG2 GLN 33 1.426 10.609 2.685
259 HG3 GLN 33 HG3 GLN 33 0.662 11.980 1.871
260 HE21 GLN 33 HE21 GLN 33 -1.672 10.055 4.642
261 HE22 GLN 33 HE22 GLN 33 -0.682 9.045 3.585
262 H TYR 34 H TYR 34 0.528 7.084 1.409
263 HA TYR 34 HA TYR 34 1.978 7.261 3.826
264 HB2 TYR 34 HB2 TYR 34 0.049 5.952 3.907
265 HB3 TYR 34 HB3 TYR 34 0.401 5.137 2.391
266 HD1 TYR 34 HD1 TYR 34 1.462 2.991 2.414
267 HD2 TYR 34 HD2 TYR 34 1.517 5.449 5.955
268 HE1 TYR 34 HE1 TYR 34 2.466 1.114 3.692
269 HE2 TYR 34 HE2 TYR 34 2.535 3.569 7.242
270 HH TYR 34 HH TYR 34 3.714 1.505 6.954
271 H ALA 35 H ALA 35 2.817 5.693 0.740
272 HA ALA 35 HA ALA 35 4.992 4.118 1.891
273 HB1 ALA 35 HB1 ALA 35 4.297 4.436 -1.053
274 HB2 ALA 35 HB2 ALA 35 5.040 3.044 -0.235
275 HB3 ALA 35 HB3 ALA 35 3.325 3.408 0.024
276 H ASN 36 H ASN 36 4.585 6.950 -0.256
277 HA ASN 36 HA ASN 36 7.314 7.459 -0.826
278 HB2 ASN 36 HB2 ASN 36 5.161 8.423 -1.913
279 HB3 ASN 36 HB3 ASN 36 5.124 9.553 -0.565
280 HD21 ASN 36 HD21 ASN 36 7.908 9.955 -3.559
281 HD22 ASN 36 HD22 ASN 36 7.054 8.428 -3.366
282 H ASP 37 H ASP 37 5.344 8.087 2.049
283 HA ASP 37 HA ASP 37 7.168 9.838 3.425
284 HB2 ASP 37 HB2 ASP 37 4.705 9.708 3.842
285 HB3 ASP 37 HB3 ASP 37 4.910 8.063 4.439
286 H ASN 38 H ASN 38 6.722 6.316 3.131
287 HA ASN 38 HA ASN 38 8.810 5.592 4.996
288 HB2 ASN 38 HB2 ASN 38 6.729 4.237 3.937
289 HB3 ASN 38 HB3 ASN 38 7.950 3.788 2.751
290 HD21 ASN 38 HD21 ASN 38 7.790 1.351 5.653
291 HD22 ASN 38 HD22 ASN 38 6.546 2.030 4.608
292 H GLY 39 H GLY 39 8.663 6.535 1.578
293 HA2 GLY 39 HA2 GLY 39 10.438 7.037 0.146
294 HA3 GLY 39 HA3 GLY 39 11.574 6.330 1.275
295 H VAL 40 H VAL 40 9.393 5.745 -1.380
296 HA VAL 40 HA VAL 40 10.523 3.050 -1.854
297 HB VAL 40 HB VAL 40 8.336 2.219 -2.558
298 HG11 VAL 40 HG11 VAL 40 7.092 2.250 -0.356
299 HG12 VAL 40 HG12 VAL 40 8.792 1.762 -0.252
300 HG13 VAL 40 HG13 VAL 40 8.315 3.391 0.245
301 HG21 VAL 40 HG21 VAL 40 7.372 5.017 -1.981
302 HG22 VAL 40 HG22 VAL 40 7.150 4.026 -3.432
303 HG23 VAL 40 HG23 VAL 40 6.256 3.631 -1.956
304 H ASP 41 H ASP 41 10.780 2.507 -4.065
305 HA ASP 41 HA ASP 41 9.855 4.295 -6.190
306 HB2 ASP 41 HB2 ASP 41 12.135 5.124 -5.446
307 HB3 ASP 41 HB3 ASP 41 12.793 3.553 -5.897
308 H GLY 42 H GLY 42 8.625 1.989 -5.779
309 HA2 GLY 42 HA2 GLY 42 10.027 -0.155 -7.314
310 HA3 GLY 42 HA3 GLY 42 9.032 -0.461 -5.905
311 H GLU 43 H GLU 43 7.291 -1.560 -6.600
312 HA GLU 43 HA GLU 43 5.512 -0.566 -8.675
313 HB2 GLU 43 HB2 GLU 43 5.694 -2.524 -10.084
314 HB3 GLU 43 HB3 GLU 43 7.288 -1.771 -9.959
315 HG2 GLU 43 HG2 GLU 43 7.954 -3.498 -8.290
316 HG3 GLU 43 HG3 GLU 43 6.339 -4.217 -8.396
317 H TRP 44 H TRP 44 3.423 -1.507 -8.435
318 HA TRP 44 HA TRP 44 3.060 -2.812 -5.788
319 HB2 TRP 44 HB2 TRP 44 1.364 -0.798 -7.306
320 HB3 TRP 44 HB3 TRP 44 0.805 -1.643 -5.867
321 HD1 TRP 44 HD1 TRP 44 4.110 0.240 -6.671
322 HE1 TRP 44 HE1 TRP 44 4.553 1.979 -4.838
323 HE3 TRP 44 HE3 TRP 44 -0.035 -0.564 -3.775
324 HZ2 TRP 44 HZ2 TRP 44 3.239 2.953 -2.455
325 HZ3 TRP 44 HZ3 TRP 44 -0.425 0.801 -1.742
326 HH2 TRP 44 HH2 TRP 44 1.199 2.556 -1.073
327 H THR 45 H THR 45 2.009 -4.698 -5.636
328 HA THR 45 HA THR 45 0.325 -5.671 -7.887
329 HB THR 45 HB THR 45 1.056 -7.998 -6.847
330 HG1 THR 45 HG1 THR 45 3.418 -6.507 -6.459
331 HG21 THR 45 HG21 THR 45 3.026 -6.502 -8.621
332 HG22 THR 45 HG22 THR 45 2.769 -8.255 -8.520
333 HG23 THR 45 HG23 THR 45 1.505 -7.211 -9.196
334 H TYR 46 H TYR 46 -1.553 -6.782 -7.319
335 HA TYR 46 HA TYR 46 -2.489 -6.139 -4.565
336 HB2 TYR 46 HB2 TYR 46 -3.480 -4.643 -6.192
337 HB3 TYR 46 HB3 TYR 46 -3.898 -5.982 -7.253
338 HD1 TYR 46 HD1 TYR 46 -4.524 -4.690 -3.761
339 HD2 TYR 46 HD2 TYR 46 -6.066 -6.863 -7.149
340 HE1 TYR 46 HE1 TYR 46 -6.759 -4.771 -2.682
341 HE2 TYR 46 HE2 TYR 46 -8.315 -6.939 -6.075
342 HH TYR 46 HH TYR 46 -9.571 -6.344 -4.277
343 H ASP 47 H ASP 47 -3.423 -7.704 -3.369
344 HA ASP 47 HA ASP 47 -4.232 -10.284 -4.594
345 HB2 ASP 47 HB2 ASP 47 -2.606 -9.658 -2.127
346 HB3 ASP 47 HB3 ASP 47 -3.612 -11.103 -2.168
347 H ASP 48 H ASP 48 -6.411 -10.440 -4.511
348 HA ASP 48 HA ASP 48 -8.043 -8.565 -3.059
349 HB2 ASP 48 HB2 ASP 48 -8.511 -9.289 -5.381
350 HB3 ASP 48 HB3 ASP 48 -8.717 -10.950 -4.828
351 H ALA 49 H ALA 49 -6.721 -11.683 -2.363
352 HA ALA 49 HA ALA 49 -8.547 -12.977 -0.741
353 HB1 ALA 49 HB1 ALA 49 -6.519 -13.878 0.417
354 HB2 ALA 49 HB2 ALA 49 -6.330 -13.879 -1.351
355 HB3 ALA 49 HB3 ALA 49 -5.531 -12.631 -0.378
356 H THR 50 H THR 50 -6.182 -10.472 0.338
357 HA THR 50 HA THR 50 -8.069 -9.611 2.463
358 HB THR 50 HB THR 50 -6.460 -10.637 3.804
359 HG1 THR 50 HG1 THR 50 -5.955 -7.950 3.319
360 HG21 THR 50 HG21 THR 50 -4.547 -10.023 1.576
361 HG22 THR 50 HG22 THR 50 -3.903 -10.115 3.226
362 HG23 THR 50 HG23 THR 50 -4.759 -11.503 2.529
363 H LYS 51 H LYS 51 -7.644 -8.721 -0.293
364 HA LYS 51 HA LYS 51 -6.978 -6.918 -1.564
365 HB2 LYS 51 HB2 LYS 51 -8.068 -5.301 0.775
366 HB3 LYS 51 HB3 LYS 51 -8.116 -4.884 -0.942
367 HG2 LYS 51 HG2 LYS 51 -9.502 -7.189 -1.087
368 HG3 LYS 51 HG3 LYS 51 -9.750 -6.880 0.640
369 HD2 LYS 51 HD2 LYS 51 -10.675 -4.641 0.103
370 HD3 LYS 51 HD3 LYS 51 -10.420 -4.957 -1.631
371 HE2 LYS 51 HE2 LYS 51 -12.025 -6.874 0.094
372 HE3 LYS 51 HE3 LYS 51 -12.788 -5.429 -0.582
373 HZ1 LYS 51 HZ1 LYS 51 -11.441 -7.555 -2.155
374 HZ2 LYS 51 HZ2 LYS 51 -13.065 -7.325 -2.048
375 HZ3 LYS 51 HZ3 LYS 51 -12.126 -6.201 -2.793
376 H THR 52 H THR 52 -4.668 -7.810 -0.691
377 HA THR 52 HA THR 52 -3.194 -5.769 0.856
378 HB THR 52 HB THR 52 -2.707 -8.668 0.132
379 HG1 THR 52 HG1 THR 52 -3.713 -7.536 2.165
380 HG21 THR 52 HG21 THR 52 -0.639 -6.610 0.932
381 HG22 THR 52 HG22 THR 52 -0.489 -8.301 1.452
382 HG23 THR 52 HG23 THR 52 -0.536 -7.905 -0.275
383 H PHE 53 H PHE 53 -2.113 -4.239 -0.176
384 HA PHE 53 HA PHE 53 -1.051 -4.663 -2.886
385 HB2 PHE 53 HB2 PHE 53 -1.360 -2.310 -1.013
386 HB3 PHE 53 HB3 PHE 53 -0.213 -2.218 -2.342
387 HD1 PHE 53 HD1 PHE 53 -1.139 -2.594 -4.750
388 HD2 PHE 53 HD2 PHE 53 -3.668 -1.977 -1.312
389 HE1 PHE 53 HE1 PHE 53 -3.037 -2.027 -6.245
390 HE2 PHE 53 HE2 PHE 53 -5.565 -1.414 -2.813
391 HZ PHE 53 HZ PHE 53 -5.252 -1.441 -5.280
392 H THR 54 H THR 54 0.915 -5.478 -3.235
393 HA THR 54 HA THR 54 2.982 -5.430 -1.096
394 HB THR 54 HB THR 54 3.942 -7.254 -2.813
395 HG1 THR 54 HG1 THR 54 2.441 -7.486 -4.283
396 HG21 THR 54 HG21 THR 54 1.727 -7.887 -0.817
397 HG22 THR 54 HG22 THR 54 2.908 -9.036 -1.477
398 HG23 THR 54 HG23 THR 54 3.450 -7.704 -0.437
399 H VAL 55 H VAL 55 4.748 -4.282 -1.393
400 HA VAL 55 HA VAL 55 5.425 -3.246 -4.090
401 HB VAL 55 HB VAL 55 5.712 -1.944 -1.357
402 HG11 VAL 55 HG11 VAL 55 7.801 -1.513 -2.611
403 HG12 VAL 55 HG12 VAL 55 6.848 -0.911 -3.980
404 HG13 VAL 55 HG13 VAL 55 6.826 -0.036 -2.442
405 HG21 VAL 55 HG21 VAL 55 4.094 -1.272 -3.818
406 HG22 VAL 55 HG22 VAL 55 3.548 -1.513 -2.149
407 HG23 VAL 55 HG23 VAL 55 4.462 -0.056 -2.571
408 H THR 56 H THR 56 7.499 -3.562 -4.830
409 HA THR 56 HA THR 56 9.674 -4.198 -2.947
410 HB THR 56 HB THR 56 9.104 -5.816 -5.466
411 HG1 THR 56 HG1 THR 56 7.856 -6.578 -3.835
412 HG21 THR 56 HG21 THR 56 11.496 -5.627 -5.255
413 HG22 THR 56 HG22 THR 56 11.419 -5.903 -3.503
414 HG23 THR 56 HG23 THR 56 11.035 -7.220 -4.625
415 H GLU 57 H GLU 57 11.393 -2.967 -3.333
416 HA GLU 57 HA GLU 57 11.475 -0.888 -5.270
417 HB2 GLU 57 HB2 GLU 57 12.352 -0.715 -2.975
418 HB3 GLU 57 HB3 GLU 57 13.503 -2.017 -3.281
419 HG2 GLU 57 HG2 GLU 57 14.454 -0.468 -5.149
420 HG3 GLU 57 HG3 GLU 57 13.478 0.804 -4.411