Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12522 | 1t1q RC | 6205 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 HT1 GLY 1 -7.713 7.020 0.114
2 2H GLY 1 HT2 GLY 1 -7.625 6.578 1.752
3 3H GLY 1 HT3 GLY 1 -7.119 5.491 0.547
4 1HA GLY 1 HA1 GLY 1 -5.552 7.635 0.133
5 2HA GLY 1 HA2 GLY 1 -5.665 7.625 1.921
6 H ILE 2 H ILE 2 -5.647 5.644 -1.185
7 HA ILE 2 HA ILE 2 -2.909 4.652 -0.526
8 HB ILE 2 HB ILE 2 -4.957 3.067 -0.964
9 1HG1 ILE 2 HG12 ILE 2 -2.191 2.801 -2.161
10 2HG1 ILE 2 HG11 ILE 2 -2.779 2.152 -0.631
11 1HG2 ILE 2 HG21 ILE 2 -5.374 4.328 -3.208
12 2HG2 ILE 2 HG22 ILE 2 -5.480 2.567 -3.205
13 3HG2 ILE 2 HG23 ILE 2 -4.030 3.363 -3.817
14 1HD1 ILE 2 HD11 ILE 2 -4.340 0.676 -1.876
15 2HD1 ILE 2 HD12 ILE 2 -2.659 0.367 -2.311
16 3HD1 ILE 2 HD13 ILE 2 -3.693 1.298 -3.395
17 H VAL 3 H VAL 3 -4.791 6.351 -2.940
18 HA VAL 3 HA VAL 3 -2.427 6.480 -4.740
19 HB VAL 3 HB VAL 3 -5.033 7.789 -5.413
20 1HG1 VAL 3 HG11 VAL 3 -4.015 6.152 -7.477
21 2HG1 VAL 3 HG12 VAL 3 -2.614 6.918 -6.726
22 3HG1 VAL 3 HG13 VAL 3 -3.924 7.910 -7.368
23 1HG2 VAL 3 HG21 VAL 3 -4.642 4.908 -4.860
24 2HG2 VAL 3 HG22 VAL 3 -5.407 5.274 -6.406
25 3HG2 VAL 3 HG23 VAL 3 -6.131 5.853 -4.905
26 H GLU 4 H GLU 4 -4.105 8.255 -2.373
27 HA GLU 4 HA GLU 4 -3.129 10.873 -3.334
28 1HB GLU 4 HB2 GLU 4 -5.356 10.756 -2.286
29 2HB GLU 4 HB1 GLU 4 -4.637 10.104 -0.812
30 1HG GLU 4 HG2 GLU 4 -4.953 12.464 -0.459
31 2HG GLU 4 HG1 GLU 4 -3.225 12.203 -0.691
32 H GLN 5 H GLN 5 -2.155 8.300 -1.282
33 HA GLN 5 HA GLN 5 -0.133 10.039 0.058
34 1HB GLN 5 HB2 GLN 5 -1.746 7.881 0.982
35 2HB GLN 5 HB1 GLN 5 -0.073 7.321 0.990
36 1HG GLN 5 HG2 GLN 5 -0.920 9.979 2.161
37 2HG GLN 5 HG1 GLN 5 -0.832 8.496 3.113
38 1HE2 GLN 5 HE21 GLN 5 0.874 10.509 3.908
39 2HE2 GLN 5 HE22 GLN 5 2.473 10.159 3.454
40 H CYS 6 H CYS 6 -0.517 7.904 -2.518
41 HA CYS 6 HA CYS 6 2.339 7.039 -2.451
42 1HB CYS 6 HB2 CYS 6 -0.087 6.092 -3.944
43 2HB CYS 6 HB1 CYS 6 1.536 5.557 -4.360
44 H CYS 7 H CYS 7 -0.122 8.339 -4.678
45 HA CYS 7 HA CYS 7 1.784 8.986 -6.748
46 1HB CYS 7 HB2 CYS 7 -0.898 8.743 -6.726
47 2HB CYS 7 HB1 CYS 7 -0.787 10.492 -6.534
48 H THR 8 H THR 8 0.433 10.675 -3.972
49 HA THR 8 HA THR 8 1.904 13.151 -4.720
50 HB THR 8 HB THR 8 -0.233 12.558 -2.657
51 HG1 THR 8 HG1 THR 8 -1.426 13.878 -3.926
52 1HG2 THR 8 HG21 THR 8 1.189 15.194 -3.101
53 2HG2 THR 8 HG22 THR 8 1.556 14.098 -1.769
54 3HG2 THR 8 HG23 THR 8 -0.040 14.839 -1.889
55 H SER 9 H SER 9 1.638 10.698 -2.171
56 HA SER 9 HA SER 9 4.230 11.718 -1.079
57 1HB SER 9 HB2 SER 9 1.866 10.489 0.355
58 2HB SER 9 HB1 SER 9 3.456 10.641 1.096
59 HG SER 9 HG SER 9 3.096 12.691 1.365
60 H ILE 10 H ILE 10 5.024 9.641 0.457
61 HA ILE 10 HA ILE 10 5.350 7.468 -1.550
62 HB ILE 10 HB ILE 10 6.915 7.994 0.992
63 1HG1 ILE 10 HG12 ILE 10 7.122 9.803 -0.731
64 2HG1 ILE 10 HG11 ILE 10 8.632 8.931 -0.467
65 1HG2 ILE 10 HG21 ILE 10 8.165 6.162 0.470
66 2HG2 ILE 10 HG22 ILE 10 8.040 6.449 -1.264
67 3HG2 ILE 10 HG23 ILE 10 6.716 5.667 -0.404
68 1HD1 ILE 10 HD11 ILE 10 8.672 8.179 -2.595
69 2HD1 ILE 10 HD12 ILE 10 7.379 9.330 -2.927
70 3HD1 ILE 10 HD13 ILE 10 6.989 7.660 -2.515
71 H CYS 11 H CYS 11 4.879 5.306 -1.031
72 HA CYS 11 HA CYS 11 3.264 4.931 1.455
73 1HB CYS 11 HB2 CYS 11 3.091 2.641 -0.207
74 2HB CYS 11 HB1 CYS 11 1.807 3.763 0.204
75 H SER 12 H SER 12 4.670 4.232 3.015
76 HA SER 12 HA SER 12 6.994 2.625 2.457
77 1HB SER 12 HB2 SER 12 6.334 2.089 5.090
78 2HB SER 12 HB1 SER 12 7.322 3.443 4.553
79 HG SER 12 HG SER 12 5.294 3.808 5.889
80 H LEU 13 H LEU 13 7.045 0.438 2.097
81 HA LEU 13 HA LEU 13 4.910 -1.136 1.465
82 1HB LEU 13 HB2 LEU 13 6.488 -2.957 2.958
83 2HB LEU 13 HB1 LEU 13 6.448 -2.747 1.218
84 HG LEU 13 HG LEU 13 8.729 -2.569 2.218
85 1HD1 LEU 13 HD11 LEU 13 9.052 -1.417 0.326
86 2HD1 LEU 13 HD12 LEU 13 8.734 0.063 1.231
87 3HD1 LEU 13 HD13 LEU 13 7.417 -0.758 0.394
88 1HD2 LEU 13 HD21 LEU 13 8.485 0.131 3.185
89 2HD2 LEU 13 HD22 LEU 13 9.076 -1.295 4.033
90 3HD2 LEU 13 HD23 LEU 13 7.359 -0.911 4.051
91 H TYR 14 H TYR 14 5.831 -0.222 4.711
92 HA TYR 14 HA TYR 14 4.231 -2.124 6.107
93 1HB TYR 14 HB2 TYR 14 5.962 -0.593 7.149
94 2HB TYR 14 HB1 TYR 14 4.786 0.713 6.987
95 HD1 TYR 14 HD1 TYR 14 4.706 -2.883 8.080
96 HD2 TYR 14 HD2 TYR 14 3.617 1.185 8.937
97 HE1 TYR 14 HE1 TYR 14 3.586 -3.621 10.166
98 HE2 TYR 14 HE2 TYR 14 2.497 0.447 11.023
99 HH TYR 14 HH TYR 14 1.750 -2.767 11.666
100 H GLN 15 H GLN 15 3.538 1.047 4.775
101 HA GLN 15 HA GLN 15 0.797 1.066 5.703
102 1HB GLN 15 HB2 GLN 15 2.103 2.641 3.459
103 2HB GLN 15 HB1 GLN 15 0.523 2.981 4.168
104 1HG GLN 15 HG2 GLN 15 1.518 3.454 6.319
105 2HG GLN 15 HG1 GLN 15 3.103 2.926 5.753
106 1HE2 GLN 15 HE21 GLN 15 2.496 5.618 6.772
107 2HE2 GLN 15 HE22 GLN 15 2.776 6.700 5.495
108 H LEU 16 H LEU 16 2.468 -0.069 2.754
109 HA LEU 16 HA LEU 16 -0.099 -0.754 1.537
110 1HB LEU 16 HB2 LEU 16 2.285 -0.152 0.416
111 2HB LEU 16 HB1 LEU 16 2.351 -1.902 0.398
112 HG LEU 16 HG LEU 16 0.292 -2.045 -0.791
113 1HD1 LEU 16 HD11 LEU 16 -1.262 -0.465 -0.436
114 2HD1 LEU 16 HD12 LEU 16 -0.367 0.544 -1.574
115 3HD1 LEU 16 HD13 LEU 16 -0.053 0.674 0.156
116 1HD2 LEU 16 HD21 LEU 16 1.571 -1.772 -2.622
117 2HD2 LEU 16 HD22 LEU 16 2.582 -0.597 -1.779
118 3HD2 LEU 16 HD23 LEU 16 1.120 -0.067 -2.611
119 H GLU 17 H GLU 17 1.808 -1.988 3.923
120 HA GLU 17 HA GLU 17 1.465 -4.832 3.329
121 1HB GLU 17 HB2 GLU 17 3.089 -3.354 5.057
122 2HB GLU 17 HB1 GLU 17 1.934 -4.149 6.125
123 1HG GLU 17 HG2 GLU 17 2.659 -6.269 5.561
124 2HG GLU 17 HG1 GLU 17 3.171 -5.776 3.947
125 H ASN 18 H ASN 18 -0.681 -2.488 3.927
126 HA ASN 18 HA ASN 18 -2.380 -4.248 5.657
127 1HB ASN 18 HB2 ASN 18 -1.623 -1.658 6.191
128 2HB ASN 18 HB1 ASN 18 -3.183 -1.426 5.401
129 1HD2 ASN 18 HD21 ASN 18 -1.709 -2.218 8.385
130 2HD2 ASN 18 HD22 ASN 18 -3.091 -2.798 9.182
131 H TYR 19 H TYR 19 -1.910 -3.680 2.558
132 HA TYR 19 HA TYR 19 -4.809 -3.369 1.898
133 1HB TYR 19 HB2 TYR 19 -2.312 -2.756 0.312
134 2HB TYR 19 HB1 TYR 19 -3.907 -2.856 -0.435
135 HD1 TYR 19 HD1 TYR 19 -1.973 -1.128 2.249
136 HD2 TYR 19 HD2 TYR 19 -5.448 -1.066 -0.279
137 HE1 TYR 19 HE1 TYR 19 -2.480 1.183 3.001
138 HE2 TYR 19 HE2 TYR 19 -5.956 1.244 0.472
139 HH TYR 19 HH TYR 19 -5.341 2.620 2.720
140 H CYS 20 H CYS 20 -3.368 -5.849 2.748
141 HA CYS 20 HA CYS 20 -3.594 -7.429 0.236
142 1HB CYS 20 HB2 CYS 20 -2.352 -8.214 2.885
143 2HB CYS 20 HB1 CYS 20 -2.325 -9.167 1.405
144 H ASN 21 H ASN 21 -4.960 -9.268 0.189
145 HA ASN 21 HA ASN 21 -7.297 -9.096 1.899
146 1HB ASN 21 HB2 ASN 21 -6.543 -10.450 -0.532
147 2HB ASN 21 HB1 ASN 21 -7.275 -11.602 0.584
148 1HD2 ASN 21 HD21 ASN 21 -8.212 -9.796 -1.924
149 2HD2 ASN 21 HD22 ASN 21 -9.754 -9.299 -1.418
150 1H PHE 1 HT1 PHE 1 9.024 4.528 4.253
151 2H PHE 1 HT2 PHE 1 9.288 4.211 5.902
152 3H PHE 1 HT3 PHE 1 9.068 2.926 4.812
153 HA PHE 1 HA PHE 1 11.409 4.675 5.169
154 1HB PHE 1 HB2 PHE 1 11.546 2.607 6.348
155 2HB PHE 1 HB1 PHE 1 10.859 1.705 4.998
156 HD1 PHE 1 HD1 PHE 1 13.696 4.120 5.520
157 HD2 PHE 1 HD2 PHE 1 12.372 0.402 3.821
158 HE1 PHE 1 HE1 PHE 1 15.975 3.720 4.623
159 HE2 PHE 1 HE2 PHE 1 14.649 0.001 2.924
160 HZ PHE 1 HZ PHE 1 16.451 1.659 3.324
161 H VAL 2 H VAL 2 10.526 2.031 2.926
162 HA VAL 2 HA VAL 2 12.202 2.854 0.819
163 HB VAL 2 HB VAL 2 9.492 1.560 0.438
164 1HG1 VAL 2 HG11 VAL 2 10.745 0.418 -1.423
165 2HG1 VAL 2 HG12 VAL 2 12.111 1.482 -1.086
166 3HG1 VAL 2 HG13 VAL 2 10.580 2.160 -1.640
167 1HG2 VAL 2 HG21 VAL 2 12.122 0.427 1.411
168 2HG2 VAL 2 HG22 VAL 2 10.897 -0.587 0.648
169 3HG2 VAL 2 HG23 VAL 2 10.529 0.264 2.148
170 H ASN 3 H ASN 3 12.141 4.634 -0.467
171 HA ASN 3 HA ASN 3 9.822 6.430 -0.343
172 1HB ASN 3 HB2 ASN 3 11.244 7.843 -1.890
173 2HB ASN 3 HB1 ASN 3 11.993 7.474 -0.336
174 1HD2 ASN 3 HD21 ASN 3 14.187 7.520 -1.083
175 2HD2 ASN 3 HD22 ASN 3 14.801 6.385 -2.187
176 H GLN 4 H GLN 4 8.684 4.336 -1.402
177 HA GLN 4 HA GLN 4 8.928 4.493 -4.362
178 1HB GLN 4 HB2 GLN 4 8.907 2.274 -2.971
179 2HB GLN 4 HB1 GLN 4 7.163 2.536 -2.920
180 1HG GLN 4 HG2 GLN 4 7.057 1.586 -4.963
181 2HG GLN 4 HG1 GLN 4 7.866 3.025 -5.583
182 1HE2 GLN 4 HE21 GLN 4 10.029 2.802 -6.303
183 2HE2 GLN 4 HE22 GLN 4 10.913 1.357 -6.195
184 H HIS 5 H HIS 5 7.623 6.016 -5.230
185 HA HIS 5 HA HIS 5 4.906 6.418 -4.052
186 1HB HIS 5 HB2 HIS 5 4.912 8.559 -5.268
187 2HB HIS 5 HB1 HIS 5 6.341 8.435 -4.244
188 HD2 HIS 5 HD2 HIS 5 5.723 9.591 -7.679
189 HE1 HIS 5 HE1 HIS 5 9.413 7.547 -7.979
190 HE2 HIS 5 HE2 HIS 5 7.830 9.169 -9.149
191 H LEU 6 H LEU 6 3.124 5.784 -5.292
192 HA LEU 6 HA LEU 6 3.391 5.518 -8.167
193 1HB LEU 6 HB2 LEU 6 2.431 2.988 -7.550
194 2HB LEU 6 HB1 LEU 6 3.973 3.404 -8.292
195 HG LEU 6 HG LEU 6 4.958 3.668 -6.061
196 1HD1 LEU 6 HD11 LEU 6 2.795 2.319 -4.676
197 2HD1 LEU 6 HD12 LEU 6 2.276 3.863 -5.354
198 3HD1 LEU 6 HD13 LEU 6 3.646 3.803 -4.244
199 1HD2 LEU 6 HD21 LEU 6 3.516 1.031 -6.344
200 2HD2 LEU 6 HD22 LEU 6 5.082 1.319 -5.585
201 3HD2 LEU 6 HD23 LEU 6 4.902 1.486 -7.331
202 H CYS 7 H CYS 7 1.406 5.268 -9.284
203 HA CYS 7 HA CYS 7 -1.035 5.289 -7.564
204 1HB CYS 7 HB2 CYS 7 -1.549 6.914 -9.850
205 2HB CYS 7 HB1 CYS 7 -1.527 7.403 -8.161
206 H GLY 8 H GLY 8 -3.047 5.161 -9.273
207 1HA GLY 8 HA2 GLY 8 -4.169 3.490 -10.538
208 2HA GLY 8 HA1 GLY 8 -3.011 4.010 -11.761
209 H SER 9 H SER 9 -2.494 2.011 -12.698
210 HA SER 9 HA SER 9 -2.254 -0.496 -11.495
211 1HB SER 9 HB2 SER 9 -0.085 -0.508 -13.196
212 2HB SER 9 HB1 SER 9 -1.748 -0.801 -13.695
213 HG SER 9 HG SER 9 -1.919 1.275 -14.355
214 H ASP 10 H ASP 10 0.174 2.098 -11.622
215 HA ASP 10 HA ASP 10 2.359 0.922 -10.376
216 1HB ASP 10 HB2 ASP 10 1.447 3.542 -10.880
217 2HB ASP 10 HB1 ASP 10 1.851 3.490 -9.170
218 H LEU 11 H LEU 11 -0.779 1.637 -9.003
219 HA LEU 11 HA LEU 11 0.028 1.118 -6.232
220 1HB LEU 11 HB2 LEU 11 -2.446 1.809 -7.653
221 2HB LEU 11 HB1 LEU 11 -2.714 0.508 -6.509
222 HG LEU 11 HG LEU 11 -3.059 2.207 -5.053
223 1HD1 LEU 11 HD11 LEU 11 -1.151 2.826 -3.762
224 2HD1 LEU 11 HD12 LEU 11 -0.068 2.646 -5.142
225 3HD1 LEU 11 HD13 LEU 11 -0.799 1.221 -4.404
226 1HD2 LEU 11 HD21 LEU 11 -1.504 4.415 -5.744
227 2HD2 LEU 11 HD22 LEU 11 -3.207 4.167 -6.134
228 3HD2 LEU 11 HD23 LEU 11 -1.961 3.696 -7.289
229 1HN ABA 12 H ABA 12 -1.890 -0.522 -8.684
230 HA ABA 12 HA ABA 12 -2.244 -3.035 -7.502
231 1HB ABA 12 HB1 ABA 12 -1.535 -2.901 -10.421
232 2HB ABA 12 HB2 ABA 12 -2.955 -2.019 -9.875
233 1HG ABA 12 HG1 ABA 12 -4.149 -3.893 -9.512
234 2HG ABA 12 HG2 ABA 12 -2.769 -4.763 -8.844
235 3HG ABA 12 HG3 ABA 12 -2.973 -4.640 -10.592
236 H GLU 13 H GLU 13 0.664 -1.572 -8.722
237 HA GLU 13 HA GLU 13 2.134 -4.088 -9.001
238 1HB GLU 13 HB2 GLU 13 2.630 -1.298 -9.599
239 2HB GLU 13 HB1 GLU 13 3.983 -2.000 -8.719
240 1HG GLU 13 HG2 GLU 13 4.342 -3.665 -10.347
241 2HG GLU 13 HG1 GLU 13 2.737 -3.450 -11.047
242 H ALA 14 H ALA 14 2.692 -1.267 -6.835
243 HA ALA 14 HA ALA 14 4.413 -2.502 -5.015
244 1HB ALA 14 HB1 ALA 14 2.113 -0.645 -4.301
245 2HB ALA 14 HB2 ALA 14 3.695 -0.111 -4.872
246 3HB ALA 14 HB3 ALA 14 3.551 -0.940 -3.322
247 H LEU 15 H LEU 15 0.905 -2.546 -5.153
248 HA LEU 15 HA LEU 15 0.366 -4.281 -2.956
249 1HB LEU 15 HB2 LEU 15 -1.018 -3.872 -5.621
250 2HB LEU 15 HB1 LEU 15 -1.692 -4.894 -4.360
251 HG LEU 15 HG LEU 15 -1.440 -1.916 -4.497
252 1HD1 LEU 15 HD11 LEU 15 -3.502 -3.571 -3.080
253 2HD1 LEU 15 HD12 LEU 15 -3.504 -3.438 -4.839
254 3HD1 LEU 15 HD13 LEU 15 -3.678 -1.992 -3.846
255 1HD2 LEU 15 HD21 LEU 15 -0.132 -2.538 -2.470
256 2HD2 LEU 15 HD22 LEU 15 -1.530 -3.431 -1.870
257 3HD2 LEU 15 HD23 LEU 15 -1.622 -1.681 -2.076
258 H TYR 16 H TYR 16 1.015 -4.911 -6.397
259 HA TYR 16 HA TYR 16 0.830 -7.787 -6.199
260 1HB TYR 16 HB2 TYR 16 1.477 -5.789 -8.223
261 2HB TYR 16 HB1 TYR 16 2.500 -7.216 -8.354
262 HD1 TYR 16 HD1 TYR 16 -0.387 -5.855 -9.592
263 HD2 TYR 16 HD2 TYR 16 0.996 -9.497 -7.778
264 HE1 TYR 16 HE1 TYR 16 -2.259 -7.088 -10.651
265 HE2 TYR 16 HE2 TYR 16 -0.879 -10.732 -8.839
266 HH TYR 16 HH TYR 16 -3.327 -9.033 -10.798
267 H LEU 17 H LEU 17 3.481 -5.465 -5.851
268 HA LEU 17 HA LEU 17 5.460 -7.657 -5.664
269 1HB LEU 17 HB2 LEU 17 5.571 -4.664 -5.687
270 2HB LEU 17 HB1 LEU 17 6.938 -5.576 -5.050
271 HG LEU 17 HG LEU 17 7.371 -5.226 -7.381
272 1HD1 LEU 17 HD11 LEU 17 6.224 -8.000 -7.401
273 2HD1 LEU 17 HD12 LEU 17 7.583 -7.613 -6.346
274 3HD1 LEU 17 HD13 LEU 17 7.741 -7.422 -8.092
275 1HD2 LEU 17 HD21 LEU 17 5.697 -6.016 -9.101
276 2HD2 LEU 17 HD22 LEU 17 5.169 -4.623 -8.157
277 3HD2 LEU 17 HD23 LEU 17 4.545 -6.230 -7.783
278 H VAL 18 H VAL 18 3.418 -5.837 -3.629
279 HA VAL 18 HA VAL 18 5.112 -6.040 -1.264
280 HB VAL 18 HB VAL 18 2.352 -5.042 -1.894
281 1HG1 VAL 18 HG11 VAL 18 3.546 -5.568 0.834
282 2HG1 VAL 18 HG12 VAL 18 2.009 -6.160 0.201
283 3HG1 VAL 18 HG13 VAL 18 2.212 -4.445 0.566
284 1HG2 VAL 18 HG21 VAL 18 4.712 -3.809 -2.015
285 2HG2 VAL 18 HG22 VAL 18 4.423 -3.601 -0.288
286 3HG2 VAL 18 HG23 VAL 18 3.269 -2.962 -1.459
287 H CYS 19 H CYS 19 2.034 -7.585 -2.317
288 HA CYS 19 HA CYS 19 2.598 -9.705 -0.281
289 1HB CYS 19 HB2 CYS 19 0.081 -8.389 -1.203
290 2HB CYS 19 HB1 CYS 19 0.001 -10.093 -0.758
291 H GLY 20 H GLY 20 0.368 -9.672 -3.042
292 1HA GLY 20 HA2 GLY 20 0.827 -10.833 -5.153
293 2HA GLY 20 HA1 GLY 20 1.995 -11.836 -4.294
294 H GLU 21 H GLU 21 1.275 -13.707 -3.276
295 HA GLU 21 HA GLU 21 -1.258 -14.782 -4.123
296 1HB GLU 21 HB2 GLU 21 -0.670 -16.668 -2.563
297 2HB GLU 21 HB1 GLU 21 0.593 -16.285 -3.734
298 1HG GLU 21 HG2 GLU 21 1.920 -15.182 -2.117
299 2HG GLU 21 HG1 GLU 21 0.570 -15.030 -0.991
300 H ARG 22 H ARG 22 -0.338 -12.891 -1.361
301 HA ARG 22 HA ARG 22 -2.343 -13.794 0.471
302 1HB ARG 22 HB2 ARG 22 -0.489 -11.551 0.276
303 2HB ARG 22 HB1 ARG 22 -2.031 -11.076 0.989
304 1HG ARG 22 HG2 ARG 22 -1.299 -13.606 2.093
305 2HG ARG 22 HG1 ARG 22 0.102 -12.540 2.209
306 1HD ARG 22 HD2 ARG 22 -1.074 -12.032 4.174
307 2HD ARG 22 HD1 ARG 22 -1.625 -10.775 3.065
308 HE ARG 22 HE ARG 22 -3.612 -12.400 2.645
309 1HH1 ARG 22 HH21 ARG 22 -2.630 -14.404 4.674
310 2HH1 ARG 22 HH22 ARG 22 -3.553 -13.967 6.073
311 1HH2 ARG 22 HH11 ARG 22 -4.459 -10.859 4.834
312 2HH2 ARG 22 HH12 ARG 22 -4.588 -11.959 6.164
313 H GLY 23 H GLY 23 -2.414 -11.503 -2.181
314 1HA GLY 23 HA2 GLY 23 -4.508 -11.153 -3.406
315 2HA GLY 23 HA1 GLY 23 -5.379 -11.415 -1.902
316 H PHE 24 H PHE 24 -5.258 -9.001 -3.833
317 HA PHE 24 HA PHE 24 -5.053 -7.028 -1.634
318 1HB PHE 24 HB2 PHE 24 -3.655 -5.486 -2.886
319 2HB PHE 24 HB1 PHE 24 -2.803 -7.011 -2.715
320 HD1 PHE 24 HD1 PHE 24 -4.668 -4.837 -5.071
321 HD2 PHE 24 HD2 PHE 24 -2.337 -8.427 -4.649
322 HE1 PHE 24 HE1 PHE 24 -4.470 -5.003 -7.526
323 HE2 PHE 24 HE2 PHE 24 -2.144 -8.589 -7.108
324 HZ PHE 24 HZ PHE 24 -3.207 -6.868 -8.550
325 H PHE 25 H PHE 25 -6.831 -5.731 -1.757
326 HA PHE 25 HA PHE 25 -8.340 -5.708 -4.323
327 1HB PHE 25 HB2 PHE 25 -10.205 -4.804 -2.914
328 2HB PHE 25 HB1 PHE 25 -9.641 -6.391 -2.391
329 HD1 PHE 25 HD1 PHE 25 -9.616 -2.772 -1.636
330 HD2 PHE 25 HD2 PHE 25 -8.457 -6.689 -0.298
331 HE1 PHE 25 HE1 PHE 25 -9.112 -1.854 0.613
332 HE2 PHE 25 HE2 PHE 25 -7.954 -5.771 1.952
333 HZ PHE 25 HZ PHE 25 -8.281 -3.353 2.407
334 H TYR 26 H TYR 26 -8.294 -3.920 -5.574
335 HA TYR 26 HA TYR 26 -7.271 -1.383 -4.378
336 1HB TYR 26 HB2 TYR 26 -5.877 -2.023 -6.202
337 2HB TYR 26 HB1 TYR 26 -7.259 -2.485 -7.195
338 HD1 TYR 26 HD1 TYR 26 -6.796 0.578 -5.112
339 HD2 TYR 26 HD2 TYR 26 -7.125 -1.056 -9.072
340 HE1 TYR 26 HE1 TYR 26 -6.894 2.873 -6.052
341 HE2 TYR 26 HE2 TYR 26 -7.224 1.238 -10.013
342 HH TYR 26 HH TYR 26 -6.220 3.760 -8.803
343 H THR 27 H THR 27 -9.191 -0.442 -3.616
344 HA THR 27 HA THR 27 -11.684 -0.513 -5.042
345 HB THR 27 HB THR 27 -11.720 -0.041 -2.681
346 HG1 THR 27 HG1 THR 27 -12.246 2.400 -4.013
347 1HG2 THR 27 HG21 THR 27 -9.428 1.527 -3.308
348 2HG2 THR 27 HG22 THR 27 -10.087 1.160 -1.714
349 3HG2 THR 27 HG23 THR 27 -10.621 2.602 -2.577
350 H LYS 28 H LYS 28 -12.733 1.295 -6.133
351 HA LYS 28 HA LYS 28 -12.779 3.033 -7.702
352 1HB LYS 28 HB2 LYS 28 -10.516 3.801 -5.896
353 2HB LYS 28 HB1 LYS 28 -10.759 4.706 -7.390
354 1HG LYS 28 HG2 LYS 28 -13.152 5.051 -6.730
355 2HG LYS 28 HG1 LYS 28 -12.791 4.284 -5.182
356 1HD LYS 28 HD2 LYS 28 -10.821 6.074 -5.157
357 2HD LYS 28 HD1 LYS 28 -11.920 6.944 -6.227
358 1HE LYS 28 HE2 LYS 28 -12.494 5.963 -3.420
359 2HE LYS 28 HE1 LYS 28 -12.432 7.635 -3.977
360 1HZ LYS 28 HZ1 LYS 28 -14.575 5.743 -4.135
361 2HZ LYS 28 HZ2 LYS 28 -14.238 6.462 -5.638
362 3HZ LYS 28 HZ3 LYS 28 -14.611 7.430 -4.294
363 HA PRO 29 HA PRO 29 -10.011 1.073 -10.641
364 1HB PRO 29 HB2 PRO 29 -11.441 1.866 -12.851
365 2HB PRO 29 HB1 PRO 29 -11.872 0.464 -11.857
366 1HG PRO 29 HG2 PRO 29 -13.164 3.149 -11.976
367 2HG PRO 29 HG1 PRO 29 -13.867 1.585 -11.534
368 1HD PRO 29 HD2 PRO 29 -13.077 3.610 -9.728
369 2HD PRO 29 HD1 PRO 29 -13.454 1.926 -9.306
370 H THR 30 H THR 30 -11.402 3.954 -12.199
371 HA THR 30 HA THR 30 -8.824 5.388 -11.945
372 HB THR 30 HB THR 30 -8.414 4.195 -13.976
373 HG1 THR 30 HG1 THR 30 -7.852 6.225 -14.399
374 1HG2 THR 30 HG21 THR 30 -11.124 3.921 -14.125
375 2HG2 THR 30 HG22 THR 30 -10.021 3.540 -15.446
376 3HG2 THR 30 HG23 THR 30 -10.836 5.104 -15.400
Start of MODEL 2
1 1H GLY 1 HT1 GLY 1 -8.261 6.898 0.470
2 2H GLY 1 HT2 GLY 1 -7.838 6.231 1.974
3 3H GLY 1 HT3 GLY 1 -7.466 5.399 0.541
4 1HA GLY 1 HA1 GLY 1 -6.097 7.546 0.085
5 2HA GLY 1 HA2 GLY 1 -6.130 7.732 1.865
6 H ILE 2 H ILE 2 -5.978 5.595 -1.135
7 HA ILE 2 HA ILE 2 -3.181 4.810 -0.439
8 HB ILE 2 HB ILE 2 -5.112 3.074 -0.866
9 1HG1 ILE 2 HG12 ILE 2 -2.270 3.055 -1.848
10 2HG1 ILE 2 HG11 ILE 2 -2.982 2.196 -0.485
11 1HG2 ILE 2 HG21 ILE 2 -5.573 4.275 -3.143
12 2HG2 ILE 2 HG22 ILE 2 -5.584 2.512 -3.102
13 3HG2 ILE 2 HG23 ILE 2 -4.172 3.370 -3.716
14 1HD1 ILE 2 HD11 ILE 2 -4.194 0.713 -2.038
15 2HD1 ILE 2 HD12 ILE 2 -2.458 0.648 -2.340
16 3HD1 ILE 2 HD13 ILE 2 -3.504 1.581 -3.410
17 H VAL 3 H VAL 3 -5.172 6.326 -2.883
18 HA VAL 3 HA VAL 3 -2.861 6.545 -4.728
19 HB VAL 3 HB VAL 3 -5.449 7.879 -5.342
20 1HG1 VAL 3 HG11 VAL 3 -4.158 7.964 -7.210
21 2HG1 VAL 3 HG12 VAL 3 -4.739 6.317 -7.457
22 3HG1 VAL 3 HG13 VAL 3 -3.167 6.596 -6.705
23 1HG2 VAL 3 HG21 VAL 3 -6.313 5.613 -6.154
24 2HG2 VAL 3 HG22 VAL 3 -6.358 5.869 -4.410
25 3HG2 VAL 3 HG23 VAL 3 -5.083 4.881 -5.123
26 H GLU 4 H GLU 4 -4.236 8.227 -2.191
27 HA GLU 4 HA GLU 4 -3.352 10.870 -3.230
28 1HB GLU 4 HB2 GLU 4 -5.540 10.969 -2.251
29 2HB GLU 4 HB1 GLU 4 -5.020 10.050 -0.839
30 1HG GLU 4 HG2 GLU 4 -3.490 11.898 -0.216
31 2HG GLU 4 HG1 GLU 4 -4.064 12.824 -1.603
32 H GLN 5 H GLN 5 -2.380 8.308 -1.146
33 HA GLN 5 HA GLN 5 -0.433 10.102 0.231
34 1HB GLN 5 HB2 GLN 5 -1.896 7.681 0.998
35 2HB GLN 5 HB1 GLN 5 -0.180 7.612 1.399
36 1HG GLN 5 HG2 GLN 5 -0.516 10.001 2.345
37 2HG GLN 5 HG1 GLN 5 -2.238 9.622 2.298
38 1HE2 GLN 5 HE21 GLN 5 0.840 8.741 3.829
39 2HE2 GLN 5 HE22 GLN 5 0.153 7.813 5.074
40 H CYS 6 H CYS 6 -0.658 7.527 -2.097
41 HA CYS 6 HA CYS 6 2.251 6.975 -1.889
42 1HB CYS 6 HB2 CYS 6 0.008 5.741 -3.473
43 2HB CYS 6 HB1 CYS 6 1.690 5.347 -3.796
44 H CYS 7 H CYS 7 -0.124 8.277 -4.213
45 HA CYS 7 HA CYS 7 1.917 8.860 -6.205
46 1HB CYS 7 HB2 CYS 7 -0.682 10.360 -6.091
47 2HB CYS 7 HB1 CYS 7 0.200 9.767 -7.494
48 H THR 8 H THR 8 -0.223 11.120 -4.446
49 HA THR 8 HA THR 8 1.392 13.419 -4.749
50 HB THR 8 HB THR 8 -0.518 12.614 -2.532
51 HG1 THR 8 HG1 THR 8 -1.577 12.944 -4.419
52 1HG2 THR 8 HG21 THR 8 0.433 14.304 -1.364
53 2HG2 THR 8 HG22 THR 8 -0.392 15.361 -2.511
54 3HG2 THR 8 HG23 THR 8 1.293 14.916 -2.777
55 H SER 9 H SER 9 1.079 11.505 -1.749
56 HA SER 9 HA SER 9 3.844 12.322 -1.029
57 1HB SER 9 HB2 SER 9 1.904 10.788 0.710
58 2HB SER 9 HB1 SER 9 3.302 11.731 1.215
59 HG SER 9 HG SER 9 0.810 12.538 0.967
60 H ILE 10 H ILE 10 5.016 10.403 0.216
61 HA ILE 10 HA ILE 10 4.913 8.090 -1.650
62 HB ILE 10 HB ILE 10 7.050 8.820 0.355
63 1HG1 ILE 10 HG12 ILE 10 6.406 9.769 -2.393
64 2HG1 ILE 10 HG11 ILE 10 7.282 10.587 -1.103
65 1HG2 ILE 10 HG21 ILE 10 8.390 7.291 -1.114
66 2HG2 ILE 10 HG22 ILE 10 6.911 6.889 -1.978
67 3HG2 ILE 10 HG23 ILE 10 7.076 6.471 -0.273
68 1HD1 ILE 10 HD11 ILE 10 8.786 10.073 -2.976
69 2HD1 ILE 10 HD12 ILE 10 8.369 8.364 -2.854
70 3HD1 ILE 10 HD13 ILE 10 9.249 9.153 -1.545
71 H CYS 11 H CYS 11 4.900 5.918 -0.809
72 HA CYS 11 HA CYS 11 4.023 5.741 2.048
73 1HB CYS 11 HB2 CYS 11 2.852 3.565 1.112
74 2HB CYS 11 HB1 CYS 11 2.067 5.134 0.947
75 H SER 12 H SER 12 4.691 3.809 3.173
76 HA SER 12 HA SER 12 7.202 2.680 2.044
77 1HB SER 12 HB2 SER 12 6.569 1.897 4.776
78 2HB SER 12 HB1 SER 12 7.992 2.727 4.157
79 HG SER 12 HG SER 12 5.674 3.729 5.278
80 H LEU 13 H LEU 13 7.426 0.519 1.681
81 HA LEU 13 HA LEU 13 5.574 -1.213 0.817
82 1HB LEU 13 HB2 LEU 13 7.106 -2.796 2.694
83 2HB LEU 13 HB1 LEU 13 7.131 -2.828 0.942
84 HG LEU 13 HG LEU 13 9.346 -2.324 1.874
85 1HD1 LEU 13 HD11 LEU 13 9.595 -1.198 -0.043
86 2HD1 LEU 13 HD12 LEU 13 9.099 0.270 0.795
87 3HD1 LEU 13 HD13 LEU 13 7.897 -0.724 -0.028
88 1HD2 LEU 13 HD21 LEU 13 9.008 0.353 2.745
89 2HD2 LEU 13 HD22 LEU 13 9.496 -1.040 3.710
90 3HD2 LEU 13 HD23 LEU 13 7.793 -0.611 3.580
91 H TYR 14 H TYR 14 6.118 -0.621 4.278
92 HA TYR 14 HA TYR 14 4.265 -2.553 5.238
93 1HB TYR 14 HB2 TYR 14 5.984 -1.137 6.568
94 2HB TYR 14 HB1 TYR 14 4.720 0.091 6.601
95 HD1 TYR 14 HD1 TYR 14 4.694 -3.652 6.890
96 HD2 TYR 14 HD2 TYR 14 3.648 0.115 8.675
97 HE1 TYR 14 HE1 TYR 14 3.581 -4.848 8.756
98 HE2 TYR 14 HE2 TYR 14 2.534 -1.081 10.542
99 HH TYR 14 HH TYR 14 1.568 -4.119 10.462
100 H GLN 15 H GLN 15 3.781 0.952 4.979
101 HA GLN 15 HA GLN 15 1.018 0.964 5.418
102 1HB GLN 15 HB2 GLN 15 2.762 2.725 3.687
103 2HB GLN 15 HB1 GLN 15 1.027 3.013 3.848
104 1HG GLN 15 HG2 GLN 15 1.245 3.222 6.266
105 2HG GLN 15 HG1 GLN 15 2.958 2.813 6.175
106 1HE2 GLN 15 HE21 GLN 15 1.002 5.435 6.561
107 2HE2 GLN 15 HE22 GLN 15 1.962 6.632 5.837
108 H LEU 16 H LEU 16 2.801 -0.125 2.584
109 HA LEU 16 HA LEU 16 0.383 -0.232 0.963
110 1HB LEU 16 HB2 LEU 16 2.963 -0.052 0.257
111 2HB LEU 16 HB1 LEU 16 2.764 -1.791 0.151
112 HG LEU 16 HG LEU 16 2.271 -0.147 -1.904
113 1HD1 LEU 16 HD11 LEU 16 2.257 -2.580 -1.943
114 2HD1 LEU 16 HD12 LEU 16 0.823 -1.976 -2.767
115 3HD1 LEU 16 HD13 LEU 16 0.700 -2.610 -1.126
116 1HD2 LEU 16 HD21 LEU 16 -0.478 -0.515 -0.691
117 2HD2 LEU 16 HD22 LEU 16 -0.060 0.361 -2.164
118 3HD2 LEU 16 HD23 LEU 16 0.416 1.003 -0.591
119 H GLU 17 H GLU 17 2.176 -2.299 3.080
120 HA GLU 17 HA GLU 17 0.891 -4.761 2.211
121 1HB GLU 17 HB2 GLU 17 3.045 -4.846 3.385
122 2HB GLU 17 HB1 GLU 17 2.331 -4.047 4.788
123 1HG GLU 17 HG2 GLU 17 0.822 -5.934 5.142
124 2HG GLU 17 HG1 GLU 17 1.423 -6.721 3.683
125 H ASN 18 H ASN 18 -0.273 -2.025 3.659
126 HA ASN 18 HA ASN 18 -2.142 -3.411 5.482
127 1HB ASN 18 HB2 ASN 18 -1.238 -0.659 5.066
128 2HB ASN 18 HB1 ASN 18 -2.991 -0.769 5.228
129 1HD2 ASN 18 HD21 ASN 18 0.052 -1.118 6.939
130 2HD2 ASN 18 HD22 ASN 18 -0.621 -1.450 8.461
131 H TYR 19 H TYR 19 -1.992 -3.541 2.368
132 HA TYR 19 HA TYR 19 -4.914 -3.106 1.950
133 1HB TYR 19 HB2 TYR 19 -2.590 -2.326 0.221
134 2HB TYR 19 HB1 TYR 19 -4.147 -2.704 -0.518
135 HD1 TYR 19 HD1 TYR 19 -2.322 -0.383 1.681
136 HD2 TYR 19 HD2 TYR 19 -6.131 -1.334 -0.066
137 HE1 TYR 19 HE1 TYR 19 -3.168 1.866 2.301
138 HE2 TYR 19 HE2 TYR 19 -6.978 0.913 0.555
139 HH TYR 19 HH TYR 19 -5.359 2.953 2.725
140 H CYS 20 H CYS 20 -3.363 -5.533 2.713
141 HA CYS 20 HA CYS 20 -3.742 -7.174 0.255
142 1HB CYS 20 HB2 CYS 20 -2.401 -8.098 2.795
143 2HB CYS 20 HB1 CYS 20 -2.238 -8.757 1.171
144 H ASN 21 H ASN 21 -5.143 -8.967 0.307
145 HA ASN 21 HA ASN 21 -7.319 -8.839 2.206
146 1HB ASN 21 HB2 ASN 21 -6.671 -10.312 -0.213
147 2HB ASN 21 HB1 ASN 21 -7.385 -11.374 1.001
148 1HD2 ASN 21 HD21 ASN 21 -8.158 -9.127 -1.431
149 2HD2 ASN 21 HD22 ASN 21 -9.760 -8.808 -0.968
150 1H PHE 1 HT1 PHE 1 15.635 -0.211 -3.469
151 2H PHE 1 HT2 PHE 1 14.811 -0.861 -2.133
152 3H PHE 1 HT3 PHE 1 15.936 0.393 -1.913
153 HA PHE 1 HA PHE 1 14.534 1.921 -3.139
154 1HB PHE 1 HB2 PHE 1 12.161 1.036 -3.607
155 2HB PHE 1 HB1 PHE 1 13.439 0.494 -4.697
156 HD1 PHE 1 HD1 PHE 1 11.163 -0.481 -1.979
157 HD2 PHE 1 HD2 PHE 1 14.326 -1.788 -4.578
158 HE1 PHE 1 HE1 PHE 1 10.691 -2.839 -1.368
159 HE2 PHE 1 HE2 PHE 1 13.854 -4.145 -3.968
160 HZ PHE 1 HZ PHE 1 12.037 -4.672 -2.363
161 H VAL 2 H VAL 2 13.972 3.233 -1.475
162 HA VAL 2 HA VAL 2 13.029 2.060 1.054
163 HB VAL 2 HB VAL 2 13.509 4.958 0.294
164 1HG1 VAL 2 HG11 VAL 2 12.044 4.152 2.374
165 2HG1 VAL 2 HG12 VAL 2 13.175 5.497 2.520
166 3HG1 VAL 2 HG13 VAL 2 13.635 3.892 3.088
167 1HG2 VAL 2 HG21 VAL 2 15.718 4.605 0.639
168 2HG2 VAL 2 HG22 VAL 2 15.364 2.879 0.554
169 3HG2 VAL 2 HG23 VAL 2 15.406 3.695 2.116
170 H ASN 3 H ASN 3 11.675 5.140 0.615
171 HA ASN 3 HA ASN 3 8.988 3.952 0.479
172 1HB ASN 3 HB2 ASN 3 9.251 6.899 0.444
173 2HB ASN 3 HB1 ASN 3 8.260 5.872 1.475
174 1HD2 ASN 3 HD21 ASN 3 11.221 7.672 1.312
175 2HD2 ASN 3 HD22 ASN 3 11.837 7.200 2.821
176 H GLN 4 H GLN 4 8.165 3.536 -1.504
177 HA GLN 4 HA GLN 4 9.041 5.231 -3.785
178 1HB GLN 4 HB2 GLN 4 9.252 2.719 -3.910
179 2HB GLN 4 HB1 GLN 4 7.490 2.633 -3.880
180 1HG GLN 4 HG2 GLN 4 8.054 2.607 -6.185
181 2HG GLN 4 HG1 GLN 4 7.545 4.266 -5.865
182 1HE2 GLN 4 HE21 GLN 4 10.498 2.229 -6.115
183 2HE2 GLN 4 HE22 GLN 4 11.520 3.502 -6.582
184 H HIS 5 H HIS 5 7.442 6.045 -5.278
185 HA HIS 5 HA HIS 5 4.774 6.510 -4.009
186 1HB HIS 5 HB2 HIS 5 4.639 8.453 -5.577
187 2HB HIS 5 HB1 HIS 5 6.022 8.564 -4.487
188 HD2 HIS 5 HD2 HIS 5 8.530 8.418 -5.722
189 HE1 HIS 5 HE1 HIS 5 7.077 7.945 -9.665
190 HE2 HIS 5 HE2 HIS 5 9.159 8.346 -8.246
191 H LEU 6 H LEU 6 2.936 5.739 -5.111
192 HA LEU 6 HA LEU 6 3.263 4.921 -7.925
193 1HB LEU 6 HB2 LEU 6 2.133 2.946 -5.986
194 2HB LEU 6 HB1 LEU 6 2.699 2.664 -7.610
195 HG LEU 6 HG LEU 6 4.991 3.450 -6.744
196 1HD1 LEU 6 HD11 LEU 6 5.088 3.963 -4.577
197 2HD1 LEU 6 HD12 LEU 6 4.438 2.377 -4.151
198 3HD1 LEU 6 HD13 LEU 6 3.346 3.724 -4.477
199 1HD2 LEU 6 HD21 LEU 6 3.606 0.839 -6.155
200 2HD2 LEU 6 HD22 LEU 6 5.278 1.084 -5.651
201 3HD2 LEU 6 HD23 LEU 6 4.847 1.181 -7.359
202 H CYS 7 H CYS 7 1.333 5.097 -9.135
203 HA CYS 7 HA CYS 7 -1.113 5.745 -7.540
204 1HB CYS 7 HB2 CYS 7 0.218 7.414 -9.317
205 2HB CYS 7 HB1 CYS 7 -1.138 6.793 -10.261
206 H GLY 8 H GLY 8 -0.792 5.196 -11.064
207 1HA GLY 8 HA2 GLY 8 -3.166 3.584 -11.152
208 2HA GLY 8 HA1 GLY 8 -1.999 3.738 -12.462
209 H SER 9 H SER 9 -1.396 1.689 -13.063
210 HA SER 9 HA SER 9 -1.581 -0.684 -11.595
211 1HB SER 9 HB2 SER 9 0.933 -0.515 -13.120
212 2HB SER 9 HB1 SER 9 -0.435 -1.602 -13.337
213 HG SER 9 HG SER 9 0.179 0.344 -14.884
214 H ASP 10 H ASP 10 0.705 1.920 -11.370
215 HA ASP 10 HA ASP 10 2.792 0.793 -9.855
216 1HB ASP 10 HB2 ASP 10 2.067 3.319 -10.690
217 2HB ASP 10 HB1 ASP 10 1.885 3.440 -8.946
218 H LEU 11 H LEU 11 -0.500 1.724 -8.884
219 HA LEU 11 HA LEU 11 -0.073 1.213 -6.043
220 1HB LEU 11 HB2 LEU 11 -2.282 1.991 -7.762
221 2HB LEU 11 HB1 LEU 11 -2.774 0.616 -6.805
222 HG LEU 11 HG LEU 11 -3.368 2.214 -5.313
223 1HD1 LEU 11 HD11 LEU 11 -1.796 2.554 -3.592
224 2HD1 LEU 11 HD12 LEU 11 -0.435 2.510 -4.712
225 3HD1 LEU 11 HD13 LEU 11 -1.321 1.031 -4.344
226 1HD2 LEU 11 HD21 LEU 11 -3.035 4.062 -6.793
227 2HD2 LEU 11 HD22 LEU 11 -1.282 3.953 -6.632
228 3HD2 LEU 11 HD23 LEU 11 -2.264 4.482 -5.265
229 1HN ABA 12 H ABA 12 -1.733 -0.460 -8.678
230 HA ABA 12 HA ABA 12 -2.259 -2.934 -7.461
231 1HB ABA 12 HB1 ABA 12 -1.325 -2.974 -10.299
232 2HB ABA 12 HB2 ABA 12 -2.717 -1.966 -9.932
233 1HG ABA 12 HG1 ABA 12 -4.004 -3.778 -10.008
234 2HG ABA 12 HG2 ABA 12 -3.158 -4.391 -8.587
235 3HG ABA 12 HG3 ABA 12 -2.592 -4.816 -10.203
236 H GLU 13 H GLU 13 0.774 -1.643 -8.636
237 HA GLU 13 HA GLU 13 2.136 -4.204 -8.726
238 1HB GLU 13 HB2 GLU 13 2.867 -1.381 -9.138
239 2HB GLU 13 HB1 GLU 13 4.128 -2.376 -8.428
240 1HG GLU 13 HG2 GLU 13 3.405 -4.081 -10.321
241 2HG GLU 13 HG1 GLU 13 2.820 -2.615 -11.109
242 H ALA 14 H ALA 14 2.503 -1.408 -6.486
243 HA ALA 14 HA ALA 14 4.201 -2.644 -4.647
244 1HB ALA 14 HB1 ALA 14 1.842 -0.904 -3.861
245 2HB ALA 14 HB2 ALA 14 3.347 -0.265 -4.520
246 3HB ALA 14 HB3 ALA 14 3.353 -1.120 -2.979
247 H LEU 15 H LEU 15 0.680 -2.803 -4.877
248 HA LEU 15 HA LEU 15 0.278 -4.641 -2.700
249 1HB LEU 15 HB2 LEU 15 -1.335 -4.483 -5.265
250 2HB LEU 15 HB1 LEU 15 -1.901 -5.116 -3.727
251 HG LEU 15 HG LEU 15 -1.346 -2.239 -4.513
252 1HD1 LEU 15 HD11 LEU 15 -3.628 -3.851 -4.382
253 2HD1 LEU 15 HD12 LEU 15 -3.570 -2.105 -4.614
254 3HD1 LEU 15 HD13 LEU 15 -3.730 -2.775 -2.990
255 1HD2 LEU 15 HD21 LEU 15 -0.918 -1.581 -2.408
256 2HD2 LEU 15 HD22 LEU 15 -0.748 -3.282 -1.969
257 3HD2 LEU 15 HD23 LEU 15 -2.307 -2.480 -1.802
258 H TYR 16 H TYR 16 1.063 -5.001 -6.114
259 HA TYR 16 HA TYR 16 0.875 -7.918 -6.100
260 1HB TYR 16 HB2 TYR 16 1.331 -5.786 -8.032
261 2HB TYR 16 HB1 TYR 16 2.415 -7.145 -8.290
262 HD1 TYR 16 HD1 TYR 16 -0.635 -5.852 -9.231
263 HD2 TYR 16 HD2 TYR 16 1.111 -9.540 -7.885
264 HE1 TYR 16 HE1 TYR 16 -2.480 -7.110 -10.305
265 HE2 TYR 16 HE2 TYR 16 -0.733 -10.801 -8.964
266 HH TYR 16 HH TYR 16 -2.469 -9.974 -11.193
267 H LEU 17 H LEU 17 3.324 -5.580 -5.291
268 HA LEU 17 HA LEU 17 5.430 -7.678 -5.562
269 1HB LEU 17 HB2 LEU 17 5.386 -4.755 -5.742
270 2HB LEU 17 HB1 LEU 17 6.708 -5.383 -4.753
271 HG LEU 17 HG LEU 17 7.290 -5.205 -7.186
272 1HD1 LEU 17 HD11 LEU 17 7.317 -8.116 -6.787
273 2HD1 LEU 17 HD12 LEU 17 7.881 -7.205 -5.386
274 3HD1 LEU 17 HD13 LEU 17 8.667 -6.993 -6.951
275 1HD2 LEU 17 HD21 LEU 17 5.432 -7.547 -7.590
276 2HD2 LEU 17 HD22 LEU 17 6.203 -6.536 -8.813
277 3HD2 LEU 17 HD23 LEU 17 4.879 -5.891 -7.844
278 H VAL 18 H VAL 18 3.485 -6.023 -3.262
279 HA VAL 18 HA VAL 18 5.369 -6.643 -1.063
280 HB VAL 18 HB VAL 18 2.681 -5.259 -1.143
281 1HG1 VAL 18 HG11 VAL 18 2.896 -6.384 0.987
282 2HG1 VAL 18 HG12 VAL 18 3.311 -4.691 1.262
283 3HG1 VAL 18 HG13 VAL 18 4.586 -5.903 1.131
284 1HG2 VAL 18 HG21 VAL 18 5.294 -4.356 -1.705
285 2HG2 VAL 18 HG22 VAL 18 4.927 -3.759 -0.086
286 3HG2 VAL 18 HG23 VAL 18 3.864 -3.360 -1.434
287 H CYS 19 H CYS 19 2.002 -7.392 -2.013
288 HA CYS 19 HA CYS 19 2.192 -9.827 -0.285
289 1HB CYS 19 HB2 CYS 19 -0.193 -8.120 -1.044
290 2HB CYS 19 HB1 CYS 19 -0.331 -9.682 -0.241
291 H GLY 20 H GLY 20 -0.110 -8.920 -2.843
292 1HA GLY 20 HA2 GLY 20 -0.652 -9.990 -4.857
293 2HA GLY 20 HA1 GLY 20 0.988 -10.639 -4.859
294 H GLU 21 H GLU 21 1.223 -12.396 -2.961
295 HA GLU 21 HA GLU 21 -0.643 -14.509 -3.683
296 1HB GLU 21 HB2 GLU 21 1.093 -14.966 -1.332
297 2HB GLU 21 HB1 GLU 21 0.866 -15.953 -2.773
298 1HG GLU 21 HG2 GLU 21 2.616 -13.500 -2.473
299 2HG GLU 21 HG1 GLU 21 3.122 -15.146 -2.847
300 H ARG 22 H ARG 22 -0.838 -12.015 -1.444
301 HA ARG 22 HA ARG 22 -2.526 -13.645 0.398
302 1HB ARG 22 HB2 ARG 22 -0.929 -11.158 0.690
303 2HB ARG 22 HB1 ARG 22 -2.453 -11.209 1.576
304 1HG ARG 22 HG2 ARG 22 -1.036 -13.732 1.806
305 2HG ARG 22 HG1 ARG 22 -0.030 -12.390 2.353
306 1HD ARG 22 HD2 ARG 22 -1.184 -12.772 4.306
307 2HD ARG 22 HD1 ARG 22 -2.324 -11.670 3.536
308 HE ARG 22 HE ARG 22 -3.810 -13.491 3.235
309 1HH1 ARG 22 HH21 ARG 22 -1.413 -14.372 5.344
310 2HH1 ARG 22 HH22 ARG 22 -1.523 -16.078 5.066
311 1HH2 ARG 22 HH11 ARG 22 -3.627 -15.763 2.328
312 2HH2 ARG 22 HH12 ARG 22 -2.775 -16.866 3.357
313 H GLY 23 H GLY 23 -2.712 -11.434 -2.192
314 1HA GLY 23 HA2 GLY 23 -4.828 -10.977 -3.278
315 2HA GLY 23 HA1 GLY 23 -5.637 -11.212 -1.737
316 H PHE 24 H PHE 24 -5.498 -8.835 -3.741
317 HA PHE 24 HA PHE 24 -5.220 -6.835 -1.577
318 1HB PHE 24 HB2 PHE 24 -3.896 -5.303 -2.920
319 2HB PHE 24 HB1 PHE 24 -3.024 -6.809 -2.724
320 HD1 PHE 24 HD1 PHE 24 -5.223 -4.936 -5.112
321 HD2 PHE 24 HD2 PHE 24 -2.288 -8.048 -4.630
322 HE1 PHE 24 HE1 PHE 24 -5.038 -5.151 -7.563
323 HE2 PHE 24 HE2 PHE 24 -2.115 -8.259 -7.087
324 HZ PHE 24 HZ PHE 24 -3.486 -6.796 -8.558
325 H PHE 25 H PHE 25 -6.887 -5.413 -1.650
326 HA PHE 25 HA PHE 25 -8.648 -5.515 -4.045
327 1HB PHE 25 HB2 PHE 25 -10.183 -4.183 -2.373
328 2HB PHE 25 HB1 PHE 25 -9.994 -5.925 -2.189
329 HD1 PHE 25 HD1 PHE 25 -8.916 -2.617 -0.904
330 HD2 PHE 25 HD2 PHE 25 -8.821 -6.873 -0.313
331 HE1 PHE 25 HE1 PHE 25 -8.004 -2.279 1.380
332 HE2 PHE 25 HE2 PHE 25 -7.909 -6.535 1.969
333 HZ PHE 25 HZ PHE 25 -7.502 -4.239 2.816
334 H TYR 26 H TYR 26 -8.817 -3.796 -5.377
335 HA TYR 26 HA TYR 26 -7.699 -1.180 -4.447
336 1HB TYR 26 HB2 TYR 26 -6.168 -2.003 -6.078
337 2HB TYR 26 HB1 TYR 26 -7.469 -2.586 -7.113
338 HD1 TYR 26 HD1 TYR 26 -5.776 0.463 -5.828
339 HD2 TYR 26 HD2 TYR 26 -8.582 -1.149 -8.653
340 HE1 TYR 26 HE1 TYR 26 -5.803 2.632 -7.040
341 HE2 TYR 26 HE2 TYR 26 -8.612 1.017 -9.867
342 HH TYR 26 HH TYR 26 -7.759 3.064 -9.994
343 H THR 27 H THR 27 -9.722 -0.259 -3.909
344 HA THR 27 HA THR 27 -11.909 -0.368 -5.892
345 HB THR 27 HB THR 27 -12.013 1.335 -3.423
346 HG1 THR 27 HG1 THR 27 -12.627 -1.393 -3.300
347 1HG2 THR 27 HG21 THR 27 -14.305 -0.200 -3.669
348 2HG2 THR 27 HG22 THR 27 -13.840 0.094 -5.344
349 3HG2 THR 27 HG23 THR 27 -14.112 1.452 -4.254
350 H LYS 28 H LYS 28 -11.500 0.957 -7.620
351 HA LYS 28 HA LYS 28 -11.811 3.735 -7.491
352 1HB LYS 28 HB2 LYS 28 -9.301 3.050 -6.455
353 2HB LYS 28 HB1 LYS 28 -8.967 3.587 -8.101
354 1HG LYS 28 HG2 LYS 28 -10.898 5.368 -7.000
355 2HG LYS 28 HG1 LYS 28 -9.607 5.187 -5.812
356 1HD LYS 28 HD2 LYS 28 -8.032 6.153 -7.170
357 2HD LYS 28 HD1 LYS 28 -8.764 5.518 -8.644
358 1HE LYS 28 HE2 LYS 28 -9.435 7.685 -8.923
359 2HE LYS 28 HE1 LYS 28 -10.728 7.205 -7.825
360 1HZ LYS 28 HZ1 LYS 28 -9.901 8.454 -6.190
361 2HZ LYS 28 HZ2 LYS 28 -8.999 9.234 -7.400
362 3HZ LYS 28 HZ3 LYS 28 -8.300 7.981 -6.491
363 HA PRO 29 HA PRO 29 -11.635 1.795 -11.653
364 1HB PRO 29 HB2 PRO 29 -14.208 2.498 -12.326
365 2HB PRO 29 HB1 PRO 29 -13.791 0.994 -11.487
366 1HG PRO 29 HG2 PRO 29 -15.057 3.463 -10.395
367 2HG PRO 29 HG1 PRO 29 -15.184 1.791 -9.825
368 1HD PRO 29 HD2 PRO 29 -13.571 3.818 -8.681
369 2HD PRO 29 HD1 PRO 29 -13.468 2.078 -8.334
370 H THR 30 H THR 30 -12.176 2.968 -13.810
371 HA THR 30 HA THR 30 -11.269 5.769 -13.559
372 HB THR 30 HB THR 30 -10.202 4.266 -15.225
373 HG1 THR 30 HG1 THR 30 -10.074 5.852 -16.631
374 1HG2 THR 30 HG21 THR 30 -12.209 4.246 -17.238
375 2HG2 THR 30 HG22 THR 30 -12.939 3.614 -15.763
376 3HG2 THR 30 HG23 THR 30 -11.483 2.863 -16.416
Start of MODEL 3
1 1H GLY 1 HT1 GLY 1 -6.737 4.505 1.169
2 2H GLY 1 HT2 GLY 1 -8.126 4.680 0.208
3 3H GLY 1 HT3 GLY 1 -8.036 5.449 1.720
4 1HA GLY 1 HA1 GLY 1 -7.038 6.389 -0.744
5 2HA GLY 1 HA2 GLY 1 -7.333 7.324 0.753
6 H ILE 2 H ILE 2 -5.415 4.390 -0.253
7 HA ILE 2 HA ILE 2 -2.836 5.549 0.026
8 HB ILE 2 HB ILE 2 -3.258 3.054 -0.225
9 1HG1 ILE 2 HG12 ILE 2 -1.231 3.831 -2.270
10 2HG1 ILE 2 HG11 ILE 2 -1.040 4.486 -0.643
11 1HG2 ILE 2 HG21 ILE 2 -3.671 2.103 -2.328
12 2HG2 ILE 2 HG22 ILE 2 -3.068 3.517 -3.193
13 3HG2 ILE 2 HG23 ILE 2 -4.650 3.568 -2.417
14 1HD1 ILE 2 HD11 ILE 2 -0.076 2.077 -1.372
15 2HD1 ILE 2 HD12 ILE 2 -1.679 1.592 -0.822
16 3HD1 ILE 2 HD13 ILE 2 -0.588 2.441 0.275
17 H VAL 3 H VAL 3 -5.141 5.835 -2.517
18 HA VAL 3 HA VAL 3 -3.444 6.542 -4.694
19 HB VAL 3 HB VAL 3 -6.078 7.912 -4.245
20 1HG1 VAL 3 HG11 VAL 3 -5.931 8.257 -6.465
21 2HG1 VAL 3 HG12 VAL 3 -5.592 6.552 -6.769
22 3HG1 VAL 3 HG13 VAL 3 -4.276 7.657 -6.367
23 1HG2 VAL 3 HG21 VAL 3 -6.833 5.597 -5.438
24 2HG2 VAL 3 HG22 VAL 3 -6.926 5.861 -3.697
25 3HG2 VAL 3 HG23 VAL 3 -5.553 4.996 -4.385
26 H GLU 4 H GLU 4 -3.886 8.121 -1.732
27 HA GLU 4 HA GLU 4 -3.187 10.743 -2.911
28 1HB GLU 4 HB2 GLU 4 -4.547 11.619 -1.353
29 2HB GLU 4 HB1 GLU 4 -5.036 9.985 -0.955
30 1HG GLU 4 HG2 GLU 4 -4.363 10.848 1.122
31 2HG GLU 4 HG1 GLU 4 -2.930 9.972 0.581
32 H GLN 5 H GLN 5 -1.752 8.089 -1.303
33 HA GLN 5 HA GLN 5 0.414 9.826 -0.224
34 1HB GLN 5 HB2 GLN 5 -0.796 7.380 0.685
35 2HB GLN 5 HB1 GLN 5 0.926 7.108 0.411
36 1HG GLN 5 HG2 GLN 5 1.157 8.013 2.488
37 2HG GLN 5 HG1 GLN 5 0.989 9.544 1.629
38 1HE2 GLN 5 HE21 GLN 5 0.155 9.322 4.341
39 2HE2 GLN 5 HE22 GLN 5 -1.537 9.444 4.403
40 H CYS 6 H CYS 6 0.862 6.464 -1.310
41 HA CYS 6 HA CYS 6 3.341 6.886 -2.513
42 1HB CYS 6 HB2 CYS 6 1.457 4.741 -2.584
43 2HB CYS 6 HB1 CYS 6 1.909 5.088 -4.230
44 H CYS 7 H CYS 7 0.170 7.656 -3.743
45 HA CYS 7 HA CYS 7 0.946 8.205 -6.469
46 1HB CYS 7 HB2 CYS 7 -1.361 8.966 -4.697
47 2HB CYS 7 HB1 CYS 7 -1.183 9.731 -6.273
48 H THR 8 H THR 8 -0.017 10.464 -3.885
49 HA THR 8 HA THR 8 1.521 12.637 -5.153
50 HB THR 8 HB THR 8 -0.266 12.579 -2.697
51 HG1 THR 8 HG1 THR 8 -0.764 12.656 -5.328
52 1HG2 THR 8 HG21 THR 8 -0.005 15.181 -3.803
53 2HG2 THR 8 HG22 THR 8 1.627 14.534 -3.637
54 3HG2 THR 8 HG23 THR 8 0.564 14.619 -2.231
55 H SER 9 H SER 9 2.911 10.344 -3.873
56 HA SER 9 HA SER 9 5.096 11.578 -2.707
57 1HB SER 9 HB2 SER 9 2.813 11.333 -0.821
58 2HB SER 9 HB1 SER 9 4.385 10.844 -0.198
59 HG SER 9 HG SER 9 5.156 12.853 -0.548
60 H ILE 10 H ILE 10 5.891 9.865 -0.702
61 HA ILE 10 HA ILE 10 5.933 7.280 -2.160
62 HB ILE 10 HB ILE 10 7.572 8.101 0.252
63 1HG1 ILE 10 HG12 ILE 10 7.767 9.646 -1.787
64 2HG1 ILE 10 HG11 ILE 10 9.266 8.905 -1.227
65 1HG2 ILE 10 HG21 ILE 10 8.096 5.898 0.088
66 2HG2 ILE 10 HG22 ILE 10 9.050 6.396 -1.308
67 3HG2 ILE 10 HG23 ILE 10 7.419 5.767 -1.536
68 1HD1 ILE 10 HD11 ILE 10 7.632 7.480 -3.298
69 2HD1 ILE 10 HD12 ILE 10 9.373 7.436 -3.027
70 3HD1 ILE 10 HD13 ILE 10 8.636 8.843 -3.792
71 H CYS 11 H CYS 11 5.198 5.358 -1.178
72 HA CYS 11 HA CYS 11 3.656 5.777 1.341
73 1HB CYS 11 HB2 CYS 11 2.397 3.720 0.698
74 2HB CYS 11 HB1 CYS 11 2.245 5.004 -0.495
75 H SER 12 H SER 12 4.079 4.472 3.116
76 HA SER 12 HA SER 12 6.705 3.233 3.192
77 1HB SER 12 HB2 SER 12 4.915 2.643 5.438
78 2HB SER 12 HB1 SER 12 6.485 3.441 5.433
79 HG SER 12 HG SER 12 5.446 5.249 5.574
80 H LEU 13 H LEU 13 7.182 1.025 3.460
81 HA LEU 13 HA LEU 13 5.694 -0.875 2.041
82 1HB LEU 13 HB2 LEU 13 7.572 -1.218 4.391
83 2HB LEU 13 HB1 LEU 13 6.908 -2.581 3.501
84 HG LEU 13 HG LEU 13 9.231 -1.094 2.877
85 1HD1 LEU 13 HD11 LEU 13 9.531 -3.124 1.981
86 2HD1 LEU 13 HD12 LEU 13 8.493 -2.641 0.639
87 3HD1 LEU 13 HD13 LEU 13 7.799 -3.453 2.043
88 1HD2 LEU 13 HD21 LEU 13 7.046 -0.663 0.807
89 2HD2 LEU 13 HD22 LEU 13 8.758 -0.317 0.573
90 3HD2 LEU 13 HD23 LEU 13 7.828 0.601 1.756
91 H TYR 14 H TYR 14 5.205 0.359 5.257
92 HA TYR 14 HA TYR 14 3.464 -1.774 6.140
93 1HB TYR 14 HB2 TYR 14 4.647 -0.240 7.714
94 2HB TYR 14 HB1 TYR 14 3.620 1.076 7.143
95 HD1 TYR 14 HD1 TYR 14 2.784 -2.511 7.812
96 HD2 TYR 14 HD2 TYR 14 2.185 1.592 8.937
97 HE1 TYR 14 HE1 TYR 14 1.009 -3.206 9.400
98 HE2 TYR 14 HE2 TYR 14 0.410 0.898 10.526
99 HH TYR 14 HH TYR 14 -0.006 -2.206 11.572
100 H GLN 15 H GLN 15 2.940 1.416 4.739
101 HA GLN 15 HA GLN 15 0.076 1.257 4.831
102 1HB GLN 15 HB2 GLN 15 1.883 2.854 2.990
103 2HB GLN 15 HB1 GLN 15 0.145 3.100 3.169
104 1HG GLN 15 HG2 GLN 15 0.446 3.599 5.556
105 2HG GLN 15 HG1 GLN 15 2.182 3.327 5.403
106 1HE2 GLN 15 HE21 GLN 15 -0.445 5.399 4.063
107 2HE2 GLN 15 HE22 GLN 15 0.558 6.737 3.769
108 H LEU 16 H LEU 16 2.500 0.041 2.555
109 HA LEU 16 HA LEU 16 0.457 -0.662 0.570
110 1HB LEU 16 HB2 LEU 16 3.154 -0.216 0.411
111 2HB LEU 16 HB1 LEU 16 3.079 -1.967 0.395
112 HG LEU 16 HG LEU 16 2.969 -0.849 -1.854
113 1HD1 LEU 16 HD11 LEU 16 0.773 -2.663 -0.865
114 2HD1 LEU 16 HD12 LEU 16 2.250 -3.114 -1.715
115 3HD1 LEU 16 HD13 LEU 16 0.969 -2.263 -2.568
116 1HD2 LEU 16 HD21 LEU 16 1.108 0.392 -2.511
117 2HD2 LEU 16 HD22 LEU 16 1.335 0.934 -0.848
118 3HD2 LEU 16 HD23 LEU 16 0.099 -0.268 -1.223
119 H GLU 17 H GLU 17 2.200 -2.123 3.226
120 HA GLU 17 HA GLU 17 1.244 -4.828 2.639
121 1HB GLU 17 HB2 GLU 17 3.004 -3.546 4.609
122 2HB GLU 17 HB1 GLU 17 1.985 -4.804 5.305
123 1HG GLU 17 HG2 GLU 17 2.823 -6.458 3.827
124 2HG GLU 17 HG1 GLU 17 3.531 -5.251 2.752
125 H ASN 18 H ASN 18 -0.339 -2.134 3.487
126 HA ASN 18 HA ASN 18 -2.135 -3.520 5.426
127 1HB ASN 18 HB2 ASN 18 -1.179 -0.809 5.197
128 2HB ASN 18 HB1 ASN 18 -2.938 -0.823 5.060
129 1HD2 ASN 18 HD21 ASN 18 -3.942 -0.657 7.061
130 2HD2 ASN 18 HD22 ASN 18 -3.325 -1.264 8.521
131 H TYR 19 H TYR 19 -1.930 -3.760 2.372
132 HA TYR 19 HA TYR 19 -4.830 -3.312 1.882
133 1HB TYR 19 HB2 TYR 19 -2.504 -2.418 0.204
134 2HB TYR 19 HB1 TYR 19 -4.060 -2.777 -0.545
135 HD1 TYR 19 HD1 TYR 19 -2.153 -0.211 0.867
136 HD2 TYR 19 HD2 TYR 19 -6.153 -1.780 0.860
137 HE1 TYR 19 HE1 TYR 19 -3.018 1.995 1.605
138 HE2 TYR 19 HE2 TYR 19 -7.020 0.427 1.596
139 HH TYR 19 HH TYR 19 -6.491 2.625 1.836
140 H CYS 20 H CYS 20 -3.395 -5.746 2.615
141 HA CYS 20 HA CYS 20 -3.711 -7.294 0.084
142 1HB CYS 20 HB2 CYS 20 -2.180 -8.222 2.513
143 2HB CYS 20 HB1 CYS 20 -2.096 -8.842 0.870
144 H ASN 21 H ASN 21 -5.119 -9.059 0.111
145 HA ASN 21 HA ASN 21 -7.190 -9.101 2.085
146 1HB ASN 21 HB2 ASN 21 -6.523 -10.544 -0.343
147 2HB ASN 21 HB1 ASN 21 -7.146 -11.644 0.886
148 1HD2 ASN 21 HD21 ASN 21 -8.362 -10.261 -1.675
149 2HD2 ASN 21 HD22 ASN 21 -9.859 -9.692 -1.114
150 1H PHE 1 HT1 PHE 1 11.738 -0.707 4.808
151 2H PHE 1 HT2 PHE 1 11.663 -1.351 3.238
152 3H PHE 1 HT3 PHE 1 10.824 0.078 3.615
153 HA PHE 1 HA PHE 1 12.887 1.254 3.972
154 1HB PHE 1 HB2 PHE 1 15.013 0.185 3.606
155 2HB PHE 1 HB1 PHE 1 14.112 -0.826 4.736
156 HD1 PHE 1 HD1 PHE 1 15.756 -0.673 1.538
157 HD2 PHE 1 HD2 PHE 1 12.809 -2.826 3.805
158 HE1 PHE 1 HE1 PHE 1 15.957 -2.591 -0.023
159 HE2 PHE 1 HE2 PHE 1 13.010 -4.745 2.245
160 HZ PHE 1 HZ PHE 1 14.583 -4.627 0.332
161 H VAL 2 H VAL 2 11.228 -0.500 1.644
162 HA VAL 2 HA VAL 2 12.737 0.692 -0.623
163 HB VAL 2 HB VAL 2 10.265 -0.979 -0.963
164 1HG1 VAL 2 HG11 VAL 2 12.813 -0.414 -2.465
165 2HG1 VAL 2 HG12 VAL 2 11.146 -0.241 -3.014
166 3HG1 VAL 2 HG13 VAL 2 11.855 -1.847 -2.838
167 1HG2 VAL 2 HG21 VAL 2 13.028 -1.994 -0.218
168 2HG2 VAL 2 HG22 VAL 2 11.737 -3.009 -0.858
169 3HG2 VAL 2 HG23 VAL 2 11.543 -2.217 0.705
170 H ASN 3 H ASN 3 11.593 2.645 0.862
171 HA ASN 3 HA ASN 3 8.925 3.389 0.442
172 1HB ASN 3 HB2 ASN 3 10.243 5.815 0.155
173 2HB ASN 3 HB1 ASN 3 9.751 5.092 1.682
174 1HD2 ASN 3 HD21 ASN 3 12.448 6.277 0.000
175 2HD2 ASN 3 HD22 ASN 3 13.663 5.536 0.926
176 H GLN 4 H GLN 4 8.381 2.601 -1.698
177 HA GLN 4 HA GLN 4 9.494 4.195 -3.956
178 1HB GLN 4 HB2 GLN 4 9.422 1.647 -4.059
179 2HB GLN 4 HB1 GLN 4 7.665 1.788 -4.132
180 1HG GLN 4 HG2 GLN 4 8.501 1.646 -6.400
181 2HG GLN 4 HG1 GLN 4 7.937 3.295 -6.126
182 1HE2 GLN 4 HE21 GLN 4 11.025 1.677 -5.188
183 2HE2 GLN 4 HE22 GLN 4 12.023 2.811 -5.961
184 H HIS 5 H HIS 5 7.938 5.126 -5.505
185 HA HIS 5 HA HIS 5 5.358 5.858 -4.183
186 1HB HIS 5 HB2 HIS 5 5.459 7.666 -6.114
187 2HB HIS 5 HB1 HIS 5 6.401 7.899 -4.640
188 HD2 HIS 5 HD2 HIS 5 8.572 9.156 -5.924
189 HE1 HIS 5 HE1 HIS 5 9.570 5.868 -8.390
190 HE2 HIS 5 HE2 HIS 5 10.325 8.164 -7.575
191 H LEU 6 H LEU 6 3.443 5.206 -5.191
192 HA LEU 6 HA LEU 6 3.601 4.432 -7.992
193 1HB LEU 6 HB2 LEU 6 2.447 2.470 -6.070
194 2HB LEU 6 HB1 LEU 6 2.825 2.234 -7.762
195 HG LEU 6 HG LEU 6 5.255 2.833 -7.039
196 1HD1 LEU 6 HD11 LEU 6 3.735 2.479 -4.555
197 2HD1 LEU 6 HD12 LEU 6 5.259 3.323 -4.828
198 3HD1 LEU 6 HD13 LEU 6 5.242 1.572 -4.636
199 1HD2 LEU 6 HD21 LEU 6 4.575 0.183 -5.975
200 2HD2 LEU 6 HD22 LEU 6 5.611 0.613 -7.337
201 3HD2 LEU 6 HD23 LEU 6 3.863 0.511 -7.554
202 H CYS 7 H CYS 7 1.854 5.070 -9.122
203 HA CYS 7 HA CYS 7 -0.695 5.484 -7.621
204 1HB CYS 7 HB2 CYS 7 0.706 7.519 -8.682
205 2HB CYS 7 HB1 CYS 7 -0.168 7.018 -10.129
206 H GLY 8 H GLY 8 -2.654 5.225 -9.062
207 1HA GLY 8 HA2 GLY 8 -3.886 3.741 -10.426
208 2HA GLY 8 HA1 GLY 8 -2.719 4.226 -11.656
209 H SER 9 H SER 9 -2.255 2.264 -12.647
210 HA SER 9 HA SER 9 -2.178 -0.300 -11.593
211 1HB SER 9 HB2 SER 9 0.018 0.699 -13.418
212 2HB SER 9 HB1 SER 9 -0.688 -0.914 -13.355
213 HG SER 9 HG SER 9 -2.122 -0.234 -14.718
214 H ASP 10 H ASP 10 0.474 2.083 -11.530
215 HA ASP 10 HA ASP 10 2.478 0.689 -10.202
216 1HB ASP 10 HB2 ASP 10 1.830 3.394 -10.676
217 2HB ASP 10 HB1 ASP 10 2.101 3.262 -8.944
218 H LEU 11 H LEU 11 -0.531 2.002 -8.801
219 HA LEU 11 HA LEU 11 0.078 1.268 -6.082
220 1HB LEU 11 HB2 LEU 11 -2.104 2.436 -7.496
221 2HB LEU 11 HB1 LEU 11 -2.745 0.984 -6.745
222 HG LEU 11 HG LEU 11 -3.079 2.373 -4.974
223 1HD1 LEU 11 HD11 LEU 11 -1.532 2.065 -3.317
224 2HD1 LEU 11 HD12 LEU 11 -0.167 2.457 -4.364
225 3HD1 LEU 11 HD13 LEU 11 -0.943 0.876 -4.478
226 1HD2 LEU 11 HD21 LEU 11 -2.698 4.459 -5.863
227 2HD2 LEU 11 HD22 LEU 11 -1.062 4.059 -6.382
228 3HD2 LEU 11 HD23 LEU 11 -1.391 4.396 -4.682
229 1HN ABA 12 H ABA 12 -1.701 -0.251 -8.728
230 HA ABA 12 HA ABA 12 -2.370 -2.714 -7.477
231 1HB ABA 12 HB1 ABA 12 -1.619 -2.648 -10.380
232 2HB ABA 12 HB2 ABA 12 -2.993 -1.682 -9.852
233 1HG ABA 12 HG1 ABA 12 -3.128 -4.310 -8.687
234 2HG ABA 12 HG2 ABA 12 -2.984 -4.420 -10.442
235 3HG ABA 12 HG3 ABA 12 -4.295 -3.488 -9.721
236 H GLU 13 H GLU 13 0.668 -1.476 -8.557
237 HA GLU 13 HA GLU 13 1.873 -4.144 -8.823
238 1HB GLU 13 HB2 GLU 13 2.603 -1.476 -9.609
239 2HB GLU 13 HB1 GLU 13 3.912 -2.216 -8.692
240 1HG GLU 13 HG2 GLU 13 4.417 -3.618 -10.386
241 2HG GLU 13 HG1 GLU 13 2.731 -4.105 -10.562
242 H ALA 14 H ALA 14 2.405 -1.326 -6.658
243 HA ALA 14 HA ALA 14 4.267 -2.479 -4.930
244 1HB ALA 14 HB1 ALA 14 3.752 -0.749 -3.521
245 2HB ALA 14 HB2 ALA 14 2.024 -1.097 -3.572
246 3HB ALA 14 HB3 ALA 14 2.779 -0.188 -4.879
247 H LEU 15 H LEU 15 0.753 -2.725 -4.836
248 HA LEU 15 HA LEU 15 0.535 -4.643 -2.721
249 1HB LEU 15 HB2 LEU 15 -1.247 -4.491 -5.165
250 2HB LEU 15 HB1 LEU 15 -1.701 -5.100 -3.578
251 HG LEU 15 HG LEU 15 -1.073 -2.221 -4.362
252 1HD1 LEU 15 HD11 LEU 15 -3.302 -1.885 -4.402
253 2HD1 LEU 15 HD12 LEU 15 -3.580 -2.923 -3.003
254 3HD1 LEU 15 HD13 LEU 15 -3.383 -3.633 -4.604
255 1HD2 LEU 15 HD21 LEU 15 -0.657 -3.351 -1.818
256 2HD2 LEU 15 HD22 LEU 15 -2.205 -2.515 -1.709
257 3HD2 LEU 15 HD23 LEU 15 -0.763 -1.634 -2.210
258 H TYR 16 H TYR 16 0.933 -4.968 -6.242
259 HA TYR 16 HA TYR 16 0.799 -7.872 -6.224
260 1HB TYR 16 HB2 TYR 16 1.185 -5.718 -8.168
261 2HB TYR 16 HB1 TYR 16 2.153 -7.141 -8.529
262 HD1 TYR 16 HD1 TYR 16 -0.662 -5.719 -9.579
263 HD2 TYR 16 HD2 TYR 16 0.511 -9.371 -7.642
264 HE1 TYR 16 HE1 TYR 16 -2.677 -6.838 -10.486
265 HE2 TYR 16 HE2 TYR 16 -1.509 -10.496 -8.550
266 HH TYR 16 HH TYR 16 -3.688 -8.826 -10.799
267 H LEU 17 H LEU 17 3.335 -5.528 -5.724
268 HA LEU 17 HA LEU 17 5.435 -7.617 -6.028
269 1HB LEU 17 HB2 LEU 17 5.322 -4.717 -6.253
270 2HB LEU 17 HB1 LEU 17 6.644 -5.250 -5.214
271 HG LEU 17 HG LEU 17 7.305 -5.124 -7.617
272 1HD1 LEU 17 HD11 LEU 17 7.340 -8.035 -7.079
273 2HD1 LEU 17 HD12 LEU 17 7.959 -7.015 -5.779
274 3HD1 LEU 17 HD13 LEU 17 8.681 -6.930 -7.386
275 1HD2 LEU 17 HD21 LEU 17 5.056 -5.767 -8.509
276 2HD2 LEU 17 HD22 LEU 17 5.345 -7.412 -7.945
277 3HD2 LEU 17 HD23 LEU 17 6.369 -6.720 -9.202
278 H VAL 18 H VAL 18 3.550 -6.025 -3.664
279 HA VAL 18 HA VAL 18 5.513 -6.441 -1.510
280 HB VAL 18 HB VAL 18 2.741 -5.264 -1.677
281 1HG1 VAL 18 HG11 VAL 18 2.513 -6.127 0.436
282 2HG1 VAL 18 HG12 VAL 18 3.487 -4.717 0.855
283 3HG1 VAL 18 HG13 VAL 18 4.253 -6.296 0.665
284 1HG2 VAL 18 HG21 VAL 18 4.024 -3.439 -2.064
285 2HG2 VAL 18 HG22 VAL 18 5.496 -4.291 -1.607
286 3HG2 VAL 18 HG23 VAL 18 4.490 -3.544 -0.367
287 H CYS 19 H CYS 19 2.055 -7.316 -1.780
288 HA CYS 19 HA CYS 19 2.622 -9.738 -0.168
289 1HB CYS 19 HB2 CYS 19 0.010 -8.501 -1.089
290 2HB CYS 19 HB1 CYS 19 0.141 -9.924 -0.055
291 H GLY 20 H GLY 20 0.666 -9.035 -3.097
292 1HA GLY 20 HA2 GLY 20 0.457 -10.291 -5.078
293 2HA GLY 20 HA1 GLY 20 1.900 -11.185 -4.594
294 H GLU 21 H GLU 21 1.649 -13.175 -3.557
295 HA GLU 21 HA GLU 21 -0.864 -14.526 -3.868
296 1HB GLU 21 HB2 GLU 21 0.204 -16.369 -2.622
297 2HB GLU 21 HB1 GLU 21 1.294 -15.728 -3.851
298 1HG GLU 21 HG2 GLU 21 2.815 -15.458 -2.209
299 2HG GLU 21 HG1 GLU 21 1.798 -14.153 -1.598
300 H ARG 22 H ARG 22 -2.393 -13.218 -2.756
301 HA ARG 22 HA ARG 22 -3.066 -13.998 -0.141
302 1HB ARG 22 HB2 ARG 22 -1.025 -11.930 -0.238
303 2HB ARG 22 HB1 ARG 22 -2.480 -11.351 0.573
304 1HG ARG 22 HG2 ARG 22 -2.047 -12.610 2.391
305 2HG ARG 22 HG1 ARG 22 -1.863 -14.059 1.403
306 1HD ARG 22 HD2 ARG 22 0.399 -13.925 1.426
307 2HD ARG 22 HD1 ARG 22 0.383 -12.183 1.148
308 HE ARG 22 HE ARG 22 -0.470 -12.640 3.818
309 1HH1 ARG 22 HH21 ARG 22 2.248 -13.480 1.898
310 2HH1 ARG 22 HH22 ARG 22 3.411 -13.084 3.119
311 1HH2 ARG 22 HH11 ARG 22 1.042 -11.925 5.371
312 2HH2 ARG 22 HH12 ARG 22 2.727 -12.203 5.086
313 H GLY 23 H GLY 23 -3.065 -11.425 -2.521
314 1HA GLY 23 HA2 GLY 23 -5.212 -10.855 -3.593
315 2HA GLY 23 HA1 GLY 23 -5.993 -11.106 -2.042
316 H PHE 24 H PHE 24 -5.800 -8.659 -3.885
317 HA PHE 24 HA PHE 24 -5.288 -6.778 -1.665
318 1HB PHE 24 HB2 PHE 24 -3.902 -5.274 -2.987
319 2HB PHE 24 HB1 PHE 24 -3.128 -6.844 -2.898
320 HD1 PHE 24 HD1 PHE 24 -5.060 -4.556 -5.102
321 HD2 PHE 24 HD2 PHE 24 -2.789 -8.204 -4.880
322 HE1 PHE 24 HE1 PHE 24 -5.005 -4.682 -7.564
323 HE2 PHE 24 HE2 PHE 24 -2.740 -8.319 -7.341
324 HZ PHE 24 HZ PHE 24 -3.840 -6.548 -8.696
325 H PHE 25 H PHE 25 -7.043 -5.477 -1.590
326 HA PHE 25 HA PHE 25 -8.751 -5.317 -4.006
327 1HB PHE 25 HB2 PHE 25 -10.397 -4.268 -2.388
328 2HB PHE 25 HB1 PHE 25 -9.955 -5.937 -2.034
329 HD1 PHE 25 HD1 PHE 25 -9.605 -2.424 -0.995
330 HD2 PHE 25 HD2 PHE 25 -8.511 -6.491 -0.135
331 HE1 PHE 25 HE1 PHE 25 -8.820 -1.737 1.255
332 HE2 PHE 25 HE2 PHE 25 -7.728 -5.804 2.117
333 HZ PHE 25 HZ PHE 25 -7.883 -3.428 2.813
334 H TYR 26 H TYR 26 -8.890 -3.514 -5.209
335 HA TYR 26 HA TYR 26 -7.818 -0.962 -4.072
336 1HB TYR 26 HB2 TYR 26 -6.182 -1.667 -5.654
337 2HB TYR 26 HB1 TYR 26 -7.408 -2.200 -6.799
338 HD1 TYR 26 HD1 TYR 26 -6.302 0.903 -4.994
339 HD2 TYR 26 HD2 TYR 26 -7.979 -0.813 -8.558
340 HE1 TYR 26 HE1 TYR 26 -6.283 3.136 -6.082
341 HE2 TYR 26 HE2 TYR 26 -7.957 1.417 -9.647
342 HH TYR 26 HH TYR 26 -7.591 4.267 -7.982
343 H THR 27 H THR 27 -10.223 -0.755 -3.554
344 HA THR 27 HA THR 27 -11.889 -0.142 -5.936
345 HB THR 27 HB THR 27 -13.487 0.333 -3.755
346 HG1 THR 27 HG1 THR 27 -12.891 -1.736 -2.557
347 1HG2 THR 27 HG21 THR 27 -14.355 -1.034 -5.426
348 2HG2 THR 27 HG22 THR 27 -14.090 -2.200 -4.130
349 3HG2 THR 27 HG23 THR 27 -12.932 -2.076 -5.453
350 H LYS 28 H LYS 28 -10.271 1.766 -6.177
351 HA LYS 28 HA LYS 28 -11.629 4.166 -5.253
352 1HB LYS 28 HB2 LYS 28 -9.240 3.174 -3.843
353 2HB LYS 28 HB1 LYS 28 -9.100 4.845 -4.391
354 1HG LYS 28 HG2 LYS 28 -11.647 4.009 -3.063
355 2HG LYS 28 HG1 LYS 28 -10.226 4.267 -2.051
356 1HD LYS 28 HD2 LYS 28 -10.444 6.498 -2.225
357 2HD LYS 28 HD1 LYS 28 -10.462 6.400 -3.985
358 1HE LYS 28 HE2 LYS 28 -12.870 5.845 -3.930
359 2HE LYS 28 HE1 LYS 28 -12.852 5.962 -2.171
360 1HZ LYS 28 HZ1 LYS 28 -13.450 8.071 -2.626
361 2HZ LYS 28 HZ2 LYS 28 -12.752 8.067 -4.175
362 3HZ LYS 28 HZ3 LYS 28 -11.778 8.294 -2.802
363 HA PRO 29 HA PRO 29 -9.495 4.583 -9.257
364 1HB PRO 29 HB2 PRO 29 -11.610 5.865 -10.458
365 2HB PRO 29 HB1 PRO 29 -11.446 4.101 -10.386
366 1HG PRO 29 HG2 PRO 29 -13.256 5.883 -8.820
367 2HG PRO 29 HG1 PRO 29 -13.468 4.182 -9.268
368 1HD PRO 29 HD2 PRO 29 -12.658 5.130 -6.731
369 2HD PRO 29 HD1 PRO 29 -12.535 3.452 -7.304
370 H THR 30 H THR 30 -10.578 6.674 -6.841
371 HA THR 30 HA THR 30 -9.159 8.953 -8.142
372 HB THR 30 HB THR 30 -11.548 9.424 -6.373
373 HG1 THR 30 HG1 THR 30 -11.848 9.487 -9.133
374 1HG2 THR 30 HG21 THR 30 -11.599 11.436 -8.041
375 2HG2 THR 30 HG22 THR 30 -9.942 10.949 -8.404
376 3HG2 THR 30 HG23 THR 30 -10.385 11.415 -6.761
Start of MODEL 4
1 1H GLY 1 HT1 GLY 1 -7.170 6.379 2.177
2 2H GLY 1 HT2 GLY 1 -8.536 6.914 1.321
3 3H GLY 1 HT3 GLY 1 -7.065 7.755 1.189
4 1HA GLY 1 HA1 GLY 1 -7.049 4.995 0.369
5 2HA GLY 1 HA2 GLY 1 -7.880 6.130 -0.740
6 H ILE 2 H ILE 2 -6.068 4.648 -1.812
7 HA ILE 2 HA ILE 2 -3.307 5.042 -0.771
8 HB ILE 2 HB ILE 2 -4.304 2.723 -1.530
9 1HG1 ILE 2 HG12 ILE 2 -2.081 1.961 -2.065
10 2HG1 ILE 2 HG11 ILE 2 -1.596 3.573 -2.587
11 1HG2 ILE 2 HG21 ILE 2 -3.329 3.822 -4.185
12 2HG2 ILE 2 HG22 ILE 2 -5.029 3.595 -3.775
13 3HG2 ILE 2 HG23 ILE 2 -3.952 2.201 -3.879
14 1HD1 ILE 2 HD11 ILE 2 -2.635 3.279 0.194
15 2HD1 ILE 2 HD12 ILE 2 -1.389 4.360 -0.430
16 3HD1 ILE 2 HD13 ILE 2 -1.020 2.659 -0.144
17 H VAL 3 H VAL 3 -5.393 5.816 -3.458
18 HA VAL 3 HA VAL 3 -3.414 6.797 -5.276
19 HB VAL 3 HB VAL 3 -6.109 8.099 -5.019
20 1HG1 VAL 3 HG11 VAL 3 -4.919 7.014 -7.537
21 2HG1 VAL 3 HG12 VAL 3 -4.169 8.440 -6.819
22 3HG1 VAL 3 HG13 VAL 3 -5.869 8.479 -7.286
23 1HG2 VAL 3 HG21 VAL 3 -5.576 5.239 -5.286
24 2HG2 VAL 3 HG22 VAL 3 -6.491 5.881 -6.651
25 3HG2 VAL 3 HG23 VAL 3 -7.105 6.070 -5.008
26 H GLU 4 H GLU 4 -4.379 7.893 -2.222
27 HA GLU 4 HA GLU 4 -3.493 10.668 -2.800
28 1HB GLU 4 HB2 GLU 4 -5.651 10.412 -1.613
29 2HB GLU 4 HB1 GLU 4 -4.839 9.505 -0.338
30 1HG GLU 4 HG2 GLU 4 -3.344 11.871 -0.640
31 2HG GLU 4 HG1 GLU 4 -5.034 12.370 -0.687
32 H GLN 5 H GLN 5 -2.331 7.716 -1.641
33 HA GLN 5 HA GLN 5 -0.330 9.012 0.139
34 1HB GLN 5 HB2 GLN 5 -1.372 6.224 -0.173
35 2HB GLN 5 HB1 GLN 5 0.263 6.443 0.446
36 1HG GLN 5 HG2 GLN 5 -0.523 7.792 2.276
37 2HG GLN 5 HG1 GLN 5 -2.144 7.884 1.585
38 1HE2 GLN 5 HE21 GLN 5 0.026 5.900 3.488
39 2HE2 GLN 5 HE22 GLN 5 -1.070 4.639 3.784
40 H CYS 6 H CYS 6 0.585 6.020 -1.351
41 HA CYS 6 HA CYS 6 3.057 6.800 -2.308
42 1HB CYS 6 HB2 CYS 6 1.380 4.559 -2.805
43 2HB CYS 6 HB1 CYS 6 1.908 5.157 -4.347
44 H CYS 7 H CYS 7 -0.068 7.452 -3.756
45 HA CYS 7 HA CYS 7 0.949 8.313 -6.302
46 1HB CYS 7 HB2 CYS 7 -1.611 8.274 -4.900
47 2HB CYS 7 HB1 CYS 7 -1.410 9.738 -5.861
48 H THR 8 H THR 8 -0.244 10.202 -3.499
49 HA THR 8 HA THR 8 0.926 12.663 -4.546
50 HB THR 8 HB THR 8 -0.420 11.902 -1.950
51 HG1 THR 8 HG1 THR 8 -1.902 13.460 -2.752
52 1HG2 THR 8 HG21 THR 8 0.971 13.495 -1.042
53 2HG2 THR 8 HG22 THR 8 -0.249 14.571 -1.726
54 3HG2 THR 8 HG23 THR 8 1.259 14.279 -2.594
55 H SER 9 H SER 9 1.661 10.413 -1.879
56 HA SER 9 HA SER 9 4.445 11.514 -1.861
57 1HB SER 9 HB2 SER 9 2.600 11.285 0.298
58 2HB SER 9 HB1 SER 9 3.860 10.084 0.559
59 HG SER 9 HG SER 9 5.309 11.634 0.761
60 H ILE 10 H ILE 10 5.429 9.376 -0.166
61 HA ILE 10 HA ILE 10 5.339 7.198 -2.186
62 HB ILE 10 HB ILE 10 7.565 6.991 -1.892
63 1HG1 ILE 10 HG12 ILE 10 8.526 6.933 0.553
64 2HG1 ILE 10 HG11 ILE 10 6.832 6.756 1.014
65 1HG2 ILE 10 HG21 ILE 10 8.737 8.864 -1.129
66 2HG2 ILE 10 HG22 ILE 10 7.590 9.175 0.173
67 3HG2 ILE 10 HG23 ILE 10 7.146 9.529 -1.497
68 1HD1 ILE 10 HD11 ILE 10 7.036 4.564 0.540
69 2HD1 ILE 10 HD12 ILE 10 8.620 4.810 -0.193
70 3HD1 ILE 10 HD13 ILE 10 7.162 5.025 -1.152
71 H CYS 11 H CYS 11 5.359 4.915 -1.283
72 HA CYS 11 HA CYS 11 3.946 4.771 1.347
73 1HB CYS 11 HB2 CYS 11 2.572 2.894 0.453
74 2HB CYS 11 HB1 CYS 11 2.245 4.402 -0.388
75 H SER 12 H SER 12 5.416 3.793 2.648
76 HA SER 12 HA SER 12 7.350 1.888 1.555
77 1HB SER 12 HB2 SER 12 7.509 1.736 4.330
78 2HB SER 12 HB1 SER 12 8.490 2.769 3.294
79 HG SER 12 HG SER 12 7.080 3.686 5.110
80 H LEU 13 H LEU 13 7.317 -0.286 1.804
81 HA LEU 13 HA LEU 13 5.298 -1.984 1.727
82 1HB LEU 13 HB2 LEU 13 6.994 -2.928 3.939
83 2HB LEU 13 HB1 LEU 13 6.644 -3.685 2.397
84 HG LEU 13 HG LEU 13 9.020 -3.195 2.576
85 1HD1 LEU 13 HD11 LEU 13 7.341 -2.407 0.485
86 2HD1 LEU 13 HD12 LEU 13 9.075 -2.720 0.393
87 3HD1 LEU 13 HD13 LEU 13 8.488 -1.084 0.677
88 1HD2 LEU 13 HD21 LEU 13 9.725 -1.364 3.665
89 2HD2 LEU 13 HD22 LEU 13 8.069 -0.768 3.766
90 3HD2 LEU 13 HD23 LEU 13 9.070 -0.360 2.372
91 H TYR 14 H TYR 14 6.401 -0.959 5.008
92 HA TYR 14 HA TYR 14 4.376 -2.161 6.478
93 1HB TYR 14 HB2 TYR 14 6.264 -0.809 7.451
94 2HB TYR 14 HB1 TYR 14 5.355 0.643 7.029
95 HD1 TYR 14 HD1 TYR 14 4.915 -2.634 8.804
96 HD2 TYR 14 HD2 TYR 14 3.823 1.517 8.578
97 HE1 TYR 14 HE1 TYR 14 3.564 -2.878 10.870
98 HE2 TYR 14 HE2 TYR 14 2.467 1.271 10.644
99 HH TYR 14 HH TYR 14 2.239 -0.143 12.541
100 H GLN 15 H GLN 15 4.183 0.944 4.819
101 HA GLN 15 HA GLN 15 1.428 1.339 5.635
102 1HB GLN 15 HB2 GLN 15 3.147 2.715 3.557
103 2HB GLN 15 HB1 GLN 15 1.490 3.199 3.927
104 1HG GLN 15 HG2 GLN 15 2.040 3.799 6.148
105 2HG GLN 15 HG1 GLN 15 3.573 2.929 6.091
106 1HE2 GLN 15 HE21 GLN 15 3.042 5.867 6.626
107 2HE2 GLN 15 HE22 GLN 15 3.980 6.695 5.480
108 H LEU 16 H LEU 16 3.016 -0.098 2.761
109 HA LEU 16 HA LEU 16 0.377 -0.389 1.516
110 1HB LEU 16 HB2 LEU 16 2.783 -0.121 0.362
111 2HB LEU 16 HB1 LEU 16 2.647 -1.871 0.368
112 HG LEU 16 HG LEU 16 0.221 -1.377 -0.519
113 1HD1 LEU 16 HD11 LEU 16 1.728 1.156 -1.040
114 2HD1 LEU 16 HD12 LEU 16 0.049 0.940 -0.545
115 3HD1 LEU 16 HD13 LEU 16 0.532 0.587 -2.205
116 1HD2 LEU 16 HD21 LEU 16 1.445 -2.617 -1.987
117 2HD2 LEU 16 HD22 LEU 16 2.859 -1.576 -1.822
118 3HD2 LEU 16 HD23 LEU 16 1.525 -1.089 -2.864
119 H GLU 17 H GLU 17 2.065 -1.930 3.891
120 HA GLU 17 HA GLU 17 1.266 -4.669 3.229
121 1HB GLU 17 HB2 GLU 17 3.187 -3.616 4.891
122 2HB GLU 17 HB1 GLU 17 1.912 -4.029 6.036
123 1HG GLU 17 HG2 GLU 17 1.892 -6.262 4.504
124 2HG GLU 17 HG1 GLU 17 3.591 -5.808 4.358
125 H ASN 18 H ASN 18 -0.403 -1.991 3.954
126 HA ASN 18 HA ASN 18 -2.355 -3.422 5.714
127 1HB ASN 18 HB2 ASN 18 -1.346 -0.715 5.684
128 2HB ASN 18 HB1 ASN 18 -3.092 -0.702 5.437
129 1HD2 ASN 18 HD21 ASN 18 -1.628 0.131 7.898
130 2HD2 ASN 18 HD22 ASN 18 -2.201 -0.870 9.142
131 H TYR 19 H TYR 19 -1.826 -3.307 2.626
132 HA TYR 19 HA TYR 19 -4.664 -2.739 1.893
133 1HB TYR 19 HB2 TYR 19 -2.122 -2.261 0.330
134 2HB TYR 19 HB1 TYR 19 -3.727 -2.229 -0.403
135 HD1 TYR 19 HD1 TYR 19 -1.734 -0.759 2.402
136 HD2 TYR 19 HD2 TYR 19 -5.072 -0.306 -0.267
137 HE1 TYR 19 HE1 TYR 19 -2.093 1.550 3.240
138 HE2 TYR 19 HE2 TYR 19 -5.433 2.001 0.573
139 HH TYR 19 HH TYR 19 -4.808 3.533 2.057
140 H CYS 20 H CYS 20 -3.398 -5.264 2.813
141 HA CYS 20 HA CYS 20 -3.623 -6.877 0.326
142 1HB CYS 20 HB2 CYS 20 -2.558 -7.736 3.021
143 2HB CYS 20 HB1 CYS 20 -2.472 -8.648 1.519
144 H ASN 21 H ASN 21 -5.080 -8.662 0.286
145 HA ASN 21 HA ASN 21 -7.517 -8.283 1.767
146 1HB ASN 21 HB2 ASN 21 -6.576 -9.972 -0.380
147 2HB ASN 21 HB1 ASN 21 -7.471 -10.937 0.796
148 1HD2 ASN 21 HD21 ASN 21 -8.032 -9.399 -2.010
149 2HD2 ASN 21 HD22 ASN 21 -9.605 -8.815 -1.747
150 1H PHE 1 HT1 PHE 1 13.232 1.458 2.778
151 2H PHE 1 HT2 PHE 1 14.178 2.737 2.183
152 3H PHE 1 HT3 PHE 1 14.807 1.688 3.361
153 HA PHE 1 HA PHE 1 15.743 1.149 1.224
154 1HB PHE 1 HB2 PHE 1 13.922 -1.129 1.369
155 2HB PHE 1 HB1 PHE 1 15.654 -1.062 1.678
156 HD1 PHE 1 HD1 PHE 1 12.309 -0.444 3.190
157 HD2 PHE 1 HD2 PHE 1 16.514 -0.983 3.903
158 HE1 PHE 1 HE1 PHE 1 11.874 -0.615 5.628
159 HE2 PHE 1 HE2 PHE 1 16.078 -1.153 6.340
160 HZ PHE 1 HZ PHE 1 13.759 -0.970 7.202
161 H VAL 2 H VAL 2 12.235 1.446 1.224
162 HA VAL 2 HA VAL 2 12.190 0.944 -1.697
163 HB VAL 2 HB VAL 2 9.854 1.461 0.141
164 1HG1 VAL 2 HG11 VAL 2 9.239 1.762 -2.159
165 2HG1 VAL 2 HG12 VAL 2 8.698 0.145 -1.714
166 3HG1 VAL 2 HG13 VAL 2 10.172 0.352 -2.660
167 1HG2 VAL 2 HG21 VAL 2 10.335 -0.566 1.028
168 2HG2 VAL 2 HG22 VAL 2 11.626 -0.836 -0.142
169 3HG2 VAL 2 HG23 VAL 2 9.963 -1.253 -0.553
170 H ASN 3 H ASN 3 10.907 3.383 0.589
171 HA ASN 3 HA ASN 3 10.299 5.634 0.171
172 1HB ASN 3 HB2 ASN 3 12.211 6.955 -0.631
173 2HB ASN 3 HB1 ASN 3 12.727 5.745 0.543
174 1HD2 ASN 3 HD21 ASN 3 12.984 6.748 -2.811
175 2HD2 ASN 3 HD22 ASN 3 14.082 5.544 -3.287
176 H GLN 4 H GLN 4 9.546 3.638 -2.080
177 HA GLN 4 HA GLN 4 9.698 5.547 -4.335
178 1HB GLN 4 HB2 GLN 4 9.635 2.617 -4.171
179 2HB GLN 4 HB1 GLN 4 8.587 3.286 -5.420
180 1HG GLN 4 HG2 GLN 4 11.265 4.527 -5.248
181 2HG GLN 4 HG1 GLN 4 11.258 2.838 -5.753
182 1HE2 GLN 4 HE21 GLN 4 11.354 5.778 -7.126
183 2HE2 GLN 4 HE22 GLN 4 10.414 5.515 -8.515
184 H HIS 5 H HIS 5 7.891 6.250 -5.479
185 HA HIS 5 HA HIS 5 5.312 5.917 -4.034
186 1HB HIS 5 HB2 HIS 5 4.702 7.969 -5.522
187 2HB HIS 5 HB1 HIS 5 5.744 8.219 -4.122
188 HD2 HIS 5 HD2 HIS 5 5.777 9.050 -7.779
189 HE1 HIS 5 HE1 HIS 5 9.848 8.828 -6.660
190 HE2 HIS 5 HE2 HIS 5 8.225 9.575 -8.482
191 H LEU 6 H LEU 6 3.383 5.422 -5.283
192 HA LEU 6 HA LEU 6 3.847 4.769 -8.091
193 1HB LEU 6 HB2 LEU 6 2.719 2.712 -6.236
194 2HB LEU 6 HB1 LEU 6 2.997 2.534 -7.957
195 HG LEU 6 HG LEU 6 5.451 3.234 -7.326
196 1HD1 LEU 6 HD11 LEU 6 4.080 2.693 -4.807
197 2HD1 LEU 6 HD12 LEU 6 5.613 3.515 -5.097
198 3HD1 LEU 6 HD13 LEU 6 5.556 1.755 -5.016
199 1HD2 LEU 6 HD21 LEU 6 4.211 0.919 -8.035
200 2HD2 LEU 6 HD22 LEU 6 4.849 0.470 -6.452
201 3HD2 LEU 6 HD23 LEU 6 5.942 1.039 -7.714
202 H CYS 7 H CYS 7 2.106 5.073 -9.429
203 HA CYS 7 HA CYS 7 -0.522 5.667 -8.122
204 1HB CYS 7 HB2 CYS 7 0.986 7.054 -10.310
205 2HB CYS 7 HB1 CYS 7 -0.772 7.023 -10.408
206 H GLY 8 H GLY 8 -2.404 5.257 -9.611
207 1HA GLY 8 HA2 GLY 8 -3.602 3.548 -10.746
208 2HA GLY 8 HA1 GLY 8 -2.526 4.042 -12.051
209 H SER 9 H SER 9 -1.861 2.143 -12.997
210 HA SER 9 HA SER 9 -1.683 -0.408 -11.922
211 1HB SER 9 HB2 SER 9 -1.194 0.060 -14.292
212 2HB SER 9 HB1 SER 9 0.297 0.883 -13.839
213 HG SER 9 HG SER 9 -0.102 -1.704 -12.879
214 H ASP 10 H ASP 10 0.971 2.012 -11.918
215 HA ASP 10 HA ASP 10 2.909 0.669 -10.437
216 1HB ASP 10 HB2 ASP 10 2.358 3.352 -11.115
217 2HB ASP 10 HB1 ASP 10 2.572 3.340 -9.372
218 H LEU 11 H LEU 11 -0.105 2.121 -9.278
219 HA LEU 11 HA LEU 11 0.377 1.622 -6.488
220 1HB LEU 11 HB2 LEU 11 -1.553 2.941 -7.944
221 2HB LEU 11 HB1 LEU 11 -2.406 1.459 -7.540
222 HG LEU 11 HG LEU 11 -2.937 2.494 -5.611
223 1HD1 LEU 11 HD11 LEU 11 -0.146 2.615 -4.624
224 2HD1 LEU 11 HD12 LEU 11 -0.772 1.029 -5.074
225 3HD1 LEU 11 HD13 LEU 11 -1.594 1.982 -3.849
226 1HD2 LEU 11 HD21 LEU 11 -2.618 4.688 -5.942
227 2HD2 LEU 11 HD22 LEU 11 -1.050 4.435 -6.708
228 3HD2 LEU 11 HD23 LEU 11 -1.177 4.476 -4.948
229 1HN ABA 12 H ABA 12 -1.401 -0.026 -9.052
230 HA ABA 12 HA ABA 12 -2.178 -2.335 -7.541
231 1HB ABA 12 HB1 ABA 12 -1.679 -2.445 -10.506
232 2HB ABA 12 HB2 ABA 12 -2.958 -1.401 -9.897
233 1HG ABA 12 HG1 ABA 12 -3.744 -3.687 -10.509
234 2HG ABA 12 HG2 ABA 12 -4.052 -3.262 -8.826
235 3HG ABA 12 HG3 ABA 12 -2.713 -4.336 -9.235
236 H GLU 13 H GLU 13 0.881 -1.322 -8.614
237 HA GLU 13 HA GLU 13 1.914 -4.060 -8.987
238 1HB GLU 13 HB2 GLU 13 2.846 -1.375 -9.638
239 2HB GLU 13 HB1 GLU 13 4.093 -2.361 -8.883
240 1HG GLU 13 HG2 GLU 13 2.638 -3.941 -10.811
241 2HG GLU 13 HG1 GLU 13 3.233 -2.467 -11.575
242 H ALA 14 H ALA 14 2.722 -1.271 -6.873
243 HA ALA 14 HA ALA 14 4.438 -2.609 -5.113
244 1HB ALA 14 HB1 ALA 14 3.993 -0.206 -4.898
245 2HB ALA 14 HB2 ALA 14 3.635 -1.007 -3.371
246 3HB ALA 14 HB3 ALA 14 2.321 -0.534 -4.447
247 H LEU 15 H LEU 15 0.902 -2.424 -5.105
248 HA LEU 15 HA LEU 15 0.461 -4.143 -2.844
249 1HB LEU 15 HB2 LEU 15 -1.236 -3.839 -5.335
250 2HB LEU 15 HB1 LEU 15 -1.794 -4.489 -3.802
251 HG LEU 15 HG LEU 15 -1.074 -1.642 -4.523
252 1HD1 LEU 15 HD11 LEU 15 -3.286 -1.203 -4.141
253 2HD1 LEU 15 HD12 LEU 15 -3.445 -2.495 -2.952
254 3HD1 LEU 15 HD13 LEU 15 -3.401 -2.880 -4.672
255 1HD2 LEU 15 HD21 LEU 15 -1.920 -1.828 -1.797
256 2HD2 LEU 15 HD22 LEU 15 -0.440 -1.129 -2.444
257 3HD2 LEU 15 HD23 LEU 15 -0.489 -2.836 -2.011
258 H TYR 16 H TYR 16 0.997 -4.690 -6.287
259 HA TYR 16 HA TYR 16 0.518 -7.556 -6.200
260 1HB TYR 16 HB2 TYR 16 1.238 -5.535 -8.170
261 2HB TYR 16 HB1 TYR 16 2.152 -7.020 -8.400
262 HD1 TYR 16 HD1 TYR 16 -0.350 -5.567 -9.906
263 HD2 TYR 16 HD2 TYR 16 0.184 -9.038 -7.430
264 HE1 TYR 16 HE1 TYR 16 -2.336 -6.619 -10.954
265 HE2 TYR 16 HE2 TYR 16 -1.801 -10.093 -8.481
266 HH TYR 16 HH TYR 16 -3.111 -9.135 -11.304
267 H LEU 17 H LEU 17 3.289 -5.466 -5.663
268 HA LEU 17 HA LEU 17 5.139 -7.795 -5.741
269 1HB LEU 17 HB2 LEU 17 5.382 -4.910 -6.013
270 2HB LEU 17 HB1 LEU 17 6.546 -5.561 -4.856
271 HG LEU 17 HG LEU 17 7.430 -5.583 -7.181
272 1HD1 LEU 17 HD11 LEU 17 7.406 -7.680 -5.291
273 2HD1 LEU 17 HD12 LEU 17 8.599 -7.407 -6.561
274 3HD1 LEU 17 HD13 LEU 17 7.206 -8.446 -6.868
275 1HD2 LEU 17 HD21 LEU 17 6.387 -6.739 -8.919
276 2HD2 LEU 17 HD22 LEU 17 4.995 -6.096 -8.047
277 3HD2 LEU 17 HD23 LEU 17 5.482 -7.775 -7.815
278 H VAL 18 H VAL 18 3.340 -5.878 -3.548
279 HA VAL 18 HA VAL 18 5.035 -6.381 -1.231
280 HB VAL 18 HB VAL 18 2.248 -5.281 -1.617
281 1HG1 VAL 18 HG11 VAL 18 3.609 -6.260 0.774
282 2HG1 VAL 18 HG12 VAL 18 1.930 -5.755 0.574
283 3HG1 VAL 18 HG13 VAL 18 3.179 -4.555 0.910
284 1HG2 VAL 18 HG21 VAL 18 3.308 -3.328 -1.876
285 2HG2 VAL 18 HG22 VAL 18 4.841 -4.190 -1.865
286 3HG2 VAL 18 HG23 VAL 18 4.176 -3.552 -0.362
287 H CYS 19 H CYS 19 1.655 -7.316 -1.943
288 HA CYS 19 HA CYS 19 2.118 -9.777 -0.313
289 1HB CYS 19 HB2 CYS 19 -0.355 -8.166 -0.945
290 2HB CYS 19 HB1 CYS 19 -0.465 -9.816 -0.333
291 H GLY 20 H GLY 20 -0.238 -8.997 -2.875
292 1HA GLY 20 HA2 GLY 20 -0.642 -10.078 -4.929
293 2HA GLY 20 HA1 GLY 20 0.919 -10.883 -4.758
294 H GLU 21 H GLU 21 0.844 -12.482 -2.720
295 HA GLU 21 HA GLU 21 -1.139 -14.483 -3.413
296 1HB GLU 21 HB2 GLU 21 0.263 -14.816 -0.832
297 2HB GLU 21 HB1 GLU 21 0.121 -15.933 -2.185
298 1HG GLU 21 HG2 GLU 21 2.055 -13.624 -1.886
299 2HG GLU 21 HG1 GLU 21 2.433 -15.337 -2.048
300 H ARG 22 H ARG 22 -0.664 -12.286 -0.656
301 HA ARG 22 HA ARG 22 -2.949 -13.249 0.818
302 1HB ARG 22 HB2 ARG 22 -1.029 -11.016 1.020
303 2HB ARG 22 HB1 ARG 22 -2.631 -10.662 1.668
304 1HG ARG 22 HG2 ARG 22 -2.453 -12.925 2.882
305 2HG ARG 22 HG1 ARG 22 -0.736 -12.868 2.482
306 1HD ARG 22 HD2 ARG 22 -1.393 -10.314 3.504
307 2HD ARG 22 HD1 ARG 22 -2.141 -11.487 4.587
308 HE ARG 22 HE ARG 22 0.550 -12.297 4.024
309 1HH1 ARG 22 HH21 ARG 22 -1.194 -11.679 6.627
310 2HH1 ARG 22 HH22 ARG 22 -0.076 -10.644 7.449
311 1HH2 ARG 22 HH11 ARG 22 1.962 -10.205 4.678
312 2HH2 ARG 22 HH12 ARG 22 1.711 -9.807 6.344
313 H GLY 23 H GLY 23 -2.592 -11.203 -1.924
314 1HA GLY 23 HA2 GLY 23 -4.430 -10.527 -3.311
315 2HA GLY 23 HA1 GLY 23 -5.519 -10.783 -1.956
316 H PHE 24 H PHE 24 -5.242 -8.325 -3.663
317 HA PHE 24 HA PHE 24 -4.859 -6.457 -1.377
318 1HB PHE 24 HB2 PHE 24 -3.583 -4.879 -2.726
319 2HB PHE 24 HB1 PHE 24 -2.741 -6.421 -2.683
320 HD1 PHE 24 HD1 PHE 24 -4.781 -4.146 -4.791
321 HD2 PHE 24 HD2 PHE 24 -2.533 -7.810 -4.669
322 HE1 PHE 24 HE1 PHE 24 -4.843 -4.277 -7.257
323 HE2 PHE 24 HE2 PHE 24 -2.602 -7.936 -7.132
324 HZ PHE 24 HZ PHE 24 -3.752 -6.160 -8.434
325 H PHE 25 H PHE 25 -6.582 -5.089 -1.264
326 HA PHE 25 HA PHE 25 -8.400 -4.971 -3.610
327 1HB PHE 25 HB2 PHE 25 -10.011 -3.954 -2.008
328 2HB PHE 25 HB1 PHE 25 -9.442 -5.533 -1.469
329 HD1 PHE 25 HD1 PHE 25 -8.954 -1.865 -1.042
330 HD2 PHE 25 HD2 PHE 25 -8.243 -5.784 0.575
331 HE1 PHE 25 HE1 PHE 25 -8.136 -0.847 1.067
332 HE2 PHE 25 HE2 PHE 25 -7.425 -4.765 2.685
333 HZ PHE 25 HZ PHE 25 -7.371 -2.296 2.930
334 H TYR 26 H TYR 26 -8.575 -3.144 -4.826
335 HA TYR 26 HA TYR 26 -7.113 -0.719 -3.865
336 1HB TYR 26 HB2 TYR 26 -6.020 -1.408 -5.830
337 2HB TYR 26 HB1 TYR 26 -7.520 -1.916 -6.600
338 HD1 TYR 26 HD1 TYR 26 -6.352 1.252 -4.958
339 HD2 TYR 26 HD2 TYR 26 -8.028 -0.615 -8.443
340 HE1 TYR 26 HE1 TYR 26 -6.530 3.472 -6.061
341 HE2 TYR 26 HE2 TYR 26 -8.207 1.601 -9.550
342 HH TYR 26 HH TYR 26 -6.899 3.914 -9.254
343 H THR 27 H THR 27 -8.671 0.582 -2.974
344 HA THR 27 HA THR 27 -11.293 0.828 -4.353
345 HB THR 27 HB THR 27 -11.822 2.217 -2.249
346 HG1 THR 27 HG1 THR 27 -10.399 2.075 -0.606
347 1HG2 THR 27 HG21 THR 27 -12.766 0.067 -2.320
348 2HG2 THR 27 HG22 THR 27 -11.835 0.043 -0.822
349 3HG2 THR 27 HG23 THR 27 -11.191 -0.726 -2.273
350 H LYS 28 H LYS 28 -12.177 3.080 -4.588
351 HA LYS 28 HA LYS 28 -10.005 5.087 -5.028
352 1HB LYS 28 HB2 LYS 28 -10.863 3.996 -7.166
353 2HB LYS 28 HB1 LYS 28 -12.413 4.767 -6.832
354 1HG LYS 28 HG2 LYS 28 -11.558 6.922 -7.130
355 2HG LYS 28 HG1 LYS 28 -9.899 6.412 -6.817
356 1HD LYS 28 HD2 LYS 28 -10.208 4.966 -8.974
357 2HD LYS 28 HD1 LYS 28 -11.541 6.069 -9.313
358 1HE LYS 28 HE2 LYS 28 -9.280 7.613 -8.466
359 2HE LYS 28 HE1 LYS 28 -8.758 6.509 -9.738
360 1HZ LYS 28 HZ1 LYS 28 -9.737 8.752 -10.416
361 2HZ LYS 28 HZ2 LYS 28 -11.243 8.077 -10.012
362 3HZ LYS 28 HZ3 LYS 28 -10.291 7.368 -11.228
363 HA PRO 29 HA PRO 29 -13.437 6.837 -2.480
364 1HB PRO 29 HB2 PRO 29 -11.823 7.606 -0.391
365 2HB PRO 29 HB1 PRO 29 -12.597 6.016 -0.496
366 1HG PRO 29 HG2 PRO 29 -9.739 6.739 -0.925
367 2HG PRO 29 HG1 PRO 29 -10.441 5.192 -0.425
368 1HD PRO 29 HD2 PRO 29 -9.519 5.845 -3.029
369 2HD PRO 29 HD1 PRO 29 -10.489 4.424 -2.583
370 H THR 30 H THR 30 -12.976 8.334 -4.504
371 HA THR 30 HA THR 30 -12.573 10.507 -5.296
372 HB THR 30 HB THR 30 -12.219 11.287 -2.396
373 HG1 THR 30 HG1 THR 30 -14.671 11.097 -3.787
374 1HG2 THR 30 HG21 THR 30 -12.174 12.734 -4.767
375 2HG2 THR 30 HG22 THR 30 -12.446 13.400 -3.157
376 3HG2 THR 30 HG23 THR 30 -13.818 12.964 -4.174
Start of MODEL 5
1 1H GLY 1 HT1 GLY 1 -8.558 5.314 0.786
2 2H GLY 1 HT2 GLY 1 -7.715 5.305 2.260
3 3H GLY 1 HT3 GLY 1 -7.115 4.432 0.933
4 1HA GLY 1 HA1 GLY 1 -6.916 6.678 -0.181
5 2HA GLY 1 HA2 GLY 1 -7.189 7.421 1.424
6 H ILE 2 H ILE 2 -5.766 5.084 -1.006
7 HA ILE 2 HA ILE 2 -2.998 5.750 -0.112
8 HB ILE 2 HB ILE 2 -3.896 3.296 -0.392
9 1HG1 ILE 2 HG12 ILE 2 -1.283 4.078 -1.708
10 2HG1 ILE 2 HG11 ILE 2 -1.530 4.060 0.038
11 1HG2 ILE 2 HG21 ILE 2 -3.629 2.361 -2.613
12 2HG2 ILE 2 HG22 ILE 2 -3.058 3.906 -3.244
13 3HG2 ILE 2 HG23 ILE 2 -4.737 3.729 -2.735
14 1HD1 ILE 2 HD11 ILE 2 -1.477 1.787 0.146
15 2HD1 ILE 2 HD12 ILE 2 -0.663 1.909 -1.413
16 3HD1 ILE 2 HD13 ILE 2 -2.398 1.602 -1.346
17 H VAL 3 H VAL 3 -5.213 6.027 -2.785
18 HA VAL 3 HA VAL 3 -3.304 6.636 -4.842
19 HB VAL 3 HB VAL 3 -6.029 7.891 -4.765
20 1HG1 VAL 3 HG11 VAL 3 -5.957 7.395 -7.147
21 2HG1 VAL 3 HG12 VAL 3 -4.471 6.467 -6.941
22 3HG1 VAL 3 HG13 VAL 3 -4.464 8.213 -6.686
23 1HG2 VAL 3 HG21 VAL 3 -6.651 5.524 -5.822
24 2HG2 VAL 3 HG22 VAL 3 -6.760 5.808 -4.084
25 3HG2 VAL 3 HG23 VAL 3 -5.355 4.980 -4.755
26 H GLU 4 H GLU 4 -4.130 8.319 -2.047
27 HA GLU 4 HA GLU 4 -3.389 10.925 -3.288
28 1HB GLU 4 HB2 GLU 4 -5.536 10.909 -2.082
29 2HB GLU 4 HB1 GLU 4 -4.715 10.354 -0.623
30 1HG GLU 4 HG2 GLU 4 -5.062 12.784 -0.530
31 2HG GLU 4 HG1 GLU 4 -3.340 12.416 -0.625
32 H GLN 5 H GLN 5 -2.129 8.444 -1.310
33 HA GLN 5 HA GLN 5 -0.203 10.326 -0.029
34 1HB GLN 5 HB2 GLN 5 -1.602 8.072 0.927
35 2HB GLN 5 HB1 GLN 5 0.092 7.591 0.833
36 1HG GLN 5 HG2 GLN 5 0.786 9.396 2.231
37 2HG GLN 5 HG1 GLN 5 -0.780 10.196 2.096
38 1HE2 GLN 5 HE21 GLN 5 -0.091 6.726 2.746
39 2HE2 GLN 5 HE22 GLN 5 -0.885 6.694 4.246
40 H CYS 6 H CYS 6 -0.098 7.065 -1.546
41 HA CYS 6 HA CYS 6 2.787 7.361 -1.966
42 1HB CYS 6 HB2 CYS 6 1.281 5.192 -3.343
43 2HB CYS 6 HB1 CYS 6 2.818 5.124 -2.497
44 H CYS 7 H CYS 7 -0.083 8.034 -3.763
45 HA CYS 7 HA CYS 7 1.276 8.005 -6.369
46 1HB CYS 7 HB2 CYS 7 -1.121 7.525 -6.291
47 2HB CYS 7 HB1 CYS 7 -1.423 9.069 -5.498
48 H THR 8 H THR 8 0.220 10.352 -3.947
49 HA THR 8 HA THR 8 1.483 12.550 -5.497
50 HB THR 8 HB THR 8 -0.336 12.465 -3.079
51 HG1 THR 8 HG1 THR 8 -1.650 12.671 -4.699
52 1HG2 THR 8 HG21 THR 8 1.049 14.218 -2.423
53 2HG2 THR 8 HG22 THR 8 -0.135 15.072 -3.412
54 3HG2 THR 8 HG23 THR 8 1.444 14.662 -4.083
55 H SER 9 H SER 9 1.942 10.498 -2.732
56 HA SER 9 HA SER 9 4.516 11.904 -2.175
57 1HB SER 9 HB2 SER 9 2.309 11.226 -0.284
58 2HB SER 9 HB1 SER 9 3.958 10.985 0.284
59 HG SER 9 HG SER 9 4.363 13.106 0.032
60 H ILE 10 H ILE 10 5.546 10.169 -0.299
61 HA ILE 10 HA ILE 10 5.818 7.678 -1.907
62 HB ILE 10 HB ILE 10 7.554 8.941 0.216
63 1HG1 ILE 10 HG12 ILE 10 7.547 8.683 -2.763
64 2HG1 ILE 10 HG11 ILE 10 8.067 10.034 -1.759
65 1HG2 ILE 10 HG21 ILE 10 7.936 6.306 -1.247
66 2HG2 ILE 10 HG22 ILE 10 7.512 6.466 0.458
67 3HG2 ILE 10 HG23 ILE 10 9.077 7.038 -0.119
68 1HD1 ILE 10 HD11 ILE 10 10.008 9.013 -2.830
69 2HD1 ILE 10 HD12 ILE 10 9.564 7.434 -2.183
70 3HD1 ILE 10 HD13 ILE 10 10.073 8.723 -1.091
71 H CYS 11 H CYS 11 5.836 5.593 -0.771
72 HA CYS 11 HA CYS 11 4.508 5.658 1.898
73 1HB CYS 11 HB2 CYS 11 3.720 4.097 -0.511
74 2HB CYS 11 HB1 CYS 11 3.309 3.532 1.095
75 H SER 12 H SER 12 5.037 3.886 3.269
76 HA SER 12 HA SER 12 7.505 2.445 2.431
77 1HB SER 12 HB2 SER 12 6.954 1.934 5.152
78 2HB SER 12 HB1 SER 12 8.192 3.007 4.502
79 HG SER 12 HG SER 12 6.386 3.835 5.977
80 H LEU 13 H LEU 13 7.488 0.238 2.249
81 HA LEU 13 HA LEU 13 5.485 -1.384 1.565
82 1HB LEU 13 HB2 LEU 13 6.823 -2.870 3.673
83 2HB LEU 13 HB1 LEU 13 6.821 -3.154 1.942
84 HG LEU 13 HG LEU 13 9.090 -2.774 2.786
85 1HD1 LEU 13 HD11 LEU 13 9.221 -0.389 1.370
86 2HD1 LEU 13 HD12 LEU 13 7.771 -1.171 0.744
87 3HD1 LEU 13 HD13 LEU 13 9.320 -2.011 0.687
88 1HD2 LEU 13 HD21 LEU 13 9.041 0.023 3.283
89 2HD2 LEU 13 HD22 LEU 13 9.426 -1.270 4.419
90 3HD2 LEU 13 HD23 LEU 13 7.766 -0.702 4.260
91 H TYR 14 H TYR 14 6.091 -0.607 4.988
92 HA TYR 14 HA TYR 14 4.110 -2.143 6.199
93 1HB TYR 14 HB2 TYR 14 5.666 -0.770 7.496
94 2HB TYR 14 HB1 TYR 14 4.914 0.695 6.868
95 HD1 TYR 14 HD1 TYR 14 3.693 -2.534 8.365
96 HD2 TYR 14 HD2 TYR 14 3.520 1.760 8.392
97 HE1 TYR 14 HE1 TYR 14 2.015 -2.612 10.192
98 HE2 TYR 14 HE2 TYR 14 1.842 1.681 10.217
99 HH TYR 14 HH TYR 14 1.326 -0.243 12.152
100 H GLN 15 H GLN 15 3.748 1.007 4.666
101 HA GLN 15 HA GLN 15 0.909 1.144 5.200
102 1HB GLN 15 HB2 GLN 15 2.750 2.664 3.337
103 2HB GLN 15 HB1 GLN 15 1.012 2.963 3.381
104 1HG GLN 15 HG2 GLN 15 1.073 3.787 5.563
105 2HG GLN 15 HG1 GLN 15 2.577 2.947 5.944
106 1HE2 GLN 15 HE21 GLN 15 3.092 5.330 6.685
107 2HE2 GLN 15 HE22 GLN 15 3.789 6.339 5.510
108 H LEU 16 H LEU 16 2.898 -0.200 2.565
109 HA LEU 16 HA LEU 16 0.517 -0.641 0.938
110 1HB LEU 16 HB2 LEU 16 3.113 -0.360 0.273
111 2HB LEU 16 HB1 LEU 16 2.952 -2.101 0.254
112 HG LEU 16 HG LEU 16 2.493 -0.974 -1.912
113 1HD1 LEU 16 HD11 LEU 16 0.570 -2.373 -2.398
114 2HD1 LEU 16 HD12 LEU 16 0.180 -2.482 -0.690
115 3HD1 LEU 16 HD13 LEU 16 1.652 -3.231 -1.309
116 1HD2 LEU 16 HD21 LEU 16 -0.186 -0.221 -0.827
117 2HD2 LEU 16 HD22 LEU 16 0.682 0.441 -2.211
118 3HD2 LEU 16 HD23 LEU 16 1.165 0.884 -0.573
119 H GLU 17 H GLU 17 2.196 -2.230 3.444
120 HA GLU 17 HA GLU 17 1.275 -4.927 2.773
121 1HB GLU 17 HB2 GLU 17 3.243 -4.002 4.416
122 2HB GLU 17 HB1 GLU 17 1.952 -4.282 5.586
123 1HG GLU 17 HG2 GLU 17 1.916 -6.519 3.872
124 2HG GLU 17 HG1 GLU 17 3.619 -6.218 4.224
125 H ASN 18 H ASN 18 -0.485 -2.350 3.314
126 HA ASN 18 HA ASN 18 -2.336 -3.732 5.212
127 1HB ASN 18 HB2 ASN 18 -1.331 -1.194 5.438
128 2HB ASN 18 HB1 ASN 18 -2.853 -0.890 4.599
129 1HD2 ASN 18 HD21 ASN 18 -1.946 -0.509 7.555
130 2HD2 ASN 18 HD22 ASN 18 -3.192 -1.242 8.445
131 H TYR 19 H TYR 19 -1.966 -3.878 2.128
132 HA TYR 19 HA TYR 19 -4.875 -3.582 1.568
133 1HB TYR 19 HB2 TYR 19 -2.583 -2.419 0.015
134 2HB TYR 19 HB1 TYR 19 -4.052 -2.908 -0.826
135 HD1 TYR 19 HD1 TYR 19 -2.497 -0.203 0.699
136 HD2 TYR 19 HD2 TYR 19 -6.300 -2.196 0.534
137 HE1 TYR 19 HE1 TYR 19 -3.619 1.881 1.444
138 HE2 TYR 19 HE2 TYR 19 -7.425 -0.113 1.281
139 HH TYR 19 HH TYR 19 -6.602 2.013 2.693
140 H CYS 20 H CYS 20 -3.260 -5.943 2.209
141 HA CYS 20 HA CYS 20 -3.283 -7.341 -0.424
142 1HB CYS 20 HB2 CYS 20 -2.141 -8.592 2.036
143 2HB CYS 20 HB1 CYS 20 -1.657 -8.788 0.358
144 H ASN 21 H ASN 21 -4.290 -9.476 -0.519
145 HA ASN 21 HA ASN 21 -6.299 -9.911 1.662
146 1HB ASN 21 HB2 ASN 21 -6.755 -9.331 -1.107
147 2HB ASN 21 HB1 ASN 21 -7.288 -10.979 -0.786
148 1HD2 ASN 21 HD21 ASN 21 -9.245 -9.061 -1.353
149 2HD2 ASN 21 HD22 ASN 21 -10.117 -8.694 0.056
150 1H PHE 1 HT1 PHE 1 11.558 0.424 5.422
151 2H PHE 1 HT2 PHE 1 10.832 0.807 3.935
152 3H PHE 1 HT3 PHE 1 12.070 1.790 4.557
153 HA PHE 1 HA PHE 1 13.699 0.109 4.238
154 1HB PHE 1 HB2 PHE 1 11.890 -1.700 4.793
155 2HB PHE 1 HB1 PHE 1 11.591 -1.690 3.056
156 HD1 PHE 1 HD1 PHE 1 13.833 -2.740 5.714
157 HD2 PHE 1 HD2 PHE 1 13.483 -2.195 1.465
158 HE1 PHE 1 HE1 PHE 1 15.819 -4.184 5.365
159 HE2 PHE 1 HE2 PHE 1 15.469 -3.640 1.116
160 HZ PHE 1 HZ PHE 1 16.637 -4.634 3.066
161 H VAL 2 H VAL 2 10.976 -0.175 1.916
162 HA VAL 2 HA VAL 2 12.833 0.610 -0.248
163 HB VAL 2 HB VAL 2 9.908 -0.154 -0.461
164 1HG1 VAL 2 HG11 VAL 2 11.491 1.003 -2.337
165 2HG1 VAL 2 HG12 VAL 2 10.212 -0.147 -2.730
166 3HG1 VAL 2 HG13 VAL 2 11.883 -0.695 -2.608
167 1HG2 VAL 2 HG21 VAL 2 11.435 -1.887 0.642
168 2HG2 VAL 2 HG22 VAL 2 12.301 -1.956 -0.893
169 3HG2 VAL 2 HG23 VAL 2 10.600 -2.414 -0.820
170 H ASN 3 H ASN 3 10.049 1.839 1.510
171 HA ASN 3 HA ASN 3 8.851 3.866 1.270
172 1HB ASN 3 HB2 ASN 3 10.451 5.832 1.248
173 2HB ASN 3 HB1 ASN 3 10.757 4.641 2.513
174 1HD2 ASN 3 HD21 ASN 3 11.854 5.632 -0.757
175 2HD2 ASN 3 HD22 ASN 3 13.415 4.985 -0.598
176 H GLN 4 H GLN 4 8.737 2.547 -1.168
177 HA GLN 4 HA GLN 4 9.518 4.558 -3.214
178 1HB GLN 4 HB2 GLN 4 9.178 1.675 -3.185
179 2HB GLN 4 HB1 GLN 4 8.215 2.405 -4.468
180 1HG GLN 4 HG2 GLN 4 10.753 3.713 -4.432
181 2HG GLN 4 HG1 GLN 4 11.039 1.973 -4.416
182 1HE2 GLN 4 HE21 GLN 4 9.378 0.780 -6.049
183 2HE2 GLN 4 HE22 GLN 4 9.270 1.500 -7.582
184 H HIS 5 H HIS 5 7.913 5.357 -4.720
185 HA HIS 5 HA HIS 5 5.174 5.403 -3.538
186 1HB HIS 5 HB2 HIS 5 4.902 7.563 -4.409
187 2HB HIS 5 HB1 HIS 5 6.603 7.557 -3.966
188 HD2 HIS 5 HD2 HIS 5 8.375 7.849 -6.096
189 HE1 HIS 5 HE1 HIS 5 5.473 7.758 -9.170
190 HE2 HIS 5 HE2 HIS 5 7.937 8.156 -8.644
191 H LEU 6 H LEU 6 3.350 5.036 -4.938
192 HA LEU 6 HA LEU 6 3.935 4.274 -7.718
193 1HB LEU 6 HB2 LEU 6 2.497 2.319 -5.936
194 2HB LEU 6 HB1 LEU 6 3.013 2.079 -7.593
195 HG LEU 6 HG LEU 6 5.388 2.530 -6.727
196 1HD1 LEU 6 HD11 LEU 6 4.720 1.397 -4.176
197 2HD1 LEU 6 HD12 LEU 6 3.846 2.912 -4.413
198 3HD1 LEU 6 HD13 LEU 6 5.606 2.880 -4.534
199 1HD2 LEU 6 HD21 LEU 6 4.402 0.013 -5.509
200 2HD2 LEU 6 HD22 LEU 6 5.657 0.254 -6.724
201 3HD2 LEU 6 HD23 LEU 6 3.958 0.253 -7.199
202 H CYS 7 H CYS 7 2.347 5.048 -9.005
203 HA CYS 7 HA CYS 7 -0.328 5.585 -7.772
204 1HB CYS 7 HB2 CYS 7 1.132 7.565 -8.578
205 2HB CYS 7 HB1 CYS 7 0.770 6.994 -10.205
206 H GLY 8 H GLY 8 -2.150 5.426 -9.388
207 1HA GLY 8 HA2 GLY 8 -3.360 3.979 -10.811
208 2HA GLY 8 HA1 GLY 8 -2.074 4.372 -11.950
209 H SER 9 H SER 9 -1.699 2.353 -12.875
210 HA SER 9 HA SER 9 -1.845 -0.182 -11.773
211 1HB SER 9 HB2 SER 9 -1.210 -0.236 -14.008
212 2HB SER 9 HB1 SER 9 -0.007 1.034 -13.807
213 HG SER 9 HG SER 9 0.126 -1.680 -12.995
214 H ASP 10 H ASP 10 0.881 2.090 -11.482
215 HA ASP 10 HA ASP 10 2.709 0.550 -10.031
216 1HB ASP 10 HB2 ASP 10 2.336 3.276 -10.587
217 2HB ASP 10 HB1 ASP 10 2.417 3.166 -8.836
218 H LEU 11 H LEU 11 -0.299 2.075 -8.854
219 HA LEU 11 HA LEU 11 0.076 1.331 -6.098
220 1HB LEU 11 HB2 LEU 11 -1.981 2.542 -7.689
221 2HB LEU 11 HB1 LEU 11 -2.707 1.152 -6.904
222 HG LEU 11 HG LEU 11 -3.078 2.656 -5.238
223 1HD1 LEU 11 HD11 LEU 11 -0.230 2.633 -4.393
224 2HD1 LEU 11 HD12 LEU 11 -1.005 1.061 -4.587
225 3HD1 LEU 11 HD13 LEU 11 -1.683 2.246 -3.473
226 1HD2 LEU 11 HD21 LEU 11 -1.031 4.170 -6.715
227 2HD2 LEU 11 HD22 LEU 11 -1.113 4.532 -4.990
228 3HD2 LEU 11 HD23 LEU 11 -2.547 4.715 -6.000
229 1HN ABA 12 H ABA 12 -1.585 -0.142 -8.855
230 HA ABA 12 HA ABA 12 -2.498 -2.535 -7.677
231 1HB ABA 12 HB1 ABA 12 -1.336 -2.493 -10.458
232 2HB ABA 12 HB2 ABA 12 -2.800 -1.590 -10.108
233 1HG ABA 12 HG1 ABA 12 -3.938 -3.589 -9.374
234 2HG ABA 12 HG2 ABA 12 -2.459 -4.534 -9.552
235 3HG ABA 12 HG3 ABA 12 -3.259 -3.870 -10.978
236 H GLU 13 H GLU 13 0.710 -1.533 -8.638
237 HA GLU 13 HA GLU 13 1.821 -4.239 -8.438
238 1HB GLU 13 HB2 GLU 13 2.724 -1.714 -9.462
239 2HB GLU 13 HB1 GLU 13 3.915 -2.384 -8.353
240 1HG GLU 13 HG2 GLU 13 3.608 -4.596 -9.624
241 2HG GLU 13 HG1 GLU 13 2.783 -3.640 -10.857
242 H ALA 14 H ALA 14 2.159 -1.208 -6.606
243 HA ALA 14 HA ALA 14 3.926 -1.945 -4.623
244 1HB ALA 14 HB1 ALA 14 2.149 0.130 -4.951
245 2HB ALA 14 HB2 ALA 14 3.159 -0.104 -3.524
246 3HB ALA 14 HB3 ALA 14 1.494 -0.685 -3.532
247 H LEU 15 H LEU 15 0.553 -2.841 -4.917
248 HA LEU 15 HA LEU 15 0.641 -4.492 -2.470
249 1HB LEU 15 HB2 LEU 15 -1.570 -4.739 -4.457
250 2HB LEU 15 HB1 LEU 15 -1.676 -4.782 -2.710
251 HG LEU 15 HG LEU 15 -0.934 -2.226 -4.202
252 1HD1 LEU 15 HD11 LEU 15 -3.500 -1.756 -3.869
253 2HD1 LEU 15 HD12 LEU 15 -3.612 -3.515 -3.926
254 3HD1 LEU 15 HD13 LEU 15 -2.927 -2.630 -5.289
255 1HD2 LEU 15 HD21 LEU 15 -2.671 -1.694 -2.026
256 2HD2 LEU 15 HD22 LEU 15 -0.953 -1.324 -2.131
257 3HD2 LEU 15 HD23 LEU 15 -1.483 -2.852 -1.429
258 H TYR 16 H TYR 16 0.690 -4.859 -5.966
259 HA TYR 16 HA TYR 16 0.282 -7.671 -6.155
260 1HB TYR 16 HB2 TYR 16 0.982 -5.519 -7.832
261 2HB TYR 16 HB1 TYR 16 2.197 -6.753 -8.085
262 HD1 TYR 16 HD1 TYR 16 -1.437 -6.036 -8.141
263 HD2 TYR 16 HD2 TYR 16 1.685 -8.766 -9.254
264 HE1 TYR 16 HE1 TYR 16 -3.014 -7.223 -9.628
265 HE2 TYR 16 HE2 TYR 16 0.105 -9.964 -10.737
266 HH TYR 16 HH TYR 16 -3.333 -9.082 -10.864
267 H LEU 17 H LEU 17 3.214 -5.784 -5.478
268 HA LEU 17 HA LEU 17 4.763 -8.335 -5.457
269 1HB LEU 17 HB2 LEU 17 5.459 -5.448 -5.821
270 2HB LEU 17 HB1 LEU 17 6.687 -6.539 -5.191
271 HG LEU 17 HG LEU 17 6.963 -7.594 -7.204
272 1HD1 LEU 17 HD11 LEU 17 3.972 -7.293 -7.556
273 2HD1 LEU 17 HD12 LEU 17 4.887 -8.777 -7.292
274 3HD1 LEU 17 HD13 LEU 17 5.014 -7.925 -8.831
275 1HD2 LEU 17 HD21 LEU 17 6.680 -6.120 -9.084
276 2HD2 LEU 17 HD22 LEU 17 7.004 -5.104 -7.677
277 3HD2 LEU 17 HD23 LEU 17 5.358 -5.269 -8.289
278 H VAL 18 H VAL 18 3.810 -5.625 -3.405
279 HA VAL 18 HA VAL 18 5.562 -6.214 -1.227
280 HB VAL 18 HB VAL 18 2.855 -4.890 -1.409
281 1HG1 VAL 18 HG11 VAL 18 2.950 -5.788 0.813
282 2HG1 VAL 18 HG12 VAL 18 3.421 -4.093 0.944
283 3HG1 VAL 18 HG13 VAL 18 4.652 -5.356 0.980
284 1HG2 VAL 18 HG21 VAL 18 4.067 -2.868 -1.239
285 2HG2 VAL 18 HG22 VAL 18 5.057 -3.860 -2.310
286 3HG2 VAL 18 HG23 VAL 18 5.503 -3.680 -0.614
287 H CYS 19 H CYS 19 2.532 -7.623 -2.289
288 HA CYS 19 HA CYS 19 2.794 -9.640 -0.103
289 1HB CYS 19 HB2 CYS 19 0.258 -8.295 -1.087
290 2HB CYS 19 HB1 CYS 19 0.266 -9.748 -0.087
291 H GLY 20 H GLY 20 0.948 -9.014 -3.118
292 1HA GLY 20 HA2 GLY 20 1.886 -10.689 -4.940
293 2HA GLY 20 HA1 GLY 20 1.273 -11.885 -3.798
294 H GLU 21 H GLU 21 0.344 -11.506 -6.497
295 HA GLU 21 HA GLU 21 -2.054 -10.003 -6.690
296 1HB GLU 21 HB2 GLU 21 -2.681 -11.641 -8.478
297 2HB GLU 21 HB1 GLU 21 -1.038 -11.027 -8.661
298 1HG GLU 21 HG2 GLU 21 -0.281 -13.087 -7.340
299 2HG GLU 21 HG1 GLU 21 -1.909 -13.717 -7.594
300 H ARG 22 H ARG 22 -1.309 -12.741 -4.793
301 HA ARG 22 HA ARG 22 -3.481 -14.336 -4.561
302 1HB ARG 22 HB2 ARG 22 -1.586 -13.229 -2.614
303 2HB ARG 22 HB1 ARG 22 -3.127 -13.708 -1.903
304 1HG ARG 22 HG2 ARG 22 -2.935 -15.935 -2.918
305 2HG ARG 22 HG1 ARG 22 -1.413 -15.469 -3.680
306 1HD ARG 22 HD2 ARG 22 -0.826 -16.672 -1.692
307 2HD ARG 22 HD1 ARG 22 -0.538 -14.968 -1.342
308 HE ARG 22 HE ARG 22 -2.472 -14.974 0.095
309 1HH1 ARG 22 HH21 ARG 22 -1.189 -17.539 0.974
310 2HH1 ARG 22 HH22 ARG 22 -2.520 -18.647 0.918
311 1HH2 ARG 22 HH11 ARG 22 -4.499 -16.585 -1.045
312 2HH2 ARG 22 HH12 ARG 22 -4.391 -18.108 -0.226
313 H GLY 23 H GLY 23 -3.377 -10.994 -3.342
314 1HA GLY 23 HA2 GLY 23 -6.189 -10.644 -3.820
315 2HA GLY 23 HA1 GLY 23 -5.933 -11.017 -2.121
316 H PHE 24 H PHE 24 -6.634 -8.472 -3.814
317 HA PHE 24 HA PHE 24 -5.537 -6.612 -1.939
318 1HB PHE 24 HB2 PHE 24 -4.074 -5.319 -3.344
319 2HB PHE 24 HB1 PHE 24 -3.492 -6.968 -3.341
320 HD1 PHE 24 HD1 PHE 24 -3.095 -4.621 -5.388
321 HD2 PHE 24 HD2 PHE 24 -5.644 -8.077 -5.350
322 HE1 PHE 24 HE1 PHE 24 -3.179 -4.584 -7.835
323 HE2 PHE 24 HE2 PHE 24 -5.728 -8.033 -7.822
324 HZ PHE 24 HZ PHE 24 -4.494 -6.267 -9.067
325 H PHE 25 H PHE 25 -7.120 -5.085 -1.835
326 HA PHE 25 HA PHE 25 -8.912 -4.806 -4.196
327 1HB PHE 25 HB2 PHE 25 -10.176 -3.377 -2.273
328 2HB PHE 25 HB1 PHE 25 -10.403 -5.109 -2.498
329 HD1 PHE 25 HD1 PHE 25 -8.753 -2.509 -0.466
330 HD2 PHE 25 HD2 PHE 25 -9.418 -6.724 -0.969
331 HE1 PHE 25 HE1 PHE 25 -7.864 -2.921 1.813
332 HE2 PHE 25 HE2 PHE 25 -8.528 -7.137 1.309
333 HZ PHE 25 HZ PHE 25 -7.751 -5.235 2.701
334 H TYR 26 H TYR 26 -8.940 -2.986 -5.384
335 HA TYR 26 HA TYR 26 -7.555 -0.558 -4.304
336 1HB TYR 26 HB2 TYR 26 -6.162 -1.326 -6.062
337 2HB TYR 26 HB1 TYR 26 -7.534 -1.797 -7.059
338 HD1 TYR 26 HD1 TYR 26 -6.867 1.396 -5.208
339 HD2 TYR 26 HD2 TYR 26 -7.395 -0.519 -9.019
340 HE1 TYR 26 HE1 TYR 26 -6.807 3.608 -6.329
341 HE2 TYR 26 HE2 TYR 26 -7.334 1.695 -10.139
342 HH TYR 26 HH TYR 26 -6.533 3.935 -9.743
343 H THR 27 H THR 27 -9.865 -0.151 -3.529
344 HA THR 27 HA THR 27 -11.993 0.294 -5.387
345 HB THR 27 HB THR 27 -12.952 1.714 -3.521
346 HG1 THR 27 HG1 THR 27 -11.487 1.149 -1.546
347 1HG2 THR 27 HG21 THR 27 -12.153 -1.121 -3.419
348 2HG2 THR 27 HG22 THR 27 -13.737 -0.387 -3.164
349 3HG2 THR 27 HG23 THR 27 -12.562 -0.424 -1.851
350 H LYS 28 H LYS 28 -12.968 2.565 -5.691
351 HA LYS 28 HA LYS 28 -10.767 4.491 -6.330
352 1HB LYS 28 HB2 LYS 28 -13.322 3.827 -7.807
353 2HB LYS 28 HB1 LYS 28 -12.431 5.318 -8.108
354 1HG LYS 28 HG2 LYS 28 -10.567 4.187 -8.964
355 2HG LYS 28 HG1 LYS 28 -10.996 2.675 -8.162
356 1HD LYS 28 HD2 LYS 28 -12.892 2.371 -9.670
357 2HD LYS 28 HD1 LYS 28 -12.576 3.934 -10.426
358 1HE LYS 28 HE2 LYS 28 -11.380 2.691 -11.918
359 2HE LYS 28 HE1 LYS 28 -10.132 2.753 -10.672
360 1HZ LYS 28 HZ1 LYS 28 -11.185 0.688 -9.746
361 2HZ LYS 28 HZ2 LYS 28 -10.401 0.499 -11.239
362 3HZ LYS 28 HZ3 LYS 28 -12.096 0.591 -11.172
363 HA PRO 29 HA PRO 29 -13.376 6.669 -3.320
364 1HB PRO 29 HB2 PRO 29 -11.299 8.177 -2.329
365 2HB PRO 29 HB1 PRO 29 -11.683 6.542 -1.762
366 1HG PRO 29 HG2 PRO 29 -9.449 7.441 -3.522
367 2HG PRO 29 HG1 PRO 29 -9.534 6.038 -2.444
368 1HD PRO 29 HD2 PRO 29 -9.845 5.985 -5.256
369 2HD PRO 29 HD1 PRO 29 -10.261 4.670 -4.135
370 H THR 30 H THR 30 -10.733 8.262 -5.160
371 HA THR 30 HA THR 30 -12.690 10.421 -5.844
372 HB THR 30 HB THR 30 -9.690 10.748 -5.570
373 HG1 THR 30 HG1 THR 30 -10.128 10.713 -3.526
374 1HG2 THR 30 HG21 THR 30 -11.947 12.765 -5.718
375 2HG2 THR 30 HG22 THR 30 -10.874 12.352 -7.054
376 3HG2 THR 30 HG23 THR 30 -10.226 13.135 -5.613
Start of MODEL 6
1 1H GLY 1 HT1 GLY 1 -6.844 4.778 1.293
2 2H GLY 1 HT2 GLY 1 -8.428 4.616 0.701
3 3H GLY 1 HT3 GLY 1 -7.973 6.023 1.536
4 1HA GLY 1 HA1 GLY 1 -7.148 5.263 -1.150
5 2HA GLY 1 HA2 GLY 1 -8.011 6.759 -0.685
6 H ILE 2 H ILE 2 -5.369 4.229 -0.511
7 HA ILE 2 HA ILE 2 -3.072 5.805 -0.142
8 HB ILE 2 HB ILE 2 -3.045 3.281 -0.326
9 1HG1 ILE 2 HG12 ILE 2 -1.052 4.497 -2.227
10 2HG1 ILE 2 HG11 ILE 2 -1.030 4.908 -0.512
11 1HG2 ILE 2 HG21 ILE 2 -2.891 3.814 -3.308
12 2HG2 ILE 2 HG22 ILE 2 -4.377 3.297 -2.513
13 3HG2 ILE 2 HG23 ILE 2 -2.956 2.250 -2.498
14 1HD1 ILE 2 HD11 ILE 2 -1.302 2.039 -0.996
15 2HD1 ILE 2 HD12 ILE 2 -0.187 2.894 0.070
16 3HD1 ILE 2 HD13 ILE 2 0.200 2.702 -1.642
17 H VAL 3 H VAL 3 -5.157 5.675 -2.902
18 HA VAL 3 HA VAL 3 -3.411 6.564 -4.953
19 HB VAL 3 HB VAL 3 -6.171 7.713 -4.738
20 1HG1 VAL 3 HG11 VAL 3 -4.246 6.844 -6.848
21 2HG1 VAL 3 HG12 VAL 3 -5.276 8.274 -6.789
22 3HG1 VAL 3 HG13 VAL 3 -5.967 6.705 -7.205
23 1HG2 VAL 3 HG21 VAL 3 -6.720 5.342 -5.874
24 2HG2 VAL 3 HG22 VAL 3 -6.868 5.609 -4.136
25 3HG2 VAL 3 HG23 VAL 3 -5.426 4.830 -4.789
26 H GLU 4 H GLU 4 -4.377 8.113 -2.083
27 HA GLU 4 HA GLU 4 -3.623 10.775 -3.185
28 1HB GLU 4 HB2 GLU 4 -5.811 10.664 -2.033
29 2HB GLU 4 HB1 GLU 4 -5.010 10.066 -0.580
30 1HG GLU 4 HG2 GLU 4 -5.346 12.449 -0.318
31 2HG GLU 4 HG1 GLU 4 -3.624 12.166 -0.566
32 H GLN 5 H GLN 5 -2.439 8.176 -1.354
33 HA GLN 5 HA GLN 5 -0.592 9.877 0.220
34 1HB GLN 5 HB2 GLN 5 -1.785 7.856 1.208
35 2HB GLN 5 HB1 GLN 5 -0.731 6.855 0.208
36 1HG GLN 5 HG2 GLN 5 1.221 7.595 1.322
37 2HG GLN 5 HG1 GLN 5 0.391 8.980 2.033
38 1HE2 GLN 5 HE21 GLN 5 0.617 8.474 4.260
39 2HE2 GLN 5 HE22 GLN 5 -0.006 7.063 4.967
40 H CYS 6 H CYS 6 0.069 6.779 -1.461
41 HA CYS 6 HA CYS 6 2.771 7.570 -2.050
42 1HB CYS 6 HB2 CYS 6 1.628 5.166 -2.039
43 2HB CYS 6 HB1 CYS 6 1.423 5.536 -3.732
44 H CYS 7 H CYS 7 -0.222 8.164 -3.697
45 HA CYS 7 HA CYS 7 1.033 8.540 -6.305
46 1HB CYS 7 HB2 CYS 7 -1.462 8.016 -5.821
47 2HB CYS 7 HB1 CYS 7 -1.606 9.730 -5.434
48 H THR 8 H THR 8 -0.056 10.563 -3.618
49 HA THR 8 HA THR 8 1.010 13.006 -4.898
50 HB THR 8 HB THR 8 -0.664 12.396 -2.470
51 HG1 THR 8 HG1 THR 8 -2.084 13.237 -3.732
52 1HG2 THR 8 HG21 THR 8 1.003 14.871 -2.945
53 2HG2 THR 8 HG22 THR 8 0.870 13.908 -1.474
54 3HG2 THR 8 HG23 THR 8 -0.478 14.923 -1.988
55 H SER 9 H SER 9 1.940 10.533 -2.722
56 HA SER 9 HA SER 9 4.516 11.906 -2.216
57 1HB SER 9 HB2 SER 9 2.486 11.689 -0.234
58 2HB SER 9 HB1 SER 9 3.734 10.524 0.186
59 HG SER 9 HG SER 9 4.398 13.147 -0.603
60 H ILE 10 H ILE 10 5.383 9.827 -0.361
61 HA ILE 10 HA ILE 10 5.575 7.600 -2.328
62 HB ILE 10 HB ILE 10 7.363 8.639 -0.169
63 1HG1 ILE 10 HG12 ILE 10 8.537 7.375 -2.515
64 2HG1 ILE 10 HG11 ILE 10 7.330 8.576 -2.970
65 1HG2 ILE 10 HG21 ILE 10 8.686 6.502 -0.348
66 2HG2 ILE 10 HG22 ILE 10 7.295 5.778 -1.147
67 3HG2 ILE 10 HG23 ILE 10 7.160 6.333 0.517
68 1HD1 ILE 10 HD11 ILE 10 8.430 10.266 -1.644
69 2HD1 ILE 10 HD12 ILE 10 9.623 9.524 -2.710
70 3HD1 ILE 10 HD13 ILE 10 9.566 9.077 -1.005
71 H CYS 11 H CYS 11 5.532 5.333 -1.393
72 HA CYS 11 HA CYS 11 3.621 5.229 0.909
73 1HB CYS 11 HB2 CYS 11 3.399 2.743 -0.134
74 2HB CYS 11 HB1 CYS 11 2.372 4.076 -0.646
75 H SER 12 H SER 12 4.585 4.581 2.746
76 HA SER 12 HA SER 12 7.214 3.396 2.777
77 1HB SER 12 HB2 SER 12 6.230 2.880 5.270
78 2HB SER 12 HB1 SER 12 6.939 4.418 4.790
79 HG SER 12 HG SER 12 4.875 4.702 5.711
80 H LEU 13 H LEU 13 7.801 1.255 3.122
81 HA LEU 13 HA LEU 13 6.334 -0.838 2.041
82 1HB LEU 13 HB2 LEU 13 8.641 -0.574 3.808
83 2HB LEU 13 HB1 LEU 13 7.718 -2.035 4.150
84 HG LEU 13 HG LEU 13 9.587 -2.153 2.352
85 1HD1 LEU 13 HD11 LEU 13 6.770 -3.163 2.135
86 2HD1 LEU 13 HD12 LEU 13 8.244 -4.048 2.524
87 3HD1 LEU 13 HD13 LEU 13 7.931 -3.543 0.864
88 1HD2 LEU 13 HD21 LEU 13 7.653 -1.442 0.280
89 2HD2 LEU 13 HD22 LEU 13 9.348 -0.978 0.435
90 3HD2 LEU 13 HD23 LEU 13 8.101 -0.053 1.271
91 H TYR 14 H TYR 14 5.909 0.655 5.169
92 HA TYR 14 HA TYR 14 4.281 -1.554 6.178
93 1HB TYR 14 HB2 TYR 14 5.630 -0.270 7.758
94 2HB TYR 14 HB1 TYR 14 4.775 1.206 7.305
95 HD1 TYR 14 HD1 TYR 14 4.200 -2.235 8.662
96 HD2 TYR 14 HD2 TYR 14 2.786 1.816 8.410
97 HE1 TYR 14 HE1 TYR 14 2.427 -2.750 10.319
98 HE2 TYR 14 HE2 TYR 14 1.014 1.300 10.069
99 HH TYR 14 HH TYR 14 -0.145 -1.372 10.747
100 H GLN 15 H GLN 15 3.679 1.519 4.616
101 HA GLN 15 HA GLN 15 0.877 1.552 5.349
102 1HB GLN 15 HB2 GLN 15 2.374 3.019 3.159
103 2HB GLN 15 HB1 GLN 15 0.673 3.284 3.536
104 1HG GLN 15 HG2 GLN 15 1.168 4.099 5.707
105 2HG GLN 15 HG1 GLN 15 2.824 3.496 5.640
106 1HE2 GLN 15 HE21 GLN 15 2.435 6.220 6.208
107 2HE2 GLN 15 HE22 GLN 15 2.923 7.155 4.877
108 H LEU 16 H LEU 16 2.681 0.275 2.504
109 HA LEU 16 HA LEU 16 0.136 -0.553 1.312
110 1HB LEU 16 HB2 LEU 16 2.590 0.080 0.241
111 2HB LEU 16 HB1 LEU 16 2.628 -1.671 0.207
112 HG LEU 16 HG LEU 16 0.793 -1.797 -1.208
113 1HD1 LEU 16 HD11 LEU 16 0.046 0.804 -0.012
114 2HD1 LEU 16 HD12 LEU 16 -0.973 -0.572 -0.433
115 3HD1 LEU 16 HD13 LEU 16 -0.436 0.544 -1.688
116 1HD2 LEU 16 HD21 LEU 16 1.751 0.852 -2.183
117 2HD2 LEU 16 HD22 LEU 16 1.453 -0.629 -3.089
118 3HD2 LEU 16 HD23 LEU 16 2.897 -0.483 -2.086
119 H GLU 17 H GLU 17 2.275 -1.667 3.645
120 HA GLU 17 HA GLU 17 2.037 -4.509 3.177
121 1HB GLU 17 HB2 GLU 17 3.428 -2.859 4.968
122 2HB GLU 17 HB1 GLU 17 2.303 -3.761 5.974
123 1HG GLU 17 HG2 GLU 17 4.321 -4.913 4.030
124 2HG GLU 17 HG1 GLU 17 4.343 -5.053 5.788
125 H ASN 18 H ASN 18 -0.252 -2.176 3.871
126 HA ASN 18 HA ASN 18 -1.931 -4.167 5.347
127 1HB ASN 18 HB2 ASN 18 -1.217 -1.645 6.207
128 2HB ASN 18 HB1 ASN 18 -2.805 -1.370 5.490
129 1HD2 ASN 18 HD21 ASN 18 -1.095 -3.316 7.953
130 2HD2 ASN 18 HD22 ASN 18 -2.487 -3.707 8.841
131 H TYR 19 H TYR 19 -1.607 -3.679 2.359
132 HA TYR 19 HA TYR 19 -4.479 -3.027 1.820
133 1HB TYR 19 HB2 TYR 19 -2.000 -2.465 0.182
134 2HB TYR 19 HB1 TYR 19 -3.606 -2.489 -0.541
135 HD1 TYR 19 HD1 TYR 19 -1.799 -1.034 2.412
136 HD2 TYR 19 HD2 TYR 19 -4.877 -0.537 -0.546
137 HE1 TYR 19 HE1 TYR 19 -2.222 1.269 3.237
138 HE2 TYR 19 HE2 TYR 19 -5.300 1.764 0.279
139 HH TYR 19 HH TYR 19 -4.964 3.124 2.179
140 H CYS 20 H CYS 20 -3.405 -5.651 2.518
141 HA CYS 20 HA CYS 20 -3.744 -7.065 -0.087
142 1HB CYS 20 HB2 CYS 20 -2.474 -8.055 2.479
143 2HB CYS 20 HB1 CYS 20 -2.594 -8.963 0.976
144 H ASN 21 H ASN 21 -5.215 -8.857 -0.158
145 HA ASN 21 HA ASN 21 -7.501 -8.559 1.620
146 1HB ASN 21 HB2 ASN 21 -6.864 -9.992 -0.846
147 2HB ASN 21 HB1 ASN 21 -7.836 -10.964 0.259
148 1HD2 ASN 21 HD21 ASN 21 -8.203 -8.853 -2.255
149 2HD2 ASN 21 HD22 ASN 21 -9.698 -8.163 -1.840
150 1H PHE 1 HT1 PHE 1 13.579 -1.215 -4.404
151 2H PHE 1 HT2 PHE 1 13.743 -0.058 -3.172
152 3H PHE 1 HT3 PHE 1 12.929 0.338 -4.610
153 HA PHE 1 HA PHE 1 11.008 -0.421 -3.849
154 1HB PHE 1 HB2 PHE 1 10.703 -2.705 -3.309
155 2HB PHE 1 HB1 PHE 1 12.068 -2.709 -4.424
156 HD1 PHE 1 HD1 PHE 1 11.045 -4.427 -1.759
157 HD2 PHE 1 HD2 PHE 1 14.323 -1.846 -2.789
158 HE1 PHE 1 HE1 PHE 1 12.444 -5.508 -0.018
159 HE2 PHE 1 HE2 PHE 1 15.721 -2.926 -1.048
160 HZ PHE 1 HZ PHE 1 14.782 -4.757 0.337
161 H VAL 2 H VAL 2 12.829 1.176 -2.153
162 HA VAL 2 HA VAL 2 12.118 0.209 0.571
163 HB VAL 2 HB VAL 2 14.015 2.347 -0.426
164 1HG1 VAL 2 HG11 VAL 2 14.392 1.964 2.328
165 2HG1 VAL 2 HG12 VAL 2 12.648 2.115 2.126
166 3HG1 VAL 2 HG13 VAL 2 13.716 3.394 1.548
167 1HG2 VAL 2 HG21 VAL 2 14.984 0.173 -0.596
168 2HG2 VAL 2 HG22 VAL 2 14.308 -0.331 0.953
169 3HG2 VAL 2 HG23 VAL 2 15.619 0.848 0.905
170 H ASN 3 H ASN 3 12.558 3.577 -0.294
171 HA ASN 3 HA ASN 3 9.733 4.083 0.546
172 1HB ASN 3 HB2 ASN 3 10.545 6.372 1.119
173 2HB ASN 3 HB1 ASN 3 11.374 5.116 2.038
174 1HD2 ASN 3 HD21 ASN 3 11.835 7.722 -0.198
175 2HD2 ASN 3 HD22 ASN 3 13.497 7.488 -0.455
176 H GLN 4 H GLN 4 9.902 3.324 -2.025
177 HA GLN 4 HA GLN 4 10.278 5.723 -3.714
178 1HB GLN 4 HB2 GLN 4 10.485 2.912 -4.118
179 2HB GLN 4 HB1 GLN 4 9.167 3.482 -5.142
180 1HG GLN 4 HG2 GLN 4 10.565 5.020 -6.282
181 2HG GLN 4 HG1 GLN 4 11.824 4.910 -5.050
182 1HE2 GLN 4 HE21 GLN 4 10.205 1.977 -6.134
183 2HE2 GLN 4 HE22 GLN 4 11.518 1.355 -7.013
184 H HIS 5 H HIS 5 8.507 6.336 -5.235
185 HA HIS 5 HA HIS 5 5.943 6.304 -3.790
186 1HB HIS 5 HB2 HIS 5 5.224 7.951 -5.500
187 2HB HIS 5 HB1 HIS 5 6.708 8.446 -4.691
188 HD2 HIS 5 HD2 HIS 5 7.199 5.716 -7.386
189 HE1 HIS 5 HE1 HIS 5 8.408 9.400 -9.075
190 HE2 HIS 5 HE2 HIS 5 8.381 6.869 -9.397
191 H LEU 6 H LEU 6 3.971 6.276 -5.451
192 HA LEU 6 HA LEU 6 4.126 4.220 -7.412
193 1HB LEU 6 HB2 LEU 6 4.788 3.067 -5.337
194 2HB LEU 6 HB1 LEU 6 3.233 3.501 -4.654
195 HG LEU 6 HG LEU 6 2.348 2.361 -6.828
196 1HD1 LEU 6 HD11 LEU 6 5.169 1.909 -6.866
197 2HD1 LEU 6 HD12 LEU 6 3.969 1.257 -7.981
198 3HD1 LEU 6 HD13 LEU 6 4.394 0.364 -6.522
199 1HD2 LEU 6 HD21 LEU 6 3.472 0.755 -4.539
200 2HD2 LEU 6 HD22 LEU 6 1.979 0.458 -5.430
201 3HD2 LEU 6 HD23 LEU 6 2.101 1.843 -4.342
202 H CYS 7 H CYS 7 2.437 4.896 -8.694
203 HA CYS 7 HA CYS 7 -0.197 5.345 -7.367
204 1HB CYS 7 HB2 CYS 7 0.986 7.531 -7.893
205 2HB CYS 7 HB1 CYS 7 0.867 7.094 -9.598
206 H GLY 8 H GLY 8 -2.022 5.215 -8.981
207 1HA GLY 8 HA2 GLY 8 -3.137 3.866 -10.564
208 2HA GLY 8 HA1 GLY 8 -1.854 4.416 -11.644
209 H SER 9 H SER 9 -1.341 2.509 -12.722
210 HA SER 9 HA SER 9 -1.375 -0.114 -11.814
211 1HB SER 9 HB2 SER 9 0.346 -0.615 -13.456
212 2HB SER 9 HB1 SER 9 -0.703 0.631 -14.125
213 HG SER 9 HG SER 9 1.507 1.146 -14.387
214 H ASP 10 H ASP 10 1.251 2.279 -11.308
215 HA ASP 10 HA ASP 10 3.112 0.692 -9.949
216 1HB ASP 10 HB2 ASP 10 2.547 3.492 -10.132
217 2HB ASP 10 HB1 ASP 10 2.850 3.095 -8.442
218 H LEU 11 H LEU 11 0.097 2.117 -8.717
219 HA LEU 11 HA LEU 11 0.340 1.161 -6.027
220 1HB LEU 11 HB2 LEU 11 -1.660 2.436 -7.665
221 2HB LEU 11 HB1 LEU 11 -2.399 1.036 -6.910
222 HG LEU 11 HG LEU 11 -2.770 2.375 -5.138
223 1HD1 LEU 11 HD11 LEU 11 -1.107 2.559 -3.491
224 2HD1 LEU 11 HD12 LEU 11 0.189 2.660 -4.683
225 3HD1 LEU 11 HD13 LEU 11 -0.644 1.129 -4.412
226 1HD2 LEU 11 HD21 LEU 11 -2.031 4.226 -6.857
227 2HD2 LEU 11 HD22 LEU 11 -0.631 4.355 -5.794
228 3HD2 LEU 11 HD23 LEU 11 -2.253 4.625 -5.154
229 1HN ABA 12 H ABA 12 -1.433 -0.087 -8.808
230 HA ABA 12 HA ABA 12 -2.247 -2.570 -7.739
231 1HB ABA 12 HB1 ABA 12 -1.441 -2.388 -10.621
232 2HB ABA 12 HB2 ABA 12 -2.738 -1.336 -10.056
233 1HG ABA 12 HG1 ABA 12 -3.004 -3.982 -10.851
234 2HG ABA 12 HG2 ABA 12 -4.194 -3.039 -9.955
235 3HG ABA 12 HG3 ABA 12 -3.047 -4.062 -9.090
236 H GLU 13 H GLU 13 0.943 -1.539 -8.535
237 HA GLU 13 HA GLU 13 1.884 -4.289 -9.046
238 1HB GLU 13 HB2 GLU 13 2.924 -1.611 -9.503
239 2HB GLU 13 HB1 GLU 13 4.119 -2.678 -8.776
240 1HG GLU 13 HG2 GLU 13 2.675 -4.112 -10.811
241 2HG GLU 13 HG1 GLU 13 3.305 -2.610 -11.488
242 H ALA 14 H ALA 14 2.892 -1.701 -6.754
243 HA ALA 14 HA ALA 14 4.451 -3.287 -5.063
244 1HB ALA 14 HB1 ALA 14 4.322 -0.952 -4.571
245 2HB ALA 14 HB2 ALA 14 3.572 -1.761 -3.196
246 3HB ALA 14 HB3 ALA 14 2.567 -1.013 -4.434
247 H LEU 15 H LEU 15 0.957 -2.821 -5.090
248 HA LEU 15 HA LEU 15 0.283 -4.602 -2.955
249 1HB LEU 15 HB2 LEU 15 -1.207 -4.020 -5.532
250 2HB LEU 15 HB1 LEU 15 -1.931 -4.772 -4.115
251 HG LEU 15 HG LEU 15 -0.918 -1.936 -4.468
252 1HD1 LEU 15 HD11 LEU 15 -3.153 -1.347 -3.824
253 2HD1 LEU 15 HD12 LEU 15 -3.517 -3.020 -3.398
254 3HD1 LEU 15 HD13 LEU 15 -3.250 -2.577 -5.084
255 1HD2 LEU 15 HD21 LEU 15 -1.137 -1.501 -2.138
256 2HD2 LEU 15 HD22 LEU 15 -0.115 -2.930 -2.268
257 3HD2 LEU 15 HD23 LEU 15 -1.813 -3.097 -1.827
258 H TYR 16 H TYR 16 0.800 -5.075 -6.431
259 HA TYR 16 HA TYR 16 0.172 -7.888 -6.463
260 1HB TYR 16 HB2 TYR 16 1.215 -5.870 -8.309
261 2HB TYR 16 HB1 TYR 16 1.944 -7.455 -8.555
262 HD1 TYR 16 HD1 TYR 16 -0.300 -5.648 -10.108
263 HD2 TYR 16 HD2 TYR 16 -0.290 -9.242 -7.750
264 HE1 TYR 16 HE1 TYR 16 -2.354 -6.418 -11.269
265 HE2 TYR 16 HE2 TYR 16 -2.345 -10.010 -8.911
266 HH TYR 16 HH TYR 16 -3.425 -9.521 -11.249
267 H LEU 17 H LEU 17 3.168 -6.059 -5.943
268 HA LEU 17 HA LEU 17 4.755 -8.561 -5.837
269 1HB LEU 17 HB2 LEU 17 5.286 -5.714 -6.144
270 2HB LEU 17 HB1 LEU 17 6.349 -6.463 -4.950
271 HG LEU 17 HG LEU 17 7.381 -6.671 -7.142
272 1HD1 LEU 17 HD11 LEU 17 8.046 -8.795 -6.740
273 2HD1 LEU 17 HD12 LEU 17 6.419 -9.431 -6.979
274 3HD1 LEU 17 HD13 LEU 17 6.886 -8.770 -5.411
275 1HD2 LEU 17 HD21 LEU 17 5.596 -6.473 -8.676
276 2HD2 LEU 17 HD22 LEU 17 4.665 -7.746 -7.887
277 3HD2 LEU 17 HD23 LEU 17 6.094 -8.158 -8.837
278 H VAL 18 H VAL 18 3.233 -6.270 -3.748
279 HA VAL 18 HA VAL 18 4.715 -6.810 -1.356
280 HB VAL 18 HB VAL 18 2.037 -5.610 -2.022
281 1HG1 VAL 18 HG11 VAL 18 2.484 -4.990 0.630
282 2HG1 VAL 18 HG12 VAL 18 2.927 -6.697 0.552
283 3HG1 VAL 18 HG13 VAL 18 1.318 -6.180 0.045
284 1HG2 VAL 18 HG21 VAL 18 3.124 -3.620 -1.750
285 2HG2 VAL 18 HG22 VAL 18 4.557 -4.597 -2.066
286 3HG2 VAL 18 HG23 VAL 18 4.098 -4.217 -0.406
287 H CYS 19 H CYS 19 1.632 -8.115 -2.620
288 HA CYS 19 HA CYS 19 2.006 -10.423 -0.757
289 1HB CYS 19 HB2 CYS 19 -0.566 -8.949 -1.391
290 2HB CYS 19 HB1 CYS 19 -0.497 -10.491 -0.540
291 H GLY 20 H GLY 20 -0.418 -9.631 -3.256
292 1HA GLY 20 HA2 GLY 20 -0.663 -10.627 -5.408
293 2HA GLY 20 HA1 GLY 20 0.703 -11.685 -5.045
294 H GLU 21 H GLU 21 0.176 -13.232 -3.089
295 HA GLU 21 HA GLU 21 -2.128 -14.804 -3.902
296 1HB GLU 21 HB2 GLU 21 -0.966 -15.411 -1.252
297 2HB GLU 21 HB1 GLU 21 -1.236 -16.473 -2.631
298 1HG GLU 21 HG2 GLU 21 1.059 -16.426 -2.706
299 2HG GLU 21 HG1 GLU 21 0.758 -14.961 -3.642
300 H ARG 22 H ARG 22 -1.352 -12.971 -0.918
301 HA ARG 22 HA ARG 22 -3.809 -13.399 0.407
302 1HB ARG 22 HB2 ARG 22 -1.580 -11.540 0.625
303 2HB ARG 22 HB1 ARG 22 -3.115 -10.753 0.997
304 1HG ARG 22 HG2 ARG 22 -3.642 -12.396 2.677
305 2HG ARG 22 HG1 ARG 22 -2.276 -13.403 2.196
306 1HD ARG 22 HD2 ARG 22 -1.545 -10.634 2.889
307 2HD ARG 22 HD1 ARG 22 -2.205 -11.566 4.234
308 HE ARG 22 HE ARG 22 -0.288 -13.198 2.930
309 1HH1 ARG 22 HH21 ARG 22 -0.463 -12.180 5.870
310 2HH1 ARG 22 HH22 ARG 22 1.099 -11.449 6.025
311 1HH2 ARG 22 HH11 ARG 22 1.719 -11.417 2.614
312 2HH2 ARG 22 HH12 ARG 22 2.334 -11.018 4.183
313 H GLY 23 H GLY 23 -3.091 -11.521 -2.392
314 1HA GLY 23 HA2 GLY 23 -4.696 -10.612 -3.885
315 2HA GLY 23 HA1 GLY 23 -5.939 -10.848 -2.668
316 H PHE 24 H PHE 24 -5.628 -8.378 -4.139
317 HA PHE 24 HA PHE 24 -5.162 -6.610 -1.802
318 1HB PHE 24 HB2 PHE 24 -3.896 -4.988 -3.102
319 2HB PHE 24 HB1 PHE 24 -3.056 -6.527 -3.096
320 HD1 PHE 24 HD1 PHE 24 -4.564 -3.954 -5.155
321 HD2 PHE 24 HD2 PHE 24 -3.309 -8.069 -5.125
322 HE1 PHE 24 HE1 PHE 24 -4.558 -3.981 -7.628
323 HE2 PHE 24 HE2 PHE 24 -3.312 -8.089 -7.596
324 HZ PHE 24 HZ PHE 24 -3.933 -6.037 -8.849
325 H PHE 25 H PHE 25 -6.900 -5.320 -1.570
326 HA PHE 25 HA PHE 25 -8.787 -5.075 -3.835
327 1HB PHE 25 HB2 PHE 25 -10.337 -4.167 -2.150
328 2HB PHE 25 HB1 PHE 25 -9.664 -5.704 -1.611
329 HD1 PHE 25 HD1 PHE 25 -9.699 -2.067 -1.096
330 HD2 PHE 25 HD2 PHE 25 -7.986 -5.794 0.187
331 HE1 PHE 25 HE1 PHE 25 -8.829 -0.962 0.946
332 HE2 PHE 25 HE2 PHE 25 -7.115 -4.688 2.232
333 HZ PHE 25 HZ PHE 25 -7.537 -2.272 2.610
334 H TYR 26 H TYR 26 -8.975 -3.230 -5.007
335 HA TYR 26 HA TYR 26 -7.768 -0.728 -3.902
336 1HB TYR 26 HB2 TYR 26 -6.207 -1.481 -5.535
337 2HB TYR 26 HB1 TYR 26 -7.486 -1.942 -6.653
338 HD1 TYR 26 HD1 TYR 26 -6.008 1.031 -4.919
339 HD2 TYR 26 HD2 TYR 26 -8.239 -0.451 -8.278
340 HE1 TYR 26 HE1 TYR 26 -5.929 3.280 -5.969
341 HE2 TYR 26 HE2 TYR 26 -8.159 1.796 -9.330
342 HH TYR 26 HH TYR 26 -6.147 4.016 -8.753
343 H THR 27 H THR 27 -9.715 0.297 -3.402
344 HA THR 27 HA THR 27 -11.906 0.305 -5.376
345 HB THR 27 HB THR 27 -12.400 0.142 -2.945
346 HG1 THR 27 HG1 THR 27 -13.753 1.299 -4.565
347 1HG2 THR 27 HG21 THR 27 -11.948 2.946 -2.341
348 2HG2 THR 27 HG22 THR 27 -10.440 2.132 -2.756
349 3HG2 THR 27 HG23 THR 27 -11.441 1.516 -1.443
350 H LYS 28 H LYS 28 -12.898 2.515 -5.896
351 HA LYS 28 HA LYS 28 -10.810 4.213 -7.015
352 1HB LYS 28 HB2 LYS 28 -13.336 3.647 -7.803
353 2HB LYS 28 HB1 LYS 28 -13.623 5.171 -6.961
354 1HG LYS 28 HG2 LYS 28 -11.280 5.083 -8.795
355 2HG LYS 28 HG1 LYS 28 -12.875 5.075 -9.546
356 1HD LYS 28 HD2 LYS 28 -13.480 7.140 -8.538
357 2HD LYS 28 HD1 LYS 28 -12.139 7.064 -7.395
358 1HE LYS 28 HE2 LYS 28 -10.976 8.335 -8.852
359 2HE LYS 28 HE1 LYS 28 -10.908 6.917 -9.896
360 1HZ LYS 28 HZ1 LYS 28 -12.680 7.640 -11.148
361 2HZ LYS 28 HZ2 LYS 28 -11.898 9.107 -10.796
362 3HZ LYS 28 HZ3 LYS 28 -13.284 8.652 -9.929
363 HA PRO 29 HA PRO 29 -10.629 6.948 -3.539
364 1HB PRO 29 HB2 PRO 29 -9.107 8.890 -4.753
365 2HB PRO 29 HB1 PRO 29 -8.447 7.357 -4.153
366 1HG PRO 29 HG2 PRO 29 -8.965 8.206 -6.964
367 2HG PRO 29 HG1 PRO 29 -7.798 7.027 -6.345
368 1HD PRO 29 HD2 PRO 29 -10.282 6.423 -7.569
369 2HD PRO 29 HD1 PRO 29 -9.251 5.287 -6.672
370 H THR 30 H THR 30 -12.396 8.178 -2.991
371 HA THR 30 HA THR 30 -13.240 10.323 -4.893
372 HB THR 30 HB THR 30 -15.364 9.212 -3.177
373 HG1 THR 30 HG1 THR 30 -14.591 7.695 -5.411
374 1HG2 THR 30 HG21 THR 30 -15.152 9.734 -6.154
375 2HG2 THR 30 HG22 THR 30 -15.717 10.898 -4.956
376 3HG2 THR 30 HG23 THR 30 -16.639 9.426 -5.260
Start of MODEL 7
1 1H GLY 1 HT1 GLY 1 -5.522 5.412 1.894
2 2H GLY 1 HT2 GLY 1 -7.173 5.591 1.538
3 3H GLY 1 HT3 GLY 1 -6.410 6.672 2.604
4 1HA GLY 1 HA1 GLY 1 -6.506 6.834 -0.200
5 2HA GLY 1 HA2 GLY 1 -6.016 8.109 0.956
6 H ILE 2 H ILE 2 -5.455 4.728 -0.367
7 HA ILE 2 HA ILE 2 -2.794 4.762 -1.076
8 HB ILE 2 HB ILE 2 -5.126 3.586 -2.612
9 1HG1 ILE 2 HG12 ILE 2 -4.640 2.634 -0.397
10 2HG1 ILE 2 HG11 ILE 2 -4.200 1.489 -1.665
11 1HG2 ILE 2 HG21 ILE 2 -3.643 3.604 -4.350
12 2HG2 ILE 2 HG22 ILE 2 -3.028 2.181 -3.510
13 3HG2 ILE 2 HG23 ILE 2 -2.241 3.745 -3.290
14 1HD1 ILE 2 HD11 ILE 2 -2.118 1.428 -0.817
15 2HD1 ILE 2 HD12 ILE 2 -2.511 2.701 0.339
16 3HD1 ILE 2 HD13 ILE 2 -1.931 3.121 -1.273
17 H VAL 3 H VAL 3 -5.285 5.582 -3.505
18 HA VAL 3 HA VAL 3 -3.600 6.728 -5.423
19 HB VAL 3 HB VAL 3 -6.242 8.029 -4.836
20 1HG1 VAL 3 HG11 VAL 3 -5.355 6.999 -7.497
21 2HG1 VAL 3 HG12 VAL 3 -4.517 8.404 -6.840
22 3HG1 VAL 3 HG13 VAL 3 -6.259 8.462 -7.105
23 1HG2 VAL 3 HG21 VAL 3 -6.925 5.806 -4.527
24 2HG2 VAL 3 HG22 VAL 3 -5.733 5.182 -5.669
25 3HG2 VAL 3 HG23 VAL 3 -7.158 6.037 -6.260
26 H GLU 4 H GLU 4 -4.339 7.928 -2.293
27 HA GLU 4 HA GLU 4 -3.333 10.620 -3.065
28 1HB GLU 4 HB2 GLU 4 -5.528 10.572 -1.938
29 2HB GLU 4 HB1 GLU 4 -4.804 9.739 -0.563
30 1HG GLU 4 HG2 GLU 4 -4.974 12.125 -0.072
31 2HG GLU 4 HG1 GLU 4 -3.275 11.684 -0.239
32 H GLN 5 H GLN 5 -2.264 7.737 -1.637
33 HA GLN 5 HA GLN 5 -0.359 9.173 0.139
34 1HB GLN 5 HB2 GLN 5 -1.708 7.095 0.864
35 2HB GLN 5 HB1 GLN 5 -0.559 6.179 -0.111
36 1HG GLN 5 HG2 GLN 5 1.310 7.207 1.167
37 2HG GLN 5 HG1 GLN 5 0.131 8.041 2.180
38 1HE2 GLN 5 HE21 GLN 5 -1.416 6.584 3.423
39 2HE2 GLN 5 HE22 GLN 5 -0.867 5.053 3.910
40 H CYS 6 H CYS 6 0.181 6.200 -1.799
41 HA CYS 6 HA CYS 6 2.925 6.945 -2.265
42 1HB CYS 6 HB2 CYS 6 1.701 5.082 -4.203
43 2HB CYS 6 HB1 CYS 6 3.203 4.946 -3.318
44 H CYS 7 H CYS 7 0.099 8.120 -3.620
45 HA CYS 7 HA CYS 7 1.233 8.666 -6.290
46 1HB CYS 7 HB2 CYS 7 -1.389 8.904 -4.959
47 2HB CYS 7 HB1 CYS 7 -1.021 10.237 -6.046
48 H THR 8 H THR 8 -0.136 10.615 -3.644
49 HA THR 8 HA THR 8 1.223 13.041 -4.472
50 HB THR 8 HB THR 8 -0.399 12.178 -2.076
51 HG1 THR 8 HG1 THR 8 -1.097 13.073 -4.272
52 1HG2 THR 8 HG21 THR 8 1.351 14.621 -2.342
53 2HG2 THR 8 HG22 THR 8 1.169 13.542 -0.960
54 3HG2 THR 8 HG23 THR 8 -0.124 14.667 -1.375
55 H SER 9 H SER 9 1.626 10.725 -1.795
56 HA SER 9 HA SER 9 4.454 11.665 -1.544
57 1HB SER 9 HB2 SER 9 2.397 11.386 0.444
58 2HB SER 9 HB1 SER 9 3.689 10.252 0.795
59 HG SER 9 HG SER 9 4.431 12.070 1.680
60 H ILE 10 H ILE 10 5.428 9.626 -0.007
61 HA ILE 10 HA ILE 10 5.207 7.311 -1.865
62 HB ILE 10 HB ILE 10 7.410 8.663 -1.204
63 1HG1 ILE 10 HG12 ILE 10 8.052 5.832 -1.215
64 2HG1 ILE 10 HG11 ILE 10 6.800 6.214 -2.393
65 1HG2 ILE 10 HG21 ILE 10 7.509 6.396 0.783
66 2HG2 ILE 10 HG22 ILE 10 6.995 8.017 1.253
67 3HG2 ILE 10 HG23 ILE 10 8.619 7.757 0.613
68 1HD1 ILE 10 HD11 ILE 10 8.493 8.289 -2.810
69 2HD1 ILE 10 HD12 ILE 10 8.587 6.771 -3.704
70 3HD1 ILE 10 HD13 ILE 10 9.645 7.047 -2.320
71 H CYS 11 H CYS 11 4.833 5.179 -1.013
72 HA CYS 11 HA CYS 11 4.051 5.148 1.881
73 1HB CYS 11 HB2 CYS 11 2.552 3.213 1.269
74 2HB CYS 11 HB1 CYS 11 2.054 4.748 0.570
75 H SER 12 H SER 12 5.411 3.951 3.084
76 HA SER 12 HA SER 12 7.400 2.223 1.865
77 1HB SER 12 HB2 SER 12 7.172 1.692 4.654
78 2HB SER 12 HB1 SER 12 8.410 2.636 3.831
79 HG SER 12 HG SER 12 6.828 3.606 5.520
80 H LEU 13 H LEU 13 7.491 -0.056 1.971
81 HA LEU 13 HA LEU 13 5.228 -1.507 1.520
82 1HB LEU 13 HB2 LEU 13 6.389 -3.552 2.075
83 2HB LEU 13 HB1 LEU 13 7.493 -2.455 1.262
84 HG LEU 13 HG LEU 13 8.692 -3.389 3.102
85 1HD1 LEU 13 HD11 LEU 13 8.852 -0.923 2.735
86 2HD1 LEU 13 HD12 LEU 13 9.239 -1.433 4.375
87 3HD1 LEU 13 HD13 LEU 13 7.681 -0.708 4.027
88 1HD2 LEU 13 HD21 LEU 13 7.742 -4.011 5.055
89 2HD2 LEU 13 HD22 LEU 13 6.195 -3.642 4.293
90 3HD2 LEU 13 HD23 LEU 13 7.000 -2.427 5.284
91 H TYR 14 H TYR 14 6.149 -0.255 4.618
92 HA TYR 14 HA TYR 14 4.570 -2.088 6.187
93 1HB TYR 14 HB2 TYR 14 6.442 -0.641 7.082
94 2HB TYR 14 HB1 TYR 14 5.358 0.740 6.909
95 HD1 TYR 14 HD1 TYR 14 5.657 -2.625 8.508
96 HD2 TYR 14 HD2 TYR 14 3.741 1.223 8.567
97 HE1 TYR 14 HE1 TYR 14 4.606 -3.180 10.683
98 HE2 TYR 14 HE2 TYR 14 2.690 0.665 10.746
99 HH TYR 14 HH TYR 14 2.192 -1.088 12.150
100 H GLN 15 H GLN 15 4.008 1.027 4.678
101 HA GLN 15 HA GLN 15 1.312 1.229 5.767
102 1HB GLN 15 HB2 GLN 15 2.833 2.796 3.670
103 2HB GLN 15 HB1 GLN 15 1.132 3.107 4.017
104 1HG GLN 15 HG2 GLN 15 1.570 3.867 6.173
105 2HG GLN 15 HG1 GLN 15 3.095 2.986 6.283
106 1HE2 GLN 15 HE21 GLN 15 1.693 6.042 5.517
107 2HE2 GLN 15 HE22 GLN 15 3.093 6.778 4.901
108 H LEU 16 H LEU 16 2.831 -0.059 2.827
109 HA LEU 16 HA LEU 16 0.197 -0.492 1.612
110 1HB LEU 16 HB2 LEU 16 2.617 -0.154 0.467
111 2HB LEU 16 HB1 LEU 16 2.524 -1.906 0.479
112 HG LEU 16 HG LEU 16 -0.017 -0.949 -0.316
113 1HD1 LEU 16 HD11 LEU 16 0.445 0.375 -2.256
114 2HD1 LEU 16 HD12 LEU 16 2.185 0.177 -2.054
115 3HD1 LEU 16 HD13 LEU 16 1.270 1.154 -0.905
116 1HD2 LEU 16 HD21 LEU 16 0.856 -2.053 -2.513
117 2HD2 LEU 16 HD22 LEU 16 0.723 -3.053 -1.068
118 3HD2 LEU 16 HD23 LEU 16 2.291 -2.424 -1.564
119 H GLU 17 H GLU 17 1.897 -1.892 4.052
120 HA GLU 17 HA GLU 17 1.283 -4.690 3.443
121 1HB GLU 17 HB2 GLU 17 3.181 -3.761 4.993
122 2HB GLU 17 HB1 GLU 17 1.896 -3.636 6.197
123 1HG GLU 17 HG2 GLU 17 1.364 -6.108 5.465
124 2HG GLU 17 HG1 GLU 17 3.031 -6.089 4.886
125 H ASN 18 H ASN 18 -0.638 -2.153 3.941
126 HA ASN 18 HA ASN 18 -2.523 -3.656 5.717
127 1HB ASN 18 HB2 ASN 18 -1.673 -0.928 5.724
128 2HB ASN 18 HB1 ASN 18 -3.381 -0.963 5.286
129 1HD2 ASN 18 HD21 ASN 18 -4.818 -1.136 7.014
130 2HD2 ASN 18 HD22 ASN 18 -4.408 -1.681 8.567
131 H TYR 19 H TYR 19 -1.928 -3.389 2.570
132 HA TYR 19 HA TYR 19 -4.823 -3.215 1.864
133 1HB TYR 19 HB2 TYR 19 -2.421 -2.372 0.222
134 2HB TYR 19 HB1 TYR 19 -4.084 -2.391 -0.358
135 HD1 TYR 19 HD1 TYR 19 -1.883 -0.967 2.297
136 HD2 TYR 19 HD2 TYR 19 -5.562 -0.608 0.109
137 HE1 TYR 19 HE1 TYR 19 -2.287 1.248 3.343
138 HE2 TYR 19 HE2 TYR 19 -5.971 1.605 1.158
139 HH TYR 19 HH TYR 19 -4.548 3.435 2.204
140 H CYS 20 H CYS 20 -3.573 -5.616 2.689
141 HA CYS 20 HA CYS 20 -3.715 -7.123 0.136
142 1HB CYS 20 HB2 CYS 20 -1.373 -7.083 0.599
143 2HB CYS 20 HB1 CYS 20 -1.644 -7.416 2.301
144 H ASN 21 H ASN 21 -5.123 -8.821 0.239
145 HA ASN 21 HA ASN 21 -6.683 -9.237 2.624
146 1HB ASN 21 HB2 ASN 21 -6.497 -10.485 -0.090
147 2HB ASN 21 HB1 ASN 21 -7.378 -11.338 1.173
148 1HD2 ASN 21 HD21 ASN 21 -8.384 -9.828 -1.303
149 2HD2 ASN 21 HD22 ASN 21 -9.522 -8.730 -0.688
150 1H PHE 1 HT1 PHE 1 11.444 -1.880 -4.047
151 2H PHE 1 HT2 PHE 1 12.306 -2.004 -2.589
152 3H PHE 1 HT3 PHE 1 11.501 -0.561 -2.984
153 HA PHE 1 HA PHE 1 9.384 -1.950 -3.007
154 1HB PHE 1 HB2 PHE 1 9.423 -4.040 -1.930
155 2HB PHE 1 HB1 PHE 1 10.902 -4.074 -2.887
156 HD1 PHE 1 HD1 PHE 1 9.481 -3.919 0.478
157 HD2 PHE 1 HD2 PHE 1 13.113 -3.696 -1.807
158 HE1 PHE 1 HE1 PHE 1 10.805 -4.226 2.553
159 HE2 PHE 1 HE2 PHE 1 14.437 -4.004 0.269
160 HZ PHE 1 HZ PHE 1 13.283 -4.268 2.449
161 H VAL 2 H VAL 2 11.920 -0.713 -1.042
162 HA VAL 2 HA VAL 2 10.640 -0.568 1.491
163 HB VAL 2 HB VAL 2 12.600 1.367 0.223
164 1HG1 VAL 2 HG11 VAL 2 11.188 1.945 2.404
165 2HG1 VAL 2 HG12 VAL 2 12.908 2.327 2.313
166 3HG1 VAL 2 HG13 VAL 2 12.370 0.884 3.172
167 1HG2 VAL 2 HG21 VAL 2 13.268 -0.781 2.224
168 2HG2 VAL 2 HG22 VAL 2 14.321 0.005 1.048
169 3HG2 VAL 2 HG23 VAL 2 13.138 -1.190 0.513
170 H ASN 3 H ASN 3 11.253 2.631 0.342
171 HA ASN 3 HA ASN 3 8.375 3.250 0.663
172 1HB ASN 3 HB2 ASN 3 9.230 5.643 0.570
173 2HB ASN 3 HB1 ASN 3 9.829 4.688 1.927
174 1HD2 ASN 3 HD21 ASN 3 12.092 4.243 2.021
175 2HD2 ASN 3 HD22 ASN 3 13.200 4.823 0.874
176 H GLN 4 H GLN 4 7.675 2.385 -1.405
177 HA GLN 4 HA GLN 4 8.756 3.787 -3.794
178 1HB GLN 4 HB2 GLN 4 7.875 1.131 -3.317
179 2HB GLN 4 HB1 GLN 4 6.722 1.858 -4.436
180 1HG GLN 4 HG2 GLN 4 8.312 2.184 -6.084
181 2HG GLN 4 HG1 GLN 4 9.636 2.313 -4.926
182 1HE2 GLN 4 HE21 GLN 4 9.708 0.553 -7.240
183 2HE2 GLN 4 HE22 GLN 4 9.765 -1.044 -6.664
184 H HIS 5 H HIS 5 7.524 5.283 -4.891
185 HA HIS 5 HA HIS 5 4.753 5.754 -3.884
186 1HB HIS 5 HB2 HIS 5 5.008 8.041 -4.414
187 2HB HIS 5 HB1 HIS 5 6.581 7.587 -3.764
188 HD2 HIS 5 HD2 HIS 5 8.672 7.407 -5.704
189 HE1 HIS 5 HE1 HIS 5 6.410 9.146 -8.826
190 HE2 HIS 5 HE2 HIS 5 8.746 8.422 -8.099
191 H LEU 6 H LEU 6 3.200 4.928 -5.262
192 HA LEU 6 HA LEU 6 3.836 4.919 -8.168
193 1HB LEU 6 HB2 LEU 6 1.736 3.079 -7.353
194 2HB LEU 6 HB1 LEU 6 3.083 2.856 -8.447
195 HG LEU 6 HG LEU 6 3.528 1.392 -6.739
196 1HD1 LEU 6 HD11 LEU 6 5.136 3.367 -5.365
197 2HD1 LEU 6 HD12 LEU 6 5.233 3.533 -7.119
198 3HD1 LEU 6 HD13 LEU 6 5.643 1.997 -6.353
199 1HD2 LEU 6 HD21 LEU 6 2.388 1.592 -4.825
200 2HD2 LEU 6 HD22 LEU 6 2.044 3.284 -5.182
201 3HD2 LEU 6 HD23 LEU 6 3.530 2.845 -4.338
202 H CYS 7 H CYS 7 1.307 4.234 -9.103
203 HA CYS 7 HA CYS 7 -0.753 5.953 -8.049
204 1HB CYS 7 HB2 CYS 7 0.979 6.908 -10.292
205 2HB CYS 7 HB1 CYS 7 -0.748 7.246 -10.387
206 H GLY 8 H GLY 8 -0.250 5.404 -11.526
207 1HA GLY 8 HA2 GLY 8 -2.809 4.148 -11.806
208 2HA GLY 8 HA1 GLY 8 -1.525 4.091 -13.014
209 H SER 9 H SER 9 -1.575 1.888 -13.522
210 HA SER 9 HA SER 9 -2.010 -0.306 -11.852
211 1HB SER 9 HB2 SER 9 -1.079 0.013 -14.439
212 2HB SER 9 HB1 SER 9 0.311 -0.698 -13.624
213 HG SER 9 HG SER 9 -1.258 -2.264 -12.774
214 H ASP 10 H ASP 10 0.720 1.844 -12.024
215 HA ASP 10 HA ASP 10 2.689 0.390 -10.627
216 1HB ASP 10 HB2 ASP 10 2.501 2.899 -11.651
217 2HB ASP 10 HB1 ASP 10 2.427 3.254 -9.939
218 H LEU 11 H LEU 11 -0.193 2.090 -9.363
219 HA LEU 11 HA LEU 11 0.463 1.649 -6.592
220 1HB LEU 11 HB2 LEU 11 -1.479 3.010 -7.866
221 2HB LEU 11 HB1 LEU 11 -2.368 1.537 -7.559
222 HG LEU 11 HG LEU 11 -2.822 2.344 -5.525
223 1HD1 LEU 11 HD11 LEU 11 0.145 2.498 -4.966
224 2HD1 LEU 11 HD12 LEU 11 -0.776 0.995 -4.912
225 3HD1 LEU 11 HD13 LEU 11 -1.153 2.299 -3.792
226 1HD2 LEU 11 HD21 LEU 11 -2.741 4.571 -5.791
227 2HD2 LEU 11 HD22 LEU 11 -1.253 4.476 -6.733
228 3HD2 LEU 11 HD23 LEU 11 -1.181 4.499 -4.970
229 1HN ABA 12 H ABA 12 -1.402 -0.031 -9.068
230 HA ABA 12 HA ABA 12 -2.255 -2.277 -7.544
231 1HB ABA 12 HB1 ABA 12 -1.511 -2.575 -10.438
232 2HB ABA 12 HB2 ABA 12 -2.821 -1.484 -10.014
233 1HG ABA 12 HG1 ABA 12 -4.159 -3.177 -9.167
234 2HG ABA 12 HG2 ABA 12 -2.788 -4.252 -8.887
235 3HG ABA 12 HG3 ABA 12 -3.370 -3.972 -10.528
236 H GLU 13 H GLU 13 0.861 -1.350 -8.614
237 HA GLU 13 HA GLU 13 1.920 -4.089 -8.684
238 1HB GLU 13 HB2 GLU 13 2.849 -1.500 -9.537
239 2HB GLU 13 HB1 GLU 13 4.060 -2.267 -8.514
240 1HG GLU 13 HG2 GLU 13 4.672 -3.420 -10.362
241 2HG GLU 13 HG1 GLU 13 3.194 -4.350 -10.119
242 H ALA 14 H ALA 14 2.485 -1.204 -6.598
243 HA ALA 14 HA ALA 14 4.172 -2.398 -4.717
244 1HB ALA 14 HB1 ALA 14 3.319 -0.001 -4.670
245 2HB ALA 14 HB2 ALA 14 3.364 -0.804 -3.101
246 3HB ALA 14 HB3 ALA 14 1.832 -0.625 -3.956
247 H LEU 15 H LEU 15 0.648 -2.504 -4.926
248 HA LEU 15 HA LEU 15 0.262 -4.283 -2.689
249 1HB LEU 15 HB2 LEU 15 -1.456 -4.077 -5.179
250 2HB LEU 15 HB1 LEU 15 -1.981 -4.644 -3.600
251 HG LEU 15 HG LEU 15 -1.161 -1.811 -4.379
252 1HD1 LEU 15 HD11 LEU 15 -3.731 -2.350 -3.067
253 2HD1 LEU 15 HD12 LEU 15 -3.553 -3.073 -4.667
254 3HD1 LEU 15 HD13 LEU 15 -3.363 -1.332 -4.460
255 1HD2 LEU 15 HD21 LEU 15 -2.384 -1.940 -1.786
256 2HD2 LEU 15 HD22 LEU 15 -0.807 -1.286 -2.221
257 3HD2 LEU 15 HD23 LEU 15 -0.968 -2.992 -1.799
258 H TYR 16 H TYR 16 0.801 -4.756 -6.166
259 HA TYR 16 HA TYR 16 0.453 -7.639 -6.069
260 1HB TYR 16 HB2 TYR 16 1.066 -5.597 -8.053
261 2HB TYR 16 HB1 TYR 16 2.013 -7.061 -8.298
262 HD1 TYR 16 HD1 TYR 16 -0.805 -5.559 -9.417
263 HD2 TYR 16 HD2 TYR 16 0.370 -9.264 -7.586
264 HE1 TYR 16 HE1 TYR 16 -2.796 -6.666 -10.396
265 HE2 TYR 16 HE2 TYR 16 -1.620 -10.374 -8.567
266 HH TYR 16 HH TYR 16 -4.097 -9.321 -9.398
267 H LEU 17 H LEU 17 3.130 -5.454 -5.525
268 HA LEU 17 HA LEU 17 5.084 -7.683 -5.667
269 1HB LEU 17 HB2 LEU 17 5.205 -4.736 -5.705
270 2HB LEU 17 HB1 LEU 17 6.503 -5.525 -4.804
271 HG LEU 17 HG LEU 17 7.050 -5.222 -7.222
272 1HD1 LEU 17 HD11 LEU 17 6.747 -8.166 -6.886
273 2HD1 LEU 17 HD12 LEU 17 7.648 -7.303 -5.640
274 3HD1 LEU 17 HD13 LEU 17 8.176 -7.227 -7.320
275 1HD2 LEU 17 HD21 LEU 17 4.927 -7.312 -7.723
276 2HD2 LEU 17 HD22 LEU 17 5.828 -6.375 -8.916
277 3HD2 LEU 17 HD23 LEU 17 4.610 -5.587 -7.914
278 H VAL 18 H VAL 18 3.479 -5.567 -3.359
279 HA VAL 18 HA VAL 18 5.130 -6.337 -1.109
280 HB VAL 18 HB VAL 18 2.536 -4.889 -1.513
281 1HG1 VAL 18 HG11 VAL 18 3.576 -6.030 1.081
282 2HG1 VAL 18 HG12 VAL 18 1.959 -6.187 0.395
283 3HG1 VAL 18 HG13 VAL 18 2.500 -4.633 1.033
284 1HG2 VAL 18 HG21 VAL 18 4.940 -4.123 0.146
285 2HG2 VAL 18 HG22 VAL 18 3.733 -3.064 -0.584
286 3HG2 VAL 18 HG23 VAL 18 4.914 -3.888 -1.602
287 H CYS 19 H CYS 19 2.159 -7.545 -2.572
288 HA CYS 19 HA CYS 19 2.285 -9.871 -0.694
289 1HB CYS 19 HB2 CYS 19 0.184 -7.971 -0.995
290 2HB CYS 19 HB1 CYS 19 -0.378 -9.488 -1.691
291 H GLY 20 H GLY 20 0.249 -9.118 -3.514
292 1HA GLY 20 HA2 GLY 20 0.698 -10.034 -5.743
293 2HA GLY 20 HA1 GLY 20 1.586 -11.347 -4.971
294 H GLU 21 H GLU 21 0.498 -13.221 -5.041
295 HA GLU 21 HA GLU 21 -2.272 -13.405 -5.733
296 1HB GLU 21 HB2 GLU 21 -2.009 -15.824 -5.175
297 2HB GLU 21 HB1 GLU 21 -0.735 -15.225 -6.236
298 1HG GLU 21 HG2 GLU 21 0.446 -16.451 -4.603
299 2HG GLU 21 HG1 GLU 21 0.592 -14.784 -4.049
300 H ARG 22 H ARG 22 -0.914 -12.542 -2.764
301 HA ARG 22 HA ARG 22 -2.669 -13.952 -0.999
302 1HB ARG 22 HB2 ARG 22 -0.997 -11.485 -0.752
303 2HB ARG 22 HB1 ARG 22 -2.248 -11.774 0.456
304 1HG ARG 22 HG2 ARG 22 -0.173 -13.833 -0.325
305 2HG ARG 22 HG1 ARG 22 0.005 -12.740 1.047
306 1HD ARG 22 HD2 ARG 22 -2.522 -14.327 0.824
307 2HD ARG 22 HD1 ARG 22 -1.061 -15.153 1.362
308 HE ARG 22 HE ARG 22 -2.357 -12.878 2.783
309 1HH1 ARG 22 HH21 ARG 22 -1.445 -15.986 3.255
310 2HH1 ARG 22 HH22 ARG 22 -0.418 -15.707 4.621
311 1HH2 ARG 22 HH11 ARG 22 -0.428 -12.259 4.260
312 2HH2 ARG 22 HH12 ARG 22 0.156 -13.597 5.190
313 H GLY 23 H GLY 23 -3.014 -10.833 -2.670
314 1HA GLY 23 HA2 GLY 23 -5.427 -10.532 -3.482
315 2HA GLY 23 HA1 GLY 23 -5.878 -10.868 -1.820
316 H PHE 24 H PHE 24 -5.870 -8.351 -3.780
317 HA PHE 24 HA PHE 24 -5.379 -6.478 -1.549
318 1HB PHE 24 HB2 PHE 24 -3.966 -4.979 -2.843
319 2HB PHE 24 HB1 PHE 24 -3.205 -6.555 -2.750
320 HD1 PHE 24 HD1 PHE 24 -5.041 -4.213 -4.971
321 HD2 PHE 24 HD2 PHE 24 -2.907 -7.943 -4.733
322 HE1 PHE 24 HE1 PHE 24 -4.949 -4.329 -7.434
323 HE2 PHE 24 HE2 PHE 24 -2.817 -8.048 -7.199
324 HZ PHE 24 HZ PHE 24 -3.835 -6.230 -8.556
325 H PHE 25 H PHE 25 -6.973 -4.926 -1.559
326 HA PHE 25 HA PHE 25 -8.736 -4.861 -3.956
327 1HB PHE 25 HB2 PHE 25 -10.402 -3.834 -2.475
328 2HB PHE 25 HB1 PHE 25 -9.798 -5.332 -1.768
329 HD1 PHE 25 HD1 PHE 25 -9.643 -1.639 -1.612
330 HD2 PHE 25 HD2 PHE 25 -8.471 -5.328 0.256
331 HE1 PHE 25 HE1 PHE 25 -8.944 -0.390 0.415
332 HE2 PHE 25 HE2 PHE 25 -7.770 -4.079 2.282
333 HZ PHE 25 HZ PHE 25 -8.008 -1.611 2.362
334 H TYR 26 H TYR 26 -8.810 -3.088 -5.242
335 HA TYR 26 HA TYR 26 -7.499 -0.590 -4.241
336 1HB TYR 26 HB2 TYR 26 -6.146 -1.406 -6.023
337 2HB TYR 26 HB1 TYR 26 -7.553 -1.837 -6.995
338 HD1 TYR 26 HD1 TYR 26 -6.807 1.287 -5.076
339 HD2 TYR 26 HD2 TYR 26 -7.447 -0.504 -8.929
340 HE1 TYR 26 HE1 TYR 26 -6.770 3.536 -6.127
341 HE2 TYR 26 HE2 TYR 26 -7.411 1.746 -9.982
342 HH TYR 26 HH TYR 26 -7.766 4.068 -9.363
343 H THR 27 H THR 27 -8.964 1.019 -3.933
344 HA THR 27 HA THR 27 -11.692 0.822 -4.833
345 HB THR 27 HB THR 27 -11.826 3.226 -4.057
346 HG1 THR 27 HG1 THR 27 -9.880 3.903 -2.932
347 1HG2 THR 27 HG21 THR 27 -10.415 1.436 -2.071
348 2HG2 THR 27 HG22 THR 27 -12.085 1.174 -2.572
349 3HG2 THR 27 HG23 THR 27 -11.636 2.664 -1.741
350 H LYS 28 H LYS 28 -12.670 1.692 -6.642
351 HA LYS 28 HA LYS 28 -11.588 3.786 -8.257
352 1HB LYS 28 HB2 LYS 28 -11.075 2.180 -10.257
353 2HB LYS 28 HB1 LYS 28 -9.844 2.417 -9.017
354 1HG LYS 28 HG2 LYS 28 -9.959 0.259 -8.354
355 2HG LYS 28 HG1 LYS 28 -11.723 0.290 -8.318
356 1HD LYS 28 HD2 LYS 28 -11.739 0.055 -10.804
357 2HD LYS 28 HD1 LYS 28 -9.983 -0.101 -10.769
358 1HE LYS 28 HE2 LYS 28 -10.747 -1.937 -8.873
359 2HE LYS 28 HE1 LYS 28 -12.051 -2.070 -10.054
360 1HZ LYS 28 HZ1 LYS 28 -9.150 -2.449 -10.479
361 2HZ LYS 28 HZ2 LYS 28 -10.216 -2.174 -11.773
362 3HZ LYS 28 HZ3 LYS 28 -10.411 -3.541 -10.784
363 HA PRO 29 HA PRO 29 -15.920 2.780 -9.155
364 1HB PRO 29 HB2 PRO 29 -16.687 5.410 -9.350
365 2HB PRO 29 HB1 PRO 29 -16.592 4.531 -7.815
366 1HG PRO 29 HG2 PRO 29 -14.749 6.602 -8.908
367 2HG PRO 29 HG1 PRO 29 -15.077 6.169 -7.222
368 1HD PRO 29 HD2 PRO 29 -12.808 5.386 -8.728
369 2HD PRO 29 HD1 PRO 29 -13.312 4.706 -7.165
370 H THR 30 H THR 30 -17.263 4.513 -10.918
371 HA THR 30 HA THR 30 -15.534 4.917 -13.276
372 HB THR 30 HB THR 30 -17.684 3.541 -14.382
373 HG1 THR 30 HG1 THR 30 -18.273 2.706 -12.399
374 1HG2 THR 30 HG21 THR 30 -15.163 3.504 -14.878
375 2HG2 THR 30 HG22 THR 30 -16.031 1.983 -15.084
376 3HG2 THR 30 HG23 THR 30 -15.054 2.254 -13.641
Start of MODEL 8
1 1H GLY 1 HT1 GLY 1 -7.482 5.622 1.949
2 2H GLY 1 HT2 GLY 1 -7.005 5.041 0.425
3 3H GLY 1 HT3 GLY 1 -8.027 6.392 0.539
4 1HA GLY 1 HA1 GLY 1 -5.987 7.398 0.229
5 2HA GLY 1 HA2 GLY 1 -6.052 7.402 2.017
6 H ILE 2 H ILE 2 -5.588 5.321 -0.987
7 HA ILE 2 HA ILE 2 -2.653 5.217 -0.446
8 HB ILE 2 HB ILE 2 -4.186 3.080 -0.690
9 1HG1 ILE 2 HG12 ILE 2 -2.168 2.026 -2.031
10 2HG1 ILE 2 HG11 ILE 2 -1.448 3.618 -1.786
11 1HG2 ILE 2 HG21 ILE 2 -5.196 3.703 -2.841
12 2HG2 ILE 2 HG22 ILE 2 -4.222 2.244 -3.029
13 3HG2 ILE 2 HG23 ILE 2 -3.599 3.800 -3.581
14 1HD1 ILE 2 HD11 ILE 2 -1.686 1.456 0.087
15 2HD1 ILE 2 HD12 ILE 2 -2.612 2.832 0.686
16 3HD1 ILE 2 HD13 ILE 2 -0.901 3.020 0.309
17 H VAL 3 H VAL 3 -5.074 6.114 -2.816
18 HA VAL 3 HA VAL 3 -3.120 6.611 -4.943
19 HB VAL 3 HB VAL 3 -5.836 7.851 -4.978
20 1HG1 VAL 3 HG11 VAL 3 -5.702 7.251 -7.315
21 2HG1 VAL 3 HG12 VAL 3 -4.295 6.229 -7.018
22 3HG1 VAL 3 HG13 VAL 3 -4.165 7.980 -6.852
23 1HG2 VAL 3 HG21 VAL 3 -6.456 5.411 -5.917
24 2HG2 VAL 3 HG22 VAL 3 -6.678 5.847 -4.221
25 3HG2 VAL 3 HG23 VAL 3 -5.251 4.938 -4.718
26 H GLU 4 H GLU 4 -3.982 8.199 -2.136
27 HA GLU 4 HA GLU 4 -3.345 10.881 -3.281
28 1HB GLU 4 HB2 GLU 4 -5.381 10.979 -2.017
29 2HB GLU 4 HB1 GLU 4 -4.681 10.043 -0.694
30 1HG GLU 4 HG2 GLU 4 -3.524 11.839 0.151
31 2HG GLU 4 HG1 GLU 4 -3.282 12.563 -1.439
32 H GLN 5 H GLN 5 -2.196 8.371 -1.171
33 HA GLN 5 HA GLN 5 -0.034 10.140 -0.160
34 1HB GLN 5 HB2 GLN 5 -1.043 8.760 1.545
35 2HB GLN 5 HB1 GLN 5 -0.872 7.314 0.550
36 1HG GLN 5 HG2 GLN 5 1.263 7.001 1.214
37 2HG GLN 5 HG1 GLN 5 1.675 8.689 0.915
38 1HE2 GLN 5 HE21 GLN 5 -0.079 6.657 3.326
39 2HE2 GLN 5 HE22 GLN 5 0.333 7.626 4.657
40 H CYS 6 H CYS 6 -0.183 6.790 -1.425
41 HA CYS 6 HA CYS 6 2.485 6.510 -2.216
42 1HB CYS 6 HB2 CYS 6 -0.060 5.535 -3.467
43 2HB CYS 6 HB1 CYS 6 1.499 5.067 -4.101
44 H CYS 7 H CYS 7 -0.157 8.168 -3.865
45 HA CYS 7 HA CYS 7 1.371 8.689 -6.282
46 1HB CYS 7 HB2 CYS 7 -1.251 9.610 -5.142
47 2HB CYS 7 HB1 CYS 7 -0.557 10.480 -6.505
48 H THR 8 H THR 8 -0.207 11.242 -4.450
49 HA THR 8 HA THR 8 1.606 13.281 -4.956
50 HB THR 8 HB THR 8 -0.402 12.725 -2.815
51 HG1 THR 8 HG1 THR 8 0.141 14.866 -4.591
52 1HG2 THR 8 HG21 THR 8 1.773 14.815 -2.592
53 2HG2 THR 8 HG22 THR 8 1.237 13.663 -1.369
54 3HG2 THR 8 HG23 THR 8 0.202 15.019 -1.816
55 H SER 9 H SER 9 1.774 10.811 -2.411
56 HA SER 9 HA SER 9 4.577 11.718 -1.887
57 1HB SER 9 HB2 SER 9 2.347 11.194 0.007
58 2HB SER 9 HB1 SER 9 3.929 10.581 0.477
59 HG SER 9 HG SER 9 3.127 13.229 -0.090
60 H ILE 10 H ILE 10 5.390 9.663 -0.245
61 HA ILE 10 HA ILE 10 5.222 7.350 -2.102
62 HB ILE 10 HB ILE 10 7.421 8.588 -1.199
63 1HG1 ILE 10 HG12 ILE 10 7.952 5.742 -1.209
64 2HG1 ILE 10 HG11 ILE 10 6.785 6.159 -2.460
65 1HG2 ILE 10 HG21 ILE 10 8.360 7.657 0.735
66 2HG2 ILE 10 HG22 ILE 10 7.274 6.267 0.708
67 3HG2 ILE 10 HG23 ILE 10 6.666 7.851 1.189
68 1HD1 ILE 10 HD11 ILE 10 8.368 8.052 -3.117
69 2HD1 ILE 10 HD12 ILE 10 8.934 6.421 -3.471
70 3HD1 ILE 10 HD13 ILE 10 9.563 7.287 -2.070
71 H CYS 11 H CYS 11 5.576 5.164 -0.816
72 HA CYS 11 HA CYS 11 4.058 5.156 1.739
73 1HB CYS 11 HB2 CYS 11 3.101 2.879 0.544
74 2HB CYS 11 HB1 CYS 11 2.197 4.376 0.677
75 H SER 12 H SER 12 5.120 3.876 3.168
76 HA SER 12 HA SER 12 7.345 2.216 2.229
77 1HB SER 12 HB2 SER 12 6.968 1.625 4.910
78 2HB SER 12 HB1 SER 12 8.022 2.891 4.289
79 HG SER 12 HG SER 12 6.334 3.501 5.879
80 H LEU 13 H LEU 13 7.283 -0.021 2.068
81 HA LEU 13 HA LEU 13 5.017 -1.422 1.471
82 1HB LEU 13 HB2 LEU 13 6.430 -3.337 2.994
83 2HB LEU 13 HB1 LEU 13 6.432 -3.142 1.252
84 HG LEU 13 HG LEU 13 8.704 -3.149 2.295
85 1HD1 LEU 13 HD11 LEU 13 7.586 -1.073 0.530
86 2HD1 LEU 13 HD12 LEU 13 8.956 -2.154 0.278
87 3HD1 LEU 13 HD13 LEU 13 9.157 -0.681 1.227
88 1HD2 LEU 13 HD21 LEU 13 8.675 -0.410 3.196
89 2HD2 LEU 13 HD22 LEU 13 9.147 -1.861 4.079
90 3HD2 LEU 13 HD23 LEU 13 7.466 -1.341 4.076
91 H TYR 14 H TYR 14 6.010 -0.464 4.678
92 HA TYR 14 HA TYR 14 4.300 -2.191 6.163
93 1HB TYR 14 HB2 TYR 14 6.131 -0.728 7.119
94 2HB TYR 14 HB1 TYR 14 5.047 0.644 6.893
95 HD1 TYR 14 HD1 TYR 14 4.944 -2.836 8.312
96 HD2 TYR 14 HD2 TYR 14 3.724 1.267 8.696
97 HE1 TYR 14 HE1 TYR 14 3.803 -3.374 10.449
98 HE2 TYR 14 HE2 TYR 14 2.583 0.729 10.832
99 HH TYR 14 HH TYR 14 1.536 -1.613 11.814
100 H GLN 15 H GLN 15 3.794 0.983 4.732
101 HA GLN 15 HA GLN 15 1.057 1.143 5.664
102 1HB GLN 15 HB2 GLN 15 2.516 2.677 3.491
103 2HB GLN 15 HB1 GLN 15 0.886 3.049 4.052
104 1HG GLN 15 HG2 GLN 15 1.691 3.497 6.290
105 2HG GLN 15 HG1 GLN 15 3.313 2.954 5.861
106 1HE2 GLN 15 HE21 GLN 15 1.074 5.647 5.678
107 2HE2 GLN 15 HE22 GLN 15 2.138 6.729 4.917
108 H LEU 16 H LEU 16 2.673 -0.115 2.747
109 HA LEU 16 HA LEU 16 0.075 -0.608 1.484
110 1HB LEU 16 HB2 LEU 16 2.505 -0.247 0.375
111 2HB LEU 16 HB1 LEU 16 2.426 -1.995 0.413
112 HG LEU 16 HG LEU 16 -0.093 -1.215 -0.449
113 1HD1 LEU 16 HD11 LEU 16 0.064 0.551 -1.842
114 2HD1 LEU 16 HD12 LEU 16 1.630 0.030 -2.458
115 3HD1 LEU 16 HD13 LEU 16 1.536 0.947 -0.956
116 1HD2 LEU 16 HD21 LEU 16 0.955 -2.108 -2.671
117 2HD2 LEU 16 HD22 LEU 16 0.895 -3.184 -1.275
118 3HD2 LEU 16 HD23 LEU 16 2.397 -2.361 -1.691
119 H GLU 17 H GLU 17 1.805 -1.991 3.932
120 HA GLU 17 HA GLU 17 1.218 -4.793 3.323
121 1HB GLU 17 HB2 GLU 17 3.036 -3.661 4.968
122 2HB GLU 17 HB1 GLU 17 1.728 -3.915 6.123
123 1HG GLU 17 HG2 GLU 17 1.619 -6.287 5.515
124 2HG GLU 17 HG1 GLU 17 2.884 -6.051 4.308
125 H ASN 18 H ASN 18 -0.731 -2.271 3.853
126 HA ASN 18 HA ASN 18 -2.582 -3.795 5.645
127 1HB ASN 18 HB2 ASN 18 -1.764 -1.123 5.753
128 2HB ASN 18 HB1 ASN 18 -3.382 -1.055 5.056
129 1HD2 ASN 18 HD21 ASN 18 -3.938 -0.037 7.249
130 2HD2 ASN 18 HD22 ASN 18 -4.285 -1.080 8.543
131 H TYR 19 H TYR 19 -1.988 -3.346 2.451
132 HA TYR 19 HA TYR 19 -4.891 -3.319 1.744
133 1HB TYR 19 HB2 TYR 19 -2.440 -2.495 0.184
134 2HB TYR 19 HB1 TYR 19 -4.007 -2.756 -0.583
135 HD1 TYR 19 HD1 TYR 19 -2.528 -0.977 2.386
136 HD2 TYR 19 HD2 TYR 19 -5.476 -0.950 -0.744
137 HE1 TYR 19 HE1 TYR 19 -3.265 1.284 3.096
138 HE2 TYR 19 HE2 TYR 19 -6.212 1.307 -0.030
139 HH TYR 19 HH TYR 19 -4.532 3.052 2.572
140 H CYS 20 H CYS 20 -3.245 -5.643 2.668
141 HA CYS 20 HA CYS 20 -3.299 -7.290 0.187
142 1HB CYS 20 HB2 CYS 20 -1.994 -7.892 2.853
143 2HB CYS 20 HB1 CYS 20 -1.887 -8.884 1.402
144 H ASN 21 H ASN 21 -4.506 -9.234 0.162
145 HA ASN 21 HA ASN 21 -6.703 -9.301 2.141
146 1HB ASN 21 HB2 ASN 21 -6.273 -10.241 -0.617
147 2HB ASN 21 HB1 ASN 21 -7.163 -11.377 0.398
148 1HD2 ASN 21 HD21 ASN 21 -8.115 -9.510 -1.846
149 2HD2 ASN 21 HD22 ASN 21 -9.386 -8.630 -1.144
150 1H PHE 1 HT1 PHE 1 10.782 1.358 3.809
151 2H PHE 1 HT2 PHE 1 11.650 1.514 5.261
152 3H PHE 1 HT3 PHE 1 10.845 0.062 4.900
153 HA PHE 1 HA PHE 1 13.472 0.812 4.261
154 1HB PHE 1 HB2 PHE 1 12.730 -1.399 5.062
155 2HB PHE 1 HB1 PHE 1 11.804 -1.628 3.578
156 HD1 PHE 1 HD1 PHE 1 15.020 0.145 3.493
157 HD2 PHE 1 HD2 PHE 1 13.077 -3.658 3.000
158 HE1 PHE 1 HE1 PHE 1 17.041 -0.741 2.363
159 HE2 PHE 1 HE2 PHE 1 15.099 -4.543 1.870
160 HZ PHE 1 HZ PHE 1 17.082 -3.085 1.551
161 H VAL 2 H VAL 2 11.061 -0.605 2.024
162 HA VAL 2 HA VAL 2 12.450 0.801 -0.202
163 HB VAL 2 HB VAL 2 10.248 -1.176 -0.659
164 1HG1 VAL 2 HG11 VAL 2 12.813 -1.359 -2.091
165 2HG1 VAL 2 HG12 VAL 2 12.002 0.197 -2.275
166 3HG1 VAL 2 HG13 VAL 2 11.171 -1.290 -2.730
167 1HG2 VAL 2 HG21 VAL 2 11.308 -2.657 0.716
168 2HG2 VAL 2 HG22 VAL 2 12.797 -1.713 0.744
169 3HG2 VAL 2 HG23 VAL 2 12.457 -2.783 -0.616
170 H ASN 3 H ASN 3 11.041 2.595 1.222
171 HA ASN 3 HA ASN 3 8.285 2.912 0.757
172 1HB ASN 3 HB2 ASN 3 8.955 5.459 0.729
173 2HB ASN 3 HB1 ASN 3 9.161 4.510 2.202
174 1HD2 ASN 3 HD21 ASN 3 11.183 4.815 3.133
175 2HD2 ASN 3 HD22 ASN 3 12.612 5.153 2.282
176 H GLN 4 H GLN 4 7.720 2.241 -1.368
177 HA GLN 4 HA GLN 4 8.839 3.860 -3.605
178 1HB GLN 4 HB2 GLN 4 8.315 1.137 -3.403
179 2HB GLN 4 HB1 GLN 4 6.945 1.747 -4.335
180 1HG GLN 4 HG2 GLN 4 8.248 2.332 -6.123
181 2HG GLN 4 HG1 GLN 4 9.604 2.816 -5.105
182 1HE2 GLN 4 HE21 GLN 4 10.263 1.282 -7.299
183 2HE2 GLN 4 HE22 GLN 4 10.646 -0.304 -6.833
184 H HIS 5 H HIS 5 7.505 5.218 -4.818
185 HA HIS 5 HA HIS 5 4.756 5.629 -3.732
186 1HB HIS 5 HB2 HIS 5 4.896 7.873 -4.518
187 2HB HIS 5 HB1 HIS 5 6.485 7.534 -3.840
188 HD2 HIS 5 HD2 HIS 5 8.570 7.813 -5.628
189 HE1 HIS 5 HE1 HIS 5 6.239 8.077 -9.145
190 HE2 HIS 5 HE2 HIS 5 8.600 8.244 -8.193
191 H LEU 6 H LEU 6 3.006 5.111 -5.007
192 HA LEU 6 HA LEU 6 3.452 4.830 -7.903
193 1HB LEU 6 HB2 LEU 6 2.120 2.678 -6.323
194 2HB LEU 6 HB1 LEU 6 2.615 2.620 -7.999
195 HG LEU 6 HG LEU 6 4.988 3.174 -6.985
196 1HD1 LEU 6 HD11 LEU 6 4.483 3.398 -4.716
197 2HD1 LEU 6 HD12 LEU 6 5.047 1.734 -4.824
198 3HD1 LEU 6 HD13 LEU 6 3.319 2.080 -4.755
199 1HD2 LEU 6 HD21 LEU 6 4.048 0.366 -6.530
200 2HD2 LEU 6 HD22 LEU 6 5.512 0.935 -7.331
201 3HD2 LEU 6 HD23 LEU 6 3.960 1.027 -8.162
202 H CYS 7 H CYS 7 1.531 4.924 -9.240
203 HA CYS 7 HA CYS 7 -0.880 5.933 -7.792
204 1HB CYS 7 HB2 CYS 7 0.404 6.743 -10.395
205 2HB CYS 7 HB1 CYS 7 -1.303 7.069 -10.102
206 H GLY 8 H GLY 8 -1.039 5.395 -11.232
207 1HA GLY 8 HA2 GLY 8 -3.387 3.830 -11.078
208 2HA GLY 8 HA1 GLY 8 -2.353 3.923 -12.500
209 H SER 9 H SER 9 -1.921 1.861 -13.165
210 HA SER 9 HA SER 9 -2.119 -0.517 -11.701
211 1HB SER 9 HB2 SER 9 -1.689 -0.679 -14.063
212 2HB SER 9 HB1 SER 9 -0.198 0.247 -13.924
213 HG SER 9 HG SER 9 0.804 -1.520 -13.398
214 H ASP 10 H ASP 10 0.342 1.935 -11.675
215 HA ASP 10 HA ASP 10 2.488 0.650 -10.387
216 1HB ASP 10 HB2 ASP 10 1.811 3.240 -11.081
217 2HB ASP 10 HB1 ASP 10 1.837 3.303 -9.328
218 H LEU 11 H LEU 11 -0.633 1.743 -9.141
219 HA LEU 11 HA LEU 11 -0.071 1.219 -6.348
220 1HB LEU 11 HB2 LEU 11 -2.316 2.092 -7.923
221 2HB LEU 11 HB1 LEU 11 -2.822 0.697 -7.029
222 HG LEU 11 HG LEU 11 -3.324 2.232 -5.445
223 1HD1 LEU 11 HD11 LEU 11 -1.674 2.418 -3.750
224 2HD1 LEU 11 HD12 LEU 11 -0.354 2.312 -4.909
225 3HD1 LEU 11 HD13 LEU 11 -1.345 0.893 -4.568
226 1HD2 LEU 11 HD21 LEU 11 -2.875 4.101 -6.928
227 2HD2 LEU 11 HD22 LEU 11 -1.144 3.969 -6.617
228 3HD2 LEU 11 HD23 LEU 11 -2.239 4.455 -5.322
229 1HN ABA 12 H ABA 12 -1.751 -0.450 -8.946
230 HA ABA 12 HA ABA 12 -2.284 -2.908 -7.647
231 1HB ABA 12 HB1 ABA 12 -1.514 -2.910 -10.545
232 2HB ABA 12 HB2 ABA 12 -2.917 -1.957 -10.066
233 1HG ABA 12 HG1 ABA 12 -2.587 -4.832 -9.232
234 2HG ABA 12 HG2 ABA 12 -3.361 -4.378 -10.751
235 3HG ABA 12 HG3 ABA 12 -4.052 -3.850 -9.216
236 H GLU 13 H GLU 13 0.706 -1.546 -8.669
237 HA GLU 13 HA GLU 13 2.056 -4.154 -8.865
238 1HB GLU 13 HB2 GLU 13 2.687 -1.416 -9.611
239 2HB GLU 13 HB1 GLU 13 4.014 -2.179 -8.746
240 1HG GLU 13 HG2 GLU 13 3.501 -4.213 -10.336
241 2HG GLU 13 HG1 GLU 13 2.750 -2.978 -11.345
242 H ALA 14 H ALA 14 2.412 -1.244 -6.779
243 HA ALA 14 HA ALA 14 4.216 -2.297 -4.918
244 1HB ALA 14 HB1 ALA 14 3.098 -0.836 -3.230
245 2HB ALA 14 HB2 ALA 14 1.770 -0.579 -4.362
246 3HB ALA 14 HB3 ALA 14 3.387 0.013 -4.748
247 H LEU 15 H LEU 15 0.706 -2.624 -5.059
248 HA LEU 15 HA LEU 15 0.413 -4.384 -2.809
249 1HB LEU 15 HB2 LEU 15 -1.267 -4.304 -5.332
250 2HB LEU 15 HB1 LEU 15 -1.782 -4.928 -3.772
251 HG LEU 15 HG LEU 15 -1.221 -2.044 -4.555
252 1HD1 LEU 15 HD11 LEU 15 -3.545 -1.752 -3.721
253 2HD1 LEU 15 HD12 LEU 15 -3.633 -3.499 -3.492
254 3HD1 LEU 15 HD13 LEU 15 -3.424 -2.830 -5.111
255 1HD2 LEU 15 HD21 LEU 15 -0.809 -3.188 -1.974
256 2HD2 LEU 15 HD22 LEU 15 -2.270 -2.204 -1.909
257 3HD2 LEU 15 HD23 LEU 15 -0.750 -1.486 -2.435
258 H TYR 16 H TYR 16 1.130 -4.884 -6.239
259 HA TYR 16 HA TYR 16 0.945 -7.790 -6.118
260 1HB TYR 16 HB2 TYR 16 1.542 -5.736 -8.111
261 2HB TYR 16 HB1 TYR 16 2.572 -7.154 -8.286
262 HD1 TYR 16 HD1 TYR 16 -0.109 -5.859 -9.753
263 HD2 TYR 16 HD2 TYR 16 0.852 -9.360 -7.451
264 HE1 TYR 16 HE1 TYR 16 -1.979 -7.080 -10.830
265 HE2 TYR 16 HE2 TYR 16 -1.023 -10.581 -8.527
266 HH TYR 16 HH TYR 16 -3.459 -9.064 -10.239
267 H LEU 17 H LEU 17 3.513 -5.406 -5.717
268 HA LEU 17 HA LEU 17 5.588 -7.508 -5.620
269 1HB LEU 17 HB2 LEU 17 5.502 -4.620 -5.926
270 2HB LEU 17 HB1 LEU 17 6.690 -5.113 -4.717
271 HG LEU 17 HG LEU 17 7.713 -5.086 -6.954
272 1HD1 LEU 17 HD11 LEU 17 7.653 -7.277 -5.148
273 2HD1 LEU 17 HD12 LEU 17 8.944 -6.838 -6.266
274 3HD1 LEU 17 HD13 LEU 17 7.675 -7.951 -6.777
275 1HD2 LEU 17 HD21 LEU 17 5.978 -5.466 -8.486
276 2HD2 LEU 17 HD22 LEU 17 5.342 -6.830 -7.568
277 3HD2 LEU 17 HD23 LEU 17 6.827 -7.011 -8.500
278 H VAL 18 H VAL 18 3.488 -5.805 -3.520
279 HA VAL 18 HA VAL 18 5.167 -6.192 -1.151
280 HB VAL 18 HB VAL 18 2.503 -4.960 -1.760
281 1HG1 VAL 18 HG11 VAL 18 2.587 -4.519 0.857
282 2HG1 VAL 18 HG12 VAL 18 3.431 -6.069 0.855
283 3HG1 VAL 18 HG13 VAL 18 1.796 -5.953 0.203
284 1HG2 VAL 18 HG21 VAL 18 5.177 -4.151 -0.673
285 2HG2 VAL 18 HG22 VAL 18 3.758 -3.201 -0.234
286 3HG2 VAL 18 HG23 VAL 18 4.206 -3.386 -1.929
287 H CYS 19 H CYS 19 2.076 -7.518 -2.402
288 HA CYS 19 HA CYS 19 2.562 -9.871 -0.622
289 1HB CYS 19 HB2 CYS 19 -0.069 -8.462 -1.152
290 2HB CYS 19 HB1 CYS 19 0.076 -10.015 -0.327
291 H GLY 20 H GLY 20 0.001 -9.151 -2.997
292 1HA GLY 20 HA2 GLY 20 -0.461 -10.182 -5.067
293 2HA GLY 20 HA1 GLY 20 1.143 -10.916 -5.009
294 H GLU 21 H GLU 21 1.251 -12.551 -2.985
295 HA GLU 21 HA GLU 21 -0.566 -14.691 -3.633
296 1HB GLU 21 HB2 GLU 21 0.505 -15.861 -1.721
297 2HB GLU 21 HB1 GLU 21 1.699 -15.142 -2.803
298 1HG GLU 21 HG2 GLU 21 1.548 -13.079 -1.217
299 2HG GLU 21 HG1 GLU 21 0.831 -14.213 -0.074
300 H ARG 22 H ARG 22 -0.275 -12.560 -0.772
301 HA ARG 22 HA ARG 22 -2.526 -13.666 0.609
302 1HB ARG 22 HB2 ARG 22 -0.629 -11.629 1.076
303 2HB ARG 22 HB1 ARG 22 -2.206 -10.842 1.149
304 1HG ARG 22 HG2 ARG 22 -2.100 -11.595 3.321
305 2HG ARG 22 HG1 ARG 22 -2.791 -13.037 2.577
306 1HD ARG 22 HD2 ARG 22 -0.727 -14.169 2.558
307 2HD ARG 22 HD1 ARG 22 0.196 -12.677 2.739
308 HE ARG 22 HE ARG 22 -0.579 -12.602 5.102
309 1HH1 ARG 22 HH21 ARG 22 0.286 -15.484 3.697
310 2HH1 ARG 22 HH22 ARG 22 -0.436 -16.507 4.894
311 1HH2 ARG 22 HH11 ARG 22 -2.100 -13.917 6.489
312 2HH2 ARG 22 HH12 ARG 22 -1.787 -15.621 6.472
313 H GLY 23 H GLY 23 -2.252 -11.430 -2.027
314 1HA GLY 23 HA2 GLY 23 -4.157 -11.025 -3.485
315 2HA GLY 23 HA1 GLY 23 -5.220 -11.277 -2.109
316 H PHE 24 H PHE 24 -5.214 -8.906 -3.874
317 HA PHE 24 HA PHE 24 -5.059 -6.914 -1.717
318 1HB PHE 24 HB2 PHE 24 -3.657 -5.338 -2.917
319 2HB PHE 24 HB1 PHE 24 -2.774 -6.839 -2.702
320 HD1 PHE 24 HD1 PHE 24 -4.652 -4.765 -5.172
321 HD2 PHE 24 HD2 PHE 24 -2.110 -8.187 -4.585
322 HE1 PHE 24 HE1 PHE 24 -4.307 -4.944 -7.613
323 HE2 PHE 24 HE2 PHE 24 -1.767 -8.355 -7.026
324 HZ PHE 24 HZ PHE 24 -2.869 -6.727 -8.542
325 H PHE 25 H PHE 25 -6.798 -5.575 -1.922
326 HA PHE 25 HA PHE 25 -8.301 -5.695 -4.482
327 1HB PHE 25 HB2 PHE 25 -10.133 -4.622 -3.116
328 2HB PHE 25 HB1 PHE 25 -9.638 -6.216 -2.547
329 HD1 PHE 25 HD1 PHE 25 -9.203 -2.558 -1.968
330 HD2 PHE 25 HD2 PHE 25 -8.711 -6.520 -0.377
331 HE1 PHE 25 HE1 PHE 25 -8.660 -1.598 0.255
332 HE2 PHE 25 HE2 PHE 25 -8.169 -5.559 1.846
333 HZ PHE 25 HZ PHE 25 -8.143 -3.099 2.162
334 H TYR 26 H TYR 26 -8.359 -3.981 -5.834
335 HA TYR 26 HA TYR 26 -7.312 -1.370 -4.817
336 1HB TYR 26 HB2 TYR 26 -5.820 -2.117 -6.507
337 2HB TYR 26 HB1 TYR 26 -7.134 -2.706 -7.523
338 HD1 TYR 26 HD1 TYR 26 -6.038 0.493 -5.883
339 HD2 TYR 26 HD2 TYR 26 -7.742 -1.402 -9.341
340 HE1 TYR 26 HE1 TYR 26 -6.136 2.689 -7.039
341 HE2 TYR 26 HE2 TYR 26 -7.841 0.791 -10.499
342 HH TYR 26 HH TYR 26 -6.144 3.409 -9.615
343 H THR 27 H THR 27 -9.666 -1.136 -4.108
344 HA THR 27 HA THR 27 -11.505 -0.548 -6.367
345 HB THR 27 HB THR 27 -13.225 -0.349 -4.555
346 HG1 THR 27 HG1 THR 27 -12.592 -0.954 -2.477
347 1HG2 THR 27 HG21 THR 27 -13.324 -2.491 -5.367
348 2HG2 THR 27 HG22 THR 27 -12.742 -2.871 -3.747
349 3HG2 THR 27 HG23 THR 27 -11.607 -2.785 -5.094
350 H LYS 28 H LYS 28 -12.486 1.525 -6.573
351 HA LYS 28 HA LYS 28 -11.663 3.671 -4.752
352 1HB LYS 28 HB2 LYS 28 -10.488 5.003 -6.349
353 2HB LYS 28 HB1 LYS 28 -9.781 3.392 -6.438
354 1HG LYS 28 HG2 LYS 28 -11.637 4.742 -8.397
355 2HG LYS 28 HG1 LYS 28 -10.077 3.989 -8.696
356 1HD LYS 28 HD2 LYS 28 -11.174 1.781 -7.995
357 2HD LYS 28 HD1 LYS 28 -12.715 2.629 -8.137
358 1HE LYS 28 HE2 LYS 28 -10.732 2.761 -10.390
359 2HE LYS 28 HE1 LYS 28 -11.761 1.341 -10.216
360 1HZ LYS 28 HZ1 LYS 28 -12.691 4.154 -10.426
361 2HZ LYS 28 HZ2 LYS 28 -13.696 2.801 -10.211
362 3HZ LYS 28 HZ3 LYS 28 -12.796 2.975 -11.643
363 HA PRO 29 HA PRO 29 -15.722 4.131 -7.078
364 1HB PRO 29 HB2 PRO 29 -17.403 3.385 -5.038
365 2HB PRO 29 HB1 PRO 29 -16.789 2.256 -6.256
366 1HG PRO 29 HG2 PRO 29 -15.959 2.575 -3.405
367 2HG PRO 29 HG1 PRO 29 -15.916 1.132 -4.433
368 1HD PRO 29 HD2 PRO 29 -13.696 2.748 -3.799
369 2HD PRO 29 HD1 PRO 29 -13.781 1.559 -5.116
370 H THR 30 H THR 30 -15.140 4.660 -3.586
371 HA THR 30 HA THR 30 -16.432 7.336 -3.834
372 HB THR 30 HB THR 30 -15.638 5.902 -1.288
373 HG1 THR 30 HG1 THR 30 -17.849 5.644 -2.968
374 1HG2 THR 30 HG21 THR 30 -17.325 7.411 -0.297
375 2HG2 THR 30 HG22 THR 30 -17.604 8.131 -1.883
376 3HG2 THR 30 HG23 THR 30 -16.039 8.319 -1.092
Start of MODEL 9
1 1H GLY 1 HT1 GLY 1 -7.498 4.656 -0.283
2 2H GLY 1 HT2 GLY 1 -8.649 5.649 0.474
3 3H GLY 1 HT3 GLY 1 -7.269 5.144 1.327
4 1HA GLY 1 HA1 GLY 1 -6.947 6.768 -1.055
5 2HA GLY 1 HA2 GLY 1 -7.324 7.582 0.496
6 H ILE 2 H ILE 2 -5.562 4.682 -0.896
7 HA ILE 2 HA ILE 2 -2.926 5.720 -0.227
8 HB ILE 2 HB ILE 2 -3.530 3.219 -0.454
9 1HG1 ILE 2 HG12 ILE 2 -1.146 3.661 -2.140
10 2HG1 ILE 2 HG11 ILE 2 -1.167 4.577 -0.633
11 1HG2 ILE 2 HG21 ILE 2 -4.476 3.772 -2.872
12 2HG2 ILE 2 HG22 ILE 2 -3.656 2.240 -2.571
13 3HG2 ILE 2 HG23 ILE 2 -2.790 3.566 -3.348
14 1HD1 ILE 2 HD11 ILE 2 -1.539 1.579 -0.898
15 2HD1 ILE 2 HD12 ILE 2 -1.623 2.482 0.615
16 3HD1 ILE 2 HD13 ILE 2 -0.104 2.395 -0.276
17 H VAL 3 H VAL 3 -5.026 6.026 -2.947
18 HA VAL 3 HA VAL 3 -2.994 6.674 -4.915
19 HB VAL 3 HB VAL 3 -5.789 7.748 -5.060
20 1HG1 VAL 3 HG11 VAL 3 -3.650 7.598 -6.800
21 2HG1 VAL 3 HG12 VAL 3 -5.332 7.838 -7.272
22 3HG1 VAL 3 HG13 VAL 3 -4.637 6.217 -7.278
23 1HG2 VAL 3 HG21 VAL 3 -4.987 4.912 -4.769
24 2HG2 VAL 3 HG22 VAL 3 -6.077 5.256 -6.112
25 3HG2 VAL 3 HG23 VAL 3 -6.546 5.678 -4.465
26 H GLU 4 H GLU 4 -3.937 8.261 -2.168
27 HA GLU 4 HA GLU 4 -3.586 10.964 -3.358
28 1HB GLU 4 HB2 GLU 4 -5.518 10.896 -1.967
29 2HB GLU 4 HB1 GLU 4 -4.669 10.007 -0.703
30 1HG GLU 4 HG2 GLU 4 -3.836 11.902 0.210
31 2HG GLU 4 HG1 GLU 4 -3.366 12.545 -1.364
32 H GLN 5 H GLN 5 -2.130 8.701 -1.088
33 HA GLN 5 HA GLN 5 -0.011 10.711 -0.504
34 1HB GLN 5 HB2 GLN 5 -1.065 8.297 0.901
35 2HB GLN 5 HB1 GLN 5 0.648 8.669 1.107
36 1HG GLN 5 HG2 GLN 5 -0.042 11.039 1.685
37 2HG GLN 5 HG1 GLN 5 -1.710 10.466 1.723
38 1HE2 GLN 5 HE21 GLN 5 -2.072 10.606 3.996
39 2HE2 GLN 5 HE22 GLN 5 -1.192 9.702 5.133
40 H CYS 6 H CYS 6 -0.346 7.276 -1.470
41 HA CYS 6 HA CYS 6 2.410 6.852 -2.052
42 1HB CYS 6 HB2 CYS 6 -0.139 5.629 -3.029
43 2HB CYS 6 HB1 CYS 6 1.364 5.195 -3.806
44 H CYS 7 H CYS 7 -0.092 8.578 -3.718
45 HA CYS 7 HA CYS 7 1.504 8.725 -6.209
46 1HB CYS 7 HB2 CYS 7 -1.113 8.514 -6.008
47 2HB CYS 7 HB1 CYS 7 -1.045 10.256 -5.729
48 H THR 8 H THR 8 -0.152 11.091 -4.085
49 HA THR 8 HA THR 8 1.383 13.334 -4.972
50 HB THR 8 HB THR 8 -0.830 12.992 -3.378
51 HG1 THR 8 HG1 THR 8 -0.127 14.842 -4.594
52 1HG2 THR 8 HG21 THR 8 1.449 13.857 -1.576
53 2HG2 THR 8 HG22 THR 8 0.443 12.421 -1.384
54 3HG2 THR 8 HG23 THR 8 -0.261 14.025 -1.180
55 H SER 9 H SER 9 1.985 10.817 -2.655
56 HA SER 9 HA SER 9 4.712 11.914 -2.217
57 1HB SER 9 HB2 SER 9 3.407 10.700 0.160
58 2HB SER 9 HB1 SER 9 4.537 12.048 0.065
59 HG SER 9 HG SER 9 1.909 12.133 0.312
60 H ILE 10 H ILE 10 5.641 9.942 -0.484
61 HA ILE 10 HA ILE 10 5.418 7.546 -2.228
62 HB ILE 10 HB ILE 10 7.645 8.785 -1.357
63 1HG1 ILE 10 HG12 ILE 10 8.234 5.982 -1.320
64 2HG1 ILE 10 HG11 ILE 10 6.948 6.261 -2.493
65 1HG2 ILE 10 HG21 ILE 10 8.573 7.873 0.592
66 2HG2 ILE 10 HG22 ILE 10 7.465 6.501 0.592
67 3HG2 ILE 10 HG23 ILE 10 6.883 8.103 1.046
68 1HD1 ILE 10 HD11 ILE 10 8.466 7.069 -3.943
69 2HD1 ILE 10 HD12 ILE 10 9.745 6.843 -2.750
70 3HD1 ILE 10 HD13 ILE 10 8.848 8.360 -2.805
71 H CYS 11 H CYS 11 5.945 5.440 -0.656
72 HA CYS 11 HA CYS 11 3.994 5.610 1.601
73 1HB CYS 11 HB2 CYS 11 4.087 3.011 0.304
74 2HB CYS 11 HB1 CYS 11 2.698 3.948 0.822
75 H SER 12 H SER 12 4.271 3.932 3.230
76 HA SER 12 HA SER 12 7.130 3.141 3.482
77 1HB SER 12 HB2 SER 12 5.550 2.556 5.820
78 2HB SER 12 HB1 SER 12 6.888 3.689 5.653
79 HG SER 12 HG SER 12 4.147 4.104 5.538
80 H LEU 13 H LEU 13 7.690 0.964 3.742
81 HA LEU 13 HA LEU 13 6.304 -1.049 2.463
82 1HB LEU 13 HB2 LEU 13 8.197 -1.115 4.799
83 2HB LEU 13 HB1 LEU 13 7.465 -2.607 4.218
84 HG LEU 13 HG LEU 13 9.758 -1.883 3.223
85 1HD1 LEU 13 HD11 LEU 13 9.276 -3.334 1.552
86 2HD1 LEU 13 HD12 LEU 13 7.943 -2.342 0.957
87 3HD1 LEU 13 HD13 LEU 13 7.688 -3.442 2.312
88 1HD2 LEU 13 HD21 LEU 13 9.212 0.435 2.721
89 2HD2 LEU 13 HD22 LEU 13 7.833 -0.062 1.740
90 3HD2 LEU 13 HD23 LEU 13 9.473 -0.421 1.202
91 H TYR 14 H TYR 14 5.607 0.269 5.629
92 HA TYR 14 HA TYR 14 3.875 -1.952 6.385
93 1HB TYR 14 HB2 TYR 14 4.813 -0.874 8.245
94 2HB TYR 14 HB1 TYR 14 4.521 0.730 7.579
95 HD1 TYR 14 HD1 TYR 14 2.931 -2.216 9.177
96 HD2 TYR 14 HD2 TYR 14 2.390 1.834 7.845
97 HE1 TYR 14 HE1 TYR 14 0.773 -2.104 10.396
98 HE2 TYR 14 HE2 TYR 14 0.232 1.946 9.064
99 HH TYR 14 HH TYR 14 -0.737 0.610 11.211
100 H GLN 15 H GLN 15 3.461 1.148 4.805
101 HA GLN 15 HA GLN 15 0.590 1.180 5.138
102 1HB GLN 15 HB2 GLN 15 2.557 2.780 3.563
103 2HB GLN 15 HB1 GLN 15 0.880 2.798 3.014
104 1HG GLN 15 HG2 GLN 15 0.120 3.843 4.917
105 2HG GLN 15 HG1 GLN 15 1.384 3.151 5.933
106 1HE2 GLN 15 HE21 GLN 15 1.556 5.561 6.633
107 2HE2 GLN 15 HE22 GLN 15 2.575 6.558 5.711
108 H LEU 16 H LEU 16 2.745 -0.177 2.603
109 HA LEU 16 HA LEU 16 0.381 -0.915 1.019
110 1HB LEU 16 HB2 LEU 16 2.942 -0.386 0.294
111 2HB LEU 16 HB1 LEU 16 2.979 -2.131 0.365
112 HG LEU 16 HG LEU 16 2.360 -1.109 -1.849
113 1HD1 LEU 16 HD11 LEU 16 0.248 -2.935 -0.727
114 2HD1 LEU 16 HD12 LEU 16 1.907 -3.479 -0.958
115 3HD1 LEU 16 HD13 LEU 16 0.957 -2.947 -2.341
116 1HD2 LEU 16 HD21 LEU 16 0.428 0.067 -2.132
117 2HD2 LEU 16 HD22 LEU 16 0.617 0.402 -0.411
118 3HD2 LEU 16 HD23 LEU 16 -0.444 -0.902 -0.943
119 H GLU 17 H GLU 17 2.180 -2.129 3.620
120 HA GLU 17 HA GLU 17 1.604 -4.955 3.101
121 1HB GLU 17 HB2 GLU 17 3.523 -3.887 4.577
122 2HB GLU 17 HB1 GLU 17 2.276 -3.890 5.823
123 1HG GLU 17 HG2 GLU 17 2.085 -6.411 4.613
124 2HG GLU 17 HG1 GLU 17 3.816 -6.115 4.772
125 H ASN 18 H ASN 18 -0.373 -2.483 3.594
126 HA ASN 18 HA ASN 18 -2.165 -4.060 5.399
127 1HB ASN 18 HB2 ASN 18 -1.235 -1.481 5.808
128 2HB ASN 18 HB1 ASN 18 -2.830 -1.222 5.103
129 1HD2 ASN 18 HD21 ASN 18 -4.607 -1.494 6.490
130 2HD2 ASN 18 HD22 ASN 18 -4.524 -2.205 8.029
131 H TYR 19 H TYR 19 -1.720 -3.765 2.301
132 HA TYR 19 HA TYR 19 -4.604 -3.257 1.688
133 1HB TYR 19 HB2 TYR 19 -2.119 -2.727 0.051
134 2HB TYR 19 HB1 TYR 19 -3.728 -2.782 -0.668
135 HD1 TYR 19 HD1 TYR 19 -1.514 -0.971 1.659
136 HD2 TYR 19 HD2 TYR 19 -5.406 -1.092 -0.159
137 HE1 TYR 19 HE1 TYR 19 -1.943 1.349 2.424
138 HE2 TYR 19 HE2 TYR 19 -5.837 1.228 0.609
139 HH TYR 19 HH TYR 19 -4.572 3.208 1.272
140 H CYS 20 H CYS 20 -3.024 -5.800 2.419
141 HA CYS 20 HA CYS 20 -3.386 -7.338 -0.085
142 1HB CYS 20 HB2 CYS 20 -2.524 -8.561 2.514
143 2HB CYS 20 HB1 CYS 20 -2.094 -9.030 0.873
144 H ASN 21 H ASN 21 -4.731 -9.264 -0.099
145 HA ASN 21 HA ASN 21 -7.152 -8.914 1.559
146 1HB ASN 21 HB2 ASN 21 -6.755 -9.652 -1.076
147 2HB ASN 21 HB1 ASN 21 -7.085 -11.195 -0.289
148 1HD2 ASN 21 HD21 ASN 21 -8.654 -8.732 -1.845
149 2HD2 ASN 21 HD22 ASN 21 -10.168 -8.827 -1.083
150 1H PHE 1 HT1 PHE 1 11.283 -0.162 4.081
151 2H PHE 1 HT2 PHE 1 11.776 1.425 3.727
152 3H PHE 1 HT3 PHE 1 12.459 0.593 5.040
153 HA PHE 1 HA PHE 1 14.113 0.354 3.492
154 1HB PHE 1 HB2 PHE 1 12.313 -1.962 2.746
155 2HB PHE 1 HB1 PHE 1 14.075 -1.936 2.791
156 HD1 PHE 1 HD1 PHE 1 11.216 -2.947 4.550
157 HD2 PHE 1 HD2 PHE 1 15.071 -1.151 5.171
158 HE1 PHE 1 HE1 PHE 1 11.169 -3.668 6.923
159 HE2 PHE 1 HE2 PHE 1 15.023 -1.871 7.546
160 HZ PHE 1 HZ PHE 1 13.072 -3.129 8.421
161 H VAL 2 H VAL 2 11.277 -0.777 1.625
162 HA VAL 2 HA VAL 2 12.382 0.687 -0.721
163 HB VAL 2 HB VAL 2 10.112 -0.795 -1.522
164 1HG1 VAL 2 HG11 VAL 2 12.550 -0.324 -2.483
165 2HG1 VAL 2 HG12 VAL 2 11.607 -1.715 -3.020
166 3HG1 VAL 2 HG13 VAL 2 12.866 -1.919 -1.801
167 1HG2 VAL 2 HG21 VAL 2 10.665 -3.071 -0.749
168 2HG2 VAL 2 HG22 VAL 2 10.259 -2.033 0.617
169 3HG2 VAL 2 HG23 VAL 2 11.945 -2.418 0.274
170 H ASN 3 H ASN 3 11.639 2.790 -0.024
171 HA ASN 3 HA ASN 3 8.777 3.225 0.434
172 1HB ASN 3 HB2 ASN 3 9.451 5.647 0.442
173 2HB ASN 3 HB1 ASN 3 10.351 4.663 1.597
174 1HD2 ASN 3 HD21 ASN 3 11.051 7.197 -0.115
175 2HD2 ASN 3 HD22 ASN 3 12.555 6.795 -0.792
176 H GLN 4 H GLN 4 7.895 2.420 -1.585
177 HA GLN 4 HA GLN 4 8.635 3.970 -4.014
178 1HB GLN 4 HB2 GLN 4 7.096 1.401 -3.597
179 2HB GLN 4 HB1 GLN 4 7.167 2.224 -5.156
180 1HG GLN 4 HG2 GLN 4 9.793 2.207 -4.582
181 2HG GLN 4 HG1 GLN 4 9.309 0.770 -3.681
182 1HE2 GLN 4 HE21 GLN 4 10.006 1.978 -6.836
183 2HE2 GLN 4 HE22 GLN 4 9.516 0.607 -7.709
184 H HIS 5 H HIS 5 7.199 5.330 -5.013
185 HA HIS 5 HA HIS 5 4.582 5.781 -3.641
186 1HB HIS 5 HB2 HIS 5 4.698 8.042 -4.416
187 2HB HIS 5 HB1 HIS 5 6.321 7.665 -3.849
188 HD2 HIS 5 HD2 HIS 5 7.998 6.654 -6.176
189 HE1 HIS 5 HE1 HIS 5 5.947 9.256 -8.804
190 HE2 HIS 5 HE2 HIS 5 8.012 7.785 -8.520
191 H LEU 6 H LEU 6 2.824 4.940 -4.778
192 HA LEU 6 HA LEU 6 3.065 4.956 -7.719
193 1HB LEU 6 HB2 LEU 6 1.454 2.786 -7.175
194 2HB LEU 6 HB1 LEU 6 3.071 2.791 -7.860
195 HG LEU 6 HG LEU 6 2.947 1.348 -5.971
196 1HD1 LEU 6 HD11 LEU 6 4.499 3.447 -4.682
197 2HD1 LEU 6 HD12 LEU 6 4.874 3.225 -6.391
198 3HD1 LEU 6 HD13 LEU 6 5.014 1.868 -5.273
199 1HD2 LEU 6 HD21 LEU 6 1.406 3.479 -4.884
200 2HD2 LEU 6 HD22 LEU 6 2.742 3.108 -3.792
201 3HD2 LEU 6 HD23 LEU 6 1.607 1.841 -4.262
202 H CYS 7 H CYS 7 1.028 4.850 -8.947
203 HA CYS 7 HA CYS 7 -1.308 5.836 -7.380
204 1HB CYS 7 HB2 CYS 7 -0.738 6.767 -10.193
205 2HB CYS 7 HB1 CYS 7 -1.774 7.507 -8.976
206 H GLY 8 H GLY 8 -1.258 5.299 -10.907
207 1HA GLY 8 HA2 GLY 8 -3.617 3.659 -10.759
208 2HA GLY 8 HA1 GLY 8 -2.633 3.899 -12.200
209 H SER 9 H SER 9 -2.030 1.930 -12.971
210 HA SER 9 HA SER 9 -2.039 -0.534 -11.699
211 1HB SER 9 HB2 SER 9 -1.076 0.418 -14.136
212 2HB SER 9 HB1 SER 9 0.363 -0.235 -13.355
213 HG SER 9 HG SER 9 -1.858 -1.506 -14.346
214 H ASP 10 H ASP 10 0.371 2.002 -11.538
215 HA ASP 10 HA ASP 10 2.480 0.715 -10.212
216 1HB ASP 10 HB2 ASP 10 1.785 3.321 -10.870
217 2HB ASP 10 HB1 ASP 10 1.881 3.346 -9.125
218 H LEU 11 H LEU 11 -0.649 1.811 -8.887
219 HA LEU 11 HA LEU 11 0.036 1.125 -6.142
220 1HB LEU 11 HB2 LEU 11 -2.333 1.995 -7.594
221 2HB LEU 11 HB1 LEU 11 -2.737 0.626 -6.590
222 HG LEU 11 HG LEU 11 -3.115 2.274 -5.064
223 1HD1 LEU 11 HD11 LEU 11 -1.502 2.174 -3.441
224 2HD1 LEU 11 HD12 LEU 11 -0.197 2.568 -4.558
225 3HD1 LEU 11 HD13 LEU 11 -0.851 0.932 -4.509
226 1HD2 LEU 11 HD21 LEU 11 -2.824 4.155 -6.438
227 2HD2 LEU 11 HD22 LEU 11 -1.102 3.848 -6.652
228 3HD2 LEU 11 HD23 LEU 11 -1.707 4.430 -5.102
229 1HN ABA 12 H ABA 12 -1.848 -0.411 -8.704
230 HA ABA 12 HA ABA 12 -2.384 -2.915 -7.568
231 1HB ABA 12 HB1 ABA 12 -1.555 -2.815 -10.445
232 2HB ABA 12 HB2 ABA 12 -2.939 -1.846 -9.957
233 1HG ABA 12 HG1 ABA 12 -4.266 -3.638 -9.691
234 2HG ABA 12 HG2 ABA 12 -2.997 -4.573 -8.899
235 3HG ABA 12 HG3 ABA 12 -3.059 -4.485 -10.659
236 H GLU 13 H GLU 13 0.647 -1.614 -8.616
237 HA GLU 13 HA GLU 13 1.933 -4.240 -8.856
238 1HB GLU 13 HB2 GLU 13 2.637 -1.504 -9.491
239 2HB GLU 13 HB1 GLU 13 3.929 -2.303 -8.609
240 1HG GLU 13 HG2 GLU 13 3.945 -4.142 -10.208
241 2HG GLU 13 HG1 GLU 13 2.558 -3.455 -11.055
242 H ALA 14 H ALA 14 2.303 -1.452 -6.615
243 HA ALA 14 HA ALA 14 4.106 -2.613 -4.823
244 1HB ALA 14 HB1 ALA 14 2.741 -0.305 -4.794
245 2HB ALA 14 HB2 ALA 14 3.464 -0.969 -3.330
246 3HB ALA 14 HB3 ALA 14 1.745 -1.206 -3.650
247 H LEU 15 H LEU 15 0.593 -2.906 -4.914
248 HA LEU 15 HA LEU 15 0.336 -4.836 -2.806
249 1HB LEU 15 HB2 LEU 15 -1.430 -4.785 -5.249
250 2HB LEU 15 HB1 LEU 15 -1.883 -5.233 -3.612
251 HG LEU 15 HG LEU 15 -1.277 -2.462 -4.706
252 1HD1 LEU 15 HD11 LEU 15 -3.535 -2.013 -4.321
253 2HD1 LEU 15 HD12 LEU 15 -3.691 -3.317 -3.144
254 3HD1 LEU 15 HD13 LEU 15 -3.571 -3.691 -4.863
255 1HD2 LEU 15 HD21 LEU 15 -1.007 -3.430 -1.955
256 2HD2 LEU 15 HD22 LEU 15 -2.182 -2.123 -2.090
257 3HD2 LEU 15 HD23 LEU 15 -0.526 -1.879 -2.645
258 H TYR 16 H TYR 16 0.907 -5.113 -6.304
259 HA TYR 16 HA TYR 16 0.740 -8.024 -6.310
260 1HB TYR 16 HB2 TYR 16 1.196 -5.878 -8.253
261 2HB TYR 16 HB1 TYR 16 2.162 -7.316 -8.573
262 HD1 TYR 16 HD1 TYR 16 -0.675 -5.861 -9.623
263 HD2 TYR 16 HD2 TYR 16 0.531 -9.556 -7.787
264 HE1 TYR 16 HE1 TYR 16 -2.676 -6.978 -10.566
265 HE2 TYR 16 HE2 TYR 16 -1.476 -10.673 -8.731
266 HH TYR 16 HH TYR 16 -3.468 -10.330 -9.743
267 H LEU 17 H LEU 17 3.281 -5.689 -5.732
268 HA LEU 17 HA LEU 17 5.336 -7.835 -5.952
269 1HB LEU 17 HB2 LEU 17 5.364 -4.869 -6.022
270 2HB LEU 17 HB1 LEU 17 6.752 -5.653 -5.264
271 HG LEU 17 HG LEU 17 7.167 -5.371 -7.659
272 1HD1 LEU 17 HD11 LEU 17 6.635 -8.257 -7.691
273 2HD1 LEU 17 HD12 LEU 17 7.446 -7.714 -6.222
274 3HD1 LEU 17 HD13 LEU 17 8.173 -7.398 -7.798
275 1HD2 LEU 17 HD21 LEU 17 4.469 -5.760 -7.937
276 2HD2 LEU 17 HD22 LEU 17 5.106 -7.311 -8.483
277 3HD2 LEU 17 HD23 LEU 17 5.622 -5.820 -9.270
278 H VAL 18 H VAL 18 3.464 -6.048 -3.699
279 HA VAL 18 HA VAL 18 5.294 -6.540 -1.453
280 HB VAL 18 HB VAL 18 2.539 -5.321 -1.699
281 1HG1 VAL 18 HG11 VAL 18 2.762 -6.519 0.448
282 2HG1 VAL 18 HG12 VAL 18 2.771 -4.773 0.698
283 3HG1 VAL 18 HG13 VAL 18 4.282 -5.682 0.756
284 1HG2 VAL 18 HG21 VAL 18 3.613 -3.296 -1.647
285 2HG2 VAL 18 HG22 VAL 18 4.961 -4.241 -2.278
286 3HG2 VAL 18 HG23 VAL 18 4.869 -3.880 -0.555
287 H CYS 19 H CYS 19 1.895 -7.426 -2.178
288 HA CYS 19 HA CYS 19 2.317 -9.891 -0.537
289 1HB CYS 19 HB2 CYS 19 -0.100 -8.159 -1.050
290 2HB CYS 19 HB1 CYS 19 -0.281 -9.826 -0.509
291 H GLY 20 H GLY 20 -0.158 -9.052 -2.951
292 1HA GLY 20 HA2 GLY 20 -0.565 -10.007 -5.076
293 2HA GLY 20 HA1 GLY 20 0.951 -10.892 -4.928
294 H GLU 21 H GLU 21 0.912 -12.993 -4.106
295 HA GLU 21 HA GLU 21 -1.289 -14.622 -4.506
296 1HB GLU 21 HB2 GLU 21 -0.210 -16.212 -2.856
297 2HB GLU 21 HB1 GLU 21 0.860 -15.619 -4.126
298 1HG GLU 21 HG2 GLU 21 2.252 -14.800 -2.564
299 2HG GLU 21 HG1 GLU 21 0.962 -13.747 -1.981
300 H ARG 22 H ARG 22 -0.784 -12.490 -1.798
301 HA ARG 22 HA ARG 22 -2.764 -13.834 -0.108
302 1HB ARG 22 HB2 ARG 22 -1.131 -11.329 0.075
303 2HB ARG 22 HB1 ARG 22 -2.539 -11.504 1.120
304 1HG ARG 22 HG2 ARG 22 -0.441 -13.665 0.895
305 2HG ARG 22 HG1 ARG 22 -0.294 -12.341 2.052
306 1HD ARG 22 HD2 ARG 22 -1.977 -13.134 3.375
307 2HD ARG 22 HD1 ARG 22 -2.927 -13.702 2.000
308 HE ARG 22 HE ARG 22 -1.554 -15.732 1.969
309 1HH1 ARG 22 HH21 ARG 22 0.772 -14.266 3.419
310 2HH1 ARG 22 HH22 ARG 22 0.762 -15.108 4.932
311 1HH2 ARG 22 HH11 ARG 22 -2.363 -16.522 4.426
312 2HH2 ARG 22 HH12 ARG 22 -1.015 -16.382 5.505
313 H GLY 23 H GLY 23 -2.805 -11.574 -2.688
314 1HA GLY 23 HA2 GLY 23 -4.873 -10.967 -3.792
315 2HA GLY 23 HA1 GLY 23 -5.721 -11.201 -2.270
316 H PHE 24 H PHE 24 -5.787 -8.754 -3.967
317 HA PHE 24 HA PHE 24 -5.182 -6.874 -1.790
318 1HB PHE 24 HB2 PHE 24 -3.847 -5.344 -3.141
319 2HB PHE 24 HB1 PHE 24 -3.052 -6.906 -3.052
320 HD1 PHE 24 HD1 PHE 24 -5.326 -4.867 -5.242
321 HD2 PHE 24 HD2 PHE 24 -2.463 -8.068 -5.016
322 HE1 PHE 24 HE1 PHE 24 -5.314 -5.043 -7.706
323 HE2 PHE 24 HE2 PHE 24 -2.453 -8.236 -7.477
324 HZ PHE 24 HZ PHE 24 -3.873 -6.709 -8.834
325 H PHE 25 H PHE 25 -6.671 -5.227 -1.766
326 HA PHE 25 HA PHE 25 -8.595 -5.178 -4.039
327 1HB PHE 25 HB2 PHE 25 -9.757 -3.600 -2.145
328 2HB PHE 25 HB1 PHE 25 -10.030 -5.333 -2.281
329 HD1 PHE 25 HD1 PHE 25 -8.130 -2.704 -0.488
330 HD2 PHE 25 HD2 PHE 25 -9.128 -6.880 -0.675
331 HE1 PHE 25 HE1 PHE 25 -7.167 -3.035 1.775
332 HE2 PHE 25 HE2 PHE 25 -8.164 -7.213 1.587
333 HZ PHE 25 HZ PHE 25 -7.184 -5.289 2.812
334 H TYR 26 H TYR 26 -8.734 -3.429 -5.342
335 HA TYR 26 HA TYR 26 -7.318 -0.934 -4.485
336 1HB TYR 26 HB2 TYR 26 -6.016 -1.871 -6.256
337 2HB TYR 26 HB1 TYR 26 -7.453 -2.277 -7.192
338 HD1 TYR 26 HD1 TYR 26 -7.224 0.912 -5.383
339 HD2 TYR 26 HD2 TYR 26 -6.659 -1.045 -9.169
340 HE1 TYR 26 HE1 TYR 26 -7.113 3.121 -6.511
341 HE2 TYR 26 HE2 TYR 26 -6.549 1.162 -10.294
342 HH TYR 26 HH TYR 26 -6.782 3.357 -10.052
343 H THR 27 H THR 27 -9.466 -0.284 -3.647
344 HA THR 27 HA THR 27 -11.882 -0.156 -4.972
345 HB THR 27 HB THR 27 -11.740 0.737 -2.754
346 HG1 THR 27 HG1 THR 27 -12.162 2.880 -4.563
347 1HG2 THR 27 HG21 THR 27 -10.211 2.299 -2.035
348 2HG2 THR 27 HG22 THR 27 -10.176 3.134 -3.587
349 3HG2 THR 27 HG23 THR 27 -9.297 1.620 -3.383
350 H LYS 28 H LYS 28 -12.382 0.514 -6.991
351 HA LYS 28 HA LYS 28 -11.510 3.125 -7.969
352 1HB LYS 28 HB2 LYS 28 -9.527 1.980 -8.634
353 2HB LYS 28 HB1 LYS 28 -10.435 0.564 -9.162
354 1HG LYS 28 HG2 LYS 28 -10.830 1.451 -11.205
355 2HG LYS 28 HG1 LYS 28 -11.293 3.011 -10.523
356 1HD LYS 28 HD2 LYS 28 -9.147 3.851 -10.631
357 2HD LYS 28 HD1 LYS 28 -8.401 2.265 -10.438
358 1HE LYS 28 HE2 LYS 28 -8.180 3.293 -12.758
359 2HE LYS 28 HE1 LYS 28 -8.870 1.669 -12.715
360 1HZ LYS 28 HZ1 LYS 28 -10.450 4.181 -12.801
361 2HZ LYS 28 HZ2 LYS 28 -11.065 2.598 -12.862
362 3HZ LYS 28 HZ3 LYS 28 -10.125 3.197 -14.143
363 HA PRO 29 HA PRO 29 -15.451 2.355 -9.893
364 1HB PRO 29 HB2 PRO 29 -15.661 4.813 -11.103
365 2HB PRO 29 HB1 PRO 29 -15.986 4.539 -9.382
366 1HG PRO 29 HG2 PRO 29 -13.628 5.839 -10.662
367 2HG PRO 29 HG1 PRO 29 -14.300 6.080 -9.041
368 1HD PRO 29 HD2 PRO 29 -12.009 4.538 -9.673
369 2HD PRO 29 HD1 PRO 29 -12.883 4.530 -8.126
370 H THR 30 H THR 30 -16.220 3.291 -12.357
371 HA THR 30 HA THR 30 -16.026 2.730 -14.632
372 HB THR 30 HB THR 30 -13.115 3.125 -14.722
373 HG1 THR 30 HG1 THR 30 -13.248 5.287 -14.065
374 1HG2 THR 30 HG21 THR 30 -13.856 4.905 -16.332
375 2HG2 THR 30 HG22 THR 30 -15.525 4.493 -15.940
376 3HG2 THR 30 HG23 THR 30 -14.481 3.300 -16.711
Start of MODEL 10
1 1H GLY 1 HT1 GLY 1 -7.878 4.740 -0.323
2 2H GLY 1 HT2 GLY 1 -7.842 5.911 -1.554
3 3H GLY 1 HT3 GLY 1 -8.972 6.038 -0.292
4 1HA GLY 1 HA1 GLY 1 -6.872 7.457 -0.116
5 2HA GLY 1 HA2 GLY 1 -7.405 6.613 1.369
6 H ILE 2 H ILE 2 -5.864 5.000 -1.342
7 HA ILE 2 HA ILE 2 -3.153 5.717 -0.349
8 HB ILE 2 HB ILE 2 -3.969 3.262 -0.661
9 1HG1 ILE 2 HG12 ILE 2 -1.363 4.127 -1.933
10 2HG1 ILE 2 HG11 ILE 2 -1.635 4.060 -0.191
11 1HG2 ILE 2 HG21 ILE 2 -4.807 3.595 -2.994
12 2HG2 ILE 2 HG22 ILE 2 -3.575 2.337 -2.895
13 3HG2 ILE 2 HG23 ILE 2 -3.154 3.934 -3.510
14 1HD1 ILE 2 HD11 ILE 2 -0.798 1.948 -1.845
15 2HD1 ILE 2 HD12 ILE 2 -2.483 1.594 -1.459
16 3HD1 ILE 2 HD13 ILE 2 -1.313 1.833 -0.162
17 H VAL 3 H VAL 3 -5.200 5.971 -3.167
18 HA VAL 3 HA VAL 3 -3.165 6.643 -5.075
19 HB VAL 3 HB VAL 3 -5.857 7.949 -5.213
20 1HG1 VAL 3 HG11 VAL 3 -4.767 8.296 -7.202
21 2HG1 VAL 3 HG12 VAL 3 -5.451 6.712 -7.566
22 3HG1 VAL 3 HG13 VAL 3 -3.776 6.847 -7.032
23 1HG2 VAL 3 HG21 VAL 3 -6.433 5.534 -6.270
24 2HG2 VAL 3 HG22 VAL 3 -6.791 5.948 -4.592
25 3HG2 VAL 3 HG23 VAL 3 -5.336 5.031 -4.984
26 H GLU 4 H GLU 4 -4.328 8.255 -2.334
27 HA GLU 4 HA GLU 4 -3.362 10.881 -3.356
28 1HB GLU 4 HB2 GLU 4 -5.618 10.958 -2.446
29 2HB GLU 4 HB1 GLU 4 -5.079 10.190 -0.954
30 1HG GLU 4 HG2 GLU 4 -3.452 12.515 -1.533
31 2HG GLU 4 HG1 GLU 4 -5.161 12.953 -1.501
32 H GLN 5 H GLN 5 -2.479 8.267 -1.326
33 HA GLN 5 HA GLN 5 -0.599 10.013 0.187
34 1HB GLN 5 HB2 GLN 5 -2.001 7.495 0.786
35 2HB GLN 5 HB1 GLN 5 -0.305 7.515 1.274
36 1HG GLN 5 HG2 GLN 5 -1.638 10.026 1.910
37 2HG GLN 5 HG1 GLN 5 -2.429 8.651 2.682
38 1HE2 GLN 5 HE21 GLN 5 -0.789 10.713 4.042
39 2HE2 GLN 5 HE22 GLN 5 0.517 9.891 4.752
40 H CYS 6 H CYS 6 -0.711 7.211 -1.980
41 HA CYS 6 HA CYS 6 2.204 6.846 -1.853
42 1HB CYS 6 HB2 CYS 6 -0.021 5.571 -3.409
43 2HB CYS 6 HB1 CYS 6 1.648 5.275 -3.848
44 H CYS 7 H CYS 7 -0.173 8.116 -4.182
45 HA CYS 7 HA CYS 7 1.803 8.686 -6.212
46 1HB CYS 7 HB2 CYS 7 -0.750 10.260 -5.920
47 2HB CYS 7 HB1 CYS 7 0.071 9.746 -7.392
48 H THR 8 H THR 8 -0.050 10.891 -4.085
49 HA THR 8 HA THR 8 1.702 13.129 -4.552
50 HB THR 8 HB THR 8 -0.441 12.519 -2.508
51 HG1 THR 8 HG1 THR 8 -1.268 13.142 -4.418
52 1HG2 THR 8 HG21 THR 8 1.295 13.880 -1.384
53 2HG2 THR 8 HG22 THR 8 -0.173 14.817 -1.660
54 3HG2 THR 8 HG23 THR 8 1.228 15.047 -2.705
55 H SER 9 H SER 9 1.142 11.561 -1.383
56 HA SER 9 HA SER 9 3.882 12.233 -0.579
57 1HB SER 9 HB2 SER 9 3.147 10.870 1.506
58 2HB SER 9 HB1 SER 9 2.353 12.410 1.205
59 HG SER 9 HG SER 9 1.400 9.807 0.964
60 H ILE 10 H ILE 10 4.984 10.249 0.692
61 HA ILE 10 HA ILE 10 5.180 8.084 -1.345
62 HB ILE 10 HB ILE 10 7.065 8.862 0.896
63 1HG1 ILE 10 HG12 ILE 10 6.830 10.419 -1.122
64 2HG1 ILE 10 HG11 ILE 10 8.453 9.798 -0.819
65 1HG2 ILE 10 HG21 ILE 10 8.499 7.294 -0.783
66 2HG2 ILE 10 HG22 ILE 10 6.908 6.557 -0.968
67 3HG2 ILE 10 HG23 ILE 10 7.650 6.665 0.629
68 1HD1 ILE 10 HD11 ILE 10 7.140 9.640 -3.233
69 2HD1 ILE 10 HD12 ILE 10 6.822 8.053 -2.534
70 3HD1 ILE 10 HD13 ILE 10 8.483 8.604 -2.748
71 H CYS 11 H CYS 11 5.192 5.868 -0.659
72 HA CYS 11 HA CYS 11 4.188 5.397 2.116
73 1HB CYS 11 HB2 CYS 11 2.920 3.409 0.965
74 2HB CYS 11 HB1 CYS 11 2.209 5.019 0.921
75 H SER 12 H SER 12 5.186 3.676 3.137
76 HA SER 12 HA SER 12 7.328 2.329 1.576
77 1HB SER 12 HB2 SER 12 7.500 1.595 4.296
78 2HB SER 12 HB1 SER 12 8.531 2.732 3.432
79 HG SER 12 HG SER 12 7.285 4.387 4.107
80 H LEU 13 H LEU 13 7.506 0.081 1.580
81 HA LEU 13 HA LEU 13 5.471 -1.583 1.078
82 1HB LEU 13 HB2 LEU 13 7.033 -3.129 2.924
83 2HB LEU 13 HB1 LEU 13 6.979 -3.237 1.175
84 HG LEU 13 HG LEU 13 9.261 -2.841 2.058
85 1HD1 LEU 13 HD11 LEU 13 9.558 -1.929 0.039
86 2HD1 LEU 13 HD12 LEU 13 9.158 -0.354 0.724
87 3HD1 LEU 13 HD13 LEU 13 7.891 -1.356 0.017
88 1HD2 LEU 13 HD21 LEU 13 7.924 -0.981 3.701
89 2HD2 LEU 13 HD22 LEU 13 8.969 -0.031 2.648
90 3HD2 LEU 13 HD23 LEU 13 9.653 -1.307 3.651
91 H TYR 14 H TYR 14 6.288 -0.524 4.348
92 HA TYR 14 HA TYR 14 4.565 -2.271 5.772
93 1HB TYR 14 HB2 TYR 14 6.320 -0.637 6.705
94 2HB TYR 14 HB1 TYR 14 5.062 0.591 6.566
95 HD1 TYR 14 HD1 TYR 14 5.451 -2.930 7.823
96 HD2 TYR 14 HD2 TYR 14 3.720 0.957 8.431
97 HE1 TYR 14 HE1 TYR 14 4.462 -3.705 9.962
98 HE2 TYR 14 HE2 TYR 14 2.731 0.180 10.570
99 HH TYR 14 HH TYR 14 3.253 -1.631 12.284
100 H GLN 15 H GLN 15 3.949 1.040 4.683
101 HA GLN 15 HA GLN 15 1.182 0.986 5.419
102 1HB GLN 15 HB2 GLN 15 2.758 2.708 3.498
103 2HB GLN 15 HB1 GLN 15 1.032 2.942 3.774
104 1HG GLN 15 HG2 GLN 15 1.352 3.830 5.837
105 2HG GLN 15 HG1 GLN 15 2.635 2.687 6.234
106 1HE2 GLN 15 HE21 GLN 15 3.027 5.381 6.903
107 2HE2 GLN 15 HE22 GLN 15 4.203 6.060 5.884
108 H LEU 16 H LEU 16 2.910 -0.184 2.568
109 HA LEU 16 HA LEU 16 0.413 -0.477 1.090
110 1HB LEU 16 HB2 LEU 16 2.976 -0.240 0.248
111 2HB LEU 16 HB1 LEU 16 2.762 -1.973 0.164
112 HG LEU 16 HG LEU 16 2.169 -0.369 -1.871
113 1HD1 LEU 16 HD11 LEU 16 2.078 -2.838 -1.796
114 2HD1 LEU 16 HD12 LEU 16 0.707 -2.164 -2.671
115 3HD1 LEU 16 HD13 LEU 16 0.500 -2.747 -1.021
116 1HD2 LEU 16 HD21 LEU 16 0.425 0.841 -0.458
117 2HD2 LEU 16 HD22 LEU 16 -0.519 -0.649 -0.513
118 3HD2 LEU 16 HD23 LEU 16 -0.143 0.212 -2.005
119 H GLU 17 H GLU 17 2.142 -2.196 3.426
120 HA GLU 17 HA GLU 17 1.149 -4.848 2.671
121 1HB GLU 17 HB2 GLU 17 3.266 -4.148 4.142
122 2HB GLU 17 HB1 GLU 17 2.080 -4.218 5.445
123 1HG GLU 17 HG2 GLU 17 1.620 -6.504 5.065
124 2HG GLU 17 HG1 GLU 17 2.350 -6.472 3.458
125 H ASN 18 H ASN 18 -0.442 -2.211 3.532
126 HA ASN 18 HA ASN 18 -2.245 -3.615 5.462
127 1HB ASN 18 HB2 ASN 18 -1.209 -1.013 5.482
128 2HB ASN 18 HB1 ASN 18 -2.886 -0.819 4.967
129 1HD2 ASN 18 HD21 ASN 18 -4.589 -1.677 6.437
130 2HD2 ASN 18 HD22 ASN 18 -4.250 -1.912 8.084
131 H TYR 19 H TYR 19 -1.952 -3.394 2.265
132 HA TYR 19 HA TYR 19 -4.892 -3.050 1.833
133 1HB TYR 19 HB2 TYR 19 -2.547 -2.407 0.032
134 2HB TYR 19 HB1 TYR 19 -4.204 -2.516 -0.564
135 HD1 TYR 19 HD1 TYR 19 -1.907 -0.665 1.662
136 HD2 TYR 19 HD2 TYR 19 -5.863 -0.850 -0.001
137 HE1 TYR 19 HE1 TYR 19 -2.346 1.645 2.456
138 HE2 TYR 19 HE2 TYR 19 -6.306 1.460 0.792
139 HH TYR 19 HH TYR 19 -5.544 3.146 2.057
140 H CYS 20 H CYS 20 -3.545 -5.529 2.602
141 HA CYS 20 HA CYS 20 -3.751 -7.087 0.072
142 1HB CYS 20 HB2 CYS 20 -2.716 -8.198 2.665
143 2HB CYS 20 HB1 CYS 20 -2.337 -8.696 1.020
144 H ASN 21 H ASN 21 -5.048 -9.038 0.077
145 HA ASN 21 HA ASN 21 -7.532 -8.786 1.484
146 1HB ASN 21 HB2 ASN 21 -6.329 -10.624 -0.442
147 2HB ASN 21 HB1 ASN 21 -7.349 -11.462 0.729
148 1HD2 ASN 21 HD21 ASN 21 -8.222 -11.307 -1.954
149 2HD2 ASN 21 HD22 ASN 21 -9.549 -10.254 -2.053
150 1H PHE 1 HT1 PHE 1 15.762 6.045 1.896
151 2H PHE 1 HT2 PHE 1 14.116 5.677 2.088
152 3H PHE 1 HT3 PHE 1 14.777 5.840 0.531
153 HA PHE 1 HA PHE 1 16.285 3.920 1.111
154 1HB PHE 1 HB2 PHE 1 15.916 4.007 3.540
155 2HB PHE 1 HB1 PHE 1 14.201 3.678 3.305
156 HD1 PHE 1 HD1 PHE 1 17.255 2.212 1.694
157 HD2 PHE 1 HD2 PHE 1 13.766 1.517 4.106
158 HE1 PHE 1 HE1 PHE 1 17.730 -0.224 1.680
159 HE2 PHE 1 HE2 PHE 1 14.241 -0.919 4.093
160 HZ PHE 1 HZ PHE 1 16.223 -1.788 2.879
161 H VAL 2 H VAL 2 12.986 3.090 2.058
162 HA VAL 2 HA VAL 2 12.652 1.807 -0.603
163 HB VAL 2 HB VAL 2 10.706 0.663 0.548
164 1HG1 VAL 2 HG11 VAL 2 12.831 -0.211 2.276
165 2HG1 VAL 2 HG12 VAL 2 13.512 0.209 0.704
166 3HG1 VAL 2 HG13 VAL 2 12.219 -0.986 0.815
167 1HG2 VAL 2 HG21 VAL 2 10.629 0.751 2.982
168 2HG2 VAL 2 HG22 VAL 2 10.490 2.391 2.353
169 3HG2 VAL 2 HG23 VAL 2 12.023 1.830 3.021
170 H ASN 3 H ASN 3 11.446 4.374 1.362
171 HA ASN 3 HA ASN 3 8.893 4.959 0.845
172 1HB ASN 3 HB2 ASN 3 10.547 7.158 -0.237
173 2HB ASN 3 HB1 ASN 3 9.383 7.171 1.084
174 1HD2 ASN 3 HD21 ASN 3 12.481 7.903 0.667
175 2HD2 ASN 3 HD22 ASN 3 13.164 7.316 2.105
176 H GLN 4 H GLN 4 8.099 3.732 -0.956
177 HA GLN 4 HA GLN 4 8.920 4.689 -3.648
178 1HB GLN 4 HB2 GLN 4 8.733 2.172 -2.870
179 2HB GLN 4 HB1 GLN 4 7.023 2.411 -3.235
180 1HG GLN 4 HG2 GLN 4 8.041 1.599 -5.250
181 2HG GLN 4 HG1 GLN 4 7.749 3.323 -5.494
182 1HE2 GLN 4 HE21 GLN 4 9.673 2.500 -7.143
183 2HE2 GLN 4 HE22 GLN 4 11.232 2.854 -6.571
184 H HIS 5 H HIS 5 7.471 5.761 -4.993
185 HA HIS 5 HA HIS 5 4.762 6.310 -3.854
186 1HB HIS 5 HB2 HIS 5 4.880 8.445 -4.692
187 2HB HIS 5 HB1 HIS 5 6.612 8.146 -4.606
188 HD2 HIS 5 HD2 HIS 5 7.856 7.622 -7.138
189 HE1 HIS 5 HE1 HIS 5 4.481 8.766 -9.415
190 HE2 HIS 5 HE2 HIS 5 6.965 8.188 -9.517
191 H LEU 6 H LEU 6 2.961 5.606 -5.029
192 HA LEU 6 HA LEU 6 3.346 4.812 -7.829
193 1HB LEU 6 HB2 LEU 6 2.062 2.757 -6.119
194 2HB LEU 6 HB1 LEU 6 2.963 2.553 -7.608
195 HG LEU 6 HG LEU 6 5.010 3.327 -6.298
196 1HD1 LEU 6 HD11 LEU 6 2.920 3.481 -4.349
197 2HD1 LEU 6 HD12 LEU 6 4.608 3.979 -4.209
198 3HD1 LEU 6 HD13 LEU 6 4.141 2.320 -3.823
199 1HD2 LEU 6 HD21 LEU 6 5.252 1.100 -6.710
200 2HD2 LEU 6 HD22 LEU 6 3.582 0.745 -6.272
201 3HD2 LEU 6 HD23 LEU 6 4.805 0.916 -5.014
202 H CYS 7 H CYS 7 1.445 5.077 -9.085
203 HA CYS 7 HA CYS 7 -1.033 5.678 -7.516
204 1HB CYS 7 HB2 CYS 7 0.317 7.426 -9.153
205 2HB CYS 7 HB1 CYS 7 -0.937 6.798 -10.225
206 H GLY 8 H GLY 8 -0.638 5.210 -11.052
207 1HA GLY 8 HA2 GLY 8 -3.049 3.670 -11.246
208 2HA GLY 8 HA1 GLY 8 -1.828 3.798 -12.511
209 H SER 9 H SER 9 -1.234 1.741 -13.104
210 HA SER 9 HA SER 9 -1.547 -0.627 -11.639
211 1HB SER 9 HB2 SER 9 -0.782 -0.677 -13.971
212 2HB SER 9 HB1 SER 9 0.725 0.117 -13.521
213 HG SER 9 HG SER 9 0.064 -2.491 -13.424
214 H ASP 10 H ASP 10 0.779 1.919 -11.387
215 HA ASP 10 HA ASP 10 2.827 0.883 -9.799
216 1HB ASP 10 HB2 ASP 10 1.751 3.424 -10.475
217 2HB ASP 10 HB1 ASP 10 1.920 3.385 -8.729
218 H LEU 11 H LEU 11 -0.516 1.693 -8.904
219 HA LEU 11 HA LEU 11 -0.152 1.033 -6.081
220 1HB LEU 11 HB2 LEU 11 -2.301 1.988 -7.776
221 2HB LEU 11 HB1 LEU 11 -2.857 0.585 -6.894
222 HG LEU 11 HG LEU 11 -3.375 2.085 -5.281
223 1HD1 LEU 11 HD11 LEU 11 -1.267 0.897 -4.429
224 2HD1 LEU 11 HD12 LEU 11 -1.777 2.362 -3.590
225 3HD1 LEU 11 HD13 LEU 11 -0.439 2.422 -4.738
226 1HD2 LEU 11 HD21 LEU 11 -1.321 3.912 -6.526
227 2HD2 LEU 11 HD22 LEU 11 -2.387 4.364 -5.197
228 3HD2 LEU 11 HD23 LEU 11 -3.066 3.958 -6.774
229 1HN ABA 12 H ABA 12 -1.754 -0.478 -8.853
230 HA ABA 12 HA ABA 12 -2.382 -2.976 -7.722
231 1HB ABA 12 HB1 ABA 12 -1.361 -2.947 -10.529
232 2HB ABA 12 HB2 ABA 12 -2.762 -1.942 -10.170
233 1HG ABA 12 HG1 ABA 12 -3.533 -4.117 -10.887
234 2HG ABA 12 HG2 ABA 12 -3.877 -3.932 -9.166
235 3HG ABA 12 HG3 ABA 12 -2.508 -4.914 -9.692
236 H GLU 13 H GLU 13 0.711 -1.667 -8.563
237 HA GLU 13 HA GLU 13 1.985 -4.325 -8.639
238 1HB GLU 13 HB2 GLU 13 2.718 -1.664 -9.484
239 2HB GLU 13 HB1 GLU 13 3.978 -2.366 -8.472
240 1HG GLU 13 HG2 GLU 13 4.515 -3.940 -10.018
241 2HG GLU 13 HG1 GLU 13 2.829 -4.229 -10.445
242 H ALA 14 H ALA 14 2.302 -1.377 -6.598
243 HA ALA 14 HA ALA 14 4.069 -2.385 -4.691
244 1HB ALA 14 HB1 ALA 14 1.646 -0.930 -3.693
245 2HB ALA 14 HB2 ALA 14 2.706 -0.097 -4.828
246 3HB ALA 14 HB3 ALA 14 3.344 -0.679 -3.290
247 H LEU 15 H LEU 15 0.596 -2.849 -4.957
248 HA LEU 15 HA LEU 15 0.312 -4.609 -2.681
249 1HB LEU 15 HB2 LEU 15 -1.366 -4.570 -5.202
250 2HB LEU 15 HB1 LEU 15 -1.883 -5.146 -3.623
251 HG LEU 15 HG LEU 15 -1.228 -2.277 -4.438
252 1HD1 LEU 15 HD11 LEU 15 -3.507 -3.649 -4.863
253 2HD1 LEU 15 HD12 LEU 15 -3.470 -1.913 -4.548
254 3HD1 LEU 15 HD13 LEU 15 -3.823 -3.041 -3.238
255 1HD2 LEU 15 HD21 LEU 15 -2.524 -2.494 -1.859
256 2HD2 LEU 15 HD22 LEU 15 -1.018 -1.679 -2.270
257 3HD2 LEU 15 HD23 LEU 15 -1.006 -3.390 -1.841
258 H TYR 16 H TYR 16 0.952 -5.060 -6.133
259 HA TYR 16 HA TYR 16 0.855 -7.977 -5.970
260 1HB TYR 16 HB2 TYR 16 1.232 -5.918 -8.035
261 2HB TYR 16 HB1 TYR 16 2.178 -7.376 -8.303
262 HD1 TYR 16 HD1 TYR 16 -0.559 -6.026 -9.535
263 HD2 TYR 16 HD2 TYR 16 0.449 -9.481 -7.188
264 HE1 TYR 16 HE1 TYR 16 -2.585 -7.182 -10.376
265 HE2 TYR 16 HE2 TYR 16 -1.576 -10.641 -8.031
266 HH TYR 16 HH TYR 16 -3.946 -9.748 -8.992
267 H LEU 17 H LEU 17 3.253 -5.552 -5.374
268 HA LEU 17 HA LEU 17 5.434 -7.569 -5.666
269 1HB LEU 17 HB2 LEU 17 5.257 -4.687 -6.018
270 2HB LEU 17 HB1 LEU 17 6.576 -5.136 -4.933
271 HG LEU 17 HG LEU 17 7.283 -5.116 -7.322
272 1HD1 LEU 17 HD11 LEU 17 8.696 -6.857 -6.940
273 2HD1 LEU 17 HD12 LEU 17 7.370 -7.999 -6.710
274 3HD1 LEU 17 HD13 LEU 17 7.876 -6.957 -5.381
275 1HD2 LEU 17 HD21 LEU 17 4.792 -6.380 -7.684
276 2HD2 LEU 17 HD22 LEU 17 6.001 -7.609 -8.054
277 3HD2 LEU 17 HD23 LEU 17 6.011 -6.073 -8.922
278 H VAL 18 H VAL 18 3.507 -5.891 -3.373
279 HA VAL 18 HA VAL 18 5.442 -6.402 -1.186
280 HB VAL 18 HB VAL 18 2.740 -5.038 -1.282
281 1HG1 VAL 18 HG11 VAL 18 4.318 -6.133 0.926
282 2HG1 VAL 18 HG12 VAL 18 2.660 -5.530 0.931
283 3HG1 VAL 18 HG13 VAL 18 4.009 -4.408 1.116
284 1HG2 VAL 18 HG21 VAL 18 5.190 -3.648 -0.353
285 2HG2 VAL 18 HG22 VAL 18 3.877 -3.058 -1.372
286 3HG2 VAL 18 HG23 VAL 18 5.152 -4.056 -2.069
287 H CYS 19 H CYS 19 2.008 -7.084 -1.916
288 HA CYS 19 HA CYS 19 2.198 -9.469 -0.133
289 1HB CYS 19 HB2 CYS 19 -0.046 -7.655 -0.972
290 2HB CYS 19 HB1 CYS 19 -0.406 -9.302 -0.457
291 H GLY 20 H GLY 20 0.050 -8.720 -2.873
292 1HA GLY 20 HA2 GLY 20 -0.329 -9.898 -4.873
293 2HA GLY 20 HA1 GLY 20 1.239 -10.671 -4.642
294 H GLU 21 H GLU 21 1.336 -12.637 -3.430
295 HA GLU 21 HA GLU 21 -0.741 -14.475 -3.788
296 1HB GLU 21 HB2 GLU 21 0.352 -15.761 -1.880
297 2HB GLU 21 HB1 GLU 21 1.432 -15.299 -3.196
298 1HG GLU 21 HG2 GLU 21 1.692 -13.109 -1.652
299 2HG GLU 21 HG1 GLU 21 1.317 -14.290 -0.397
300 H ARG 22 H ARG 22 -0.233 -12.216 -1.116
301 HA ARG 22 HA ARG 22 -2.276 -13.319 0.590
302 1HB ARG 22 HB2 ARG 22 -0.628 -10.868 0.508
303 2HB ARG 22 HB1 ARG 22 -2.193 -10.687 1.305
304 1HG ARG 22 HG2 ARG 22 -0.388 -13.018 1.934
305 2HG ARG 22 HG1 ARG 22 -0.189 -11.466 2.750
306 1HD ARG 22 HD2 ARG 22 -2.793 -11.677 3.129
307 2HD ARG 22 HD1 ARG 22 -2.481 -13.395 2.881
308 HE ARG 22 HE ARG 22 -0.583 -12.399 4.757
309 1HH1 ARG 22 HH21 ARG 22 -3.714 -11.506 5.041
310 2HH1 ARG 22 HH22 ARG 22 -4.095 -12.477 6.424
311 1HH2 ARG 22 HH11 ARG 22 -1.162 -14.321 6.265
312 2HH2 ARG 22 HH12 ARG 22 -2.649 -14.071 7.117
313 H GLY 23 H GLY 23 -2.359 -11.367 -2.246
314 1HA GLY 23 HA2 GLY 23 -4.361 -10.970 -3.502
315 2HA GLY 23 HA1 GLY 23 -5.305 -11.303 -2.060
316 H PHE 24 H PHE 24 -5.421 -8.927 -3.901
317 HA PHE 24 HA PHE 24 -5.324 -6.919 -1.730
318 1HB PHE 24 HB2 PHE 24 -4.203 -5.232 -3.080
319 2HB PHE 24 HB1 PHE 24 -3.160 -6.638 -2.935
320 HD1 PHE 24 HD1 PHE 24 -5.834 -5.267 -5.201
321 HD2 PHE 24 HD2 PHE 24 -2.168 -7.495 -4.888
322 HE1 PHE 24 HE1 PHE 24 -5.732 -5.448 -7.662
323 HE2 PHE 24 HE2 PHE 24 -2.068 -7.664 -7.348
324 HZ PHE 24 HZ PHE 24 -3.846 -6.639 -8.744
325 H PHE 25 H PHE 25 -6.753 -5.070 -2.209
326 HA PHE 25 HA PHE 25 -8.887 -5.900 -4.106
327 1HB PHE 25 HB2 PHE 25 -9.851 -3.695 -2.695
328 2HB PHE 25 HB1 PHE 25 -10.224 -5.384 -2.378
329 HD1 PHE 25 HD1 PHE 25 -8.706 -2.410 -1.085
330 HD2 PHE 25 HD2 PHE 25 -8.590 -6.699 -0.857
331 HE1 PHE 25 HE1 PHE 25 -7.553 -2.262 1.108
332 HE2 PHE 25 HE2 PHE 25 -7.436 -6.552 1.334
333 HZ PHE 25 HZ PHE 25 -6.918 -4.334 2.318
334 H TYR 26 H TYR 26 -8.421 -2.612 -3.046
335 HA TYR 26 HA TYR 26 -7.491 -0.749 -4.270
336 1HB TYR 26 HB2 TYR 26 -6.364 -2.110 -5.978
337 2HB TYR 26 HB1 TYR 26 -7.917 -2.478 -6.728
338 HD1 TYR 26 HD1 TYR 26 -6.053 0.568 -5.550
339 HD2 TYR 26 HD2 TYR 26 -8.519 -1.231 -8.577
340 HE1 TYR 26 HE1 TYR 26 -5.953 2.660 -6.879
341 HE2 TYR 26 HE2 TYR 26 -8.418 0.863 -9.905
342 HH TYR 26 HH TYR 26 -6.877 3.776 -8.620
343 H THR 27 H THR 27 -9.641 -0.201 -3.270
344 HA THR 27 HA THR 27 -11.923 -0.201 -5.146
345 HB THR 27 HB THR 27 -11.751 0.964 -2.352
346 HG1 THR 27 HG1 THR 27 -12.882 -1.512 -3.077
347 1HG2 THR 27 HG21 THR 27 -13.907 0.544 -4.369
348 2HG2 THR 27 HG22 THR 27 -13.707 1.842 -3.193
349 3HG2 THR 27 HG23 THR 27 -14.314 0.269 -2.675
350 H LYS 28 H LYS 28 -11.912 1.396 -6.652
351 HA LYS 28 HA LYS 28 -12.054 4.149 -5.993
352 1HB LYS 28 HB2 LYS 28 -9.700 3.985 -5.382
353 2HB LYS 28 HB1 LYS 28 -9.321 3.231 -6.930
354 1HG LYS 28 HG2 LYS 28 -9.027 5.270 -7.827
355 2HG LYS 28 HG1 LYS 28 -10.722 5.633 -7.507
356 1HD LYS 28 HD2 LYS 28 -9.950 6.162 -5.094
357 2HD LYS 28 HD1 LYS 28 -8.323 6.212 -5.773
358 1HE LYS 28 HE2 LYS 28 -9.154 7.875 -7.467
359 2HE LYS 28 HE1 LYS 28 -10.691 7.914 -6.602
360 1HZ LYS 28 HZ1 LYS 28 -8.610 9.513 -6.066
361 2HZ LYS 28 HZ2 LYS 28 -8.352 8.268 -4.942
362 3HZ LYS 28 HZ3 LYS 28 -9.822 9.120 -4.947
363 HA PRO 29 HA PRO 29 -13.396 3.294 -10.219
364 1HB PRO 29 HB2 PRO 29 -15.308 5.270 -10.221
365 2HB PRO 29 HB1 PRO 29 -15.573 3.651 -9.548
366 1HG PRO 29 HG2 PRO 29 -15.126 6.231 -8.118
367 2HG PRO 29 HG1 PRO 29 -15.994 4.785 -7.578
368 1HD PRO 29 HD2 PRO 29 -13.380 5.527 -6.799
369 2HD PRO 29 HD1 PRO 29 -14.126 3.934 -6.555
370 H THR 30 H THR 30 -11.565 4.095 -11.349
371 HA THR 30 HA THR 30 -10.402 5.635 -12.684
372 HB THR 30 HB THR 30 -12.589 7.626 -12.066
373 HG1 THR 30 HG1 THR 30 -12.704 5.888 -14.252
374 1HG2 THR 30 HG21 THR 30 -11.862 8.730 -13.951
375 2HG2 THR 30 HG22 THR 30 -11.334 7.246 -14.744
376 3HG2 THR 30 HG23 THR 30 -10.340 7.974 -13.482
Start of MODEL 11
1 1H GLY 1 HT1 GLY 1 -8.710 6.606 -0.419
2 2H GLY 1 HT2 GLY 1 -7.320 6.457 -1.383
3 3H GLY 1 HT3 GLY 1 -7.829 7.989 -0.855
4 1HA GLY 1 HA1 GLY 1 -6.598 7.701 0.979
5 2HA GLY 1 HA2 GLY 1 -7.554 6.262 1.441
6 H ILE 2 H ILE 2 -5.789 5.016 -0.692
7 HA ILE 2 HA ILE 2 -3.110 5.564 0.466
8 HB ILE 2 HB ILE 2 -4.110 3.178 0.198
9 1HG1 ILE 2 HG12 ILE 2 -1.341 3.899 -0.807
10 2HG1 ILE 2 HG11 ILE 2 -1.802 3.625 0.871
11 1HG2 ILE 2 HG21 ILE 2 -4.277 3.960 -2.471
12 2HG2 ILE 2 HG22 ILE 2 -4.370 2.302 -1.880
13 3HG2 ILE 2 HG23 ILE 2 -2.829 2.956 -2.428
14 1HD1 ILE 2 HD11 ILE 2 -1.431 1.651 -1.339
15 2HD1 ILE 2 HD12 ILE 2 -2.662 1.306 -0.124
16 3HD1 ILE 2 HD13 ILE 2 -0.981 1.528 0.362
17 H VAL 3 H VAL 3 -4.873 5.887 -2.543
18 HA VAL 3 HA VAL 3 -2.518 6.371 -4.177
19 HB VAL 3 HB VAL 3 -5.231 7.476 -4.838
20 1HG1 VAL 3 HG11 VAL 3 -2.815 6.446 -6.279
21 2HG1 VAL 3 HG12 VAL 3 -3.748 7.915 -6.567
22 3HG1 VAL 3 HG13 VAL 3 -4.386 6.351 -7.075
23 1HG2 VAL 3 HG21 VAL 3 -6.191 5.453 -4.601
24 2HG2 VAL 3 HG22 VAL 3 -4.649 4.725 -4.150
25 3HG2 VAL 3 HG23 VAL 3 -5.101 4.852 -5.850
26 H GLU 4 H GLU 4 -4.028 8.121 -1.766
27 HA GLU 4 HA GLU 4 -3.408 10.768 -2.927
28 1HB GLU 4 HB2 GLU 4 -5.468 10.548 -1.603
29 2HB GLU 4 HB1 GLU 4 -4.532 9.987 -0.217
30 1HG GLU 4 HG2 GLU 4 -4.096 12.106 0.398
31 2HG GLU 4 HG1 GLU 4 -3.409 12.454 -1.190
32 H GLN 5 H GLN 5 -2.119 8.469 -0.629
33 HA GLN 5 HA GLN 5 -0.023 10.426 0.167
34 1HB GLN 5 HB2 GLN 5 -1.270 8.991 1.887
35 2HB GLN 5 HB1 GLN 5 -0.391 7.612 1.224
36 1HG GLN 5 HG2 GLN 5 1.608 8.285 2.111
37 2HG GLN 5 HG1 GLN 5 1.243 9.997 1.895
38 1HE2 GLN 5 HE21 GLN 5 -0.803 7.600 3.598
39 2HE2 GLN 5 HE22 GLN 5 -0.694 8.353 5.116
40 H CYS 6 H CYS 6 -0.558 8.215 -2.224
41 HA CYS 6 HA CYS 6 2.272 7.287 -2.323
42 1HB CYS 6 HB2 CYS 6 -0.291 6.228 -3.272
43 2HB CYS 6 HB1 CYS 6 0.954 6.176 -4.463
44 H CYS 7 H CYS 7 -0.274 8.516 -4.462
45 HA CYS 7 HA CYS 7 1.548 9.173 -6.585
46 1HB CYS 7 HB2 CYS 7 -1.203 8.995 -6.304
47 2HB CYS 7 HB1 CYS 7 -0.951 10.732 -6.469
48 H THR 8 H THR 8 -0.400 11.306 -4.480
49 HA THR 8 HA THR 8 0.959 13.711 -5.099
50 HB THR 8 HB THR 8 -0.605 12.805 -2.672
51 HG1 THR 8 HG1 THR 8 -2.198 13.743 -3.703
52 1HG2 THR 8 HG21 THR 8 0.320 14.512 -1.519
53 2HG2 THR 8 HG22 THR 8 -0.496 15.597 -2.644
54 3HG2 THR 8 HG23 THR 8 1.170 15.103 -2.949
55 H SER 9 H SER 9 1.365 11.705 -2.142
56 HA SER 9 HA SER 9 4.127 12.828 -1.943
57 1HB SER 9 HB2 SER 9 2.387 13.090 -0.021
58 2HB SER 9 HB1 SER 9 2.719 11.394 0.298
59 HG SER 9 HG SER 9 4.128 12.693 1.487
60 H ILE 10 H ILE 10 5.048 10.853 -0.114
61 HA ILE 10 HA ILE 10 5.394 8.587 -2.015
62 HB ILE 10 HB ILE 10 7.013 9.363 0.420
63 1HG1 ILE 10 HG12 ILE 10 7.085 10.062 -2.477
64 2HG1 ILE 10 HG11 ILE 10 7.601 11.007 -1.085
65 1HG2 ILE 10 HG21 ILE 10 8.599 7.684 -0.405
66 2HG2 ILE 10 HG22 ILE 10 7.537 7.316 -1.761
67 3HG2 ILE 10 HG23 ILE 10 7.035 6.929 -0.117
68 1HD1 ILE 10 HD11 ILE 10 9.515 9.269 -0.888
69 2HD1 ILE 10 HD12 ILE 10 9.620 10.474 -2.171
70 3HD1 ILE 10 HD13 ILE 10 9.090 8.834 -2.542
71 H CYS 11 H CYS 11 5.432 6.366 -1.069
72 HA CYS 11 HA CYS 11 3.610 6.177 1.296
73 1HB CYS 11 HB2 CYS 11 3.630 3.723 -0.126
74 2HB CYS 11 HB1 CYS 11 2.282 4.815 0.126
75 H SER 12 H SER 12 4.013 4.401 2.768
76 HA SER 12 HA SER 12 6.895 3.656 2.817
77 1HB SER 12 HB2 SER 12 5.813 2.809 5.211
78 2HB SER 12 HB1 SER 12 6.616 4.355 4.953
79 HG SER 12 HG SER 12 3.849 3.853 4.551
80 H LEU 13 H LEU 13 7.438 1.432 3.478
81 HA LEU 13 HA LEU 13 6.083 -0.552 1.931
82 1HB LEU 13 HB2 LEU 13 8.138 -0.654 4.137
83 2HB LEU 13 HB1 LEU 13 7.447 -2.139 3.494
84 HG LEU 13 HG LEU 13 9.666 -0.996 2.467
85 1HD1 LEU 13 HD11 LEU 13 9.009 -3.135 1.731
86 2HD1 LEU 13 HD12 LEU 13 8.965 -2.147 0.271
87 3HD1 LEU 13 HD13 LEU 13 7.468 -2.543 1.111
88 1HD2 LEU 13 HD21 LEU 13 7.458 0.030 0.667
89 2HD2 LEU 13 HD22 LEU 13 9.192 0.307 0.512
90 3HD2 LEU 13 HD23 LEU 13 8.299 1.053 1.833
91 H TYR 14 H TYR 14 5.307 0.843 4.939
92 HA TYR 14 HA TYR 14 3.881 -1.523 5.933
93 1HB TYR 14 HB2 TYR 14 4.994 -0.062 7.559
94 2HB TYR 14 HB1 TYR 14 4.021 1.302 7.007
95 HD1 TYR 14 HD1 TYR 14 3.510 -2.248 8.127
96 HD2 TYR 14 HD2 TYR 14 2.123 1.817 8.249
97 HE1 TYR 14 HE1 TYR 14 1.685 -2.917 9.668
98 HE2 TYR 14 HE2 TYR 14 0.299 1.149 9.791
99 HH TYR 14 HH TYR 14 -0.441 -0.514 11.151
100 H GLN 15 H GLN 15 3.148 1.538 4.390
101 HA GLN 15 HA GLN 15 0.294 1.300 4.775
102 1HB GLN 15 HB2 GLN 15 1.977 2.962 2.886
103 2HB GLN 15 HB1 GLN 15 0.214 3.033 2.900
104 1HG GLN 15 HG2 GLN 15 0.133 3.952 5.043
105 2HG GLN 15 HG1 GLN 15 1.731 3.342 5.473
106 1HE2 GLN 15 HE21 GLN 15 0.824 6.168 5.644
107 2HE2 GLN 15 HE22 GLN 15 1.850 7.055 4.625
108 H LEU 16 H LEU 16 2.576 0.078 2.367
109 HA LEU 16 HA LEU 16 0.391 -0.776 0.593
110 1HB LEU 16 HB2 LEU 16 3.088 -0.276 0.208
111 2HB LEU 16 HB1 LEU 16 3.005 -2.027 0.174
112 HG LEU 16 HG LEU 16 2.689 -0.771 -2.038
113 1HD1 LEU 16 HD11 LEU 16 2.195 -3.136 -1.789
114 2HD1 LEU 16 HD12 LEU 16 0.924 -2.383 -2.749
115 3HD1 LEU 16 HD13 LEU 16 0.642 -2.761 -1.049
116 1HD2 LEU 16 HD21 LEU 16 -0.161 -0.478 -1.145
117 2HD2 LEU 16 HD22 LEU 16 0.662 0.295 -2.499
118 3HD2 LEU 16 HD23 LEU 16 0.994 0.821 -0.848
119 H GLU 17 H GLU 17 2.246 -1.949 3.244
120 HA GLU 17 HA GLU 17 1.578 -4.767 2.840
121 1HB GLU 17 HB2 GLU 17 3.606 -3.827 4.134
122 2HB GLU 17 HB1 GLU 17 2.461 -3.491 5.433
123 1HG GLU 17 HG2 GLU 17 1.747 -5.951 5.217
124 2HG GLU 17 HG1 GLU 17 3.210 -6.170 4.255
125 H ASN 18 H ASN 18 -0.388 -2.298 3.319
126 HA ASN 18 HA ASN 18 -2.055 -3.748 5.333
127 1HB ASN 18 HB2 ASN 18 -1.151 -1.148 5.483
128 2HB ASN 18 HB1 ASN 18 -2.764 -0.948 4.797
129 1HD2 ASN 18 HD21 ASN 18 -1.438 -0.692 7.691
130 2HD2 ASN 18 HD22 ASN 18 -2.607 -1.427 8.678
131 H TYR 19 H TYR 19 -1.817 -3.708 2.178
132 HA TYR 19 HA TYR 19 -4.770 -3.464 1.802
133 1HB TYR 19 HB2 TYR 19 -2.550 -2.354 0.145
134 2HB TYR 19 HB1 TYR 19 -3.995 -2.938 -0.681
135 HD1 TYR 19 HD1 TYR 19 -2.664 -0.448 1.685
136 HD2 TYR 19 HD2 TYR 19 -6.183 -1.907 -0.303
137 HE1 TYR 19 HE1 TYR 19 -3.881 1.617 2.323
138 HE2 TYR 19 HE2 TYR 19 -7.402 0.157 0.335
139 HH TYR 19 HH TYR 19 -7.167 2.248 1.154
140 H CYS 20 H CYS 20 -3.479 -5.872 2.505
141 HA CYS 20 HA CYS 20 -3.566 -7.384 -0.064
142 1HB CYS 20 HB2 CYS 20 -2.379 -8.323 2.549
143 2HB CYS 20 HB1 CYS 20 -2.178 -9.049 0.960
144 H ASN 21 H ASN 21 -4.866 -9.305 -0.123
145 HA ASN 21 HA ASN 21 -7.168 -9.213 1.697
146 1HB ASN 21 HB2 ASN 21 -6.663 -10.166 -0.938
147 2HB ASN 21 HB1 ASN 21 -7.177 -11.548 0.028
148 1HD2 ASN 21 HD21 ASN 21 -8.312 -8.778 -1.651
149 2HD2 ASN 21 HD22 ASN 21 -9.902 -8.788 -1.058
150 1H PHE 1 HT1 PHE 1 12.458 -2.154 0.784
151 2H PHE 1 HT2 PHE 1 10.828 -2.008 1.238
152 3H PHE 1 HT3 PHE 1 11.969 -2.617 2.341
153 HA PHE 1 HA PHE 1 11.419 -0.341 2.893
154 1HB PHE 1 HB2 PHE 1 13.679 0.506 3.009
155 2HB PHE 1 HB1 PHE 1 13.758 -1.246 3.196
156 HD1 PHE 1 HD1 PHE 1 14.577 1.605 1.056
157 HD2 PHE 1 HD2 PHE 1 14.496 -2.684 1.313
158 HE1 PHE 1 HE1 PHE 1 16.070 1.457 -0.921
159 HE2 PHE 1 HE2 PHE 1 15.989 -2.832 -0.663
160 HZ PHE 1 HZ PHE 1 16.777 -0.761 -1.780
161 H VAL 2 H VAL 2 11.473 -1.005 -0.385
162 HA VAL 2 HA VAL 2 12.189 1.292 -1.735
163 HB VAL 2 HB VAL 2 10.026 0.836 -3.145
164 1HG1 VAL 2 HG11 VAL 2 12.338 0.140 -3.741
165 2HG1 VAL 2 HG12 VAL 2 11.141 -1.069 -4.209
166 3HG1 VAL 2 HG13 VAL 2 12.129 -1.317 -2.769
167 1HG2 VAL 2 HG21 VAL 2 9.902 -1.890 -2.256
168 2HG2 VAL 2 HG22 VAL 2 8.599 -0.706 -2.331
169 3HG2 VAL 2 HG23 VAL 2 9.587 -0.836 -0.880
170 H ASN 3 H ASN 3 11.920 3.223 -0.596
171 HA ASN 3 HA ASN 3 9.185 3.948 0.296
172 1HB ASN 3 HB2 ASN 3 10.367 5.970 1.248
173 2HB ASN 3 HB1 ASN 3 10.924 4.430 1.904
174 1HD2 ASN 3 HD21 ASN 3 12.604 6.760 1.928
175 2HD2 ASN 3 HD22 ASN 3 13.908 6.487 0.876
176 H GLN 4 H GLN 4 9.259 3.770 -2.423
177 HA GLN 4 HA GLN 4 9.683 6.537 -3.436
178 1HB GLN 4 HB2 GLN 4 8.853 4.191 -5.135
179 2HB GLN 4 HB1 GLN 4 9.776 5.621 -5.599
180 1HG GLN 4 HG2 GLN 4 11.255 4.373 -3.538
181 2HG GLN 4 HG1 GLN 4 10.750 3.082 -4.627
182 1HE2 GLN 4 HE21 GLN 4 10.766 4.443 -7.110
183 2HE2 GLN 4 HE22 GLN 4 12.352 4.932 -7.466
184 H HIS 5 H HIS 5 7.794 6.703 -5.425
185 HA HIS 5 HA HIS 5 5.285 6.781 -3.834
186 1HB HIS 5 HB2 HIS 5 4.445 8.284 -5.578
187 2HB HIS 5 HB1 HIS 5 6.024 8.854 -5.035
188 HD2 HIS 5 HD2 HIS 5 4.465 7.008 -8.157
189 HE1 HIS 5 HE1 HIS 5 8.326 8.406 -9.164
190 HE2 HIS 5 HE2 HIS 5 6.211 7.297 -10.065
191 H LEU 6 H LEU 6 3.256 6.461 -5.460
192 HA LEU 6 HA LEU 6 3.649 4.262 -7.245
193 1HB LEU 6 HB2 LEU 6 4.268 3.426 -4.976
194 2HB LEU 6 HB1 LEU 6 2.595 3.674 -4.512
195 HG LEU 6 HG LEU 6 1.993 2.217 -6.477
196 1HD1 LEU 6 HD11 LEU 6 4.581 0.862 -6.299
197 2HD1 LEU 6 HD12 LEU 6 4.740 2.495 -6.945
198 3HD1 LEU 6 HD13 LEU 6 3.679 1.334 -7.738
199 1HD2 LEU 6 HD21 LEU 6 2.065 1.654 -4.009
200 2HD2 LEU 6 HD22 LEU 6 3.675 0.989 -4.289
201 3HD2 LEU 6 HD23 LEU 6 2.273 0.271 -5.085
202 H CYS 7 H CYS 7 2.145 5.162 -8.639
203 HA CYS 7 HA CYS 7 -0.614 5.632 -7.591
204 1HB CYS 7 HB2 CYS 7 1.020 7.190 -9.195
205 2HB CYS 7 HB1 CYS 7 -0.054 6.416 -10.360
206 H GLY 8 H GLY 8 -2.152 5.384 -9.726
207 1HA GLY 8 HA2 GLY 8 -3.432 3.363 -10.360
208 2HA GLY 8 HA1 GLY 8 -2.448 3.846 -11.735
209 H SER 9 H SER 9 -1.508 2.101 -12.662
210 HA SER 9 HA SER 9 -1.360 -0.501 -11.711
211 1HB SER 9 HB2 SER 9 0.808 0.887 -13.331
212 2HB SER 9 HB1 SER 9 0.545 -0.851 -13.230
213 HG SER 9 HG SER 9 -0.783 -0.550 -14.824
214 H ASP 10 H ASP 10 0.991 2.123 -11.129
215 HA ASP 10 HA ASP 10 2.956 0.736 -9.706
216 1HB ASP 10 HB2 ASP 10 2.075 3.467 -9.905
217 2HB ASP 10 HB1 ASP 10 2.422 3.092 -8.217
218 H LEU 11 H LEU 11 -0.228 1.843 -8.606
219 HA LEU 11 HA LEU 11 0.040 0.915 -5.894
220 1HB LEU 11 HB2 LEU 11 -2.001 2.087 -7.569
221 2HB LEU 11 HB1 LEU 11 -2.673 0.660 -6.810
222 HG LEU 11 HG LEU 11 -3.110 1.953 -5.026
223 1HD1 LEU 11 HD11 LEU 11 -1.394 2.404 -3.433
224 2HD1 LEU 11 HD12 LEU 11 -0.150 2.421 -4.681
225 3HD1 LEU 11 HD13 LEU 11 -0.945 0.907 -4.248
226 1HD2 LEU 11 HD21 LEU 11 -1.231 4.158 -5.544
227 2HD2 LEU 11 HD22 LEU 11 -2.968 4.197 -5.245
228 3HD2 LEU 11 HD23 LEU 11 -2.359 3.815 -6.855
229 1HN ABA 12 H ABA 12 -1.751 -0.384 -8.652
230 HA ABA 12 HA ABA 12 -2.390 -2.929 -7.661
231 1HB ABA 12 HB1 ABA 12 -1.527 -2.694 -10.516
232 2HB ABA 12 HB2 ABA 12 -2.888 -1.712 -9.989
233 1HG ABA 12 HG1 ABA 12 -3.651 -4.032 -8.921
234 2HG ABA 12 HG2 ABA 12 -2.672 -4.660 -10.247
235 3HG ABA 12 HG3 ABA 12 -4.035 -3.592 -10.585
236 H GLU 13 H GLU 13 0.739 -1.693 -8.505
237 HA GLU 13 HA GLU 13 1.854 -4.373 -8.948
238 1HB GLU 13 HB2 GLU 13 2.764 -1.624 -9.343
239 2HB GLU 13 HB1 GLU 13 3.997 -2.684 -8.674
240 1HG GLU 13 HG2 GLU 13 2.326 -3.486 -11.058
241 2HG GLU 13 HG1 GLU 13 3.840 -2.598 -11.234
242 H ALA 14 H ALA 14 2.662 -1.741 -6.615
243 HA ALA 14 HA ALA 14 4.327 -3.267 -4.969
244 1HB ALA 14 HB1 ALA 14 3.817 -0.839 -4.634
245 2HB ALA 14 HB2 ALA 14 3.732 -1.774 -3.145
246 3HB ALA 14 HB3 ALA 14 2.248 -1.294 -3.970
247 H LEU 15 H LEU 15 0.810 -3.023 -4.959
248 HA LEU 15 HA LEU 15 0.292 -4.901 -2.861
249 1HB LEU 15 HB2 LEU 15 -1.326 -4.478 -5.394
250 2HB LEU 15 HB1 LEU 15 -1.939 -5.148 -3.886
251 HG LEU 15 HG LEU 15 -0.975 -2.304 -4.407
252 1HD1 LEU 15 HD11 LEU 15 -3.166 -1.674 -4.377
253 2HD1 LEU 15 HD12 LEU 15 -3.632 -2.967 -3.271
254 3HD1 LEU 15 HD13 LEU 15 -3.366 -3.320 -4.979
255 1HD2 LEU 15 HD21 LEU 15 -2.270 -2.805 -1.826
256 2HD2 LEU 15 HD22 LEU 15 -0.839 -1.849 -2.198
257 3HD2 LEU 15 HD23 LEU 15 -0.701 -3.593 -1.979
258 H TYR 16 H TYR 16 0.859 -5.235 -6.335
259 HA TYR 16 HA TYR 16 0.480 -8.124 -6.383
260 1HB TYR 16 HB2 TYR 16 1.080 -5.976 -8.279
261 2HB TYR 16 HB1 TYR 16 1.984 -7.448 -8.618
262 HD1 TYR 16 HD1 TYR 16 -0.659 -5.900 -9.852
263 HD2 TYR 16 HD2 TYR 16 0.143 -9.559 -7.747
264 HE1 TYR 16 HE1 TYR 16 -2.690 -6.915 -10.850
265 HE2 TYR 16 HE2 TYR 16 -1.885 -10.578 -8.751
266 HH TYR 16 HH TYR 16 -4.023 -8.697 -10.894
267 H LEU 17 H LEU 17 3.144 -5.986 -5.666
268 HA LEU 17 HA LEU 17 5.067 -8.253 -5.968
269 1HB LEU 17 HB2 LEU 17 5.233 -5.363 -6.276
270 2HB LEU 17 HB1 LEU 17 6.501 -5.995 -5.225
271 HG LEU 17 HG LEU 17 7.070 -5.975 -7.699
272 1HD1 LEU 17 HD11 LEU 17 7.289 -8.795 -7.237
273 2HD1 LEU 17 HD12 LEU 17 7.508 -7.953 -5.702
274 3HD1 LEU 17 HD13 LEU 17 8.537 -7.560 -7.080
275 1HD2 LEU 17 HD21 LEU 17 5.733 -8.455 -8.297
276 2HD2 LEU 17 HD22 LEU 17 5.653 -6.924 -9.169
277 3HD2 LEU 17 HD23 LEU 17 4.538 -7.241 -7.840
278 H VAL 18 H VAL 18 3.361 -6.403 -3.634
279 HA VAL 18 HA VAL 18 5.287 -6.956 -1.485
280 HB VAL 18 HB VAL 18 2.553 -5.665 -1.563
281 1HG1 VAL 18 HG11 VAL 18 3.322 -4.997 0.841
282 2HG1 VAL 18 HG12 VAL 18 4.388 -6.397 0.712
283 3HG1 VAL 18 HG13 VAL 18 2.640 -6.606 0.596
284 1HG2 VAL 18 HG21 VAL 18 4.435 -3.909 -0.518
285 2HG2 VAL 18 HG22 VAL 18 3.832 -3.897 -2.172
286 3HG2 VAL 18 HG23 VAL 18 5.325 -4.748 -1.787
287 H CYS 19 H CYS 19 1.848 -7.816 -2.100
288 HA CYS 19 HA CYS 19 2.303 -10.227 -0.388
289 1HB CYS 19 HB2 CYS 19 -0.269 -8.763 -1.059
290 2HB CYS 19 HB1 CYS 19 -0.178 -10.244 -0.107
291 H GLY 20 H GLY 20 -0.163 -9.500 -2.864
292 1HA GLY 20 HA2 GLY 20 -0.570 -10.567 -4.927
293 2HA GLY 20 HA1 GLY 20 0.961 -11.419 -4.743
294 H GLU 21 H GLU 21 0.912 -13.186 -2.979
295 HA GLU 21 HA GLU 21 -1.075 -15.098 -3.639
296 1HB GLU 21 HB2 GLU 21 -0.225 -16.360 -1.659
297 2HB GLU 21 HB1 GLU 21 1.064 -15.785 -2.715
298 1HG GLU 21 HG2 GLU 21 0.573 -13.695 -0.879
299 2HG GLU 21 HG1 GLU 21 0.608 -15.181 0.070
300 H ARG 22 H ARG 22 -1.010 -12.687 -1.048
301 HA ARG 22 HA ARG 22 -3.365 -13.847 0.255
302 1HB ARG 22 HB2 ARG 22 -1.425 -11.760 0.841
303 2HB ARG 22 HB1 ARG 22 -3.073 -11.221 1.171
304 1HG ARG 22 HG2 ARG 22 -3.483 -13.144 2.588
305 2HG ARG 22 HG1 ARG 22 -1.925 -13.847 2.157
306 1HD ARG 22 HD2 ARG 22 -0.762 -11.951 3.207
307 2HD ARG 22 HD1 ARG 22 -2.312 -11.213 3.612
308 HE ARG 22 HE ARG 22 -2.531 -12.762 5.389
309 1HH1 ARG 22 HH21 ARG 22 -1.969 -15.229 3.750
310 2HH1 ARG 22 HH22 ARG 22 -0.516 -15.818 4.486
311 1HH2 ARG 22 HH11 ARG 22 0.183 -12.838 6.114
312 2HH2 ARG 22 HH12 ARG 22 0.700 -14.467 5.827
313 H GLY 23 H GLY 23 -2.794 -11.734 -2.377
314 1HA GLY 23 HA2 GLY 23 -4.515 -10.986 -3.859
315 2HA GLY 23 HA1 GLY 23 -5.703 -11.266 -2.597
316 H PHE 24 H PHE 24 -5.671 -8.803 -4.046
317 HA PHE 24 HA PHE 24 -5.201 -6.994 -1.756
318 1HB PHE 24 HB2 PHE 24 -4.006 -5.329 -3.075
319 2HB PHE 24 HB1 PHE 24 -3.104 -6.834 -3.053
320 HD1 PHE 24 HD1 PHE 24 -5.384 -4.725 -5.138
321 HD2 PHE 24 HD2 PHE 24 -2.622 -8.022 -5.071
322 HE1 PHE 24 HE1 PHE 24 -5.388 -4.790 -7.611
323 HE2 PHE 24 HE2 PHE 24 -2.630 -8.076 -7.540
324 HZ PHE 24 HZ PHE 24 -4.010 -6.458 -8.816
325 H PHE 25 H PHE 25 -6.903 -5.651 -1.547
326 HA PHE 25 HA PHE 25 -8.835 -5.495 -3.799
327 1HB PHE 25 HB2 PHE 25 -10.397 -4.603 -2.108
328 2HB PHE 25 HB1 PHE 25 -9.712 -6.139 -1.580
329 HD1 PHE 25 HD1 PHE 25 -9.655 -2.475 -1.103
330 HD2 PHE 25 HD2 PHE 25 -8.150 -6.258 0.274
331 HE1 PHE 25 HE1 PHE 25 -8.780 -1.382 0.945
332 HE2 PHE 25 HE2 PHE 25 -7.275 -5.165 2.322
333 HZ PHE 25 HZ PHE 25 -7.591 -2.726 2.659
334 H TYR 26 H TYR 26 -9.067 -3.629 -4.957
335 HA TYR 26 HA TYR 26 -7.759 -1.167 -3.867
336 1HB TYR 26 HB2 TYR 26 -6.347 -1.903 -5.620
337 2HB TYR 26 HB1 TYR 26 -7.710 -2.358 -6.638
338 HD1 TYR 26 HD1 TYR 26 -7.352 0.787 -4.676
339 HD2 TYR 26 HD2 TYR 26 -7.305 -1.037 -8.564
340 HE1 TYR 26 HE1 TYR 26 -7.332 3.033 -5.731
341 HE2 TYR 26 HE2 TYR 26 -7.285 1.206 -9.622
342 HH TYR 26 HH TYR 26 -6.731 4.084 -7.805
343 H THR 27 H THR 27 -9.543 0.013 -3.243
344 HA THR 27 HA THR 27 -11.820 0.234 -5.151
345 HB THR 27 HB THR 27 -12.998 1.320 -3.242
346 HG1 THR 27 HG1 THR 27 -11.428 2.194 -2.036
347 1HG2 THR 27 HG21 THR 27 -13.353 -1.018 -3.421
348 2HG2 THR 27 HG22 THR 27 -12.933 -0.754 -1.728
349 3HG2 THR 27 HG23 THR 27 -11.727 -1.389 -2.847
350 H LYS 28 H LYS 28 -12.767 2.627 -5.109
351 HA LYS 28 HA LYS 28 -10.775 4.735 -4.786
352 1HB LYS 28 HB2 LYS 28 -10.691 5.353 -7.185
353 2HB LYS 28 HB1 LYS 28 -10.010 3.750 -6.905
354 1HG LYS 28 HG2 LYS 28 -12.376 2.855 -7.414
355 2HG LYS 28 HG1 LYS 28 -12.698 4.458 -8.078
356 1HD LYS 28 HD2 LYS 28 -10.707 4.200 -9.563
357 2HD LYS 28 HD1 LYS 28 -10.511 2.554 -8.960
358 1HE LYS 28 HE2 LYS 28 -12.969 2.203 -9.675
359 2HE LYS 28 HE1 LYS 28 -12.771 3.688 -10.606
360 1HZ LYS 28 HZ1 LYS 28 -10.554 2.004 -11.032
361 2HZ LYS 28 HZ2 LYS 28 -11.694 2.566 -12.159
362 3HZ LYS 28 HZ3 LYS 28 -11.975 1.120 -11.310
363 HA PRO 29 HA PRO 29 -15.287 5.932 -4.896
364 1HB PRO 29 HB2 PRO 29 -15.572 6.382 -2.199
365 2HB PRO 29 HB1 PRO 29 -15.910 4.823 -2.972
366 1HG PRO 29 HG2 PRO 29 -13.585 5.615 -1.281
367 2HG PRO 29 HG1 PRO 29 -14.285 4.010 -1.543
368 1HD PRO 29 HD2 PRO 29 -11.932 5.014 -2.759
369 2HD PRO 29 HD1 PRO 29 -12.819 3.552 -3.241
370 H THR 30 H THR 30 -15.564 8.095 -5.363
371 HA THR 30 HA THR 30 -15.320 10.431 -5.238
372 HB THR 30 HB THR 30 -13.652 10.213 -2.762
373 HG1 THR 30 HG1 THR 30 -15.107 8.890 -2.010
374 1HG2 THR 30 HG21 THR 30 -15.355 12.145 -4.117
375 2HG2 THR 30 HG22 THR 30 -14.161 12.405 -2.846
376 3HG2 THR 30 HG23 THR 30 -15.812 11.949 -2.425
Start of MODEL 12
1 1H GLY 1 HT1 GLY 1 -7.412 7.487 -2.043
2 2H GLY 1 HT2 GLY 1 -8.621 7.714 -0.871
3 3H GLY 1 HT3 GLY 1 -8.461 6.212 -1.648
4 1HA GLY 1 HA1 GLY 1 -6.723 7.314 0.397
5 2HA GLY 1 HA2 GLY 1 -7.496 5.701 0.388
6 H ILE 2 H ILE 2 -5.555 4.548 -0.676
7 HA ILE 2 HA ILE 2 -2.964 5.675 -0.183
8 HB ILE 2 HB ILE 2 -3.458 3.168 -0.395
9 1HG1 ILE 2 HG12 ILE 2 -1.196 3.685 -2.223
10 2HG1 ILE 2 HG11 ILE 2 -1.158 4.605 -0.717
11 1HG2 ILE 2 HG21 ILE 2 -4.620 3.566 -2.686
12 2HG2 ILE 2 HG22 ILE 2 -3.543 2.176 -2.551
13 3HG2 ILE 2 HG23 ILE 2 -2.987 3.649 -3.344
14 1HD1 ILE 2 HD11 ILE 2 -1.403 1.597 -0.992
15 2HD1 ILE 2 HD12 ILE 2 -1.538 2.468 0.535
16 3HD1 ILE 2 HD13 ILE 2 -0.018 2.488 -0.360
17 H VAL 3 H VAL 3 -5.122 6.039 -2.817
18 HA VAL 3 HA VAL 3 -3.175 6.646 -4.870
19 HB VAL 3 HB VAL 3 -5.912 7.867 -4.842
20 1HG1 VAL 3 HG11 VAL 3 -5.649 6.837 -7.255
21 2HG1 VAL 3 HG12 VAL 3 -3.938 6.800 -6.829
22 3HG1 VAL 3 HG13 VAL 3 -4.811 8.332 -6.836
23 1HG2 VAL 3 HG21 VAL 3 -6.617 5.560 -5.829
24 2HG2 VAL 3 HG22 VAL 3 -6.528 5.735 -4.076
25 3HG2 VAL 3 HG23 VAL 3 -5.219 4.940 -4.950
26 H GLU 4 H GLU 4 -3.934 8.225 -2.046
27 HA GLU 4 HA GLU 4 -3.345 10.905 -3.211
28 1HB GLU 4 HB2 GLU 4 -5.396 10.786 -1.850
29 2HB GLU 4 HB1 GLU 4 -4.460 10.172 -0.486
30 1HG GLU 4 HG2 GLU 4 -4.795 12.567 -0.197
31 2HG GLU 4 HG1 GLU 4 -3.092 12.266 -0.541
32 H GLN 5 H GLN 5 -2.063 8.397 -1.188
33 HA GLN 5 HA GLN 5 0.058 10.228 -0.183
34 1HB GLN 5 HB2 GLN 5 -1.292 8.449 1.242
35 2HB GLN 5 HB1 GLN 5 -0.093 7.336 0.582
36 1HG GLN 5 HG2 GLN 5 0.948 8.075 2.546
37 2HG GLN 5 HG1 GLN 5 1.633 9.153 1.330
38 1HE2 GLN 5 HE21 GLN 5 1.726 10.232 3.805
39 2HE2 GLN 5 HE22 GLN 5 0.502 11.382 4.046
40 H CYS 6 H CYS 6 0.017 6.834 -1.367
41 HA CYS 6 HA CYS 6 2.751 6.816 -2.140
42 1HB CYS 6 HB2 CYS 6 0.448 5.292 -3.358
43 2HB CYS 6 HB1 CYS 6 2.140 4.892 -3.565
44 H CYS 7 H CYS 7 -0.101 8.040 -3.778
45 HA CYS 7 HA CYS 7 1.213 8.300 -6.370
46 1HB CYS 7 HB2 CYS 7 -1.336 9.418 -5.193
47 2HB CYS 7 HB1 CYS 7 -0.797 9.823 -6.817
48 H THR 8 H THR 8 -0.107 10.783 -4.171
49 HA THR 8 HA THR 8 1.541 12.875 -5.302
50 HB THR 8 HB THR 8 -0.365 12.657 -2.978
51 HG1 THR 8 HG1 THR 8 -0.185 14.217 -5.339
52 1HG2 THR 8 HG21 THR 8 1.410 15.037 -3.620
53 2HG2 THR 8 HG22 THR 8 1.448 14.079 -2.140
54 3HG2 THR 8 HG23 THR 8 0.037 15.069 -2.512
55 H SER 9 H SER 9 2.150 10.454 -2.962
56 HA SER 9 HA SER 9 4.738 11.731 -2.344
57 1HB SER 9 HB2 SER 9 2.543 11.353 -0.365
58 2HB SER 9 HB1 SER 9 4.179 10.980 0.167
59 HG SER 9 HG SER 9 3.019 13.367 -0.195
60 H ILE 10 H ILE 10 5.725 10.045 -0.482
61 HA ILE 10 HA ILE 10 5.697 7.436 -1.911
62 HB ILE 10 HB ILE 10 7.620 8.658 0.085
63 1HG1 ILE 10 HG12 ILE 10 7.408 8.579 -2.841
64 2HG1 ILE 10 HG11 ILE 10 8.405 9.606 -1.822
65 1HG2 ILE 10 HG21 ILE 10 8.983 6.631 -0.253
66 2HG2 ILE 10 HG22 ILE 10 7.726 5.952 -1.286
67 3HG2 ILE 10 HG23 ILE 10 7.408 6.224 0.426
68 1HD1 ILE 10 HD11 ILE 10 9.993 7.681 -1.535
69 2HD1 ILE 10 HD12 ILE 10 9.872 8.256 -3.198
70 3HD1 ILE 10 HD13 ILE 10 9.037 6.780 -2.713
71 H CYS 11 H CYS 11 5.675 5.441 -0.617
72 HA CYS 11 HA CYS 11 4.522 5.784 2.114
73 1HB CYS 11 HB2 CYS 11 3.268 3.524 1.400
74 2HB CYS 11 HB1 CYS 11 2.547 5.106 1.141
75 H SER 12 H SER 12 4.943 3.956 3.521
76 HA SER 12 HA SER 12 7.435 2.543 2.746
77 1HB SER 12 HB2 SER 12 6.384 2.075 5.447
78 2HB SER 12 HB1 SER 12 7.983 2.618 4.946
79 HG SER 12 HG SER 12 6.278 4.086 6.099
80 H LEU 13 H LEU 13 7.463 0.345 2.450
81 HA LEU 13 HA LEU 13 5.341 -1.161 1.651
82 1HB LEU 13 HB2 LEU 13 6.735 -3.060 3.195
83 2HB LEU 13 HB1 LEU 13 6.897 -2.763 1.473
84 HG LEU 13 HG LEU 13 9.050 -2.698 2.750
85 1HD1 LEU 13 HD11 LEU 13 9.535 -1.552 0.877
86 2HD1 LEU 13 HD12 LEU 13 9.358 -0.097 1.857
87 3HD1 LEU 13 HD13 LEU 13 7.995 -0.692 0.910
88 1HD2 LEU 13 HD21 LEU 13 8.619 0.009 3.765
89 2HD2 LEU 13 HD22 LEU 13 9.320 -1.394 4.567
90 3HD2 LEU 13 HD23 LEU 13 7.574 -1.179 4.540
91 H TYR 14 H TYR 14 6.075 -0.313 4.957
92 HA TYR 14 HA TYR 14 4.419 -2.147 6.318
93 1HB TYR 14 HB2 TYR 14 5.852 -0.713 7.604
94 2HB TYR 14 HB1 TYR 14 5.131 0.732 6.897
95 HD1 TYR 14 HD1 TYR 14 3.938 -2.380 8.638
96 HD2 TYR 14 HD2 TYR 14 3.659 1.892 8.271
97 HE1 TYR 14 HE1 TYR 14 2.257 -2.333 10.462
98 HE2 TYR 14 HE2 TYR 14 1.979 1.940 10.096
99 HH TYR 14 HH TYR 14 0.238 -0.466 11.058
100 H GLN 15 H GLN 15 3.656 0.989 4.889
101 HA GLN 15 HA GLN 15 0.842 0.766 5.565
102 1HB GLN 15 HB2 GLN 15 2.509 2.696 3.986
103 2HB GLN 15 HB1 GLN 15 0.757 2.717 3.781
104 1HG GLN 15 HG2 GLN 15 0.478 3.755 5.753
105 2HG GLN 15 HG1 GLN 15 1.439 2.531 6.586
106 1HE2 GLN 15 HE21 GLN 15 2.308 4.468 7.846
107 2HE2 GLN 15 HE22 GLN 15 3.579 5.363 7.164
108 H LEU 16 H LEU 16 2.817 -0.178 2.750
109 HA LEU 16 HA LEU 16 0.389 -0.635 1.193
110 1HB LEU 16 HB2 LEU 16 2.939 -0.132 0.414
111 2HB LEU 16 HB1 LEU 16 2.882 -1.871 0.233
112 HG LEU 16 HG LEU 16 2.197 -0.245 -1.733
113 1HD1 LEU 16 HD11 LEU 16 0.663 -2.747 -0.985
114 2HD1 LEU 16 HD12 LEU 16 2.210 -2.694 -1.828
115 3HD1 LEU 16 HD13 LEU 16 0.764 -2.056 -2.602
116 1HD2 LEU 16 HD21 LEU 16 -0.012 0.455 -1.812
117 2HD2 LEU 16 HD22 LEU 16 0.353 0.687 -0.102
118 3HD2 LEU 16 HD23 LEU 16 -0.541 -0.738 -0.626
119 H GLU 17 H GLU 17 2.155 -2.248 3.555
120 HA GLU 17 HA GLU 17 1.399 -4.964 2.712
121 1HB GLU 17 HB2 GLU 17 3.303 -3.920 4.472
122 2HB GLU 17 HB1 GLU 17 2.086 -4.628 5.533
123 1HG GLU 17 HG2 GLU 17 2.213 -6.735 4.183
124 2HG GLU 17 HG1 GLU 17 3.540 -6.020 3.267
125 H ASN 18 H ASN 18 -0.476 -2.561 3.380
126 HA ASN 18 HA ASN 18 -2.219 -4.107 5.258
127 1HB ASN 18 HB2 ASN 18 -1.281 -1.542 5.607
128 2HB ASN 18 HB1 ASN 18 -2.857 -1.260 4.864
129 1HD2 ASN 18 HD21 ASN 18 -1.448 -1.581 7.851
130 2HD2 ASN 18 HD22 ASN 18 -2.769 -2.196 8.723
131 H TYR 19 H TYR 19 -1.854 -3.833 2.119
132 HA TYR 19 HA TYR 19 -4.775 -3.428 1.609
133 1HB TYR 19 HB2 TYR 19 -2.376 -2.721 -0.082
134 2HB TYR 19 HB1 TYR 19 -3.990 -2.881 -0.773
135 HD1 TYR 19 HD1 TYR 19 -1.987 -1.051 1.773
136 HD2 TYR 19 HD2 TYR 19 -5.649 -1.205 -0.470
137 HE1 TYR 19 HE1 TYR 19 -2.557 1.236 2.549
138 HE2 TYR 19 HE2 TYR 19 -6.220 1.082 0.304
139 HH TYR 19 HH TYR 19 -5.388 2.944 1.298
140 H CYS 20 H CYS 20 -3.513 -5.965 2.334
141 HA CYS 20 HA CYS 20 -3.669 -7.419 -0.266
142 1HB CYS 20 HB2 CYS 20 -2.901 -8.904 2.184
143 2HB CYS 20 HB1 CYS 20 -2.226 -8.990 0.563
144 H ASN 21 H ASN 21 -5.092 -9.252 -0.422
145 HA ASN 21 HA ASN 21 -7.632 -8.959 0.776
146 1HB ASN 21 HB2 ASN 21 -6.726 -10.488 -1.231
147 2HB ASN 21 HB1 ASN 21 -6.743 -11.712 0.040
148 1HD2 ASN 21 HD21 ASN 21 -8.860 -9.232 -1.485
149 2HD2 ASN 21 HD22 ASN 21 -10.307 -10.066 -1.183
150 1H PHE 1 HT1 PHE 1 12.159 -3.593 -1.643
151 2H PHE 1 HT2 PHE 1 13.247 -4.096 -0.441
152 3H PHE 1 HT3 PHE 1 13.305 -2.504 -1.030
153 HA PHE 1 HA PHE 1 10.703 -3.011 -0.100
154 1HB PHE 1 HB2 PHE 1 12.985 -3.851 1.690
155 2HB PHE 1 HB1 PHE 1 11.479 -3.230 2.369
156 HD1 PHE 1 HD1 PHE 1 13.157 -6.127 1.125
157 HD2 PHE 1 HD2 PHE 1 9.271 -4.329 1.505
158 HE1 PHE 1 HE1 PHE 1 12.098 -8.350 0.825
159 HE2 PHE 1 HE2 PHE 1 8.213 -6.552 1.204
160 HZ PHE 1 HZ PHE 1 9.625 -8.563 0.865
161 H VAL 2 H VAL 2 11.940 -0.895 -1.327
162 HA VAL 2 HA VAL 2 12.619 1.025 0.843
163 HB VAL 2 HB VAL 2 13.551 0.621 -1.854
164 1HG1 VAL 2 HG11 VAL 2 12.428 3.383 -1.294
165 2HG1 VAL 2 HG12 VAL 2 11.930 2.293 -2.588
166 3HG1 VAL 2 HG13 VAL 2 13.545 3.001 -2.603
167 1HG2 VAL 2 HG21 VAL 2 14.540 2.923 -0.293
168 2HG2 VAL 2 HG22 VAL 2 15.422 1.551 -0.964
169 3HG2 VAL 2 HG23 VAL 2 14.557 1.381 0.564
170 H ASN 3 H ASN 3 11.194 2.632 1.393
171 HA ASN 3 HA ASN 3 8.482 2.592 0.749
172 1HB ASN 3 HB2 ASN 3 8.556 5.097 1.333
173 2HB ASN 3 HB1 ASN 3 9.160 3.982 2.557
174 1HD2 ASN 3 HD21 ASN 3 11.427 4.031 3.051
175 2HD2 ASN 3 HD22 ASN 3 12.489 5.169 2.374
176 H GLN 4 H GLN 4 8.083 2.276 -1.467
177 HA GLN 4 HA GLN 4 9.094 4.359 -3.334
178 1HB GLN 4 HB2 GLN 4 8.910 1.613 -3.586
179 2HB GLN 4 HB1 GLN 4 7.500 2.180 -4.482
180 1HG GLN 4 HG2 GLN 4 9.164 3.888 -5.546
181 2HG GLN 4 HG1 GLN 4 10.410 2.782 -4.969
182 1HE2 GLN 4 HE21 GLN 4 9.594 3.337 -7.806
183 2HE2 GLN 4 HE22 GLN 4 9.137 1.834 -8.449
184 H HIS 5 H HIS 5 7.597 5.280 -4.900
185 HA HIS 5 HA HIS 5 4.860 5.640 -3.762
186 1HB HIS 5 HB2 HIS 5 4.844 7.809 -4.752
187 2HB HIS 5 HB1 HIS 5 6.456 7.637 -4.077
188 HD2 HIS 5 HD2 HIS 5 8.539 7.448 -5.971
189 HE1 HIS 5 HE1 HIS 5 6.071 8.045 -9.353
190 HE2 HIS 5 HE2 HIS 5 8.482 7.895 -8.535
191 H LEU 6 H LEU 6 3.076 5.100 -5.071
192 HA LEU 6 HA LEU 6 3.591 4.535 -7.911
193 1HB LEU 6 HB2 LEU 6 2.300 2.462 -6.171
194 2HB LEU 6 HB1 LEU 6 2.772 2.301 -7.848
195 HG LEU 6 HG LEU 6 5.149 2.860 -7.017
196 1HD1 LEU 6 HD11 LEU 6 4.577 1.548 -4.521
197 2HD1 LEU 6 HD12 LEU 6 3.655 3.045 -4.661
198 3HD1 LEU 6 HD13 LEU 6 5.413 3.073 -4.811
199 1HD2 LEU 6 HD21 LEU 6 3.897 0.543 -7.633
200 2HD2 LEU 6 HD22 LEU 6 4.289 0.224 -5.943
201 3HD2 LEU 6 HD23 LEU 6 5.574 0.603 -7.089
202 H CYS 7 H CYS 7 1.892 5.102 -9.195
203 HA CYS 7 HA CYS 7 -0.764 5.503 -7.877
204 1HB CYS 7 HB2 CYS 7 0.737 7.487 -8.982
205 2HB CYS 7 HB1 CYS 7 -0.209 6.977 -10.382
206 H GLY 8 H GLY 8 -2.611 5.277 -9.517
207 1HA GLY 8 HA2 GLY 8 -3.755 3.744 -10.906
208 2HA GLY 8 HA1 GLY 8 -2.502 4.194 -12.060
209 H SER 9 H SER 9 -2.061 2.185 -12.981
210 HA SER 9 HA SER 9 -2.052 -0.355 -11.871
211 1HB SER 9 HB2 SER 9 -0.245 -0.929 -13.478
212 2HB SER 9 HB1 SER 9 -1.494 0.059 -14.231
213 HG SER 9 HG SER 9 -0.021 1.870 -13.504
214 H ASP 10 H ASP 10 0.563 2.051 -11.658
215 HA ASP 10 HA ASP 10 2.512 0.621 -10.259
216 1HB ASP 10 HB2 ASP 10 2.060 3.276 -10.865
217 2HB ASP 10 HB1 ASP 10 1.986 3.262 -9.108
218 H LEU 11 H LEU 11 -0.588 1.863 -9.037
219 HA LEU 11 HA LEU 11 -0.085 1.182 -6.268
220 1HB LEU 11 HB2 LEU 11 -2.262 2.231 -7.824
221 2HB LEU 11 HB1 LEU 11 -2.863 0.795 -7.012
222 HG LEU 11 HG LEU 11 -3.300 2.255 -5.329
223 1HD1 LEU 11 HD11 LEU 11 -1.284 0.858 -4.558
224 2HD1 LEU 11 HD12 LEU 11 -1.672 2.307 -3.630
225 3HD1 LEU 11 HD13 LEU 11 -0.341 2.331 -4.786
226 1HD2 LEU 11 HD21 LEU 11 -1.962 3.971 -7.086
227 2HD2 LEU 11 HD22 LEU 11 -1.195 4.218 -5.517
228 3HD2 LEU 11 HD23 LEU 11 -2.938 4.428 -5.691
229 1HN ABA 12 H ABA 12 -1.689 -0.357 -8.997
230 HA ABA 12 HA ABA 12 -2.414 -2.829 -7.824
231 1HB ABA 12 HB1 ABA 12 -1.415 -2.764 -10.650
232 2HB ABA 12 HB2 ABA 12 -2.823 -1.783 -10.251
233 1HG ABA 12 HG1 ABA 12 -2.571 -4.744 -9.691
234 2HG ABA 12 HG2 ABA 12 -3.447 -4.042 -11.052
235 3HG ABA 12 HG3 ABA 12 -3.994 -3.741 -9.402
236 H GLU 13 H GLU 13 0.692 -1.542 -8.512
237 HA GLU 13 HA GLU 13 1.939 -4.208 -8.680
238 1HB GLU 13 HB2 GLU 13 2.706 -1.497 -9.409
239 2HB GLU 13 HB1 GLU 13 3.975 -2.349 -8.539
240 1HG GLU 13 HG2 GLU 13 4.062 -2.698 -11.027
241 2HG GLU 13 HG1 GLU 13 3.897 -4.196 -10.110
242 H ALA 14 H ALA 14 2.406 -1.289 -6.591
243 HA ALA 14 HA ALA 14 4.159 -2.382 -4.727
244 1HB ALA 14 HB1 ALA 14 3.440 -0.747 -3.213
245 2HB ALA 14 HB2 ALA 14 1.751 -0.903 -3.694
246 3HB ALA 14 HB3 ALA 14 2.893 -0.060 -4.741
247 H LEU 15 H LEU 15 0.668 -2.683 -4.846
248 HA LEU 15 HA LEU 15 0.330 -4.487 -2.640
249 1HB LEU 15 HB2 LEU 15 -1.288 -4.425 -5.191
250 2HB LEU 15 HB1 LEU 15 -1.857 -4.954 -3.613
251 HG LEU 15 HG LEU 15 -1.039 -2.121 -4.412
252 1HD1 LEU 15 HD11 LEU 15 -3.469 -1.659 -3.972
253 2HD1 LEU 15 HD12 LEU 15 -3.713 -3.401 -3.847
254 3HD1 LEU 15 HD13 LEU 15 -3.160 -2.696 -5.365
255 1HD2 LEU 15 HD21 LEU 15 -2.549 -2.234 -1.967
256 2HD2 LEU 15 HD22 LEU 15 -0.951 -1.551 -2.234
257 3HD2 LEU 15 HD23 LEU 15 -1.119 -3.254 -1.803
258 H TYR 16 H TYR 16 0.915 -4.940 -6.102
259 HA TYR 16 HA TYR 16 0.853 -7.857 -5.934
260 1HB TYR 16 HB2 TYR 16 1.172 -5.782 -8.009
261 2HB TYR 16 HB1 TYR 16 2.063 -7.268 -8.314
262 HD1 TYR 16 HD1 TYR 16 -0.892 -7.672 -6.259
263 HD2 TYR 16 HD2 TYR 16 0.505 -7.478 -10.322
264 HE1 TYR 16 HE1 TYR 16 -2.969 -8.780 -7.027
265 HE2 TYR 16 HE2 TYR 16 -1.581 -8.581 -11.088
266 HH TYR 16 HH TYR 16 -4.258 -8.701 -9.589
267 H LEU 17 H LEU 17 3.201 -5.422 -5.322
268 HA LEU 17 HA LEU 17 5.416 -7.398 -5.671
269 1HB LEU 17 HB2 LEU 17 5.227 -4.439 -5.813
270 2HB LEU 17 HB1 LEU 17 6.699 -5.101 -5.097
271 HG LEU 17 HG LEU 17 7.000 -4.855 -7.507
272 1HD1 LEU 17 HD11 LEU 17 8.231 -6.731 -7.417
273 2HD1 LEU 17 HD12 LEU 17 6.783 -7.700 -7.689
274 3HD1 LEU 17 HD13 LEU 17 7.270 -7.284 -6.045
275 1HD2 LEU 17 HD21 LEU 17 5.006 -6.938 -8.176
276 2HD2 LEU 17 HD22 LEU 17 5.449 -5.481 -9.065
277 3HD2 LEU 17 HD23 LEU 17 4.335 -5.378 -7.701
278 H VAL 18 H VAL 18 3.462 -5.793 -3.361
279 HA VAL 18 HA VAL 18 5.430 -6.317 -1.190
280 HB VAL 18 HB VAL 18 2.808 -4.796 -1.213
281 1HG1 VAL 18 HG11 VAL 18 3.569 -4.112 1.091
282 2HG1 VAL 18 HG12 VAL 18 4.860 -5.306 0.963
283 3HG1 VAL 18 HG13 VAL 18 3.175 -5.826 0.959
284 1HG2 VAL 18 HG21 VAL 18 4.165 -3.186 -2.069
285 2HG2 VAL 18 HG22 VAL 18 5.634 -4.052 -1.617
286 3HG2 VAL 18 HG23 VAL 18 4.788 -3.067 -0.424
287 H CYS 19 H CYS 19 1.886 -6.643 -1.635
288 HA CYS 19 HA CYS 19 1.662 -8.694 0.388
289 1HB CYS 19 HB2 CYS 19 -0.250 -7.955 -1.852
290 2HB CYS 19 HB1 CYS 19 -0.651 -8.927 -0.437
291 H GLY 20 H GLY 20 1.294 -8.824 -3.164
292 1HA GLY 20 HA2 GLY 20 2.390 -10.547 -4.504
293 2HA GLY 20 HA1 GLY 20 2.410 -11.585 -3.078
294 H GLU 21 H GLU 21 1.372 -13.237 -4.390
295 HA GLU 21 HA GLU 21 -1.184 -12.832 -5.639
296 1HB GLU 21 HB2 GLU 21 -0.683 -15.538 -4.556
297 2HB GLU 21 HB1 GLU 21 -1.096 -15.042 -6.194
298 1HG GLU 21 HG2 GLU 21 1.632 -15.008 -4.884
299 2HG GLU 21 HG1 GLU 21 1.125 -15.925 -6.302
300 H ARG 22 H ARG 22 -0.293 -12.871 -2.383
301 HA ARG 22 HA ARG 22 -2.311 -14.196 -1.022
302 1HB ARG 22 HB2 ARG 22 -0.785 -11.692 -0.515
303 2HB ARG 22 HB1 ARG 22 -2.224 -11.959 0.469
304 1HG ARG 22 HG2 ARG 22 -1.393 -14.030 1.306
305 2HG ARG 22 HG1 ARG 22 -0.112 -14.089 0.095
306 1HD ARG 22 HD2 ARG 22 1.220 -13.136 1.652
307 2HD ARG 22 HD1 ARG 22 0.309 -11.653 1.372
308 HE ARG 22 HE ARG 22 -1.063 -12.195 3.324
309 1HH1 ARG 22 HH21 ARG 22 -0.683 -15.193 3.231
310 2HH1 ARG 22 HH22 ARG 22 0.367 -15.453 4.584
311 1HH2 ARG 22 HH11 ARG 22 1.290 -12.121 4.848
312 2HH2 ARG 22 HH12 ARG 22 1.483 -13.713 5.500
313 H GLY 23 H GLY 23 -2.568 -11.345 -3.005
314 1HA GLY 23 HA2 GLY 23 -4.859 -11.062 -4.019
315 2HA GLY 23 HA1 GLY 23 -5.500 -11.308 -2.402
316 H PHE 24 H PHE 24 -6.123 -8.987 -3.880
317 HA PHE 24 HA PHE 24 -5.455 -6.959 -1.958
318 1HB PHE 24 HB2 PHE 24 -4.219 -5.413 -3.322
319 2HB PHE 24 HB1 PHE 24 -3.337 -6.925 -3.295
320 HD1 PHE 24 HD1 PHE 24 -3.115 -4.648 -5.355
321 HD2 PHE 24 HD2 PHE 24 -5.380 -8.291 -5.363
322 HE1 PHE 24 HE1 PHE 24 -3.112 -4.649 -7.817
323 HE2 PHE 24 HE2 PHE 24 -5.378 -8.291 -7.828
324 HZ PHE 24 HZ PHE 24 -4.243 -6.453 -9.056
325 H PHE 25 H PHE 25 -6.774 -5.034 -2.338
326 HA PHE 25 HA PHE 25 -9.001 -5.642 -4.210
327 1HB PHE 25 HB2 PHE 25 -9.722 -3.411 -2.641
328 2HB PHE 25 HB1 PHE 25 -10.306 -5.061 -2.488
329 HD1 PHE 25 HD1 PHE 25 -7.556 -2.772 -1.401
330 HD2 PHE 25 HD2 PHE 25 -9.737 -6.393 -0.627
331 HE1 PHE 25 HE1 PHE 25 -6.401 -3.000 0.780
332 HE2 PHE 25 HE2 PHE 25 -8.583 -6.620 1.556
333 HZ PHE 25 HZ PHE 25 -6.915 -4.924 2.261
334 H TYR 26 H TYR 26 -8.299 -2.425 -3.054
335 HA TYR 26 HA TYR 26 -7.208 -0.617 -4.250
336 1HB TYR 26 HB2 TYR 26 -6.302 -1.920 -6.087
337 2HB TYR 26 HB1 TYR 26 -7.919 -2.235 -6.712
338 HD1 TYR 26 HD1 TYR 26 -5.732 0.659 -5.778
339 HD2 TYR 26 HD2 TYR 26 -8.775 -0.888 -8.387
340 HE1 TYR 26 HE1 TYR 26 -5.654 2.753 -7.111
341 HE2 TYR 26 HE2 TYR 26 -8.698 1.203 -9.721
342 HH TYR 26 HH TYR 26 -7.993 3.682 -9.216
343 H THR 27 H THR 27 -9.027 0.414 -3.226
344 HA THR 27 HA THR 27 -11.677 0.385 -4.276
345 HB THR 27 HB THR 27 -12.036 2.411 -2.966
346 HG1 THR 27 HG1 THR 27 -10.454 3.728 -2.515
347 1HG2 THR 27 HG21 THR 27 -11.247 1.628 -0.787
348 2HG2 THR 27 HG22 THR 27 -10.057 0.589 -1.571
349 3HG2 THR 27 HG23 THR 27 -11.778 0.255 -1.759
350 H LYS 28 H LYS 28 -12.576 2.722 -5.086
351 HA LYS 28 HA LYS 28 -10.958 3.297 -7.515
352 1HB LYS 28 HB2 LYS 28 -13.827 3.141 -6.923
353 2HB LYS 28 HB1 LYS 28 -13.385 4.570 -7.858
354 1HG LYS 28 HG2 LYS 28 -12.517 3.301 -9.631
355 2HG LYS 28 HG1 LYS 28 -12.312 1.864 -8.627
356 1HD LYS 28 HD2 LYS 28 -14.856 1.826 -8.396
357 2HD LYS 28 HD1 LYS 28 -14.893 3.028 -9.686
358 1HE LYS 28 HE2 LYS 28 -13.311 1.303 -10.914
359 2HE LYS 28 HE1 LYS 28 -14.056 0.153 -9.803
360 1HZ LYS 28 HZ1 LYS 28 -16.216 1.390 -10.616
361 2HZ LYS 28 HZ2 LYS 28 -15.557 0.086 -11.484
362 3HZ LYS 28 HZ3 LYS 28 -15.258 1.682 -11.985
363 HA PRO 29 HA PRO 29 -10.057 7.225 -5.627
364 1HB PRO 29 HB2 PRO 29 -8.602 8.213 -7.740
365 2HB PRO 29 HB1 PRO 29 -7.956 7.054 -6.566
366 1HG PRO 29 HG2 PRO 29 -8.819 6.591 -9.382
367 2HG PRO 29 HG1 PRO 29 -7.634 5.701 -8.412
368 1HD PRO 29 HD2 PRO 29 -10.284 4.871 -8.956
369 2HD PRO 29 HD1 PRO 29 -9.204 4.177 -7.725
370 H THR 30 H THR 30 -10.806 9.404 -5.897
371 HA THR 30 HA THR 30 -13.077 9.681 -7.737
372 HB THR 30 HB THR 30 -12.491 12.152 -6.455
373 HG1 THR 30 HG1 THR 30 -12.520 11.275 -4.265
374 1HG2 THR 30 HG21 THR 30 -14.735 11.439 -6.884
375 2HG2 THR 30 HG22 THR 30 -14.556 11.482 -5.129
376 3HG2 THR 30 HG23 THR 30 -14.497 9.941 -5.985
Start of MODEL 13
1 1H GLY 1 HT1 GLY 1 -5.500 9.372 1.217
2 2H GLY 1 HT2 GLY 1 -7.033 8.644 1.176
3 3H GLY 1 HT3 GLY 1 -6.162 8.872 -0.263
4 1HA GLY 1 HA1 GLY 1 -4.638 7.332 1.481
5 2HA GLY 1 HA2 GLY 1 -6.254 6.571 1.372
6 H ILE 2 H ILE 2 -5.285 4.954 -0.046
7 HA ILE 2 HA ILE 2 -2.732 4.685 -1.021
8 HB ILE 2 HB ILE 2 -5.309 3.855 -2.386
9 1HG1 ILE 2 HG12 ILE 2 -4.955 2.763 -0.264
10 2HG1 ILE 2 HG11 ILE 2 -4.539 1.611 -1.534
11 1HG2 ILE 2 HG21 ILE 2 -4.079 3.375 -4.202
12 2HG2 ILE 2 HG22 ILE 2 -3.208 2.198 -3.219
13 3HG2 ILE 2 HG23 ILE 2 -2.590 3.842 -3.382
14 1HD1 ILE 2 HD11 ILE 2 -2.659 1.387 -0.218
15 2HD1 ILE 2 HD12 ILE 2 -2.754 3.043 0.382
16 3HD1 ILE 2 HD13 ILE 2 -2.131 2.726 -1.237
17 H VAL 3 H VAL 3 -5.311 5.825 -3.218
18 HA VAL 3 HA VAL 3 -3.566 6.814 -5.211
19 HB VAL 3 HB VAL 3 -6.153 8.230 -4.657
20 1HG1 VAL 3 HG11 VAL 3 -4.431 8.442 -6.684
21 2HG1 VAL 3 HG12 VAL 3 -6.172 8.561 -6.942
22 3HG1 VAL 3 HG13 VAL 3 -5.333 7.045 -7.274
23 1HG2 VAL 3 HG21 VAL 3 -7.122 6.187 -6.022
24 2HG2 VAL 3 HG22 VAL 3 -6.984 6.093 -4.267
25 3HG2 VAL 3 HG23 VAL 3 -5.771 5.323 -5.290
26 H GLU 4 H GLU 4 -4.234 8.073 -2.093
27 HA GLU 4 HA GLU 4 -3.133 10.718 -2.911
28 1HB GLU 4 HB2 GLU 4 -5.314 10.772 -1.731
29 2HB GLU 4 HB1 GLU 4 -4.581 9.942 -0.359
30 1HG GLU 4 HG2 GLU 4 -4.049 11.979 0.455
31 2HG GLU 4 HG1 GLU 4 -2.882 12.114 -0.859
32 H GLN 5 H GLN 5 -2.037 7.831 -1.792
33 HA GLN 5 HA GLN 5 -0.094 9.080 0.093
34 1HB GLN 5 HB2 GLN 5 -1.552 6.690 0.251
35 2HB GLN 5 HB1 GLN 5 0.104 6.193 -0.095
36 1HG GLN 5 HG2 GLN 5 -0.036 6.349 2.282
37 2HG GLN 5 HG1 GLN 5 0.826 7.796 1.759
38 1HE2 GLN 5 HE21 GLN 5 -1.222 7.104 4.076
39 2HE2 GLN 5 HE22 GLN 5 -2.284 8.427 4.028
40 H CYS 6 H CYS 6 0.320 6.176 -1.952
41 HA CYS 6 HA CYS 6 3.054 6.851 -2.526
42 1HB CYS 6 HB2 CYS 6 1.588 5.213 -4.498
43 2HB CYS 6 HB1 CYS 6 3.174 4.956 -3.807
44 H CYS 7 H CYS 7 0.027 7.605 -4.100
45 HA CYS 7 HA CYS 7 1.088 8.424 -6.627
46 1HB CYS 7 HB2 CYS 7 -1.437 8.578 -5.192
47 2HB CYS 7 HB1 CYS 7 -1.125 10.077 -6.057
48 H THR 8 H THR 8 0.087 10.336 -3.791
49 HA THR 8 HA THR 8 1.481 12.721 -4.767
50 HB THR 8 HB THR 8 -0.046 12.043 -2.240
51 HG1 THR 8 HG1 THR 8 -1.496 13.482 -3.110
52 1HG2 THR 8 HG21 THR 8 0.230 14.647 -1.934
53 2HG2 THR 8 HG22 THR 8 1.693 14.403 -2.887
54 3HG2 THR 8 HG23 THR 8 1.487 13.555 -1.355
55 H SER 9 H SER 9 1.736 10.721 -1.815
56 HA SER 9 HA SER 9 4.611 11.503 -1.648
57 1HB SER 9 HB2 SER 9 2.491 11.098 0.325
58 2HB SER 9 HB1 SER 9 3.949 10.196 0.717
59 HG SER 9 HG SER 9 3.573 12.967 0.374
60 H ILE 10 H ILE 10 5.464 9.405 -0.002
61 HA ILE 10 HA ILE 10 5.375 7.126 -1.925
62 HB ILE 10 HB ILE 10 7.309 7.769 0.315
63 1HG1 ILE 10 HG12 ILE 10 7.059 8.943 -2.208
64 2HG1 ILE 10 HG11 ILE 10 8.483 8.997 -1.179
65 1HG2 ILE 10 HG21 ILE 10 7.394 5.615 -1.811
66 2HG2 ILE 10 HG22 ILE 10 7.073 5.354 -0.099
67 3HG2 ILE 10 HG23 ILE 10 8.649 5.940 -0.622
68 1HD1 ILE 10 HD11 ILE 10 8.967 8.211 -3.511
69 2HD1 ILE 10 HD12 ILE 10 7.938 6.810 -3.211
70 3HD1 ILE 10 HD13 ILE 10 9.416 7.037 -2.275
71 H CYS 11 H CYS 11 4.960 4.944 -1.104
72 HA CYS 11 HA CYS 11 3.717 4.961 1.628
73 1HB CYS 11 HB2 CYS 11 2.688 2.710 0.726
74 2HB CYS 11 HB1 CYS 11 1.936 4.239 0.301
75 H SER 12 H SER 12 5.194 4.145 3.029
76 HA SER 12 HA SER 12 7.313 2.369 2.290
77 1HB SER 12 HB2 SER 12 6.679 1.893 5.006
78 2HB SER 12 HB1 SER 12 7.926 2.968 4.381
79 HG SER 12 HG SER 12 6.569 4.214 5.594
80 H LEU 13 H LEU 13 7.195 0.207 1.896
81 HA LEU 13 HA LEU 13 4.962 -1.268 1.419
82 1HB LEU 13 HB2 LEU 13 6.567 -3.162 2.792
83 2HB LEU 13 HB1 LEU 13 6.420 -2.929 1.060
84 HG LEU 13 HG LEU 13 8.768 -2.850 1.924
85 1HD1 LEU 13 HD11 LEU 13 8.916 -1.774 -0.041
86 2HD1 LEU 13 HD12 LEU 13 8.926 -0.284 0.902
87 3HD1 LEU 13 HD13 LEU 13 7.412 -0.895 0.236
88 1HD2 LEU 13 HD21 LEU 13 9.276 -1.592 3.712
89 2HD2 LEU 13 HD22 LEU 13 7.591 -1.090 3.815
90 3HD2 LEU 13 HD23 LEU 13 8.734 -0.141 2.869
91 H TYR 14 H TYR 14 6.128 -0.441 4.626
92 HA TYR 14 HA TYR 14 4.528 -2.318 6.073
93 1HB TYR 14 HB2 TYR 14 6.436 -0.844 6.976
94 2HB TYR 14 HB1 TYR 14 5.230 0.439 7.069
95 HD1 TYR 14 HD1 TYR 14 5.824 -3.113 8.105
96 HD2 TYR 14 HD2 TYR 14 3.818 0.595 8.942
97 HE1 TYR 14 HE1 TYR 14 4.987 -4.048 10.245
98 HE2 TYR 14 HE2 TYR 14 2.981 -0.342 11.081
99 HH TYR 14 HH TYR 14 2.518 -2.906 11.906
100 H GLN 15 H GLN 15 3.916 0.891 4.811
101 HA GLN 15 HA GLN 15 1.254 1.017 5.981
102 1HB GLN 15 HB2 GLN 15 2.591 2.691 3.835
103 2HB GLN 15 HB1 GLN 15 0.996 3.028 4.508
104 1HG GLN 15 HG2 GLN 15 1.860 3.524 6.634
105 2HG GLN 15 HG1 GLN 15 3.381 2.691 6.312
106 1HE2 GLN 15 HE21 GLN 15 3.403 5.385 7.228
107 2HE2 GLN 15 HE22 GLN 15 3.951 6.386 5.971
108 H LEU 16 H LEU 16 2.655 -0.028 2.855
109 HA LEU 16 HA LEU 16 -0.010 -0.383 1.770
110 1HB LEU 16 HB2 LEU 16 2.377 0.033 0.564
111 2HB LEU 16 HB1 LEU 16 2.261 -1.708 0.440
112 HG LEU 16 HG LEU 16 0.627 -1.606 -1.099
113 1HD1 LEU 16 HD11 LEU 16 -0.495 0.772 0.359
114 2HD1 LEU 16 HD12 LEU 16 -1.177 -0.852 0.257
115 3HD1 LEU 16 HD13 LEU 16 -1.155 0.187 -1.168
116 1HD2 LEU 16 HD21 LEU 16 0.746 0.318 -2.567
117 2HD2 LEU 16 HD22 LEU 16 2.354 -0.069 -1.954
118 3HD2 LEU 16 HD23 LEU 16 1.452 1.283 -1.271
119 H GLU 17 H GLU 17 1.792 -1.957 4.003
120 HA GLU 17 HA GLU 17 1.196 -4.707 3.233
121 1HB GLU 17 HB2 GLU 17 3.118 -3.937 4.761
122 2HB GLU 17 HB1 GLU 17 1.886 -3.725 6.006
123 1HG GLU 17 HG2 GLU 17 1.205 -6.185 5.250
124 2HG GLU 17 HG1 GLU 17 2.894 -6.240 4.746
125 H ASN 18 H ASN 18 -0.715 -2.197 4.057
126 HA ASN 18 HA ASN 18 -2.567 -3.875 5.697
127 1HB ASN 18 HB2 ASN 18 -1.736 -1.262 6.078
128 2HB ASN 18 HB1 ASN 18 -3.300 -1.060 5.285
129 1HD2 ASN 18 HD21 ASN 18 -4.843 -3.105 6.275
130 2HD2 ASN 18 HD22 ASN 18 -4.950 -3.024 7.967
131 H TYR 19 H TYR 19 -2.031 -3.752 2.652
132 HA TYR 19 HA TYR 19 -4.888 -3.395 1.884
133 1HB TYR 19 HB2 TYR 19 -2.408 -2.612 0.350
134 2HB TYR 19 HB1 TYR 19 -4.025 -2.658 -0.353
135 HD1 TYR 19 HD1 TYR 19 -2.050 -1.191 2.454
136 HD2 TYR 19 HD2 TYR 19 -5.559 -0.881 -0.009
137 HE1 TYR 19 HE1 TYR 19 -2.564 1.014 3.468
138 HE2 TYR 19 HE2 TYR 19 -6.076 1.322 1.011
139 HH TYR 19 HH TYR 19 -4.802 2.396 3.808
140 H CYS 20 H CYS 20 -3.417 -5.812 2.727
141 HA CYS 20 HA CYS 20 -3.508 -7.342 0.176
142 1HB CYS 20 HB2 CYS 20 -2.281 -8.319 2.751
143 2HB CYS 20 HB1 CYS 20 -2.009 -8.915 1.120
144 H ASN 21 H ASN 21 -4.888 -9.134 0.054
145 HA ASN 21 HA ASN 21 -7.191 -9.155 1.759
146 1HB ASN 21 HB2 ASN 21 -6.246 -10.596 -0.580
147 2HB ASN 21 HB1 ASN 21 -7.040 -11.686 0.556
148 1HD2 ASN 21 HD21 ASN 21 -7.536 -8.691 -1.333
149 2HD2 ASN 21 HD22 ASN 21 -9.232 -8.758 -1.296
150 1H PHE 1 HT1 PHE 1 11.141 -1.419 3.596
151 2H PHE 1 HT2 PHE 1 11.813 -2.909 4.058
152 3H PHE 1 HT3 PHE 1 10.543 -2.859 2.930
153 HA PHE 1 HA PHE 1 13.370 -2.513 2.534
154 1HB PHE 1 HB2 PHE 1 11.077 -2.940 0.594
155 2HB PHE 1 HB1 PHE 1 12.786 -3.258 0.296
156 HD1 PHE 1 HD1 PHE 1 9.700 -4.590 1.566
157 HD2 PHE 1 HD2 PHE 1 13.974 -4.976 1.795
158 HE1 PHE 1 HE1 PHE 1 9.443 -6.871 2.509
159 HE2 PHE 1 HE2 PHE 1 13.717 -7.258 2.737
160 HZ PHE 1 HZ PHE 1 11.452 -8.205 3.094
161 H VAL 2 H VAL 2 12.791 -1.473 -0.234
162 HA VAL 2 HA VAL 2 13.223 1.326 0.382
163 HB VAL 2 HB VAL 2 13.515 1.627 -1.977
164 1HG1 VAL 2 HG11 VAL 2 15.196 0.018 -2.451
165 2HG1 VAL 2 HG12 VAL 2 14.372 -1.234 -1.523
166 3HG1 VAL 2 HG13 VAL 2 15.154 0.110 -0.690
167 1HG2 VAL 2 HG21 VAL 2 11.890 -0.914 -2.161
168 2HG2 VAL 2 HG22 VAL 2 12.889 -0.365 -3.507
169 3HG2 VAL 2 HG23 VAL 2 11.571 0.648 -2.917
170 H ASN 3 H ASN 3 11.738 2.915 0.479
171 HA ASN 3 HA ASN 3 8.903 2.216 0.023
172 1HB ASN 3 HB2 ASN 3 8.739 4.774 0.808
173 2HB ASN 3 HB1 ASN 3 8.951 3.466 1.963
174 1HD2 ASN 3 HD21 ASN 3 10.268 6.433 0.961
175 2HD2 ASN 3 HD22 ASN 3 11.796 6.279 1.685
176 H GLN 4 H GLN 4 8.394 2.280 -2.125
177 HA GLN 4 HA GLN 4 9.431 4.533 -3.771
178 1HB GLN 4 HB2 GLN 4 9.535 1.963 -4.378
179 2HB GLN 4 HB1 GLN 4 7.879 2.240 -4.912
180 1HG GLN 4 HG2 GLN 4 9.527 2.567 -6.747
181 2HG GLN 4 HG1 GLN 4 8.621 4.037 -6.395
182 1HE2 GLN 4 HE21 GLN 4 11.757 2.427 -5.707
183 2HE2 GLN 4 HE22 GLN 4 12.612 3.869 -5.438
184 H HIS 5 H HIS 5 7.886 5.425 -5.402
185 HA HIS 5 HA HIS 5 5.165 5.756 -4.219
186 1HB HIS 5 HB2 HIS 5 5.076 7.844 -5.674
187 2HB HIS 5 HB1 HIS 5 6.219 7.901 -4.338
188 HD2 HIS 5 HD2 HIS 5 7.695 5.842 -7.211
189 HE1 HIS 5 HE1 HIS 5 9.134 9.784 -7.692
190 HE2 HIS 5 HE2 HIS 5 9.379 7.368 -8.468
191 H LEU 6 H LEU 6 3.336 5.409 -5.580
192 HA LEU 6 HA LEU 6 3.809 4.727 -8.399
193 1HB LEU 6 HB2 LEU 6 2.430 2.690 -6.671
194 2HB LEU 6 HB1 LEU 6 2.978 2.511 -8.320
195 HG LEU 6 HG LEU 6 5.334 2.948 -7.422
196 1HD1 LEU 6 HD11 LEU 6 4.647 1.777 -4.880
197 2HD1 LEU 6 HD12 LEU 6 3.826 3.323 -5.095
198 3HD1 LEU 6 HD13 LEU 6 5.584 3.233 -5.219
199 1HD2 LEU 6 HD21 LEU 6 3.767 0.448 -6.719
200 2HD2 LEU 6 HD22 LEU 6 5.527 0.549 -6.695
201 3HD2 LEU 6 HD23 LEU 6 4.654 0.753 -8.213
202 H CYS 7 H CYS 7 1.942 5.105 -9.700
203 HA CYS 7 HA CYS 7 -0.411 6.084 -8.156
204 1HB CYS 7 HB2 CYS 7 1.010 7.111 -10.529
205 2HB CYS 7 HB1 CYS 7 -0.748 7.186 -10.624
206 H GLY 8 H GLY 8 -0.346 5.391 -11.643
207 1HA GLY 8 HA2 GLY 8 -2.909 4.132 -11.567
208 2HA GLY 8 HA1 GLY 8 -1.782 4.028 -12.918
209 H SER 9 H SER 9 -1.585 1.875 -13.415
210 HA SER 9 HA SER 9 -2.047 -0.348 -11.779
211 1HB SER 9 HB2 SER 9 -1.572 -0.736 -14.108
212 2HB SER 9 HB1 SER 9 -0.003 0.056 -13.987
213 HG SER 9 HG SER 9 0.404 -2.098 -13.872
214 H ASP 10 H ASP 10 0.624 1.847 -11.927
215 HA ASP 10 HA ASP 10 2.644 0.580 -10.478
216 1HB ASP 10 HB2 ASP 10 2.091 3.155 -11.355
217 2HB ASP 10 HB1 ASP 10 2.134 3.331 -9.605
218 H LEU 11 H LEU 11 -0.423 1.956 -9.309
219 HA LEU 11 HA LEU 11 0.161 1.518 -6.506
220 1HB LEU 11 HB2 LEU 11 -1.952 2.657 -7.970
221 2HB LEU 11 HB1 LEU 11 -2.656 1.225 -7.259
222 HG LEU 11 HG LEU 11 -3.009 2.508 -5.448
223 1HD1 LEU 11 HD11 LEU 11 -0.879 1.154 -4.867
224 2HD1 LEU 11 HD12 LEU 11 -1.351 2.476 -3.800
225 3HD1 LEU 11 HD13 LEU 11 -0.054 2.709 -4.971
226 1HD2 LEU 11 HD21 LEU 11 -2.747 4.572 -6.578
227 2HD2 LEU 11 HD22 LEU 11 -1.001 4.363 -6.714
228 3HD2 LEU 11 HD23 LEU 11 -1.728 4.709 -5.145
229 1HN ABA 12 H ABA 12 -1.609 -0.149 -9.036
230 HA ABA 12 HA ABA 12 -2.353 -2.485 -7.582
231 1HB ABA 12 HB1 ABA 12 -1.582 -2.661 -10.482
232 2HB ABA 12 HB2 ABA 12 -2.928 -1.612 -10.048
233 1HG ABA 12 HG1 ABA 12 -4.291 -3.365 -9.781
234 2HG ABA 12 HG2 ABA 12 -3.152 -4.146 -8.684
235 3HG ABA 12 HG3 ABA 12 -3.009 -4.388 -10.425
236 H GLU 13 H GLU 13 0.687 -1.334 -8.671
237 HA GLU 13 HA GLU 13 1.954 -3.977 -8.781
238 1HB GLU 13 HB2 GLU 13 2.654 -1.307 -9.618
239 2HB GLU 13 HB1 GLU 13 3.948 -1.996 -8.644
240 1HG GLU 13 HG2 GLU 13 4.360 -3.699 -10.145
241 2HG GLU 13 HG1 GLU 13 2.693 -3.735 -10.722
242 H ALA 14 H ALA 14 2.333 -1.070 -6.694
243 HA ALA 14 HA ALA 14 4.138 -2.118 -4.838
244 1HB ALA 14 HB1 ALA 14 2.752 0.173 -4.911
245 2HB ALA 14 HB2 ALA 14 3.456 -0.425 -3.409
246 3HB ALA 14 HB3 ALA 14 1.747 -0.693 -3.752
247 H LEU 15 H LEU 15 0.632 -2.458 -4.929
248 HA LEU 15 HA LEU 15 0.394 -4.265 -2.705
249 1HB LEU 15 HB2 LEU 15 -1.373 -4.144 -5.158
250 2HB LEU 15 HB1 LEU 15 -1.845 -4.722 -3.566
251 HG LEU 15 HG LEU 15 -1.168 -1.879 -4.407
252 1HD1 LEU 15 HD11 LEU 15 -3.644 -2.815 -3.028
253 2HD1 LEU 15 HD12 LEU 15 -3.465 -2.978 -4.776
254 3HD1 LEU 15 HD13 LEU 15 -3.399 -1.383 -4.028
255 1HD2 LEU 15 HD21 LEU 15 -0.661 -2.957 -1.873
256 2HD2 LEU 15 HD22 LEU 15 -2.196 -2.100 -1.716
257 3HD2 LEU 15 HD23 LEU 15 -0.768 -1.251 -2.300
258 H TYR 16 H TYR 16 1.075 -4.692 -6.154
259 HA TYR 16 HA TYR 16 0.850 -7.611 -6.060
260 1HB TYR 16 HB2 TYR 16 1.379 -5.539 -8.060
261 2HB TYR 16 HB1 TYR 16 2.364 -6.978 -8.295
262 HD1 TYR 16 HD1 TYR 16 -0.371 -5.590 -9.585
263 HD2 TYR 16 HD2 TYR 16 0.653 -9.172 -7.443
264 HE1 TYR 16 HE1 TYR 16 -2.321 -6.744 -10.590
265 HE2 TYR 16 HE2 TYR 16 -1.300 -10.328 -8.448
266 HH TYR 16 HH TYR 16 -2.990 -10.176 -9.881
267 H LEU 17 H LEU 17 3.377 -5.220 -5.660
268 HA LEU 17 HA LEU 17 5.525 -7.247 -5.719
269 1HB LEU 17 HB2 LEU 17 5.326 -4.300 -5.719
270 2HB LEU 17 HB1 LEU 17 6.702 -4.963 -4.839
271 HG LEU 17 HG LEU 17 7.170 -4.534 -7.270
272 1HD1 LEU 17 HD11 LEU 17 8.651 -6.078 -6.336
273 2HD1 LEU 17 HD12 LEU 17 7.969 -6.990 -7.682
274 3HD1 LEU 17 HD13 LEU 17 7.379 -7.264 -6.043
275 1HD2 LEU 17 HD21 LEU 17 6.137 -6.666 -8.607
276 2HD2 LEU 17 HD22 LEU 17 5.403 -5.064 -8.614
277 3HD2 LEU 17 HD23 LEU 17 4.807 -6.302 -7.512
278 H VAL 18 H VAL 18 3.475 -5.588 -3.503
279 HA VAL 18 HA VAL 18 5.171 -6.051 -1.163
280 HB VAL 18 HB VAL 18 2.451 -4.893 -1.700
281 1HG1 VAL 18 HG11 VAL 18 2.690 -4.572 0.982
282 2HG1 VAL 18 HG12 VAL 18 3.386 -6.182 0.792
283 3HG1 VAL 18 HG13 VAL 18 1.743 -5.859 0.236
284 1HG2 VAL 18 HG21 VAL 18 4.711 -3.635 -1.739
285 2HG2 VAL 18 HG22 VAL 18 4.683 -3.807 0.015
286 3HG2 VAL 18 HG23 VAL 18 3.398 -2.921 -0.804
287 H CYS 19 H CYS 19 1.839 -7.107 -1.945
288 HA CYS 19 HA CYS 19 2.446 -9.654 -0.505
289 1HB CYS 19 HB2 CYS 19 -0.189 -8.225 -0.976
290 2HB CYS 19 HB1 CYS 19 -0.044 -9.816 -0.229
291 H GLY 20 H GLY 20 -0.081 -8.777 -2.874
292 1HA GLY 20 HA2 GLY 20 -0.601 -9.734 -4.954
293 2HA GLY 20 HA1 GLY 20 1.070 -10.291 -5.033
294 H GLU 21 H GLU 21 1.381 -12.080 -3.100
295 HA GLU 21 HA GLU 21 -0.277 -14.311 -3.959
296 1HB GLU 21 HB2 GLU 21 1.343 -14.683 -1.512
297 2HB GLU 21 HB1 GLU 21 1.311 -15.637 -2.991
298 1HG GLU 21 HG2 GLU 21 2.524 -13.554 -4.041
299 2HG GLU 21 HG1 GLU 21 2.919 -13.172 -2.364
300 H ARG 22 H ARG 22 -0.746 -11.874 -1.698
301 HA ARG 22 HA ARG 22 -2.481 -13.623 -0.012
302 1HB ARG 22 HB2 ARG 22 -0.683 -11.508 0.629
303 2HB ARG 22 HB1 ARG 22 -2.314 -10.942 0.990
304 1HG ARG 22 HG2 ARG 22 -1.271 -12.134 2.918
305 2HG ARG 22 HG1 ARG 22 -2.742 -12.925 2.351
306 1HD ARG 22 HD2 ARG 22 -0.371 -13.872 0.935
307 2HD ARG 22 HD1 ARG 22 -0.258 -14.141 2.674
308 HE ARG 22 HE ARG 22 -1.967 -15.592 0.884
309 1HH1 ARG 22 HH21 ARG 22 -1.276 -14.812 4.113
310 2HH1 ARG 22 HH22 ARG 22 -2.706 -15.542 4.761
311 1HH2 ARG 22 HH11 ARG 22 -4.083 -16.234 1.656
312 2HH2 ARG 22 HH12 ARG 22 -4.295 -16.346 3.371
313 H GLY 23 H GLY 23 -2.541 -11.309 -2.501
314 1HA GLY 23 HA2 GLY 23 -4.576 -10.754 -3.680
315 2HA GLY 23 HA1 GLY 23 -5.487 -11.098 -2.217
316 H PHE 24 H PHE 24 -5.415 -8.569 -3.920
317 HA PHE 24 HA PHE 24 -5.134 -6.740 -1.612
318 1HB PHE 24 HB2 PHE 24 -3.748 -5.129 -2.794
319 2HB PHE 24 HB1 PHE 24 -2.909 -6.669 -2.713
320 HD1 PHE 24 HD1 PHE 24 -4.929 -4.473 -4.971
321 HD2 PHE 24 HD2 PHE 24 -2.318 -7.877 -4.676
322 HE1 PHE 24 HE1 PHE 24 -4.742 -4.556 -7.433
323 HE2 PHE 24 HE2 PHE 24 -2.139 -7.956 -7.132
324 HZ PHE 24 HZ PHE 24 -3.346 -6.291 -8.521
325 H PHE 25 H PHE 25 -6.804 -5.294 -1.645
326 HA PHE 25 HA PHE 25 -8.459 -5.203 -4.118
327 1HB PHE 25 HB2 PHE 25 -10.202 -4.234 -2.619
328 2HB PHE 25 HB1 PHE 25 -9.658 -5.824 -2.086
329 HD1 PHE 25 HD1 PHE 25 -9.364 -2.178 -1.477
330 HD2 PHE 25 HD2 PHE 25 -8.483 -6.121 -0.013
331 HE1 PHE 25 HE1 PHE 25 -8.705 -1.217 0.713
332 HE2 PHE 25 HE2 PHE 25 -7.824 -5.160 2.178
333 HZ PHE 25 HZ PHE 25 -7.934 -2.707 2.540
334 H TYR 26 H TYR 26 -8.549 -3.366 -5.325
335 HA TYR 26 HA TYR 26 -7.251 -0.919 -4.197
336 1HB TYR 26 HB2 TYR 26 -5.975 -1.549 -6.075
337 2HB TYR 26 HB1 TYR 26 -7.395 -2.054 -6.988
338 HD1 TYR 26 HD1 TYR 26 -7.000 1.097 -5.041
339 HD2 TYR 26 HD2 TYR 26 -7.201 -0.704 -8.936
340 HE1 TYR 26 HE1 TYR 26 -7.152 3.350 -6.077
341 HE2 TYR 26 HE2 TYR 26 -7.354 1.546 -9.972
342 HH TYR 26 HH TYR 26 -6.685 4.405 -8.256
343 H THR 27 H THR 27 -9.142 0.003 -3.281
344 HA THR 27 HA THR 27 -11.410 0.531 -5.140
345 HB THR 27 HB THR 27 -12.118 -0.383 -3.019
346 HG1 THR 27 HG1 THR 27 -13.551 1.132 -3.499
347 1HG2 THR 27 HG21 THR 27 -11.485 1.360 -1.017
348 2HG2 THR 27 HG22 THR 27 -10.028 1.443 -2.006
349 3HG2 THR 27 HG23 THR 27 -10.574 -0.108 -1.370
350 H LYS 28 H LYS 28 -12.322 2.815 -5.037
351 HA LYS 28 HA LYS 28 -10.725 4.975 -4.005
352 1HB LYS 28 HB2 LYS 28 -10.005 5.853 -6.289
353 2HB LYS 28 HB1 LYS 28 -9.113 4.450 -5.699
354 1HG LYS 28 HG2 LYS 28 -9.802 3.194 -7.437
355 2HG LYS 28 HG1 LYS 28 -11.488 3.626 -7.150
356 1HD LYS 28 HD2 LYS 28 -10.582 5.959 -8.191
357 2HD LYS 28 HD1 LYS 28 -9.525 4.820 -9.027
358 1HE LYS 28 HE2 LYS 28 -11.216 4.031 -10.308
359 2HE LYS 28 HE1 LYS 28 -12.313 3.923 -8.931
360 1HZ LYS 28 HZ1 LYS 28 -11.641 6.392 -10.439
361 2HZ LYS 28 HZ2 LYS 28 -12.660 6.318 -9.082
362 3HZ LYS 28 HZ3 LYS 28 -13.104 5.538 -10.524
363 HA PRO 29 HA PRO 29 -14.997 5.993 -5.428
364 1HB PRO 29 HB2 PRO 29 -15.940 6.654 -2.932
365 2HB PRO 29 HB1 PRO 29 -16.008 5.012 -3.597
366 1HG PRO 29 HG2 PRO 29 -14.208 6.109 -1.493
367 2HG PRO 29 HG1 PRO 29 -14.732 4.438 -1.763
368 1HD PRO 29 HD2 PRO 29 -12.214 5.541 -2.483
369 2HD PRO 29 HD1 PRO 29 -12.857 3.965 -2.992
370 H THR 30 H THR 30 -15.927 8.177 -5.474
371 HA THR 30 HA THR 30 -13.902 10.266 -4.877
372 HB THR 30 HB THR 30 -16.426 11.055 -6.196
373 HG1 THR 30 HG1 THR 30 -16.281 9.125 -7.203
374 1HG2 THR 30 HG21 THR 30 -13.549 11.325 -7.090
375 2HG2 THR 30 HG22 THR 30 -14.303 12.424 -5.936
376 3HG2 THR 30 HG23 THR 30 -14.926 12.311 -7.582
Start of MODEL 14
1 1H GLY 1 HT1 GLY 1 -7.596 3.611 0.417
2 2H GLY 1 HT2 GLY 1 -8.092 4.047 -1.148
3 3H GLY 1 HT3 GLY 1 -9.050 4.458 0.194
4 1HA GLY 1 HA1 GLY 1 -7.327 6.152 -0.863
5 2HA GLY 1 HA2 GLY 1 -7.828 6.257 0.849
6 H ILE 2 H ILE 2 -5.940 4.456 -1.743
7 HA ILE 2 HA ILE 2 -3.371 5.325 -0.508
8 HB ILE 2 HB ILE 2 -3.916 2.847 -1.123
9 1HG1 ILE 2 HG12 ILE 2 -1.321 3.923 -2.220
10 2HG1 ILE 2 HG11 ILE 2 -1.676 3.984 -0.494
11 1HG2 ILE 2 HG21 ILE 2 -2.731 3.482 -3.774
12 2HG2 ILE 2 HG22 ILE 2 -4.445 3.824 -3.579
13 3HG2 ILE 2 HG23 ILE 2 -3.837 2.187 -3.325
14 1HD1 ILE 2 HD11 ILE 2 -0.921 1.865 -0.359
15 2HD1 ILE 2 HD12 ILE 2 -0.842 1.719 -2.113
16 3HD1 ILE 2 HD13 ILE 2 -2.352 1.376 -1.267
17 H VAL 3 H VAL 3 -5.368 5.755 -3.292
18 HA VAL 3 HA VAL 3 -3.514 6.691 -5.211
19 HB VAL 3 HB VAL 3 -6.166 8.051 -4.805
20 1HG1 VAL 3 HG11 VAL 3 -6.090 7.571 -7.380
21 2HG1 VAL 3 HG12 VAL 3 -4.368 7.315 -7.097
22 3HG1 VAL 3 HG13 VAL 3 -5.102 8.872 -6.716
23 1HG2 VAL 3 HG21 VAL 3 -6.965 6.002 -6.266
24 2HG2 VAL 3 HG22 VAL 3 -6.936 5.882 -4.507
25 3HG2 VAL 3 HG23 VAL 3 -5.630 5.178 -5.461
26 H GLU 4 H GLU 4 -4.356 8.026 -2.175
27 HA GLU 4 HA GLU 4 -3.311 10.693 -2.994
28 1HB GLU 4 HB2 GLU 4 -5.516 10.692 -1.868
29 2HB GLU 4 HB1 GLU 4 -4.798 9.884 -0.476
30 1HG GLU 4 HG2 GLU 4 -4.999 12.355 -0.162
31 2HG GLU 4 HG1 GLU 4 -3.331 11.792 -0.070
32 H GLN 5 H GLN 5 -2.231 7.848 -1.666
33 HA GLN 5 HA GLN 5 -0.359 9.214 0.205
34 1HB GLN 5 HB2 GLN 5 -1.033 6.281 -0.156
35 2HB GLN 5 HB1 GLN 5 0.167 6.893 0.982
36 1HG GLN 5 HG2 GLN 5 -2.823 7.326 0.999
37 2HG GLN 5 HG1 GLN 5 -1.805 6.667 2.279
38 1HE2 GLN 5 HE21 GLN 5 -3.599 9.288 1.826
39 2HE2 GLN 5 HE22 GLN 5 -2.628 10.493 2.524
40 H CYS 6 H CYS 6 0.093 6.293 -1.801
41 HA CYS 6 HA CYS 6 2.857 6.957 -2.292
42 1HB CYS 6 HB2 CYS 6 1.179 4.726 -2.843
43 2HB CYS 6 HB1 CYS 6 1.898 5.237 -4.343
44 H CYS 7 H CYS 7 -0.107 7.823 -3.885
45 HA CYS 7 HA CYS 7 1.125 8.499 -6.437
46 1HB CYS 7 HB2 CYS 7 -1.409 8.054 -5.832
47 2HB CYS 7 HB1 CYS 7 -1.408 9.776 -5.453
48 H THR 8 H THR 8 -0.006 10.355 -3.609
49 HA THR 8 HA THR 8 1.202 12.826 -4.641
50 HB THR 8 HB THR 8 -0.294 12.088 -2.114
51 HG1 THR 8 HG1 THR 8 -0.923 14.216 -3.788
52 1HG2 THR 8 HG21 THR 8 0.985 14.756 -2.780
53 2HG2 THR 8 HG22 THR 8 1.518 13.658 -1.507
54 3HG2 THR 8 HG23 THR 8 -0.065 14.430 -1.401
55 H SER 9 H SER 9 1.748 10.538 -1.966
56 HA SER 9 HA SER 9 4.548 11.582 -1.778
57 1HB SER 9 HB2 SER 9 2.530 11.059 0.296
58 2HB SER 9 HB1 SER 9 4.078 10.291 0.619
59 HG SER 9 HG SER 9 4.883 12.522 -0.078
60 H ILE 10 H ILE 10 5.552 9.490 -0.167
61 HA ILE 10 HA ILE 10 5.376 7.255 -2.112
62 HB ILE 10 HB ILE 10 7.601 8.340 -1.563
63 1HG1 ILE 10 HG12 ILE 10 7.060 5.963 -2.428
64 2HG1 ILE 10 HG11 ILE 10 8.701 6.305 -1.887
65 1HG2 ILE 10 HG21 ILE 10 6.756 7.536 1.109
66 2HG2 ILE 10 HG22 ILE 10 8.055 8.625 0.621
67 3HG2 ILE 10 HG23 ILE 10 8.342 6.888 0.691
68 1HD1 ILE 10 HD11 ILE 10 8.540 4.777 -0.229
69 2HD1 ILE 10 HD12 ILE 10 7.031 4.246 -0.967
70 3HD1 ILE 10 HD13 ILE 10 7.007 5.444 0.320
71 H CYS 11 H CYS 11 5.339 5.018 -1.244
72 HA CYS 11 HA CYS 11 4.282 4.832 1.536
73 1HB CYS 11 HB2 CYS 11 2.540 3.247 0.850
74 2HB CYS 11 HB1 CYS 11 2.308 4.773 0.013
75 H SER 12 H SER 12 5.742 3.566 2.547
76 HA SER 12 HA SER 12 7.297 1.585 1.033
77 1HB SER 12 HB2 SER 12 7.569 1.541 3.951
78 2HB SER 12 HB1 SER 12 8.799 1.776 2.713
79 HG SER 12 HG SER 12 7.844 3.942 2.491
80 H LEU 13 H LEU 13 7.403 -0.638 1.673
81 HA LEU 13 HA LEU 13 5.204 -2.175 1.628
82 1HB LEU 13 HB2 LEU 13 6.668 -3.487 3.666
83 2HB LEU 13 HB1 LEU 13 6.644 -3.853 1.952
84 HG LEU 13 HG LEU 13 8.928 -3.487 2.920
85 1HD1 LEU 13 HD11 LEU 13 9.466 -3.006 0.812
86 2HD1 LEU 13 HD12 LEU 13 8.971 -1.332 1.043
87 3HD1 LEU 13 HD13 LEU 13 7.796 -2.530 0.509
88 1HD2 LEU 13 HD21 LEU 13 7.719 -1.259 4.079
89 2HD2 LEU 13 HD22 LEU 13 8.775 -0.584 2.841
90 3HD2 LEU 13 HD23 LEU 13 9.437 -1.636 4.088
91 H TYR 14 H TYR 14 6.246 -0.426 4.503
92 HA TYR 14 HA TYR 14 4.569 -1.688 6.393
93 1HB TYR 14 HB2 TYR 14 6.378 0.028 6.865
94 2HB TYR 14 HB1 TYR 14 5.220 1.258 6.359
95 HD1 TYR 14 HD1 TYR 14 4.458 -1.889 8.210
96 HD2 TYR 14 HD2 TYR 14 4.813 2.390 8.418
97 HE1 TYR 14 HE1 TYR 14 3.444 -1.913 10.471
98 HE2 TYR 14 HE2 TYR 14 3.797 2.364 10.679
99 HH TYR 14 HH TYR 14 2.062 0.430 11.893
100 H GLN 15 H GLN 15 3.921 1.439 4.888
101 HA GLN 15 HA GLN 15 1.164 1.408 5.597
102 1HB GLN 15 HB2 GLN 15 2.573 2.900 3.370
103 2HB GLN 15 HB1 GLN 15 0.938 3.238 3.936
104 1HG GLN 15 HG2 GLN 15 1.939 4.674 5.375
105 2HG GLN 15 HG1 GLN 15 2.358 3.223 6.287
106 1HE2 GLN 15 HE21 GLN 15 4.514 3.410 6.899
107 2HE2 GLN 15 HE22 GLN 15 5.774 3.927 5.886
108 H LEU 16 H LEU 16 2.867 0.050 2.767
109 HA LEU 16 HA LEU 16 0.301 -0.471 1.471
110 1HB LEU 16 HB2 LEU 16 2.746 -0.142 0.404
111 2HB LEU 16 HB1 LEU 16 2.646 -1.889 0.446
112 HG LEU 16 HG LEU 16 0.140 -0.963 -0.451
113 1HD1 LEU 16 HD11 LEU 16 2.504 0.385 -1.750
114 2HD1 LEU 16 HD12 LEU 16 0.996 1.117 -1.199
115 3HD1 LEU 16 HD13 LEU 16 1.004 0.084 -2.627
116 1HD2 LEU 16 HD21 LEU 16 2.510 -2.443 -1.576
117 2HD2 LEU 16 HD22 LEU 16 1.105 -2.111 -2.584
118 3HD2 LEU 16 HD23 LEU 16 0.930 -3.079 -1.123
119 H GLU 17 H GLU 17 2.005 -1.891 3.956
120 HA GLU 17 HA GLU 17 1.286 -4.669 3.336
121 1HB GLU 17 HB2 GLU 17 2.925 -3.362 5.297
122 2HB GLU 17 HB1 GLU 17 1.712 -4.325 6.135
123 1HG GLU 17 HG2 GLU 17 2.326 -6.303 4.844
124 2HG GLU 17 HG1 GLU 17 3.480 -5.361 3.900
125 H ASN 18 H ASN 18 -0.527 -2.052 3.938
126 HA ASN 18 HA ASN 18 -2.443 -3.520 5.703
127 1HB ASN 18 HB2 ASN 18 -1.688 -0.678 5.378
128 2HB ASN 18 HB1 ASN 18 -3.415 -0.978 5.543
129 1HD2 ASN 18 HD21 ASN 18 -0.391 -2.253 7.070
130 2HD2 ASN 18 HD22 ASN 18 -0.993 -2.177 8.656
131 H TYR 19 H TYR 19 -1.879 -3.463 2.611
132 HA TYR 19 HA TYR 19 -4.736 -3.043 1.854
133 1HB TYR 19 HB2 TYR 19 -2.228 -2.496 0.259
134 2HB TYR 19 HB1 TYR 19 -3.854 -2.475 -0.422
135 HD1 TYR 19 HD1 TYR 19 -1.466 -0.298 0.513
136 HD2 TYR 19 HD2 TYR 19 -5.521 -1.256 1.567
137 HE1 TYR 19 HE1 TYR 19 -1.795 2.018 1.342
138 HE2 TYR 19 HE2 TYR 19 -5.850 1.061 2.398
139 HH TYR 19 HH TYR 19 -3.280 3.198 2.943
140 H CYS 20 H CYS 20 -3.158 -5.506 2.731
141 HA CYS 20 HA CYS 20 -3.460 -7.092 0.233
142 1HB CYS 20 HB2 CYS 20 -2.086 -7.890 2.811
143 2HB CYS 20 HB1 CYS 20 -2.074 -8.784 1.295
144 H ASN 21 H ASN 21 -4.838 -8.895 0.211
145 HA ASN 21 HA ASN 21 -7.049 -8.824 2.092
146 1HB ASN 21 HB2 ASN 21 -6.487 -10.004 -0.470
147 2HB ASN 21 HB1 ASN 21 -7.099 -11.250 0.617
148 1HD2 ASN 21 HD21 ASN 21 -8.283 -9.313 -1.675
149 2HD2 ASN 21 HD22 ASN 21 -9.785 -8.890 -1.008
150 1H PHE 1 HT1 PHE 1 12.841 -3.218 3.099
151 2H PHE 1 HT2 PHE 1 11.881 -3.202 1.698
152 3H PHE 1 HT3 PHE 1 11.175 -2.920 3.217
153 HA PHE 1 HA PHE 1 11.505 -0.762 3.002
154 1HB PHE 1 HB2 PHE 1 14.318 -1.800 2.926
155 2HB PHE 1 HB1 PHE 1 14.042 -0.096 2.569
156 HD1 PHE 1 HD1 PHE 1 11.561 -1.577 4.715
157 HD2 PHE 1 HD2 PHE 1 15.436 0.282 4.700
158 HE1 PHE 1 HE1 PHE 1 11.334 -1.097 7.135
159 HE2 PHE 1 HE2 PHE 1 15.209 0.763 7.120
160 HZ PHE 1 HZ PHE 1 13.162 0.076 8.339
161 H VAL 2 H VAL 2 10.394 -0.233 1.149
162 HA VAL 2 HA VAL 2 11.794 -0.531 -1.455
163 HB VAL 2 HB VAL 2 8.902 0.012 -0.745
164 1HG1 VAL 2 HG11 VAL 2 9.319 -0.567 -3.529
165 2HG1 VAL 2 HG12 VAL 2 10.320 0.813 -3.078
166 3HG1 VAL 2 HG13 VAL 2 8.579 0.860 -2.804
167 1HG2 VAL 2 HG21 VAL 2 8.525 -2.189 -1.259
168 2HG2 VAL 2 HG22 VAL 2 10.220 -2.350 -0.800
169 3HG2 VAL 2 HG23 VAL 2 9.774 -2.222 -2.502
170 H ASN 3 H ASN 3 10.041 1.888 0.499
171 HA ASN 3 HA ASN 3 10.194 4.225 0.493
172 1HB ASN 3 HB2 ASN 3 12.772 4.260 -0.960
173 2HB ASN 3 HB1 ASN 3 12.323 5.041 0.555
174 1HD2 ASN 3 HD21 ASN 3 11.842 3.279 2.386
175 2HD2 ASN 3 HD22 ASN 3 13.000 2.044 2.506
176 H GLN 4 H GLN 4 9.372 2.579 -2.037
177 HA GLN 4 HA GLN 4 9.856 4.694 -4.068
178 1HB GLN 4 HB2 GLN 4 10.266 2.165 -4.489
179 2HB GLN 4 HB1 GLN 4 8.510 2.057 -4.618
180 1HG GLN 4 HG2 GLN 4 8.521 2.983 -6.673
181 2HG GLN 4 HG1 GLN 4 9.547 4.314 -6.134
182 1HE2 GLN 4 HE21 GLN 4 10.142 0.753 -6.374
183 2HE2 GLN 4 HE22 GLN 4 11.552 0.909 -7.307
184 H HIS 5 H HIS 5 8.140 5.652 -5.229
185 HA HIS 5 HA HIS 5 5.526 5.499 -3.817
186 1HB HIS 5 HB2 HIS 5 5.116 7.743 -4.442
187 2HB HIS 5 HB1 HIS 5 6.824 7.721 -4.010
188 HD2 HIS 5 HD2 HIS 5 4.637 8.702 -6.966
189 HE1 HIS 5 HE1 HIS 5 8.566 8.318 -8.478
190 HE2 HIS 5 HE2 HIS 5 6.210 9.148 -8.989
191 H LEU 6 H LEU 6 3.561 5.329 -5.098
192 HA LEU 6 HA LEU 6 3.910 4.859 -7.945
193 1HB LEU 6 HB2 LEU 6 2.723 2.737 -6.196
194 2HB LEU 6 HB1 LEU 6 2.874 2.683 -7.937
195 HG LEU 6 HG LEU 6 5.401 3.098 -7.496
196 1HD1 LEU 6 HD11 LEU 6 5.181 1.554 -5.058
197 2HD1 LEU 6 HD12 LEU 6 4.375 3.116 -4.900
198 3HD1 LEU 6 HD13 LEU 6 6.076 3.044 -5.359
199 1HD2 LEU 6 HD21 LEU 6 4.473 1.012 -8.424
200 2HD2 LEU 6 HD22 LEU 6 4.061 0.468 -6.798
201 3HD2 LEU 6 HD23 LEU 6 5.752 0.661 -7.262
202 H CYS 7 H CYS 7 1.781 4.361 -9.025
203 HA CYS 7 HA CYS 7 -0.663 5.261 -7.705
204 1HB CYS 7 HB2 CYS 7 0.783 7.337 -8.469
205 2HB CYS 7 HB1 CYS 7 0.190 6.907 -10.073
206 H GLY 8 H GLY 8 -2.527 4.812 -9.091
207 1HA GLY 8 HA2 GLY 8 -3.646 3.483 -10.682
208 2HA GLY 8 HA1 GLY 8 -2.425 4.067 -11.816
209 H SER 9 H SER 9 -1.816 2.176 -12.876
210 HA SER 9 HA SER 9 -1.701 -0.427 -11.853
211 1HB SER 9 HB2 SER 9 -1.132 0.463 -14.247
212 2HB SER 9 HB1 SER 9 0.511 0.604 -13.628
213 HG SER 9 HG SER 9 -0.938 -1.764 -13.212
214 H ASP 10 H ASP 10 0.946 1.991 -11.857
215 HA ASP 10 HA ASP 10 2.881 0.595 -10.416
216 1HB ASP 10 HB2 ASP 10 2.075 3.484 -10.567
217 2HB ASP 10 HB1 ASP 10 3.348 2.992 -9.464
218 H LEU 11 H LEU 11 -0.134 2.039 -9.263
219 HA LEU 11 HA LEU 11 0.388 1.636 -6.449
220 1HB LEU 11 HB2 LEU 11 -1.592 2.875 -7.920
221 2HB LEU 11 HB1 LEU 11 -2.403 1.387 -7.459
222 HG LEU 11 HG LEU 11 -2.937 2.489 -5.560
223 1HD1 LEU 11 HD11 LEU 11 -0.038 2.475 -4.773
224 2HD1 LEU 11 HD12 LEU 11 -0.960 0.976 -4.895
225 3HD1 LEU 11 HD13 LEU 11 -1.457 2.227 -3.759
226 1HD2 LEU 11 HD21 LEU 11 -2.062 4.644 -4.990
227 2HD2 LEU 11 HD22 LEU 11 -2.158 4.574 -6.749
228 3HD2 LEU 11 HD23 LEU 11 -0.605 4.365 -5.942
229 1HN ABA 12 H ABA 12 -1.421 -0.078 -8.947
230 HA ABA 12 HA ABA 12 -2.200 -2.374 -7.485
231 1HB ABA 12 HB1 ABA 12 -1.383 -2.655 -10.356
232 2HB ABA 12 HB2 ABA 12 -2.692 -1.543 -9.983
233 1HG ABA 12 HG1 ABA 12 -4.137 -3.194 -9.533
234 2HG ABA 12 HG2 ABA 12 -2.942 -4.113 -8.618
235 3HG ABA 12 HG3 ABA 12 -2.992 -4.234 -10.378
236 H GLU 13 H GLU 13 0.871 -1.413 -8.795
237 HA GLU 13 HA GLU 13 2.068 -4.052 -8.795
238 1HB GLU 13 HB2 GLU 13 2.928 -1.330 -9.410
239 2HB GLU 13 HB1 GLU 13 4.155 -2.249 -8.552
240 1HG GLU 13 HG2 GLU 13 2.702 -3.560 -10.819
241 2HG GLU 13 HG1 GLU 13 3.982 -2.401 -11.185
242 H ALA 14 H ALA 14 2.581 -1.223 -6.621
243 HA ALA 14 HA ALA 14 4.246 -2.430 -4.742
244 1HB ALA 14 HB1 ALA 14 2.921 -1.013 -3.015
245 2HB ALA 14 HB2 ALA 14 1.980 -0.457 -4.399
246 3HB ALA 14 HB3 ALA 14 3.717 -0.153 -4.332
247 H LEU 15 H LEU 15 0.731 -2.551 -4.952
248 HA LEU 15 HA LEU 15 0.348 -4.394 -2.766
249 1HB LEU 15 HB2 LEU 15 -1.395 -4.136 -5.223
250 2HB LEU 15 HB1 LEU 15 -1.898 -4.678 -3.630
251 HG LEU 15 HG LEU 15 -1.097 -1.873 -4.492
252 1HD1 LEU 15 HD11 LEU 15 -3.598 -2.896 -3.169
253 2HD1 LEU 15 HD12 LEU 15 -3.412 -2.726 -4.914
254 3HD1 LEU 15 HD13 LEU 15 -3.336 -1.302 -3.875
255 1HD2 LEU 15 HD21 LEU 15 -2.109 -1.907 -1.820
256 2HD2 LEU 15 HD22 LEU 15 -0.546 -1.323 -2.384
257 3HD2 LEU 15 HD23 LEU 15 -0.736 -3.009 -1.900
258 H TYR 16 H TYR 16 0.964 -4.752 -6.232
259 HA TYR 16 HA TYR 16 0.534 -7.632 -6.266
260 1HB TYR 16 HB2 TYR 16 1.181 -5.537 -8.158
261 2HB TYR 16 HB1 TYR 16 2.218 -6.934 -8.410
262 HD1 TYR 16 HD1 TYR 16 -0.977 -5.515 -9.048
263 HD2 TYR 16 HD2 TYR 16 1.020 -9.272 -8.454
264 HE1 TYR 16 HE1 TYR 16 -2.842 -6.678 -10.189
265 HE2 TYR 16 HE2 TYR 16 -0.851 -10.439 -9.596
266 HH TYR 16 HH TYR 16 -3.383 -9.918 -9.988
267 H LEU 17 H LEU 17 3.276 -5.516 -5.648
268 HA LEU 17 HA LEU 17 5.142 -7.824 -5.725
269 1HB LEU 17 HB2 LEU 17 5.386 -4.889 -5.815
270 2HB LEU 17 HB1 LEU 17 6.623 -5.703 -4.854
271 HG LEU 17 HG LEU 17 7.385 -5.554 -7.164
272 1HD1 LEU 17 HD11 LEU 17 7.321 -7.851 -5.662
273 2HD1 LEU 17 HD12 LEU 17 8.221 -7.666 -7.166
274 3HD1 LEU 17 HD13 LEU 17 6.617 -8.397 -7.185
275 1HD2 LEU 17 HD21 LEU 17 4.822 -7.031 -7.829
276 2HD2 LEU 17 HD22 LEU 17 6.099 -6.632 -8.979
277 3HD2 LEU 17 HD23 LEU 17 5.163 -5.347 -8.216
278 H VAL 18 H VAL 18 3.439 -5.760 -3.512
279 HA VAL 18 HA VAL 18 5.064 -6.406 -1.203
280 HB VAL 18 HB VAL 18 2.400 -5.089 -1.667
281 1HG1 VAL 18 HG11 VAL 18 1.725 -5.851 0.360
282 2HG1 VAL 18 HG12 VAL 18 2.917 -4.729 1.015
283 3HG1 VAL 18 HG13 VAL 18 3.340 -6.424 0.778
284 1HG2 VAL 18 HG21 VAL 18 4.093 -3.516 -1.922
285 2HG2 VAL 18 HG22 VAL 18 5.159 -4.330 -0.779
286 3HG2 VAL 18 HG23 VAL 18 3.796 -3.378 -0.190
287 H CYS 19 H CYS 19 1.869 -7.530 -2.380
288 HA CYS 19 HA CYS 19 2.293 -9.982 -0.726
289 1HB CYS 19 HB2 CYS 19 -0.313 -8.487 -1.147
290 2HB CYS 19 HB1 CYS 19 -0.149 -10.026 -0.301
291 H GLY 20 H GLY 20 -0.208 -8.956 -3.077
292 1HA GLY 20 HA2 GLY 20 -0.795 -9.906 -5.150
293 2HA GLY 20 HA1 GLY 20 0.783 -10.695 -5.165
294 H GLU 21 H GLU 21 0.878 -12.445 -3.243
295 HA GLU 21 HA GLU 21 -1.096 -14.448 -3.945
296 1HB GLU 21 HB2 GLU 21 0.058 -15.811 -2.190
297 2HB GLU 21 HB1 GLU 21 1.176 -15.128 -3.373
298 1HG GLU 21 HG2 GLU 21 1.070 -13.121 -1.508
299 2HG GLU 21 HG1 GLU 21 0.907 -14.553 -0.491
300 H ARG 22 H ARG 22 -0.650 -12.216 -1.258
301 HA ARG 22 HA ARG 22 -2.705 -13.439 0.398
302 1HB ARG 22 HB2 ARG 22 -0.698 -11.548 0.798
303 2HB ARG 22 HB1 ARG 22 -2.190 -10.614 0.924
304 1HG ARG 22 HG2 ARG 22 -2.653 -11.512 2.934
305 2HG ARG 22 HG1 ARG 22 -2.474 -13.146 2.293
306 1HD ARG 22 HD2 ARG 22 -0.724 -13.164 3.790
307 2HD ARG 22 HD1 ARG 22 0.118 -12.485 2.397
308 HE ARG 22 HE ARG 22 -1.138 -10.524 4.202
309 1HH1 ARG 22 HH21 ARG 22 1.491 -12.617 4.322
310 2HH1 ARG 22 HH22 ARG 22 2.684 -11.382 4.556
311 1HH2 ARG 22 HH11 ARG 22 0.467 -8.771 4.024
312 2HH2 ARG 22 HH12 ARG 22 2.103 -9.206 4.388
313 H GLY 23 H GLY 23 -2.640 -11.185 -2.215
314 1HA GLY 23 HA2 GLY 23 -4.660 -10.657 -3.455
315 2HA GLY 23 HA1 GLY 23 -5.590 -10.905 -1.985
316 H PHE 24 H PHE 24 -5.536 -8.461 -3.749
317 HA PHE 24 HA PHE 24 -5.112 -6.556 -1.530
318 1HB PHE 24 HB2 PHE 24 -3.748 -5.017 -2.822
319 2HB PHE 24 HB1 PHE 24 -2.938 -6.572 -2.745
320 HD1 PHE 24 HD1 PHE 24 -4.674 -4.176 -4.934
321 HD2 PHE 24 HD2 PHE 24 -2.837 -8.059 -4.722
322 HE1 PHE 24 HE1 PHE 24 -4.636 -4.304 -7.398
323 HE2 PHE 24 HE2 PHE 24 -2.803 -8.183 -7.190
324 HZ PHE 24 HZ PHE 24 -3.700 -6.288 -8.533
325 H PHE 25 H PHE 25 -6.756 -5.080 -1.539
326 HA PHE 25 HA PHE 25 -8.536 -5.059 -3.923
327 1HB PHE 25 HB2 PHE 25 -10.107 -3.877 -2.272
328 2HB PHE 25 HB1 PHE 25 -9.747 -5.573 -1.949
329 HD1 PHE 25 HD1 PHE 25 -8.791 -2.085 -1.041
330 HD2 PHE 25 HD2 PHE 25 -8.646 -6.240 0.048
331 HE1 PHE 25 HE1 PHE 25 -7.885 -1.471 1.186
332 HE2 PHE 25 HE2 PHE 25 -7.739 -5.626 2.275
333 HZ PHE 25 HZ PHE 25 -7.359 -3.241 2.844
334 H TYR 26 H TYR 26 -8.653 -3.295 -5.213
335 HA TYR 26 HA TYR 26 -7.511 -0.723 -4.191
336 1HB TYR 26 HB2 TYR 26 -6.022 -1.435 -5.899
337 2HB TYR 26 HB1 TYR 26 -7.337 -2.025 -6.912
338 HD1 TYR 26 HD1 TYR 26 -5.879 1.097 -5.456
339 HD2 TYR 26 HD2 TYR 26 -8.329 -0.654 -8.519
340 HE1 TYR 26 HE1 TYR 26 -5.989 3.289 -6.622
341 HE2 TYR 26 HE2 TYR 26 -8.440 1.532 -9.686
342 HH TYR 26 HH TYR 26 -6.485 4.257 -8.675
343 H THR 27 H THR 27 -9.489 0.215 -3.577
344 HA THR 27 HA THR 27 -11.927 0.040 -5.034
345 HB THR 27 HB THR 27 -12.724 1.748 -3.611
346 HG1 THR 27 HG1 THR 27 -10.787 2.944 -2.499
347 1HG2 THR 27 HG21 THR 27 -11.497 -0.346 -2.531
348 2HG2 THR 27 HG22 THR 27 -12.132 0.951 -1.520
349 3HG2 THR 27 HG23 THR 27 -10.412 0.899 -1.912
350 H LYS 28 H LYS 28 -12.947 2.187 -5.984
351 HA LYS 28 HA LYS 28 -12.865 3.912 -7.588
352 1HB LYS 28 HB2 LYS 28 -10.638 4.415 -6.226
353 2HB LYS 28 HB1 LYS 28 -9.875 3.810 -7.698
354 1HG LYS 28 HG2 LYS 28 -12.077 5.695 -8.199
355 2HG LYS 28 HG1 LYS 28 -10.721 6.405 -7.322
356 1HD LYS 28 HD2 LYS 28 -9.186 5.427 -9.074
357 2HD LYS 28 HD1 LYS 28 -10.624 4.972 -9.989
358 1HE LYS 28 HE2 LYS 28 -11.341 7.340 -10.034
359 2HE LYS 28 HE1 LYS 28 -9.885 7.793 -9.149
360 1HZ LYS 28 HZ1 LYS 28 -10.011 7.830 -11.775
361 2HZ LYS 28 HZ2 LYS 28 -9.536 6.211 -11.575
362 3HZ LYS 28 HZ3 LYS 28 -8.576 7.464 -10.947
363 HA PRO 29 HA PRO 29 -11.852 0.506 -10.563
364 1HB PRO 29 HB2 PRO 29 -14.454 -0.015 -11.274
365 2HB PRO 29 HB1 PRO 29 -13.630 -0.826 -9.932
366 1HG PRO 29 HG2 PRO 29 -15.717 1.300 -9.841
367 2HG PRO 29 HG1 PRO 29 -15.323 0.063 -8.635
368 1HD PRO 29 HD2 PRO 29 -14.557 2.795 -8.538
369 2HD PRO 29 HD1 PRO 29 -13.925 1.489 -7.511
370 H THR 30 H THR 30 -11.012 2.351 -11.834
371 HA THR 30 HA THR 30 -11.040 3.755 -13.712
372 HB THR 30 HB THR 30 -13.607 2.234 -14.259
373 HG1 THR 30 HG1 THR 30 -11.323 1.272 -14.156
374 1HG2 THR 30 HG21 THR 30 -13.743 4.156 -15.610
375 2HG2 THR 30 HG22 THR 30 -12.976 2.969 -16.666
376 3HG2 THR 30 HG23 THR 30 -12.000 4.205 -15.872
Start of MODEL 15
1 1H GLY 1 HT1 GLY 1 -7.944 6.641 2.182
2 2H GLY 1 HT2 GLY 1 -8.891 7.475 1.043
3 3H GLY 1 HT3 GLY 1 -7.400 8.117 1.542
4 1HA GLY 1 HA1 GLY 1 -7.205 5.532 0.364
5 2HA GLY 1 HA2 GLY 1 -7.769 6.782 -0.789
6 H ILE 2 H ILE 2 -5.778 4.972 -1.200
7 HA ILE 2 HA ILE 2 -3.295 5.751 0.261
8 HB ILE 2 HB ILE 2 -4.064 3.259 -0.102
9 1HG1 ILE 2 HG12 ILE 2 -1.238 3.602 -0.948
10 2HG1 ILE 2 HG11 ILE 2 -1.710 4.446 0.528
11 1HG2 ILE 2 HG21 ILE 2 -2.534 3.684 -2.680
12 2HG2 ILE 2 HG22 ILE 2 -4.297 3.678 -2.631
13 3HG2 ILE 2 HG23 ILE 2 -3.398 2.238 -2.154
14 1HD1 ILE 2 HD11 ILE 2 -1.320 2.458 1.549
15 2HD1 ILE 2 HD12 ILE 2 -1.404 1.560 0.033
16 3HD1 ILE 2 HD13 ILE 2 -2.887 1.990 0.886
17 H VAL 3 H VAL 3 -4.930 6.054 -2.748
18 HA VAL 3 HA VAL 3 -2.595 6.575 -4.387
19 HB VAL 3 HB VAL 3 -5.239 7.794 -5.056
20 1HG1 VAL 3 HG11 VAL 3 -4.505 6.459 -7.221
21 2HG1 VAL 3 HG12 VAL 3 -2.929 6.480 -6.427
22 3HG1 VAL 3 HG13 VAL 3 -3.745 7.996 -6.810
23 1HG2 VAL 3 HG21 VAL 3 -4.722 4.871 -4.615
24 2HG2 VAL 3 HG22 VAL 3 -5.750 5.355 -5.965
25 3HG2 VAL 3 HG23 VAL 3 -6.189 5.802 -4.316
26 H GLU 4 H GLU 4 -3.966 8.269 -1.879
27 HA GLU 4 HA GLU 4 -3.400 10.946 -2.990
28 1HB GLU 4 HB2 GLU 4 -5.384 10.695 -1.577
29 2HB GLU 4 HB1 GLU 4 -4.391 10.072 -0.260
30 1HG GLU 4 HG2 GLU 4 -3.424 12.149 0.175
31 2HG GLU 4 HG1 GLU 4 -3.739 12.749 -1.454
32 H GLN 5 H GLN 5 -2.008 8.613 -0.750
33 HA GLN 5 HA GLN 5 0.172 10.555 -0.134
34 1HB GLN 5 HB2 GLN 5 -1.246 9.039 1.598
35 2HB GLN 5 HB1 GLN 5 0.067 7.919 1.235
36 1HG GLN 5 HG2 GLN 5 1.702 9.345 2.095
37 2HG GLN 5 HG1 GLN 5 0.702 10.783 1.885
38 1HE2 GLN 5 HE21 GLN 5 -0.867 11.283 3.547
39 2HE2 GLN 5 HE22 GLN 5 -0.914 10.450 5.025
40 H CYS 6 H CYS 6 -0.481 8.117 -2.295
41 HA CYS 6 HA CYS 6 2.334 7.119 -2.275
42 1HB CYS 6 HB2 CYS 6 -0.243 6.029 -3.329
43 2HB CYS 6 HB1 CYS 6 1.272 5.510 -4.046
44 H CYS 7 H CYS 7 -0.093 8.706 -4.315
45 HA CYS 7 HA CYS 7 1.889 8.892 -6.513
46 1HB CYS 7 HB2 CYS 7 -0.698 8.467 -6.758
47 2HB CYS 7 HB1 CYS 7 -0.809 10.218 -6.575
48 H THR 8 H THR 8 0.082 10.951 -4.260
49 HA THR 8 HA THR 8 1.483 13.369 -5.181
50 HB THR 8 HB THR 8 -0.561 12.804 -3.021
51 HG1 THR 8 HG1 THR 8 -0.663 14.630 -5.169
52 1HG2 THR 8 HG21 THR 8 1.303 15.076 -3.302
53 2HG2 THR 8 HG22 THR 8 0.391 14.533 -1.894
54 3HG2 THR 8 HG23 THR 8 -0.393 15.528 -3.121
55 H SER 9 H SER 9 1.855 10.876 -2.818
56 HA SER 9 HA SER 9 4.285 12.245 -1.799
57 1HB SER 9 HB2 SER 9 2.211 10.973 0.013
58 2HB SER 9 HB1 SER 9 3.715 11.736 0.521
59 HG SER 9 HG SER 9 1.325 12.854 -0.337
60 H ILE 10 H ILE 10 5.126 10.375 0.016
61 HA ILE 10 HA ILE 10 5.517 7.990 -1.724
62 HB ILE 10 HB ILE 10 7.022 8.959 0.726
63 1HG1 ILE 10 HG12 ILE 10 7.228 10.236 -1.493
64 2HG1 ILE 10 HG11 ILE 10 8.732 9.642 -0.792
65 1HG2 ILE 10 HG21 ILE 10 8.677 7.165 -0.293
66 2HG2 ILE 10 HG22 ILE 10 7.192 6.479 -0.953
67 3HG2 ILE 10 HG23 ILE 10 7.379 6.663 0.791
68 1HD1 ILE 10 HD11 ILE 10 8.133 9.215 -3.358
69 2HD1 ILE 10 HD12 ILE 10 7.272 7.837 -2.671
70 3HD1 ILE 10 HD13 ILE 10 9.006 8.014 -2.405
71 H CYS 11 H CYS 11 5.457 5.825 -0.664
72 HA CYS 11 HA CYS 11 3.494 5.801 1.592
73 1HB CYS 11 HB2 CYS 11 3.845 3.293 0.155
74 2HB CYS 11 HB1 CYS 11 2.367 4.105 0.631
75 H SER 12 H SER 12 3.733 3.988 3.126
76 HA SER 12 HA SER 12 6.615 3.417 3.597
77 1HB SER 12 HB2 SER 12 5.273 2.500 5.817
78 2HB SER 12 HB1 SER 12 5.971 4.111 5.662
79 HG SER 12 HG SER 12 4.002 4.808 5.803
80 H LEU 13 H LEU 13 7.299 1.248 3.974
81 HA LEU 13 HA LEU 13 6.210 -0.763 2.350
82 1HB LEU 13 HB2 LEU 13 7.990 -0.784 4.766
83 2HB LEU 13 HB1 LEU 13 7.397 -2.316 4.132
84 HG LEU 13 HG LEU 13 9.667 -1.322 3.244
85 1HD1 LEU 13 HD11 LEU 13 8.400 -3.343 2.422
86 2HD1 LEU 13 HD12 LEU 13 9.334 -2.510 1.179
87 3HD1 LEU 13 HD13 LEU 13 7.587 -2.284 1.270
88 1HD2 LEU 13 HD21 LEU 13 9.389 0.098 1.268
89 2HD2 LEU 13 HD22 LEU 13 8.673 0.897 2.667
90 3HD2 LEU 13 HD23 LEU 13 7.640 0.096 1.484
91 H TYR 14 H TYR 14 5.121 0.366 5.435
92 HA TYR 14 HA TYR 14 3.563 -2.053 5.996
93 1HB TYR 14 HB2 TYR 14 4.600 -0.638 7.804
94 2HB TYR 14 HB1 TYR 14 3.442 0.627 7.391
95 HD1 TYR 14 HD1 TYR 14 3.040 -3.095 7.564
96 HD2 TYR 14 HD2 TYR 14 1.890 0.731 9.144
97 HE1 TYR 14 HE1 TYR 14 1.330 -4.196 8.987
98 HE2 TYR 14 HE2 TYR 14 0.179 -0.368 10.565
99 HH TYR 14 HH TYR 14 0.110 -3.210 11.490
100 H GLN 15 H GLN 15 2.999 1.184 4.768
101 HA GLN 15 HA GLN 15 0.135 1.018 4.860
102 1HB GLN 15 HB2 GLN 15 2.027 2.723 3.231
103 2HB GLN 15 HB1 GLN 15 0.273 2.874 3.113
104 1HG GLN 15 HG2 GLN 15 0.174 3.245 5.572
105 2HG GLN 15 HG1 GLN 15 1.936 3.201 5.624
106 1HE2 GLN 15 HE21 GLN 15 -0.515 5.386 5.632
107 2HE2 GLN 15 HE22 GLN 15 0.227 6.676 4.816
108 H LEU 16 H LEU 16 2.526 -0.122 2.487
109 HA LEU 16 HA LEU 16 0.404 -0.740 0.545
110 1HB LEU 16 HB2 LEU 16 3.116 -0.306 0.305
111 2HB LEU 16 HB1 LEU 16 3.002 -2.050 0.178
112 HG LEU 16 HG LEU 16 2.820 -0.746 -1.982
113 1HD1 LEU 16 HD11 LEU 16 2.141 -3.033 -1.983
114 2HD1 LEU 16 HD12 LEU 16 0.828 -2.144 -2.753
115 3HD1 LEU 16 HD13 LEU 16 0.677 -2.664 -1.074
116 1HD2 LEU 16 HD21 LEU 16 1.013 0.601 -2.433
117 2HD2 LEU 16 HD22 LEU 16 1.131 0.867 -0.694
118 3HD2 LEU 16 HD23 LEU 16 -0.046 -0.280 -1.333
119 H GLU 17 H GLU 17 2.189 -2.266 3.121
120 HA GLU 17 HA GLU 17 1.242 -4.962 2.441
121 1HB GLU 17 HB2 GLU 17 3.427 -4.478 3.662
122 2HB GLU 17 HB1 GLU 17 2.447 -4.017 5.055
123 1HG GLU 17 HG2 GLU 17 1.372 -6.464 4.265
124 2HG GLU 17 HG1 GLU 17 3.112 -6.680 4.066
125 H ASN 18 H ASN 18 -0.317 -2.315 3.397
126 HA ASN 18 HA ASN 18 -2.009 -3.684 5.428
127 1HB ASN 18 HB2 ASN 18 -1.285 -0.896 4.859
128 2HB ASN 18 HB1 ASN 18 -3.017 -1.122 5.100
129 1HD2 ASN 18 HD21 ASN 18 -3.671 -1.090 7.256
130 2HD2 ASN 18 HD22 ASN 18 -2.669 -1.430 8.584
131 H TYR 19 H TYR 19 -1.838 -3.368 2.138
132 HA TYR 19 HA TYR 19 -4.812 -3.349 1.854
133 1HB TYR 19 HB2 TYR 19 -2.600 -2.345 0.103
134 2HB TYR 19 HB1 TYR 19 -4.095 -2.904 -0.648
135 HD1 TYR 19 HD1 TYR 19 -3.393 -1.079 2.559
136 HD2 TYR 19 HD2 TYR 19 -5.410 -1.067 -1.235
137 HE1 TYR 19 HE1 TYR 19 -4.503 1.057 3.156
138 HE2 TYR 19 HE2 TYR 19 -6.521 1.069 -0.639
139 HH TYR 19 HH TYR 19 -6.238 2.445 2.590
140 H CYS 20 H CYS 20 -3.150 -5.678 2.568
141 HA CYS 20 HA CYS 20 -3.443 -7.309 0.090
142 1HB CYS 20 HB2 CYS 20 -1.905 -7.924 2.626
143 2HB CYS 20 HB1 CYS 20 -1.952 -8.931 1.185
144 H ASN 21 H ASN 21 -4.702 -9.225 0.169
145 HA ASN 21 HA ASN 21 -6.915 -9.199 2.011
146 1HB ASN 21 HB2 ASN 21 -6.203 -10.567 -0.381
147 2HB ASN 21 HB1 ASN 21 -6.591 -11.793 0.827
148 1HD2 ASN 21 HD21 ASN 21 -8.006 -9.778 -1.478
149 2HD2 ASN 21 HD22 ASN 21 -9.591 -9.766 -0.871
150 1H PHE 1 HT1 PHE 1 13.769 0.960 4.027
151 2H PHE 1 HT2 PHE 1 14.206 0.185 2.582
152 3H PHE 1 HT3 PHE 1 13.810 -0.733 3.956
153 HA PHE 1 HA PHE 1 11.811 -0.903 2.975
154 1HB PHE 1 HB2 PHE 1 11.446 1.978 3.786
155 2HB PHE 1 HB1 PHE 1 10.292 0.650 3.896
156 HD1 PHE 1 HD1 PHE 1 12.191 2.696 5.875
157 HD2 PHE 1 HD2 PHE 1 11.511 -1.497 5.222
158 HE1 PHE 1 HE1 PHE 1 12.959 2.211 8.183
159 HE2 PHE 1 HE2 PHE 1 12.278 -1.981 7.531
160 HZ PHE 1 HZ PHE 1 13.001 -0.127 9.012
161 H VAL 2 H VAL 2 11.173 -0.899 0.882
162 HA VAL 2 HA VAL 2 12.257 1.005 -1.019
163 HB VAL 2 HB VAL 2 9.916 -0.798 -1.596
164 1HG1 VAL 2 HG11 VAL 2 12.298 0.274 -3.115
165 2HG1 VAL 2 HG12 VAL 2 10.587 0.532 -3.453
166 3HG1 VAL 2 HG13 VAL 2 11.313 -1.052 -3.732
167 1HG2 VAL 2 HG21 VAL 2 11.909 -2.456 -2.167
168 2HG2 VAL 2 HG22 VAL 2 11.234 -2.398 -0.539
169 3HG2 VAL 2 HG23 VAL 2 12.736 -1.547 -0.900
170 H ASN 3 H ASN 3 11.156 2.720 0.617
171 HA ASN 3 HA ASN 3 8.387 3.285 0.470
172 1HB ASN 3 HB2 ASN 3 9.153 5.700 0.856
173 2HB ASN 3 HB1 ASN 3 9.701 4.512 2.038
174 1HD2 ASN 3 HD21 ASN 3 11.701 5.541 2.591
175 2HD2 ASN 3 HD22 ASN 3 12.967 5.745 1.479
176 H GLN 4 H GLN 4 7.833 2.750 -1.761
177 HA GLN 4 HA GLN 4 8.798 4.692 -3.797
178 1HB GLN 4 HB2 GLN 4 8.587 2.026 -4.017
179 2HB GLN 4 HB1 GLN 4 6.956 2.466 -4.528
180 1HG GLN 4 HG2 GLN 4 7.995 4.108 -6.141
181 2HG GLN 4 HG1 GLN 4 9.567 3.418 -5.732
182 1HE2 GLN 4 HE21 GLN 4 10.186 1.907 -7.280
183 2HE2 GLN 4 HE22 GLN 4 9.135 0.833 -8.072
184 H HIS 5 H HIS 5 7.252 5.767 -5.175
185 HA HIS 5 HA HIS 5 4.637 6.261 -3.819
186 1HB HIS 5 HB2 HIS 5 4.807 8.480 -4.460
187 2HB HIS 5 HB1 HIS 5 6.519 8.089 -4.424
188 HD2 HIS 5 HD2 HIS 5 7.728 7.756 -6.999
189 HE1 HIS 5 HE1 HIS 5 4.414 9.283 -9.136
190 HE2 HIS 5 HE2 HIS 5 6.865 8.596 -9.305
191 H LEU 6 H LEU 6 2.866 5.322 -4.865
192 HA LEU 6 HA LEU 6 3.029 5.121 -7.807
193 1HB LEU 6 HB2 LEU 6 1.619 2.889 -7.218
194 2HB LEU 6 HB1 LEU 6 3.296 2.952 -7.731
195 HG LEU 6 HG LEU 6 2.950 1.629 -5.748
196 1HD1 LEU 6 HD11 LEU 6 4.933 3.437 -6.207
197 2HD1 LEU 6 HD12 LEU 6 4.975 2.179 -4.970
198 3HD1 LEU 6 HD13 LEU 6 4.450 3.811 -4.554
199 1HD2 LEU 6 HD21 LEU 6 2.625 3.687 -3.821
200 2HD2 LEU 6 HD22 LEU 6 1.582 2.296 -4.127
201 3HD2 LEU 6 HD23 LEU 6 1.328 3.802 -5.010
202 H CYS 7 H CYS 7 0.951 4.937 -8.936
203 HA CYS 7 HA CYS 7 -1.380 5.701 -7.239
204 1HB CYS 7 HB2 CYS 7 -1.641 6.858 -9.869
205 2HB CYS 7 HB1 CYS 7 -1.675 7.655 -8.304
206 H GLY 8 H GLY 8 -1.248 5.333 -10.784
207 1HA GLY 8 HA2 GLY 8 -3.576 3.678 -10.838
208 2HA GLY 8 HA1 GLY 8 -2.462 3.891 -12.185
209 H SER 9 H SER 9 -2.010 1.834 -12.877
210 HA SER 9 HA SER 9 -2.067 -0.564 -11.483
211 1HB SER 9 HB2 SER 9 0.195 -0.892 -13.048
212 2HB SER 9 HB1 SER 9 -1.461 -1.127 -13.602
213 HG SER 9 HG SER 9 -0.156 0.374 -14.861
214 H ASP 10 H ASP 10 0.300 1.979 -11.375
215 HA ASP 10 HA ASP 10 2.466 0.757 -10.069
216 1HB ASP 10 HB2 ASP 10 1.651 3.340 -10.717
217 2HB ASP 10 HB1 ASP 10 1.794 3.369 -8.975
218 H LEU 11 H LEU 11 -0.683 1.756 -8.752
219 HA LEU 11 HA LEU 11 0.036 1.088 -6.002
220 1HB LEU 11 HB2 LEU 11 -2.340 1.977 -7.430
221 2HB LEU 11 HB1 LEU 11 -2.748 0.566 -6.485
222 HG LEU 11 HG LEU 11 -3.078 1.983 -4.776
223 1HD1 LEU 11 HD11 LEU 11 -0.161 2.690 -4.774
224 2HD1 LEU 11 HD12 LEU 11 -0.720 1.094 -4.288
225 3HD1 LEU 11 HD13 LEU 11 -1.249 2.524 -3.401
226 1HD2 LEU 11 HD21 LEU 11 -1.420 4.060 -6.215
227 2HD2 LEU 11 HD22 LEU 11 -2.579 4.343 -4.915
228 3HD2 LEU 11 HD23 LEU 11 -3.141 3.788 -6.491
229 1HN ABA 12 H ABA 12 -1.863 -0.407 -8.573
230 HA ABA 12 HA ABA 12 -2.393 -2.926 -7.449
231 1HB ABA 12 HB1 ABA 12 -1.662 -2.851 -10.342
232 2HB ABA 12 HB2 ABA 12 -2.984 -1.807 -9.829
233 1HG ABA 12 HG1 ABA 12 -3.068 -4.588 -10.337
234 2HG ABA 12 HG2 ABA 12 -4.374 -3.544 -9.772
235 3HG ABA 12 HG3 ABA 12 -3.330 -4.360 -8.608
236 H GLU 13 H GLU 13 0.638 -1.625 -8.453
237 HA GLU 13 HA GLU 13 1.856 -4.264 -8.858
238 1HB GLU 13 HB2 GLU 13 2.608 -1.500 -9.370
239 2HB GLU 13 HB1 GLU 13 3.914 -2.425 -8.650
240 1HG GLU 13 HG2 GLU 13 3.946 -3.989 -10.408
241 2HG GLU 13 HG1 GLU 13 2.324 -3.552 -10.942
242 H ALA 14 H ALA 14 2.684 -1.547 -6.644
243 HA ALA 14 HA ALA 14 4.390 -2.936 -4.941
244 1HB ALA 14 HB1 ALA 14 2.268 -1.193 -3.718
245 2HB ALA 14 HB2 ALA 14 3.443 -0.472 -4.817
246 3HB ALA 14 HB3 ALA 14 3.988 -1.275 -3.345
247 H LEU 15 H LEU 15 0.881 -2.884 -4.975
248 HA LEU 15 HA LEU 15 0.419 -4.668 -2.775
249 1HB LEU 15 HB2 LEU 15 -1.190 -4.322 -5.326
250 2HB LEU 15 HB1 LEU 15 -1.800 -5.042 -3.840
251 HG LEU 15 HG LEU 15 -0.882 -2.162 -4.247
252 1HD1 LEU 15 HD11 LEU 15 -3.104 -1.557 -4.302
253 2HD1 LEU 15 HD12 LEU 15 -3.621 -2.966 -3.374
254 3HD1 LEU 15 HD13 LEU 15 -3.189 -3.138 -5.076
255 1HD2 LEU 15 HD21 LEU 15 -2.347 -2.779 -1.777
256 2HD2 LEU 15 HD22 LEU 15 -0.906 -1.793 -2.012
257 3HD2 LEU 15 HD23 LEU 15 -0.758 -3.543 -1.854
258 H TYR 16 H TYR 16 0.831 -5.169 -6.265
259 HA TYR 16 HA TYR 16 0.559 -8.064 -6.093
260 1HB TYR 16 HB2 TYR 16 1.004 -6.024 -8.156
261 2HB TYR 16 HB1 TYR 16 1.859 -7.529 -8.463
262 HD1 TYR 16 HD1 TYR 16 -0.784 -6.051 -9.670
263 HD2 TYR 16 HD2 TYR 16 0.008 -9.512 -7.250
264 HE1 TYR 16 HE1 TYR 16 -2.892 -7.084 -10.468
265 HE2 TYR 16 HE2 TYR 16 -2.103 -10.548 -8.047
266 HH TYR 16 HH TYR 16 -3.743 -9.565 -10.707
267 H LEU 17 H LEU 17 3.175 -5.797 -5.708
268 HA LEU 17 HA LEU 17 5.181 -7.979 -6.028
269 1HB LEU 17 HB2 LEU 17 5.217 -5.026 -6.189
270 2HB LEU 17 HB1 LEU 17 6.645 -5.776 -5.476
271 HG LEU 17 HG LEU 17 6.631 -5.458 -8.036
272 1HD1 LEU 17 HD11 LEU 17 7.382 -7.831 -6.439
273 2HD1 LEU 17 HD12 LEU 17 8.381 -6.803 -7.466
274 3HD1 LEU 17 HD13 LEU 17 7.377 -8.060 -8.188
275 1HD2 LEU 17 HD21 LEU 17 4.202 -6.563 -7.987
276 2HD2 LEU 17 HD22 LEU 17 5.145 -8.045 -8.145
277 3HD2 LEU 17 HD23 LEU 17 5.280 -6.780 -9.366
278 H VAL 18 H VAL 18 3.514 -6.124 -3.646
279 HA VAL 18 HA VAL 18 5.547 -6.553 -1.576
280 HB VAL 18 HB VAL 18 2.764 -5.383 -1.604
281 1HG1 VAL 18 HG11 VAL 18 2.855 -6.378 0.536
282 2HG1 VAL 18 HG12 VAL 18 3.457 -4.746 0.826
283 3HG1 VAL 18 HG13 VAL 18 4.588 -6.093 0.691
284 1HG2 VAL 18 HG21 VAL 18 5.443 -4.376 -1.930
285 2HG2 VAL 18 HG22 VAL 18 4.735 -3.683 -0.471
286 3HG2 VAL 18 HG23 VAL 18 3.920 -3.493 -2.021
287 H CYS 19 H CYS 19 2.224 -7.749 -2.223
288 HA CYS 19 HA CYS 19 2.805 -9.966 -0.308
289 1HB CYS 19 HB2 CYS 19 0.162 -8.792 -1.221
290 2HB CYS 19 HB1 CYS 19 0.326 -10.195 -0.170
291 H GLY 20 H GLY 20 0.393 -9.705 -2.906
292 1HA GLY 20 HA2 GLY 20 0.339 -10.904 -4.967
293 2HA GLY 20 HA1 GLY 20 1.791 -11.770 -4.473
294 H GLU 21 H GLU 21 1.464 -13.397 -2.658
295 HA GLU 21 HA GLU 21 -0.802 -15.075 -3.338
296 1HB GLU 21 HB2 GLU 21 0.128 -16.629 -1.658
297 2HB GLU 21 HB1 GLU 21 1.370 -16.061 -2.774
298 1HG GLU 21 HG2 GLU 21 2.187 -14.464 -1.154
299 2HG GLU 21 HG1 GLU 21 0.844 -14.813 -0.065
300 H ARG 22 H ARG 22 -0.678 -12.417 -1.339
301 HA ARG 22 HA ARG 22 -2.593 -13.593 0.616
302 1HB ARG 22 HB2 ARG 22 -1.081 -10.983 0.554
303 2HB ARG 22 HB1 ARG 22 -2.416 -11.253 1.666
304 1HG ARG 22 HG2 ARG 22 -0.831 -13.552 1.893
305 2HG ARG 22 HG1 ARG 22 0.319 -12.215 1.832
306 1HD ARG 22 HD2 ARG 22 -0.148 -12.169 4.085
307 2HD ARG 22 HD1 ARG 22 -1.454 -11.128 3.519
308 HE ARG 22 HE ARG 22 -2.878 -13.257 3.525
309 1HH1 ARG 22 HH21 ARG 22 0.026 -14.308 4.601
310 2HH1 ARG 22 HH22 ARG 22 -0.491 -14.809 6.176
311 1HH2 ARG 22 HH11 ARG 22 -3.601 -13.291 5.927
312 2HH2 ARG 22 HH12 ARG 22 -2.546 -14.234 6.927
313 H GLY 23 H GLY 23 -2.384 -11.557 -2.158
314 1HA GLY 23 HA2 GLY 23 -4.253 -10.987 -3.531
315 2HA GLY 23 HA1 GLY 23 -5.327 -11.347 -2.191
316 H PHE 24 H PHE 24 -5.523 -8.935 -3.753
317 HA PHE 24 HA PHE 24 -5.221 -7.007 -1.531
318 1HB PHE 24 HB2 PHE 24 -4.194 -5.283 -2.911
319 2HB PHE 24 HB1 PHE 24 -3.162 -6.704 -2.909
320 HD1 PHE 24 HD1 PHE 24 -4.723 -4.288 -4.984
321 HD2 PHE 24 HD2 PHE 24 -3.643 -8.449 -4.861
322 HE1 PHE 24 HE1 PHE 24 -4.862 -4.406 -7.445
323 HE2 PHE 24 HE2 PHE 24 -3.786 -8.562 -7.319
324 HZ PHE 24 HZ PHE 24 -4.388 -6.530 -8.624
325 H PHE 25 H PHE 25 -6.740 -5.199 -1.765
326 HA PHE 25 HA PHE 25 -8.979 -5.940 -3.573
327 1HB PHE 25 HB2 PHE 25 -9.721 -3.793 -1.847
328 2HB PHE 25 HB1 PHE 25 -10.305 -5.454 -1.841
329 HD1 PHE 25 HD1 PHE 25 -8.216 -3.005 -0.178
330 HD2 PHE 25 HD2 PHE 25 -9.027 -7.210 -0.535
331 HE1 PHE 25 HE1 PHE 25 -7.034 -3.414 1.964
332 HE2 PHE 25 HE2 PHE 25 -7.845 -7.620 1.608
333 HZ PHE 25 HZ PHE 25 -6.848 -5.722 2.857
334 H TYR 26 H TYR 26 -8.258 -2.745 -2.298
335 HA TYR 26 HA TYR 26 -7.603 -0.759 -3.444
336 1HB TYR 26 HB2 TYR 26 -6.507 -2.055 -5.257
337 2HB TYR 26 HB1 TYR 26 -8.080 -2.323 -6.002
338 HD1 TYR 26 HD1 TYR 26 -7.735 0.873 -4.336
339 HD2 TYR 26 HD2 TYR 26 -7.052 -1.202 -8.041
340 HE1 TYR 26 HE1 TYR 26 -7.598 3.042 -5.532
341 HE2 TYR 26 HE2 TYR 26 -6.915 0.969 -9.231
342 HH TYR 26 HH TYR 26 -7.842 3.363 -8.800
343 H THR 27 H THR 27 -9.479 0.192 -2.590
344 HA THR 27 HA THR 27 -12.021 -0.151 -4.072
345 HB THR 27 HB THR 27 -12.912 1.346 -2.226
346 HG1 THR 27 HG1 THR 27 -10.489 0.802 -0.918
347 1HG2 THR 27 HG21 THR 27 -13.340 -0.532 -1.039
348 2HG2 THR 27 HG22 THR 27 -11.628 -0.829 -0.733
349 3HG2 THR 27 HG23 THR 27 -12.357 -1.357 -2.250
350 H LYS 28 H LYS 28 -13.262 2.148 -4.136
351 HA LYS 28 HA LYS 28 -11.366 4.118 -5.352
352 1HB LYS 28 HB2 LYS 28 -14.104 3.246 -6.316
353 2HB LYS 28 HB1 LYS 28 -13.277 4.681 -6.922
354 1HG LYS 28 HG2 LYS 28 -11.363 2.623 -7.031
355 2HG LYS 28 HG1 LYS 28 -12.858 1.903 -7.630
356 1HD LYS 28 HD2 LYS 28 -13.130 3.848 -9.173
357 2HD LYS 28 HD1 LYS 28 -11.566 4.457 -8.631
358 1HE LYS 28 HE2 LYS 28 -10.404 2.600 -9.548
359 2HE LYS 28 HE1 LYS 28 -11.887 1.666 -9.739
360 1HZ LYS 28 HZ1 LYS 28 -11.282 4.184 -11.191
361 2HZ LYS 28 HZ2 LYS 28 -12.627 3.173 -11.429
362 3HZ LYS 28 HZ3 LYS 28 -11.068 2.630 -11.835
363 HA PRO 29 HA PRO 29 -13.720 6.249 -2.063
364 1HB PRO 29 HB2 PRO 29 -11.549 7.679 -1.170
365 2HB PRO 29 HB1 PRO 29 -11.952 6.052 -0.595
366 1HG PRO 29 HG2 PRO 29 -9.788 6.899 -2.466
367 2HG PRO 29 HG1 PRO 29 -9.856 5.491 -1.394
368 1HD PRO 29 HD2 PRO 29 -10.318 5.466 -4.185
369 2HD PRO 29 HD1 PRO 29 -10.714 4.157 -3.049
370 H THR 30 H THR 30 -13.587 8.803 -1.636
371 HA THR 30 HA THR 30 -14.228 10.111 -4.095
372 HB THR 30 HB THR 30 -13.527 12.123 -2.272
373 HG1 THR 30 HG1 THR 30 -14.052 11.380 -0.326
374 1HG2 THR 30 HG21 THR 30 -15.552 12.375 -3.382
375 2HG2 THR 30 HG22 THR 30 -16.108 11.893 -1.779
376 3HG2 THR 30 HG23 THR 30 -16.041 10.708 -3.082