Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
23270 | 2jum RC | 15450 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 1H GLY 1 -0.005 0.539 9.734
2 H2 GLY 1 2H GLY 1 0.541 -0.544 10.923
3 H3 GLY 1 3H GLY 1 -0.493 0.736 11.348
4 HA2 GLY 1 1HA GLY 1 -1.203 -1.767 10.144
5 HA3 GLY 1 2HA GLY 1 -2.154 -0.781 11.297
6 H ILE 2 H ILE 2 -0.292 -0.869 8.121
7 HA ILE 2 HA ILE 2 -2.654 -0.266 6.522
8 HB ILE 2 HB ILE 2 -0.409 0.534 5.859
9 HG12 ILE 2 2HG1 ILE 2 -0.417 -0.705 3.488
10 HG13 ILE 2 1HG1 ILE 2 -1.948 -1.345 4.074
11 HG21 ILE 2 1HG2 ILE 2 0.156 -2.392 5.919
12 HG22 ILE 2 2HG2 ILE 2 1.108 -1.049 6.551
13 HG23 ILE 2 3HG2 ILE 2 1.059 -1.354 4.815
14 HD11 ILE 2 3HD1 ILE 2 -1.708 1.010 2.718
15 HD12 ILE 2 1HD1 ILE 2 -1.611 1.589 4.381
16 HD13 ILE 2 2HD1 ILE 2 -3.016 0.666 3.848
17 H THR 3 H THR 3 -0.957 -3.147 7.534
18 HA THR 3 HA THR 3 -2.140 -4.867 5.504
19 HB THR 3 HB THR 3 -0.877 -5.575 8.168
20 HG1 THR 3 HG1 THR 3 0.806 -4.903 7.103
21 HG21 THR 3 3HG2 THR 3 -2.301 -7.143 6.238
22 HG22 THR 3 1HG2 THR 3 -1.505 -7.682 7.716
23 HG23 THR 3 2HG2 THR 3 -0.601 -7.613 6.203
24 H GLU 4 H GLU 4 -3.020 -3.716 8.667
25 HA GLU 4 HA GLU 4 -5.294 -5.615 8.831
26 HB2 GLU 4 2HB GLU 4 -3.913 -5.092 10.867
27 HB3 GLU 4 1HB GLU 4 -4.492 -3.428 10.774
28 HG2 GLU 4 2HG GLU 4 -6.438 -3.985 11.761
29 HG3 GLU 4 1HG GLU 4 -6.712 -5.277 10.592
30 H GLN 5 H GLN 5 -5.411 -3.827 6.675
31 HA GLN 5 HA GLN 5 -7.993 -2.627 7.084
32 HB2 GLN 5 2HB GLN 5 -6.374 -0.995 8.261
33 HB3 GLN 5 1HB GLN 5 -5.798 -0.594 6.643
34 HG2 GLN 5 2HG GLN 5 -8.686 -0.603 6.681
35 HG3 GLN 5 1HG GLN 5 -8.069 0.457 7.948
36 HE21 GLN 5 1HE2 GLN 5 -9.133 0.725 4.901
37 HE22 GLN 5 2HE2 GLN 5 -8.086 1.914 4.293
38 H CYS 6 H CYS 6 -4.980 -2.462 5.178
39 HA CYS 6 HA CYS 6 -6.521 -2.001 2.717
40 HB2 CYS 6 2HB CYS 6 -3.696 -1.847 3.517
41 HB3 CYS 6 1HB CYS 6 -3.947 -2.510 1.901
42 H CYS 7 H CYS 7 -5.865 -4.655 4.557
43 HA CYS 7 HA CYS 7 -5.839 -6.424 2.153
44 HB2 CYS 7 2HB CYS 7 -3.865 -6.810 3.431
45 HB3 CYS 7 1HB CYS 7 -4.756 -6.843 4.943
46 H THR 8 H THR 8 -7.884 -5.119 4.321
47 HA THR 8 HA THR 8 -9.565 -7.581 4.529
48 HB THR 8 HB THR 8 -9.029 -6.349 6.673
49 HG1 THR 8 HG1 THR 8 -10.972 -6.823 7.366
50 HG21 THR 8 3HG2 THR 8 -10.104 -4.184 7.053
51 HG22 THR 8 1HG2 THR 8 -10.756 -4.200 5.414
52 HG23 THR 8 2HG2 THR 8 -9.016 -4.076 5.670
53 H SER 9 H SER 9 -9.168 -4.535 3.026
54 HA SER 9 HA SER 9 -11.653 -4.911 1.487
55 HG SER 9 HG SER 9 -11.095 -1.999 4.080
56 HB2 SER 9 2HB SER 9 -12.376 -2.567 1.874
57 HB3 SER 9 1HB SER 9 -12.382 -3.494 3.371
58 H ILE 10 H ILE 10 -11.574 -2.509 0.058
59 HA ILE 10 HA ILE 10 -8.896 -2.747 -1.231
60 HB ILE 10 HB ILE 10 -11.534 -1.712 -2.297
61 HG12 ILE 10 2HG1 ILE 10 -9.884 -4.084 -3.195
62 HG13 ILE 10 1HG1 ILE 10 -11.128 -4.225 -1.951
63 HG21 ILE 10 1HG2 ILE 10 -10.403 -0.746 -3.994
64 HG22 ILE 10 2HG2 ILE 10 -9.495 -2.231 -4.278
65 HG23 ILE 10 3HG2 ILE 10 -8.906 -1.047 -3.111
66 HD11 ILE 10 3HD1 ILE 10 -11.449 -4.157 -4.798
67 HD12 ILE 10 1HD1 ILE 10 -12.257 -2.753 -4.098
68 HD13 ILE 10 2HD1 ILE 10 -12.683 -4.377 -3.556
69 H CYS 11 H CYS 11 -7.640 -0.886 -1.605
70 HA CYS 11 HA CYS 11 -8.523 1.522 -0.075
71 HB2 CYS 11 2HB CYS 11 -5.668 1.183 -0.868
72 HB3 CYS 11 1HB CYS 11 -6.349 1.841 0.618
73 H SER 12 H SER 12 -6.508 3.246 -1.168
74 HA SER 12 HA SER 12 -7.160 3.378 -4.066
75 HG SER 12 HG SER 12 -8.772 6.004 -1.541
76 HB2 SER 12 2HB SER 12 -7.404 6.000 -3.382
77 HB3 SER 12 1HB SER 12 -8.771 4.905 -3.556
78 H LEU 13 H LEU 13 -5.339 3.788 -5.172
79 HA LEU 13 HA LEU 13 -2.777 4.110 -4.180
80 HG LEU 13 HG LEU 13 -2.029 5.714 -7.651
81 HB2 LEU 13 2HB LEU 13 -2.702 3.828 -6.434
82 HB3 LEU 13 1HB LEU 13 -4.167 4.745 -6.706
83 HD11 LEU 13 1HD1 LEU 13 -3.203 7.621 -7.686
84 HD12 LEU 13 2HD1 LEU 13 -2.867 7.900 -5.977
85 HD13 LEU 13 3HD1 LEU 13 -4.262 6.931 -6.455
86 HD21 LEU 13 3HD2 LEU 13 -0.267 6.015 -6.317
87 HD22 LEU 13 1HD2 LEU 13 -1.206 5.473 -4.926
88 HD23 LEU 13 2HD2 LEU 13 -1.201 7.177 -5.379
89 H TYR 14 H TYR 14 -5.223 6.592 -4.668
90 HA TYR 14 HA TYR 14 -3.772 8.941 -4.259
91 HD1 TYR 14 HD2 TYR 14 -3.996 10.736 -2.755
92 HD2 TYR 14 HD1 TYR 14 -7.582 10.253 -5.076
93 HE1 TYR 14 HE2 TYR 14 -3.977 13.158 -3.291
94 HE2 TYR 14 HE1 TYR 14 -7.560 12.676 -5.612
95 HH TYR 14 HH TYR 14 -6.643 14.761 -4.654
96 HB2 TYR 14 2HB TYR 14 -6.442 8.345 -4.254
97 HB3 TYR 14 1HB TYR 14 -6.181 8.723 -2.552
98 H GLN 15 H GLN 15 -5.279 7.068 -1.680
99 HA GLN 15 HA GLN 15 -3.700 8.271 0.414
100 HB2 GLN 15 2HB GLN 15 -5.904 7.362 0.831
101 HB3 GLN 15 1HB GLN 15 -5.376 5.760 0.352
102 HG2 GLN 15 2HG GLN 15 -3.520 6.545 2.284
103 HG3 GLN 15 1HG GLN 15 -5.068 7.106 2.917
104 HE21 GLN 15 1HE2 GLN 15 -5.997 5.531 4.226
105 HE22 GLN 15 2HE2 GLN 15 -5.927 3.859 3.943
106 H LEU 16 H LEU 16 -3.706 5.123 -1.166
107 HA LEU 16 HA LEU 16 -1.722 3.728 0.129
108 HG LEU 16 HG LEU 16 -1.022 1.829 -0.911
109 HB2 LEU 16 2HB LEU 16 -2.883 3.647 -2.462
110 HB3 LEU 16 1HB LEU 16 -1.142 3.647 -2.701
111 HD11 LEU 16 1HD1 LEU 16 -3.644 0.804 -1.458
112 HD12 LEU 16 2HD1 LEU 16 -3.793 2.432 -0.797
113 HD13 LEU 16 3HD1 LEU 16 -2.921 1.192 0.104
114 HD21 LEU 16 3HD2 LEU 16 -0.766 0.513 -2.714
115 HD22 LEU 16 1HD2 LEU 16 -1.556 1.748 -3.692
116 HD23 LEU 16 2HD2 LEU 16 -2.513 0.463 -2.955
117 H GLU 17 H GLU 17 -1.350 6.624 -1.798
118 HA GLU 17 HA GLU 17 1.539 6.341 -2.047
119 HB2 GLU 17 2HB GLU 17 0.335 7.603 -3.716
120 HB3 GLU 17 1HB GLU 17 -0.296 8.702 -2.491
121 HG2 GLU 17 2HG GLU 17 2.053 9.364 -1.946
122 HG3 GLU 17 1HG GLU 17 2.612 8.342 -3.269
123 H ASN 18 H ASN 18 -0.579 7.706 0.347
124 HA ASN 18 HA ASN 18 1.395 9.432 1.561
125 HB2 ASN 18 2HB ASN 18 -1.307 9.072 1.889
126 HB3 ASN 18 1HB ASN 18 -0.663 8.344 3.358
127 HD21 ASN 18 1HD2 ASN 18 -0.935 11.370 1.545
128 HD22 ASN 18 2HD2 ASN 18 -0.381 12.376 2.795
129 H TYR 19 H TYR 19 1.412 6.109 1.317
130 HA TYR 19 HA TYR 19 2.567 5.797 4.042
131 HD1 TYR 19 HD2 TYR 19 1.438 4.169 5.693
132 HD2 TYR 19 HD1 TYR 19 -0.587 4.143 1.905
133 HE1 TYR 19 HE2 TYR 19 -0.744 4.336 6.857
134 HE2 TYR 19 HE1 TYR 19 -2.769 4.311 3.065
135 HH TYR 19 HH TYR 19 -3.010 5.031 6.427
136 HB2 TYR 19 2HB TYR 19 1.732 3.723 1.997
137 HB3 TYR 19 1HB TYR 19 2.519 3.342 3.528
138 H CYS 20 H CYS 20 3.975 7.176 1.779
139 HA CYS 20 HA CYS 20 6.205 5.238 1.373
140 HB2 CYS 20 2HB CYS 20 5.131 6.783 -0.494
141 HB3 CYS 20 1HB CYS 20 6.282 7.947 0.122
142 H ASN 21 H ASN 21 8.392 6.577 1.264
143 HA ASN 21 HA ASN 21 8.693 7.761 3.966
144 HB2 ASN 21 2HB ASN 21 10.243 5.957 3.348
145 HB3 ASN 21 1HB ASN 21 10.769 6.877 1.937
146 HD21 ASN 21 1HD2 ASN 21 12.755 6.218 3.747
147 HD22 ASN 21 2HD2 ASN 21 13.225 7.583 4.640
148 HA PHE 1 HA PHE 1 -6.616 0.994 -10.789
149 HD1 PHE 1 HD1 PHE 1 -4.208 2.284 -12.453
150 HD2 PHE 1 HD2 PHE 1 -5.154 3.013 -8.325
151 HE1 PHE 1 HE1 PHE 1 -1.907 1.613 -11.808
152 HE2 PHE 1 HE2 PHE 1 -2.854 2.343 -7.680
153 HZ PHE 1 HZ PHE 1 -1.231 1.643 -9.421
154 H1 PHE 1 1H PHE 1 -7.891 1.631 -13.141
155 H2 PHE 1 2H PHE 1 -6.378 0.876 -12.974
156 H3 PHE 1 3H PHE 1 -6.474 2.563 -13.152
157 HB2 PHE 1 2HB PHE 1 -6.178 3.812 -11.641
158 HB3 PHE 1 1HB PHE 1 -6.718 3.566 -9.980
159 H VAL 2 H VAL 2 -8.861 0.109 -11.101
160 HA VAL 2 HA VAL 2 -10.852 2.041 -10.011
161 HB VAL 2 HB VAL 2 -12.560 0.692 -11.397
162 HG11 VAL 2 1HG1 VAL 2 -10.838 2.097 -13.337
163 HG12 VAL 2 2HG1 VAL 2 -11.184 3.018 -11.873
164 HG13 VAL 2 3HG1 VAL 2 -12.508 2.423 -12.874
165 HG21 VAL 2 3HG2 VAL 2 -10.172 0.124 -13.144
166 HG22 VAL 2 1HG2 VAL 2 -11.772 -0.620 -13.183
167 HG23 VAL 2 2HG2 VAL 2 -10.642 -1.024 -11.890
168 H ASN 3 H ASN 3 -9.168 0.090 -8.762
169 HA ASN 3 HA ASN 3 -10.598 -0.978 -6.719
170 HB2 ASN 3 2HB ASN 3 -11.214 -2.445 -9.199
171 HB3 ASN 3 1HB ASN 3 -10.824 -3.462 -7.818
172 HD21 ASN 3 1HD2 ASN 3 -11.885 -1.889 -5.713
173 HD22 ASN 3 2HD2 ASN 3 -13.569 -1.779 -5.895
174 H GLN 4 H GLN 4 -8.719 -1.181 -5.585
175 HA GLN 4 HA GLN 4 -6.686 -3.056 -6.678
176 HB2 GLN 4 2HB GLN 4 -5.462 -1.114 -6.781
177 HB3 GLN 4 1HB GLN 4 -6.431 -0.318 -5.546
178 HG2 GLN 4 2HG GLN 4 -4.649 -2.602 -4.757
179 HG3 GLN 4 1HG GLN 4 -3.943 -1.008 -5.022
180 HE21 GLN 4 1HE2 GLN 4 -4.802 -2.795 -2.499
181 HE22 GLN 4 2HE2 GLN 4 -5.504 -1.631 -1.481
182 H HIS 5 H HIS 5 -6.299 -4.779 -5.420
183 HA HIS 5 HA HIS 5 -7.243 -4.744 -2.590
184 HD2 HIS 5 HD2 HIS 5 -9.873 -5.676 -4.336
185 HE1 HIS 5 HE1 HIS 5 -8.452 -7.234 -8.000
186 HE2 HIS 5 HE2 HIS 5 -10.423 -6.099 -6.843
187 HB2 HIS 5 2HB HIS 5 -6.271 -7.280 -3.793
188 HB3 HIS 5 1HB HIS 5 -7.695 -6.987 -2.797
189 H LEU 6 H LEU 6 -5.656 -4.481 -1.060
190 HA LEU 6 HA LEU 6 -2.868 -5.193 -1.853
191 HG LEU 6 HG LEU 6 -2.989 -2.092 -2.226
192 HB2 LEU 6 2HB LEU 6 -4.042 -2.928 -0.338
193 HB3 LEU 6 1HB LEU 6 -2.571 -3.582 0.338
194 HD11 LEU 6 1HD1 LEU 6 -0.365 -2.041 -0.990
195 HD12 LEU 6 2HD1 LEU 6 -1.635 -1.717 0.192
196 HD13 LEU 6 3HD1 LEU 6 -1.504 -0.722 -1.257
197 HD21 LEU 6 3HD2 LEU 6 -1.305 -4.537 -1.973
198 HD22 LEU 6 1HD2 LEU 6 -0.508 -3.130 -2.662
199 HD23 LEU 6 2HD2 LEU 6 -1.966 -3.773 -3.414
200 H CYS 7 H CYS 7 -1.659 -6.524 -0.567
201 HA CYS 7 HA CYS 7 -2.147 -7.067 2.170
202 HB2 CYS 7 2HB CYS 7 -4.281 -8.031 1.134
203 HB3 CYS 7 1HB CYS 7 -3.255 -9.262 0.398
204 H GLY 8 H GLY 8 -0.176 -7.802 2.777
205 HA2 GLY 8 2HA GLY 8 1.928 -8.835 2.675
206 HA3 GLY 8 1HA GLY 8 1.082 -10.136 1.841
207 H SER 9 H SER 9 2.434 -10.604 0.172
208 HA SER 9 HA SER 9 4.240 -9.091 -1.219
209 HG SER 9 HG SER 9 3.697 -10.882 -4.156
210 HB2 SER 9 2HB SER 9 3.689 -11.504 -1.661
211 HB3 SER 9 1HB SER 9 2.291 -10.965 -2.587
212 H ASP 10 H ASP 10 0.764 -9.270 -2.103
213 HA ASP 10 HA ASP 10 0.926 -7.377 -4.223
214 HB2 ASP 10 2HB ASP 10 -1.341 -8.221 -2.409
215 HB3 ASP 10 1HB ASP 10 -1.561 -7.087 -3.737
216 H LEU 11 H LEU 11 0.658 -6.976 -0.745
217 HA LEU 11 HA LEU 11 -0.199 -4.279 -0.603
218 HG LEU 11 HG LEU 11 2.064 -3.554 1.864
219 HB2 LEU 11 2HB LEU 11 0.044 -5.717 1.378
220 HB3 LEU 11 1HB LEU 11 1.789 -5.750 1.153
221 HD11 LEU 11 1HD1 LEU 11 -0.105 -2.063 2.028
222 HD12 LEU 11 2HD1 LEU 11 -0.722 -3.195 0.824
223 HD13 LEU 11 3HD1 LEU 11 0.727 -2.246 0.484
224 HD21 LEU 11 3HD2 LEU 11 0.958 -3.387 3.927
225 HD22 LEU 11 1HD2 LEU 11 0.892 -5.114 3.576
226 HD23 LEU 11 2HD2 LEU 11 -0.524 -4.102 3.291
227 H VAL 12 H VAL 12 3.134 -5.554 -0.831
228 HA VAL 12 HA VAL 12 4.317 -2.929 -0.991
229 HB VAL 12 HB VAL 12 6.320 -4.210 -1.852
230 HG11 VAL 12 1HG1 VAL 12 5.014 -4.324 0.711
231 HG12 VAL 12 2HG1 VAL 12 6.743 -4.331 0.358
232 HG13 VAL 12 3HG1 VAL 12 5.847 -5.850 0.418
233 HG21 VAL 12 3HG2 VAL 12 4.801 -5.992 -2.909
234 HG22 VAL 12 1HG2 VAL 12 4.625 -6.647 -1.281
235 HG23 VAL 12 2HG2 VAL 12 6.216 -6.585 -2.038
236 H GLU 13 H GLU 13 3.049 -5.197 -3.374
237 HA GLU 13 HA GLU 13 4.168 -4.077 -5.717
238 HB2 GLU 13 2HB GLU 13 2.654 -6.162 -5.447
239 HB3 GLU 13 1HB GLU 13 1.309 -5.030 -5.594
240 HG2 GLU 13 2HG GLU 13 3.133 -4.351 -7.644
241 HG3 GLU 13 1HG GLU 13 2.994 -6.109 -7.672
242 H ALA 14 H ALA 14 1.004 -3.289 -4.223
243 HA ALA 14 HA ALA 14 0.463 -1.062 -5.927
244 HB1 ALA 14 3HB ALA 14 -1.300 -0.537 -4.419
245 HB2 ALA 14 1HB ALA 14 -0.467 -1.301 -3.064
246 HB3 ALA 14 2HB ALA 14 -1.146 -2.290 -4.357
247 H LEU 15 H LEU 15 1.844 -1.208 -2.653
248 HA LEU 15 HA LEU 15 2.376 1.601 -2.415
249 HG LEU 15 HG LEU 15 1.522 -0.817 -0.465
250 HB2 LEU 15 2HB LEU 15 3.829 -0.761 -1.162
251 HB3 LEU 15 1HB LEU 15 4.003 0.915 -0.656
252 HD11 LEU 15 1HD1 LEU 15 1.774 -0.246 1.935
253 HD12 LEU 15 2HD1 LEU 15 3.236 0.663 1.550
254 HD13 LEU 15 3HD1 LEU 15 3.194 -1.083 1.308
255 HD21 LEU 15 3HD2 LEU 15 0.439 1.203 0.500
256 HD22 LEU 15 1HD2 LEU 15 0.876 1.455 -1.190
257 HD23 LEU 15 2HD2 LEU 15 1.867 2.153 0.091
258 H TYR 16 H TYR 16 3.857 -0.926 -4.225
259 HA TYR 16 HA TYR 16 6.523 0.142 -4.385
260 HD1 TYR 16 HD2 TYR 16 8.451 -0.549 -5.935
261 HD2 TYR 16 HD1 TYR 16 6.079 -3.725 -4.277
262 HE1 TYR 16 HE2 TYR 16 10.506 -1.615 -5.041
263 HE2 TYR 16 HE1 TYR 16 8.132 -4.791 -3.383
264 HH TYR 16 HH TYR 16 10.996 -3.261 -3.029
265 HB2 TYR 16 2HB TYR 16 5.032 -2.057 -5.523
266 HB3 TYR 16 1HB TYR 16 5.992 -1.261 -6.771
267 H LEU 17 H LEU 17 3.900 0.204 -6.844
268 HA LEU 17 HA LEU 17 5.240 1.993 -8.588
269 HG LEU 17 HG LEU 17 2.308 1.156 -6.889
270 HB2 LEU 17 2HB LEU 17 2.903 2.570 -9.404
271 HB3 LEU 17 1HB LEU 17 3.313 0.855 -9.421
272 HD11 LEU 17 1HD1 LEU 17 1.666 3.541 -7.779
273 HD12 LEU 17 2HD1 LEU 17 0.489 2.616 -6.845
274 HD13 LEU 17 3HD1 LEU 17 0.370 2.675 -8.603
275 HD21 LEU 17 3HD2 LEU 17 0.271 0.072 -7.820
276 HD22 LEU 17 1HD2 LEU 17 1.752 -0.638 -8.465
277 HD23 LEU 17 2HD2 LEU 17 0.816 0.492 -9.444
278 H VAL 18 H VAL 18 3.239 2.664 -5.722
279 HA VAL 18 HA VAL 18 3.176 5.523 -6.220
280 HB VAL 18 HB VAL 18 2.398 5.723 -3.901
281 HG11 VAL 18 1HG1 VAL 18 0.339 4.710 -4.255
282 HG12 VAL 18 2HG1 VAL 18 1.061 3.261 -4.955
283 HG13 VAL 18 3HG1 VAL 18 0.992 4.752 -5.892
284 HG21 VAL 18 3HG2 VAL 18 3.090 2.786 -3.779
285 HG22 VAL 18 1HG2 VAL 18 2.124 3.618 -2.566
286 HG23 VAL 18 2HG2 VAL 18 3.807 4.076 -2.818
287 H CYS 19 H CYS 19 5.063 3.460 -4.051
288 HA CYS 19 HA CYS 19 6.700 5.645 -3.111
289 HB2 CYS 19 2HB CYS 19 6.652 2.694 -2.798
290 HB3 CYS 19 1HB CYS 19 8.230 3.449 -2.621
291 H GLY 20 H GLY 20 7.587 2.801 -5.069
292 HA2 GLY 20 2HA GLY 20 8.982 2.735 -7.003
293 HA3 GLY 20 1HA GLY 20 9.196 4.485 -6.871
294 H GLU 21 H GLU 21 11.534 4.219 -7.070
295 HA GLU 21 HA GLU 21 12.980 2.593 -5.141
296 HB2 GLU 21 2HB GLU 21 13.609 4.065 -7.510
297 HB3 GLU 21 1HB GLU 21 14.660 4.643 -6.216
298 HG2 GLU 21 2HG GLU 21 15.706 2.607 -5.965
299 HG3 GLU 21 1HG GLU 21 14.272 1.695 -6.437
300 H ARG 22 H ARG 22 11.254 4.148 -3.682
301 HA ARG 22 HA ARG 22 13.104 6.052 -2.332
302 HE ARG 22 HE ARG 22 11.072 9.727 -2.080
303 HB2 ARG 22 2HB ARG 22 10.142 6.296 -2.895
304 HB3 ARG 22 1HB ARG 22 10.931 7.236 -1.628
305 HG2 ARG 22 2HG ARG 22 12.447 8.238 -3.240
306 HG3 ARG 22 1HG ARG 22 11.820 7.205 -4.525
307 HD2 ARG 22 2HD ARG 22 10.619 9.170 -4.887
308 HD3 ARG 22 1HD ARG 22 9.507 8.263 -3.860
309 HH11 ARG 22 1HH2 ARG 22 8.398 10.047 -4.128
310 HH12 ARG 22 2HH2 ARG 22 8.212 11.752 -3.886
311 HH21 ARG 22 1HH1 ARG 22 11.136 12.079 -2.051
312 HH22 ARG 22 2HH1 ARG 22 9.761 12.902 -2.707
313 H GLY 23 H GLY 23 11.294 3.203 -2.153
314 HA2 GLY 23 2HA GLY 23 11.172 1.721 -0.308
315 HA3 GLY 23 1HA GLY 23 11.845 2.987 0.715
316 H PHE 24 H PHE 24 9.374 1.148 0.837
317 HA PHE 24 HA PHE 24 7.341 3.287 1.346
318 HD1 PHE 24 HD2 PHE 24 7.752 1.206 -1.767
319 HD2 PHE 24 HD1 PHE 24 7.080 -1.105 1.796
320 HE1 PHE 24 HE2 PHE 24 8.923 -0.723 -2.795
321 HE2 PHE 24 HE1 PHE 24 8.252 -3.033 0.765
322 HZ PHE 24 HZ PHE 24 9.173 -2.842 -1.530
323 HB2 PHE 24 2HB PHE 24 5.889 0.987 1.414
324 HB3 PHE 24 1HB PHE 24 6.128 1.922 -0.056
325 H PHE 25 H PHE 25 5.643 1.910 3.041
326 HA PHE 25 HA PHE 25 7.382 1.571 5.433
327 HD1 PHE 25 HD2 PHE 25 7.644 2.268 7.149
328 HD2 PHE 25 HD1 PHE 25 4.504 4.850 5.747
329 HE1 PHE 25 HE2 PHE 25 8.713 4.189 8.293
330 HE2 PHE 25 HE1 PHE 25 5.575 6.769 6.894
331 HZ PHE 25 HZ PHE 25 7.678 6.439 8.167
332 HB2 PHE 25 2HB PHE 25 4.657 2.623 4.932
333 HB3 PHE 25 1HB PHE 25 4.824 1.656 6.392
334 H TYR 26 H TYR 26 4.271 0.178 4.297
335 HA TYR 26 HA TYR 26 3.418 -1.987 4.603
336 HD1 TYR 26 HD1 TYR 26 2.833 -3.851 4.329
337 HD2 TYR 26 HD2 TYR 26 6.946 -4.894 3.625
338 HE1 TYR 26 HE1 TYR 26 2.264 -6.252 4.551
339 HE2 TYR 26 HE2 TYR 26 6.372 -7.294 3.849
340 HH TYR 26 HH TYR 26 3.777 -8.442 5.261
341 HB2 TYR 26 2HB TYR 26 5.055 -2.416 2.827
342 HB3 TYR 26 1HB TYR 26 6.322 -2.606 4.027
343 H THR 27 H THR 27 3.790 -0.783 7.037
344 HA THR 27 HA THR 27 5.441 -2.542 8.738
345 HB THR 27 HB THR 27 5.489 -0.265 9.407
346 HG1 THR 27 HG1 THR 27 3.850 -0.469 11.331
347 HG21 THR 27 3HG2 THR 27 2.996 0.648 10.012
348 HG22 THR 27 1HG2 THR 27 2.641 -0.372 8.618
349 HG23 THR 27 2HG2 THR 27 3.802 0.947 8.473
350 H LYS 28 H LYS 28 4.547 -3.816 10.459
351 HA LYS 28 HA LYS 28 1.983 -5.055 9.771
352 HB2 LYS 28 2HB LYS 28 2.497 -6.678 11.452
353 HB3 LYS 28 1HB LYS 28 4.023 -6.303 10.657
354 HG2 LYS 28 2HG LYS 28 3.611 -4.458 12.835
355 HG3 LYS 28 1HG LYS 28 3.429 -6.110 13.424
356 HD2 LYS 28 2HD LYS 28 5.590 -6.648 12.175
357 HD3 LYS 28 1HD LYS 28 5.799 -4.907 11.982
358 HE2 LYS 28 2HE LYS 28 6.840 -5.009 13.997
359 HE3 LYS 28 1HE LYS 28 5.207 -5.106 14.658
360 HZ1 LYS 28 3HZ LYS 28 6.915 -6.901 15.291
361 HZ2 LYS 28 1HZ LYS 28 6.596 -7.543 13.754
362 HZ3 LYS 28 2HZ LYS 28 5.337 -7.384 14.884
363 HA PRO 29 HA PRO 29 -0.486 -2.673 12.492
364 HB2 PRO 29 2HB PRO 29 -2.590 -4.426 12.749
365 HB3 PRO 29 1HB PRO 29 -2.308 -3.429 11.311
366 HG2 PRO 29 2HG PRO 29 -1.834 -6.350 11.694
367 HG3 PRO 29 1HG PRO 29 -2.186 -5.454 10.207
368 HD2 PRO 29 2HD PRO 29 0.360 -6.368 11.008
369 HD3 PRO 29 1HD PRO 29 0.041 -5.175 9.735
370 H THR 30 H THR 30 -0.297 -6.143 13.366
371 HA THR 30 HA THR 30 0.184 -5.291 16.185
372 HB THR 30 HB THR 30 -2.152 -5.962 16.084
373 HG1 THR 30 HG1 THR 30 -0.991 -8.297 17.044
374 HG21 THR 30 3HG2 THR 30 -2.478 -7.254 14.194
375 HG22 THR 30 1HG2 THR 30 -2.441 -8.519 15.421
376 HG23 THR 30 2HG2 THR 30 -1.005 -8.190 14.452
Start of MODEL 2
1 H1 GLY 1 1H GLY 1 -2.228 1.232 11.714
2 H2 GLY 1 2H GLY 1 -2.340 -0.284 12.471
3 H3 GLY 1 3H GLY 1 -3.589 0.251 11.451
4 HA2 GLY 1 1HA GLY 1 -1.235 0.220 9.991
5 HA3 GLY 1 2HA GLY 1 -1.354 -1.371 10.804
6 H ILE 2 H ILE 2 -0.917 -1.111 8.178
7 HA ILE 2 HA ILE 2 -3.342 -0.185 6.711
8 HB ILE 2 HB ILE 2 -1.029 0.688 6.073
9 HG12 ILE 2 2HG1 ILE 2 -2.815 -0.776 4.121
10 HG13 ILE 2 1HG1 ILE 2 -2.811 0.946 4.500
11 HG21 ILE 2 1HG2 ILE 2 0.590 -0.721 5.268
12 HG22 ILE 2 2HG2 ILE 2 -0.583 -1.824 4.550
13 HG23 ILE 2 3HG2 ILE 2 -0.248 -1.898 6.279
14 HD11 ILE 2 3HD1 ILE 2 -1.426 1.234 2.745
15 HD12 ILE 2 1HD1 ILE 2 -1.214 -0.506 2.554
16 HD13 ILE 2 2HD1 ILE 2 -0.190 0.390 3.677
17 H THR 3 H THR 3 -1.371 -2.992 7.426
18 HA THR 3 HA THR 3 -2.370 -4.733 5.398
19 HB THR 3 HB THR 3 -1.486 -5.450 8.208
20 HG1 THR 3 HG1 THR 3 0.117 -4.328 7.125
21 HG21 THR 3 3HG2 THR 3 -0.858 -7.365 6.150
22 HG22 THR 3 1HG2 THR 3 -2.587 -7.019 6.127
23 HG23 THR 3 2HG2 THR 3 -1.822 -7.591 7.610
24 H GLU 4 H GLU 4 -3.752 -3.585 8.369
25 HA GLU 4 HA GLU 4 -5.935 -5.588 8.239
26 HB2 GLU 4 2HB GLU 4 -4.934 -4.997 10.449
27 HB3 GLU 4 1HB GLU 4 -5.486 -3.337 10.224
28 HG2 GLU 4 2HG GLU 4 -7.437 -3.954 11.167
29 HG3 GLU 4 1HG GLU 4 -7.749 -4.912 9.719
30 H GLN 5 H GLN 5 -5.832 -3.871 6.033
31 HA GLN 5 HA GLN 5 -8.492 -2.818 5.996
32 HB2 GLN 5 2HB GLN 5 -6.936 -1.110 7.385
33 HB3 GLN 5 1HB GLN 5 -6.591 -0.537 5.752
34 HG2 GLN 5 2HG GLN 5 -9.247 -0.737 5.529
35 HG3 GLN 5 1HG GLN 5 -9.159 -0.493 7.274
36 HE21 GLN 5 1HE2 GLN 5 -8.853 1.643 7.990
37 HE22 GLN 5 2HE2 GLN 5 -8.430 2.940 6.980
38 H CYS 6 H CYS 6 -5.209 -2.493 4.655
39 HA CYS 6 HA CYS 6 -6.238 -1.958 1.964
40 HB2 CYS 6 2HB CYS 6 -3.542 -2.239 3.222
41 HB3 CYS 6 1HB CYS 6 -3.667 -2.518 1.493
42 H CYS 7 H CYS 7 -6.095 -4.682 3.824
43 HA CYS 7 HA CYS 7 -5.811 -6.388 1.387
44 HB2 CYS 7 2HB CYS 7 -3.998 -6.783 3.032
45 HB3 CYS 7 1HB CYS 7 -5.198 -7.139 4.258
46 H THR 8 H THR 8 -7.638 -5.676 4.306
47 HA THR 8 HA THR 8 -9.529 -7.867 3.903
48 HB THR 8 HB THR 8 -9.283 -7.021 6.156
49 HG1 THR 8 HG1 THR 8 -11.447 -7.495 5.301
50 HG21 THR 8 3HG2 THR 8 -8.782 -4.859 6.496
51 HG22 THR 8 1HG2 THR 8 -10.410 -4.412 5.984
52 HG23 THR 8 2HG2 THR 8 -9.108 -4.506 4.799
53 H SER 9 H SER 9 -9.055 -4.676 2.710
54 HA SER 9 HA SER 9 -11.425 -4.947 0.975
55 HG SER 9 HG SER 9 -12.282 -4.630 3.422
56 HB2 SER 9 2HB SER 9 -11.082 -2.310 2.353
57 HB3 SER 9 1HB SER 9 -12.537 -3.031 1.672
58 H ILE 10 H ILE 10 -11.274 -2.248 -0.001
59 HA ILE 10 HA ILE 10 -8.569 -2.357 -1.262
60 HB ILE 10 HB ILE 10 -11.185 -1.231 -2.285
61 HG12 ILE 10 2HG1 ILE 10 -9.442 -3.314 -3.585
62 HG13 ILE 10 1HG1 ILE 10 -10.567 -3.774 -2.306
63 HG21 ILE 10 1HG2 ILE 10 -9.043 0.096 -2.838
64 HG22 ILE 10 2HG2 ILE 10 -10.021 -0.442 -4.203
65 HG23 ILE 10 3HG2 ILE 10 -8.554 -1.319 -3.769
66 HD11 ILE 10 3HD1 ILE 10 -11.370 -2.204 -4.764
67 HD12 ILE 10 1HD1 ILE 10 -12.440 -2.905 -3.549
68 HD13 ILE 10 2HD1 ILE 10 -11.520 -3.957 -4.626
69 H CYS 11 H CYS 11 -7.246 -0.572 -1.090
70 HA CYS 11 HA CYS 11 -8.188 1.606 0.678
71 HB2 CYS 11 2HB CYS 11 -5.471 0.788 -0.370
72 HB3 CYS 11 1HB CYS 11 -5.723 2.302 0.496
73 H SER 12 H SER 12 -6.656 3.737 -0.212
74 HA SER 12 HA SER 12 -7.857 4.285 -2.899
75 HG SER 12 HG SER 12 -8.337 5.508 0.349
76 HB2 SER 12 2HB SER 12 -7.310 6.749 -1.910
77 HB3 SER 12 1HB SER 12 -8.854 5.935 -1.679
78 H LEU 13 H LEU 13 -6.181 3.761 -4.238
79 HA LEU 13 HA LEU 13 -3.485 3.807 -4.134
80 HG LEU 13 HG LEU 13 -5.722 2.930 -5.821
81 HB2 LEU 13 2HB LEU 13 -4.328 5.552 -6.348
82 HB3 LEU 13 1HB LEU 13 -3.455 4.030 -6.391
83 HD11 LEU 13 1HD1 LEU 13 -6.571 5.474 -5.463
84 HD12 LEU 13 2HD1 LEU 13 -7.652 4.175 -5.968
85 HD13 LEU 13 3HD1 LEU 13 -6.972 5.274 -7.168
86 HD21 LEU 13 3HD2 LEU 13 -6.418 3.210 -8.282
87 HD22 LEU 13 1HD2 LEU 13 -4.798 2.588 -7.970
88 HD23 LEU 13 2HD2 LEU 13 -5.021 4.278 -8.423
89 H TYR 14 H TYR 14 -5.412 6.734 -4.565
90 HA TYR 14 HA TYR 14 -3.374 8.658 -4.574
91 HD1 TYR 14 HD1 TYR 14 -3.274 10.951 -4.075
92 HD2 TYR 14 HD2 TYR 14 -6.973 10.219 -2.017
93 HE1 TYR 14 HE1 TYR 14 -2.935 13.011 -2.733
94 HE2 TYR 14 HE2 TYR 14 -6.637 12.279 -0.675
95 HH TYR 14 HH TYR 14 -4.753 14.680 -1.438
96 HB2 TYR 14 2HB TYR 14 -5.536 9.475 -4.978
97 HB3 TYR 14 1HB TYR 14 -6.205 8.657 -3.569
98 H GLN 15 H GLN 15 -5.213 7.614 -1.717
99 HA GLN 15 HA GLN 15 -3.357 8.746 0.171
100 HB2 GLN 15 2HB GLN 15 -5.646 6.849 0.271
101 HB3 GLN 15 1HB GLN 15 -4.501 6.779 1.607
102 HG2 GLN 15 2HG GLN 15 -6.083 9.194 0.684
103 HG3 GLN 15 1HG GLN 15 -6.235 8.344 2.222
104 HE21 GLN 15 1HE2 GLN 15 -3.722 8.102 3.201
105 HE22 GLN 15 2HE2 GLN 15 -2.946 9.606 3.330
106 H LEU 16 H LEU 16 -3.883 5.585 -1.201
107 HA LEU 16 HA LEU 16 -2.177 3.855 0.036
108 HG LEU 16 HG LEU 16 -2.331 1.685 -2.837
109 HB2 LEU 16 2HB LEU 16 -3.544 3.630 -2.161
110 HB3 LEU 16 1HB LEU 16 -2.082 4.193 -2.962
111 HD11 LEU 16 1HD1 LEU 16 0.087 2.557 -1.281
112 HD12 LEU 16 2HD1 LEU 16 -0.134 3.093 -2.946
113 HD13 LEU 16 3HD1 LEU 16 -0.028 1.371 -2.579
114 HD21 LEU 16 3HD2 LEU 16 -2.421 0.586 -0.836
115 HD22 LEU 16 1HD2 LEU 16 -3.123 2.112 -0.298
116 HD23 LEU 16 2HD2 LEU 16 -1.414 1.780 -0.016
117 H GLU 17 H GLU 17 -1.219 6.407 -2.224
118 HA GLU 17 HA GLU 17 1.586 5.689 -2.192
119 HB2 GLU 17 2HB GLU 17 0.979 6.828 -4.122
120 HB3 GLU 17 1HB GLU 17 -0.033 7.977 -3.252
121 HG2 GLU 17 2HG GLU 17 2.038 8.982 -2.264
122 HG3 GLU 17 1HG GLU 17 3.003 7.881 -3.249
123 H ASN 18 H ASN 18 -0.396 7.604 -0.089
124 HA ASN 18 HA ASN 18 1.678 9.295 0.973
125 HB2 ASN 18 2HB ASN 18 -0.822 9.603 1.283
126 HB3 ASN 18 1HB ASN 18 -0.753 8.316 2.482
127 HD21 ASN 18 1HD2 ASN 18 1.248 11.237 1.730
128 HD22 ASN 18 2HD2 ASN 18 1.323 11.773 3.339
129 H TYR 19 H TYR 19 1.342 5.959 1.142
130 HA TYR 19 HA TYR 19 2.414 5.733 3.879
131 HD1 TYR 19 HD2 TYR 19 0.974 4.729 5.278
132 HD2 TYR 19 HD1 TYR 19 -0.500 3.571 1.413
133 HE1 TYR 19 HE2 TYR 19 -1.354 4.980 6.093
134 HE2 TYR 19 HE1 TYR 19 -2.830 3.823 2.225
135 HH TYR 19 HH TYR 19 -4.124 4.132 4.032
136 HB2 TYR 19 2HB TYR 19 1.799 3.632 1.782
137 HB3 TYR 19 1HB TYR 19 2.333 3.289 3.430
138 H CYS 20 H CYS 20 3.980 7.050 1.672
139 HA CYS 20 HA CYS 20 6.250 5.134 1.470
140 HB2 CYS 20 2HB CYS 20 5.259 6.648 -0.484
141 HB3 CYS 20 1HB CYS 20 6.385 7.815 0.168
142 H ASN 21 H ASN 21 8.403 6.642 1.402
143 HA ASN 21 HA ASN 21 8.631 7.623 4.163
144 HB2 ASN 21 2HB ASN 21 10.372 6.176 2.965
145 HB3 ASN 21 1HB ASN 21 10.794 7.623 2.048
146 HD21 ASN 21 1HD2 ASN 21 12.865 6.776 3.526
147 HD22 ASN 21 2HD2 ASN 21 13.055 7.673 4.954
148 HA PHE 1 HA PHE 1 -8.460 2.903 -12.237
149 HD1 PHE 1 HD1 PHE 1 -9.214 4.674 -13.002
150 HD2 PHE 1 HD2 PHE 1 -11.077 4.680 -9.127
151 HE1 PHE 1 HE1 PHE 1 -9.003 7.144 -12.904
152 HE2 PHE 1 HE2 PHE 1 -10.865 7.151 -9.032
153 HZ PHE 1 HZ PHE 1 -9.828 8.381 -10.919
154 H1 PHE 1 1H PHE 1 -10.904 3.369 -13.413
155 H2 PHE 1 2H PHE 1 -10.423 1.848 -13.995
156 H3 PHE 1 3H PHE 1 -9.412 3.199 -14.202
157 HB2 PHE 1 2HB PHE 1 -11.327 2.743 -11.290
158 HB3 PHE 1 1HB PHE 1 -9.963 2.585 -10.184
159 H VAL 2 H VAL 2 -8.766 1.111 -10.183
160 HA VAL 2 HA VAL 2 -9.539 -1.514 -11.242
161 HB VAL 2 HB VAL 2 -6.701 -1.437 -10.353
162 HG11 VAL 2 1HG1 VAL 2 -7.976 -2.812 -12.724
163 HG12 VAL 2 2HG1 VAL 2 -8.066 -3.471 -11.091
164 HG13 VAL 2 3HG1 VAL 2 -6.499 -3.263 -11.873
165 HG21 VAL 2 3HG2 VAL 2 -6.899 0.529 -11.899
166 HG22 VAL 2 1HG2 VAL 2 -7.517 -0.559 -13.142
167 HG23 VAL 2 2HG2 VAL 2 -5.870 -0.753 -12.540
168 H ASN 3 H ASN 3 -10.050 -2.879 -9.550
169 HA ASN 3 HA ASN 3 -10.361 -1.933 -6.922
170 HB2 ASN 3 2HB ASN 3 -9.903 -4.782 -7.863
171 HB3 ASN 3 1HB ASN 3 -10.492 -4.340 -6.261
172 HD21 ASN 3 1HD2 ASN 3 -12.720 -3.881 -6.048
173 HD22 ASN 3 2HD2 ASN 3 -13.802 -3.815 -7.352
174 H GLN 4 H GLN 4 -8.742 -1.192 -5.620
175 HA GLN 4 HA GLN 4 -6.017 -2.206 -5.974
176 HB2 GLN 4 2HB GLN 4 -6.485 0.213 -5.658
177 HB3 GLN 4 1HB GLN 4 -7.105 -0.140 -4.051
178 HG2 GLN 4 2HG GLN 4 -4.559 0.591 -4.463
179 HG3 GLN 4 1HG GLN 4 -5.026 -0.497 -3.163
180 HE21 GLN 4 1HE2 GLN 4 -3.008 -0.208 -5.937
181 HE22 GLN 4 2HE2 GLN 4 -2.547 -1.838 -6.052
182 H HIS 5 H HIS 5 -6.418 -4.411 -5.181
183 HA HIS 5 HA HIS 5 -7.031 -4.665 -2.295
184 HD2 HIS 5 HD2 HIS 5 -8.893 -5.289 -1.570
185 HE1 HIS 5 HE1 HIS 5 -11.348 -7.583 -4.137
186 HE2 HIS 5 HE2 HIS 5 -11.322 -6.068 -2.085
187 HB2 HIS 5 2HB HIS 5 -6.714 -6.577 -4.584
188 HB3 HIS 5 1HB HIS 5 -6.441 -7.173 -2.949
189 H LEU 6 H LEU 6 -5.409 -5.017 -0.766
190 HA LEU 6 HA LEU 6 -2.646 -5.421 -1.805
191 HG LEU 6 HG LEU 6 -2.694 -2.319 -2.146
192 HB2 LEU 6 2HB LEU 6 -3.765 -3.164 -0.281
193 HB3 LEU 6 1HB LEU 6 -2.300 -3.829 0.404
194 HD11 LEU 6 1HD1 LEU 6 -1.395 -1.889 0.214
195 HD12 LEU 6 2HD1 LEU 6 -0.996 -1.080 -1.300
196 HD13 LEU 6 3HD1 LEU 6 -0.080 -2.497 -0.790
197 HD21 LEU 6 3HD2 LEU 6 -0.932 -4.750 -1.866
198 HD22 LEU 6 1HD2 LEU 6 -0.356 -3.377 -2.804
199 HD23 LEU 6 2HD2 LEU 6 -1.844 -4.197 -3.270
200 H CYS 7 H CYS 7 -1.461 -6.872 -0.738
201 HA CYS 7 HA CYS 7 -1.994 -7.470 2.085
202 HB2 CYS 7 2HB CYS 7 -2.290 -9.695 0.026
203 HB3 CYS 7 1HB CYS 7 -2.496 -9.836 1.768
204 H GLY 8 H GLY 8 0.043 -7.689 2.906
205 HA2 GLY 8 2HA GLY 8 2.406 -7.934 2.883
206 HA3 GLY 8 1HA GLY 8 1.936 -9.572 2.452
207 H SER 9 H SER 9 2.849 -10.332 0.636
208 HA SER 9 HA SER 9 4.700 -9.117 -0.971
209 HG SER 9 HG SER 9 5.266 -10.773 -2.807
210 HB2 SER 9 2HB SER 9 3.076 -11.453 -1.172
211 HB3 SER 9 1HB SER 9 3.067 -10.660 -2.744
212 H ASP 10 H ASP 10 1.194 -9.142 -1.710
213 HA ASP 10 HA ASP 10 1.491 -7.340 -3.953
214 HB2 ASP 10 2HB ASP 10 -0.883 -8.184 -2.271
215 HB3 ASP 10 1HB ASP 10 -1.022 -7.086 -3.640
216 H LEU 11 H LEU 11 1.042 -6.993 -0.514
217 HA LEU 11 HA LEU 11 0.170 -4.305 -0.363
218 HG LEU 11 HG LEU 11 2.088 -3.605 2.349
219 HB2 LEU 11 2HB LEU 11 0.323 -5.887 1.564
220 HB3 LEU 11 1HB LEU 11 2.076 -5.757 1.501
221 HD11 LEU 11 1HD1 LEU 11 -0.607 -3.385 1.049
222 HD12 LEU 11 2HD1 LEU 11 0.814 -2.360 0.835
223 HD13 LEU 11 3HD1 LEU 11 -0.144 -2.247 2.312
224 HD21 LEU 11 3HD2 LEU 11 -0.596 -4.452 3.423
225 HD22 LEU 11 1HD2 LEU 11 0.693 -3.585 4.255
226 HD23 LEU 11 2HD2 LEU 11 0.885 -5.297 3.874
227 H VAL 12 H VAL 12 3.467 -5.646 -0.618
228 HA VAL 12 HA VAL 12 4.689 -3.001 -0.573
229 HB VAL 12 HB VAL 12 6.732 -4.310 -1.371
230 HG11 VAL 12 1HG1 VAL 12 5.620 -4.027 1.121
231 HG12 VAL 12 2HG1 VAL 12 7.197 -4.753 0.814
232 HG13 VAL 12 3HG1 VAL 12 5.777 -5.780 1.005
233 HG21 VAL 12 3HG2 VAL 12 6.602 -6.678 -1.503
234 HG22 VAL 12 1HG2 VAL 12 5.201 -6.101 -2.404
235 HG23 VAL 12 2HG2 VAL 12 5.002 -6.710 -0.761
236 H GLU 13 H GLU 13 3.498 -5.199 -3.039
237 HA GLU 13 HA GLU 13 4.785 -4.066 -5.306
238 HB2 GLU 13 2HB GLU 13 3.328 -6.162 -5.230
239 HB3 GLU 13 1HB GLU 13 1.935 -5.079 -5.281
240 HG2 GLU 13 2HG GLU 13 3.437 -4.059 -7.313
241 HG3 GLU 13 1HG GLU 13 3.866 -5.767 -7.413
242 H ALA 14 H ALA 14 1.545 -3.310 -3.966
243 HA ALA 14 HA ALA 14 0.978 -1.107 -5.651
244 HB1 ALA 14 3HB ALA 14 -0.492 -0.325 -3.778
245 HB2 ALA 14 1HB ALA 14 0.210 -1.583 -2.761
246 HB3 ALA 14 2HB ALA 14 -0.731 -2.024 -4.185
247 H LEU 15 H LEU 15 2.457 -1.119 -2.407
248 HA LEU 15 HA LEU 15 3.050 1.667 -2.332
249 HG LEU 15 HG LEU 15 2.294 -0.798 -0.288
250 HB2 LEU 15 2HB LEU 15 4.552 -0.613 -1.013
251 HB3 LEU 15 1HB LEU 15 4.642 1.085 -0.553
252 HD11 LEU 15 1HD1 LEU 15 3.323 1.131 1.766
253 HD12 LEU 15 2HD1 LEU 15 4.209 -0.364 1.468
254 HD13 LEU 15 3HD1 LEU 15 2.528 -0.426 1.999
255 HD21 LEU 15 3HD2 LEU 15 1.028 0.991 -0.934
256 HD22 LEU 15 1HD2 LEU 15 2.335 2.144 -0.663
257 HD23 LEU 15 2HD2 LEU 15 1.372 1.566 0.697
258 H TYR 16 H TYR 16 4.746 -1.089 -3.726
259 HA TYR 16 HA TYR 16 7.289 0.107 -4.108
260 HD1 TYR 16 HD2 TYR 16 9.319 -0.791 -5.330
261 HD2 TYR 16 HD1 TYR 16 6.737 -3.744 -3.575
262 HE1 TYR 16 HE2 TYR 16 11.256 -1.771 -4.130
263 HE2 TYR 16 HE1 TYR 16 8.674 -4.724 -2.373
264 HH TYR 16 HH TYR 16 11.965 -3.629 -2.994
265 HB2 TYR 16 2HB TYR 16 5.854 -2.229 -5.115
266 HB3 TYR 16 1HB TYR 16 6.950 -1.540 -6.314
267 H LEU 17 H LEU 17 4.754 -0.255 -6.632
268 HA LEU 17 HA LEU 17 6.003 1.412 -8.524
269 HG LEU 17 HG LEU 17 3.130 0.499 -6.772
270 HB2 LEU 17 2HB LEU 17 3.586 1.875 -9.322
271 HB3 LEU 17 1HB LEU 17 4.162 0.210 -9.341
272 HD11 LEU 17 1HD1 LEU 17 1.086 1.654 -8.659
273 HD12 LEU 17 2HD1 LEU 17 2.159 2.696 -7.724
274 HD13 LEU 17 3HD1 LEU 17 1.051 1.602 -6.896
275 HD21 LEU 17 3HD2 LEU 17 2.912 -1.422 -8.371
276 HD22 LEU 17 1HD2 LEU 17 1.674 -0.510 -9.236
277 HD23 LEU 17 2HD2 LEU 17 1.394 -1.016 -7.570
278 H VAL 18 H VAL 18 3.999 2.337 -5.751
279 HA VAL 18 HA VAL 18 3.905 5.139 -6.587
280 HB VAL 18 HB VAL 18 2.926 5.533 -4.348
281 HG11 VAL 18 1HG1 VAL 18 1.587 3.037 -5.250
282 HG12 VAL 18 2HG1 VAL 18 1.739 4.340 -6.431
283 HG13 VAL 18 3HG1 VAL 18 0.896 4.623 -4.907
284 HG21 VAL 18 3HG2 VAL 18 2.496 3.542 -2.910
285 HG22 VAL 18 1HG2 VAL 18 4.210 3.923 -3.055
286 HG23 VAL 18 2HG2 VAL 18 3.518 2.594 -3.983
287 H CYS 19 H CYS 19 5.596 3.289 -4.119
288 HA CYS 19 HA CYS 19 7.087 5.538 -3.100
289 HB2 CYS 19 2HB CYS 19 7.180 2.569 -2.770
290 HB3 CYS 19 1HB CYS 19 8.625 3.478 -2.345
291 H GLY 20 H GLY 20 8.227 2.678 -4.889
292 HA2 GLY 20 2HA GLY 20 9.763 2.639 -6.722
293 HA3 GLY 20 1HA GLY 20 9.993 4.382 -6.533
294 H GLU 21 H GLU 21 12.358 3.708 -6.669
295 HA GLU 21 HA GLU 21 13.502 2.223 -4.461
296 HB2 GLU 21 2HB GLU 21 14.434 2.822 -6.906
297 HB3 GLU 21 1HB GLU 21 15.181 4.142 -6.007
298 HG2 GLU 21 2HG GLU 21 16.094 2.470 -4.391
299 HG3 GLU 21 1HG GLU 21 15.439 1.182 -5.403
300 H ARG 22 H ARG 22 11.898 4.093 -3.289
301 HA ARG 22 HA ARG 22 13.860 5.996 -2.098
302 HE ARG 22 HE ARG 22 9.531 8.091 -3.507
303 HB2 ARG 22 2HB ARG 22 10.902 6.378 -2.646
304 HB3 ARG 22 1HB ARG 22 11.841 7.445 -1.604
305 HG2 ARG 22 2HG ARG 22 12.681 8.538 -3.382
306 HG3 ARG 22 1HG ARG 22 13.227 7.025 -4.108
307 HD2 ARG 22 2HD ARG 22 11.637 8.079 -5.618
308 HD3 ARG 22 1HD ARG 22 10.889 6.638 -4.928
309 HH11 ARG 22 1HH2 ARG 22 11.566 10.392 -3.539
310 HH12 ARG 22 2HH2 ARG 22 10.708 11.568 -4.477
311 HH21 ARG 22 1HH1 ARG 22 8.399 9.292 -5.707
312 HH22 ARG 22 2HH1 ARG 22 8.914 10.946 -5.703
313 H GLY 23 H GLY 23 11.788 3.339 -1.648
314 HA2 GLY 23 2HA GLY 23 11.810 2.099 0.439
315 HA3 GLY 23 1HA GLY 23 12.144 3.600 1.296
316 H PHE 24 H PHE 24 9.911 1.398 1.285
317 HA PHE 24 HA PHE 24 7.596 3.297 1.277
318 HD1 PHE 24 HD1 PHE 24 7.480 -0.926 2.275
319 HD2 PHE 24 HD2 PHE 24 8.924 0.789 -1.391
320 HE1 PHE 24 HE1 PHE 24 8.940 -2.900 1.927
321 HE2 PHE 24 HE2 PHE 24 10.384 -1.185 -1.740
322 HZ PHE 24 HZ PHE 24 10.392 -3.030 -0.081
323 HB2 PHE 24 2HB PHE 24 6.327 0.964 1.203
324 HB3 PHE 24 1HB PHE 24 6.952 1.681 -0.278
325 H PHE 25 H PHE 25 5.777 2.023 2.786
326 HA PHE 25 HA PHE 25 7.144 1.799 5.426
327 HD1 PHE 25 HD2 PHE 25 6.282 2.322 7.803
328 HD2 PHE 25 HD1 PHE 25 5.276 5.248 4.818
329 HE1 PHE 25 HE2 PHE 25 7.254 4.106 9.223
330 HE2 PHE 25 HE1 PHE 25 6.248 7.030 6.240
331 HZ PHE 25 HZ PHE 25 7.236 6.461 8.443
332 HB2 PHE 25 2HB PHE 25 4.637 3.019 4.498
333 HB3 PHE 25 1HB PHE 25 4.416 2.004 5.921
334 H TYR 26 H TYR 26 3.991 0.537 4.279
335 HA TYR 26 HA TYR 26 3.070 -1.611 4.542
336 HD1 TYR 26 HD1 TYR 26 2.623 -3.705 4.651
337 HD2 TYR 26 HD2 TYR 26 6.791 -4.483 3.925
338 HE1 TYR 26 HE1 TYR 26 2.279 -6.091 5.222
339 HE2 TYR 26 HE2 TYR 26 6.442 -6.867 4.499
340 HH TYR 26 HH TYR 26 4.816 -8.214 5.852
341 HB2 TYR 26 2HB TYR 26 4.660 -2.309 2.879
342 HB3 TYR 26 1HB TYR 26 5.989 -2.230 4.023
343 H THR 27 H THR 27 3.344 -0.283 6.905
344 HA THR 27 HA THR 27 4.891 -1.878 8.822
345 HB THR 27 HB THR 27 4.474 -0.180 10.308
346 HG1 THR 27 HG1 THR 27 1.897 -0.027 9.140
347 HG21 THR 27 3HG2 THR 27 4.721 1.805 9.198
348 HG22 THR 27 1HG2 THR 27 3.315 1.523 8.172
349 HG23 THR 27 2HG2 THR 27 4.853 0.749 7.791
350 H LYS 28 H LYS 28 3.556 -2.527 10.907
351 HA LYS 28 HA LYS 28 1.067 -3.920 10.000
352 HB2 LYS 28 2HB LYS 28 3.358 -4.907 11.699
353 HB3 LYS 28 1HB LYS 28 1.761 -5.649 11.798
354 HG2 LYS 28 2HG LYS 28 2.882 -5.225 9.071
355 HG3 LYS 28 1HG LYS 28 3.619 -6.494 10.050
356 HD2 LYS 28 2HD LYS 28 0.832 -6.764 10.408
357 HD3 LYS 28 1HD LYS 28 1.078 -6.517 8.679
358 HE2 LYS 28 2HE LYS 28 2.354 -8.630 10.432
359 HE3 LYS 28 1HE LYS 28 1.251 -8.883 9.080
360 HZ1 LYS 28 3HZ LYS 28 3.057 -9.053 7.824
361 HZ2 LYS 28 1HZ LYS 28 4.077 -8.494 9.059
362 HZ3 LYS 28 2HZ LYS 28 3.289 -7.384 8.042
363 HA PRO 29 HA PRO 29 -0.838 -1.973 13.426
364 HB2 PRO 29 2HB PRO 29 -2.948 -3.702 13.777
365 HB3 PRO 29 1HB PRO 29 -2.854 -2.514 12.464
366 HG2 PRO 29 2HG PRO 29 -2.459 -5.467 12.355
367 HG3 PRO 29 1HG PRO 29 -2.991 -4.358 11.080
368 HD2 PRO 29 2HD PRO 29 -0.392 -5.439 11.351
369 HD3 PRO 29 1HD PRO 29 -0.853 -4.084 10.303
370 H THR 30 H THR 30 -0.723 -5.544 13.781
371 HA THR 30 HA THR 30 -0.923 -5.701 16.573
372 HB THR 30 HB THR 30 1.062 -7.582 15.733
373 HG1 THR 30 HG1 THR 30 -1.149 -7.436 13.978
374 HG21 THR 30 3HG2 THR 30 -0.382 -8.631 17.119
375 HG22 THR 30 1HG2 THR 30 -1.396 -8.860 15.694
376 HG23 THR 30 2HG2 THR 30 -1.674 -7.485 16.763
Start of MODEL 3
1 H1 GLY 1 1H GLY 1 -4.457 -0.613 11.646
2 H2 GLY 1 2H GLY 1 -3.184 -0.320 12.731
3 H3 GLY 1 3H GLY 1 -3.297 -1.818 11.938
4 HA2 GLY 1 1HA GLY 1 -2.692 0.716 10.610
5 HA3 GLY 1 2HA GLY 1 -1.501 -0.589 10.898
6 H ILE 2 H ILE 2 -1.341 -0.144 8.502
7 HA ILE 2 HA ILE 2 -3.611 0.503 6.825
8 HB ILE 2 HB ILE 2 -1.207 1.093 6.313
9 HG12 ILE 2 2HG1 ILE 2 -2.915 -0.416 4.323
10 HG13 ILE 2 1HG1 ILE 2 -2.801 1.329 4.543
11 HG21 ILE 2 1HG2 ILE 2 -1.053 -1.805 5.444
12 HG22 ILE 2 2HG2 ILE 2 -0.322 -1.184 6.923
13 HG23 ILE 2 3HG2 ILE 2 0.231 -0.600 5.353
14 HD11 ILE 2 3HD1 ILE 2 -0.513 -0.436 3.624
15 HD12 ILE 2 1HD1 ILE 2 -0.503 1.324 3.731
16 HD13 ILE 2 2HD1 ILE 2 -1.532 0.518 2.546
17 H THR 3 H THR 3 -1.759 -2.483 7.437
18 HA THR 3 HA THR 3 -2.919 -4.183 5.562
19 HB THR 3 HB THR 3 -2.197 -4.741 8.449
20 HG1 THR 3 HG1 THR 3 -0.325 -4.553 7.520
21 HG21 THR 3 3HG2 THR 3 -2.040 -7.151 7.236
22 HG22 THR 3 1HG2 THR 3 -3.397 -6.459 6.348
23 HG23 THR 3 2HG2 THR 3 -3.476 -6.605 8.104
24 H GLU 4 H GLU 4 -4.246 -3.145 8.661
25 HA GLU 4 HA GLU 4 -6.720 -4.675 8.244
26 HB2 GLU 4 2HB GLU 4 -5.402 -3.473 10.471
27 HB3 GLU 4 1HB GLU 4 -6.998 -2.734 10.329
28 HG2 GLU 4 2HG GLU 4 -7.485 -4.620 11.608
29 HG3 GLU 4 1HG GLU 4 -7.795 -5.220 9.978
30 H GLN 5 H GLN 5 -6.343 -2.953 6.114
31 HA GLN 5 HA GLN 5 -8.798 -1.480 6.089
32 HB2 GLN 5 2HB GLN 5 -7.311 0.017 7.552
33 HB3 GLN 5 1HB GLN 5 -6.364 0.319 6.093
34 HG2 GLN 5 2HG GLN 5 -8.509 1.008 4.949
35 HG3 GLN 5 1HG GLN 5 -9.300 0.919 6.524
36 HE21 GLN 5 1HE2 GLN 5 -7.253 2.880 4.502
37 HE22 GLN 5 2HE2 GLN 5 -6.998 4.130 5.622
38 H CYS 6 H CYS 6 -5.557 -1.918 4.783
39 HA CYS 6 HA CYS 6 -6.548 -1.249 2.071
40 HB2 CYS 6 2HB CYS 6 -3.821 -1.639 3.277
41 HB3 CYS 6 1HB CYS 6 -4.038 -1.706 1.537
42 H CYS 7 H CYS 7 -6.244 -3.891 4.087
43 HA CYS 7 HA CYS 7 -6.056 -5.728 1.741
44 HB2 CYS 7 2HB CYS 7 -4.204 -6.027 3.318
45 HB3 CYS 7 1HB CYS 7 -5.343 -6.237 4.642
46 H THR 8 H THR 8 -7.769 -4.952 4.738
47 HA THR 8 HA THR 8 -9.610 -7.131 4.724
48 HB THR 8 HB THR 8 -10.306 -4.299 5.540
49 HG1 THR 8 HG1 THR 8 -9.222 -6.062 7.381
50 HG21 THR 8 3HG2 THR 8 -11.179 -6.209 7.406
51 HG22 THR 8 1HG2 THR 8 -11.505 -6.920 5.825
52 HG23 THR 8 2HG2 THR 8 -12.173 -5.340 6.236
53 H SER 9 H SER 9 -9.196 -4.463 2.628
54 HA SER 9 HA SER 9 -11.422 -5.342 0.941
55 HG SER 9 HG SER 9 -13.023 -4.723 2.563
56 HB2 SER 9 2HB SER 9 -11.354 -2.506 2.025
57 HB3 SER 9 1HB SER 9 -12.515 -3.147 0.866
58 H ILE 10 H ILE 10 -11.157 -2.457 -0.264
59 HA ILE 10 HA ILE 10 -8.517 -2.975 -1.571
60 HB ILE 10 HB ILE 10 -11.061 -1.793 -2.714
61 HG12 ILE 10 2HG1 ILE 10 -9.557 -4.007 -4.004
62 HG13 ILE 10 1HG1 ILE 10 -10.341 -4.401 -2.473
63 HG21 ILE 10 1HG2 ILE 10 -8.322 -1.253 -3.384
64 HG22 ILE 10 2HG2 ILE 10 -9.779 -0.670 -4.189
65 HG23 ILE 10 3HG2 ILE 10 -9.045 -2.194 -4.689
66 HD11 ILE 10 3HD1 ILE 10 -12.105 -2.826 -4.137
67 HD12 ILE 10 1HD1 ILE 10 -12.366 -4.426 -3.445
68 HD13 ILE 10 2HD1 ILE 10 -11.556 -4.260 -5.002
69 H CYS 11 H CYS 11 -7.122 -1.182 -1.814
70 HA CYS 11 HA CYS 11 -7.978 1.251 -0.306
71 HB2 CYS 11 2HB CYS 11 -5.535 -0.327 -0.343
72 HB3 CYS 11 1HB CYS 11 -5.207 1.374 -0.677
73 H SER 12 H SER 12 -7.090 3.338 -1.127
74 HA SER 12 HA SER 12 -7.228 3.399 -4.094
75 HG SER 12 HG SER 12 -7.947 6.340 -1.433
76 HB2 SER 12 2HB SER 12 -7.473 5.862 -3.756
77 HB3 SER 12 1HB SER 12 -8.718 4.933 -2.926
78 H LEU 13 H LEU 13 -5.363 3.434 -5.197
79 HA LEU 13 HA LEU 13 -2.780 3.468 -4.273
80 HG LEU 13 HG LEU 13 -5.065 5.080 -6.329
81 HB2 LEU 13 2HB LEU 13 -2.185 4.670 -6.462
82 HB3 LEU 13 1HB LEU 13 -3.061 3.154 -6.581
83 HD11 LEU 13 1HD1 LEU 13 -4.409 6.498 -8.404
84 HD12 LEU 13 2HD1 LEU 13 -2.753 6.036 -8.013
85 HD13 LEU 13 3HD1 LEU 13 -3.714 6.946 -6.846
86 HD21 LEU 13 3HD2 LEU 13 -3.913 3.682 -8.756
87 HD22 LEU 13 1HD2 LEU 13 -5.489 4.472 -8.713
88 HD23 LEU 13 2HD2 LEU 13 -5.179 3.067 -7.693
89 H TYR 14 H TYR 14 -4.827 6.243 -4.911
90 HA TYR 14 HA TYR 14 -3.074 8.380 -4.541
91 HD1 TYR 14 HD1 TYR 14 -3.763 10.506 -5.408
92 HD2 TYR 14 HD2 TYR 14 -5.946 9.977 -1.746
93 HE1 TYR 14 HE1 TYR 14 -3.364 12.886 -4.827
94 HE2 TYR 14 HE2 TYR 14 -5.548 12.356 -1.163
95 HH TYR 14 HH TYR 14 -5.047 14.563 -2.698
96 HB2 TYR 14 2HB TYR 14 -5.550 8.580 -4.958
97 HB3 TYR 14 1HB TYR 14 -5.812 8.210 -3.255
98 H GLN 15 H GLN 15 -5.072 7.265 -1.840
99 HA GLN 15 HA GLN 15 -3.389 8.278 0.207
100 HB2 GLN 15 2HB GLN 15 -5.610 6.341 0.014
101 HB3 GLN 15 1HB GLN 15 -4.531 6.088 1.384
102 HG2 GLN 15 2HG GLN 15 -5.787 7.667 2.418
103 HG3 GLN 15 1HG GLN 15 -4.880 8.815 1.434
104 HE21 GLN 15 1HE2 GLN 15 -7.853 6.781 1.303
105 HE22 GLN 15 2HE2 GLN 15 -8.722 7.856 0.317
106 H LEU 16 H LEU 16 -3.544 5.147 -1.365
107 HA LEU 16 HA LEU 16 -1.716 3.607 0.036
108 HG LEU 16 HG LEU 16 -0.413 1.955 -1.428
109 HB2 LEU 16 2HB LEU 16 -3.027 3.237 -2.246
110 HB3 LEU 16 1HB LEU 16 -1.481 3.710 -2.950
111 HD11 LEU 16 1HD1 LEU 16 -3.132 1.812 -0.544
112 HD12 LEU 16 2HD1 LEU 16 -1.746 0.894 0.044
113 HD13 LEU 16 3HD1 LEU 16 -2.715 0.271 -1.291
114 HD21 LEU 16 3HD2 LEU 16 -1.908 1.693 -3.903
115 HD22 LEU 16 1HD2 LEU 16 -1.886 0.169 -3.016
116 HD23 LEU 16 2HD2 LEU 16 -0.370 0.958 -3.451
117 H GLU 17 H GLU 17 -1.056 6.239 -2.220
118 HA GLU 17 HA GLU 17 1.810 5.838 -2.244
119 HB2 GLU 17 2HB GLU 17 0.974 6.979 -4.119
120 HB3 GLU 17 1HB GLU 17 -0.057 8.022 -3.141
121 HG2 GLU 17 2HG GLU 17 2.832 8.238 -2.558
122 HG3 GLU 17 1HG GLU 17 2.358 8.783 -4.168
123 H ASN 18 H ASN 18 -0.412 7.492 -0.147
124 HA ASN 18 HA ASN 18 1.474 9.323 1.046
125 HB2 ASN 18 2HB ASN 18 -0.948 9.670 1.246
126 HB3 ASN 18 1HB ASN 18 -1.100 8.169 2.161
127 HD21 ASN 18 1HD2 ASN 18 -1.644 8.974 4.236
128 HD22 ASN 18 2HD2 ASN 18 -0.672 10.056 5.112
129 H TYR 19 H TYR 19 1.411 5.986 1.151
130 HA TYR 19 HA TYR 19 2.404 5.884 3.951
131 HD1 TYR 19 HD2 TYR 19 0.781 4.610 5.495
132 HD2 TYR 19 HD1 TYR 19 -0.475 4.007 1.430
133 HE1 TYR 19 HE2 TYR 19 -1.581 4.930 6.174
134 HE2 TYR 19 HE1 TYR 19 -2.836 4.327 2.108
135 HH TYR 19 HH TYR 19 -4.236 4.526 3.847
136 HB2 TYR 19 2HB TYR 19 1.771 3.635 2.015
137 HB3 TYR 19 1HB TYR 19 2.235 3.437 3.702
138 H CYS 20 H CYS 20 3.962 7.055 1.669
139 HA CYS 20 HA CYS 20 6.208 5.090 1.560
140 HB2 CYS 20 2HB CYS 20 5.183 6.324 -0.527
141 HB3 CYS 20 1HB CYS 20 6.216 7.641 -0.018
142 H ASN 21 H ASN 21 8.377 6.549 1.307
143 HA ASN 21 HA ASN 21 9.040 7.456 3.888
144 HB2 ASN 21 2HB ASN 21 10.852 6.922 2.453
145 HB3 ASN 21 1HB ASN 21 10.257 7.976 1.171
146 HD21 ASN 21 1HD2 ASN 21 11.209 10.020 1.081
147 HD22 ASN 21 2HD2 ASN 21 12.056 10.755 2.355
148 HA PHE 1 HA PHE 1 -9.011 2.972 -13.282
149 HD1 PHE 1 HD1 PHE 1 -9.743 6.308 -12.628
150 HD2 PHE 1 HD2 PHE 1 -6.921 3.546 -10.932
151 HE1 PHE 1 HE1 PHE 1 -7.892 7.871 -13.164
152 HE2 PHE 1 HE2 PHE 1 -5.069 5.109 -11.468
153 HZ PHE 1 HZ PHE 1 -5.555 7.271 -12.584
154 H1 PHE 1 1H PHE 1 -10.679 4.177 -14.159
155 H2 PHE 1 2H PHE 1 -11.612 4.149 -12.740
156 H3 PHE 1 3H PHE 1 -11.607 2.808 -13.782
157 HB2 PHE 1 2HB PHE 1 -10.461 4.439 -11.155
158 HB3 PHE 1 1HB PHE 1 -9.289 3.247 -10.589
159 H VAL 2 H VAL 2 -8.510 1.398 -11.194
160 HA VAL 2 HA VAL 2 -10.678 -0.655 -11.118
161 HB VAL 2 HB VAL 2 -7.832 -1.567 -11.235
162 HG11 VAL 2 1HG1 VAL 2 -9.144 -3.429 -11.068
163 HG12 VAL 2 2HG1 VAL 2 -9.325 -3.209 -12.809
164 HG13 VAL 2 3HG1 VAL 2 -10.567 -2.607 -11.710
165 HG21 VAL 2 3HG2 VAL 2 -9.301 -0.200 -13.429
166 HG22 VAL 2 1HG2 VAL 2 -8.499 -1.712 -13.857
167 HG23 VAL 2 2HG2 VAL 2 -7.564 -0.379 -13.179
168 H ASN 3 H ASN 3 -10.917 -1.638 -9.113
169 HA ASN 3 HA ASN 3 -9.533 -0.414 -6.860
170 HB2 ASN 3 2HB ASN 3 -11.533 -2.680 -7.072
171 HB3 ASN 3 1HB ASN 3 -10.860 -2.135 -5.536
172 HD21 ASN 3 1HD2 ASN 3 -12.854 -1.233 -4.724
173 HD22 ASN 3 2HD2 ASN 3 -13.578 0.134 -5.420
174 H GLN 4 H GLN 4 -7.565 -1.092 -6.135
175 HA GLN 4 HA GLN 4 -6.655 -3.808 -6.922
176 HB2 GLN 4 2HB GLN 4 -5.406 -1.361 -7.123
177 HB3 GLN 4 1HB GLN 4 -4.750 -1.957 -5.604
178 HG2 GLN 4 2HG GLN 4 -4.381 -3.014 -8.378
179 HG3 GLN 4 1HG GLN 4 -3.208 -2.852 -7.075
180 HE21 GLN 4 1HE2 GLN 4 -4.868 -5.172 -8.797
181 HE22 GLN 4 2HE2 GLN 4 -4.889 -6.416 -7.641
182 H HIS 5 H HIS 5 -6.328 -5.366 -5.385
183 HA HIS 5 HA HIS 5 -7.029 -4.738 -2.594
184 HD2 HIS 5 HD2 HIS 5 -9.293 -6.183 -1.618
185 HE1 HIS 5 HE1 HIS 5 -10.901 -7.354 -5.349
186 HE2 HIS 5 HE2 HIS 5 -11.469 -6.562 -2.992
187 HB2 HIS 5 2HB HIS 5 -6.347 -7.302 -4.052
188 HB3 HIS 5 1HB HIS 5 -6.608 -7.247 -2.309
189 H LEU 6 H LEU 6 -5.539 -4.885 -0.849
190 HA LEU 6 HA LEU 6 -2.698 -5.302 -1.624
191 HG LEU 6 HG LEU 6 -2.816 -2.264 -2.399
192 HB2 LEU 6 2HB LEU 6 -3.987 -2.896 -0.515
193 HB3 LEU 6 1HB LEU 6 -2.552 -3.401 0.347
194 HD11 LEU 6 1HD1 LEU 6 -0.275 -2.207 -0.908
195 HD12 LEU 6 2HD1 LEU 6 -1.648 -1.513 -0.046
196 HD13 LEU 6 3HD1 LEU 6 -1.192 -0.886 -1.630
197 HD21 LEU 6 3HD2 LEU 6 -1.039 -4.602 -1.725
198 HD22 LEU 6 1HD2 LEU 6 -0.422 -3.338 -2.781
199 HD23 LEU 6 2HD2 LEU 6 -1.868 -4.236 -3.237
200 H CYS 7 H CYS 7 -1.582 -6.579 -0.309
201 HA CYS 7 HA CYS 7 -2.239 -6.777 2.539
202 HB2 CYS 7 2HB CYS 7 -2.457 -9.271 0.810
203 HB3 CYS 7 1HB CYS 7 -2.712 -9.171 2.548
204 H GLY 8 H GLY 8 -0.207 -6.712 3.385
205 HA2 GLY 8 2HA GLY 8 2.156 -6.933 3.462
206 HA3 GLY 8 1HA GLY 8 1.710 -8.634 3.381
207 H SER 9 H SER 9 2.538 -9.766 1.725
208 HA SER 9 HA SER 9 4.449 -8.974 -0.058
209 HG SER 9 HG SER 9 1.560 -11.622 -0.757
210 HB2 SER 9 2HB SER 9 3.996 -10.907 -1.330
211 HB3 SER 9 1HB SER 9 3.366 -11.307 0.265
212 H ASP 10 H ASP 10 0.950 -8.944 -0.841
213 HA ASP 10 HA ASP 10 1.410 -7.510 -3.328
214 HB2 ASP 10 2HB ASP 10 -1.076 -8.079 -1.692
215 HB3 ASP 10 1HB ASP 10 -1.105 -7.199 -3.217
216 H LEU 11 H LEU 11 0.764 -6.703 -0.004
217 HA LEU 11 HA LEU 11 -0.070 -4.005 -0.271
218 HG LEU 11 HG LEU 11 1.775 -3.003 2.383
219 HB2 LEU 11 2HB LEU 11 -0.099 -5.283 1.852
220 HB3 LEU 11 1HB LEU 11 1.660 -5.273 1.877
221 HD11 LEU 11 1HD1 LEU 11 -0.884 -2.870 1.007
222 HD12 LEU 11 2HD1 LEU 11 0.564 -1.902 0.727
223 HD13 LEU 11 3HD1 LEU 11 -0.437 -1.603 2.148
224 HD21 LEU 11 3HD2 LEU 11 0.780 -4.134 4.268
225 HD22 LEU 11 1HD2 LEU 11 -0.822 -4.033 3.539
226 HD23 LEU 11 2HD2 LEU 11 -0.013 -2.568 4.096
227 H VAL 12 H VAL 12 3.159 -5.461 -0.349
228 HA VAL 12 HA VAL 12 4.486 -2.857 -0.448
229 HB VAL 12 HB VAL 12 6.512 -4.265 -1.009
230 HG11 VAL 12 1HG1 VAL 12 5.385 -3.749 1.372
231 HG12 VAL 12 2HG1 VAL 12 6.837 -4.737 1.218
232 HG13 VAL 12 3HG1 VAL 12 5.260 -5.508 1.392
233 HG21 VAL 12 3HG2 VAL 12 4.714 -6.600 -0.370
234 HG22 VAL 12 1HG2 VAL 12 6.345 -6.629 -1.038
235 HG23 VAL 12 2HG2 VAL 12 4.995 -6.083 -2.032
236 H GLU 13 H GLU 13 3.423 -5.320 -2.744
237 HA GLU 13 HA GLU 13 4.774 -4.440 -5.059
238 HB2 GLU 13 2HB GLU 13 3.188 -6.457 -4.764
239 HB3 GLU 13 1HB GLU 13 1.883 -5.317 -5.091
240 HG2 GLU 13 2HG GLU 13 3.639 -4.720 -7.108
241 HG3 GLU 13 1HG GLU 13 3.885 -6.458 -6.931
242 H ALA 14 H ALA 14 1.560 -3.411 -3.870
243 HA ALA 14 HA ALA 14 1.196 -1.357 -5.828
244 HB1 ALA 14 3HB ALA 14 -0.624 -0.609 -4.461
245 HB2 ALA 14 1HB ALA 14 0.066 -1.358 -3.021
246 HB3 ALA 14 2HB ALA 14 -0.580 -2.362 -4.320
247 H LEU 15 H LEU 15 2.379 -1.214 -2.466
248 HA LEU 15 HA LEU 15 2.979 1.599 -2.506
249 HG LEU 15 HG LEU 15 1.923 -0.557 -0.351
250 HB2 LEU 15 2HB LEU 15 4.273 -0.616 -0.882
251 HB3 LEU 15 1HB LEU 15 4.447 1.106 -0.570
252 HD11 LEU 15 1HD1 LEU 15 2.184 0.787 1.957
253 HD12 LEU 15 2HD1 LEU 15 3.882 0.731 1.483
254 HD13 LEU 15 3HD1 LEU 15 2.971 -0.767 1.680
255 HD21 LEU 15 3HD2 LEU 15 0.765 1.532 0.219
256 HD22 LEU 15 1HD2 LEU 15 1.455 1.676 -1.398
257 HD23 LEU 15 2HD2 LEU 15 2.250 2.453 -0.028
258 H TYR 16 H TYR 16 4.522 -1.179 -3.845
259 HA TYR 16 HA TYR 16 7.220 -0.233 -3.930
260 HD1 TYR 16 HD2 TYR 16 9.072 -0.838 -4.723
261 HD2 TYR 16 HD1 TYR 16 6.697 -4.369 -4.126
262 HE1 TYR 16 HE2 TYR 16 10.997 -1.944 -3.615
263 HE2 TYR 16 HE1 TYR 16 8.621 -5.475 -3.018
264 HH TYR 16 HH TYR 16 10.660 -5.099 -2.067
265 HB2 TYR 16 2HB TYR 16 5.694 -2.441 -5.010
266 HB3 TYR 16 1HB TYR 16 6.781 -1.792 -6.238
267 H LEU 17 H LEU 17 4.828 -0.319 -6.599
268 HA LEU 17 HA LEU 17 6.335 1.313 -8.358
269 HG LEU 17 HG LEU 17 3.262 0.591 -6.862
270 HB2 LEU 17 2HB LEU 17 4.056 1.831 -9.403
271 HB3 LEU 17 1HB LEU 17 4.506 0.130 -9.296
272 HD11 LEU 17 1HD1 LEU 17 2.568 2.830 -7.997
273 HD12 LEU 17 2HD1 LEU 17 1.326 1.880 -7.182
274 HD13 LEU 17 3HD1 LEU 17 1.466 1.825 -8.938
275 HD21 LEU 17 3HD2 LEU 17 2.580 -0.697 -9.451
276 HD22 LEU 17 1HD2 LEU 17 1.237 -0.433 -8.339
277 HD23 LEU 17 2HD2 LEU 17 2.630 -1.390 -7.830
278 H VAL 18 H VAL 18 3.882 2.288 -5.922
279 HA VAL 18 HA VAL 18 3.937 5.069 -6.632
280 HB VAL 18 HB VAL 18 2.998 5.489 -4.401
281 HG11 VAL 18 1HG1 VAL 18 1.315 4.819 -5.870
282 HG12 VAL 18 2HG1 VAL 18 1.135 3.670 -4.544
283 HG13 VAL 18 3HG1 VAL 18 1.968 3.188 -6.022
284 HG21 VAL 18 3HG2 VAL 18 2.617 3.403 -2.960
285 HG22 VAL 18 1HG2 VAL 18 4.255 4.056 -2.992
286 HG23 VAL 18 2HG2 VAL 18 3.852 2.637 -3.956
287 H CYS 19 H CYS 19 5.678 3.242 -4.172
288 HA CYS 19 HA CYS 19 7.167 5.482 -3.176
289 HB2 CYS 19 2HB CYS 19 7.365 2.501 -2.958
290 HB3 CYS 19 1HB CYS 19 8.733 3.481 -2.437
291 H GLY 20 H GLY 20 8.324 2.693 -5.068
292 HA2 GLY 20 2HA GLY 20 9.869 2.679 -6.875
293 HA3 GLY 20 1HA GLY 20 9.920 4.443 -6.801
294 H GLU 21 H GLU 21 12.259 4.432 -6.850
295 HA GLU 21 HA GLU 21 13.775 2.979 -4.843
296 HB2 GLU 21 2HB GLU 21 14.392 4.980 -6.975
297 HB3 GLU 21 1HB GLU 21 15.561 4.787 -5.667
298 HG2 GLU 21 2HG GLU 21 15.185 2.207 -6.162
299 HG3 GLU 21 1HG GLU 21 14.701 2.813 -7.747
300 H ARG 22 H ARG 22 11.825 4.405 -3.474
301 HA ARG 22 HA ARG 22 13.504 6.387 -2.021
302 HE ARG 22 HE ARG 22 9.482 8.656 -1.096
303 HB2 ARG 22 2HB ARG 22 11.592 7.805 -1.666
304 HB3 ARG 22 1HB ARG 22 11.668 7.466 -3.395
305 HG2 ARG 22 2HG ARG 22 10.048 5.565 -2.999
306 HG3 ARG 22 1HG ARG 22 9.859 6.165 -1.349
307 HD2 ARG 22 2HD ARG 22 9.281 7.711 -3.894
308 HD3 ARG 22 1HD ARG 22 8.084 7.088 -2.757
309 HH11 ARG 22 1HH2 ARG 22 7.676 9.174 -3.911
310 HH12 ARG 22 2HH2 ARG 22 7.965 10.880 -3.978
311 HH21 ARG 22 1HH1 ARG 22 10.247 10.867 -1.370
312 HH22 ARG 22 2HH1 ARG 22 9.420 11.838 -2.543
313 H GLY 23 H GLY 23 11.895 3.463 -1.932
314 HA2 GLY 23 2HA GLY 23 11.682 2.015 -0.069
315 HA3 GLY 23 1HA GLY 23 12.151 3.348 0.981
316 H PHE 24 H PHE 24 9.864 1.326 1.006
317 HA PHE 24 HA PHE 24 7.589 3.260 1.168
318 HD1 PHE 24 HD1 PHE 24 7.514 -0.527 2.714
319 HD2 PHE 24 HD2 PHE 24 8.472 0.071 -1.432
320 HE1 PHE 24 HE1 PHE 24 8.752 -2.675 2.690
321 HE2 PHE 24 HE2 PHE 24 9.710 -2.078 -1.455
322 HZ PHE 24 HZ PHE 24 9.850 -3.452 0.605
323 HB2 PHE 24 2HB PHE 24 6.208 1.079 1.156
324 HB3 PHE 24 1HB PHE 24 6.981 1.536 -0.359
325 H PHE 25 H PHE 25 5.896 2.301 2.887
326 HA PHE 25 HA PHE 25 7.477 1.950 5.388
327 HD1 PHE 25 HD2 PHE 25 6.001 1.082 7.433
328 HD2 PHE 25 HD1 PHE 25 5.871 5.326 6.761
329 HE1 PHE 25 HE2 PHE 25 6.556 1.477 9.817
330 HE2 PHE 25 HE1 PHE 25 6.426 5.719 9.146
331 HZ PHE 25 HZ PHE 25 6.768 3.795 10.674
332 HB2 PHE 25 2HB PHE 25 5.682 3.856 4.932
333 HB3 PHE 25 1HB PHE 25 4.549 2.591 5.404
334 H TYR 26 H TYR 26 4.179 0.954 4.340
335 HA TYR 26 HA TYR 26 3.038 -1.060 4.789
336 HD1 TYR 26 HD1 TYR 26 2.355 -3.200 4.749
337 HD2 TYR 26 HD2 TYR 26 6.520 -4.220 4.410
338 HE1 TYR 26 HE1 TYR 26 1.849 -5.513 5.475
339 HE2 TYR 26 HE2 TYR 26 6.007 -6.532 5.133
340 HH TYR 26 HH TYR 26 2.701 -7.650 5.519
341 HB2 TYR 26 2HB TYR 26 4.437 -1.993 3.085
342 HB3 TYR 26 1HB TYR 26 5.847 -1.978 4.131
343 H THR 27 H THR 27 3.225 0.117 7.119
344 HA THR 27 HA THR 27 4.942 -1.269 9.029
345 HB THR 27 HB THR 27 4.361 1.009 9.519
346 HG1 THR 27 HG1 THR 27 3.173 0.707 11.501
347 HG21 THR 27 3HG2 THR 27 1.712 1.265 9.998
348 HG22 THR 27 1HG2 THR 27 1.668 0.064 8.708
349 HG23 THR 27 2HG2 THR 27 2.444 1.624 8.434
350 H LYS 28 H LYS 28 4.371 -2.934 10.402
351 HA LYS 28 HA LYS 28 1.601 -3.768 10.757
352 HB2 LYS 28 2HB LYS 28 2.151 -4.725 8.510
353 HB3 LYS 28 1HB LYS 28 3.477 -5.620 9.254
354 HG2 LYS 28 2HG LYS 28 2.042 -7.008 10.466
355 HG3 LYS 28 1HG LYS 28 0.709 -5.855 10.396
356 HD2 LYS 28 2HD LYS 28 -0.068 -6.754 8.480
357 HD3 LYS 28 1HD LYS 28 1.526 -6.669 7.728
358 HE2 LYS 28 2HE LYS 28 2.170 -8.742 8.975
359 HE3 LYS 28 1HE LYS 28 0.514 -8.853 9.573
360 HZ1 LYS 28 3HZ LYS 28 0.923 -10.208 7.573
361 HZ2 LYS 28 1HZ LYS 28 1.264 -8.793 6.701
362 HZ3 LYS 28 2HZ LYS 28 -0.291 -9.041 7.341
363 HA PRO 29 HA PRO 29 4.568 -4.858 14.091
364 HB2 PRO 29 2HB PRO 29 3.132 -3.625 16.084
365 HB3 PRO 29 1HB PRO 29 4.375 -2.809 15.119
366 HG2 PRO 29 2HG PRO 29 1.405 -2.576 14.942
367 HG3 PRO 29 1HG PRO 29 2.652 -1.390 14.519
368 HD2 PRO 29 2HD PRO 29 1.231 -2.998 12.689
369 HD3 PRO 29 1HD PRO 29 2.719 -2.097 12.338
370 H THR 30 H THR 30 4.277 -6.636 15.485
371 HA THR 30 HA THR 30 1.528 -7.804 15.511
372 HB THR 30 HB THR 30 4.217 -9.158 15.903
373 HG1 THR 30 HG1 THR 30 4.170 -9.408 13.833
374 HG21 THR 30 3HG2 THR 30 3.082 -10.949 16.646
375 HG22 THR 30 1HG2 THR 30 2.006 -10.891 15.250
376 HG23 THR 30 2HG2 THR 30 1.626 -9.955 16.695
Start of MODEL 4
1 H1 GLY 1 1H GLY 1 -2.929 1.418 11.315
2 H2 GLY 1 2H GLY 1 -2.618 0.117 12.362
3 H3 GLY 1 3H GLY 1 -3.962 0.071 11.325
4 HA2 GLY 1 1HA GLY 1 -1.481 0.349 9.958
5 HA3 GLY 1 2HA GLY 1 -1.605 -1.205 10.839
6 H ILE 2 H ILE 2 -0.928 -1.128 8.277
7 HA ILE 2 HA ILE 2 -3.183 -0.347 6.491
8 HB ILE 2 HB ILE 2 -0.819 0.498 6.040
9 HG12 ILE 2 2HG1 ILE 2 -2.348 -1.147 4.009
10 HG13 ILE 2 1HG1 ILE 2 -2.450 0.591 4.279
11 HG21 ILE 2 1HG2 ILE 2 0.886 -0.947 5.606
12 HG22 ILE 2 2HG2 ILE 2 -0.158 -2.071 4.738
13 HG23 ILE 2 3HG2 ILE 2 -0.103 -2.100 6.501
14 HD11 ILE 2 3HD1 ILE 2 -0.714 0.977 2.895
15 HD12 ILE 2 1HD1 ILE 2 -0.800 -0.719 2.428
16 HD13 ILE 2 2HD1 ILE 2 0.288 -0.213 3.720
17 H THR 3 H THR 3 -1.405 -3.081 7.722
18 HA THR 3 HA THR 3 -2.229 -4.959 5.683
19 HB THR 3 HB THR 3 -1.361 -5.426 8.553
20 HG1 THR 3 HG1 THR 3 0.067 -4.432 6.846
21 HG21 THR 3 3HG2 THR 3 -1.842 -7.287 6.222
22 HG22 THR 3 1HG2 THR 3 -2.514 -7.385 7.849
23 HG23 THR 3 2HG2 THR 3 -0.806 -7.730 7.578
24 H GLU 4 H GLU 4 -3.722 -3.603 8.497
25 HA GLU 4 HA GLU 4 -5.918 -5.611 8.367
26 HB2 GLU 4 2HB GLU 4 -5.021 -5.183 10.608
27 HB3 GLU 4 1HB GLU 4 -5.311 -3.454 10.415
28 HG2 GLU 4 2HG GLU 4 -7.432 -3.708 11.114
29 HG3 GLU 4 1HG GLU 4 -7.737 -4.866 9.819
30 H GLN 5 H GLN 5 -5.756 -3.866 6.194
31 HA GLN 5 HA GLN 5 -8.382 -2.707 6.188
32 HB2 GLN 5 2HB GLN 5 -6.760 -1.062 7.548
33 HB3 GLN 5 1HB GLN 5 -6.342 -0.540 5.915
34 HG2 GLN 5 2HG GLN 5 -8.176 0.838 6.621
35 HG3 GLN 5 1HG GLN 5 -8.838 -0.326 5.472
36 HE21 GLN 5 1HE2 GLN 5 -10.303 -1.952 6.278
37 HE22 GLN 5 2HE2 GLN 5 -10.889 -1.938 7.871
38 H CYS 6 H CYS 6 -5.129 -2.760 4.818
39 HA CYS 6 HA CYS 6 -6.181 -2.170 2.122
40 HB2 CYS 6 2HB CYS 6 -3.448 -2.479 3.324
41 HB3 CYS 6 1HB CYS 6 -3.643 -2.616 1.584
42 H CYS 7 H CYS 7 -5.847 -4.852 4.072
43 HA CYS 7 HA CYS 7 -5.690 -6.605 1.663
44 HB2 CYS 7 2HB CYS 7 -3.740 -6.880 3.159
45 HB3 CYS 7 1HB CYS 7 -4.825 -7.261 4.488
46 H THR 8 H THR 8 -7.454 -5.690 4.485
47 HA THR 8 HA THR 8 -9.284 -8.008 4.255
48 HB THR 8 HB THR 8 -8.990 -7.409 6.521
49 HG1 THR 8 HG1 THR 8 -11.004 -6.285 7.040
50 HG21 THR 8 3HG2 THR 8 -8.879 -4.647 5.404
51 HG22 THR 8 1HG2 THR 8 -7.853 -5.410 6.619
52 HG23 THR 8 2HG2 THR 8 -9.460 -4.832 7.059
53 H SER 9 H SER 9 -8.799 -5.155 2.676
54 HA SER 9 HA SER 9 -11.370 -5.213 1.367
55 HG SER 9 HG SER 9 -13.270 -4.198 2.914
56 HB2 SER 9 2HB SER 9 -11.358 -3.763 3.739
57 HB3 SER 9 1HB SER 9 -11.063 -2.533 2.513
58 H ILE 10 H ILE 10 -11.369 -2.668 0.230
59 HA ILE 10 HA ILE 10 -8.758 -2.730 -1.195
60 HB ILE 10 HB ILE 10 -11.434 -1.519 -1.910
61 HG12 ILE 10 2HG1 ILE 10 -9.809 -3.685 -3.268
62 HG13 ILE 10 1HG1 ILE 10 -11.075 -4.023 -2.085
63 HG21 ILE 10 1HG2 ILE 10 -8.962 -1.594 -3.649
64 HG22 ILE 10 2HG2 ILE 10 -9.359 -0.195 -2.652
65 HG23 ILE 10 3HG2 ILE 10 -10.461 -0.710 -3.929
66 HD11 ILE 10 3HD1 ILE 10 -12.310 -4.118 -4.035
67 HD12 ILE 10 1HD1 ILE 10 -11.311 -2.913 -4.848
68 HD13 ILE 10 2HD1 ILE 10 -12.488 -2.410 -3.635
69 H CYS 11 H CYS 11 -7.353 -1.039 -1.078
70 HA CYS 11 HA CYS 11 -8.092 1.229 0.689
71 HB2 CYS 11 2HB CYS 11 -5.502 0.053 -0.287
72 HB3 CYS 11 1HB CYS 11 -5.538 1.725 0.266
73 H SER 12 H SER 12 -6.852 3.360 -0.157
74 HA SER 12 HA SER 12 -7.716 3.717 -3.001
75 HG SER 12 HG SER 12 -6.785 5.660 -0.143
76 HB2 SER 12 2HB SER 12 -7.637 6.232 -2.192
77 HB3 SER 12 1HB SER 12 -9.036 5.227 -1.826
78 H LEU 13 H LEU 13 -5.998 3.765 -4.339
79 HA LEU 13 HA LEU 13 -3.314 3.849 -3.806
80 HG LEU 13 HG LEU 13 -5.930 5.434 -5.449
81 HB2 LEU 13 2HB LEU 13 -3.088 5.218 -5.991
82 HB3 LEU 13 1HB LEU 13 -3.853 3.641 -6.066
83 HD11 LEU 13 1HD1 LEU 13 -4.165 7.143 -6.305
84 HD12 LEU 13 2HD1 LEU 13 -5.787 7.207 -6.995
85 HD13 LEU 13 3HD1 LEU 13 -4.477 6.439 -7.891
86 HD21 LEU 13 3HD2 LEU 13 -6.905 4.406 -7.254
87 HD22 LEU 13 1HD2 LEU 13 -5.528 3.319 -7.072
88 HD23 LEU 13 2HD2 LEU 13 -5.478 4.611 -8.271
89 H TYR 14 H TYR 14 -5.480 6.591 -4.055
90 HA TYR 14 HA TYR 14 -3.802 8.785 -3.822
91 HD1 TYR 14 HD1 TYR 14 -4.266 10.777 -4.214
92 HD2 TYR 14 HD2 TYR 14 -6.775 10.211 -0.772
93 HE1 TYR 14 HE1 TYR 14 -3.945 13.157 -3.588
94 HE2 TYR 14 HE2 TYR 14 -6.457 12.590 -0.146
95 HH TYR 14 HH TYR 14 -5.865 14.782 -1.506
96 HB2 TYR 14 2HB TYR 14 -6.322 8.841 -3.827
97 HB3 TYR 14 1HB TYR 14 -6.279 8.385 -2.125
98 H GLN 15 H GLN 15 -5.232 7.279 -0.949
99 HA GLN 15 HA GLN 15 -3.249 8.343 0.843
100 HB2 GLN 15 2HB GLN 15 -5.338 6.189 1.048
101 HB3 GLN 15 1HB GLN 15 -4.173 6.432 2.347
102 HG2 GLN 15 2HG GLN 15 -5.522 8.067 3.129
103 HG3 GLN 15 1HG GLN 15 -5.083 9.009 1.704
104 HE21 GLN 15 1HE2 GLN 15 -7.415 6.461 2.733
105 HE22 GLN 15 2HE2 GLN 15 -8.661 6.977 1.703
106 H LEU 16 H LEU 16 -3.725 5.267 -0.748
107 HA LEU 16 HA LEU 16 -1.844 3.570 0.287
108 HG LEU 16 HG LEU 16 -2.268 1.482 -2.571
109 HB2 LEU 16 2HB LEU 16 -3.330 3.572 -1.954
110 HB3 LEU 16 1HB LEU 16 -1.761 3.921 -2.674
111 HD11 LEU 16 1HD1 LEU 16 -0.029 1.939 -0.648
112 HD12 LEU 16 2HD1 LEU 16 0.080 2.678 -2.245
113 HD13 LEU 16 3HD1 LEU 16 -0.079 0.928 -2.091
114 HD21 LEU 16 3HD2 LEU 16 -1.707 1.249 0.278
115 HD22 LEU 16 1HD2 LEU 16 -2.991 0.505 -0.674
116 HD23 LEU 16 2HD2 LEU 16 -3.201 2.134 -0.029
117 H GLU 17 H GLU 17 -1.203 6.346 -1.806
118 HA GLU 17 HA GLU 17 1.639 5.804 -2.036
119 HB2 GLU 17 2HB GLU 17 0.730 7.054 -3.812
120 HB3 GLU 17 1HB GLU 17 -0.142 8.133 -2.726
121 HG2 GLU 17 2HG GLU 17 2.067 9.011 -1.919
122 HG3 GLU 17 1HG GLU 17 2.861 8.019 -3.143
123 H ASN 18 H ASN 18 -0.342 7.459 0.280
124 HA ASN 18 HA ASN 18 1.740 9.127 1.385
125 HB2 ASN 18 2HB ASN 18 -0.697 9.525 1.743
126 HB3 ASN 18 1HB ASN 18 -0.753 8.086 2.760
127 HD21 ASN 18 1HD2 ASN 18 0.605 8.137 4.776
128 HD22 ASN 18 2HD2 ASN 18 0.990 9.633 5.481
129 H TYR 19 H TYR 19 1.521 5.798 1.332
130 HA TYR 19 HA TYR 19 2.621 5.465 4.065
131 HD1 TYR 19 HD2 TYR 19 0.954 5.102 5.093
132 HD2 TYR 19 HD1 TYR 19 -0.224 2.709 1.724
133 HE1 TYR 19 HE2 TYR 19 -1.423 5.337 5.758
134 HE2 TYR 19 HE1 TYR 19 -2.603 2.943 2.389
135 HH TYR 19 HH TYR 19 -3.973 4.652 3.738
136 HB2 TYR 19 2HB TYR 19 2.021 3.375 1.949
137 HB3 TYR 19 1HB TYR 19 2.457 3.061 3.629
138 H CYS 20 H CYS 20 4.095 6.824 1.793
139 HA CYS 20 HA CYS 20 6.323 4.903 1.390
140 HB2 CYS 20 2HB CYS 20 5.277 6.623 -0.376
141 HB3 CYS 20 1HB CYS 20 6.500 7.672 0.304
142 H ASN 21 H ASN 21 8.483 6.531 1.281
143 HA ASN 21 HA ASN 21 8.783 7.334 4.128
144 HB2 ASN 21 2HB ASN 21 10.363 5.670 2.943
145 HB3 ASN 21 1HB ASN 21 11.009 7.081 2.105
146 HD21 ASN 21 1HD2 ASN 21 11.956 8.828 3.495
147 HD22 ASN 21 2HD2 ASN 21 12.563 8.435 5.031
148 HA PHE 1 HA PHE 1 -9.495 2.426 -12.747
149 HD1 PHE 1 HD2 PHE 1 -7.029 3.308 -14.456
150 HD2 PHE 1 HD1 PHE 1 -6.447 4.671 -10.422
151 HE1 PHE 1 HE2 PHE 1 -5.832 5.311 -15.303
152 HE2 PHE 1 HE1 PHE 1 -5.250 6.671 -11.269
153 HZ PHE 1 HZ PHE 1 -4.942 6.991 -13.709
154 H1 PHE 1 1H PHE 1 -9.245 4.709 -12.873
155 H2 PHE 1 2H PHE 1 -8.662 4.848 -11.283
156 H3 PHE 1 3H PHE 1 -10.308 4.532 -11.562
157 HB2 PHE 1 2HB PHE 1 -7.226 2.438 -10.849
158 HB3 PHE 1 1HB PHE 1 -7.317 1.792 -12.486
159 H VAL 2 H VAL 2 -10.483 0.774 -11.631
160 HA VAL 2 HA VAL 2 -10.894 1.210 -8.700
161 HB VAL 2 HB VAL 2 -12.924 1.240 -10.254
162 HG11 VAL 2 1HG1 VAL 2 -13.489 -0.598 -11.483
163 HG12 VAL 2 2HG1 VAL 2 -12.931 -1.720 -10.241
164 HG13 VAL 2 3HG1 VAL 2 -11.772 -0.980 -11.347
165 HG21 VAL 2 3HG2 VAL 2 -14.257 0.306 -8.583
166 HG22 VAL 2 1HG2 VAL 2 -12.753 0.578 -7.702
167 HG23 VAL 2 2HG2 VAL 2 -13.144 -1.033 -8.303
168 H ASN 3 H ASN 3 -11.324 -0.957 -7.534
169 HA ASN 3 HA ASN 3 -10.682 -3.166 -7.010
170 HB2 ASN 3 2HB ASN 3 -9.193 -3.314 -9.629
171 HB3 ASN 3 1HB ASN 3 -9.907 -4.628 -8.694
172 HD21 ASN 3 1HD2 ASN 3 -10.416 -2.936 -11.480
173 HD22 ASN 3 2HD2 ASN 3 -12.110 -3.018 -11.568
174 H GLN 4 H GLN 4 -9.326 -2.145 -5.396
175 HA GLN 4 HA GLN 4 -6.433 -2.219 -6.127
176 HB2 GLN 4 2HB GLN 4 -7.055 0.105 -5.872
177 HB3 GLN 4 1HB GLN 4 -7.890 -0.238 -4.357
178 HG2 GLN 4 2HG GLN 4 -5.787 0.644 -3.705
179 HG3 GLN 4 1HG GLN 4 -5.630 -1.099 -3.498
180 HE21 GLN 4 1HE2 GLN 4 -3.342 0.594 -3.934
181 HE22 GLN 4 2HE2 GLN 4 -2.676 0.196 -5.444
182 H HIS 5 H HIS 5 -6.522 -4.446 -5.273
183 HA HIS 5 HA HIS 5 -7.080 -4.714 -2.379
184 HD2 HIS 5 HD2 HIS 5 -9.070 -4.761 -4.598
185 HE1 HIS 5 HE1 HIS 5 -8.723 -7.724 -7.594
186 HE2 HIS 5 HE2 HIS 5 -10.003 -5.642 -6.861
187 HB2 HIS 5 2HB HIS 5 -5.921 -7.020 -3.825
188 HB3 HIS 5 1HB HIS 5 -7.327 -6.949 -2.767
189 H LEU 6 H LEU 6 -5.436 -5.422 -0.875
190 HA LEU 6 HA LEU 6 -2.651 -5.442 -1.857
191 HG LEU 6 HG LEU 6 -2.795 -2.292 -2.045
192 HB2 LEU 6 2HB LEU 6 -3.878 -3.278 -0.274
193 HB3 LEU 6 1HB LEU 6 -2.404 -3.911 0.421
194 HD11 LEU 6 1HD1 LEU 6 -1.436 -2.090 0.352
195 HD12 LEU 6 2HD1 LEU 6 -1.159 -1.082 -1.069
196 HD13 LEU 6 3HD1 LEU 6 -0.157 -2.504 -0.790
197 HD21 LEU 6 3HD2 LEU 6 -0.478 -3.277 -2.814
198 HD22 LEU 6 1HD2 LEU 6 -1.957 -4.117 -3.278
199 HD23 LEU 6 2HD2 LEU 6 -0.987 -4.708 -1.928
200 H CYS 7 H CYS 7 -1.477 -6.933 -0.846
201 HA CYS 7 HA CYS 7 -1.963 -7.616 1.959
202 HB2 CYS 7 2HB CYS 7 -2.431 -9.677 -0.236
203 HB3 CYS 7 1HB CYS 7 -2.361 -10.036 1.486
204 H GLY 8 H GLY 8 -0.014 -8.170 2.822
205 HA2 GLY 8 2HA GLY 8 2.358 -8.379 2.800
206 HA3 GLY 8 1HA GLY 8 1.885 -9.950 2.169
207 H SER 9 H SER 9 2.918 -10.493 0.346
208 HA SER 9 HA SER 9 4.767 -9.034 -1.068
209 HG SER 9 HG SER 9 5.243 -10.734 -3.392
210 HB2 SER 9 2HB SER 9 3.478 -11.488 -1.438
211 HB3 SER 9 1HB SER 9 3.186 -10.610 -2.937
212 H ASP 10 H ASP 10 1.296 -9.208 -1.931
213 HA ASP 10 HA ASP 10 1.529 -7.325 -4.091
214 HB2 ASP 10 2HB ASP 10 -0.959 -7.843 -2.455
215 HB3 ASP 10 1HB ASP 10 -0.856 -7.375 -4.147
216 H LEU 11 H LEU 11 1.360 -7.027 -0.672
217 HA LEU 11 HA LEU 11 0.290 -4.400 -0.384
218 HG LEU 11 HG LEU 11 2.162 -3.661 2.403
219 HB2 LEU 11 2HB LEU 11 0.848 -6.127 1.439
220 HB3 LEU 11 1HB LEU 11 2.520 -5.611 1.278
221 HD11 LEU 11 1HD1 LEU 11 -0.553 -3.604 1.078
222 HD12 LEU 11 2HD1 LEU 11 0.828 -2.551 0.761
223 HD13 LEU 11 3HD1 LEU 11 -0.049 -2.422 2.285
224 HD21 LEU 11 3HD2 LEU 11 0.990 -4.188 4.268
225 HD22 LEU 11 1HD2 LEU 11 0.734 -5.739 3.468
226 HD23 LEU 11 2HD2 LEU 11 -0.496 -4.480 3.365
227 H VAL 12 H VAL 12 3.684 -5.491 -0.757
228 HA VAL 12 HA VAL 12 4.706 -2.787 -0.895
229 HB VAL 12 HB VAL 12 6.730 -3.982 -1.925
230 HG11 VAL 12 1HG1 VAL 12 7.389 -4.919 0.235
231 HG12 VAL 12 2HG1 VAL 12 5.701 -4.996 0.742
232 HG13 VAL 12 3HG1 VAL 12 6.479 -3.432 0.498
233 HG21 VAL 12 3HG2 VAL 12 5.282 -6.465 -1.008
234 HG22 VAL 12 1HG2 VAL 12 6.750 -6.349 -1.980
235 HG23 VAL 12 2HG2 VAL 12 5.191 -5.916 -2.681
236 H GLU 13 H GLU 13 3.215 -4.962 -3.132
237 HA GLU 13 HA GLU 13 4.228 -3.936 -5.593
238 HB2 GLU 13 2HB GLU 13 2.728 -5.995 -5.213
239 HB3 GLU 13 1HB GLU 13 1.377 -4.861 -5.175
240 HG2 GLU 13 2HG GLU 13 2.836 -4.091 -7.424
241 HG3 GLU 13 1HG GLU 13 2.888 -5.855 -7.464
242 H ALA 14 H ALA 14 1.223 -3.081 -3.830
243 HA ALA 14 HA ALA 14 0.511 -0.864 -5.470
244 HB1 ALA 14 3HB ALA 14 -1.026 -1.813 -3.799
245 HB2 ALA 14 1HB ALA 14 -0.783 -0.092 -3.496
246 HB3 ALA 14 2HB ALA 14 0.050 -1.288 -2.504
247 H LEU 15 H LEU 15 2.301 -0.977 -2.402
248 HA LEU 15 HA LEU 15 2.989 1.772 -2.270
249 HG LEU 15 HG LEU 15 2.361 -0.728 -0.364
250 HB2 LEU 15 2HB LEU 15 4.596 -0.624 -1.315
251 HB3 LEU 15 1HB LEU 15 4.798 1.034 -0.765
252 HD11 LEU 15 1HD1 LEU 15 3.267 0.422 2.031
253 HD12 LEU 15 2HD1 LEU 15 4.729 -0.086 1.185
254 HD13 LEU 15 3HD1 LEU 15 3.457 -1.258 1.530
255 HD21 LEU 15 3HD2 LEU 15 1.804 1.682 -0.877
256 HD22 LEU 15 1HD2 LEU 15 2.784 2.150 0.510
257 HD23 LEU 15 2HD2 LEU 15 1.332 1.176 0.743
258 H TYR 16 H TYR 16 4.496 -0.943 -3.965
259 HA TYR 16 HA TYR 16 6.939 0.274 -4.697
260 HD1 TYR 16 HD2 TYR 16 8.640 -0.274 -5.482
261 HD2 TYR 16 HD1 TYR 16 6.459 -3.954 -5.075
262 HE1 TYR 16 HE2 TYR 16 10.685 -1.392 -4.631
263 HE2 TYR 16 HE1 TYR 16 8.503 -5.073 -4.225
264 HH TYR 16 HH TYR 16 11.050 -4.679 -4.468
265 HB2 TYR 16 2HB TYR 16 5.310 -1.978 -5.633
266 HB3 TYR 16 1HB TYR 16 6.256 -1.228 -6.919
267 H LEU 17 H LEU 17 4.141 -0.042 -6.906
268 HA LEU 17 HA LEU 17 5.047 1.774 -8.832
269 HG LEU 17 HG LEU 17 2.480 0.633 -6.775
270 HB2 LEU 17 2HB LEU 17 2.517 2.153 -9.277
271 HB3 LEU 17 1HB LEU 17 3.181 0.534 -9.478
272 HD11 LEU 17 1HD1 LEU 17 0.115 1.661 -8.324
273 HD12 LEU 17 2HD1 LEU 17 1.223 2.777 -7.524
274 HD13 LEU 17 3HD1 LEU 17 0.341 1.578 -6.576
275 HD21 LEU 17 3HD2 LEU 17 2.052 -1.367 -7.876
276 HD22 LEU 17 1HD2 LEU 17 1.344 -0.563 -9.277
277 HD23 LEU 17 2HD2 LEU 17 0.419 -0.709 -7.783
278 H VAL 18 H VAL 18 3.705 2.538 -5.684
279 HA VAL 18 HA VAL 18 3.343 5.372 -6.482
280 HB VAL 18 HB VAL 18 2.500 5.695 -4.188
281 HG11 VAL 18 1HG1 VAL 18 1.013 4.844 -6.026
282 HG12 VAL 18 2HG1 VAL 18 0.487 4.375 -4.408
283 HG13 VAL 18 3HG1 VAL 18 1.316 3.209 -5.439
284 HG21 VAL 18 3HG2 VAL 18 3.909 4.091 -3.011
285 HG22 VAL 18 1HG2 VAL 18 3.166 2.761 -3.898
286 HG23 VAL 18 2HG2 VAL 18 2.215 3.686 -2.741
287 H CYS 19 H CYS 19 5.200 3.449 -4.203
288 HA CYS 19 HA CYS 19 6.774 5.632 -3.186
289 HB2 CYS 19 2HB CYS 19 6.906 2.647 -3.079
290 HB3 CYS 19 1HB CYS 19 8.375 3.541 -2.705
291 H GLY 20 H GLY 20 7.660 2.962 -5.391
292 HA2 GLY 20 2HA GLY 20 9.081 3.026 -7.290
293 HA3 GLY 20 1HA GLY 20 9.274 4.766 -7.046
294 H GLU 21 H GLU 21 11.631 4.109 -7.469
295 HA GLU 21 HA GLU 21 13.027 2.626 -5.410
296 HB2 GLU 21 2HB GLU 21 13.794 3.006 -7.829
297 HB3 GLU 21 1HB GLU 21 14.281 4.619 -7.306
298 HG2 GLU 21 2HG GLU 21 16.241 3.340 -7.021
299 HG3 GLU 21 1HG GLU 21 15.543 3.386 -5.401
300 H ARG 22 H ARG 22 11.498 4.468 -4.070
301 HA ARG 22 HA ARG 22 13.514 6.431 -3.095
302 HE ARG 22 HE ARG 22 12.645 10.632 -4.847
303 HB2 ARG 22 2HB ARG 22 10.611 6.686 -3.681
304 HB3 ARG 22 1HB ARG 22 11.162 7.443 -2.186
305 HG2 ARG 22 2HG ARG 22 13.064 8.027 -4.249
306 HG3 ARG 22 1HG ARG 22 11.451 8.420 -4.847
307 HD2 ARG 22 2HD ARG 22 11.016 9.776 -2.850
308 HD3 ARG 22 1HD ARG 22 12.599 9.351 -2.198
309 HH11 ARG 22 1HH2 ARG 22 14.693 10.551 -2.476
310 HH12 ARG 22 2HH2 ARG 22 14.697 12.228 -2.041
311 HH21 ARG 22 1HH1 ARG 22 11.828 12.975 -3.840
312 HH22 ARG 22 2HH1 ARG 22 13.078 13.601 -2.816
313 H GLY 23 H GLY 23 11.619 3.676 -2.427
314 HA2 GLY 23 2HA GLY 23 12.082 2.402 -0.387
315 HA3 GLY 23 1HA GLY 23 12.343 3.925 0.460
316 H PHE 24 H PHE 24 10.299 1.462 0.491
317 HA PHE 24 HA PHE 24 7.871 3.172 0.836
318 HD1 PHE 24 HD2 PHE 24 9.298 1.441 -1.925
319 HD2 PHE 24 HD1 PHE 24 7.969 -1.406 1.006
320 HE1 PHE 24 HE2 PHE 24 10.868 -0.244 -2.849
321 HE2 PHE 24 HE1 PHE 24 9.536 -3.092 0.082
322 HZ PHE 24 HZ PHE 24 10.987 -2.511 -1.846
323 HB2 PHE 24 2HB PHE 24 6.857 0.655 0.800
324 HB3 PHE 24 1HB PHE 24 7.049 1.627 -0.652
325 H PHE 25 H PHE 25 6.280 1.877 2.437
326 HA PHE 25 HA PHE 25 7.834 0.896 4.781
327 HD1 PHE 25 HD1 PHE 25 8.589 1.178 6.474
328 HD2 PHE 25 HD2 PHE 25 4.998 3.403 7.261
329 HE1 PHE 25 HE1 PHE 25 8.813 0.682 8.894
330 HE2 PHE 25 HE2 PHE 25 5.222 2.907 9.683
331 HZ PHE 25 HZ PHE 25 7.130 1.546 10.498
332 HB2 PHE 25 2HB PHE 25 7.355 3.392 4.962
333 HB3 PHE 25 1HB PHE 25 5.643 2.971 5.032
334 H TYR 26 H TYR 26 6.904 -1.182 4.148
335 HA TYR 26 HA TYR 26 3.973 -1.463 4.225
336 HD1 TYR 26 HD1 TYR 26 2.789 -3.415 4.811
337 HD2 TYR 26 HD2 TYR 26 6.226 -5.667 3.540
338 HE1 TYR 26 HE1 TYR 26 1.728 -5.498 5.631
339 HE2 TYR 26 HE2 TYR 26 5.162 -7.746 4.362
340 HH TYR 26 HH TYR 26 2.716 -7.862 6.459
341 HB2 TYR 26 2HB TYR 26 4.896 -2.913 2.634
342 HB3 TYR 26 1HB TYR 26 6.305 -3.261 3.617
343 H THR 27 H THR 27 4.213 -0.464 6.576
344 HA THR 27 HA THR 27 5.158 -2.345 8.610
345 HB THR 27 HB THR 27 5.311 0.024 9.092
346 HG1 THR 27 HG1 THR 27 3.091 -0.799 10.606
347 HG21 THR 27 3HG2 THR 27 3.116 1.320 9.335
348 HG22 THR 27 1HG2 THR 27 2.361 0.001 8.441
349 HG23 THR 27 2HG2 THR 27 3.633 0.962 7.687
350 H LYS 28 H LYS 28 3.506 -2.863 10.455
351 HA LYS 28 HA LYS 28 0.754 -3.282 9.499
352 HB2 LYS 28 2HB LYS 28 1.428 -5.817 10.518
353 HB3 LYS 28 1HB LYS 28 1.054 -5.419 8.844
354 HG2 LYS 28 2HG LYS 28 3.175 -6.466 8.735
355 HG3 LYS 28 1HG LYS 28 3.540 -4.744 8.643
356 HD2 LYS 28 2HD LYS 28 4.206 -4.658 10.932
357 HD3 LYS 28 1HD LYS 28 3.512 -6.245 11.266
358 HE2 LYS 28 2HE LYS 28 5.228 -7.379 10.142
359 HE3 LYS 28 1HE LYS 28 5.680 -5.957 9.200
360 HZ1 LYS 28 3HZ LYS 28 7.326 -6.148 10.818
361 HZ2 LYS 28 1HZ LYS 28 6.223 -6.523 12.050
362 HZ3 LYS 28 2HZ LYS 28 6.297 -4.942 11.430
363 HA PRO 29 HA PRO 29 0.064 -2.735 13.787
364 HB2 PRO 29 2HB PRO 29 -2.538 -3.620 13.875
365 HB3 PRO 29 1HB PRO 29 -2.057 -2.040 13.228
366 HG2 PRO 29 2HG PRO 29 -2.890 -4.498 11.757
367 HG3 PRO 29 1HG PRO 29 -3.025 -2.800 11.272
368 HD2 PRO 29 2HD PRO 29 -1.065 -4.618 10.362
369 HD3 PRO 29 1HD PRO 29 -1.009 -2.853 10.183
370 H THR 30 H THR 30 -1.604 -4.328 15.399
371 HA THR 30 HA THR 30 -0.067 -6.886 15.437
372 HB THR 30 HB THR 30 -1.706 -6.280 17.791
373 HG1 THR 30 HG1 THR 30 -1.003 -4.350 18.179
374 HG21 THR 30 3HG2 THR 30 0.304 -6.907 18.943
375 HG22 THR 30 1HG2 THR 30 1.285 -6.629 17.505
376 HG23 THR 30 2HG2 THR 30 0.155 -7.982 17.553
Start of MODEL 5
1 H1 GLY 1 1H GLY 1 -0.924 0.777 9.992
2 H2 GLY 1 2H GLY 1 -0.903 -0.887 10.337
3 H3 GLY 1 3H GLY 1 -1.408 0.221 11.521
4 HA2 GLY 1 1HA GLY 1 -3.153 -1.036 10.026
5 HA3 GLY 1 2HA GLY 1 -3.494 0.602 10.661
6 H ILE 2 H ILE 2 -1.165 -0.272 8.122
7 HA ILE 2 HA ILE 2 -3.062 0.250 5.976
8 HB ILE 2 HB ILE 2 -0.851 1.038 5.588
9 HG12 ILE 2 2HG1 ILE 2 0.037 -0.525 3.715
10 HG13 ILE 2 1HG1 ILE 2 -1.367 -1.528 4.052
11 HG21 ILE 2 1HG2 ILE 2 -0.128 -1.450 6.920
12 HG22 ILE 2 2HG2 ILE 2 0.714 0.098 6.872
13 HG23 ILE 2 3HG2 ILE 2 0.912 -1.054 5.553
14 HD11 ILE 2 3HD1 ILE 2 -1.244 1.224 2.852
15 HD12 ILE 2 1HD1 ILE 2 -2.685 0.753 3.754
16 HD13 ILE 2 2HD1 ILE 2 -2.187 -0.175 2.339
17 H THR 3 H THR 3 -1.511 -2.598 7.371
18 HA THR 3 HA THR 3 -2.562 -4.373 5.288
19 HB THR 3 HB THR 3 -1.174 -4.862 7.936
20 HG1 THR 3 HG1 THR 3 0.380 -5.735 6.392
21 HG21 THR 3 3HG2 THR 3 -2.264 -6.839 5.919
22 HG22 THR 3 1HG2 THR 3 -2.687 -6.714 7.626
23 HG23 THR 3 2HG2 THR 3 -1.077 -7.259 7.154
24 H GLU 4 H GLU 4 -3.775 -2.879 8.087
25 HA GLU 4 HA GLU 4 -5.817 -4.996 8.517
26 HB2 GLU 4 2HB GLU 4 -4.442 -3.626 10.366
27 HB3 GLU 4 1HB GLU 4 -5.777 -2.495 10.144
28 HG2 GLU 4 2HG GLU 4 -6.810 -3.822 11.689
29 HG3 GLU 4 1HG GLU 4 -7.149 -4.836 10.286
30 H GLN 5 H GLN 5 -5.811 -3.288 6.109
31 HA GLN 5 HA GLN 5 -8.603 -2.534 6.139
32 HB2 GLN 5 2HB GLN 5 -7.165 -0.586 7.301
33 HB3 GLN 5 1HB GLN 5 -6.885 -0.146 5.615
34 HG2 GLN 5 2HG GLN 5 -9.545 -0.585 5.513
35 HG3 GLN 5 1HG GLN 5 -9.400 -0.078 7.197
36 HE21 GLN 5 1HE2 GLN 5 -7.765 1.966 7.369
37 HE22 GLN 5 2HE2 GLN 5 -8.088 3.204 6.253
38 H CYS 6 H CYS 6 -5.431 -2.123 4.610
39 HA CYS 6 HA CYS 6 -6.631 -1.900 1.940
40 HB2 CYS 6 2HB CYS 6 -3.802 -1.973 2.984
41 HB3 CYS 6 1HB CYS 6 -4.142 -2.051 1.264
42 H CYS 7 H CYS 7 -6.180 -4.409 4.004
43 HA CYS 7 HA CYS 7 -5.770 -6.314 1.738
44 HB2 CYS 7 2HB CYS 7 -3.855 -6.473 3.143
45 HB3 CYS 7 1HB CYS 7 -4.824 -6.439 4.609
46 H THR 8 H THR 8 -8.023 -5.065 3.773
47 HA THR 8 HA THR 8 -9.504 -7.647 4.031
48 HB THR 8 HB THR 8 -9.194 -6.383 6.147
49 HG1 THR 8 HG1 THR 8 -11.872 -5.965 5.543
50 HG21 THR 8 3HG2 THR 8 -10.709 -4.218 4.662
51 HG22 THR 8 1HG2 THR 8 -9.037 -4.129 5.217
52 HG23 THR 8 2HG2 THR 8 -10.353 -4.195 6.389
53 H SER 9 H SER 9 -9.312 -4.695 2.329
54 HA SER 9 HA SER 9 -11.796 -5.342 0.866
55 HG SER 9 HG SER 9 -13.587 -3.450 0.738
56 HB2 SER 9 2HB SER 9 -12.551 -3.785 2.618
57 HB3 SER 9 1HB SER 9 -11.289 -2.643 2.164
58 H ILE 10 H ILE 10 -11.410 -2.389 -0.179
59 HA ILE 10 HA ILE 10 -9.009 -2.999 -1.858
60 HB ILE 10 HB ILE 10 -11.383 -1.435 -2.876
61 HG12 ILE 10 2HG1 ILE 10 -12.255 -3.633 -2.224
62 HG13 ILE 10 1HG1 ILE 10 -12.132 -3.543 -3.981
63 HG21 ILE 10 1HG2 ILE 10 -10.444 -2.111 -5.056
64 HG22 ILE 10 2HG2 ILE 10 -9.183 -3.027 -4.231
65 HG23 ILE 10 3HG2 ILE 10 -9.234 -1.270 -4.087
66 HD11 ILE 10 3HD1 ILE 10 -11.122 -5.596 -2.508
67 HD12 ILE 10 1HD1 ILE 10 -9.712 -4.543 -2.602
68 HD13 ILE 10 2HD1 ILE 10 -10.484 -5.114 -4.080
69 H CYS 11 H CYS 11 -7.494 -1.397 -1.814
70 HA CYS 11 HA CYS 11 -8.265 1.165 -0.501
71 HB2 CYS 11 2HB CYS 11 -5.744 -0.411 -0.714
72 HB3 CYS 11 1HB CYS 11 -5.588 1.343 -0.651
73 H SER 12 H SER 12 -7.210 3.152 -1.394
74 HA SER 12 HA SER 12 -7.060 3.007 -4.379
75 HG SER 12 HG SER 12 -8.328 6.359 -2.481
76 HB2 SER 12 2HB SER 12 -7.971 5.212 -4.473
77 HB3 SER 12 1HB SER 12 -8.962 4.346 -3.303
78 H LEU 13 H LEU 13 -5.102 3.534 -5.240
79 HA LEU 13 HA LEU 13 -2.775 3.853 -3.854
80 HG LEU 13 HG LEU 13 -2.837 5.718 -7.602
81 HB2 LEU 13 2HB LEU 13 -1.727 4.566 -5.771
82 HB3 LEU 13 1HB LEU 13 -3.135 3.717 -6.373
83 HD11 LEU 13 1HD1 LEU 13 -5.035 6.084 -7.716
84 HD12 LEU 13 2HD1 LEU 13 -5.058 6.806 -6.109
85 HD13 LEU 13 3HD1 LEU 13 -5.189 5.059 -6.292
86 HD21 LEU 13 3HD2 LEU 13 -3.389 7.673 -5.515
87 HD22 LEU 13 1HD2 LEU 13 -2.169 7.704 -6.789
88 HD23 LEU 13 2HD2 LEU 13 -1.853 6.837 -5.286
89 H TYR 14 H TYR 14 -5.189 6.266 -4.340
90 HA TYR 14 HA TYR 14 -3.997 8.690 -3.847
91 HD1 TYR 14 HD1 TYR 14 -5.933 9.563 -5.423
92 HD2 TYR 14 HD2 TYR 14 -6.310 10.442 -1.234
93 HE1 TYR 14 HE1 TYR 14 -6.215 11.971 -5.954
94 HE2 TYR 14 HE2 TYR 14 -6.591 12.849 -1.763
95 HH TYR 14 HH TYR 14 -6.467 14.016 -5.135
96 HB2 TYR 14 2HB TYR 14 -6.586 7.796 -3.595
97 HB3 TYR 14 1HB TYR 14 -6.185 8.214 -1.934
98 H GLN 15 H GLN 15 -5.193 6.819 -1.094
99 HA GLN 15 HA GLN 15 -3.412 8.112 0.766
100 HB2 GLN 15 2HB GLN 15 -5.412 5.935 0.841
101 HB3 GLN 15 1HB GLN 15 -4.148 5.844 2.066
102 HG2 GLN 15 2HG GLN 15 -5.744 8.360 1.530
103 HG3 GLN 15 1HG GLN 15 -6.208 7.170 2.745
104 HE21 GLN 15 1HE2 GLN 15 -5.634 9.659 3.752
105 HE22 GLN 15 2HE2 GLN 15 -4.116 9.674 4.511
106 H LEU 16 H LEU 16 -3.414 5.092 -0.989
107 HA LEU 16 HA LEU 16 -1.332 3.651 0.148
108 HG LEU 16 HG LEU 16 -0.429 1.814 -1.465
109 HB2 LEU 16 2HB LEU 16 -2.750 3.602 -2.260
110 HB3 LEU 16 1HB LEU 16 -1.068 3.764 -2.758
111 HD11 LEU 16 1HD1 LEU 16 -1.613 1.521 0.447
112 HD12 LEU 16 2HD1 LEU 16 -2.747 0.626 -0.564
113 HD13 LEU 16 3HD1 LEU 16 -3.037 2.329 -0.210
114 HD21 LEU 16 3HD2 LEU 16 -2.740 0.481 -2.515
115 HD22 LEU 16 1HD2 LEU 16 -1.109 0.539 -3.176
116 HD23 LEU 16 2HD2 LEU 16 -2.281 1.777 -3.621
117 H GLU 17 H GLU 17 -1.135 6.553 -1.826
118 HA GLU 17 HA GLU 17 1.727 6.346 -2.211
119 HB2 GLU 17 2HB GLU 17 0.515 7.562 -3.859
120 HB3 GLU 17 1HB GLU 17 -0.242 8.586 -2.639
121 HG2 GLU 17 2HG GLU 17 2.031 9.456 -2.039
122 HG3 GLU 17 1HG GLU 17 2.702 8.513 -3.370
123 H ASN 18 H ASN 18 -0.237 7.532 0.372
124 HA ASN 18 HA ASN 18 1.848 9.302 1.417
125 HB2 ASN 18 2HB ASN 18 -0.899 8.686 2.084
126 HB3 ASN 18 1HB ASN 18 0.110 8.607 3.524
127 HD21 ASN 18 1HD2 ASN 18 0.030 10.602 4.565
128 HD22 ASN 18 2HD2 ASN 18 0.093 12.109 3.787
129 H TYR 19 H TYR 19 1.084 5.951 1.549
130 HA TYR 19 HA TYR 19 2.690 5.489 3.973
131 HD1 TYR 19 HD2 TYR 19 0.760 5.406 5.063
132 HD2 TYR 19 HD1 TYR 19 -0.560 2.972 1.778
133 HE1 TYR 19 HE2 TYR 19 -1.599 5.846 5.677
134 HE2 TYR 19 HE1 TYR 19 -2.915 3.411 2.387
135 HH TYR 19 HH TYR 19 -3.730 5.497 5.174
136 HB2 TYR 19 2HB TYR 19 1.707 3.393 2.033
137 HB3 TYR 19 1HB TYR 19 2.111 3.189 3.735
138 H CYS 20 H CYS 20 3.429 6.243 0.836
139 HA CYS 20 HA CYS 20 5.465 4.260 0.305
140 HB2 CYS 20 2HB CYS 20 5.939 5.454 -1.606
141 HB3 CYS 20 1HB CYS 20 4.352 6.060 -1.324
142 H ASN 21 H ASN 21 7.729 5.757 -0.219
143 HA ASN 21 HA ASN 21 8.988 5.828 2.349
144 HB2 ASN 21 2HB ASN 21 10.217 5.479 0.205
145 HB3 ASN 21 1HB ASN 21 9.919 7.168 -0.210
146 HD21 ASN 21 1HD2 ASN 21 11.894 8.231 0.093
147 HD22 ASN 21 2HD2 ASN 21 12.863 8.091 1.480
148 HA PHE 1 HA PHE 1 -9.226 3.434 -11.154
149 HD1 PHE 1 HD2 PHE 1 -7.505 4.046 -9.495
150 HD2 PHE 1 HD1 PHE 1 -11.346 5.532 -8.266
151 HE1 PHE 1 HE2 PHE 1 -6.498 6.264 -9.027
152 HE2 PHE 1 HE1 PHE 1 -10.339 7.749 -7.797
153 HZ PHE 1 HZ PHE 1 -7.914 8.116 -8.177
154 H1 PHE 1 1H PHE 1 -11.606 4.568 -10.613
155 H2 PHE 1 2H PHE 1 -12.079 3.190 -11.488
156 H3 PHE 1 3H PHE 1 -10.995 4.305 -12.173
157 HB2 PHE 1 2HB PHE 1 -11.107 3.265 -8.803
158 HB3 PHE 1 1HB PHE 1 -9.505 2.526 -8.743
159 H VAL 2 H VAL 2 -8.439 1.207 -10.511
160 HA VAL 2 HA VAL 2 -10.318 -0.847 -11.596
161 HB VAL 2 HB VAL 2 -7.336 -1.206 -11.377
162 HG11 VAL 2 1HG1 VAL 2 -8.250 -2.364 -13.699
163 HG12 VAL 2 2HG1 VAL 2 -9.638 -2.551 -12.627
164 HG13 VAL 2 3HG1 VAL 2 -8.069 -3.207 -12.160
165 HG21 VAL 2 3HG2 VAL 2 -8.879 0.508 -13.280
166 HG22 VAL 2 1HG2 VAL 2 -7.568 -0.471 -13.940
167 HG23 VAL 2 2HG2 VAL 2 -7.236 0.708 -12.670
168 H ASN 3 H ASN 3 -10.236 -2.974 -10.566
169 HA ASN 3 HA ASN 3 -10.461 -2.943 -7.766
170 HB2 ASN 3 2HB ASN 3 -9.444 -5.395 -9.192
171 HB3 ASN 3 1HB ASN 3 -10.604 -5.285 -7.868
172 HD21 ASN 3 1HD2 ASN 3 -12.726 -4.049 -8.498
173 HD22 ASN 3 2HD2 ASN 3 -13.335 -4.344 -10.054
174 H GLN 4 H GLN 4 -8.903 -2.480 -6.281
175 HA GLN 4 HA GLN 4 -6.111 -3.339 -6.899
176 HB2 GLN 4 2HB GLN 4 -6.234 -0.927 -7.006
177 HB3 GLN 4 1HB GLN 4 -7.101 -0.859 -5.472
178 HG2 GLN 4 2HG GLN 4 -4.887 -0.347 -4.864
179 HG3 GLN 4 1HG GLN 4 -5.020 -2.063 -4.487
180 HE21 GLN 4 1HE2 GLN 4 -2.644 -0.307 -5.424
181 HE22 GLN 4 2HE2 GLN 4 -2.004 -1.167 -6.740
182 H HIS 5 H HIS 5 -5.955 -5.202 -5.671
183 HA HIS 5 HA HIS 5 -6.858 -5.091 -2.838
184 HD2 HIS 5 HD2 HIS 5 -8.382 -5.177 -5.239
185 HE1 HIS 5 HE1 HIS 5 -9.728 -9.036 -6.323
186 HE2 HIS 5 HE2 HIS 5 -10.119 -6.535 -6.619
187 HB2 HIS 5 2HB HIS 5 -5.636 -7.501 -4.176
188 HB3 HIS 5 1HB HIS 5 -6.738 -7.447 -2.807
189 H LEU 6 H LEU 6 -5.347 -4.893 -1.208
190 HA LEU 6 HA LEU 6 -2.485 -5.287 -1.954
191 HG LEU 6 HG LEU 6 -2.704 -2.216 -2.615
192 HB2 LEU 6 2HB LEU 6 -3.853 -2.952 -0.756
193 HB3 LEU 6 1HB LEU 6 -2.402 -3.443 0.092
194 HD11 LEU 6 1HD1 LEU 6 -1.143 -0.795 -1.788
195 HD12 LEU 6 2HD1 LEU 6 -0.167 -2.100 -1.116
196 HD13 LEU 6 3HD1 LEU 6 -1.568 -1.498 -0.229
197 HD21 LEU 6 3HD2 LEU 6 -0.863 -4.520 -2.020
198 HD22 LEU 6 1HD2 LEU 6 -0.256 -3.191 -2.999
199 HD23 LEU 6 2HD2 LEU 6 -1.670 -4.101 -3.529
200 H CYS 7 H CYS 7 -1.264 -6.444 -0.525
201 HA CYS 7 HA CYS 7 -1.870 -6.763 2.249
202 HB2 CYS 7 2HB CYS 7 -3.805 -8.010 1.038
203 HB3 CYS 7 1HB CYS 7 -2.586 -9.221 0.643
204 H GLY 8 H GLY 8 -0.067 -7.694 3.214
205 HA2 GLY 8 2HA GLY 8 2.177 -8.424 3.268
206 HA3 GLY 8 1HA GLY 8 1.522 -9.789 2.365
207 H SER 9 H SER 9 3.104 -10.114 0.836
208 HA SER 9 HA SER 9 4.816 -8.350 -0.402
209 HG SER 9 HG SER 9 3.289 -11.788 -1.236
210 HB2 SER 9 2HB SER 9 4.564 -9.845 -2.477
211 HB3 SER 9 1HB SER 9 5.022 -10.643 -0.975
212 H ASP 10 H ASP 10 1.515 -9.091 -1.603
213 HA ASP 10 HA ASP 10 1.489 -7.323 -3.781
214 HB2 ASP 10 2HB ASP 10 -0.822 -7.849 -1.889
215 HB3 ASP 10 1HB ASP 10 -0.930 -7.334 -3.570
216 H LEU 11 H LEU 11 0.955 -6.684 -0.347
217 HA LEU 11 HA LEU 11 0.071 -3.994 -0.531
218 HG LEU 11 HG LEU 11 1.907 -3.063 2.212
219 HB2 LEU 11 2HB LEU 11 0.043 -5.313 1.560
220 HB3 LEU 11 1HB LEU 11 1.803 -5.299 1.599
221 HD11 LEU 11 1HD1 LEU 11 0.789 -1.950 0.473
222 HD12 LEU 11 2HD1 LEU 11 -0.196 -1.570 1.886
223 HD13 LEU 11 3HD1 LEU 11 -0.714 -2.826 0.763
224 HD21 LEU 11 3HD2 LEU 11 0.687 -4.351 3.949
225 HD22 LEU 11 1HD2 LEU 11 -0.838 -3.881 3.199
226 HD23 LEU 11 2HD2 LEU 11 0.202 -2.655 3.923
227 H VAL 12 H VAL 12 3.432 -5.219 -0.147
228 HA VAL 12 HA VAL 12 4.596 -2.594 -0.376
229 HB VAL 12 HB VAL 12 6.704 -3.888 -0.936
230 HG11 VAL 12 1HG1 VAL 12 6.303 -3.299 1.350
231 HG12 VAL 12 2HG1 VAL 12 6.758 -5.003 1.348
232 HG13 VAL 12 3HG1 VAL 12 5.065 -4.544 1.518
233 HG21 VAL 12 3HG2 VAL 12 5.402 -5.801 -1.973
234 HG22 VAL 12 1HG2 VAL 12 4.954 -6.284 -0.337
235 HG23 VAL 12 2HG2 VAL 12 6.648 -6.288 -0.824
236 H GLU 13 H GLU 13 3.511 -4.964 -2.705
237 HA GLU 13 HA GLU 13 4.955 -4.074 -4.988
238 HB2 GLU 13 2HB GLU 13 3.440 -6.120 -4.807
239 HB3 GLU 13 1HB GLU 13 2.078 -5.018 -5.014
240 HG2 GLU 13 2HG GLU 13 3.147 -4.206 -7.142
241 HG3 GLU 13 1HG GLU 13 4.357 -5.476 -6.959
242 H ALA 14 H ALA 14 1.619 -3.196 -4.034
243 HA ALA 14 HA ALA 14 1.331 -1.083 -5.903
244 HB1 ALA 14 3HB ALA 14 -0.567 -0.404 -4.616
245 HB2 ALA 14 1HB ALA 14 0.073 -1.152 -3.152
246 HB3 ALA 14 2HB ALA 14 -0.488 -2.158 -4.490
247 H LEU 15 H LEU 15 2.694 -1.122 -2.640
248 HA LEU 15 HA LEU 15 3.075 1.748 -2.487
249 HG LEU 15 HG LEU 15 2.106 -0.510 -0.413
250 HB2 LEU 15 2HB LEU 15 4.430 -0.520 -0.992
251 HB3 LEU 15 1HB LEU 15 4.607 1.186 -0.597
252 HD11 LEU 15 1HD1 LEU 15 2.350 -0.251 1.852
253 HD12 LEU 15 2HD1 LEU 15 3.093 1.341 1.695
254 HD13 LEU 15 3HD1 LEU 15 4.047 -0.111 1.392
255 HD21 LEU 15 3HD2 LEU 15 0.936 1.587 0.231
256 HD22 LEU 15 1HD2 LEU 15 1.498 1.657 -1.440
257 HD23 LEU 15 2HD2 LEU 15 2.382 2.511 -0.175
258 H TYR 16 H TYR 16 4.905 -1.006 -3.657
259 HA TYR 16 HA TYR 16 7.453 0.227 -3.942
260 HD1 TYR 16 HD2 TYR 16 9.493 -0.562 -4.926
261 HD2 TYR 16 HD1 TYR 16 6.975 -3.790 -3.616
262 HE1 TYR 16 HE2 TYR 16 11.406 -1.556 -3.700
263 HE2 TYR 16 HE1 TYR 16 8.889 -4.783 -2.389
264 HH TYR 16 HH TYR 16 11.865 -4.283 -2.913
265 HB2 TYR 16 2HB TYR 16 6.080 -2.146 -4.989
266 HB3 TYR 16 1HB TYR 16 7.199 -1.441 -6.154
267 H LEU 17 H LEU 17 4.445 0.734 -5.520
268 HA LEU 17 HA LEU 17 5.713 2.033 -7.859
269 HG LEU 17 HG LEU 17 3.205 -0.103 -6.662
270 HB2 LEU 17 2HB LEU 17 2.766 2.164 -7.432
271 HB3 LEU 17 1HB LEU 17 3.674 1.872 -8.913
272 HD11 LEU 17 1HD1 LEU 17 1.334 -0.481 -7.882
273 HD12 LEU 17 2HD1 LEU 17 2.413 -1.215 -9.068
274 HD13 LEU 17 3HD1 LEU 17 1.929 0.472 -9.241
275 HD21 LEU 17 3HD2 LEU 17 4.634 -1.621 -7.754
276 HD22 LEU 17 1HD2 LEU 17 5.513 -0.097 -7.883
277 HD23 LEU 17 2HD2 LEU 17 4.601 -0.708 -9.264
278 H VAL 18 H VAL 18 3.572 2.906 -5.112
279 HA VAL 18 HA VAL 18 3.210 5.600 -5.716
280 HB VAL 18 HB VAL 18 3.208 6.005 -3.194
281 HG11 VAL 18 1HG1 VAL 18 1.247 4.196 -3.024
282 HG12 VAL 18 2HG1 VAL 18 1.523 4.121 -4.765
283 HG13 VAL 18 3HG1 VAL 18 1.087 5.653 -4.006
284 HG21 VAL 18 3HG2 VAL 18 2.944 3.694 -2.008
285 HG22 VAL 18 1HG2 VAL 18 4.562 4.333 -2.264
286 HG23 VAL 18 2HG2 VAL 18 3.921 3.104 -3.340
287 H CYS 19 H CYS 19 5.807 4.550 -3.468
288 HA CYS 19 HA CYS 19 7.167 7.043 -4.229
289 HB2 CYS 19 2HB CYS 19 7.439 5.279 -1.933
290 HB3 CYS 19 1HB CYS 19 8.983 5.768 -2.598
291 H GLY 20 H GLY 20 7.427 3.640 -4.965
292 HA2 GLY 20 2HA GLY 20 8.774 2.733 -6.727
293 HA3 GLY 20 1HA GLY 20 9.622 4.276 -6.831
294 H GLU 21 H GLU 21 11.736 3.357 -6.642
295 HA GLU 21 HA GLU 21 12.424 1.516 -4.529
296 HB2 GLU 21 2HB GLU 21 13.781 2.859 -6.699
297 HB3 GLU 21 1HB GLU 21 14.738 2.979 -5.221
298 HG2 GLU 21 2HG GLU 21 14.742 0.598 -4.927
299 HG3 GLU 21 1HG GLU 21 13.533 0.379 -6.192
300 H ARG 22 H ARG 22 11.597 4.778 -4.471
301 HA ARG 22 HA ARG 22 13.336 5.948 -2.601
302 HE ARG 22 HE ARG 22 11.721 9.315 -5.767
303 HB2 ARG 22 2HB ARG 22 10.587 6.390 -3.517
304 HB3 ARG 22 1HB ARG 22 10.842 6.886 -1.844
305 HG2 ARG 22 2HG ARG 22 12.622 8.362 -2.452
306 HG3 ARG 22 1HG ARG 22 12.718 7.684 -4.078
307 HD2 ARG 22 2HD ARG 22 10.135 8.452 -4.089
308 HD3 ARG 22 1HD ARG 22 10.776 9.638 -2.952
309 HH11 ARG 22 1HH2 ARG 22 10.123 11.570 -4.134
310 HH12 ARG 22 2HH2 ARG 22 11.326 12.815 -4.185
311 HH21 ARG 22 1HH1 ARG 22 13.850 10.698 -5.270
312 HH22 ARG 22 2HH1 ARG 22 13.437 12.320 -4.825
313 H GLY 23 H GLY 23 11.024 3.405 -2.159
314 HA2 GLY 23 2HA GLY 23 11.387 1.969 -0.154
315 HA3 GLY 23 1HA GLY 23 11.638 3.450 0.769
316 H PHE 24 H PHE 24 9.863 2.163 2.037
317 HA PHE 24 HA PHE 24 7.355 3.560 1.636
318 HD1 PHE 24 HD1 PHE 24 8.901 0.303 2.451
319 HD2 PHE 24 HD2 PHE 24 7.103 0.324 -1.452
320 HE1 PHE 24 HE1 PHE 24 10.417 -1.529 1.744
321 HE2 PHE 24 HE2 PHE 24 8.620 -1.507 -2.158
322 HZ PHE 24 HZ PHE 24 10.277 -2.435 -0.562
323 HB2 PHE 24 2HB PHE 24 6.175 1.142 1.567
324 HB3 PHE 24 1HB PHE 24 6.575 2.035 0.100
325 H PHE 25 H PHE 25 5.638 2.104 3.173
326 HA PHE 25 HA PHE 25 7.151 1.795 5.729
327 HD1 PHE 25 HD2 PHE 25 7.003 2.471 7.809
328 HD2 PHE 25 HD1 PHE 25 4.862 5.332 5.417
329 HE1 PHE 25 HE2 PHE 25 8.134 4.321 9.011
330 HE2 PHE 25 HE1 PHE 25 5.996 7.180 6.620
331 HZ PHE 25 HZ PHE 25 7.631 6.676 8.416
332 HB2 PHE 25 2HB PHE 25 4.568 3.055 5.001
333 HB3 PHE 25 1HB PHE 25 4.543 2.103 6.480
334 H TYR 26 H TYR 26 3.911 0.710 4.649
335 HA TYR 26 HA TYR 26 2.926 -1.419 4.760
336 HD1 TYR 26 HD1 TYR 26 2.427 -3.666 4.029
337 HD2 TYR 26 HD2 TYR 26 6.560 -4.240 5.070
338 HE1 TYR 26 HE1 TYR 26 1.966 -6.041 4.554
339 HE2 TYR 26 HE2 TYR 26 6.094 -6.616 5.591
340 HH TYR 26 HH TYR 26 3.666 -7.889 6.352
341 HB2 TYR 26 2HB TYR 26 4.571 -2.140 3.171
342 HB3 TYR 26 1HB TYR 26 5.844 -2.123 4.382
343 H THR 27 H THR 27 2.879 -0.310 7.174
344 HA THR 27 HA THR 27 4.425 -1.807 9.154
345 HB THR 27 HB THR 27 3.840 0.427 9.757
346 HG1 THR 27 HG1 THR 27 2.085 -0.118 11.433
347 HG21 THR 27 3HG2 THR 27 1.305 0.987 9.885
348 HG22 THR 27 1HG2 THR 27 1.103 -0.388 8.798
349 HG23 THR 27 2HG2 THR 27 2.080 0.994 8.301
350 H LYS 28 H LYS 28 3.511 -3.300 10.691
351 HA LYS 28 HA LYS 28 0.799 -4.195 10.628
352 HB2 LYS 28 2HB LYS 28 1.322 -5.054 8.412
353 HB3 LYS 28 1HB LYS 28 2.781 -5.834 9.019
354 HG2 LYS 28 2HG LYS 28 0.960 -7.472 8.770
355 HG3 LYS 28 1HG LYS 28 1.398 -7.290 10.465
356 HD2 LYS 28 2HD LYS 28 -0.537 -5.346 10.135
357 HD3 LYS 28 1HD LYS 28 -1.124 -6.656 9.113
358 HE2 LYS 28 2HE LYS 28 -1.305 -8.149 10.893
359 HE3 LYS 28 1HE LYS 28 -0.119 -7.283 11.870
360 HZ1 LYS 28 3HZ LYS 28 -2.008 -5.422 11.559
361 HZ2 LYS 28 1HZ LYS 28 -1.933 -6.480 12.882
362 HZ3 LYS 28 2HZ LYS 28 -2.962 -6.827 11.576
363 HA PRO 29 HA PRO 29 3.477 -5.625 14.086
364 HB2 PRO 29 2HB PRO 29 2.075 -4.305 16.045
365 HB3 PRO 29 1HB PRO 29 3.438 -3.591 15.166
366 HG2 PRO 29 2HG PRO 29 0.522 -3.045 14.871
367 HG3 PRO 29 1HG PRO 29 1.903 -1.992 14.518
368 HD2 PRO 29 2HD PRO 29 0.388 -3.433 12.612
369 HD3 PRO 29 1HD PRO 29 1.951 -2.645 12.325
370 H THR 30 H THR 30 2.201 -6.285 16.454
371 HA THR 30 HA THR 30 0.042 -8.131 15.518
372 HB THR 30 HB THR 30 1.045 -8.880 18.092
373 HG1 THR 30 HG1 THR 30 3.023 -8.221 17.879
374 HG21 THR 30 3HG2 THR 30 1.111 -10.024 15.302
375 HG22 THR 30 1HG2 THR 30 0.122 -10.529 16.672
376 HG23 THR 30 2HG2 THR 30 1.851 -10.873 16.659
Start of MODEL 6
1 H1 GLY 1 1H GLY 1 -2.047 0.002 10.893
2 H2 GLY 1 2H GLY 1 -2.615 -1.400 10.122
3 H3 GLY 1 3H GLY 1 -3.447 -0.772 11.462
4 HA2 GLY 1 1HA GLY 1 -4.671 0.008 9.652
5 HA3 GLY 1 2HA GLY 1 -3.667 1.432 10.061
6 H ILE 2 H ILE 2 -1.805 -0.258 8.169
7 HA ILE 2 HA ILE 2 -3.352 0.036 5.679
8 HB ILE 2 HB ILE 2 -1.099 0.903 5.632
9 HG12 ILE 2 2HG1 ILE 2 -0.006 -0.880 3.976
10 HG13 ILE 2 1HG1 ILE 2 -1.589 -1.634 4.078
11 HG21 ILE 2 1HG2 ILE 2 -0.082 -0.245 7.430
12 HG22 ILE 2 2HG2 ILE 2 0.833 -0.676 5.984
13 HG23 ILE 2 3HG2 ILE 2 -0.335 -1.811 6.662
14 HD11 ILE 2 3HD1 ILE 2 -0.766 0.816 2.668
15 HD12 ILE 2 1HD1 ILE 2 -2.241 1.011 3.617
16 HD13 ILE 2 2HD1 ILE 2 -2.149 -0.238 2.376
17 H THR 3 H THR 3 -1.834 -2.554 7.575
18 HA THR 3 HA THR 3 -2.509 -4.586 5.589
19 HB THR 3 HB THR 3 -1.643 -4.872 8.481
20 HG1 THR 3 HG1 THR 3 -0.290 -3.930 6.578
21 HG21 THR 3 3HG2 THR 3 -0.876 -7.154 7.276
22 HG22 THR 3 1HG2 THR 3 -2.311 -6.796 6.314
23 HG23 THR 3 2HG2 THR 3 -2.445 -6.980 8.063
24 H GLU 4 H GLU 4 -4.070 -3.086 8.282
25 HA GLU 4 HA GLU 4 -6.203 -5.171 8.254
26 HB2 GLU 4 2HB GLU 4 -5.121 -4.481 10.454
27 HB3 GLU 4 1HB GLU 4 -5.886 -2.906 10.237
28 HG2 GLU 4 2HG GLU 4 -7.358 -4.233 11.610
29 HG3 GLU 4 1HG GLU 4 -8.097 -4.112 10.013
30 H GLN 5 H GLN 5 -5.994 -3.296 6.078
31 HA GLN 5 HA GLN 5 -8.701 -2.250 6.116
32 HB2 GLN 5 2HB GLN 5 -7.124 -0.533 7.389
33 HB3 GLN 5 1HB GLN 5 -6.649 -0.090 5.748
34 HG2 GLN 5 2HG GLN 5 -8.664 0.864 5.286
35 HG3 GLN 5 1HG GLN 5 -9.561 -0.379 6.160
36 HE21 GLN 5 1HE2 GLN 5 -7.957 2.751 6.490
37 HE22 GLN 5 2HE2 GLN 5 -8.488 3.059 8.073
38 H CYS 6 H CYS 6 -5.490 -2.206 4.644
39 HA CYS 6 HA CYS 6 -6.655 -1.788 1.965
40 HB2 CYS 6 2HB CYS 6 -3.820 -2.060 2.981
41 HB3 CYS 6 1HB CYS 6 -4.214 -1.943 1.272
42 H CYS 7 H CYS 7 -6.321 -4.351 3.999
43 HA CYS 7 HA CYS 7 -5.982 -6.245 1.715
44 HB2 CYS 7 2HB CYS 7 -4.098 -6.394 3.302
45 HB3 CYS 7 1HB CYS 7 -5.227 -6.665 4.621
46 H THR 8 H THR 8 -7.548 -5.733 4.886
47 HA THR 8 HA THR 8 -9.361 -7.940 4.667
48 HB THR 8 HB THR 8 -8.966 -6.637 6.773
49 HG1 THR 8 HG1 THR 8 -10.995 -6.957 7.436
50 HG21 THR 8 3HG2 THR 8 -10.848 -4.557 6.452
51 HG22 THR 8 1HG2 THR 8 -9.782 -4.472 5.050
52 HG23 THR 8 2HG2 THR 8 -9.106 -4.397 6.677
53 H SER 9 H SER 9 -9.235 -4.807 3.214
54 HA SER 9 HA SER 9 -11.761 -5.406 1.745
55 HG SER 9 HG SER 9 -13.312 -3.618 1.547
56 HB2 SER 9 2HB SER 9 -12.158 -3.656 3.502
57 HB3 SER 9 1HB SER 9 -10.916 -2.665 2.744
58 H ILE 10 H ILE 10 -11.420 -2.857 0.234
59 HA ILE 10 HA ILE 10 -9.063 -3.731 -1.380
60 HB ILE 10 HB ILE 10 -11.439 -2.063 -2.237
61 HG12 ILE 10 2HG1 ILE 10 -10.715 -4.865 -3.116
62 HG13 ILE 10 1HG1 ILE 10 -11.781 -4.572 -1.739
63 HG21 ILE 10 1HG2 ILE 10 -9.038 -3.184 -3.712
64 HG22 ILE 10 2HG2 ILE 10 -9.459 -1.484 -3.508
65 HG23 ILE 10 3HG2 ILE 10 -10.462 -2.528 -4.515
66 HD11 ILE 10 3HD1 ILE 10 -12.927 -2.913 -3.501
67 HD12 ILE 10 1HD1 ILE 10 -13.374 -4.615 -3.387
68 HD13 ILE 10 2HD1 ILE 10 -12.246 -4.081 -4.634
69 H CYS 11 H CYS 11 -7.329 -2.378 -1.419
70 HA CYS 11 HA CYS 11 -7.607 0.277 -0.142
71 HB2 CYS 11 2HB CYS 11 -5.724 -1.486 0.293
72 HB3 CYS 11 1HB CYS 11 -5.026 -0.854 -1.196
73 H SER 12 H SER 12 -6.968 2.218 -1.219
74 HA SER 12 HA SER 12 -7.086 2.022 -4.196
75 HG SER 12 HG SER 12 -7.638 5.215 -1.930
76 HB2 SER 12 2HB SER 12 -7.537 4.572 -3.900
77 HB3 SER 12 1HB SER 12 -8.823 3.437 -3.501
78 H LEU 13 H LEU 13 -5.284 2.463 -5.334
79 HA LEU 13 HA LEU 13 -2.733 2.825 -4.370
80 HG LEU 13 HG LEU 13 -5.175 4.239 -6.393
81 HB2 LEU 13 2HB LEU 13 -2.264 4.122 -6.507
82 HB3 LEU 13 1HB LEU 13 -2.995 2.536 -6.697
83 HD11 LEU 13 1HD1 LEU 13 -4.754 5.925 -8.210
84 HD12 LEU 13 2HD1 LEU 13 -3.050 5.473 -8.171
85 HD13 LEU 13 3HD1 LEU 13 -3.799 6.209 -6.754
86 HD21 LEU 13 3HD2 LEU 13 -5.211 3.851 -8.996
87 HD22 LEU 13 1HD2 LEU 13 -5.388 2.486 -7.894
88 HD23 LEU 13 2HD2 LEU 13 -3.829 2.811 -8.652
89 H TYR 14 H TYR 14 -5.184 5.259 -4.887
90 HA TYR 14 HA TYR 14 -3.843 7.656 -4.558
91 HD1 TYR 14 HD1 TYR 14 -5.148 9.347 -5.715
92 HD2 TYR 14 HD2 TYR 14 -6.579 9.026 -1.676
93 HE1 TYR 14 HE1 TYR 14 -5.166 11.821 -5.525
94 HE2 TYR 14 HE2 TYR 14 -6.596 11.500 -1.486
95 HH TYR 14 HH TYR 14 -6.751 13.464 -3.055
96 HB2 TYR 14 2HB TYR 14 -6.381 7.229 -4.722
97 HB3 TYR 14 1HB TYR 14 -6.341 7.090 -2.966
98 H GLN 15 H GLN 15 -5.359 6.188 -1.706
99 HA GLN 15 HA GLN 15 -3.642 7.492 0.163
100 HB2 GLN 15 2HB GLN 15 -5.563 5.230 0.229
101 HB3 GLN 15 1HB GLN 15 -4.371 5.280 1.527
102 HG2 GLN 15 2HG GLN 15 -6.067 7.668 0.760
103 HG3 GLN 15 1HG GLN 15 -6.539 6.519 2.012
104 HE21 GLN 15 1HE2 GLN 15 -4.163 6.023 3.357
105 HE22 GLN 15 2HE2 GLN 15 -3.539 7.461 4.008
106 H LEU 16 H LEU 16 -3.607 4.307 -1.293
107 HA LEU 16 HA LEU 16 -1.538 2.950 -0.131
108 HG LEU 16 HG LEU 16 -1.817 0.650 -2.811
109 HB2 LEU 16 2HB LEU 16 -2.903 2.793 -2.524
110 HB3 LEU 16 1HB LEU 16 -1.247 3.071 -3.059
111 HD11 LEU 16 1HD1 LEU 16 0.399 0.496 -2.504
112 HD12 LEU 16 2HD1 LEU 16 0.142 0.654 -0.767
113 HD13 LEU 16 3HD1 LEU 16 0.427 2.089 -1.752
114 HD21 LEU 16 3HD2 LEU 16 -2.987 0.018 -1.003
115 HD22 LEU 16 1HD2 LEU 16 -2.822 1.627 -0.301
116 HD23 LEU 16 2HD2 LEU 16 -1.588 0.403 0.000
117 H GLU 17 H GLU 17 -1.210 5.664 -2.384
118 HA GLU 17 HA GLU 17 1.687 5.524 -2.448
119 HB2 GLU 17 2HB GLU 17 0.657 6.511 -4.343
120 HB3 GLU 17 1HB GLU 17 -0.320 7.588 -3.348
121 HG2 GLU 17 2HG GLU 17 1.658 8.836 -2.669
122 HG3 GLU 17 1HG GLU 17 2.707 7.692 -3.509
123 H ASN 18 H ASN 18 -0.645 7.119 -0.410
124 HA ASN 18 HA ASN 18 1.140 9.092 0.697
125 HB2 ASN 18 2HB ASN 18 -1.336 9.227 0.881
126 HB3 ASN 18 1HB ASN 18 -1.309 7.837 1.968
127 HD21 ASN 18 1HD2 ASN 18 0.135 11.129 1.652
128 HD22 ASN 18 2HD2 ASN 18 0.181 11.427 3.323
129 H TYR 19 H TYR 19 1.193 5.730 0.976
130 HA TYR 19 HA TYR 19 2.275 5.831 3.739
131 HD1 TYR 19 HD2 TYR 19 0.586 4.632 5.301
132 HD2 TYR 19 HD1 TYR 19 -0.457 3.623 1.256
133 HE1 TYR 19 HE2 TYR 19 -1.815 4.925 5.849
134 HE2 TYR 19 HE1 TYR 19 -2.860 3.919 1.803
135 HH TYR 19 HH TYR 19 -3.887 5.111 4.980
136 HB2 TYR 19 2HB TYR 19 1.784 3.404 1.983
137 HB3 TYR 19 1HB TYR 19 2.170 3.401 3.702
138 H CYS 20 H CYS 20 3.728 7.011 1.463
139 HA CYS 20 HA CYS 20 6.060 5.161 1.282
140 HB2 CYS 20 2HB CYS 20 4.959 6.431 -0.758
141 HB3 CYS 20 1HB CYS 20 5.959 7.759 -0.214
142 H ASN 21 H ASN 21 8.132 6.862 1.000
143 HA ASN 21 HA ASN 21 8.309 8.097 3.686
144 HB2 ASN 21 2HB ASN 21 10.126 6.615 3.209
145 HB3 ASN 21 1HB ASN 21 10.372 7.322 1.612
146 HD21 ASN 21 1HD2 ASN 21 11.748 9.142 1.461
147 HD22 ASN 21 2HD2 ASN 21 12.450 9.908 2.803
148 HA PHE 1 HA PHE 1 -9.895 5.538 -11.352
149 HD1 PHE 1 HD1 PHE 1 -7.011 7.079 -9.774
150 HD2 PHE 1 HD2 PHE 1 -7.762 5.656 -13.758
151 HE1 PHE 1 HE1 PHE 1 -6.310 9.274 -10.689
152 HE2 PHE 1 HE2 PHE 1 -7.060 7.853 -14.675
153 HZ PHE 1 HZ PHE 1 -6.333 9.662 -13.140
154 H1 PHE 1 1H PHE 1 -9.258 6.740 -9.501
155 H2 PHE 1 2H PHE 1 -8.480 5.420 -8.768
156 H3 PHE 1 3H PHE 1 -10.177 5.489 -8.816
157 HB2 PHE 1 2HB PHE 1 -7.204 4.613 -10.338
158 HB3 PHE 1 1HB PHE 1 -7.807 4.146 -11.929
159 H VAL 2 H VAL 2 -8.080 2.850 -9.995
160 HA VAL 2 HA VAL 2 -10.600 1.239 -10.006
161 HB VAL 2 HB VAL 2 -7.862 0.219 -10.808
162 HG11 VAL 2 1HG1 VAL 2 -9.458 -1.469 -9.979
163 HG12 VAL 2 2HG1 VAL 2 -9.190 -1.660 -11.712
164 HG13 VAL 2 3HG1 VAL 2 -10.667 -0.893 -11.128
165 HG21 VAL 2 3HG2 VAL 2 -9.159 0.194 -13.122
166 HG22 VAL 2 1HG2 VAL 2 -8.313 1.647 -12.589
167 HG23 VAL 2 2HG2 VAL 2 -10.061 1.518 -12.383
168 H ASN 3 H ASN 3 -10.916 0.008 -8.197
169 HA ASN 3 HA ASN 3 -9.087 0.356 -5.951
170 HB2 ASN 3 2HB ASN 3 -11.433 -1.536 -6.017
171 HB3 ASN 3 1HB ASN 3 -10.778 -0.641 -4.647
172 HD21 ASN 3 1HD2 ASN 3 -13.448 -0.269 -4.963
173 HD22 ASN 3 2HD2 ASN 3 -13.791 1.236 -5.670
174 H GLN 4 H GLN 4 -7.666 -1.174 -5.124
175 HA GLN 4 HA GLN 4 -7.593 -3.838 -6.473
176 HB2 GLN 4 2HB GLN 4 -5.869 -2.787 -7.638
177 HB3 GLN 4 1HB GLN 4 -5.454 -1.740 -6.287
178 HG2 GLN 4 2HG GLN 4 -3.916 -3.205 -5.509
179 HG3 GLN 4 1HG GLN 4 -5.031 -4.565 -5.652
180 HE21 GLN 4 1HE2 GLN 4 -3.023 -5.727 -6.500
181 HE22 GLN 4 2HE2 GLN 4 -2.640 -5.558 -8.145
182 H HIS 5 H HIS 5 -7.213 -5.527 -5.075
183 HA HIS 5 HA HIS 5 -7.292 -5.083 -2.233
184 HD2 HIS 5 HD2 HIS 5 -9.142 -6.433 -0.919
185 HE1 HIS 5 HE1 HIS 5 -11.518 -7.940 -4.071
186 HE2 HIS 5 HE2 HIS 5 -11.558 -6.995 -1.701
187 HB2 HIS 5 2HB HIS 5 -6.816 -7.491 -3.981
188 HB3 HIS 5 1HB HIS 5 -6.650 -7.606 -2.229
189 H LEU 6 H LEU 6 -5.619 -5.296 -0.686
190 HA LEU 6 HA LEU 6 -2.846 -5.600 -1.716
191 HG LEU 6 HG LEU 6 -3.021 -2.577 -2.454
192 HB2 LEU 6 2HB LEU 6 -4.085 -3.219 -0.509
193 HB3 LEU 6 1HB LEU 6 -2.603 -3.711 0.279
194 HD11 LEU 6 1HD1 LEU 6 -0.423 -2.421 -1.069
195 HD12 LEU 6 2HD1 LEU 6 -1.780 -1.792 -0.135
196 HD13 LEU 6 3HD1 LEU 6 -1.429 -1.134 -1.733
197 HD21 LEU 6 3HD2 LEU 6 -1.150 -4.856 -1.826
198 HD22 LEU 6 1HD2 LEU 6 -0.609 -3.585 -2.920
199 HD23 LEU 6 2HD2 LEU 6 -2.045 -4.532 -3.311
200 H CYS 7 H CYS 7 -1.541 -6.795 -0.406
201 HA CYS 7 HA CYS 7 -2.135 -7.027 2.460
202 HB2 CYS 7 2HB CYS 7 -2.204 -9.518 0.716
203 HB3 CYS 7 1HB CYS 7 -2.420 -9.456 2.463
204 H GLY 8 H GLY 8 -0.286 -7.446 3.574
205 HA2 GLY 8 2HA GLY 8 2.116 -7.327 3.714
206 HA3 GLY 8 1HA GLY 8 1.810 -9.031 3.410
207 H SER 9 H SER 9 2.941 -9.879 1.765
208 HA SER 9 HA SER 9 4.823 -8.622 0.197
209 HG SER 9 HG SER 9 2.987 -12.127 -0.401
210 HB2 SER 9 2HB SER 9 3.896 -10.487 -1.584
211 HB3 SER 9 1HB SER 9 4.982 -10.845 -0.244
212 H ASP 10 H ASP 10 1.404 -9.124 -0.765
213 HA ASP 10 HA ASP 10 1.688 -7.641 -3.224
214 HB2 ASP 10 2HB ASP 10 -0.655 -8.550 -1.557
215 HB3 ASP 10 1HB ASP 10 -0.898 -7.471 -2.927
216 H LEU 11 H LEU 11 1.142 -6.789 0.096
217 HA LEU 11 HA LEU 11 0.021 -4.189 -0.209
218 HG LEU 11 HG LEU 11 1.576 -2.918 2.597
219 HB2 LEU 11 2HB LEU 11 0.335 -5.517 1.947
220 HB3 LEU 11 1HB LEU 11 2.026 -5.046 1.904
221 HD11 LEU 11 1HD1 LEU 11 0.472 -2.166 0.597
222 HD12 LEU 11 2HD1 LEU 11 -0.544 -1.703 1.962
223 HD13 LEU 11 3HD1 LEU 11 -0.971 -3.104 0.979
224 HD21 LEU 11 3HD2 LEU 11 0.146 -4.693 3.965
225 HD22 LEU 11 1HD2 LEU 11 -1.201 -3.768 3.302
226 HD23 LEU 11 2HD2 LEU 11 0.012 -2.966 4.299
227 H VAL 12 H VAL 12 3.408 -5.283 -0.119
228 HA VAL 12 HA VAL 12 4.459 -2.611 -0.510
229 HB VAL 12 HB VAL 12 6.579 -3.853 -1.080
230 HG11 VAL 12 1HG1 VAL 12 5.383 -3.389 1.343
231 HG12 VAL 12 2HG1 VAL 12 7.024 -4.001 1.144
232 HG13 VAL 12 3HG1 VAL 12 5.694 -5.123 1.429
233 HG21 VAL 12 3HG2 VAL 12 5.216 -5.864 -1.933
234 HG22 VAL 12 1HG2 VAL 12 5.042 -6.308 -0.235
235 HG23 VAL 12 2HG2 VAL 12 6.645 -6.220 -0.963
236 H GLU 13 H GLU 13 3.353 -5.196 -2.601
237 HA GLU 13 HA GLU 13 4.601 -4.450 -5.029
238 HB2 GLU 13 2HB GLU 13 3.053 -6.450 -4.604
239 HB3 GLU 13 1HB GLU 13 1.709 -5.327 -4.809
240 HG2 GLU 13 2HG GLU 13 2.266 -4.884 -7.061
241 HG3 GLU 13 1HG GLU 13 3.894 -5.538 -6.877
242 H ALA 14 H ALA 14 1.528 -3.316 -3.622
243 HA ALA 14 HA ALA 14 1.027 -1.331 -5.644
244 HB1 ALA 14 3HB ALA 14 0.104 -1.445 -2.761
245 HB2 ALA 14 1HB ALA 14 -0.733 -2.180 -4.127
246 HB3 ALA 14 2HB ALA 14 -0.595 -0.426 -4.018
247 H LEU 15 H LEU 15 2.601 -1.274 -2.484
248 HA LEU 15 HA LEU 15 3.164 1.562 -2.473
249 HG LEU 15 HG LEU 15 2.154 -0.413 -0.277
250 HB2 LEU 15 2HB LEU 15 4.462 -0.774 -1.021
251 HB3 LEU 15 1HB LEU 15 4.863 0.907 -0.711
252 HD11 LEU 15 1HD1 LEU 15 2.649 -0.340 1.978
253 HD12 LEU 15 2HD1 LEU 15 3.771 1.009 1.799
254 HD13 LEU 15 3HD1 LEU 15 4.262 -0.617 1.321
255 HD21 LEU 15 3HD2 LEU 15 1.355 1.728 0.454
256 HD22 LEU 15 1HD2 LEU 15 2.136 2.034 -1.094
257 HD23 LEU 15 2HD2 LEU 15 2.972 2.428 0.404
258 H TYR 16 H TYR 16 4.699 -1.218 -3.915
259 HA TYR 16 HA TYR 16 7.318 -0.083 -4.243
260 HD1 TYR 16 HD2 TYR 16 9.364 -1.228 -5.735
261 HD2 TYR 16 HD1 TYR 16 6.809 -3.690 -3.311
262 HE1 TYR 16 HE2 TYR 16 11.354 -2.137 -4.562
263 HE2 TYR 16 HE1 TYR 16 8.796 -4.598 -2.138
264 HH TYR 16 HH TYR 16 11.003 -4.381 -1.828
265 HB2 TYR 16 2HB TYR 16 5.886 -2.469 -5.088
266 HB3 TYR 16 1HB TYR 16 6.920 -1.850 -6.374
267 H LEU 17 H LEU 17 4.646 -0.439 -6.615
268 HA LEU 17 HA LEU 17 5.948 1.096 -8.640
269 HG LEU 17 HG LEU 17 2.989 0.306 -6.887
270 HB2 LEU 17 2HB LEU 17 3.627 1.341 -9.602
271 HB3 LEU 17 1HB LEU 17 4.111 -0.320 -9.264
272 HD11 LEU 17 1HD1 LEU 17 1.369 1.912 -6.981
273 HD12 LEU 17 2HD1 LEU 17 0.996 1.582 -8.673
274 HD13 LEU 17 3HD1 LEU 17 2.400 2.564 -8.254
275 HD21 LEU 17 3HD2 LEU 17 2.388 -1.645 -8.186
276 HD22 LEU 17 1HD2 LEU 17 1.625 -0.645 -9.423
277 HD23 LEU 17 2HD2 LEU 17 0.902 -0.771 -7.819
278 H VAL 18 H VAL 18 4.084 2.098 -5.831
279 HA VAL 18 HA VAL 18 3.780 4.836 -6.863
280 HB VAL 18 HB VAL 18 2.794 5.333 -4.676
281 HG11 VAL 18 1HG1 VAL 18 0.830 4.265 -5.134
282 HG12 VAL 18 2HG1 VAL 18 1.598 2.679 -5.220
283 HG13 VAL 18 3HG1 VAL 18 1.691 3.780 -6.595
284 HG21 VAL 18 3HG2 VAL 18 4.118 4.074 -3.166
285 HG22 VAL 18 1HG2 VAL 18 3.810 2.573 -4.034
286 HG23 VAL 18 2HG2 VAL 18 2.521 3.326 -3.100
287 H CYS 19 H CYS 19 5.588 3.220 -4.308
288 HA CYS 19 HA CYS 19 6.985 5.564 -3.421
289 HB2 CYS 19 2HB CYS 19 7.343 2.603 -3.078
290 HB3 CYS 19 1HB CYS 19 8.643 3.686 -2.592
291 H GLY 20 H GLY 20 8.192 2.755 -5.273
292 HA2 GLY 20 2HA GLY 20 9.752 2.720 -7.064
293 HA3 GLY 20 1HA GLY 20 9.777 4.487 -7.030
294 H GLU 21 H GLU 21 12.105 4.575 -7.016
295 HA GLU 21 HA GLU 21 13.623 3.154 -4.989
296 HB2 GLU 21 2HB GLU 21 14.434 4.129 -7.278
297 HB3 GLU 21 1HB GLU 21 14.632 5.628 -6.370
298 HG2 GLU 21 2HG GLU 21 16.735 4.444 -6.275
299 HG3 GLU 21 1HG GLU 21 15.987 4.326 -4.682
300 H ARG 22 H ARG 22 11.465 5.614 -4.653
301 HA ARG 22 HA ARG 22 12.919 7.403 -2.914
302 HE ARG 22 HE ARG 22 10.574 11.672 -1.878
303 HB2 ARG 22 2HB ARG 22 10.827 8.061 -4.075
304 HB3 ARG 22 1HB ARG 22 9.934 6.903 -3.088
305 HG2 ARG 22 2HG ARG 22 10.247 8.132 -1.124
306 HG3 ARG 22 1HG ARG 22 11.662 8.972 -1.760
307 HD2 ARG 22 2HD ARG 22 9.356 9.512 -3.418
308 HD3 ARG 22 1HD ARG 22 9.004 9.910 -1.736
309 HH11 ARG 22 1HH2 ARG 22 9.918 10.855 -4.949
310 HH12 ARG 22 2HH2 ARG 22 11.479 11.198 -5.619
311 HH21 ARG 22 1HH1 ARG 22 13.028 11.511 -2.533
312 HH22 ARG 22 2HH1 ARG 22 13.237 11.571 -4.252
313 H GLY 23 H GLY 23 11.572 4.268 -2.494
314 HA2 GLY 23 2HA GLY 23 12.041 2.940 -0.529
315 HA3 GLY 23 1HA GLY 23 12.237 4.427 0.395
316 H PHE 24 H PHE 24 10.352 1.871 0.399
317 HA PHE 24 HA PHE 24 7.831 3.420 0.835
318 HD1 PHE 24 HD1 PHE 24 7.385 -0.652 1.808
319 HD2 PHE 24 HD2 PHE 24 9.656 0.639 -1.605
320 HE1 PHE 24 HE1 PHE 24 8.665 -2.775 1.855
321 HE2 PHE 24 HE2 PHE 24 10.937 -1.483 -1.558
322 HZ PHE 24 HZ PHE 24 10.444 -3.191 0.174
323 HB2 PHE 24 2HB PHE 24 6.658 1.251 0.439
324 HB3 PHE 24 1HB PHE 24 7.598 1.771 -0.959
325 H PHE 25 H PHE 25 6.404 2.472 2.560
326 HA PHE 25 HA PHE 25 7.925 1.053 4.695
327 HD1 PHE 25 HD2 PHE 25 6.583 0.886 7.035
328 HD2 PHE 25 HD1 PHE 25 9.126 4.321 6.576
329 HE1 PHE 25 HE2 PHE 25 7.666 0.376 9.207
330 HE2 PHE 25 HE1 PHE 25 10.210 3.809 8.746
331 HZ PHE 25 HZ PHE 25 9.479 1.838 10.064
332 HB2 PHE 25 2HB PHE 25 7.680 3.730 4.840
333 HB3 PHE 25 1HB PHE 25 6.114 3.286 5.515
334 H TYR 26 H TYR 26 6.615 -0.820 4.337
335 HA TYR 26 HA TYR 26 3.686 -0.483 4.477
336 HD1 TYR 26 HD1 TYR 26 2.812 -4.016 5.125
337 HD2 TYR 26 HD2 TYR 26 6.965 -3.595 4.086
338 HE1 TYR 26 HE1 TYR 26 3.321 -6.124 6.315
339 HE2 TYR 26 HE2 TYR 26 7.469 -5.703 5.283
340 HH TYR 26 HH TYR 26 5.901 -7.018 7.453
341 HB2 TYR 26 2HB TYR 26 3.557 -2.456 3.348
342 HB3 TYR 26 1HB TYR 26 5.263 -2.199 3.030
343 H THR 27 H THR 27 3.279 0.140 6.644
344 HA THR 27 HA THR 27 4.485 -1.365 8.841
345 HB THR 27 HB THR 27 3.370 0.153 10.260
346 HG1 THR 27 HG1 THR 27 1.625 0.934 8.198
347 HG21 THR 27 3HG2 THR 27 4.696 1.101 7.984
348 HG22 THR 27 1HG2 THR 27 4.389 1.998 9.470
349 HG23 THR 27 2HG2 THR 27 3.259 2.115 8.121
350 H LYS 28 H LYS 28 2.644 -2.010 10.622
351 HA LYS 28 HA LYS 28 0.209 -3.139 9.654
352 HB2 LYS 28 2HB LYS 28 1.074 -5.609 10.047
353 HB3 LYS 28 1HB LYS 28 1.249 -4.843 8.471
354 HG2 LYS 28 2HG LYS 28 3.413 -5.575 8.745
355 HG3 LYS 28 1HG LYS 28 3.563 -4.026 9.567
356 HD2 LYS 28 2HD LYS 28 3.464 -5.002 11.701
357 HD3 LYS 28 1HD LYS 28 2.709 -6.476 11.092
358 HE2 LYS 28 2HE LYS 28 4.707 -7.428 10.626
359 HE3 LYS 28 1HE LYS 28 5.310 -5.960 9.857
360 HZ1 LYS 28 3HZ LYS 28 6.191 -6.912 12.201
361 HZ2 LYS 28 1HZ LYS 28 5.025 -5.799 12.728
362 HZ3 LYS 28 2HZ LYS 28 6.299 -5.284 11.730
363 HA PRO 29 HA PRO 29 -0.211 -3.210 14.026
364 HB2 PRO 29 2HB PRO 29 -2.681 -4.414 14.123
365 HB3 PRO 29 1HB PRO 29 -2.432 -2.714 13.689
366 HG2 PRO 29 2HG PRO 29 -3.083 -5.027 11.920
367 HG3 PRO 29 1HG PRO 29 -3.438 -3.306 11.696
368 HD2 PRO 29 2HD PRO 29 -1.354 -4.737 10.434
369 HD3 PRO 29 1HD PRO 29 -1.513 -2.971 10.500
370 H THR 30 H THR 30 -1.544 -5.180 15.501
371 HA THR 30 HA THR 30 -0.984 -7.200 16.580
372 HB THR 30 HB THR 30 -0.889 -9.147 14.898
373 HG1 THR 30 HG1 THR 30 -1.741 -7.143 13.105
374 HG21 THR 30 3HG2 THR 30 -3.377 -8.207 14.106
375 HG22 THR 30 1HG2 THR 30 -3.065 -7.329 15.604
376 HG23 THR 30 2HG2 THR 30 -3.036 -9.092 15.592
Start of MODEL 7
1 H1 GLY 1 1H GLY 1 -4.396 -1.729 10.435
2 H2 GLY 1 2H GLY 1 -5.808 -0.799 10.272
3 H3 GLY 1 3H GLY 1 -4.674 -0.420 11.479
4 HA2 GLY 1 1HA GLY 1 -4.657 0.872 9.223
5 HA3 GLY 1 2HA GLY 1 -3.121 0.554 10.084
6 H ILE 2 H ILE 2 -2.058 -0.533 8.172
7 HA ILE 2 HA ILE 2 -3.516 -0.412 5.599
8 HB ILE 2 HB ILE 2 -1.173 0.551 5.977
9 HG12 ILE 2 2HG1 ILE 2 -1.664 -1.451 3.751
10 HG13 ILE 2 1HG1 ILE 2 -2.107 0.255 3.734
11 HG21 ILE 2 1HG2 ILE 2 -0.435 -1.583 7.185
12 HG22 ILE 2 2HG2 ILE 2 0.688 -0.892 6.017
13 HG23 ILE 2 3HG2 ILE 2 -0.285 -2.294 5.578
14 HD11 ILE 2 3HD1 ILE 2 0.094 0.965 3.466
15 HD12 ILE 2 1HD1 ILE 2 0.128 -0.553 2.569
16 HD13 ILE 2 2HD1 ILE 2 0.762 -0.487 4.211
17 H THR 3 H THR 3 -1.787 -2.766 7.631
18 HA THR 3 HA THR 3 -2.282 -4.951 5.760
19 HB THR 3 HB THR 3 -1.299 -4.878 8.625
20 HG1 THR 3 HG1 THR 3 -0.031 -5.483 6.161
21 HG21 THR 3 3HG2 THR 3 -2.299 -7.095 7.021
22 HG22 THR 3 1HG2 THR 3 -1.850 -7.060 8.727
23 HG23 THR 3 2HG2 THR 3 -0.617 -7.334 7.496
24 H GLU 4 H GLU 4 -4.073 -3.356 8.197
25 HA GLU 4 HA GLU 4 -5.925 -5.681 8.461
26 HB2 GLU 4 2HB GLU 4 -4.933 -3.832 10.342
27 HB3 GLU 4 1HB GLU 4 -6.626 -3.406 10.104
28 HG2 GLU 4 2HG GLU 4 -7.351 -5.626 10.660
29 HG3 GLU 4 1HG GLU 4 -5.697 -6.240 10.622
30 H GLN 5 H GLN 5 -5.764 -3.937 6.072
31 HA GLN 5 HA GLN 5 -8.611 -3.403 5.811
32 HB2 GLN 5 2HB GLN 5 -7.463 -1.334 7.025
33 HB3 GLN 5 1HB GLN 5 -6.939 -0.948 5.384
34 HG2 GLN 5 2HG GLN 5 -9.815 -1.510 6.154
35 HG3 GLN 5 1HG GLN 5 -9.129 0.109 6.008
36 HE21 GLN 5 1HE2 GLN 5 -8.251 0.707 3.806
37 HE22 GLN 5 2HE2 GLN 5 -8.926 -0.022 2.430
38 H CYS 6 H CYS 6 -5.342 -2.832 4.541
39 HA CYS 6 HA CYS 6 -6.295 -2.757 1.784
40 HB2 CYS 6 2HB CYS 6 -3.536 -2.879 3.004
41 HB3 CYS 6 1HB CYS 6 -3.810 -2.882 1.270
42 H CYS 7 H CYS 7 -5.388 -5.171 4.029
43 HA CYS 7 HA CYS 7 -5.263 -7.136 1.795
44 HB2 CYS 7 2HB CYS 7 -3.247 -6.999 3.270
45 HB3 CYS 7 1HB CYS 7 -4.261 -7.474 4.622
46 H THR 8 H THR 8 -7.613 -5.950 2.864
47 HA THR 8 HA THR 8 -9.033 -8.418 3.720
48 HB THR 8 HB THR 8 -9.166 -5.673 4.997
49 HG1 THR 8 HG1 THR 8 -8.976 -8.321 5.991
50 HG21 THR 8 3HG2 THR 8 -11.453 -6.063 4.676
51 HG22 THR 8 1HG2 THR 8 -11.167 -6.802 6.252
52 HG23 THR 8 2HG2 THR 8 -11.272 -7.812 4.809
53 H SER 9 H SER 9 -9.215 -5.098 2.481
54 HA SER 9 HA SER 9 -11.328 -5.991 0.576
55 HG SER 9 HG SER 9 -12.129 -4.293 3.557
56 HB2 SER 9 2HB SER 9 -11.314 -3.282 1.933
57 HB3 SER 9 1HB SER 9 -12.573 -3.954 0.901
58 H ILE 10 H ILE 10 -11.002 -2.772 0.058
59 HA ILE 10 HA ILE 10 -8.503 -3.073 -1.543
60 HB ILE 10 HB ILE 10 -11.182 -2.001 -2.450
61 HG12 ILE 10 2HG1 ILE 10 -9.549 -3.872 -4.069
62 HG13 ILE 10 1HG1 ILE 10 -10.181 -4.529 -2.559
63 HG21 ILE 10 1HG2 ILE 10 -9.938 -0.461 -3.580
64 HG22 ILE 10 2HG2 ILE 10 -9.529 -1.820 -4.626
65 HG23 ILE 10 3HG2 ILE 10 -8.436 -1.347 -3.325
66 HD11 ILE 10 3HD1 ILE 10 -12.379 -3.228 -3.482
67 HD12 ILE 10 1HD1 ILE 10 -12.041 -4.927 -3.817
68 HD13 ILE 10 2HD1 ILE 10 -11.622 -3.693 -5.005
69 H CYS 11 H CYS 11 -7.197 -1.219 -1.567
70 HA CYS 11 HA CYS 11 -8.168 1.015 0.161
71 HB2 CYS 11 2HB CYS 11 -5.377 0.062 -0.523
72 HB3 CYS 11 1HB CYS 11 -5.695 1.573 0.324
73 H SER 12 H SER 12 -6.764 3.135 -0.510
74 HA SER 12 HA SER 12 -7.287 3.528 -3.433
75 HG SER 12 HG SER 12 -7.026 5.252 -0.301
76 HB2 SER 12 2HB SER 12 -7.253 6.048 -2.423
77 HB3 SER 12 1HB SER 12 -8.717 5.082 -2.580
78 H LEU 13 H LEU 13 -5.351 3.308 -4.381
79 HA LEU 13 HA LEU 13 -2.761 3.601 -3.589
80 HG LEU 13 HG LEU 13 -4.477 2.528 -5.781
81 HB2 LEU 13 2HB LEU 13 -3.148 5.226 -5.989
82 HB3 LEU 13 1HB LEU 13 -2.216 3.756 -5.770
83 HD11 LEU 13 1HD1 LEU 13 -6.298 3.880 -5.859
84 HD12 LEU 13 2HD1 LEU 13 -5.830 4.277 -7.512
85 HD13 LEU 13 3HD1 LEU 13 -5.299 5.299 -6.176
86 HD21 LEU 13 3HD2 LEU 13 -2.713 3.436 -7.806
87 HD22 LEU 13 1HD2 LEU 13 -4.348 3.526 -8.456
88 HD23 LEU 13 2HD2 LEU 13 -3.734 1.997 -7.823
89 H TYR 14 H TYR 14 -4.834 6.261 -4.594
90 HA TYR 14 HA TYR 14 -3.152 8.440 -4.296
91 HD1 TYR 14 HD1 TYR 14 -3.475 10.740 -4.305
92 HD2 TYR 14 HD2 TYR 14 -7.123 9.675 -2.301
93 HE1 TYR 14 HE1 TYR 14 -3.549 12.983 -3.246
94 HE2 TYR 14 HE2 TYR 14 -7.200 11.919 -1.244
95 HH TYR 14 HH TYR 14 -6.161 14.327 -1.971
96 HB2 TYR 14 2HB TYR 14 -5.348 8.818 -5.091
97 HB3 TYR 14 1HB TYR 14 -6.071 8.096 -3.658
98 H GLN 15 H GLN 15 -5.285 7.330 -1.656
99 HA GLN 15 HA GLN 15 -3.807 8.772 0.369
100 HB2 GLN 15 2HB GLN 15 -6.034 6.835 0.298
101 HB3 GLN 15 1HB GLN 15 -5.029 6.725 1.741
102 HG2 GLN 15 2HG GLN 15 -6.111 9.363 0.730
103 HG3 GLN 15 1HG GLN 15 -7.008 8.351 1.862
104 HE21 GLN 15 1HE2 GLN 15 -4.690 10.830 1.692
105 HE22 GLN 15 2HE2 GLN 15 -4.074 10.696 3.268
106 H LEU 16 H LEU 16 -3.884 5.452 -0.743
107 HA LEU 16 HA LEU 16 -2.165 4.067 0.902
108 HG LEU 16 HG LEU 16 -0.213 2.941 -0.876
109 HB2 LEU 16 2HB LEU 16 -3.207 3.156 -1.144
110 HB3 LEU 16 1HB LEU 16 -2.128 4.146 -2.118
111 HD11 LEU 16 1HD1 LEU 16 -2.592 1.661 0.203
112 HD12 LEU 16 2HD1 LEU 16 -0.917 1.527 0.739
113 HD13 LEU 16 3HD1 LEU 16 -1.515 0.491 -0.553
114 HD21 LEU 16 3HD2 LEU 16 -1.173 2.596 -3.288
115 HD22 LEU 16 1HD2 LEU 16 -1.836 1.105 -2.618
116 HD23 LEU 16 2HD2 LEU 16 -0.093 1.376 -2.613
117 H GLU 17 H GLU 17 -1.323 6.561 -1.435
118 HA GLU 17 HA GLU 17 1.517 6.147 -1.297
119 HB2 GLU 17 2HB GLU 17 0.812 7.284 -3.217
120 HB3 GLU 17 1HB GLU 17 -0.261 8.342 -2.309
121 HG2 GLU 17 2HG GLU 17 1.675 9.502 -1.336
122 HG3 GLU 17 1HG GLU 17 2.772 8.402 -2.172
123 H ASN 18 H ASN 18 -0.569 7.296 1.047
124 HA ASN 18 HA ASN 18 1.245 9.327 2.111
125 HB2 ASN 18 2HB ASN 18 -1.353 9.131 2.444
126 HB3 ASN 18 1HB ASN 18 -0.919 8.014 3.740
127 HD21 ASN 18 1HD2 ASN 18 -1.352 9.343 5.568
128 HD22 ASN 18 2HD2 ASN 18 -0.573 10.824 5.852
129 H TYR 19 H TYR 19 1.305 5.999 2.002
130 HA TYR 19 HA TYR 19 2.768 5.800 4.590
131 HD1 TYR 19 HD2 TYR 19 1.119 5.561 5.836
132 HD2 TYR 19 HD1 TYR 19 -0.364 2.897 2.813
133 HE1 TYR 19 HE2 TYR 19 -1.182 5.864 6.694
134 HE2 TYR 19 HE1 TYR 19 -2.665 3.194 3.666
135 HH TYR 19 HH TYR 19 -3.628 5.626 5.548
136 HB2 TYR 19 2HB TYR 19 1.869 3.558 2.760
137 HB3 TYR 19 1HB TYR 19 2.479 3.403 4.405
138 H CYS 20 H CYS 20 3.469 6.619 1.523
139 HA CYS 20 HA CYS 20 5.681 4.748 1.090
140 HB2 CYS 20 2HB CYS 20 5.869 5.653 -0.991
141 HB3 CYS 20 1HB CYS 20 4.317 6.299 -0.667
142 H ASN 21 H ASN 21 7.851 6.017 0.527
143 HA ASN 21 HA ASN 21 8.569 7.406 3.069
144 HB2 ASN 21 2HB ASN 21 9.900 5.404 2.492
145 HB3 ASN 21 1HB ASN 21 10.369 6.160 0.969
146 HD21 ASN 21 1HD2 ASN 21 12.027 7.767 1.023
147 HD22 ASN 21 2HD2 ASN 21 12.842 8.209 2.445
148 HA PHE 1 HA PHE 1 -11.519 4.663 -11.140
149 HD1 PHE 1 HD1 PHE 1 -8.136 2.621 -12.626
150 HD2 PHE 1 HD2 PHE 1 -8.283 6.884 -12.099
151 HE1 PHE 1 HE1 PHE 1 -5.666 2.679 -12.400
152 HE2 PHE 1 HE2 PHE 1 -5.812 6.941 -11.873
153 HZ PHE 1 HZ PHE 1 -4.504 4.838 -12.023
154 H1 PHE 1 1H PHE 1 -8.743 4.384 -10.118
155 H2 PHE 1 2H PHE 1 -10.146 4.425 -9.163
156 H3 PHE 1 3H PHE 1 -9.689 5.791 -10.063
157 HB2 PHE 1 2HB PHE 1 -10.144 4.025 -13.309
158 HB3 PHE 1 1HB PHE 1 -10.233 5.701 -12.773
159 H VAL 2 H VAL 2 -8.731 2.565 -10.494
160 HA VAL 2 HA VAL 2 -10.524 0.225 -11.027
161 HB VAL 2 HB VAL 2 -7.546 0.551 -11.463
162 HG11 VAL 2 1HG1 VAL 2 -9.245 -1.953 -11.370
163 HG12 VAL 2 2HG1 VAL 2 -7.806 -1.597 -10.416
164 HG13 VAL 2 3HG1 VAL 2 -7.664 -1.891 -12.149
165 HG21 VAL 2 3HG2 VAL 2 -8.087 0.675 -13.656
166 HG22 VAL 2 1HG2 VAL 2 -9.758 0.894 -13.135
167 HG23 VAL 2 2HG2 VAL 2 -9.163 -0.718 -13.536
168 H ASN 3 H ASN 3 -11.188 -0.331 -8.954
169 HA ASN 3 HA ASN 3 -9.902 0.051 -6.524
170 HB2 ASN 3 2HB ASN 3 -11.445 -2.429 -7.355
171 HB3 ASN 3 1HB ASN 3 -11.121 -1.935 -5.693
172 HD21 ASN 3 1HD2 ASN 3 -13.801 -2.171 -6.465
173 HD22 ASN 3 2HD2 ASN 3 -14.500 -0.630 -6.605
174 H GLN 4 H GLN 4 -8.143 -0.898 -5.471
175 HA GLN 4 HA GLN 4 -6.788 -3.104 -6.964
176 HB2 GLN 4 2HB GLN 4 -5.338 -1.314 -7.334
177 HB3 GLN 4 1HB GLN 4 -5.711 -0.559 -5.788
178 HG2 GLN 4 2HG GLN 4 -4.033 -1.657 -4.735
179 HG3 GLN 4 1HG GLN 4 -4.461 -3.197 -5.479
180 HE21 GLN 4 1HE2 GLN 4 -1.767 -2.717 -5.324
181 HE22 GLN 4 2HE2 GLN 4 -1.132 -2.285 -6.838
182 H HIS 5 H HIS 5 -6.322 -4.890 -5.781
183 HA HIS 5 HA HIS 5 -6.980 -4.883 -2.901
184 HD2 HIS 5 HD2 HIS 5 -9.624 -6.013 -4.478
185 HE1 HIS 5 HE1 HIS 5 -8.313 -7.461 -8.229
186 HE2 HIS 5 HE2 HIS 5 -10.296 -6.498 -6.944
187 HB2 HIS 5 2HB HIS 5 -5.873 -7.329 -4.182
188 HB3 HIS 5 1HB HIS 5 -7.249 -7.161 -3.094
189 H LEU 6 H LEU 6 -5.396 -5.650 -1.315
190 HA LEU 6 HA LEU 6 -2.570 -5.648 -2.217
191 HG LEU 6 HG LEU 6 -2.802 -2.581 -2.395
192 HB2 LEU 6 2HB LEU 6 -3.920 -3.573 -0.617
193 HB3 LEU 6 1HB LEU 6 -2.453 -4.188 0.114
194 HD11 LEU 6 1HD1 LEU 6 -1.661 -2.271 0.136
195 HD12 LEU 6 2HD1 LEU 6 -1.487 -1.189 -1.240
196 HD13 LEU 6 3HD1 LEU 6 -0.286 -2.448 -0.955
197 HD21 LEU 6 3HD2 LEU 6 -1.622 -4.221 -3.543
198 HD22 LEU 6 1HD2 LEU 6 -0.924 -4.898 -2.072
199 HD23 LEU 6 2HD2 LEU 6 -0.262 -3.418 -2.757
200 H CYS 7 H CYS 7 -1.303 -7.028 -1.093
201 HA CYS 7 HA CYS 7 -1.914 -7.830 1.634
202 HB2 CYS 7 2HB CYS 7 -2.649 -9.623 -0.681
203 HB3 CYS 7 1HB CYS 7 -2.084 -10.340 0.822
204 H GLY 8 H GLY 8 0.032 -8.384 2.520
205 HA2 GLY 8 2HA GLY 8 2.381 -8.687 2.562
206 HA3 GLY 8 1HA GLY 8 1.931 -10.172 1.733
207 H SER 9 H SER 9 3.231 -10.465 0.034
208 HA SER 9 HA SER 9 4.979 -8.767 -1.198
209 HG SER 9 HG SER 9 3.155 -9.899 -3.913
210 HB2 SER 9 2HB SER 9 5.101 -10.280 -2.961
211 HB3 SER 9 1HB SER 9 4.322 -11.269 -1.728
212 H ASP 10 H ASP 10 1.585 -9.169 -2.298
213 HA ASP 10 HA ASP 10 1.707 -7.154 -4.304
214 HB2 ASP 10 2HB ASP 10 -0.640 -8.103 -2.629
215 HB3 ASP 10 1HB ASP 10 -0.773 -7.120 -4.082
216 H LEU 11 H LEU 11 1.177 -7.017 -0.847
217 HA LEU 11 HA LEU 11 0.153 -4.420 -0.519
218 HG LEU 11 HG LEU 11 1.894 -3.743 2.334
219 HB2 LEU 11 2HB LEU 11 0.590 -6.181 1.263
220 HB3 LEU 11 1HB LEU 11 2.281 -5.703 1.218
221 HD11 LEU 11 1HD1 LEU 11 -0.789 -3.703 0.948
222 HD12 LEU 11 2HD1 LEU 11 0.573 -2.609 0.703
223 HD13 LEU 11 3HD1 LEU 11 -0.351 -2.545 2.204
224 HD21 LEU 11 3HD2 LEU 11 0.403 -4.120 4.113
225 HD22 LEU 11 1HD2 LEU 11 0.778 -5.746 3.541
226 HD23 LEU 11 2HD2 LEU 11 -0.744 -4.979 3.085
227 H VAL 12 H VAL 12 3.602 -5.384 -0.599
228 HA VAL 12 HA VAL 12 4.567 -2.685 -0.532
229 HB VAL 12 HB VAL 12 6.680 -3.747 -1.502
230 HG11 VAL 12 1HG1 VAL 12 6.170 -3.441 0.949
231 HG12 VAL 12 2HG1 VAL 12 7.232 -4.806 0.602
232 HG13 VAL 12 3HG1 VAL 12 5.528 -5.084 0.961
233 HG21 VAL 12 3HG2 VAL 12 6.768 -6.130 -1.693
234 HG22 VAL 12 1HG2 VAL 12 5.338 -5.624 -2.590
235 HG23 VAL 12 2HG2 VAL 12 5.167 -6.314 -0.976
236 H GLU 13 H GLU 13 3.404 -4.758 -3.093
237 HA GLU 13 HA GLU 13 4.526 -3.454 -5.345
238 HB2 GLU 13 2HB GLU 13 2.666 -5.475 -4.933
239 HB3 GLU 13 1HB GLU 13 1.713 -4.206 -5.702
240 HG2 GLU 13 2HG GLU 13 3.611 -4.035 -7.419
241 HG3 GLU 13 1HG GLU 13 4.209 -5.553 -6.749
242 H ALA 14 H ALA 14 1.492 -2.770 -3.591
243 HA ALA 14 HA ALA 14 0.867 -0.427 -5.154
244 HB1 ALA 14 3HB ALA 14 -0.071 -0.815 -2.330
245 HB2 ALA 14 1HB ALA 14 -0.671 -1.871 -3.607
246 HB3 ALA 14 2HB ALA 14 -0.945 -0.136 -3.703
247 H LEU 15 H LEU 15 2.584 -1.015 -2.138
248 HA LEU 15 HA LEU 15 2.995 1.812 -1.561
249 HG LEU 15 HG LEU 15 2.203 -0.664 0.486
250 HB2 LEU 15 2HB LEU 15 4.307 -0.708 -0.505
251 HB3 LEU 15 1HB LEU 15 4.724 0.904 0.060
252 HD11 LEU 15 1HD1 LEU 15 2.688 0.922 2.666
253 HD12 LEU 15 2HD1 LEU 15 4.317 0.699 2.029
254 HD13 LEU 15 3HD1 LEU 15 3.338 -0.705 2.457
255 HD21 LEU 15 3HD2 LEU 15 1.139 1.263 -0.376
256 HD22 LEU 15 1HD2 LEU 15 2.408 2.342 0.207
257 HD23 LEU 15 2HD2 LEU 15 1.261 1.633 1.343
258 H TYR 16 H TYR 16 4.310 -0.422 -3.746
259 HA TYR 16 HA TYR 16 7.009 0.660 -3.866
260 HD1 TYR 16 HD2 TYR 16 8.934 -0.101 -5.656
261 HD2 TYR 16 HD1 TYR 16 6.491 -3.116 -3.806
262 HE1 TYR 16 HE2 TYR 16 10.975 -1.268 -4.861
263 HE2 TYR 16 HE1 TYR 16 8.532 -4.282 -3.012
264 HH TYR 16 HH TYR 16 10.742 -4.262 -2.926
265 HB2 TYR 16 2HB TYR 16 5.482 -1.469 -5.145
266 HB3 TYR 16 1HB TYR 16 6.453 -0.575 -6.314
267 H LEU 17 H LEU 17 4.013 1.037 -5.784
268 HA LEU 17 HA LEU 17 5.239 2.930 -7.599
269 HG LEU 17 HG LEU 17 2.359 1.819 -5.842
270 HB2 LEU 17 2HB LEU 17 2.886 3.449 -8.281
271 HB3 LEU 17 1HB LEU 17 3.275 1.732 -8.355
272 HD11 LEU 17 1HD1 LEU 17 0.506 3.373 -5.622
273 HD12 LEU 17 2HD1 LEU 17 0.759 3.965 -7.264
274 HD13 LEU 17 3HD1 LEU 17 1.957 4.294 -6.015
275 HD21 LEU 17 3HD2 LEU 17 1.526 0.423 -7.728
276 HD22 LEU 17 1HD2 LEU 17 0.572 1.796 -8.291
277 HD23 LEU 17 2HD2 LEU 17 0.210 1.050 -6.734
278 H VAL 18 H VAL 18 3.578 3.224 -4.483
279 HA VAL 18 HA VAL 18 3.100 6.031 -4.698
280 HB VAL 18 HB VAL 18 3.037 6.043 -2.207
281 HG11 VAL 18 1HG1 VAL 18 1.121 4.456 -2.087
282 HG12 VAL 18 2HG1 VAL 18 1.604 3.804 -3.655
283 HG13 VAL 18 3HG1 VAL 18 1.062 5.476 -3.524
284 HG21 VAL 18 3HG2 VAL 18 3.052 3.627 -1.253
285 HG22 VAL 18 1HG2 VAL 18 4.599 4.428 -1.502
286 HG23 VAL 18 2HG2 VAL 18 4.018 3.254 -2.674
287 H CYS 19 H CYS 19 5.783 4.478 -2.860
288 HA CYS 19 HA CYS 19 7.237 6.948 -3.589
289 HB2 CYS 19 2HB CYS 19 7.413 5.360 -1.146
290 HB3 CYS 19 1HB CYS 19 8.978 5.711 -1.856
291 H GLY 20 H GLY 20 7.613 3.422 -3.439
292 HA2 GLY 20 2HA GLY 20 8.696 2.072 -5.087
293 HA3 GLY 20 1HA GLY 20 9.345 3.537 -5.825
294 H GLU 21 H GLU 21 11.513 2.811 -5.844
295 HA GLU 21 HA GLU 21 12.892 1.562 -3.730
296 HB2 GLU 21 2HB GLU 21 13.936 1.776 -5.901
297 HB3 GLU 21 1HB GLU 21 13.884 3.537 -5.805
298 HG2 GLU 21 2HG GLU 21 15.476 3.565 -4.002
299 HG3 GLU 21 1HG GLU 21 15.388 1.812 -3.824
300 H ARG 22 H ARG 22 11.743 4.811 -4.000
301 HA ARG 22 HA ARG 22 13.530 6.157 -2.257
302 HE ARG 22 HE ARG 22 9.745 9.220 -5.160
303 HB2 ARG 22 2HB ARG 22 10.540 6.605 -2.488
304 HB3 ARG 22 1HB ARG 22 11.740 7.772 -1.929
305 HG2 ARG 22 2HG ARG 22 12.816 7.127 -4.327
306 HG3 ARG 22 1HG ARG 22 11.107 6.890 -4.692
307 HD2 ARG 22 2HD ARG 22 11.183 9.276 -3.234
308 HD3 ARG 22 1HD ARG 22 12.576 9.371 -4.311
309 HH11 ARG 22 1HH2 ARG 22 12.563 7.976 -6.389
310 HH12 ARG 22 2HH2 ARG 22 12.577 8.922 -7.840
311 HH21 ARG 22 1HH1 ARG 22 9.991 10.996 -6.834
312 HH22 ARG 22 2HH1 ARG 22 11.124 10.628 -8.092
313 H GLY 23 H GLY 23 11.237 3.683 -1.614
314 HA2 GLY 23 2HA GLY 23 11.520 2.538 0.589
315 HA3 GLY 23 1HA GLY 23 11.622 4.141 1.319
316 H PHE 24 H PHE 24 9.694 1.892 1.787
317 HA PHE 24 HA PHE 24 7.202 3.488 1.381
318 HD1 PHE 24 HD1 PHE 24 8.182 -0.499 2.359
319 HD2 PHE 24 HD2 PHE 24 8.182 1.110 -1.627
320 HE1 PHE 24 HE1 PHE 24 9.910 -2.152 1.691
321 HE2 PHE 24 HE2 PHE 24 9.909 -0.542 -2.293
322 HZ PHE 24 HZ PHE 24 10.773 -2.172 -0.635
323 HB2 PHE 24 2HB PHE 24 6.250 0.923 1.393
324 HB3 PHE 24 1HB PHE 24 6.569 1.846 -0.074
325 H PHE 25 H PHE 25 5.451 1.923 2.863
326 HA PHE 25 HA PHE 25 6.845 1.469 5.450
327 HD1 PHE 25 HD2 PHE 25 5.984 0.902 7.264
328 HD2 PHE 25 HD1 PHE 25 5.526 5.177 7.194
329 HE1 PHE 25 HE2 PHE 25 6.647 1.012 9.651
330 HE2 PHE 25 HE1 PHE 25 6.189 5.283 9.581
331 HZ PHE 25 HZ PHE 25 6.749 3.203 10.810
332 HB2 PHE 25 2HB PHE 25 5.684 3.844 5.096
333 HB3 PHE 25 1HB PHE 25 4.238 2.933 5.532
334 H TYR 26 H TYR 26 6.144 -0.711 4.164
335 HA TYR 26 HA TYR 26 3.365 -1.495 4.631
336 HD1 TYR 26 HD1 TYR 26 2.300 -3.708 4.534
337 HD2 TYR 26 HD2 TYR 26 6.315 -5.137 3.949
338 HE1 TYR 26 HE1 TYR 26 1.603 -5.970 5.260
339 HE2 TYR 26 HE2 TYR 26 5.611 -7.395 4.678
340 HH TYR 26 HH TYR 26 3.213 -8.668 4.654
341 HB2 TYR 26 2HB TYR 26 4.323 -2.646 2.816
342 HB3 TYR 26 1HB TYR 26 5.858 -2.866 3.637
343 H THR 27 H THR 27 3.831 -0.599 7.009
344 HA THR 27 HA THR 27 5.295 -2.428 8.748
345 HB THR 27 HB THR 27 5.146 -0.064 9.325
346 HG1 THR 27 HG1 THR 27 3.429 -1.114 11.221
347 HG21 THR 27 3HG2 THR 27 2.164 -0.589 9.294
348 HG22 THR 27 1HG2 THR 27 3.063 0.542 8.282
349 HG23 THR 27 2HG2 THR 27 2.887 0.851 10.010
350 H LYS 28 H LYS 28 4.033 -3.243 10.777
351 HA LYS 28 HA LYS 28 1.435 -4.432 9.882
352 HB2 LYS 28 2HB LYS 28 3.892 -5.691 10.923
353 HB3 LYS 28 1HB LYS 28 2.413 -6.222 11.723
354 HG2 LYS 28 2HG LYS 28 2.187 -7.642 9.970
355 HG3 LYS 28 1HG LYS 28 1.678 -6.218 9.062
356 HD2 LYS 28 2HD LYS 28 3.404 -6.909 7.700
357 HD3 LYS 28 1HD LYS 28 4.327 -5.907 8.820
358 HE2 LYS 28 2HE LYS 28 5.537 -7.931 8.772
359 HE3 LYS 28 1HE LYS 28 4.559 -8.070 10.234
360 HZ1 LYS 28 3HZ LYS 28 4.548 -9.714 7.948
361 HZ2 LYS 28 1HZ LYS 28 3.020 -8.996 8.111
362 HZ3 LYS 28 2HZ LYS 28 3.674 -9.898 9.393
363 HA PRO 29 HA PRO 29 0.534 -2.155 13.693
364 HB2 PRO 29 2HB PRO 29 -2.084 -1.666 13.015
365 HB3 PRO 29 1HB PRO 29 -0.728 -0.647 12.501
366 HG2 PRO 29 2HG PRO 29 -2.293 -2.633 10.915
367 HG3 PRO 29 1HG PRO 29 -1.432 -1.185 10.366
368 HD2 PRO 29 2HD PRO 29 -0.496 -3.834 10.130
369 HD3 PRO 29 1HD PRO 29 0.487 -2.368 9.943
370 H THR 30 H THR 30 0.776 -4.472 14.584
371 HA THR 30 HA THR 30 -1.920 -5.679 15.059
372 HB THR 30 HB THR 30 0.829 -6.962 15.112
373 HG1 THR 30 HG1 THR 30 -0.015 -8.095 13.345
374 HG21 THR 30 3HG2 THR 30 -0.370 -8.094 16.787
375 HG22 THR 30 1HG2 THR 30 -0.670 -9.069 15.348
376 HG23 THR 30 2HG2 THR 30 -1.900 -7.943 15.923
Start of MODEL 8
1 H1 GLY 1 1H GLY 1 -2.494 -2.081 11.929
2 H2 GLY 1 2H GLY 1 -3.553 -2.654 10.731
3 H3 GLY 1 3H GLY 1 -4.096 -1.524 11.877
4 HA2 GLY 1 1HA GLY 1 -3.436 0.092 10.483
5 HA3 GLY 1 2HA GLY 1 -1.737 -0.459 10.615
6 H ILE 2 H ILE 2 -1.600 -1.279 8.270
7 HA ILE 2 HA ILE 2 -3.863 -0.450 6.514
8 HB ILE 2 HB ILE 2 -1.567 0.566 6.186
9 HG12 ILE 2 2HG1 ILE 2 -2.970 -0.998 4.015
10 HG13 ILE 2 1HG1 ILE 2 -3.054 0.732 4.342
11 HG21 ILE 2 1HG2 ILE 2 0.259 -0.701 5.629
12 HG22 ILE 2 2HG2 ILE 2 -0.709 -1.918 4.797
13 HG23 ILE 2 3HG2 ILE 2 -0.612 -1.922 6.558
14 HD11 ILE 2 3HD1 ILE 2 -0.503 0.726 3.837
15 HD12 ILE 2 1HD1 ILE 2 -1.620 0.607 2.477
16 HD13 ILE 2 2HD1 ILE 2 -0.810 -0.838 3.083
17 H THR 3 H THR 3 -2.461 -3.206 7.839
18 HA THR 3 HA THR 3 -2.813 -4.961 5.534
19 HB THR 3 HB THR 3 -2.420 -5.598 8.471
20 HG1 THR 3 HG1 THR 3 -0.749 -4.478 7.106
21 HG21 THR 3 3HG2 THR 3 -1.723 -7.524 6.317
22 HG22 THR 3 1HG2 THR 3 -3.441 -7.308 6.654
23 HG23 THR 3 2HG2 THR 3 -2.348 -7.826 7.938
24 H GLU 4 H GLU 4 -4.566 -4.341 8.549
25 HA GLU 4 HA GLU 4 -6.744 -6.144 7.762
26 HB2 GLU 4 2HB GLU 4 -6.130 -5.884 10.148
27 HB3 GLU 4 1HB GLU 4 -6.571 -4.177 10.065
28 HG2 GLU 4 2HG GLU 4 -8.697 -4.747 10.537
29 HG3 GLU 4 1HG GLU 4 -8.766 -5.608 8.999
30 H GLN 5 H GLN 5 -6.429 -4.274 5.773
31 HA GLN 5 HA GLN 5 -9.052 -3.057 5.684
32 HB2 GLN 5 2HB GLN 5 -7.585 -1.462 7.139
33 HB3 GLN 5 1HB GLN 5 -6.797 -1.051 5.613
34 HG2 GLN 5 2HG GLN 5 -8.581 0.133 4.877
35 HG3 GLN 5 1HG GLN 5 -9.730 -1.079 5.446
36 HE21 GLN 5 1HE2 GLN 5 -7.876 1.788 6.434
37 HE22 GLN 5 2HE2 GLN 5 -8.767 2.086 7.848
38 H CYS 6 H CYS 6 -5.739 -2.700 4.418
39 HA CYS 6 HA CYS 6 -6.731 -2.359 1.691
40 HB2 CYS 6 2HB CYS 6 -4.033 -2.485 2.998
41 HB3 CYS 6 1HB CYS 6 -4.150 -2.696 1.260
42 H CYS 7 H CYS 7 -6.265 -4.968 3.729
43 HA CYS 7 HA CYS 7 -5.994 -6.783 1.375
44 HB2 CYS 7 2HB CYS 7 -4.058 -6.941 2.880
45 HB3 CYS 7 1HB CYS 7 -5.128 -7.266 4.238
46 H THR 8 H THR 8 -7.804 -5.897 4.202
47 HA THR 8 HA THR 8 -9.519 -8.303 4.019
48 HB THR 8 HB THR 8 -9.951 -5.872 5.769
49 HG1 THR 8 HG1 THR 8 -7.950 -6.557 6.311
50 HG21 THR 8 3HG2 THR 8 -11.672 -7.065 6.583
51 HG22 THR 8 1HG2 THR 8 -10.619 -8.446 6.889
52 HG23 THR 8 2HG2 THR 8 -11.390 -8.256 5.314
53 H SER 9 H SER 9 -9.319 -5.088 2.845
54 HA SER 9 HA SER 9 -11.992 -5.395 1.581
55 HG SER 9 HG SER 9 -13.679 -3.831 2.283
56 HB2 SER 9 2HB SER 9 -11.959 -3.842 3.679
57 HB3 SER 9 1HB SER 9 -11.094 -2.718 2.637
58 H ILE 10 H ILE 10 -11.231 -2.378 0.778
59 HA ILE 10 HA ILE 10 -9.097 -3.068 -1.172
60 HB ILE 10 HB ILE 10 -11.609 -1.648 -2.057
61 HG12 ILE 10 2HG1 ILE 10 -12.148 -3.945 -1.180
62 HG13 ILE 10 1HG1 ILE 10 -12.449 -3.764 -2.908
63 HG21 ILE 10 1HG2 ILE 10 -9.152 -2.796 -3.320
64 HG22 ILE 10 2HG2 ILE 10 -10.001 -1.295 -3.685
65 HG23 ILE 10 3HG2 ILE 10 -10.656 -2.836 -4.240
66 HD11 ILE 10 3HD1 ILE 10 -10.704 -5.141 -3.499
67 HD12 ILE 10 1HD1 ILE 10 -11.055 -5.833 -1.915
68 HD13 ILE 10 2HD1 ILE 10 -9.732 -4.681 -2.101
69 H CYS 11 H CYS 11 -7.776 -1.315 -1.672
70 HA CYS 11 HA CYS 11 -8.508 1.275 -0.360
71 HB2 CYS 11 2HB CYS 11 -5.774 0.067 -0.885
72 HB3 CYS 11 1HB CYS 11 -6.042 1.682 -0.234
73 H SER 12 H SER 12 -6.472 2.814 -1.622
74 HA SER 12 HA SER 12 -7.055 2.546 -4.527
75 HG SER 12 HG SER 12 -7.302 6.204 -3.044
76 HB2 SER 12 2HB SER 12 -7.611 4.937 -4.678
77 HB3 SER 12 1HB SER 12 -8.730 4.111 -3.596
78 H LEU 13 H LEU 13 -5.181 2.674 -5.610
79 HA LEU 13 HA LEU 13 -2.637 3.011 -4.657
80 HG LEU 13 HG LEU 13 -4.957 4.343 -6.856
81 HB2 LEU 13 2HB LEU 13 -2.063 4.006 -6.921
82 HB3 LEU 13 1HB LEU 13 -2.907 2.464 -6.936
83 HD11 LEU 13 1HD1 LEU 13 -4.368 6.189 -8.021
84 HD12 LEU 13 2HD1 LEU 13 -3.521 5.234 -9.239
85 HD13 LEU 13 3HD1 LEU 13 -2.695 5.699 -7.751
86 HD21 LEU 13 3HD2 LEU 13 -5.142 2.335 -8.101
87 HD22 LEU 13 1HD2 LEU 13 -3.705 2.704 -9.054
88 HD23 LEU 13 2HD2 LEU 13 -5.187 3.629 -9.298
89 H TYR 14 H TYR 14 -4.916 5.513 -5.509
90 HA TYR 14 HA TYR 14 -3.354 7.825 -5.376
91 HD1 TYR 14 HD1 TYR 14 -4.822 9.007 -7.355
92 HD2 TYR 14 HD2 TYR 14 -5.725 10.126 -3.305
93 HE1 TYR 14 HE1 TYR 14 -4.572 11.402 -7.961
94 HE2 TYR 14 HE2 TYR 14 -5.474 12.519 -3.910
95 HH TYR 14 HH TYR 14 -5.075 13.541 -7.243
96 HB2 TYR 14 2HB TYR 14 -5.964 7.437 -5.713
97 HB3 TYR 14 1HB TYR 14 -6.005 7.872 -4.008
98 H GLN 15 H GLN 15 -5.359 6.883 -2.605
99 HA GLN 15 HA GLN 15 -3.743 8.320 -0.725
100 HB2 GLN 15 2HB GLN 15 -5.952 6.328 -0.565
101 HB3 GLN 15 1HB GLN 15 -4.962 6.551 0.878
102 HG2 GLN 15 2HG GLN 15 -5.892 9.015 -0.516
103 HG3 GLN 15 1HG GLN 15 -7.103 8.090 0.374
104 HE21 GLN 15 1HE2 GLN 15 -3.781 9.429 0.826
105 HE22 GLN 15 2HE2 GLN 15 -3.988 9.774 2.475
106 H LEU 16 H LEU 16 -3.881 4.997 -1.775
107 HA LEU 16 HA LEU 16 -2.241 3.598 -0.064
108 HG LEU 16 HG LEU 16 -0.232 2.514 -1.755
109 HB2 LEU 16 2HB LEU 16 -3.212 2.586 -2.050
110 HB3 LEU 16 1HB LEU 16 -2.244 3.628 -3.084
111 HD11 LEU 16 1HD1 LEU 16 -2.306 0.311 -1.754
112 HD12 LEU 16 2HD1 LEU 16 -1.904 1.247 -0.314
113 HD13 LEU 16 3HD1 LEU 16 -0.673 0.251 -1.091
114 HD21 LEU 16 3HD2 LEU 16 -1.748 1.021 -3.913
115 HD22 LEU 16 1HD2 LEU 16 -0.018 0.931 -3.583
116 HD23 LEU 16 2HD2 LEU 16 -0.718 2.420 -4.217
117 H GLU 17 H GLU 17 -1.264 6.010 -2.441
118 HA GLU 17 HA GLU 17 1.569 5.521 -2.188
119 HB2 GLU 17 2HB GLU 17 0.971 6.583 -4.181
120 HB3 GLU 17 1HB GLU 17 -0.127 7.698 -3.374
121 HG2 GLU 17 2HG GLU 17 1.719 8.950 -2.443
122 HG3 GLU 17 1HG GLU 17 2.881 7.744 -2.996
123 H ASN 18 H ASN 18 -0.719 7.325 -0.307
124 HA ASN 18 HA ASN 18 1.113 9.194 0.886
125 HB2 ASN 18 2HB ASN 18 -1.495 9.127 0.953
126 HB3 ASN 18 1HB ASN 18 -1.264 8.097 2.364
127 HD21 ASN 18 1HD2 ASN 18 0.758 9.173 3.782
128 HD22 ASN 18 2HD2 ASN 18 0.490 10.809 4.146
129 H TYR 19 H TYR 19 0.977 5.836 1.135
130 HA TYR 19 HA TYR 19 1.940 5.782 3.931
131 HD1 TYR 19 HD2 TYR 19 0.501 4.032 5.493
132 HD2 TYR 19 HD1 TYR 19 -0.806 4.077 1.402
133 HE1 TYR 19 HE2 TYR 19 -1.854 4.176 6.247
134 HE2 TYR 19 HE1 TYR 19 -3.162 4.220 2.151
135 HH TYR 19 HH TYR 19 -4.382 3.429 4.548
136 HB2 TYR 19 2HB TYR 19 1.458 3.554 1.929
137 HB3 TYR 19 1HB TYR 19 1.982 3.309 3.594
138 H CYS 20 H CYS 20 3.518 7.113 1.826
139 HA CYS 20 HA CYS 20 5.859 5.274 1.677
140 HB2 CYS 20 2HB CYS 20 4.809 6.675 -0.337
141 HB3 CYS 20 1HB CYS 20 5.908 7.894 0.263
142 H ASN 21 H ASN 21 7.954 6.753 1.600
143 HA ASN 21 HA ASN 21 7.967 8.207 4.203
144 HB2 ASN 21 2HB ASN 21 9.553 6.263 3.809
145 HB3 ASN 21 1HB ASN 21 10.356 7.264 2.599
146 HD21 ASN 21 1HD2 ASN 21 11.089 6.287 5.510
147 HD22 ASN 21 2HD2 ASN 21 11.670 7.705 6.240
148 HA PHE 1 HA PHE 1 -9.033 5.848 -6.656
149 HD1 PHE 1 HD2 PHE 1 -7.059 8.087 -9.082
150 HD2 PHE 1 HD1 PHE 1 -10.426 6.069 -10.831
151 HE1 PHE 1 HE2 PHE 1 -6.006 8.271 -11.321
152 HE2 PHE 1 HE1 PHE 1 -9.373 6.254 -13.071
153 HZ PHE 1 HZ PHE 1 -7.163 7.355 -13.315
154 H1 PHE 1 1H PHE 1 -7.032 4.816 -7.468
155 H2 PHE 1 2H PHE 1 -6.947 6.491 -7.741
156 H3 PHE 1 3H PHE 1 -7.292 5.434 -9.026
157 HB2 PHE 1 2HB PHE 1 -10.518 6.848 -8.558
158 HB3 PHE 1 1HB PHE 1 -9.232 7.845 -7.878
159 H VAL 2 H VAL 2 -7.904 3.554 -8.627
160 HA VAL 2 HA VAL 2 -10.539 2.445 -9.425
161 HB VAL 2 HB VAL 2 -9.008 0.623 -10.430
162 HG11 VAL 2 1HG1 VAL 2 -8.984 3.515 -11.323
163 HG12 VAL 2 2HG1 VAL 2 -10.053 2.226 -11.874
164 HG13 VAL 2 3HG1 VAL 2 -8.346 2.207 -12.317
165 HG21 VAL 2 3HG2 VAL 2 -6.708 0.998 -10.534
166 HG22 VAL 2 1HG2 VAL 2 -7.075 1.599 -8.917
167 HG23 VAL 2 2HG2 VAL 2 -6.875 2.731 -10.255
168 H ASN 3 H ASN 3 -10.535 -0.123 -9.093
169 HA ASN 3 HA ASN 3 -10.317 -0.501 -6.179
170 HB2 ASN 3 2HB ASN 3 -11.085 -2.818 -7.848
171 HB3 ASN 3 1HB ASN 3 -11.880 -2.143 -6.428
172 HD21 ASN 3 1HD2 ASN 3 -12.524 -2.713 -9.580
173 HD22 ASN 3 2HD2 ASN 3 -13.525 -1.389 -9.938
174 H GLN 4 H GLN 4 -8.551 -1.429 -5.252
175 HA GLN 4 HA GLN 4 -6.980 -3.378 -6.848
176 HB2 GLN 4 2HB GLN 4 -5.719 -1.394 -7.202
177 HB3 GLN 4 1HB GLN 4 -5.947 -0.859 -5.538
178 HG2 GLN 4 2HG GLN 4 -3.701 -1.700 -5.711
179 HG3 GLN 4 1HG GLN 4 -4.630 -2.890 -4.801
180 HE21 GLN 4 1HE2 GLN 4 -3.385 -4.747 -5.464
181 HE22 GLN 4 2HE2 GLN 4 -3.350 -5.295 -7.071
182 H HIS 5 H HIS 5 -6.583 -5.158 -5.640
183 HA HIS 5 HA HIS 5 -7.173 -5.092 -2.750
184 HD2 HIS 5 HD2 HIS 5 -7.826 -6.296 -6.594
185 HE1 HIS 5 HE1 HIS 5 -11.463 -7.397 -4.740
186 HE2 HIS 5 HE2 HIS 5 -10.389 -6.606 -6.915
187 HB2 HIS 5 2HB HIS 5 -6.222 -7.468 -4.369
188 HB3 HIS 5 1HB HIS 5 -7.129 -7.482 -2.856
189 H LEU 6 H LEU 6 -5.590 -5.628 -1.145
190 HA LEU 6 HA LEU 6 -2.783 -5.831 -2.075
191 HG LEU 6 HG LEU 6 -2.914 -2.751 -2.533
192 HB2 LEU 6 2HB LEU 6 -4.041 -3.562 -0.687
193 HB3 LEU 6 1HB LEU 6 -2.587 -4.147 0.090
194 HD11 LEU 6 1HD1 LEU 6 -0.352 -2.772 -1.094
195 HD12 LEU 6 2HD1 LEU 6 -1.720 -2.234 -0.118
196 HD13 LEU 6 3HD1 LEU 6 -1.338 -1.413 -1.629
197 HD21 LEU 6 3HD2 LEU 6 -1.946 -4.631 -3.555
198 HD22 LEU 6 1HD2 LEU 6 -1.092 -5.114 -2.090
199 HD23 LEU 6 2HD2 LEU 6 -0.507 -3.751 -3.039
200 H CYS 7 H CYS 7 -1.592 -7.204 -0.920
201 HA CYS 7 HA CYS 7 -2.179 -7.711 1.906
202 HB2 CYS 7 2HB CYS 7 -2.467 -9.946 -0.145
203 HB3 CYS 7 1HB CYS 7 -2.506 -10.158 1.601
204 H GLY 8 H GLY 8 -0.290 -8.238 2.914
205 HA2 GLY 8 2HA GLY 8 2.090 -8.348 3.037
206 HA3 GLY 8 1HA GLY 8 1.709 -9.957 2.438
207 H SER 9 H SER 9 2.950 -10.507 0.755
208 HA SER 9 HA SER 9 4.781 -9.023 -0.632
209 HG SER 9 HG SER 9 4.984 -10.306 -3.205
210 HB2 SER 9 2HB SER 9 4.030 -11.547 -0.877
211 HB3 SER 9 1HB SER 9 3.125 -10.922 -2.253
212 H ASP 10 H ASP 10 1.375 -9.412 -1.699
213 HA ASP 10 HA ASP 10 1.642 -7.625 -3.928
214 HB2 ASP 10 2HB ASP 10 -0.736 -8.559 -2.309
215 HB3 ASP 10 1HB ASP 10 -0.897 -7.472 -3.684
216 H LEU 11 H LEU 11 1.039 -7.171 -0.527
217 HA LEU 11 HA LEU 11 0.000 -4.545 -0.495
218 HG LEU 11 HG LEU 11 1.697 -3.612 2.317
219 HB2 LEU 11 2HB LEU 11 0.306 -6.103 1.476
220 HB3 LEU 11 1HB LEU 11 2.019 -5.711 1.445
221 HD11 LEU 11 1HD1 LEU 11 -0.553 -2.406 2.041
222 HD12 LEU 11 2HD1 LEU 11 -0.937 -3.650 0.851
223 HD13 LEU 11 3HD1 LEU 11 0.442 -2.579 0.595
224 HD21 LEU 11 3HD2 LEU 11 0.425 -3.917 4.178
225 HD22 LEU 11 1HD2 LEU 11 0.255 -5.556 3.548
226 HD23 LEU 11 2HD2 LEU 11 -1.006 -4.360 3.246
227 H VAL 12 H VAL 12 3.415 -5.616 -0.482
228 HA VAL 12 HA VAL 12 4.455 -2.925 -0.574
229 HB VAL 12 HB VAL 12 6.582 -4.127 -1.368
230 HG11 VAL 12 1HG1 VAL 12 7.127 -4.527 0.827
231 HG12 VAL 12 2HG1 VAL 12 5.650 -5.439 1.138
232 HG13 VAL 12 3HG1 VAL 12 5.606 -3.677 1.096
233 HG21 VAL 12 3HG2 VAL 12 5.255 -6.085 -2.294
234 HG22 VAL 12 1HG2 VAL 12 4.973 -6.581 -0.626
235 HG23 VAL 12 2HG2 VAL 12 6.615 -6.525 -1.262
236 H GLU 13 H GLU 13 3.559 -5.299 -3.040
237 HA GLU 13 HA GLU 13 4.743 -4.134 -5.312
238 HB2 GLU 13 2HB GLU 13 3.379 -6.252 -5.286
239 HB3 GLU 13 1HB GLU 13 1.927 -5.255 -5.188
240 HG2 GLU 13 2HG GLU 13 2.502 -4.165 -7.310
241 HG3 GLU 13 1HG GLU 13 3.991 -5.107 -7.406
242 H ALA 14 H ALA 14 1.430 -3.491 -4.115
243 HA ALA 14 HA ALA 14 0.865 -1.297 -5.787
244 HB1 ALA 14 3HB ALA 14 -0.779 -2.424 -4.284
245 HB2 ALA 14 1HB ALA 14 -0.811 -0.669 -4.133
246 HB3 ALA 14 2HB ALA 14 -0.002 -1.642 -2.906
247 H LEU 15 H LEU 15 2.149 -1.225 -2.458
248 HA LEU 15 HA LEU 15 2.643 1.564 -2.354
249 HG LEU 15 HG LEU 15 1.882 -0.840 -0.295
250 HB2 LEU 15 2HB LEU 15 4.145 -0.690 -0.995
251 HB3 LEU 15 1HB LEU 15 4.253 1.011 -0.552
252 HD11 LEU 15 1HD1 LEU 15 2.014 0.482 2.000
253 HD12 LEU 15 2HD1 LEU 15 3.680 0.754 1.490
254 HD13 LEU 15 3HD1 LEU 15 3.076 -0.891 1.690
255 HD21 LEU 15 3HD2 LEU 15 0.563 1.175 0.340
256 HD22 LEU 15 1HD2 LEU 15 1.072 1.239 -1.347
257 HD23 LEU 15 2HD2 LEU 15 1.919 2.198 -0.134
258 H TYR 16 H TYR 16 4.498 -1.060 -3.779
259 HA TYR 16 HA TYR 16 6.995 0.295 -4.008
260 HD1 TYR 16 HD2 TYR 16 9.027 -0.228 -5.370
261 HD2 TYR 16 HD1 TYR 16 7.036 -3.625 -3.648
262 HE1 TYR 16 HE2 TYR 16 11.162 -0.957 -4.338
263 HE2 TYR 16 HE1 TYR 16 9.172 -4.354 -2.617
264 HH TYR 16 HH TYR 16 12.113 -2.375 -2.887
265 HB2 TYR 16 2HB TYR 16 5.816 -2.153 -4.971
266 HB3 TYR 16 1HB TYR 16 6.712 -1.367 -6.273
267 H LEU 17 H LEU 17 4.602 -0.220 -6.630
268 HA LEU 17 HA LEU 17 5.800 1.552 -8.461
269 HG LEU 17 HG LEU 17 2.927 0.456 -6.831
270 HB2 LEU 17 2HB LEU 17 3.407 1.800 -9.387
271 HB3 LEU 17 1HB LEU 17 4.104 0.182 -9.337
272 HD11 LEU 17 1HD1 LEU 17 1.176 1.700 -8.964
273 HD12 LEU 17 2HD1 LEU 17 1.740 2.467 -7.479
274 HD13 LEU 17 3HD1 LEU 17 0.584 1.137 -7.401
275 HD21 LEU 17 3HD2 LEU 17 1.395 -1.240 -7.644
276 HD22 LEU 17 1HD2 LEU 17 2.961 -1.510 -8.410
277 HD23 LEU 17 2HD2 LEU 17 1.659 -0.737 -9.314
278 H VAL 18 H VAL 18 3.983 2.332 -5.589
279 HA VAL 18 HA VAL 18 3.577 5.120 -6.514
280 HB VAL 18 HB VAL 18 2.526 5.453 -4.286
281 HG11 VAL 18 1HG1 VAL 18 1.301 4.521 -6.321
282 HG12 VAL 18 2HG1 VAL 18 0.552 4.216 -4.752
283 HG13 VAL 18 3HG1 VAL 18 1.462 2.938 -5.559
284 HG21 VAL 18 3HG2 VAL 18 3.118 2.511 -3.945
285 HG22 VAL 18 1HG2 VAL 18 2.153 3.492 -2.847
286 HG23 VAL 18 2HG2 VAL 18 3.874 3.817 -3.033
287 H CYS 19 H CYS 19 5.321 3.308 -4.085
288 HA CYS 19 HA CYS 19 6.672 5.619 -2.968
289 HB2 CYS 19 2HB CYS 19 6.799 2.657 -2.631
290 HB3 CYS 19 1HB CYS 19 8.220 3.581 -2.160
291 H GLY 20 H GLY 20 8.035 2.757 -4.573
292 HA2 GLY 20 2HA GLY 20 9.636 2.748 -6.374
293 HA3 GLY 20 1HA GLY 20 9.852 4.490 -6.154
294 H GLU 21 H GLU 21 12.211 4.026 -6.053
295 HA GLU 21 HA GLU 21 13.258 2.386 -3.911
296 HB2 GLU 21 2HB GLU 21 15.315 2.830 -4.808
297 HB3 GLU 21 1HB GLU 21 14.354 3.381 -6.176
298 HG2 GLU 21 2HG GLU 21 15.683 5.248 -5.892
299 HG3 GLU 21 1HG GLU 21 14.383 5.670 -4.776
300 H ARG 22 H ARG 22 11.573 5.205 -3.678
301 HA ARG 22 HA ARG 22 13.190 6.673 -1.792
302 HE ARG 22 HE ARG 22 12.168 11.416 -2.687
303 HB2 ARG 22 2HB ARG 22 10.253 6.733 -2.499
304 HB3 ARG 22 1HB ARG 22 10.943 7.778 -1.256
305 HG2 ARG 22 2HG ARG 22 12.726 8.236 -3.215
306 HG3 ARG 22 1HG ARG 22 11.324 7.842 -4.210
307 HD2 ARG 22 2HD ARG 22 10.710 9.999 -3.915
308 HD3 ARG 22 1HD ARG 22 10.256 9.514 -2.282
309 HH11 ARG 22 1HH2 ARG 22 11.694 9.631 -0.143
310 HH12 ARG 22 2HH2 ARG 22 13.336 9.216 0.221
311 HH21 ARG 22 1HH1 ARG 22 14.558 10.229 -2.859
312 HH22 ARG 22 2HH1 ARG 22 14.954 9.549 -1.317
313 H GLY 23 H GLY 23 11.286 3.823 -1.512
314 HA2 GLY 23 2HA GLY 23 11.428 2.462 0.507
315 HA3 GLY 23 1HA GLY 23 11.669 3.935 1.442
316 H PHE 24 H PHE 24 9.575 1.624 1.411
317 HA PHE 24 HA PHE 24 7.156 3.387 1.388
318 HD1 PHE 24 HD2 PHE 24 8.731 1.223 -1.233
319 HD2 PHE 24 HD1 PHE 24 7.229 -1.009 2.119
320 HE1 PHE 24 HE2 PHE 24 10.332 -0.605 -1.732
321 HE2 PHE 24 HE1 PHE 24 8.829 -2.836 1.619
322 HZ PHE 24 HZ PHE 24 10.381 -2.635 -0.306
323 HB2 PHE 24 2HB PHE 24 6.056 0.938 1.326
324 HB3 PHE 24 1HB PHE 24 6.548 1.768 -0.147
325 H PHE 25 H PHE 25 5.387 1.936 2.840
326 HA PHE 25 HA PHE 25 6.709 1.785 5.517
327 HD1 PHE 25 HD2 PHE 25 6.307 1.937 7.518
328 HD2 PHE 25 HD1 PHE 25 4.166 5.194 5.704
329 HE1 PHE 25 HE2 PHE 25 7.125 3.462 9.292
330 HE2 PHE 25 HE1 PHE 25 4.987 6.717 7.479
331 HZ PHE 25 HZ PHE 25 6.465 5.853 9.272
332 HB2 PHE 25 2HB PHE 25 4.326 3.113 4.575
333 HB3 PHE 25 1HB PHE 25 3.883 1.927 5.799
334 H TYR 26 H TYR 26 3.539 0.531 4.471
335 HA TYR 26 HA TYR 26 2.618 -1.613 4.723
336 HD1 TYR 26 HD1 TYR 26 2.310 -3.558 5.327
337 HD2 TYR 26 HD2 TYR 26 6.022 -4.663 3.459
338 HE1 TYR 26 HE1 TYR 26 1.876 -5.935 5.873
339 HE2 TYR 26 HE2 TYR 26 5.586 -7.039 4.007
340 HH TYR 26 HH TYR 26 4.097 -8.240 5.940
341 HB2 TYR 26 2HB TYR 26 4.176 -2.301 3.011
342 HB3 TYR 26 1HB TYR 26 5.512 -2.292 4.149
343 H THR 27 H THR 27 2.980 -0.294 7.077
344 HA THR 27 HA THR 27 4.578 -1.878 8.948
345 HB THR 27 HB THR 27 4.141 -0.207 10.467
346 HG1 THR 27 HG1 THR 27 1.576 0.084 9.295
347 HG21 THR 27 3HG2 THR 27 2.967 1.496 8.339
348 HG22 THR 27 1HG2 THR 27 4.513 0.737 7.956
349 HG23 THR 27 2HG2 THR 27 4.370 1.787 9.367
350 H LYS 28 H LYS 28 3.835 -3.469 10.317
351 HA LYS 28 HA LYS 28 1.012 -3.890 10.835
352 HB2 LYS 28 2HB LYS 28 0.794 -6.061 9.725
353 HB3 LYS 28 1HB LYS 28 1.186 -4.818 8.540
354 HG2 LYS 28 2HG LYS 28 3.261 -6.622 9.821
355 HG3 LYS 28 1HG LYS 28 2.498 -6.957 8.271
356 HD2 LYS 28 2HD LYS 28 4.099 -5.696 7.319
357 HD3 LYS 28 1HD LYS 28 3.344 -4.295 8.077
358 HE2 LYS 28 2HE LYS 28 5.398 -4.063 9.058
359 HE3 LYS 28 1HE LYS 28 4.756 -5.259 10.181
360 HZ1 LYS 28 3HZ LYS 28 6.715 -5.582 8.039
361 HZ2 LYS 28 1HZ LYS 28 5.662 -6.880 8.329
362 HZ3 LYS 28 2HZ LYS 28 6.658 -6.301 9.578
363 HA PRO 29 HA PRO 29 4.248 -5.777 13.664
364 HB2 PRO 29 2HB PRO 29 4.099 -3.907 15.672
365 HB3 PRO 29 1HB PRO 29 5.264 -3.824 14.339
366 HG2 PRO 29 2HG PRO 29 2.759 -2.246 14.750
367 HG3 PRO 29 1HG PRO 29 4.248 -1.788 13.904
368 HD2 PRO 29 2HD PRO 29 1.870 -2.618 12.660
369 HD3 PRO 29 1HD PRO 29 3.473 -2.571 11.902
370 H THR 30 H THR 30 2.235 -3.895 15.814
371 HA THR 30 HA THR 30 0.120 -5.867 16.079
372 HB THR 30 HB THR 30 1.972 -7.074 17.199
373 HG1 THR 30 HG1 THR 30 -0.383 -6.584 18.151
374 HG21 THR 30 3HG2 THR 30 3.455 -6.009 18.507
375 HG22 THR 30 1HG2 THR 30 2.167 -5.373 19.530
376 HG23 THR 30 2HG2 THR 30 2.656 -4.495 18.081
Start of MODEL 9
1 H1 GLY 1 1H GLY 1 -3.292 -3.858 10.970
2 H2 GLY 1 2H GLY 1 -2.595 -2.912 12.196
3 H3 GLY 1 3H GLY 1 -1.779 -4.282 11.611
4 HA2 GLY 1 1HA GLY 1 -1.860 -1.676 10.459
5 HA3 GLY 1 2HA GLY 1 -0.579 -2.916 10.306
6 H ILE 2 H ILE 2 -0.790 -2.816 7.951
7 HA ILE 2 HA ILE 2 -3.276 -1.694 6.746
8 HB ILE 2 HB ILE 2 -1.312 -0.441 6.128
9 HG12 ILE 2 2HG1 ILE 2 -2.312 -2.316 3.974
10 HG13 ILE 2 1HG1 ILE 2 -2.811 -0.654 4.282
11 HG21 ILE 2 1HG2 ILE 2 0.376 -2.124 6.676
12 HG22 ILE 2 2HG2 ILE 2 0.618 -1.544 5.029
13 HG23 ILE 2 3HG2 ILE 2 -0.139 -3.112 5.310
14 HD11 ILE 2 3HD1 ILE 2 -0.086 -1.548 3.297
15 HD12 ILE 2 1HD1 ILE 2 -0.524 0.118 3.678
16 HD13 ILE 2 2HD1 ILE 2 -1.319 -0.720 2.345
17 H THR 3 H THR 3 -1.358 -4.570 6.991
18 HA THR 3 HA THR 3 -2.269 -5.859 4.578
19 HB THR 3 HB THR 3 -1.249 -6.996 7.197
20 HG1 THR 3 HG1 THR 3 -0.053 -6.725 4.641
21 HG21 THR 3 3HG2 THR 3 -0.852 -9.052 5.713
22 HG22 THR 3 1HG2 THR 3 -1.989 -8.317 4.583
23 HG23 THR 3 2HG2 THR 3 -2.516 -8.749 6.209
24 H GLU 4 H GLU 4 -3.925 -4.952 7.367
25 HA GLU 4 HA GLU 4 -5.898 -7.168 7.095
26 HB2 GLU 4 2HB GLU 4 -4.884 -6.299 9.368
27 HB3 GLU 4 1HB GLU 4 -6.085 -5.020 9.187
28 HG2 GLU 4 2HG GLU 4 -7.413 -6.540 10.277
29 HG3 GLU 4 1HG GLU 4 -7.641 -7.152 8.638
30 H GLN 5 H GLN 5 -5.858 -5.377 4.971
31 HA GLN 5 HA GLN 5 -8.557 -4.566 4.749
32 HB2 GLN 5 2HB GLN 5 -7.404 -2.858 6.487
33 HB3 GLN 5 1HB GLN 5 -6.955 -2.063 4.977
34 HG2 GLN 5 2HG GLN 5 -9.068 -1.356 4.615
35 HG3 GLN 5 1HG GLN 5 -9.733 -2.954 4.956
36 HE21 GLN 5 1HE2 GLN 5 -11.466 -2.044 6.290
37 HE22 GLN 5 2HE2 GLN 5 -11.145 -1.406 7.830
38 H CYS 6 H CYS 6 -5.272 -3.459 3.905
39 HA CYS 6 HA CYS 6 -5.912 -2.679 1.218
40 HB2 CYS 6 2HB CYS 6 -3.450 -3.223 2.790
41 HB3 CYS 6 1HB CYS 6 -3.293 -3.368 1.044
42 H CYS 7 H CYS 7 -5.756 -5.719 2.685
43 HA CYS 7 HA CYS 7 -5.523 -7.011 0.001
44 HB2 CYS 7 2HB CYS 7 -3.632 -7.636 1.374
45 HB3 CYS 7 1HB CYS 7 -4.679 -8.023 2.731
46 H THR 8 H THR 8 -7.147 -7.060 3.164
47 HA THR 8 HA THR 8 -9.036 -9.125 2.435
48 HB THR 8 HB THR 8 -9.180 -6.893 4.490
49 HG1 THR 8 HG1 THR 8 -7.696 -8.884 4.521
50 HG21 THR 8 3HG2 THR 8 -10.952 -8.699 5.383
51 HG22 THR 8 1HG2 THR 8 -11.137 -8.974 3.651
52 HG23 THR 8 2HG2 THR 8 -11.420 -7.369 4.324
53 H SER 9 H SER 9 -8.665 -5.785 1.718
54 HA SER 9 HA SER 9 -11.029 -5.848 -0.038
55 HG SER 9 HG SER 9 -13.077 -4.326 0.703
56 HB2 SER 9 2HB SER 9 -10.961 -4.416 2.509
57 HB3 SER 9 1HB SER 9 -11.233 -3.328 1.152
58 H ILE 10 H ILE 10 -11.009 -3.244 -0.920
59 HA ILE 10 HA ILE 10 -8.243 -3.023 -1.987
60 HB ILE 10 HB ILE 10 -10.855 -1.791 -2.894
61 HG12 ILE 10 2HG1 ILE 10 -9.013 -3.724 -4.323
62 HG13 ILE 10 1HG1 ILE 10 -10.349 -4.268 -3.309
63 HG21 ILE 10 1HG2 ILE 10 -8.102 -0.999 -3.362
64 HG22 ILE 10 2HG2 ILE 10 -9.588 -0.217 -3.902
65 HG23 ILE 10 3HG2 ILE 10 -8.868 -1.506 -4.867
66 HD11 ILE 10 3HD1 ILE 10 -10.564 -3.677 -5.977
67 HD12 ILE 10 1HD1 ILE 10 -11.082 -2.167 -5.229
68 HD13 ILE 10 2HD1 ILE 10 -11.911 -3.674 -4.837
69 H CYS 11 H CYS 11 -6.941 -1.305 -1.454
70 HA CYS 11 HA CYS 11 -7.906 0.537 0.627
71 HB2 CYS 11 2HB CYS 11 -5.259 -0.127 -0.600
72 HB3 CYS 11 1HB CYS 11 -5.441 1.435 0.197
73 H SER 12 H SER 12 -7.071 2.922 0.302
74 HA SER 12 HA SER 12 -8.034 3.827 -2.381
75 HG SER 12 HG SER 12 -7.518 4.899 1.033
76 HB2 SER 12 2HB SER 12 -8.054 6.065 -0.808
77 HB3 SER 12 1HB SER 12 -9.447 5.014 -1.049
78 H LEU 13 H LEU 13 -6.224 4.013 -3.592
79 HA LEU 13 HA LEU 13 -3.604 4.385 -3.222
80 HG LEU 13 HG LEU 13 -5.622 3.899 -5.343
81 HB2 LEU 13 2HB LEU 13 -4.521 6.662 -4.823
82 HB3 LEU 13 1HB LEU 13 -3.493 5.315 -5.277
83 HD11 LEU 13 1HD1 LEU 13 -7.533 4.892 -4.665
84 HD12 LEU 13 2HD1 LEU 13 -7.383 6.031 -6.003
85 HD13 LEU 13 3HD1 LEU 13 -6.682 6.418 -4.432
86 HD21 LEU 13 3HD2 LEU 13 -4.455 5.749 -7.181
87 HD22 LEU 13 1HD2 LEU 13 -6.197 5.713 -7.451
88 HD23 LEU 13 2HD2 LEU 13 -5.261 4.219 -7.528
89 H TYR 14 H TYR 14 -5.915 7.011 -2.849
90 HA TYR 14 HA TYR 14 -4.275 9.123 -2.111
91 HD1 TYR 14 HD2 TYR 14 -6.687 8.461 1.273
92 HD2 TYR 14 HD1 TYR 14 -5.780 11.717 -1.380
93 HE1 TYR 14 HE2 TYR 14 -6.619 10.015 3.207
94 HE2 TYR 14 HE1 TYR 14 -5.713 13.273 0.553
95 HH TYR 14 HH TYR 14 -6.433 13.469 2.782
96 HB2 TYR 14 2HB TYR 14 -6.580 9.586 -2.235
97 HB3 TYR 14 1HB TYR 14 -6.992 8.254 -1.160
98 H GLN 15 H GLN 15 -5.721 6.831 0.195
99 HA GLN 15 HA GLN 15 -3.899 7.594 2.324
100 HB2 GLN 15 2HB GLN 15 -6.020 5.542 1.937
101 HB3 GLN 15 1HB GLN 15 -4.782 5.177 3.135
102 HG2 GLN 15 2HG GLN 15 -5.688 6.626 4.600
103 HG3 GLN 15 1HG GLN 15 -5.643 7.925 3.407
104 HE21 GLN 15 1HE2 GLN 15 -7.735 5.780 5.104
105 HE22 GLN 15 2HE2 GLN 15 -9.155 6.123 4.240
106 H LEU 16 H LEU 16 -4.148 4.999 -0.012
107 HA LEU 16 HA LEU 16 -2.135 3.235 0.694
108 HG LEU 16 HG LEU 16 -2.243 1.802 -2.580
109 HB2 LEU 16 2HB LEU 16 -3.639 3.526 -1.502
110 HB3 LEU 16 1HB LEU 16 -2.139 4.213 -2.125
111 HD11 LEU 16 1HD1 LEU 16 -0.247 2.321 -0.372
112 HD12 LEU 16 2HD1 LEU 16 -0.081 3.011 -1.987
113 HD13 LEU 16 3HD1 LEU 16 -0.061 1.262 -1.767
114 HD21 LEU 16 3HD2 LEU 16 -3.636 1.509 -0.368
115 HD22 LEU 16 1HD2 LEU 16 -2.049 1.279 0.366
116 HD23 LEU 16 2HD2 LEU 16 -2.589 0.204 -0.924
117 H GLU 17 H GLU 17 -1.819 6.448 -0.709
118 HA GLU 17 HA GLU 17 1.048 6.264 -1.102
119 HB2 GLU 17 2HB GLU 17 -0.244 7.773 -2.480
120 HB3 GLU 17 1HB GLU 17 -0.861 8.612 -1.059
121 HG2 GLU 17 2HG GLU 17 1.588 9.135 -0.496
122 HG3 GLU 17 1HG GLU 17 1.967 8.593 -2.131
123 H ASN 18 H ASN 18 -0.952 6.937 1.617
124 HA ASN 18 HA ASN 18 1.048 8.526 3.027
125 HB2 ASN 18 2HB ASN 18 -1.407 8.702 3.497
126 HB3 ASN 18 1HB ASN 18 -1.355 7.071 4.168
127 HD21 ASN 18 1HD2 ASN 18 0.102 10.331 4.587
128 HD22 ASN 18 2HD2 ASN 18 0.408 10.148 6.247
129 H TYR 19 H TYR 19 0.631 5.211 2.385
130 HA TYR 19 HA TYR 19 2.170 4.419 4.796
131 HD1 TYR 19 HD2 TYR 19 0.296 2.825 6.165
132 HD2 TYR 19 HD1 TYR 19 -0.999 3.415 2.117
133 HE1 TYR 19 HE2 TYR 19 -2.034 3.110 6.956
134 HE2 TYR 19 HE1 TYR 19 -3.332 3.702 2.899
135 HH TYR 19 HH TYR 19 -4.306 2.927 6.094
136 HB2 TYR 19 2HB TYR 19 1.196 2.621 2.567
137 HB3 TYR 19 1HB TYR 19 1.690 2.152 4.192
138 H CYS 20 H CYS 20 2.928 5.765 1.924
139 HA CYS 20 HA CYS 20 5.014 3.901 1.090
140 HB2 CYS 20 2HB CYS 20 5.472 5.366 -0.645
141 HB3 CYS 20 1HB CYS 20 3.815 5.743 -0.364
142 H ASN 21 H ASN 21 7.257 5.363 0.756
143 HA ASN 21 HA ASN 21 8.502 5.302 3.306
144 HB2 ASN 21 2HB ASN 21 9.857 5.239 1.292
145 HB3 ASN 21 1HB ASN 21 9.294 6.838 0.814
146 HD21 ASN 21 1HD2 ASN 21 11.747 7.304 0.883
147 HD22 ASN 21 2HD2 ASN 21 12.413 7.755 2.377
148 HA PHE 1 HA PHE 1 -8.385 5.158 -9.192
149 HD1 PHE 1 HD1 PHE 1 -7.128 6.773 -9.089
150 HD2 PHE 1 HD2 PHE 1 -10.494 8.856 -10.764
151 HE1 PHE 1 HE1 PHE 1 -6.362 8.874 -8.016
152 HE2 PHE 1 HE2 PHE 1 -9.728 10.956 -9.691
153 HZ PHE 1 HZ PHE 1 -7.664 10.966 -8.317
154 H1 PHE 1 1H PHE 1 -6.368 5.180 -10.115
155 H2 PHE 1 2H PHE 1 -6.964 6.427 -11.103
156 H3 PHE 1 3H PHE 1 -6.954 4.825 -11.666
157 HB2 PHE 1 2HB PHE 1 -9.319 6.527 -11.732
158 HB3 PHE 1 1HB PHE 1 -10.355 6.197 -10.346
159 H VAL 2 H VAL 2 -7.866 2.796 -9.699
160 HA VAL 2 HA VAL 2 -10.135 1.667 -11.223
161 HB VAL 2 HB VAL 2 -7.356 0.605 -11.684
162 HG11 VAL 2 1HG1 VAL 2 -9.950 -0.281 -12.265
163 HG12 VAL 2 2HG1 VAL 2 -8.450 -0.902 -12.954
164 HG13 VAL 2 3HG1 VAL 2 -9.345 0.369 -13.788
165 HG21 VAL 2 3HG2 VAL 2 -7.455 2.986 -12.379
166 HG22 VAL 2 1HG2 VAL 2 -8.884 2.630 -13.349
167 HG23 VAL 2 2HG2 VAL 2 -7.330 1.908 -13.770
168 H ASN 3 H ASN 3 -9.579 1.843 -8.497
169 HA ASN 3 HA ASN 3 -9.595 0.518 -6.548
170 HB2 ASN 3 2HB ASN 3 -10.428 -1.451 -8.679
171 HB3 ASN 3 1HB ASN 3 -10.296 -1.922 -6.984
172 HD21 ASN 3 1HD2 ASN 3 -11.273 0.338 -5.666
173 HD22 ASN 3 2HD2 ASN 3 -12.892 0.607 -6.099
174 H GLN 4 H GLN 4 -7.695 0.067 -5.537
175 HA GLN 4 HA GLN 4 -5.659 -1.487 -7.037
176 HB2 GLN 4 2HB GLN 4 -5.277 0.915 -6.093
177 HB3 GLN 4 1HB GLN 4 -5.162 0.113 -4.529
178 HG2 GLN 4 2HG GLN 4 -2.946 0.419 -5.600
179 HG3 GLN 4 1HG GLN 4 -3.336 -1.281 -5.338
180 HE21 GLN 4 1HE2 GLN 4 -2.450 -2.367 -7.127
181 HE22 GLN 4 2HE2 GLN 4 -2.702 -1.920 -8.745
182 H HIS 5 H HIS 5 -5.587 -3.606 -6.433
183 HA HIS 5 HA HIS 5 -6.482 -4.410 -3.731
184 HD2 HIS 5 HD2 HIS 5 -7.064 -4.428 -7.726
185 HE1 HIS 5 HE1 HIS 5 -10.630 -6.209 -6.314
186 HE2 HIS 5 HE2 HIS 5 -9.615 -4.739 -8.136
187 HB2 HIS 5 2HB HIS 5 -5.385 -6.146 -5.966
188 HB3 HIS 5 1HB HIS 5 -6.270 -6.689 -4.544
189 H LEU 6 H LEU 6 -5.019 -4.721 -2.077
190 HA LEU 6 HA LEU 6 -2.142 -4.946 -2.851
191 HG LEU 6 HG LEU 6 -2.418 -1.858 -2.378
192 HB2 LEU 6 2HB LEU 6 -3.545 -3.223 -0.890
193 HB3 LEU 6 1HB LEU 6 -2.083 -3.973 -0.290
194 HD11 LEU 6 1HD1 LEU 6 0.122 -2.131 -0.977
195 HD12 LEU 6 2HD1 LEU 6 -1.250 -2.106 0.133
196 HD13 LEU 6 3HD1 LEU 6 -1.007 -0.779 -1.003
197 HD21 LEU 6 3HD2 LEU 6 -0.555 -4.199 -2.637
198 HD22 LEU 6 1HD2 LEU 6 0.081 -2.603 -3.008
199 HD23 LEU 6 2HD2 LEU 6 -1.306 -3.224 -3.898
200 H CYS 7 H CYS 7 -0.943 -6.542 -1.926
201 HA CYS 7 HA CYS 7 -1.596 -7.816 0.539
202 HB2 CYS 7 2HB CYS 7 -3.471 -8.544 -1.165
203 HB3 CYS 7 1HB CYS 7 -2.231 -9.640 -1.767
204 H GLY 8 H GLY 8 0.354 -8.552 1.151
205 HA2 GLY 8 2HA GLY 8 2.584 -9.289 1.008
206 HA3 GLY 8 1HA GLY 8 1.918 -10.478 -0.109
207 H SER 9 H SER 9 3.152 -10.512 -1.894
208 HA SER 9 HA SER 9 5.014 -8.725 -2.824
209 HG SER 9 HG SER 9 5.971 -9.675 -4.491
210 HB2 SER 9 2HB SER 9 4.146 -11.002 -3.825
211 HB3 SER 9 1HB SER 9 3.166 -9.952 -4.846
212 H ASP 10 H ASP 10 1.564 -8.654 -3.797
213 HA ASP 10 HA ASP 10 1.785 -6.271 -5.349
214 HB2 ASP 10 2HB ASP 10 -0.615 -7.365 -3.850
215 HB3 ASP 10 1HB ASP 10 -0.665 -6.169 -5.141
216 H LEU 11 H LEU 11 1.302 -6.814 -1.909
217 HA LEU 11 HA LEU 11 0.400 -4.281 -1.086
218 HG LEU 11 HG LEU 11 2.396 -4.176 1.698
219 HB2 LEU 11 2HB LEU 11 0.694 -6.260 0.402
220 HB3 LEU 11 1HB LEU 11 2.438 -6.033 0.323
221 HD11 LEU 11 1HD1 LEU 11 -0.316 -3.666 0.495
222 HD12 LEU 11 2HD1 LEU 11 1.116 -2.635 0.474
223 HD13 LEU 11 3HD1 LEU 11 0.192 -2.831 1.963
224 HD21 LEU 11 3HD2 LEU 11 1.373 -6.064 2.926
225 HD22 LEU 11 1HD2 LEU 11 -0.223 -5.524 2.406
226 HD23 LEU 11 2HD2 LEU 11 0.742 -4.512 3.480
227 H VAL 12 H VAL 12 3.805 -5.321 -1.530
228 HA VAL 12 HA VAL 12 4.828 -2.683 -0.931
229 HB VAL 12 HB VAL 12 6.910 -3.622 -2.158
230 HG11 VAL 12 1HG1 VAL 12 5.654 -4.457 0.394
231 HG12 VAL 12 2HG1 VAL 12 7.243 -3.751 0.098
232 HG13 VAL 12 3HG1 VAL 12 6.980 -5.474 -0.171
233 HG21 VAL 12 3HG2 VAL 12 5.401 -6.216 -1.815
234 HG22 VAL 12 1HG2 VAL 12 6.929 -5.945 -2.651
235 HG23 VAL 12 2HG2 VAL 12 5.427 -5.346 -3.349
236 H GLU 13 H GLU 13 3.585 -4.237 -3.799
237 HA GLU 13 HA GLU 13 4.736 -2.589 -5.799
238 HB2 GLU 13 2HB GLU 13 3.287 -4.648 -6.146
239 HB3 GLU 13 1HB GLU 13 1.890 -3.626 -5.804
240 HG2 GLU 13 2HG GLU 13 1.937 -3.285 -8.060
241 HG3 GLU 13 1HG GLU 13 3.158 -2.084 -7.633
242 H ALA 14 H ALA 14 1.548 -2.206 -4.197
243 HA ALA 14 HA ALA 14 0.965 0.370 -5.227
244 HB1 ALA 14 3HB ALA 14 0.254 -0.647 -2.465
245 HB2 ALA 14 1HB ALA 14 -0.607 -1.119 -3.928
246 HB3 ALA 14 2HB ALA 14 -0.617 0.564 -3.405
247 H LEU 15 H LEU 15 2.483 -0.522 -2.127
248 HA LEU 15 HA LEU 15 3.105 2.101 -1.257
249 HG LEU 15 HG LEU 15 2.511 -0.820 0.321
250 HB2 LEU 15 2HB LEU 15 4.526 -0.516 -0.754
251 HB3 LEU 15 1HB LEU 15 4.881 0.979 0.104
252 HD11 LEU 15 1HD1 LEU 15 4.328 0.796 2.070
253 HD12 LEU 15 2HD1 LEU 15 3.928 -0.920 2.157
254 HD13 LEU 15 3HD1 LEU 15 2.757 0.287 2.689
255 HD21 LEU 15 3HD2 LEU 15 1.518 1.336 -0.479
256 HD22 LEU 15 1HD2 LEU 15 2.340 2.175 0.837
257 HD23 LEU 15 2HD2 LEU 15 1.089 0.985 1.195
258 H TYR 16 H TYR 16 4.642 -0.008 -3.572
259 HA TYR 16 HA TYR 16 7.192 1.314 -3.700
260 HD1 TYR 16 HD2 TYR 16 9.043 1.069 -5.496
261 HD2 TYR 16 HD1 TYR 16 7.124 -2.566 -4.241
262 HE1 TYR 16 HE2 TYR 16 11.259 0.075 -4.989
263 HE2 TYR 16 HE1 TYR 16 9.341 -3.560 -3.733
264 HH TYR 16 HH TYR 16 11.566 -3.310 -3.977
265 HB2 TYR 16 2HB TYR 16 5.822 -0.823 -5.077
266 HB3 TYR 16 1HB TYR 16 6.582 0.248 -6.251
267 H LEU 17 H LEU 17 4.547 1.394 -6.107
268 HA LEU 17 HA LEU 17 5.533 3.592 -7.562
269 HG LEU 17 HG LEU 17 2.853 1.969 -6.032
270 HB2 LEU 17 2HB LEU 17 3.012 4.004 -8.100
271 HB3 LEU 17 1HB LEU 17 3.777 2.516 -8.643
272 HD11 LEU 17 1HD1 LEU 17 1.050 3.798 -7.558
273 HD12 LEU 17 2HD1 LEU 17 1.280 3.645 -5.816
274 HD13 LEU 17 3HD1 LEU 17 0.317 2.452 -6.687
275 HD21 LEU 17 3HD2 LEU 17 1.739 1.295 -8.777
276 HD22 LEU 17 1HD2 LEU 17 1.249 0.489 -7.287
277 HD23 LEU 17 2HD2 LEU 17 2.912 0.352 -7.857
278 H VAL 18 H VAL 18 3.214 3.687 -4.816
279 HA VAL 18 HA VAL 18 2.731 6.426 -4.776
280 HB VAL 18 HB VAL 18 2.801 6.152 -2.180
281 HG11 VAL 18 1HG1 VAL 18 0.693 4.681 -2.372
282 HG12 VAL 18 2HG1 VAL 18 1.006 4.677 -4.108
283 HG13 VAL 18 3HG1 VAL 18 0.695 6.198 -3.272
284 HG21 VAL 18 3HG2 VAL 18 3.911 3.674 -3.096
285 HG22 VAL 18 1HG2 VAL 18 2.370 3.357 -2.308
286 HG23 VAL 18 2HG2 VAL 18 3.648 4.209 -1.439
287 H CYS 19 H CYS 19 5.184 5.200 -2.459
288 HA CYS 19 HA CYS 19 6.538 7.758 -2.730
289 HB2 CYS 19 2HB CYS 19 7.001 5.396 -1.049
290 HB3 CYS 19 1HB CYS 19 8.467 6.194 -1.580
291 H GLY 20 H GLY 20 7.608 4.429 -3.433
292 HA2 GLY 20 2HA GLY 20 8.432 4.115 -5.845
293 HA3 GLY 20 1HA GLY 20 9.412 5.551 -5.536
294 H GLU 21 H GLU 21 11.192 3.923 -6.076
295 HA GLU 21 HA GLU 21 11.804 1.759 -4.306
296 HB2 GLU 21 2HB GLU 21 13.971 1.738 -5.321
297 HB3 GLU 21 1HB GLU 21 12.848 2.232 -6.589
298 HG2 GLU 21 2HG GLU 21 13.644 4.593 -5.217
299 HG3 GLU 21 1HG GLU 21 15.110 3.668 -5.545
300 H ARG 22 H ARG 22 11.873 5.121 -3.805
301 HA ARG 22 HA ARG 22 14.095 5.500 -2.117
302 HE ARG 22 HE ARG 22 11.678 9.510 -0.269
303 HB2 ARG 22 2HB ARG 22 11.518 6.829 -2.566
304 HB3 ARG 22 1HB ARG 22 12.131 7.028 -0.924
305 HG2 ARG 22 2HG ARG 22 14.404 7.417 -2.416
306 HG3 ARG 22 1HG ARG 22 13.165 8.121 -3.458
307 HD2 ARG 22 2HD ARG 22 13.914 8.890 -0.641
308 HD3 ARG 22 1HD ARG 22 13.791 9.918 -2.068
309 HH11 ARG 22 1HH2 ARG 22 12.332 10.194 -3.510
310 HH12 ARG 22 2HH2 ARG 22 10.698 10.007 -4.052
311 HH21 ARG 22 1HH1 ARG 22 9.543 8.809 -1.012
312 HH22 ARG 22 2HH1 ARG 22 9.121 9.222 -2.640
313 H GLY 23 H GLY 23 11.213 3.673 -1.568
314 HA2 GLY 23 2HA GLY 23 11.737 2.015 0.382
315 HA3 GLY 23 1HA GLY 23 11.844 3.491 1.340
316 H PHE 24 H PHE 24 10.004 1.781 2.224
317 HA PHE 24 HA PHE 24 7.503 3.226 1.811
318 HD1 PHE 24 HD1 PHE 24 8.608 -0.401 2.541
319 HD2 PHE 24 HD2 PHE 24 8.065 0.595 -1.604
320 HE1 PHE 24 HE1 PHE 24 10.214 -2.182 1.902
321 HE2 PHE 24 HE2 PHE 24 9.667 -1.185 -2.240
322 HZ PHE 24 HZ PHE 24 10.744 -2.574 -0.489
323 HB2 PHE 24 2HB PHE 24 6.382 0.851 1.344
324 HB3 PHE 24 1HB PHE 24 6.975 1.855 0.021
325 H PHE 25 H PHE 25 5.714 1.598 3.057
326 HA PHE 25 HA PHE 25 7.071 1.062 5.662
327 HD1 PHE 25 HD2 PHE 25 6.041 -0.024 7.468
328 HD2 PHE 25 HD1 PHE 25 4.607 4.021 7.202
329 HE1 PHE 25 HE2 PHE 25 6.467 0.287 9.890
330 HE2 PHE 25 HE1 PHE 25 5.035 4.329 9.624
331 HZ PHE 25 HZ PHE 25 5.963 2.463 10.969
332 HB2 PHE 25 2HB PHE 25 4.998 2.755 5.212
333 HB3 PHE 25 1HB PHE 25 4.105 1.274 5.555
334 H TYR 26 H TYR 26 3.980 -0.085 4.258
335 HA TYR 26 HA TYR 26 3.106 -2.262 4.152
336 HD1 TYR 26 HD1 TYR 26 2.815 -4.266 4.474
337 HD2 TYR 26 HD2 TYR 26 6.678 -5.030 2.744
338 HE1 TYR 26 HE1 TYR 26 2.390 -6.702 4.601
339 HE2 TYR 26 HE2 TYR 26 6.247 -7.466 2.871
340 HH TYR 26 HH TYR 26 3.211 -8.775 3.393
341 HB2 TYR 26 2HB TYR 26 4.861 -2.653 2.526
342 HB3 TYR 26 1HB TYR 26 6.066 -2.802 3.795
343 H THR 27 H THR 27 3.238 -1.244 6.691
344 HA THR 27 HA THR 27 4.643 -3.150 8.443
345 HB THR 27 HB THR 27 4.435 -0.716 9.003
346 HG1 THR 27 HG1 THR 27 3.495 -1.206 11.173
347 HG21 THR 27 3HG2 THR 27 2.423 0.337 9.213
348 HG22 THR 27 1HG2 THR 27 1.640 -1.084 9.904
349 HG23 THR 27 2HG2 THR 27 1.863 -0.961 8.158
350 H LYS 28 H LYS 28 3.715 -4.995 9.189
351 HA LYS 28 HA LYS 28 0.940 -5.595 8.502
352 HB2 LYS 28 2HB LYS 28 3.170 -7.163 8.891
353 HB3 LYS 28 1HB LYS 28 2.267 -7.426 10.384
354 HG2 LYS 28 2HG LYS 28 0.539 -8.475 9.318
355 HG3 LYS 28 1HG LYS 28 0.678 -7.467 7.878
356 HD2 LYS 28 2HD LYS 28 1.588 -9.326 6.935
357 HD3 LYS 28 1HD LYS 28 3.046 -8.837 7.800
358 HE2 LYS 28 2HE LYS 28 1.873 -10.167 9.791
359 HE3 LYS 28 1HE LYS 28 1.093 -11.004 8.449
360 HZ1 LYS 28 3HZ LYS 28 4.018 -10.672 8.834
361 HZ2 LYS 28 1HZ LYS 28 3.286 -11.442 7.512
362 HZ3 LYS 28 2HZ LYS 28 3.136 -12.105 9.070
363 HA PRO 29 HA PRO 29 0.457 -5.411 13.238
364 HB2 PRO 29 2HB PRO 29 2.534 -4.354 14.695
365 HB3 PRO 29 1HB PRO 29 2.358 -6.082 14.343
366 HG2 PRO 29 2HG PRO 29 4.239 -4.107 13.149
367 HG3 PRO 29 1HG PRO 29 4.405 -5.864 13.302
368 HD2 PRO 29 2HD PRO 29 3.677 -4.454 10.960
369 HD3 PRO 29 1HD PRO 29 3.552 -6.206 11.206
370 H THR 30 H THR 30 0.726 -3.363 15.033
371 HA THR 30 HA THR 30 -0.391 -1.097 13.569
372 HB THR 30 HB THR 30 0.382 -0.977 16.470
373 HG1 THR 30 HG1 THR 30 -1.296 -2.252 17.004
374 HG21 THR 30 3HG2 THR 30 -1.582 0.269 14.618
375 HG22 THR 30 1HG2 THR 30 -0.698 0.982 15.967
376 HG23 THR 30 2HG2 THR 30 -2.122 -0.013 16.274
Start of MODEL 10
1 H1 GLY 1 1H GLY 1 -3.474 0.832 11.840
2 H2 GLY 1 2H GLY 1 -2.545 1.456 10.562
3 H3 GLY 1 3H GLY 1 -1.801 0.548 11.790
4 HA2 GLY 1 1HA GLY 1 -2.099 -0.901 9.950
5 HA3 GLY 1 2HA GLY 1 -3.288 -1.426 11.173
6 H ILE 2 H ILE 2 -1.875 -1.268 8.153
7 HA ILE 2 HA ILE 2 -4.223 -0.205 6.657
8 HB ILE 2 HB ILE 2 -1.795 0.585 6.227
9 HG12 ILE 2 2HG1 ILE 2 -3.634 -0.422 4.038
10 HG13 ILE 2 1HG1 ILE 2 -3.604 1.194 4.743
11 HG21 ILE 2 1HG2 ILE 2 -0.558 -0.825 4.608
12 HG22 ILE 2 2HG2 ILE 2 -1.773 -2.088 4.801
13 HG23 ILE 2 3HG2 ILE 2 -0.751 -1.631 6.165
14 HD11 ILE 2 3HD1 ILE 2 -0.993 0.862 3.902
15 HD12 ILE 2 1HD1 ILE 2 -2.242 1.732 3.011
16 HD13 ILE 2 2HD1 ILE 2 -1.910 0.041 2.638
17 H THR 3 H THR 3 -2.633 -3.112 7.547
18 HA THR 3 HA THR 3 -3.440 -4.727 5.292
19 HB THR 3 HB THR 3 -2.629 -5.385 8.132
20 HG1 THR 3 HG1 THR 3 -0.948 -4.783 6.830
21 HG21 THR 3 3HG2 THR 3 -2.505 -7.772 7.246
22 HG22 THR 3 1HG2 THR 3 -3.500 -7.225 5.896
23 HG23 THR 3 2HG2 THR 3 -4.129 -7.152 7.542
24 H GLU 4 H GLU 4 -5.037 -3.523 8.114
25 HA GLU 4 HA GLU 4 -7.284 -5.429 7.828
26 HB2 GLU 4 2HB GLU 4 -6.694 -3.192 9.783
27 HB3 GLU 4 1HB GLU 4 -8.230 -4.059 9.763
28 HG2 GLU 4 2HG GLU 4 -6.992 -5.284 11.330
29 HG3 GLU 4 1HG GLU 4 -6.733 -6.201 9.846
30 H GLN 5 H GLN 5 -6.834 -3.820 5.577
31 HA GLN 5 HA GLN 5 -9.435 -2.687 5.171
32 HB2 GLN 5 2HB GLN 5 -7.920 -0.952 6.621
33 HB3 GLN 5 1HB GLN 5 -7.461 -0.477 4.984
34 HG2 GLN 5 2HG GLN 5 -9.364 0.737 4.940
35 HG3 GLN 5 1HG GLN 5 -10.222 -0.801 4.828
36 HE21 GLN 5 1HE2 GLN 5 -10.954 1.775 6.304
37 HE22 GLN 5 2HE2 GLN 5 -11.239 1.280 7.902
38 H CYS 6 H CYS 6 -6.005 -2.463 4.208
39 HA CYS 6 HA CYS 6 -6.701 -2.072 1.405
40 HB2 CYS 6 2HB CYS 6 -4.237 -2.178 3.005
41 HB3 CYS 6 1HB CYS 6 -4.073 -2.873 1.392
42 H CYS 7 H CYS 7 -6.451 -4.733 3.490
43 HA CYS 7 HA CYS 7 -6.281 -6.558 1.135
44 HB2 CYS 7 2HB CYS 7 -4.458 -6.792 2.830
45 HB3 CYS 7 1HB CYS 7 -5.675 -7.190 4.028
46 H THR 8 H THR 8 -8.108 -5.656 4.003
47 HA THR 8 HA THR 8 -10.007 -7.867 3.749
48 HB THR 8 HB THR 8 -11.203 -5.628 5.064
49 HG1 THR 8 HG1 THR 8 -9.512 -4.625 5.761
50 HG21 THR 8 3HG2 THR 8 -11.769 -7.672 5.961
51 HG22 THR 8 1HG2 THR 8 -10.492 -7.219 7.089
52 HG23 THR 8 2HG2 THR 8 -10.145 -8.328 5.763
53 H SER 9 H SER 9 -9.513 -4.709 2.467
54 HA SER 9 HA SER 9 -11.722 -5.080 0.541
55 HG SER 9 HG SER 9 -13.928 -2.954 1.701
56 HB2 SER 9 2HB SER 9 -11.709 -3.100 2.719
57 HB3 SER 9 1HB SER 9 -11.914 -2.377 1.126
58 H ILE 10 H ILE 10 -11.371 -3.474 -1.317
59 HA ILE 10 HA ILE 10 -8.493 -3.274 -1.785
60 HB ILE 10 HB ILE 10 -8.966 -2.808 -4.020
61 HG12 ILE 10 2HG1 ILE 10 -11.296 -1.953 -4.728
62 HG13 ILE 10 1HG1 ILE 10 -11.525 -1.548 -3.025
63 HG21 ILE 10 1HG2 ILE 10 -11.081 -4.509 -2.782
64 HG22 ILE 10 2HG2 ILE 10 -9.814 -4.939 -3.927
65 HG23 ILE 10 3HG2 ILE 10 -11.249 -4.080 -4.483
66 HD11 ILE 10 3HD1 ILE 10 -10.251 0.276 -3.241
67 HD12 ILE 10 1HD1 ILE 10 -10.159 -0.043 -4.974
68 HD13 ILE 10 2HD1 ILE 10 -8.924 -0.687 -3.891
69 H CYS 11 H CYS 11 -7.374 -1.240 -2.249
70 HA CYS 11 HA CYS 11 -8.737 1.093 -0.950
71 HB2 CYS 11 2HB CYS 11 -6.054 1.658 -0.684
72 HB3 CYS 11 1HB CYS 11 -7.074 0.984 0.581
73 H SER 12 H SER 12 -6.850 3.054 -1.563
74 HA SER 12 HA SER 12 -6.959 3.094 -4.554
75 HG SER 12 HG SER 12 -7.455 6.470 -2.396
76 HB2 SER 12 2HB SER 12 -7.267 5.533 -4.369
77 HB3 SER 12 1HB SER 12 -8.557 4.661 -3.546
78 H LEU 13 H LEU 13 -5.071 3.312 -5.559
79 HA LEU 13 HA LEU 13 -2.529 3.325 -4.427
80 HG LEU 13 HG LEU 13 -0.812 3.752 -6.803
81 HB2 LEU 13 2HB LEU 13 -2.990 2.872 -6.749
82 HB3 LEU 13 1HB LEU 13 -3.742 4.437 -6.965
83 HD11 LEU 13 1HD1 LEU 13 -2.141 3.732 -8.901
84 HD12 LEU 13 2HD1 LEU 13 -0.870 4.956 -8.918
85 HD13 LEU 13 3HD1 LEU 13 -2.546 5.425 -8.626
86 HD21 LEU 13 3HD2 LEU 13 -2.114 6.460 -6.352
87 HD22 LEU 13 1HD2 LEU 13 -0.485 6.301 -7.004
88 HD23 LEU 13 2HD2 LEU 13 -0.846 5.697 -5.390
89 H TYR 14 H TYR 14 -4.561 6.008 -5.493
90 HA TYR 14 HA TYR 14 -3.016 8.226 -5.102
91 HD1 TYR 14 HD2 TYR 14 -3.788 10.161 -3.124
92 HD2 TYR 14 HD1 TYR 14 -6.078 9.883 -6.749
93 HE1 TYR 14 HE2 TYR 14 -3.533 12.605 -3.474
94 HE2 TYR 14 HE1 TYR 14 -5.824 12.325 -7.099
95 HH TYR 14 HH TYR 14 -4.801 14.183 -6.402
96 HB2 TYR 14 2HB TYR 14 -5.575 7.944 -5.583
97 HB3 TYR 14 1HB TYR 14 -5.728 8.193 -3.852
98 H GLN 15 H GLN 15 -4.982 6.935 -2.436
99 HA GLN 15 HA GLN 15 -3.439 8.374 -0.452
100 HB2 GLN 15 2HB GLN 15 -4.867 7.392 1.146
101 HB3 GLN 15 1HB GLN 15 -5.867 7.575 -0.288
102 HG2 GLN 15 2HG GLN 15 -5.424 5.219 -0.895
103 HG3 GLN 15 1HG GLN 15 -4.457 5.037 0.568
104 HE21 GLN 15 1HE2 GLN 15 -7.502 6.898 0.332
105 HE22 GLN 15 2HE2 GLN 15 -8.378 5.903 1.392
106 H LEU 16 H LEU 16 -3.658 5.017 -1.465
107 HA LEU 16 HA LEU 16 -1.932 3.696 0.241
108 HG LEU 16 HG LEU 16 -1.838 1.721 -0.149
109 HB2 LEU 16 2HB LEU 16 -3.065 3.158 -2.210
110 HB3 LEU 16 1HB LEU 16 -1.353 3.203 -2.617
111 HD11 LEU 16 1HD1 LEU 16 -3.952 1.381 -1.734
112 HD12 LEU 16 2HD1 LEU 16 -3.236 0.030 -0.856
113 HD13 LEU 16 3HD1 LEU 16 -2.848 0.280 -2.558
114 HD21 LEU 16 3HD2 LEU 16 -0.811 0.504 -2.677
115 HD22 LEU 16 1HD2 LEU 16 -0.201 0.338 -1.033
116 HD23 LEU 16 2HD2 LEU 16 0.125 1.807 -1.955
117 H GLU 17 H GLU 17 -1.182 6.166 -2.105
118 HA GLU 17 HA GLU 17 1.683 5.690 -2.166
119 HB2 GLU 17 2HB GLU 17 0.804 6.829 -4.040
120 HB3 GLU 17 1HB GLU 17 -0.094 7.965 -3.036
121 HG2 GLU 17 2HG GLU 17 1.970 9.022 -2.297
122 HG3 GLU 17 1HG GLU 17 2.933 7.812 -3.146
123 H ASN 18 H ASN 18 -0.437 7.490 -0.072
124 HA ASN 18 HA ASN 18 1.506 9.291 1.018
125 HB2 ASN 18 2HB ASN 18 -1.240 8.619 1.511
126 HB3 ASN 18 1HB ASN 18 -0.372 8.670 3.044
127 HD21 ASN 18 1HD2 ASN 18 -2.330 10.678 2.118
128 HD22 ASN 18 2HD2 ASN 18 -1.493 12.150 2.006
129 H TYR 19 H TYR 19 1.374 5.915 1.283
130 HA TYR 19 HA TYR 19 2.541 5.989 4.012
131 HD1 TYR 19 HD2 TYR 19 1.429 4.292 5.899
132 HD2 TYR 19 HD1 TYR 19 -0.571 4.370 2.098
133 HE1 TYR 19 HE2 TYR 19 -0.742 4.617 7.045
134 HE2 TYR 19 HE1 TYR 19 -2.741 4.699 3.240
135 HH TYR 19 HH TYR 19 -3.099 4.314 6.646
136 HB2 TYR 19 2HB TYR 19 1.715 3.672 2.246
137 HB3 TYR 19 1HB TYR 19 2.517 3.477 3.807
138 H CYS 20 H CYS 20 4.023 7.125 1.761
139 HA CYS 20 HA CYS 20 6.230 5.150 1.474
140 HB2 CYS 20 2HB CYS 20 5.209 6.722 -0.429
141 HB3 CYS 20 1HB CYS 20 6.426 7.822 0.176
142 H ASN 21 H ASN 21 8.424 6.557 1.326
143 HA ASN 21 HA ASN 21 8.870 7.459 4.073
144 HB2 ASN 21 2HB ASN 21 10.517 6.080 2.725
145 HB3 ASN 21 1HB ASN 21 10.818 7.521 1.753
146 HD21 ASN 21 1HD2 ASN 21 11.505 9.530 3.078
147 HD22 ASN 21 2HD2 ASN 21 12.485 9.264 4.438
148 HA PHE 1 HA PHE 1 -9.410 5.098 -11.794
149 HD1 PHE 1 HD1 PHE 1 -9.090 6.938 -11.242
150 HD2 PHE 1 HD2 PHE 1 -5.309 5.061 -10.430
151 HE1 PHE 1 HE1 PHE 1 -7.909 8.938 -12.112
152 HE2 PHE 1 HE2 PHE 1 -4.129 7.061 -11.301
153 HZ PHE 1 HZ PHE 1 -5.429 9.001 -12.142
154 H1 PHE 1 1H PHE 1 -10.365 6.209 -10.031
155 H2 PHE 1 2H PHE 1 -10.122 4.928 -8.941
156 H3 PHE 1 3H PHE 1 -11.329 4.816 -10.132
157 HB2 PHE 1 2HB PHE 1 -8.071 4.716 -9.173
158 HB3 PHE 1 1HB PHE 1 -7.434 3.761 -10.511
159 H VAL 2 H VAL 2 -8.815 2.512 -9.449
160 HA VAL 2 HA VAL 2 -10.605 0.668 -10.906
161 HB VAL 2 HB VAL 2 -8.619 -0.957 -11.146
162 HG11 VAL 2 1HG1 VAL 2 -8.181 -0.182 -13.340
163 HG12 VAL 2 2HG1 VAL 2 -8.371 1.508 -12.871
164 HG13 VAL 2 3HG1 VAL 2 -9.784 0.457 -12.974
165 HG21 VAL 2 3HG2 VAL 2 -7.025 1.613 -11.083
166 HG22 VAL 2 1HG2 VAL 2 -6.415 -0.040 -11.154
167 HG23 VAL 2 2HG2 VAL 2 -7.163 0.562 -9.674
168 H ASN 3 H ASN 3 -10.994 -1.289 -9.683
169 HA ASN 3 HA ASN 3 -10.458 -0.940 -6.802
170 HB2 ASN 3 2HB ASN 3 -12.006 -3.214 -8.040
171 HB3 ASN 3 1HB ASN 3 -12.184 -2.512 -6.432
172 HD21 ASN 3 1HD2 ASN 3 -14.164 -2.763 -8.790
173 HD22 ASN 3 2HD2 ASN 3 -14.751 -1.185 -8.998
174 H GLN 4 H GLN 4 -8.450 -1.680 -6.185
175 HA GLN 4 HA GLN 4 -7.742 -4.443 -7.030
176 HB2 GLN 4 2HB GLN 4 -6.101 -3.453 -8.254
177 HB3 GLN 4 1HB GLN 4 -6.249 -1.928 -7.394
178 HG2 GLN 4 2HG GLN 4 -5.039 -4.138 -5.829
179 HG3 GLN 4 1HG GLN 4 -4.095 -3.574 -7.204
180 HE21 GLN 4 1HE2 GLN 4 -3.915 -3.106 -4.110
181 HE22 GLN 4 2HE2 GLN 4 -3.707 -1.425 -3.999
182 H HIS 5 H HIS 5 -7.495 -5.731 -5.363
183 HA HIS 5 HA HIS 5 -7.585 -4.839 -2.616
184 HD2 HIS 5 HD2 HIS 5 -9.149 -5.391 -1.127
185 HE1 HIS 5 HE1 HIS 5 -12.011 -7.987 -2.840
186 HE2 HIS 5 HE2 HIS 5 -11.644 -6.134 -1.124
187 HB2 HIS 5 2HB HIS 5 -7.472 -7.435 -4.073
188 HB3 HIS 5 1HB HIS 5 -6.947 -7.449 -2.392
189 H LEU 6 H LEU 6 -5.935 -5.069 -1.013
190 HA LEU 6 HA LEU 6 -3.152 -5.423 -2.044
191 HG LEU 6 HG LEU 6 -3.343 -2.339 -2.438
192 HB2 LEU 6 2HB LEU 6 -4.400 -3.198 -0.577
193 HB3 LEU 6 1HB LEU 6 -2.914 -3.778 0.140
194 HD11 LEU 6 1HD1 LEU 6 -2.179 -1.690 -0.122
195 HD12 LEU 6 2HD1 LEU 6 -1.611 -1.055 -1.666
196 HD13 LEU 6 3HD1 LEU 6 -0.786 -2.421 -0.919
197 HD21 LEU 6 3HD2 LEU 6 -2.377 -4.185 -3.524
198 HD22 LEU 6 1HD2 LEU 6 -1.476 -4.678 -2.090
199 HD23 LEU 6 2HD2 LEU 6 -0.937 -3.295 -3.032
200 H CYS 7 H CYS 7 -1.868 -6.770 -0.909
201 HA CYS 7 HA CYS 7 -2.461 -7.325 1.915
202 HB2 CYS 7 2HB CYS 7 -2.509 -9.602 -0.102
203 HB3 CYS 7 1HB CYS 7 -2.749 -9.733 1.637
204 H GLY 8 H GLY 8 -0.573 -7.775 2.962
205 HA2 GLY 8 2HA GLY 8 1.832 -7.668 3.074
206 HA3 GLY 8 1HA GLY 8 1.525 -9.343 2.641
207 H SER 9 H SER 9 2.637 -10.052 0.911
208 HA SER 9 HA SER 9 4.483 -8.649 -0.571
209 HG SER 9 HG SER 9 5.004 -9.578 -2.545
210 HB2 SER 9 2HB SER 9 3.724 -11.186 -0.657
211 HB3 SER 9 1HB SER 9 2.806 -10.639 -2.057
212 H ASP 10 H ASP 10 1.058 -9.096 -1.520
213 HA ASP 10 HA ASP 10 1.275 -7.381 -3.834
214 HB2 ASP 10 2HB ASP 10 -1.006 -8.519 -2.231
215 HB3 ASP 10 1HB ASP 10 -1.314 -7.316 -3.480
216 H LEU 11 H LEU 11 0.786 -6.859 -0.450
217 HA LEU 11 HA LEU 11 -0.411 -4.244 -0.564
218 HG LEU 11 HG LEU 11 1.385 -3.345 2.191
219 HB2 LEU 11 2HB LEU 11 -0.447 -5.613 1.468
220 HB3 LEU 11 1HB LEU 11 1.309 -5.591 1.545
221 HD11 LEU 11 1HD1 LEU 11 -1.262 -3.220 0.816
222 HD12 LEU 11 2HD1 LEU 11 0.116 -2.126 0.691
223 HD13 LEU 11 3HD1 LEU 11 -0.937 -2.062 2.104
224 HD21 LEU 11 3HD2 LEU 11 0.263 -3.443 4.178
225 HD22 LEU 11 1HD2 LEU 11 -0.063 -5.094 3.650
226 HD23 LEU 11 2HD2 LEU 11 -1.273 -3.835 3.403
227 H VAL 12 H VAL 12 2.949 -5.376 -0.441
228 HA VAL 12 HA VAL 12 4.017 -2.664 -0.415
229 HB VAL 12 HB VAL 12 6.197 -3.903 -0.924
230 HG11 VAL 12 1HG1 VAL 12 4.484 -4.447 1.501
231 HG12 VAL 12 2HG1 VAL 12 5.809 -3.295 1.334
232 HG13 VAL 12 3HG1 VAL 12 6.148 -5.024 1.400
233 HG21 VAL 12 3HG2 VAL 12 4.929 -5.881 -1.919
234 HG22 VAL 12 1HG2 VAL 12 4.518 -6.329 -0.264
235 HG23 VAL 12 2HG2 VAL 12 6.206 -6.289 -0.773
236 H GLU 13 H GLU 13 3.073 -5.011 -2.810
237 HA GLU 13 HA GLU 13 4.565 -4.031 -5.041
238 HB2 GLU 13 2HB GLU 13 3.249 -6.148 -5.065
239 HB3 GLU 13 1HB GLU 13 1.761 -5.200 -5.028
240 HG2 GLU 13 2HG GLU 13 2.320 -4.156 -7.159
241 HG3 GLU 13 1HG GLU 13 3.883 -4.974 -7.183
242 H ALA 14 H ALA 14 1.224 -3.262 -3.999
243 HA ALA 14 HA ALA 14 0.788 -1.150 -5.852
244 HB1 ALA 14 3HB ALA 14 -0.950 -0.387 -4.287
245 HB2 ALA 14 1HB ALA 14 -0.280 -1.425 -3.029
246 HB3 ALA 14 2HB ALA 14 -1.008 -2.138 -4.469
247 H LEU 15 H LEU 15 1.943 -1.044 -2.486
248 HA LEU 15 HA LEU 15 2.517 1.744 -2.406
249 HG LEU 15 HG LEU 15 1.533 -0.482 -0.430
250 HB2 LEU 15 2HB LEU 15 3.944 -0.543 -1.003
251 HB3 LEU 15 1HB LEU 15 4.099 1.154 -0.578
252 HD11 LEU 15 1HD1 LEU 15 1.880 -0.569 1.866
253 HD12 LEU 15 2HD1 LEU 15 2.997 0.797 1.851
254 HD13 LEU 15 3HD1 LEU 15 3.517 -0.775 1.243
255 HD21 LEU 15 3HD2 LEU 15 1.563 2.169 -0.887
256 HD22 LEU 15 1HD2 LEU 15 1.921 2.217 0.836
257 HD23 LEU 15 2HD2 LEU 15 0.435 1.464 0.271
258 H TYR 16 H TYR 16 4.298 -1.021 -3.671
259 HA TYR 16 HA TYR 16 6.837 0.187 -3.988
260 HD1 TYR 16 HD2 TYR 16 8.861 -0.618 -4.943
261 HD2 TYR 16 HD1 TYR 16 6.265 -3.792 -3.654
262 HE1 TYR 16 HE2 TYR 16 10.727 -1.617 -3.649
263 HE2 TYR 16 HE1 TYR 16 8.132 -4.791 -2.360
264 HH TYR 16 HH TYR 16 11.315 -3.990 -2.808
265 HB2 TYR 16 2HB TYR 16 5.428 -2.140 -5.079
266 HB3 TYR 16 1HB TYR 16 6.593 -1.445 -6.207
267 H LEU 17 H LEU 17 4.516 -0.281 -6.687
268 HA LEU 17 HA LEU 17 5.717 1.437 -8.503
269 HG LEU 17 HG LEU 17 2.862 0.415 -6.811
270 HB2 LEU 17 2HB LEU 17 3.239 2.010 -9.208
271 HB3 LEU 17 1HB LEU 17 3.886 0.391 -9.445
272 HD11 LEU 17 1HD1 LEU 17 1.596 2.431 -7.286
273 HD12 LEU 17 2HD1 LEU 17 0.486 1.061 -7.244
274 HD13 LEU 17 3HD1 LEU 17 0.993 1.739 -8.791
275 HD21 LEU 17 3HD2 LEU 17 0.951 -0.844 -8.362
276 HD22 LEU 17 1HD2 LEU 17 2.437 -1.599 -7.779
277 HD23 LEU 17 2HD2 LEU 17 2.378 -0.900 -9.397
278 H VAL 18 H VAL 18 3.639 2.390 -5.769
279 HA VAL 18 HA VAL 18 3.714 5.201 -6.557
280 HB VAL 18 HB VAL 18 2.682 5.630 -4.357
281 HG11 VAL 18 1HG1 VAL 18 1.360 3.171 -5.455
282 HG12 VAL 18 2HG1 VAL 18 1.439 4.645 -6.421
283 HG13 VAL 18 3HG1 VAL 18 0.616 4.654 -4.861
284 HG21 VAL 18 3HG2 VAL 18 3.885 3.910 -3.067
285 HG22 VAL 18 1HG2 VAL 18 3.020 2.660 -3.958
286 HG23 VAL 18 2HG2 VAL 18 2.142 3.742 -2.884
287 H CYS 19 H CYS 19 5.264 3.229 -4.084
288 HA CYS 19 HA CYS 19 6.840 5.401 -3.027
289 HB2 CYS 19 2HB CYS 19 6.675 2.471 -2.635
290 HB3 CYS 19 1HB CYS 19 8.265 3.164 -2.348
291 H GLY 20 H GLY 20 7.911 2.486 -4.759
292 HA2 GLY 20 2HA GLY 20 9.504 2.329 -6.526
293 HA3 GLY 20 1HA GLY 20 9.722 4.081 -6.448
294 H GLU 21 H GLU 21 12.038 3.883 -6.349
295 HA GLU 21 HA GLU 21 13.334 2.269 -4.324
296 HB2 GLU 21 2HB GLU 21 14.258 3.323 -6.575
297 HB3 GLU 21 1HB GLU 21 14.670 4.669 -5.512
298 HG2 GLU 21 2HG GLU 21 15.474 2.436 -4.068
299 HG3 GLU 21 1HG GLU 21 15.914 2.034 -5.728
300 H ARG 22 H ARG 22 11.449 4.964 -3.962
301 HA ARG 22 HA ARG 22 13.051 6.487 -2.094
302 HE ARG 22 HE ARG 22 10.531 9.620 -1.567
303 HB2 ARG 22 2HB ARG 22 10.060 6.406 -2.574
304 HB3 ARG 22 1HB ARG 22 10.866 7.573 -1.524
305 HG2 ARG 22 2HG ARG 22 12.330 8.148 -3.555
306 HG3 ARG 22 1HG ARG 22 11.160 7.245 -4.516
307 HD2 ARG 22 2HD ARG 22 10.512 9.575 -4.559
308 HD3 ARG 22 1HD ARG 22 9.349 8.704 -3.559
309 HH11 ARG 22 1HH2 ARG 22 13.054 10.432 -3.034
310 HH12 ARG 22 2HH2 ARG 22 12.855 12.150 -3.137
311 HH21 ARG 22 1HH1 ARG 22 9.465 12.068 -2.410
312 HH22 ARG 22 2HH1 ARG 22 10.823 13.076 -2.785
313 H GLY 23 H GLY 23 11.392 3.508 -1.832
314 HA2 GLY 23 2HA GLY 23 11.506 2.092 0.109
315 HA3 GLY 23 1HA GLY 23 11.893 3.507 1.088
316 H PHE 24 H PHE 24 9.753 1.393 1.421
317 HA PHE 24 HA PHE 24 7.407 3.250 1.440
318 HD1 PHE 24 HD2 PHE 24 8.884 1.098 -1.038
319 HD2 PHE 24 HD1 PHE 24 7.145 -1.250 2.115
320 HE1 PHE 24 HE2 PHE 24 10.378 -0.796 -1.622
321 HE2 PHE 24 HE1 PHE 24 8.640 -3.141 1.531
322 HZ PHE 24 HZ PHE 24 10.256 -2.915 -0.337
323 HB2 PHE 24 2HB PHE 24 6.202 0.844 1.566
324 HB3 PHE 24 1HB PHE 24 6.591 1.626 0.035
325 H PHE 25 H PHE 25 5.681 1.925 3.073
326 HA PHE 25 HA PHE 25 7.176 1.838 5.662
327 HD1 PHE 25 HD1 PHE 25 7.698 3.790 6.098
328 HD2 PHE 25 HD2 PHE 25 3.853 3.256 7.947
329 HE1 PHE 25 HE1 PHE 25 8.515 4.946 8.133
330 HE2 PHE 25 HE2 PHE 25 4.675 4.410 9.981
331 HZ PHE 25 HZ PHE 25 7.004 5.256 10.075
332 HB2 PHE 25 2HB PHE 25 5.056 3.477 4.864
333 HB3 PHE 25 1HB PHE 25 4.286 2.249 5.863
334 H TYR 26 H TYR 26 3.871 0.762 4.796
335 HA TYR 26 HA TYR 26 2.765 -1.227 5.395
336 HD1 TYR 26 HD1 TYR 26 1.847 -3.116 5.158
337 HD2 TYR 26 HD2 TYR 26 5.830 -4.632 4.583
338 HE1 TYR 26 HE1 TYR 26 1.076 -5.382 5.795
339 HE2 TYR 26 HE2 TYR 26 5.054 -6.897 5.219
340 HH TYR 26 HH TYR 26 3.247 -8.180 5.608
341 HB2 TYR 26 2HB TYR 26 4.005 -2.089 3.474
342 HB3 TYR 26 1HB TYR 26 5.438 -2.308 4.457
343 H THR 27 H THR 27 3.722 0.099 7.604
344 HA THR 27 HA THR 27 5.377 -1.665 9.244
345 HB THR 27 HB THR 27 5.538 0.679 9.705
346 HG1 THR 27 HG1 THR 27 4.477 0.732 11.871
347 HG21 THR 27 3HG2 THR 27 2.527 0.545 9.702
348 HG22 THR 27 1HG2 THR 27 3.580 1.582 8.741
349 HG23 THR 27 2HG2 THR 27 3.379 1.887 10.466
350 H LYS 28 H LYS 28 4.647 -3.299 10.526
351 HA LYS 28 HA LYS 28 2.123 -3.283 11.868
352 HB2 LYS 28 2HB LYS 28 0.830 -4.857 10.618
353 HB3 LYS 28 1HB LYS 28 1.379 -3.645 9.465
354 HG2 LYS 28 2HG LYS 28 2.448 -5.211 8.253
355 HG3 LYS 28 1HG LYS 28 3.339 -5.765 9.670
356 HD2 LYS 28 2HD LYS 28 0.756 -6.708 10.106
357 HD3 LYS 28 1HD LYS 28 0.999 -6.940 8.375
358 HE2 LYS 28 2HE LYS 28 2.821 -8.373 8.688
359 HE3 LYS 28 1HE LYS 28 3.151 -7.761 10.308
360 HZ1 LYS 28 3HZ LYS 28 0.665 -9.220 9.630
361 HZ2 LYS 28 1HZ LYS 28 1.285 -8.874 11.170
362 HZ3 LYS 28 2HZ LYS 28 2.067 -10.009 10.177
363 HA PRO 29 HA PRO 29 5.329 -6.457 13.048
364 HB2 PRO 29 2HB PRO 29 6.318 -5.149 15.253
365 HB3 PRO 29 1HB PRO 29 7.002 -4.987 13.627
366 HG2 PRO 29 2HG PRO 29 5.327 -3.057 15.157
367 HG3 PRO 29 1HG PRO 29 6.510 -2.749 13.875
368 HD2 PRO 29 2HD PRO 29 3.696 -2.771 13.566
369 HD3 PRO 29 1HD PRO 29 4.898 -2.779 12.264
370 H THR 30 H THR 30 5.641 -6.764 15.863
371 HA THR 30 HA THR 30 3.194 -8.041 16.597
372 HB THR 30 HB THR 30 5.563 -7.138 18.259
373 HG1 THR 30 HG1 THR 30 6.227 -9.174 17.977
374 HG21 THR 30 3HG2 THR 30 4.374 -7.598 20.107
375 HG22 THR 30 1HG2 THR 30 4.110 -9.237 19.513
376 HG23 THR 30 2HG2 THR 30 2.957 -7.961 19.122
Start of MODEL 11
1 H1 GLY 1 1H GLY 1 0.096 -1.673 10.264
2 H2 GLY 1 2H GLY 1 -0.368 -0.197 10.964
3 H3 GLY 1 3H GLY 1 -0.309 -0.356 9.274
4 HA2 GLY 1 1HA GLY 1 -2.056 -2.259 9.995
5 HA3 GLY 1 2HA GLY 1 -2.451 -0.973 11.174
6 H ILE 2 H ILE 2 -1.213 -1.730 7.790
7 HA ILE 2 HA ILE 2 -3.819 -0.851 6.643
8 HB ILE 2 HB ILE 2 -1.414 0.096 6.000
9 HG12 ILE 2 2HG1 ILE 2 -3.704 -0.534 4.121
10 HG13 ILE 2 1HG1 ILE 2 -3.425 0.960 5.014
11 HG21 ILE 2 1HG2 ILE 2 -1.701 -2.026 3.883
12 HG22 ILE 2 2HG2 ILE 2 -0.766 -2.345 5.343
13 HG23 ILE 2 3HG2 ILE 2 -0.299 -1.028 4.268
14 HD11 ILE 2 3HD1 ILE 2 -2.628 1.541 2.903
15 HD12 ILE 2 1HD1 ILE 2 -2.009 -0.079 2.581
16 HD13 ILE 2 2HD1 ILE 2 -1.150 0.988 3.690
17 H THR 3 H THR 3 -1.617 -3.565 6.894
18 HA THR 3 HA THR 3 -2.602 -5.178 4.781
19 HB THR 3 HB THR 3 -1.560 -6.002 7.505
20 HG1 THR 3 HG1 THR 3 -0.239 -4.781 5.904
21 HG21 THR 3 3HG2 THR 3 -2.660 -7.922 6.721
22 HG22 THR 3 1HG2 THR 3 -1.018 -8.140 6.118
23 HG23 THR 3 2HG2 THR 3 -2.285 -7.562 5.036
24 H GLU 4 H GLU 4 -3.957 -4.410 7.896
25 HA GLU 4 HA GLU 4 -6.080 -6.452 7.581
26 HB2 GLU 4 2HB GLU 4 -5.024 -5.968 9.828
27 HB3 GLU 4 1HB GLU 4 -5.776 -4.374 9.769
28 HG2 GLU 4 2HG GLU 4 -7.408 -5.555 10.918
29 HG3 GLU 4 1HG GLU 4 -7.961 -5.787 9.259
30 H GLN 5 H GLN 5 -6.093 -4.602 5.529
31 HA GLN 5 HA GLN 5 -8.770 -3.577 5.650
32 HB2 GLN 5 2HB GLN 5 -7.100 -1.911 7.018
33 HB3 GLN 5 1HB GLN 5 -6.944 -1.254 5.387
34 HG2 GLN 5 2HG GLN 5 -9.673 -1.889 6.470
35 HG3 GLN 5 1HG GLN 5 -8.871 -0.392 6.953
36 HE21 GLN 5 1HE2 GLN 5 -9.149 1.344 5.542
37 HE22 GLN 5 2HE2 GLN 5 -9.619 1.211 3.917
38 H CYS 6 H CYS 6 -5.573 -2.877 4.191
39 HA CYS 6 HA CYS 6 -6.712 -2.328 1.585
40 HB2 CYS 6 2HB CYS 6 -4.015 -2.484 2.763
41 HB3 CYS 6 1HB CYS 6 -4.100 -2.975 1.070
42 H CYS 7 H CYS 7 -6.452 -5.158 3.280
43 HA CYS 7 HA CYS 7 -6.227 -6.735 0.757
44 HB2 CYS 7 2HB CYS 7 -4.433 -7.180 2.423
45 HB3 CYS 7 1HB CYS 7 -5.662 -7.647 3.589
46 H THR 8 H THR 8 -7.937 -6.433 3.865
47 HA THR 8 HA THR 8 -9.898 -8.465 3.257
48 HB THR 8 HB THR 8 -9.400 -7.467 5.558
49 HG1 THR 8 HG1 THR 8 -12.126 -7.261 4.878
50 HG21 THR 8 3HG2 THR 8 -9.886 -5.307 6.022
51 HG22 THR 8 1HG2 THR 8 -11.418 -5.375 5.150
52 HG23 THR 8 2HG2 THR 8 -9.916 -5.084 4.273
53 H SER 9 H SER 9 -9.297 -5.374 2.015
54 HA SER 9 HA SER 9 -11.764 -5.456 0.426
55 HG SER 9 HG SER 9 -13.757 -3.973 1.862
56 HB2 SER 9 2HB SER 9 -11.199 -3.332 2.490
57 HB3 SER 9 1HB SER 9 -12.124 -2.943 1.043
58 H ILE 10 H ILE 10 -11.556 -2.909 -0.718
59 HA ILE 10 HA ILE 10 -8.827 -3.061 -1.924
60 HB ILE 10 HB ILE 10 -11.415 -1.995 -3.080
61 HG12 ILE 10 2HG1 ILE 10 -9.828 -4.239 -4.249
62 HG13 ILE 10 1HG1 ILE 10 -10.782 -4.576 -2.805
63 HG21 ILE 10 1HG2 ILE 10 -10.159 -0.909 -4.598
64 HG22 ILE 10 2HG2 ILE 10 -9.329 -2.413 -5.001
65 HG23 ILE 10 3HG2 ILE 10 -8.706 -1.380 -3.715
66 HD11 ILE 10 3HD1 ILE 10 -11.734 -4.526 -5.418
67 HD12 ILE 10 1HD1 ILE 10 -12.265 -2.987 -4.741
68 HD13 ILE 10 2HD1 ILE 10 -12.717 -4.499 -3.953
69 H CYS 11 H CYS 11 -7.609 -1.123 -2.127
70 HA CYS 11 HA CYS 11 -8.827 1.243 -0.741
71 HB2 CYS 11 2HB CYS 11 -6.124 1.660 -0.485
72 HB3 CYS 11 1HB CYS 11 -7.156 0.971 0.764
73 H SER 12 H SER 12 -7.513 3.329 -1.367
74 HA SER 12 HA SER 12 -7.254 3.294 -4.345
75 HG SER 12 HG SER 12 -7.704 6.614 -2.232
76 HB2 SER 12 2HB SER 12 -7.644 5.773 -4.136
77 HB3 SER 12 1HB SER 12 -8.999 4.789 -3.589
78 H LEU 13 H LEU 13 -5.184 3.343 -5.049
79 HA LEU 13 HA LEU 13 -2.876 3.597 -3.607
80 HG LEU 13 HG LEU 13 -2.680 6.174 -6.029
81 HB2 LEU 13 2HB LEU 13 -1.785 3.828 -5.628
82 HB3 LEU 13 1HB LEU 13 -3.340 3.215 -6.172
83 HD11 LEU 13 1HD1 LEU 13 -2.226 4.090 -8.113
84 HD12 LEU 13 2HD1 LEU 13 -1.197 5.442 -7.638
85 HD13 LEU 13 3HD1 LEU 13 -2.642 5.729 -8.610
86 HD21 LEU 13 3HD2 LEU 13 -5.132 5.107 -6.200
87 HD22 LEU 13 1HD2 LEU 13 -4.672 4.949 -7.895
88 HD23 LEU 13 2HD2 LEU 13 -4.685 6.537 -7.130
89 H TYR 14 H TYR 14 -4.948 6.221 -4.710
90 HA TYR 14 HA TYR 14 -3.385 8.475 -4.414
91 HD1 TYR 14 HD1 TYR 14 -3.987 10.606 -5.053
92 HD2 TYR 14 HD2 TYR 14 -6.671 9.847 -1.787
93 HE1 TYR 14 HE1 TYR 14 -3.795 12.980 -4.346
94 HE2 TYR 14 HE2 TYR 14 -6.483 12.219 -1.078
95 HH TYR 14 HH TYR 14 -5.880 14.488 -2.400
96 HB2 TYR 14 2HB TYR 14 -5.802 8.596 -4.910
97 HB3 TYR 14 1HB TYR 14 -6.157 8.126 -3.251
98 H GLN 15 H GLN 15 -5.289 7.262 -1.677
99 HA GLN 15 HA GLN 15 -3.662 8.610 0.281
100 HB2 GLN 15 2HB GLN 15 -5.879 6.632 0.318
101 HB3 GLN 15 1HB GLN 15 -4.846 6.677 1.746
102 HG2 GLN 15 2HG GLN 15 -6.044 9.182 0.554
103 HG3 GLN 15 1HG GLN 15 -6.884 8.229 1.779
104 HE21 GLN 15 1HE2 GLN 15 -6.436 10.574 2.848
105 HE22 GLN 15 2HE2 GLN 15 -5.028 10.651 3.794
106 H LEU 16 H LEU 16 -3.810 5.334 -0.964
107 HA LEU 16 HA LEU 16 -2.098 3.892 0.647
108 HG LEU 16 HG LEU 16 -0.795 1.976 -0.705
109 HB2 LEU 16 2HB LEU 16 -3.204 3.465 -1.778
110 HB3 LEU 16 1HB LEU 16 -1.529 3.718 -2.266
111 HD11 LEU 16 1HD1 LEU 16 -3.665 2.162 0.085
112 HD12 LEU 16 2HD1 LEU 16 -2.237 1.928 1.095
113 HD13 LEU 16 3HD1 LEU 16 -2.891 0.580 0.164
114 HD21 LEU 16 3HD2 LEU 16 -1.174 0.497 -2.349
115 HD22 LEU 16 1HD2 LEU 16 -2.358 1.605 -3.038
116 HD23 LEU 16 2HD2 LEU 16 -2.871 0.368 -1.889
117 H GLU 17 H GLU 17 -1.229 6.405 -1.660
118 HA GLU 17 HA GLU 17 1.617 5.925 -1.530
119 HB2 GLU 17 2HB GLU 17 0.900 7.062 -3.455
120 HB3 GLU 17 1HB GLU 17 -0.114 8.173 -2.537
121 HG2 GLU 17 2HG GLU 17 1.869 9.270 -1.614
122 HG3 GLU 17 1HG GLU 17 2.919 8.107 -2.424
123 H ASN 18 H ASN 18 -0.604 7.502 0.578
124 HA ASN 18 HA ASN 18 1.218 9.402 1.769
125 HB2 ASN 18 2HB ASN 18 -1.494 8.421 2.264
126 HB3 ASN 18 1HB ASN 18 -0.609 8.756 3.750
127 HD21 ASN 18 1HD2 ASN 18 -2.857 10.332 2.462
128 HD22 ASN 18 2HD2 ASN 18 -2.234 11.898 2.263
129 H TYR 19 H TYR 19 1.301 6.065 1.796
130 HA TYR 19 HA TYR 19 2.326 5.906 4.575
131 HD1 TYR 19 HD1 TYR 19 -0.525 4.653 2.207
132 HD2 TYR 19 HD2 TYR 19 1.003 3.669 6.102
133 HE1 TYR 19 HE1 TYR 19 -2.829 4.710 3.122
134 HE2 TYR 19 HE2 TYR 19 -1.302 3.726 7.017
135 HH TYR 19 HH TYR 19 -3.523 4.911 6.338
136 HB2 TYR 19 2HB TYR 19 1.754 3.770 2.504
137 HB3 TYR 19 1HB TYR 19 2.394 3.442 4.114
138 H CYS 20 H CYS 20 3.799 7.264 2.310
139 HA CYS 20 HA CYS 20 6.128 5.433 2.053
140 HB2 CYS 20 2HB CYS 20 5.044 6.984 0.159
141 HB3 CYS 20 1HB CYS 20 6.203 8.129 0.798
142 H ASN 21 H ASN 21 8.232 6.986 1.942
143 HA ASN 21 HA ASN 21 8.451 8.059 4.696
144 HB2 ASN 21 2HB ASN 21 10.128 6.401 3.775
145 HB3 ASN 21 1HB ASN 21 10.653 7.657 2.654
146 HD21 ASN 21 1HD2 ASN 21 11.837 6.315 5.281
147 HD22 ASN 21 2HD2 ASN 21 12.427 7.659 6.132
148 HA PHE 1 HA PHE 1 -7.286 4.616 -10.478
149 HD1 PHE 1 HD2 PHE 1 -6.771 6.451 -10.423
150 HD2 PHE 1 HD1 PHE 1 -5.017 5.727 -14.279
151 HE1 PHE 1 HE2 PHE 1 -5.210 8.347 -10.069
152 HE2 PHE 1 HE1 PHE 1 -3.456 7.623 -13.925
153 HZ PHE 1 HZ PHE 1 -3.553 8.933 -11.821
154 H1 PHE 1 1H PHE 1 -4.972 3.818 -11.600
155 H2 PHE 1 2H PHE 1 -5.752 2.332 -11.337
156 H3 PHE 1 3H PHE 1 -5.485 3.395 -10.040
157 HB2 PHE 1 2HB PHE 1 -6.586 4.196 -13.399
158 HB3 PHE 1 1HB PHE 1 -7.925 5.195 -12.834
159 H VAL 2 H VAL 2 -7.307 1.797 -10.026
160 HA VAL 2 HA VAL 2 -10.003 1.193 -11.022
161 HB VAL 2 HB VAL 2 -8.548 0.336 -12.840
162 HG11 VAL 2 1HG1 VAL 2 -7.422 -1.732 -11.003
163 HG12 VAL 2 2HG1 VAL 2 -6.694 -0.126 -10.965
164 HG13 VAL 2 3HG1 VAL 2 -6.733 -1.041 -12.472
165 HG21 VAL 2 3HG2 VAL 2 -9.489 -2.062 -11.279
166 HG22 VAL 2 1HG2 VAL 2 -9.612 -1.750 -13.011
167 HG23 VAL 2 2HG2 VAL 2 -10.657 -0.887 -11.884
168 H ASN 3 H ASN 3 -10.971 -0.574 -9.803
169 HA ASN 3 HA ASN 3 -10.365 -0.659 -7.073
170 HB2 ASN 3 2HB ASN 3 -11.444 -3.092 -8.492
171 HB3 ASN 3 1HB ASN 3 -11.875 -2.466 -6.900
172 HD21 ASN 3 1HD2 ASN 3 -13.914 -1.513 -6.931
173 HD22 ASN 3 2HD2 ASN 3 -14.569 -0.648 -8.236
174 H GLN 4 H GLN 4 -8.312 -1.140 -6.326
175 HA GLN 4 HA GLN 4 -7.038 -3.601 -7.431
176 HB2 GLN 4 2HB GLN 4 -5.500 -1.986 -8.024
177 HB3 GLN 4 1HB GLN 4 -5.972 -0.904 -6.720
178 HG2 GLN 4 2HG GLN 4 -4.696 -3.429 -5.840
179 HG3 GLN 4 1HG GLN 4 -3.647 -2.338 -6.744
180 HE21 GLN 4 1HE2 GLN 4 -2.408 -1.446 -5.037
181 HE22 GLN 4 2HE2 GLN 4 -3.084 -0.588 -3.737
182 H HIS 5 H HIS 5 -6.503 -5.182 -6.016
183 HA HIS 5 HA HIS 5 -7.251 -4.837 -3.173
184 HD2 HIS 5 HD2 HIS 5 -8.862 -5.695 -1.917
185 HE1 HIS 5 HE1 HIS 5 -11.480 -8.042 -4.264
186 HE2 HIS 5 HE2 HIS 5 -11.310 -6.521 -2.223
187 HB2 HIS 5 2HB HIS 5 -6.907 -7.106 -5.062
188 HB3 HIS 5 1HB HIS 5 -6.487 -7.435 -3.383
189 H LEU 6 H LEU 6 -5.730 -5.349 -1.458
190 HA LEU 6 HA LEU 6 -2.888 -5.537 -2.308
191 HG LEU 6 HG LEU 6 -3.026 -2.429 -2.592
192 HB2 LEU 6 2HB LEU 6 -4.217 -3.356 -0.846
193 HB3 LEU 6 1HB LEU 6 -2.787 -3.967 -0.044
194 HD11 LEU 6 1HD1 LEU 6 -0.501 -2.508 -1.106
195 HD12 LEU 6 2HD1 LEU 6 -1.886 -2.086 -0.098
196 HD13 LEU 6 3HD1 LEU 6 -1.515 -1.131 -1.532
197 HD21 LEU 6 3HD2 LEU 6 -0.597 -3.396 -3.067
198 HD22 LEU 6 1HD2 LEU 6 -2.014 -4.238 -3.693
199 HD23 LEU 6 2HD2 LEU 6 -1.217 -4.813 -2.228
200 H CYS 7 H CYS 7 -1.700 -6.943 -1.169
201 HA CYS 7 HA CYS 7 -2.417 -7.632 1.591
202 HB2 CYS 7 2HB CYS 7 -2.403 -9.812 -0.529
203 HB3 CYS 7 1HB CYS 7 -2.743 -10.012 1.187
204 H GLY 8 H GLY 8 -0.639 -8.417 2.685
205 HA2 GLY 8 2HA GLY 8 1.761 -8.304 2.951
206 HA3 GLY 8 1HA GLY 8 1.483 -9.902 2.276
207 H SER 9 H SER 9 2.777 -10.364 0.599
208 HA SER 9 HA SER 9 4.663 -8.754 -0.597
209 HG SER 9 HG SER 9 4.818 -12.069 -0.931
210 HB2 SER 9 2HB SER 9 3.108 -11.104 -1.626
211 HB3 SER 9 1HB SER 9 4.204 -10.256 -2.713
212 H ASP 10 H ASP 10 1.324 -9.201 -1.822
213 HA ASP 10 HA ASP 10 1.608 -7.359 -3.999
214 HB2 ASP 10 2HB ASP 10 -0.772 -8.404 -2.454
215 HB3 ASP 10 1HB ASP 10 -0.953 -7.260 -3.780
216 H LEU 11 H LEU 11 1.060 -6.981 -0.607
217 HA LEU 11 HA LEU 11 -0.078 -4.377 -0.511
218 HG LEU 11 HG LEU 11 1.435 -3.558 2.472
219 HB2 LEU 11 2HB LEU 11 0.298 -6.056 1.392
220 HB3 LEU 11 1HB LEU 11 1.966 -5.509 1.425
221 HD11 LEU 11 1HD1 LEU 11 -0.680 -2.296 2.045
222 HD12 LEU 11 2HD1 LEU 11 -1.153 -3.552 0.900
223 HD13 LEU 11 3HD1 LEU 11 0.274 -2.563 0.585
224 HD21 LEU 11 3HD2 LEU 11 -1.055 -3.915 3.519
225 HD22 LEU 11 1HD2 LEU 11 0.393 -4.712 4.134
226 HD23 LEU 11 2HD2 LEU 11 -0.670 -5.559 3.011
227 H VAL 12 H VAL 12 3.353 -5.382 -0.417
228 HA VAL 12 HA VAL 12 4.353 -2.681 -0.459
229 HB VAL 12 HB VAL 12 6.504 -3.838 -1.184
230 HG11 VAL 12 1HG1 VAL 12 5.065 -3.892 1.290
231 HG12 VAL 12 2HG1 VAL 12 6.812 -3.898 1.046
232 HG13 VAL 12 3HG1 VAL 12 5.927 -5.422 1.121
233 HG21 VAL 12 3HG2 VAL 12 5.134 -5.746 -2.251
234 HG22 VAL 12 1HG2 VAL 12 4.942 -6.358 -0.608
235 HG23 VAL 12 2HG2 VAL 12 6.553 -6.208 -1.311
236 H GLU 13 H GLU 13 3.368 -4.957 -2.939
237 HA GLU 13 HA GLU 13 4.648 -3.823 -5.196
238 HB2 GLU 13 2HB GLU 13 3.097 -5.923 -4.991
239 HB3 GLU 13 1HB GLU 13 1.798 -4.779 -5.330
240 HG2 GLU 13 2HG GLU 13 2.464 -4.456 -7.493
241 HG3 GLU 13 1HG GLU 13 4.177 -4.594 -7.093
242 H ALA 14 H ALA 14 1.472 -3.024 -3.763
243 HA ALA 14 HA ALA 14 0.943 -0.830 -5.547
244 HB1 ALA 14 3HB ALA 14 -0.798 -1.977 -4.176
245 HB2 ALA 14 1HB ALA 14 -0.808 -0.229 -3.968
246 HB3 ALA 14 2HB ALA 14 -0.086 -1.258 -2.730
247 H LEU 15 H LEU 15 2.128 -0.942 -2.194
248 HA LEU 15 HA LEU 15 2.627 1.828 -1.866
249 HG LEU 15 HG LEU 15 1.849 -0.612 0.091
250 HB2 LEU 15 2HB LEU 15 4.076 -0.580 -0.719
251 HB3 LEU 15 1HB LEU 15 4.339 1.075 -0.178
252 HD11 LEU 15 1HD1 LEU 15 2.538 1.023 2.334
253 HD12 LEU 15 2HD1 LEU 15 4.002 0.219 1.765
254 HD13 LEU 15 3HD1 LEU 15 2.585 -0.735 2.207
255 HD21 LEU 15 3HD2 LEU 15 1.011 1.482 -0.762
256 HD22 LEU 15 1HD2 LEU 15 2.136 2.408 0.233
257 HD23 LEU 15 2HD2 LEU 15 0.802 1.536 0.988
258 H TYR 16 H TYR 16 4.583 -0.739 -3.322
259 HA TYR 16 HA TYR 16 7.026 0.641 -3.585
260 HD1 TYR 16 HD2 TYR 16 9.118 -0.176 -5.422
261 HD2 TYR 16 HD1 TYR 16 6.902 -2.970 -3.024
262 HE1 TYR 16 HE2 TYR 16 11.237 -1.010 -4.441
263 HE2 TYR 16 HE1 TYR 16 9.023 -3.806 -2.042
264 HH TYR 16 HH TYR 16 12.172 -2.471 -3.065
265 HB2 TYR 16 2HB TYR 16 5.798 -1.719 -4.720
266 HB3 TYR 16 1HB TYR 16 6.721 -0.854 -5.948
267 H LEU 17 H LEU 17 4.675 0.247 -6.274
268 HA LEU 17 HA LEU 17 5.801 2.148 -7.975
269 HG LEU 17 HG LEU 17 2.988 0.837 -6.403
270 HB2 LEU 17 2HB LEU 17 3.326 2.567 -8.730
271 HB3 LEU 17 1HB LEU 17 4.067 0.991 -8.986
272 HD11 LEU 17 1HD1 LEU 17 0.907 1.995 -8.263
273 HD12 LEU 17 2HD1 LEU 17 1.740 2.961 -7.044
274 HD13 LEU 17 3HD1 LEU 17 0.730 1.602 -6.552
275 HD21 LEU 17 3HD2 LEU 17 2.136 -0.148 -9.127
276 HD22 LEU 17 1HD2 LEU 17 1.227 -0.579 -7.679
277 HD23 LEU 17 2HD2 LEU 17 2.919 -1.052 -7.831
278 H VAL 18 H VAL 18 3.385 2.810 -5.406
279 HA VAL 18 HA VAL 18 3.275 5.631 -5.932
280 HB VAL 18 HB VAL 18 2.380 5.811 -3.614
281 HG11 VAL 18 1HG1 VAL 18 0.868 3.497 -4.349
282 HG12 VAL 18 2HG1 VAL 18 1.319 4.377 -5.810
283 HG13 VAL 18 3HG1 VAL 18 0.432 5.197 -4.523
284 HG21 VAL 18 3HG2 VAL 18 2.056 3.695 -2.348
285 HG22 VAL 18 1HG2 VAL 18 3.760 4.107 -2.533
286 HG23 VAL 18 2HG2 VAL 18 3.036 2.858 -3.548
287 H CYS 19 H CYS 19 5.147 3.719 -3.648
288 HA CYS 19 HA CYS 19 6.571 5.970 -2.538
289 HB2 CYS 19 2HB CYS 19 6.741 3.007 -2.379
290 HB3 CYS 19 1HB CYS 19 8.229 3.886 -2.041
291 H GLY 20 H GLY 20 7.745 3.303 -4.592
292 HA2 GLY 20 2HA GLY 20 9.182 3.468 -6.496
293 HA3 GLY 20 1HA GLY 20 9.369 5.196 -6.173
294 H GLU 21 H GLU 21 11.746 4.396 -6.559
295 HA GLU 21 HA GLU 21 12.991 2.910 -4.408
296 HB2 GLU 21 2HB GLU 21 15.091 3.440 -5.466
297 HB3 GLU 21 1HB GLU 21 13.926 3.105 -6.746
298 HG2 GLU 21 2HG GLU 21 13.976 5.929 -5.933
299 HG3 GLU 21 1HG GLU 21 15.511 5.363 -6.592
300 H ARG 22 H ARG 22 11.501 4.814 -3.159
301 HA ARG 22 HA ARG 22 13.542 6.724 -2.130
302 HE ARG 22 HE ARG 22 9.717 9.817 -3.273
303 HB2 ARG 22 2HB ARG 22 10.572 7.024 -2.572
304 HB3 ARG 22 1HB ARG 22 11.406 8.012 -1.371
305 HG2 ARG 22 2HG ARG 22 13.062 8.184 -3.589
306 HG3 ARG 22 1HG ARG 22 11.444 8.210 -4.292
307 HD2 ARG 22 2HD ARG 22 12.443 10.015 -2.068
308 HD3 ARG 22 1HD ARG 22 12.167 10.495 -3.743
309 HH11 ARG 22 1HH2 ARG 22 11.446 9.701 -0.429
310 HH12 ARG 22 2HH2 ARG 22 10.456 10.828 0.438
311 HH21 ARG 22 1HH1 ARG 22 8.649 11.795 -2.358
312 HH22 ARG 22 2HH1 ARG 22 8.879 12.020 -0.656
313 H GLY 23 H GLY 23 11.503 4.058 -1.506
314 HA2 GLY 23 2HA GLY 23 11.879 2.796 0.566
315 HA3 GLY 23 1HA GLY 23 12.123 4.326 1.403
316 H PHE 24 H PHE 24 10.041 1.873 1.271
317 HA PHE 24 HA PHE 24 7.627 3.605 1.639
318 HD1 PHE 24 HD2 PHE 24 9.367 1.079 -0.879
319 HD2 PHE 24 HD1 PHE 24 7.081 -0.654 2.322
320 HE1 PHE 24 HE2 PHE 24 10.685 -1.011 -1.070
321 HE2 PHE 24 HE1 PHE 24 8.400 -2.744 2.130
322 HZ PHE 24 HZ PHE 24 10.203 -2.925 0.436
323 HB2 PHE 24 2HB PHE 24 6.371 1.402 1.284
324 HB3 PHE 24 1HB PHE 24 7.193 2.040 -0.136
325 H PHE 25 H PHE 25 6.023 2.339 3.263
326 HA PHE 25 HA PHE 25 7.614 1.095 5.445
327 HD1 PHE 25 HD2 PHE 25 6.291 0.736 7.700
328 HD2 PHE 25 HD1 PHE 25 8.432 4.456 7.451
329 HE1 PHE 25 HE2 PHE 25 7.347 0.277 9.897
330 HE2 PHE 25 HE1 PHE 25 9.486 3.994 9.647
331 HZ PHE 25 HZ PHE 25 8.944 1.906 10.870
332 HB2 PHE 25 2HB PHE 25 7.163 3.731 5.613
333 HB3 PHE 25 1HB PHE 25 5.613 3.172 6.237
334 H TYR 26 H TYR 26 6.295 -0.765 4.475
335 HA TYR 26 HA TYR 26 3.422 -0.688 5.049
336 HD1 TYR 26 HD1 TYR 26 2.695 -4.262 5.225
337 HD2 TYR 26 HD2 TYR 26 6.748 -3.596 3.945
338 HE1 TYR 26 HE1 TYR 26 3.327 -6.506 6.058
339 HE2 TYR 26 HE2 TYR 26 7.373 -5.845 4.777
340 HH TYR 26 HH TYR 26 5.130 -7.813 6.633
341 HB2 TYR 26 2HB TYR 26 3.286 -2.449 3.623
342 HB3 TYR 26 1HB TYR 26 4.962 -2.104 3.239
343 H THR 27 H THR 27 3.533 -0.215 7.339
344 HA THR 27 HA THR 27 4.850 -2.182 9.086
345 HB THR 27 HB THR 27 4.883 0.172 9.734
346 HG1 THR 27 HG1 THR 27 3.012 -0.834 11.519
347 HG21 THR 27 3HG2 THR 27 2.942 1.066 8.705
348 HG22 THR 27 1HG2 THR 27 2.624 1.179 10.437
349 HG23 THR 27 2HG2 THR 27 1.888 -0.113 9.487
350 H LYS 28 H LYS 28 3.663 -3.380 10.731
351 HA LYS 28 HA LYS 28 0.786 -3.830 10.066
352 HB2 LYS 28 2HB LYS 28 2.442 -6.137 11.003
353 HB3 LYS 28 1HB LYS 28 1.039 -6.126 9.935
354 HG2 LYS 28 2HG LYS 28 2.661 -6.507 8.350
355 HG3 LYS 28 1HG LYS 28 2.739 -4.745 8.382
356 HD2 LYS 28 2HD LYS 28 4.974 -5.210 8.703
357 HD3 LYS 28 1HD LYS 28 4.440 -5.232 10.385
358 HE2 LYS 28 2HE LYS 28 4.153 -7.677 10.270
359 HE3 LYS 28 1HE LYS 28 4.669 -7.663 8.582
360 HZ1 LYS 28 3HZ LYS 28 6.770 -6.602 9.393
361 HZ2 LYS 28 1HZ LYS 28 6.551 -8.215 9.868
362 HZ3 LYS 28 2HZ LYS 28 6.269 -6.959 10.976
363 HA PRO 29 HA PRO 29 0.317 -3.291 14.392
364 HB2 PRO 29 2HB PRO 29 -2.192 -4.392 14.644
365 HB3 PRO 29 1HB PRO 29 -1.886 -2.779 13.978
366 HG2 PRO 29 2HG PRO 29 -2.600 -5.298 12.545
367 HG3 PRO 29 1HG PRO 29 -2.914 -3.616 12.084
368 HD2 PRO 29 2HD PRO 29 -0.873 -5.249 11.026
369 HD3 PRO 29 1HD PRO 29 -0.967 -3.484 10.875
370 H THR 30 H THR 30 -0.511 -6.488 13.050
371 HA THR 30 HA THR 30 0.804 -7.708 15.433
372 HB THR 30 HB THR 30 -1.733 -8.801 14.191
373 HG1 THR 30 HG1 THR 30 -1.462 -7.418 16.645
374 HG21 THR 30 3HG2 THR 30 -0.085 -9.452 16.638
375 HG22 THR 30 1HG2 THR 30 -0.509 -10.520 15.299
376 HG23 THR 30 2HG2 THR 30 -1.747 -10.009 16.446
Start of MODEL 12
1 H1 GLY 1 1H GLY 1 -5.309 0.263 11.424
2 H2 GLY 1 2H GLY 1 -5.945 0.859 9.966
3 H3 GLY 1 3H GLY 1 -5.009 1.868 10.962
4 HA2 GLY 1 1HA GLY 1 -3.321 1.211 9.627
5 HA3 GLY 1 2HA GLY 1 -3.315 -0.300 10.586
6 H ILE 2 H ILE 2 -1.949 0.087 8.286
7 HA ILE 2 HA ILE 2 -3.535 0.410 5.850
8 HB ILE 2 HB ILE 2 -1.223 1.185 5.858
9 HG12 ILE 2 2HG1 ILE 2 -1.726 -1.253 4.128
10 HG13 ILE 2 1HG1 ILE 2 -2.082 0.423 3.715
11 HG21 ILE 2 1HG2 ILE 2 -0.424 -1.703 6.222
12 HG22 ILE 2 2HG2 ILE 2 -0.400 -0.503 7.514
13 HG23 ILE 2 3HG2 ILE 2 0.648 -0.309 6.110
14 HD11 ILE 2 3HD1 ILE 2 0.495 -1.028 3.647
15 HD12 ILE 2 1HD1 ILE 2 0.575 0.607 4.302
16 HD13 ILE 2 2HD1 ILE 2 -0.053 0.339 2.676
17 H THR 3 H THR 3 -1.748 -2.296 7.363
18 HA THR 3 HA THR 3 -2.575 -4.229 5.418
19 HB THR 3 HB THR 3 -1.623 -4.472 8.280
20 HG1 THR 3 HG1 THR 3 0.221 -4.495 7.313
21 HG21 THR 3 3HG2 THR 3 -3.051 -6.383 7.924
22 HG22 THR 3 1HG2 THR 3 -1.382 -6.927 7.751
23 HG23 THR 3 2HG2 THR 3 -2.373 -6.653 6.319
24 H GLU 4 H GLU 4 -4.074 -2.914 8.283
25 HA GLU 4 HA GLU 4 -6.267 -4.905 8.170
26 HB2 GLU 4 2HB GLU 4 -5.225 -4.017 10.356
27 HB3 GLU 4 1HB GLU 4 -6.111 -2.528 10.026
28 HG2 GLU 4 2HG GLU 4 -7.367 -4.119 11.503
29 HG3 GLU 4 1HG GLU 4 -8.225 -3.724 10.014
30 H GLN 5 H GLN 5 -5.860 -3.013 5.972
31 HA GLN 5 HA GLN 5 -8.600 -2.068 5.741
32 HB2 GLN 5 2HB GLN 5 -7.245 -0.273 7.120
33 HB3 GLN 5 1HB GLN 5 -6.555 0.138 5.548
34 HG2 GLN 5 2HG GLN 5 -8.627 0.788 4.665
35 HG3 GLN 5 1HG GLN 5 -9.536 -0.128 5.868
36 HE21 GLN 5 1HE2 GLN 5 -10.502 1.230 7.375
37 HE22 GLN 5 2HE2 GLN 5 -9.850 2.694 7.934
38 H CYS 6 H CYS 6 -5.270 -1.959 4.569
39 HA CYS 6 HA CYS 6 -6.242 -1.768 1.775
40 HB2 CYS 6 2HB CYS 6 -3.528 -1.543 3.075
41 HB3 CYS 6 1HB CYS 6 -3.702 -1.729 1.332
42 H CYS 7 H CYS 7 -5.416 -4.079 4.099
43 HA CYS 7 HA CYS 7 -5.088 -6.127 1.959
44 HB2 CYS 7 2HB CYS 7 -2.952 -5.899 3.092
45 HB3 CYS 7 1HB CYS 7 -3.731 -6.024 4.664
46 H THR 8 H THR 8 -7.480 -5.902 2.290
47 HA THR 8 HA THR 8 -8.454 -8.168 3.793
48 HB THR 8 HB THR 8 -9.127 -5.373 4.771
49 HG1 THR 8 HG1 THR 8 -8.502 -6.594 6.783
50 HG21 THR 8 3HG2 THR 8 -10.521 -8.003 5.070
51 HG22 THR 8 1HG2 THR 8 -11.203 -6.384 4.922
52 HG23 THR 8 2HG2 THR 8 -10.493 -6.906 6.450
53 H SER 9 H SER 9 -9.141 -5.119 2.152
54 HA SER 9 HA SER 9 -11.258 -6.509 0.588
55 HG SER 9 HG SER 9 -13.620 -4.630 0.520
56 HB2 SER 9 2HB SER 9 -12.494 -5.176 2.180
57 HB3 SER 9 1HB SER 9 -11.449 -3.785 1.909
58 H ILE 10 H ILE 10 -10.392 -3.094 0.471
59 HA ILE 10 HA ILE 10 -8.647 -3.552 -1.874
60 HB ILE 10 HB ILE 10 -10.884 -1.548 -2.116
61 HG12 ILE 10 2HG1 ILE 10 -11.812 -3.869 -1.629
62 HG13 ILE 10 1HG1 ILE 10 -12.290 -3.187 -3.185
63 HG21 ILE 10 1HG2 ILE 10 -10.461 -2.222 -4.575
64 HG22 ILE 10 2HG2 ILE 10 -9.004 -3.010 -3.970
65 HG23 ILE 10 3HG2 ILE 10 -9.214 -1.270 -3.770
66 HD11 ILE 10 3HD1 ILE 10 -11.068 -4.705 -4.375
67 HD12 ILE 10 1HD1 ILE 10 -11.235 -5.670 -2.909
68 HD13 ILE 10 2HD1 ILE 10 -9.766 -4.735 -3.187
69 H CYS 11 H CYS 11 -7.077 -1.947 -2.052
70 HA CYS 11 HA CYS 11 -7.094 0.090 0.117
71 HB2 CYS 11 2HB CYS 11 -5.125 -1.460 -0.145
72 HB3 CYS 11 1HB CYS 11 -4.806 -0.706 -1.706
73 H SER 12 H SER 12 -6.482 2.303 -0.397
74 HA SER 12 HA SER 12 -7.411 3.102 -3.112
75 HG SER 12 HG SER 12 -8.336 4.394 0.305
76 HB2 SER 12 2HB SER 12 -7.138 5.434 -1.728
77 HB3 SER 12 1HB SER 12 -8.622 4.486 -1.778
78 H LEU 13 H LEU 13 -5.771 3.213 -4.505
79 HA LEU 13 HA LEU 13 -3.055 3.413 -4.237
80 HG LEU 13 HG LEU 13 -5.207 2.728 -6.168
81 HB2 LEU 13 2HB LEU 13 -3.964 5.472 -6.120
82 HB3 LEU 13 1HB LEU 13 -2.990 4.043 -6.413
83 HD11 LEU 13 1HD1 LEU 13 -7.229 3.926 -6.468
84 HD12 LEU 13 2HD1 LEU 13 -6.387 5.387 -6.983
85 HD13 LEU 13 3HD1 LEU 13 -6.344 4.895 -5.290
86 HD21 LEU 13 3HD2 LEU 13 -5.004 2.606 -8.399
87 HD22 LEU 13 1HD2 LEU 13 -3.858 3.943 -8.305
88 HD23 LEU 13 2HD2 LEU 13 -5.569 4.266 -8.587
89 H TYR 14 H TYR 14 -5.287 6.138 -4.209
90 HA TYR 14 HA TYR 14 -3.526 8.261 -3.773
91 HD1 TYR 14 HD2 TYR 14 -6.143 8.272 -0.447
92 HD2 TYR 14 HD1 TYR 14 -4.849 11.021 -3.489
93 HE1 TYR 14 HE2 TYR 14 -6.067 10.096 1.234
94 HE2 TYR 14 HE1 TYR 14 -4.775 12.844 -1.806
95 HH TYR 14 HH TYR 14 -4.874 13.330 0.381
96 HB2 TYR 14 2HB TYR 14 -5.785 8.841 -4.066
97 HB3 TYR 14 1HB TYR 14 -6.327 7.711 -2.829
98 H GLN 15 H GLN 15 -5.296 6.712 -1.102
99 HA GLN 15 HA GLN 15 -3.576 7.626 0.968
100 HB2 GLN 15 2HB GLN 15 -5.547 5.425 0.662
101 HB3 GLN 15 1HB GLN 15 -4.344 5.202 1.926
102 HG2 GLN 15 2HG GLN 15 -6.027 7.703 1.641
103 HG3 GLN 15 1HG GLN 15 -6.449 6.356 2.696
104 HE21 GLN 15 1HE2 GLN 15 -3.073 6.536 2.658
105 HE22 GLN 15 2HE2 GLN 15 -2.858 7.487 4.043
106 H LEU 16 H LEU 16 -3.547 4.738 -1.005
107 HA LEU 16 HA LEU 16 -1.427 3.280 0.088
108 HG LEU 16 HG LEU 16 0.009 2.212 -1.692
109 HB2 LEU 16 2HB LEU 16 -2.930 2.660 -1.870
110 HB3 LEU 16 1HB LEU 16 -1.887 3.668 -2.873
111 HD11 LEU 16 1HD1 LEU 16 -2.243 0.230 -1.943
112 HD12 LEU 16 2HD1 LEU 16 -1.898 1.037 -0.413
113 HD13 LEU 16 3HD1 LEU 16 -0.675 0.013 -1.166
114 HD21 LEU 16 3HD2 LEU 16 0.273 1.245 -3.746
115 HD22 LEU 16 1HD2 LEU 16 -0.971 2.413 -4.193
116 HD23 LEU 16 2HD2 LEU 16 -1.415 0.743 -3.840
117 H GLU 17 H GLU 17 -1.334 6.088 -2.039
118 HA GLU 17 HA GLU 17 1.523 5.929 -2.499
119 HB2 GLU 17 2HB GLU 17 0.255 7.074 -4.150
120 HB3 GLU 17 1HB GLU 17 -0.542 8.083 -2.945
121 HG2 GLU 17 2HG GLU 17 1.732 9.047 -2.387
122 HG3 GLU 17 1HG GLU 17 2.368 8.173 -3.780
123 H ASN 18 H ASN 18 -0.462 7.260 0.006
124 HA ASN 18 HA ASN 18 1.599 9.063 0.997
125 HB2 ASN 18 2HB ASN 18 -0.851 9.427 1.399
126 HB3 ASN 18 1HB ASN 18 -0.839 8.014 2.455
127 HD21 ASN 18 1HD2 ASN 18 0.244 8.197 4.529
128 HD22 ASN 18 2HD2 ASN 18 0.753 9.695 5.143
129 H TYR 19 H TYR 19 1.028 5.702 1.239
130 HA TYR 19 HA TYR 19 2.536 5.500 3.783
131 HD1 TYR 19 HD2 TYR 19 0.555 5.782 4.545
132 HD2 TYR 19 HD1 TYR 19 -0.614 2.445 2.104
133 HE1 TYR 19 HE2 TYR 19 -1.826 6.246 5.032
134 HE2 TYR 19 HE1 TYR 19 -2.989 2.906 2.589
135 HH TYR 19 HH TYR 19 -4.300 4.053 4.420
136 HB2 TYR 19 2HB TYR 19 1.617 3.202 2.056
137 HB3 TYR 19 1HB TYR 19 1.990 3.187 3.777
138 H CYS 20 H CYS 20 3.362 6.025 0.645
139 HA CYS 20 HA CYS 20 5.388 3.982 0.306
140 HB2 CYS 20 2HB CYS 20 6.076 5.125 -1.614
141 HB3 CYS 20 1HB CYS 20 4.401 5.545 -1.535
142 H ASN 21 H ASN 21 7.727 5.269 -0.195
143 HA ASN 21 HA ASN 21 8.919 5.506 2.353
144 HB2 ASN 21 2HB ASN 21 10.209 5.168 0.259
145 HB3 ASN 21 1HB ASN 21 9.853 6.830 -0.210
146 HD21 ASN 21 1HD2 ASN 21 11.463 8.293 0.368
147 HD22 ASN 21 2HD2 ASN 21 12.541 8.094 1.665
148 HA PHE 1 HA PHE 1 -11.057 5.005 -10.892
149 HD1 PHE 1 HD1 PHE 1 -13.489 6.805 -9.276
150 HD2 PHE 1 HD2 PHE 1 -9.474 5.704 -8.208
151 HE1 PHE 1 HE1 PHE 1 -12.906 9.200 -8.994
152 HE2 PHE 1 HE2 PHE 1 -8.891 8.099 -7.929
153 HZ PHE 1 HZ PHE 1 -10.607 9.848 -8.322
154 H1 PHE 1 1H PHE 1 -13.358 5.021 -11.260
155 H2 PHE 1 2H PHE 1 -13.589 3.530 -10.479
156 H3 PHE 1 3H PHE 1 -12.810 3.591 -11.987
157 HB2 PHE 1 2HB PHE 1 -12.908 4.488 -8.685
158 HB3 PHE 1 1HB PHE 1 -11.247 4.041 -8.292
159 H VAL 2 H VAL 2 -9.303 3.670 -9.499
160 HA VAL 2 HA VAL 2 -9.211 1.007 -10.799
161 HB VAL 2 HB VAL 2 -7.062 2.432 -9.208
162 HG11 VAL 2 1HG1 VAL 2 -6.513 0.425 -11.344
163 HG12 VAL 2 2HG1 VAL 2 -7.145 -0.181 -9.813
164 HG13 VAL 2 3HG1 VAL 2 -5.640 0.738 -9.843
165 HG21 VAL 2 3HG2 VAL 2 -7.918 2.592 -12.079
166 HG22 VAL 2 1HG2 VAL 2 -6.197 2.686 -11.705
167 HG23 VAL 2 2HG2 VAL 2 -7.313 3.867 -11.020
168 H ASN 3 H ASN 3 -9.706 -0.798 -9.655
169 HA ASN 3 HA ASN 3 -9.564 -0.632 -6.669
170 HB2 ASN 3 2HB ASN 3 -11.241 -2.660 -6.944
171 HB3 ASN 3 1HB ASN 3 -11.829 -1.001 -7.063
172 HD21 ASN 3 1HD2 ASN 3 -12.424 -0.192 -9.185
173 HD22 ASN 3 2HD2 ASN 3 -12.587 -1.225 -10.522
174 H GLN 4 H GLN 4 -7.923 -1.857 -5.869
175 HA GLN 4 HA GLN 4 -7.371 -4.492 -7.107
176 HB2 GLN 4 2HB GLN 4 -5.799 -3.128 -8.287
177 HB3 GLN 4 1HB GLN 4 -5.381 -2.225 -6.835
178 HG2 GLN 4 2HG GLN 4 -3.642 -3.645 -6.598
179 HG3 GLN 4 1HG GLN 4 -4.821 -4.882 -6.162
180 HE21 GLN 4 1HE2 GLN 4 -4.229 -6.738 -7.319
181 HE22 GLN 4 2HE2 GLN 4 -3.870 -6.765 -8.979
182 H HIS 5 H HIS 5 -6.851 -6.002 -5.557
183 HA HIS 5 HA HIS 5 -6.986 -5.210 -2.756
184 HD2 HIS 5 HD2 HIS 5 -9.846 -7.781 -2.796
185 HE1 HIS 5 HE1 HIS 5 -9.592 -7.723 -7.016
186 HE2 HIS 5 HE2 HIS 5 -11.165 -7.966 -5.025
187 HB2 HIS 5 2HB HIS 5 -6.106 -7.930 -3.682
188 HB3 HIS 5 1HB HIS 5 -7.088 -7.503 -2.284
189 H LEU 6 H LEU 6 -5.286 -5.358 -1.225
190 HA LEU 6 HA LEU 6 -2.541 -5.738 -2.317
191 HG LEU 6 HG LEU 6 -2.759 -2.703 -3.080
192 HB2 LEU 6 2HB LEU 6 -3.743 -3.347 -1.097
193 HB3 LEU 6 1HB LEU 6 -2.227 -3.831 -0.373
194 HD11 LEU 6 1HD1 LEU 6 -0.081 -2.616 -1.887
195 HD12 LEU 6 2HD1 LEU 6 -1.347 -2.007 -0.820
196 HD13 LEU 6 3HD1 LEU 6 -1.127 -1.302 -2.420
197 HD21 LEU 6 3HD2 LEU 6 -0.873 -5.007 -2.568
198 HD22 LEU 6 1HD2 LEU 6 -0.435 -3.763 -3.732
199 HD23 LEU 6 2HD2 LEU 6 -1.899 -4.714 -3.971
200 H CYS 7 H CYS 7 -1.308 -7.031 -1.127
201 HA CYS 7 HA CYS 7 -1.621 -7.234 1.774
202 HB2 CYS 7 2HB CYS 7 -2.596 -9.418 -0.077
203 HB3 CYS 7 1HB CYS 7 -1.994 -9.808 1.532
204 H GLY 8 H GLY 8 0.273 -8.065 2.668
205 HA2 GLY 8 2HA GLY 8 2.606 -8.470 2.619
206 HA3 GLY 8 1HA GLY 8 2.060 -9.933 1.807
207 H SER 9 H SER 9 3.520 -10.218 0.194
208 HA SER 9 HA SER 9 5.126 -8.469 -1.155
209 HG SER 9 HG SER 9 3.920 -12.086 -2.183
210 HB2 SER 9 2HB SER 9 4.309 -10.056 -3.251
211 HB3 SER 9 1HB SER 9 5.533 -10.499 -2.064
212 H ASP 10 H ASP 10 1.773 -9.195 -2.207
213 HA ASP 10 HA ASP 10 1.716 -7.358 -4.362
214 HB2 ASP 10 2HB ASP 10 -0.527 -8.214 -2.507
215 HB3 ASP 10 1HB ASP 10 -0.746 -7.431 -4.069
216 H LEU 11 H LEU 11 1.125 -6.907 -0.911
217 HA LEU 11 HA LEU 11 0.116 -4.250 -0.965
218 HG LEU 11 HG LEU 11 1.929 -3.431 1.805
219 HB2 LEU 11 2HB LEU 11 0.076 -5.667 1.039
220 HB3 LEU 11 1HB LEU 11 1.834 -5.657 1.104
221 HD11 LEU 11 1HD1 LEU 11 0.459 -2.558 -0.017
222 HD12 LEU 11 2HD1 LEU 11 0.124 -1.819 1.549
223 HD13 LEU 11 3HD1 LEU 11 -0.946 -3.072 0.919
224 HD21 LEU 11 3HD2 LEU 11 -0.686 -4.524 2.876
225 HD22 LEU 11 1HD2 LEU 11 0.247 -3.222 3.614
226 HD23 LEU 11 2HD2 LEU 11 0.918 -4.851 3.530
227 H VAL 12 H VAL 12 3.499 -5.374 -0.648
228 HA VAL 12 HA VAL 12 4.593 -2.719 -0.624
229 HB VAL 12 HB VAL 12 6.727 -3.901 -1.312
230 HG11 VAL 12 1HG1 VAL 12 6.006 -3.521 1.060
231 HG12 VAL 12 2HG1 VAL 12 6.996 -4.966 0.856
232 HG13 VAL 12 3HG1 VAL 12 5.247 -5.113 1.039
233 HG21 VAL 12 3HG2 VAL 12 6.724 -6.316 -1.382
234 HG22 VAL 12 1HG2 VAL 12 5.519 -5.739 -2.530
235 HG23 VAL 12 2HG2 VAL 12 5.013 -6.371 -0.963
236 H GLU 13 H GLU 13 3.958 -5.042 -3.245
237 HA GLU 13 HA GLU 13 5.240 -3.820 -5.385
238 HB2 GLU 13 2HB GLU 13 3.857 -5.880 -5.575
239 HB3 GLU 13 1HB GLU 13 2.401 -4.896 -5.418
240 HG2 GLU 13 2HG GLU 13 3.196 -3.574 -7.427
241 HG3 GLU 13 1HG GLU 13 4.455 -4.790 -7.640
242 H ALA 14 H ALA 14 1.953 -3.003 -4.217
243 HA ALA 14 HA ALA 14 1.596 -0.753 -5.938
244 HB1 ALA 14 3HB ALA 14 0.387 -0.638 -3.232
245 HB2 ALA 14 1HB ALA 14 -0.002 -2.064 -4.191
246 HB3 ALA 14 2HB ALA 14 -0.379 -0.459 -4.811
247 H LEU 15 H LEU 15 2.915 -1.047 -2.667
248 HA LEU 15 HA LEU 15 3.322 1.773 -2.282
249 HG LEU 15 HG LEU 15 2.312 -0.513 -0.185
250 HB2 LEU 15 2HB LEU 15 4.498 -0.673 -0.966
251 HB3 LEU 15 1HB LEU 15 4.906 0.959 -0.465
252 HD11 LEU 15 1HD1 LEU 15 4.231 -0.066 1.543
253 HD12 LEU 15 2HD1 LEU 15 2.548 0.102 2.043
254 HD13 LEU 15 3HD1 LEU 15 3.501 1.535 1.652
255 HD21 LEU 15 3HD2 LEU 15 1.158 1.641 0.273
256 HD22 LEU 15 1HD2 LEU 15 1.687 1.549 -1.406
257 HD23 LEU 15 2HD2 LEU 15 2.596 2.519 -0.248
258 H TYR 16 H TYR 16 5.190 -0.790 -3.733
259 HA TYR 16 HA TYR 16 7.762 0.423 -3.720
260 HD1 TYR 16 HD2 TYR 16 9.967 -0.612 -5.329
261 HD2 TYR 16 HD1 TYR 16 7.216 -3.183 -3.256
262 HE1 TYR 16 HE2 TYR 16 11.866 -1.694 -4.150
263 HE2 TYR 16 HE1 TYR 16 9.114 -4.265 -2.079
264 HH TYR 16 HH TYR 16 11.498 -4.594 -2.345
265 HB2 TYR 16 2HB TYR 16 6.447 -1.816 -5.040
266 HB3 TYR 16 1HB TYR 16 7.578 -1.007 -6.121
267 H LEU 17 H LEU 17 5.310 0.400 -6.319
268 HA LEU 17 HA LEU 17 6.740 2.264 -7.956
269 HG LEU 17 HG LEU 17 3.686 1.016 -6.712
270 HB2 LEU 17 2HB LEU 17 4.507 2.535 -9.128
271 HB3 LEU 17 1HB LEU 17 5.110 0.882 -9.019
272 HD11 LEU 17 1HD1 LEU 17 1.940 2.480 -6.760
273 HD12 LEU 17 2HD1 LEU 17 1.752 2.351 -8.508
274 HD13 LEU 17 3HD1 LEU 17 2.999 3.396 -7.831
275 HD21 LEU 17 3HD2 LEU 17 2.060 0.475 -9.136
276 HD22 LEU 17 1HD2 LEU 17 2.371 -0.555 -7.740
277 HD23 LEU 17 2HD2 LEU 17 3.581 -0.410 -9.015
278 H VAL 18 H VAL 18 4.196 2.801 -5.480
279 HA VAL 18 HA VAL 18 3.651 5.478 -6.100
280 HB VAL 18 HB VAL 18 3.378 5.832 -3.558
281 HG11 VAL 18 1HG1 VAL 18 1.301 4.479 -3.596
282 HG12 VAL 18 2HG1 VAL 18 1.881 3.672 -5.051
283 HG13 VAL 18 3HG1 VAL 18 1.531 5.400 -5.082
284 HG21 VAL 18 3HG2 VAL 18 3.040 3.576 -2.421
285 HG22 VAL 18 1HG2 VAL 18 4.709 4.080 -2.633
286 HG23 VAL 18 2HG2 VAL 18 4.006 2.890 -3.716
287 H CYS 19 H CYS 19 6.007 4.635 -3.525
288 HA CYS 19 HA CYS 19 7.247 7.234 -3.972
289 HB2 CYS 19 2HB CYS 19 7.648 5.108 -2.003
290 HB3 CYS 19 1HB CYS 19 9.143 5.848 -2.539
291 H GLY 20 H GLY 20 8.625 3.957 -4.091
292 HA2 GLY 20 2HA GLY 20 9.573 3.360 -6.424
293 HA3 GLY 20 1HA GLY 20 10.442 4.890 -6.271
294 H GLU 21 H GLU 21 12.536 3.964 -6.191
295 HA GLU 21 HA GLU 21 13.199 1.760 -4.449
296 HB2 GLU 21 2HB GLU 21 14.488 2.919 -6.512
297 HB3 GLU 21 1HB GLU 21 15.314 3.724 -5.176
298 HG2 GLU 21 2HG GLU 21 16.451 1.850 -4.641
299 HG3 GLU 21 1HG GLU 21 14.978 0.880 -4.659
300 H ARG 22 H ARG 22 12.501 5.013 -3.818
301 HA ARG 22 HA ARG 22 14.290 5.662 -1.725
302 HE ARG 22 HE ARG 22 13.228 10.050 -2.559
303 HB2 ARG 22 2HB ARG 22 11.349 6.368 -1.931
304 HB3 ARG 22 1HB ARG 22 12.543 7.199 -0.933
305 HG2 ARG 22 2HG ARG 22 13.752 7.961 -2.863
306 HG3 ARG 22 1HG ARG 22 12.815 6.920 -3.935
307 HD2 ARG 22 2HD ARG 22 11.556 8.786 -4.271
308 HD3 ARG 22 1HD ARG 22 10.826 8.352 -2.725
309 HH11 ARG 22 1HH2 ARG 22 10.526 9.548 -0.896
310 HH12 ARG 22 2HH2 ARG 22 9.914 11.168 -0.920
311 HH21 ARG 22 1HH1 ARG 22 12.135 12.257 -3.347
312 HH22 ARG 22 2HH1 ARG 22 10.826 12.702 -2.303
313 H GLY 23 H GLY 23 11.734 3.349 -1.835
314 HA2 GLY 23 2HA GLY 23 11.855 1.574 -0.078
315 HA3 GLY 23 1HA GLY 23 12.101 2.869 1.094
316 H PHE 24 H PHE 24 10.136 1.571 1.993
317 HA PHE 24 HA PHE 24 7.725 3.132 1.338
318 HD1 PHE 24 HD2 PHE 24 8.982 0.835 -1.351
319 HD2 PHE 24 HD1 PHE 24 7.880 -1.174 2.284
320 HE1 PHE 24 HE2 PHE 24 10.558 -1.001 -1.887
321 HE2 PHE 24 HE1 PHE 24 9.457 -3.014 1.745
322 HZ PHE 24 HZ PHE 24 10.796 -2.927 -0.342
323 HB2 PHE 24 2HB PHE 24 6.547 0.684 1.407
324 HB3 PHE 24 1HB PHE 24 6.994 1.499 -0.090
325 H PHE 25 H PHE 25 5.866 1.764 2.828
326 HA PHE 25 HA PHE 25 7.166 1.673 5.520
327 HD1 PHE 25 HD2 PHE 25 6.237 2.002 7.844
328 HD2 PHE 25 HD1 PHE 25 5.470 5.279 5.166
329 HE1 PHE 25 HE2 PHE 25 7.195 3.580 9.498
330 HE2 PHE 25 HE1 PHE 25 6.432 6.853 6.823
331 HZ PHE 25 HZ PHE 25 7.292 6.006 8.989
332 HB2 PHE 25 2HB PHE 25 4.859 3.121 4.523
333 HB3 PHE 25 1HB PHE 25 4.376 2.043 5.829
334 H TYR 26 H TYR 26 4.087 0.503 4.076
335 HA TYR 26 HA TYR 26 2.981 -1.543 4.445
336 HD1 TYR 26 HD1 TYR 26 2.447 -3.459 4.906
337 HD2 TYR 26 HD2 TYR 26 6.364 -4.787 3.728
338 HE1 TYR 26 HE1 TYR 26 1.833 -5.788 5.488
339 HE2 TYR 26 HE2 TYR 26 5.746 -7.113 4.311
340 HH TYR 26 HH TYR 26 3.637 -8.042 6.182
341 HB2 TYR 26 2HB TYR 26 4.639 -2.366 2.889
342 HB3 TYR 26 1HB TYR 26 5.877 -2.394 4.139
343 H THR 27 H THR 27 3.295 -0.133 6.784
344 HA THR 27 HA THR 27 4.605 -1.774 8.819
345 HB THR 27 HB THR 27 4.537 0.552 9.302
346 HG1 THR 27 HG1 THR 27 2.289 -0.209 10.767
347 HG21 THR 27 3HG2 THR 27 2.982 1.722 8.147
348 HG22 THR 27 1HG2 THR 27 1.896 1.357 9.488
349 HG23 THR 27 2HG2 THR 27 1.897 0.335 8.051
350 H LYS 28 H LYS 28 3.636 -3.275 10.149
351 HA LYS 28 HA LYS 28 0.699 -3.720 9.772
352 HB2 LYS 28 2HB LYS 28 2.401 -5.458 8.806
353 HB3 LYS 28 1HB LYS 28 2.614 -5.932 10.492
354 HG2 LYS 28 2HG LYS 28 -0.166 -5.652 9.392
355 HG3 LYS 28 1HG LYS 28 0.764 -7.105 9.023
356 HD2 LYS 28 2HD LYS 28 0.390 -6.062 11.841
357 HD3 LYS 28 1HD LYS 28 -0.680 -7.258 11.108
358 HE2 LYS 28 2HE LYS 28 2.269 -7.521 11.706
359 HE3 LYS 28 1HE LYS 28 0.946 -8.533 12.287
360 HZ1 LYS 28 3HZ LYS 28 1.834 -9.782 10.584
361 HZ2 LYS 28 1HZ LYS 28 2.170 -8.435 9.609
362 HZ3 LYS 28 2HZ LYS 28 0.568 -8.975 9.792
363 HA PRO 29 HA PRO 29 1.363 -2.868 14.182
364 HB2 PRO 29 2HB PRO 29 -1.059 -1.611 14.505
365 HB3 PRO 29 1HB PRO 29 0.412 -0.788 13.957
366 HG2 PRO 29 2HG PRO 29 -1.970 -1.636 12.369
367 HG3 PRO 29 1HG PRO 29 -0.842 -0.300 12.076
368 HD2 PRO 29 2HD PRO 29 -0.814 -2.784 10.743
369 HD3 PRO 29 1HD PRO 29 0.511 -1.603 10.755
370 H THR 30 H THR 30 0.529 -4.037 15.945
371 HA THR 30 HA THR 30 -2.000 -5.526 15.615
372 HB THR 30 HB THR 30 -0.343 -7.054 14.657
373 HG1 THR 30 HG1 THR 30 -1.571 -8.398 15.689
374 HG21 THR 30 3HG2 THR 30 1.148 -7.397 17.181
375 HG22 THR 30 1HG2 THR 30 1.426 -5.860 16.364
376 HG23 THR 30 2HG2 THR 30 1.736 -7.375 15.518
Start of MODEL 13
1 H1 GLY 1 1H GLY 1 -4.215 -1.129 11.472
2 H2 GLY 1 2H GLY 1 -2.942 -0.647 12.488
3 H3 GLY 1 3H GLY 1 -2.946 -2.204 11.810
4 HA2 GLY 1 1HA GLY 1 -2.531 0.282 10.337
5 HA3 GLY 1 2HA GLY 1 -1.311 -1.005 10.573
6 H ILE 2 H ILE 2 -1.312 -0.772 8.162
7 HA ILE 2 HA ILE 2 -3.793 -0.247 6.665
8 HB ILE 2 HB ILE 2 -1.507 0.714 6.055
9 HG12 ILE 2 2HG1 ILE 2 -3.201 -0.844 4.088
10 HG13 ILE 2 1HG1 ILE 2 -3.265 0.883 4.442
11 HG21 ILE 2 1HG2 ILE 2 -0.034 -0.765 4.741
12 HG22 ILE 2 2HG2 ILE 2 -1.112 -2.124 5.061
13 HG23 ILE 2 3HG2 ILE 2 -0.225 -1.371 6.386
14 HD11 ILE 2 3HD1 ILE 2 -1.332 -0.637 2.754
15 HD12 ILE 2 1HD1 ILE 2 -0.703 0.734 3.668
16 HD13 ILE 2 2HD1 ILE 2 -2.013 0.972 2.511
17 H THR 3 H THR 3 -1.661 -2.955 7.385
18 HA THR 3 HA THR 3 -2.520 -4.777 5.398
19 HB THR 3 HB THR 3 -1.667 -5.246 8.266
20 HG1 THR 3 HG1 THR 3 -0.424 -5.346 5.731
21 HG21 THR 3 3HG2 THR 3 -2.380 -7.174 6.060
22 HG22 THR 3 1HG2 THR 3 -2.898 -7.193 7.745
23 HG23 THR 3 2HG2 THR 3 -1.238 -7.620 7.329
24 H GLU 4 H GLU 4 -4.149 -3.565 8.204
25 HA GLU 4 HA GLU 4 -6.305 -5.597 7.906
26 HB2 GLU 4 2HB GLU 4 -5.219 -4.100 10.128
27 HB3 GLU 4 1HB GLU 4 -6.948 -3.788 9.978
28 HG2 GLU 4 2HG GLU 4 -7.084 -5.725 11.200
29 HG3 GLU 4 1HG GLU 4 -6.962 -6.454 9.598
30 H GLN 5 H GLN 5 -6.012 -3.702 5.819
31 HA GLN 5 HA GLN 5 -8.685 -2.589 5.775
32 HB2 GLN 5 2HB GLN 5 -7.142 -0.968 7.195
33 HB3 GLN 5 1HB GLN 5 -6.574 -0.463 5.603
34 HG2 GLN 5 2HG GLN 5 -8.460 0.705 5.222
35 HG3 GLN 5 1HG GLN 5 -9.469 -0.677 5.653
36 HE21 GLN 5 1HE2 GLN 5 -7.617 2.031 7.117
37 HE22 GLN 5 2HE2 GLN 5 -8.550 2.106 8.533
38 H CYS 6 H CYS 6 -5.414 -2.632 4.419
39 HA CYS 6 HA CYS 6 -6.494 -2.053 1.726
40 HB2 CYS 6 2HB CYS 6 -3.744 -2.208 2.925
41 HB3 CYS 6 1HB CYS 6 -3.929 -2.380 1.187
42 H CYS 7 H CYS 7 -6.319 -4.710 3.611
43 HA CYS 7 HA CYS 7 -5.853 -6.458 1.233
44 HB2 CYS 7 2HB CYS 7 -4.044 -6.739 2.885
45 HB3 CYS 7 1HB CYS 7 -5.228 -7.090 4.132
46 H THR 8 H THR 8 -7.911 -5.625 3.904
47 HA THR 8 HA THR 8 -9.571 -8.027 3.680
48 HB THR 8 HB THR 8 -9.575 -6.934 5.821
49 HG1 THR 8 HG1 THR 8 -11.783 -6.416 6.008
50 HG21 THR 8 3HG2 THR 8 -8.824 -4.745 5.348
51 HG22 THR 8 1HG2 THR 8 -10.482 -4.516 5.907
52 HG23 THR 8 2HG2 THR 8 -10.116 -4.462 4.183
53 H SER 9 H SER 9 -9.094 -5.374 1.735
54 HA SER 9 HA SER 9 -11.422 -5.947 0.109
55 HG SER 9 HG SER 9 -13.543 -3.363 0.473
56 HB2 SER 9 2HB SER 9 -12.429 -4.524 1.906
57 HB3 SER 9 1HB SER 9 -11.299 -3.241 1.482
58 H ILE 10 H ILE 10 -11.137 -2.904 -0.719
59 HA ILE 10 HA ILE 10 -8.542 -3.275 -2.153
60 HB ILE 10 HB ILE 10 -11.124 -2.080 -3.191
61 HG12 ILE 10 2HG1 ILE 10 -9.606 -4.275 -4.532
62 HG13 ILE 10 1HG1 ILE 10 -10.506 -4.686 -3.070
63 HG21 ILE 10 1HG2 ILE 10 -8.574 -1.238 -3.818
64 HG22 ILE 10 2HG2 ILE 10 -9.968 -1.106 -4.889
65 HG23 ILE 10 3HG2 ILE 10 -8.868 -2.474 -5.041
66 HD11 ILE 10 3HD1 ILE 10 -11.501 -4.134 -5.738
67 HD12 ILE 10 1HD1 ILE 10 -12.240 -3.058 -4.551
68 HD13 ILE 10 2HD1 ILE 10 -12.352 -4.806 -4.347
69 H CYS 11 H CYS 11 -7.206 -1.437 -2.251
70 HA CYS 11 HA CYS 11 -8.151 0.872 -0.609
71 HB2 CYS 11 2HB CYS 11 -5.520 -0.457 -0.984
72 HB3 CYS 11 1HB CYS 11 -5.484 1.301 -0.839
73 H SER 12 H SER 12 -6.652 2.935 -1.407
74 HA SER 12 HA SER 12 -7.163 3.143 -4.351
75 HG SER 12 HG SER 12 -7.139 4.817 -1.301
76 HB2 SER 12 2HB SER 12 -7.726 5.502 -3.979
77 HB3 SER 12 1HB SER 12 -8.764 4.465 -3.004
78 H LEU 13 H LEU 13 -5.438 3.702 -5.560
79 HA LEU 13 HA LEU 13 -2.807 3.859 -4.660
80 HG LEU 13 HG LEU 13 -2.093 5.633 -8.017
81 HB2 LEU 13 2HB LEU 13 -2.897 3.721 -6.945
82 HB3 LEU 13 1HB LEU 13 -4.296 4.766 -7.063
83 HD11 LEU 13 1HD1 LEU 13 -2.813 7.736 -6.172
84 HD12 LEU 13 2HD1 LEU 13 -4.248 6.893 -6.759
85 HD13 LEU 13 3HD1 LEU 13 -3.121 7.620 -7.905
86 HD21 LEU 13 3HD2 LEU 13 -1.213 6.873 -5.602
87 HD22 LEU 13 1HD2 LEU 13 -0.301 5.845 -6.707
88 HD23 LEU 13 2HD2 LEU 13 -1.210 5.124 -5.378
89 H TYR 14 H TYR 14 -5.260 6.381 -4.856
90 HA TYR 14 HA TYR 14 -3.742 8.678 -4.330
91 HD1 TYR 14 HD1 TYR 14 -4.637 10.456 -5.277
92 HD2 TYR 14 HD2 TYR 14 -6.665 10.075 -1.508
93 HE1 TYR 14 HE1 TYR 14 -4.452 12.906 -4.930
94 HE2 TYR 14 HE2 TYR 14 -6.480 12.525 -1.161
95 HH TYR 14 HH TYR 14 -6.238 14.586 -2.709
96 HB2 TYR 14 2HB TYR 14 -6.339 8.417 -4.524
97 HB3 TYR 14 1HB TYR 14 -6.272 8.169 -2.779
98 H GLN 15 H GLN 15 -5.305 6.707 -1.838
99 HA GLN 15 HA GLN 15 -3.743 7.769 0.317
100 HB2 GLN 15 2HB GLN 15 -5.581 5.448 -0.051
101 HB3 GLN 15 1HB GLN 15 -4.522 5.450 1.359
102 HG2 GLN 15 2HG GLN 15 -6.475 7.640 0.585
103 HG3 GLN 15 1HG GLN 15 -6.653 6.513 1.931
104 HE21 GLN 15 1HE2 GLN 15 -6.189 9.603 1.756
105 HE22 GLN 15 2HE2 GLN 15 -4.916 9.864 2.847
106 H LEU 16 H LEU 16 -3.561 4.743 -1.488
107 HA LEU 16 HA LEU 16 -1.486 3.401 -0.307
108 HG LEU 16 HG LEU 16 -0.821 1.503 -1.518
109 HB2 LEU 16 2HB LEU 16 -2.630 3.489 -2.925
110 HB3 LEU 16 1HB LEU 16 -0.881 3.424 -3.097
111 HD11 LEU 16 1HD1 LEU 16 -3.394 2.370 -0.896
112 HD12 LEU 16 2HD1 LEU 16 -2.644 0.869 -0.351
113 HD13 LEU 16 3HD1 LEU 16 -3.656 0.876 -1.797
114 HD21 LEU 16 3HD2 LEU 16 -0.855 1.070 -3.916
115 HD22 LEU 16 1HD2 LEU 16 -2.611 1.228 -3.951
116 HD23 LEU 16 2HD2 LEU 16 -1.865 -0.127 -3.107
117 H GLU 17 H GLU 17 -1.181 6.290 -2.338
118 HA GLU 17 HA GLU 17 1.712 6.223 -2.331
119 HB2 GLU 17 2HB GLU 17 0.669 7.376 -4.143
120 HB3 GLU 17 1HB GLU 17 -0.301 8.364 -3.051
121 HG2 GLU 17 2HG GLU 17 2.555 8.583 -2.493
122 HG3 GLU 17 1HG GLU 17 2.157 9.072 -4.141
123 H ASN 18 H ASN 18 -0.732 7.581 -0.233
124 HA ASN 18 HA ASN 18 1.011 9.435 1.142
125 HB2 ASN 18 2HB ASN 18 -1.520 9.509 1.144
126 HB3 ASN 18 1HB ASN 18 -1.488 8.143 2.258
127 HD21 ASN 18 1HD2 ASN 18 -1.534 8.764 4.421
128 HD22 ASN 18 2HD2 ASN 18 -0.936 10.232 5.029
129 H TYR 19 H TYR 19 0.975 6.064 1.133
130 HA TYR 19 HA TYR 19 1.821 5.880 3.967
131 HD1 TYR 19 HD2 TYR 19 0.333 4.943 5.269
132 HD2 TYR 19 HD1 TYR 19 -0.864 3.424 1.433
133 HE1 TYR 19 HE2 TYR 19 -2.047 5.077 5.958
134 HE2 TYR 19 HE1 TYR 19 -3.244 3.558 2.121
135 HH TYR 19 HH TYR 19 -4.508 3.520 4.370
136 HB2 TYR 19 2HB TYR 19 1.399 3.734 1.867
137 HB3 TYR 19 1HB TYR 19 1.867 3.427 3.540
138 H CYS 20 H CYS 20 3.447 7.225 1.813
139 HA CYS 20 HA CYS 20 5.800 5.402 1.766
140 HB2 CYS 20 2HB CYS 20 4.843 6.861 -0.258
141 HB3 CYS 20 1HB CYS 20 5.917 8.060 0.424
142 H ASN 21 H ASN 21 7.891 6.949 1.785
143 HA ASN 21 HA ASN 21 7.723 8.461 4.362
144 HB2 ASN 21 2HB ASN 21 9.130 6.339 4.309
145 HB3 ASN 21 1HB ASN 21 10.201 7.180 3.188
146 HD21 ASN 21 1HD2 ASN 21 12.015 7.623 4.500
147 HD22 ASN 21 2HD2 ASN 21 11.941 8.476 5.966
148 HA PHE 1 HA PHE 1 -7.402 4.929 -11.063
149 HD1 PHE 1 HD1 PHE 1 -7.971 6.906 -10.910
150 HD2 PHE 1 HD2 PHE 1 -8.030 5.765 -6.766
151 HE1 PHE 1 HE1 PHE 1 -7.141 9.156 -10.279
152 HE2 PHE 1 HE2 PHE 1 -7.199 8.017 -6.137
153 HZ PHE 1 HZ PHE 1 -6.755 9.712 -7.893
154 H1 PHE 1 1H PHE 1 -8.966 5.935 -12.244
155 H2 PHE 1 2H PHE 1 -9.928 5.983 -10.844
156 H3 PHE 1 3H PHE 1 -10.093 4.702 -11.949
157 HB2 PHE 1 2HB PHE 1 -9.612 4.733 -9.010
158 HB3 PHE 1 1HB PHE 1 -8.009 4.060 -8.717
159 H VAL 2 H VAL 2 -7.055 2.611 -9.848
160 HA VAL 2 HA VAL 2 -8.570 0.634 -11.508
161 HB VAL 2 HB VAL 2 -6.272 0.742 -12.270
162 HG11 VAL 2 1HG1 VAL 2 -5.787 1.131 -9.428
163 HG12 VAL 2 2HG1 VAL 2 -4.731 1.487 -10.796
164 HG13 VAL 2 3HG1 VAL 2 -4.743 -0.129 -10.086
165 HG21 VAL 2 3HG2 VAL 2 -5.763 -1.636 -10.728
166 HG22 VAL 2 1HG2 VAL 2 -6.264 -1.508 -12.415
167 HG23 VAL 2 2HG2 VAL 2 -7.478 -1.568 -11.135
168 H ASN 3 H ASN 3 -9.747 -0.791 -10.317
169 HA ASN 3 HA ASN 3 -9.640 -0.826 -7.436
170 HB2 ASN 3 2HB ASN 3 -10.858 -2.897 -9.288
171 HB3 ASN 3 1HB ASN 3 -11.263 -2.633 -7.592
172 HD21 ASN 3 1HD2 ASN 3 -13.304 -2.433 -9.551
173 HD22 ASN 3 2HD2 ASN 3 -13.779 -0.809 -9.692
174 H GLN 4 H GLN 4 -7.850 -1.642 -6.408
175 HA GLN 4 HA GLN 4 -6.886 -4.310 -7.296
176 HB2 GLN 4 2HB GLN 4 -5.070 -3.240 -8.136
177 HB3 GLN 4 1HB GLN 4 -5.437 -1.749 -7.278
178 HG2 GLN 4 2HG GLN 4 -4.415 -4.078 -5.694
179 HG3 GLN 4 1HG GLN 4 -3.274 -3.182 -6.694
180 HE21 GLN 4 1HE2 GLN 4 -4.902 -3.157 -3.668
181 HE22 GLN 4 2HE2 GLN 4 -4.522 -1.566 -3.219
182 H HIS 5 H HIS 5 -6.308 -5.691 -5.636
183 HA HIS 5 HA HIS 5 -7.016 -4.812 -2.897
184 HD2 HIS 5 HD2 HIS 5 -9.580 -6.172 -4.511
185 HE1 HIS 5 HE1 HIS 5 -8.093 -8.976 -7.305
186 HE2 HIS 5 HE2 HIS 5 -10.058 -7.456 -6.725
187 HB2 HIS 5 2HB HIS 5 -6.060 -7.581 -3.275
188 HB3 HIS 5 1HB HIS 5 -7.525 -7.002 -2.488
189 H LEU 6 H LEU 6 -5.458 -5.442 -1.095
190 HA LEU 6 HA LEU 6 -2.637 -5.593 -2.009
191 HG LEU 6 HG LEU 6 -2.897 -2.501 -2.511
192 HB2 LEU 6 2HB LEU 6 -3.974 -3.340 -0.654
193 HB3 LEU 6 1HB LEU 6 -2.490 -3.860 0.112
194 HD11 LEU 6 1HD1 LEU 6 -1.682 -1.914 -0.136
195 HD12 LEU 6 2HD1 LEU 6 -1.301 -1.130 -1.668
196 HD13 LEU 6 3HD1 LEU 6 -0.312 -2.472 -1.096
197 HD21 LEU 6 3HD2 LEU 6 -1.901 -4.342 -3.556
198 HD22 LEU 6 1HD2 LEU 6 -1.023 -4.819 -2.103
199 HD23 LEU 6 2HD2 LEU 6 -0.473 -3.443 -3.045
200 H CYS 7 H CYS 7 -1.421 -6.920 -0.818
201 HA CYS 7 HA CYS 7 -2.007 -7.359 2.023
202 HB2 CYS 7 2HB CYS 7 -2.126 -9.727 0.116
203 HB3 CYS 7 1HB CYS 7 -2.377 -9.761 1.858
204 H GLY 8 H GLY 8 0.024 -7.343 2.881
205 HA2 GLY 8 2HA GLY 8 2.397 -7.432 2.912
206 HA3 GLY 8 1HA GLY 8 2.039 -9.135 2.666
207 H SER 9 H SER 9 2.945 -10.051 0.911
208 HA SER 9 HA SER 9 4.778 -8.916 -0.787
209 HG SER 9 HG SER 9 5.046 -12.128 -1.433
210 HB2 SER 9 2HB SER 9 3.152 -11.305 -0.836
211 HB3 SER 9 1HB SER 9 3.339 -10.669 -2.467
212 H ASP 10 H ASP 10 1.290 -9.177 -1.536
213 HA ASP 10 HA ASP 10 1.525 -7.553 -3.921
214 HB2 ASP 10 2HB ASP 10 -0.862 -8.304 -2.205
215 HB3 ASP 10 1HB ASP 10 -0.974 -7.485 -3.759
216 H LEU 11 H LEU 11 1.024 -6.986 -0.533
217 HA LEU 11 HA LEU 11 -0.002 -4.323 -0.630
218 HG LEU 11 HG LEU 11 1.855 -3.445 2.071
219 HB2 LEU 11 2HB LEU 11 -0.014 -5.702 1.408
220 HB3 LEU 11 1HB LEU 11 1.744 -5.694 1.444
221 HD11 LEU 11 1HD1 LEU 11 -0.385 -2.079 1.990
222 HD12 LEU 11 2HD1 LEU 11 -0.845 -3.284 0.788
223 HD13 LEU 11 3HD1 LEU 11 0.574 -2.271 0.524
224 HD21 LEU 11 3HD2 LEU 11 0.668 -3.397 4.056
225 HD22 LEU 11 1HD2 LEU 11 0.496 -5.103 3.641
226 HD23 LEU 11 2HD2 LEU 11 -0.816 -3.976 3.298
227 H VAL 12 H VAL 12 3.333 -5.579 -0.685
228 HA VAL 12 HA VAL 12 4.479 -2.898 -0.600
229 HB VAL 12 HB VAL 12 6.595 -4.164 -1.282
230 HG11 VAL 12 1HG1 VAL 12 5.287 -3.878 1.157
231 HG12 VAL 12 2HG1 VAL 12 6.966 -4.369 0.937
232 HG13 VAL 12 3HG1 VAL 12 5.705 -5.590 1.106
233 HG21 VAL 12 3HG2 VAL 12 5.185 -6.051 -2.298
234 HG22 VAL 12 1HG2 VAL 12 4.901 -6.583 -0.641
235 HG23 VAL 12 2HG2 VAL 12 6.542 -6.545 -1.287
236 H GLU 13 H GLU 13 3.675 -5.249 -3.124
237 HA GLU 13 HA GLU 13 5.023 -4.071 -5.300
238 HB2 GLU 13 2HB GLU 13 3.762 -6.206 -5.446
239 HB3 GLU 13 1HB GLU 13 2.250 -5.303 -5.334
240 HG2 GLU 13 2HG GLU 13 3.862 -4.096 -7.368
241 HG3 GLU 13 1HG GLU 13 3.802 -5.834 -7.667
242 H ALA 14 H ALA 14 1.697 -3.378 -4.160
243 HA ALA 14 HA ALA 14 1.226 -1.220 -5.971
244 HB1 ALA 14 3HB ALA 14 0.069 -1.467 -3.190
245 HB2 ALA 14 1HB ALA 14 -0.491 -2.437 -4.553
246 HB3 ALA 14 2HB ALA 14 -0.653 -0.685 -4.597
247 H LEU 15 H LEU 15 2.260 -1.154 -2.547
248 HA LEU 15 HA LEU 15 2.640 1.663 -2.405
249 HG LEU 15 HG LEU 15 1.801 -0.793 -0.532
250 HB2 LEU 15 2HB LEU 15 4.182 -0.504 -0.943
251 HB3 LEU 15 1HB LEU 15 4.096 1.193 -0.478
252 HD11 LEU 15 1HD1 LEU 15 3.276 0.713 1.634
253 HD12 LEU 15 2HD1 LEU 15 3.192 -1.035 1.412
254 HD13 LEU 15 3HD1 LEU 15 1.755 -0.138 1.904
255 HD21 LEU 15 3HD2 LEU 15 1.750 2.135 0.265
256 HD22 LEU 15 1HD2 LEU 15 0.380 1.029 0.187
257 HD23 LEU 15 2HD2 LEU 15 1.180 1.545 -1.296
258 H TYR 16 H TYR 16 4.628 -0.906 -3.724
259 HA TYR 16 HA TYR 16 7.123 0.449 -3.825
260 HD1 TYR 16 HD2 TYR 16 9.189 -0.068 -4.792
261 HD2 TYR 16 HD1 TYR 16 6.935 -3.605 -3.855
262 HE1 TYR 16 HE2 TYR 16 11.156 -1.008 -3.608
263 HE2 TYR 16 HE1 TYR 16 8.901 -4.544 -2.670
264 HH TYR 16 HH TYR 16 11.991 -3.363 -3.022
265 HB2 TYR 16 2HB TYR 16 5.913 -1.898 -5.055
266 HB3 TYR 16 1HB TYR 16 6.993 -1.059 -6.168
267 H LEU 17 H LEU 17 4.905 0.017 -6.603
268 HA LEU 17 HA LEU 17 6.099 1.889 -8.290
269 HG LEU 17 HG LEU 17 3.222 0.627 -6.804
270 HB2 LEU 17 2HB LEU 17 3.651 2.278 -9.153
271 HB3 LEU 17 1HB LEU 17 4.414 0.705 -9.356
272 HD11 LEU 17 1HD1 LEU 17 1.255 1.735 -6.858
273 HD12 LEU 17 2HD1 LEU 17 0.922 1.212 -8.509
274 HD13 LEU 17 3HD1 LEU 17 1.927 2.632 -8.220
275 HD21 LEU 17 3HD2 LEU 17 1.755 -0.487 -9.142
276 HD22 LEU 17 1HD2 LEU 17 2.270 -1.286 -7.657
277 HD23 LEU 17 2HD2 LEU 17 3.432 -0.995 -8.950
278 H VAL 18 H VAL 18 3.717 2.561 -5.704
279 HA VAL 18 HA VAL 18 3.583 5.383 -6.358
280 HB VAL 18 HB VAL 18 2.520 5.648 -4.144
281 HG11 VAL 18 1HG1 VAL 18 0.564 4.716 -4.838
282 HG12 VAL 18 2HG1 VAL 18 1.295 3.130 -5.093
283 HG13 VAL 18 3HG1 VAL 18 1.489 4.396 -6.305
284 HG21 VAL 18 3HG2 VAL 18 2.143 3.612 -2.768
285 HG22 VAL 18 1HG2 VAL 18 3.846 4.056 -2.861
286 HG23 VAL 18 2HG2 VAL 18 3.223 2.728 -3.840
287 H CYS 19 H CYS 19 5.277 3.523 -3.885
288 HA CYS 19 HA CYS 19 6.671 5.808 -2.802
289 HB2 CYS 19 2HB CYS 19 6.830 2.846 -2.504
290 HB3 CYS 19 1HB CYS 19 8.265 3.767 -2.070
291 H GLY 20 H GLY 20 7.867 3.051 -4.732
292 HA2 GLY 20 2HA GLY 20 9.513 3.022 -6.428
293 HA3 GLY 20 1HA GLY 20 9.544 4.789 -6.374
294 H GLU 21 H GLU 21 11.914 4.703 -6.345
295 HA GLU 21 HA GLU 21 13.296 3.340 -4.188
296 HB2 GLU 21 2HB GLU 21 14.085 4.446 -6.579
297 HB3 GLU 21 1HB GLU 21 14.685 5.628 -5.414
298 HG2 GLU 21 2HG GLU 21 16.427 4.003 -5.673
299 HG3 GLU 21 1HG GLU 21 15.668 3.671 -4.116
300 H ARG 22 H ARG 22 11.287 4.800 -2.991
301 HA ARG 22 HA ARG 22 12.808 6.965 -1.624
302 HE ARG 22 HE ARG 22 8.553 8.628 -3.950
303 HB2 ARG 22 2HB ARG 22 10.106 6.946 -2.795
304 HB3 ARG 22 1HB ARG 22 10.149 7.521 -1.127
305 HG2 ARG 22 2HG ARG 22 11.080 9.472 -1.760
306 HG3 ARG 22 1HG ARG 22 12.365 8.627 -2.625
307 HD2 ARG 22 2HD ARG 22 11.102 10.001 -4.201
308 HD3 ARG 22 1HD ARG 22 10.810 8.297 -4.546
309 HH11 ARG 22 1HH2 ARG 22 9.070 9.679 -1.198
310 HH12 ARG 22 2HH2 ARG 22 8.422 11.282 -1.290
311 HH21 ARG 22 1HH1 ARG 22 8.360 11.341 -4.758
312 HH22 ARG 22 2HH1 ARG 22 8.020 12.224 -3.308
313 H GLY 23 H GLY 23 11.372 3.922 -1.393
314 HA2 GLY 23 2HA GLY 23 11.368 2.531 0.535
315 HA3 GLY 23 1HA GLY 23 11.709 3.948 1.526
316 H PHE 24 H PHE 24 9.481 1.677 1.263
317 HA PHE 24 HA PHE 24 7.160 3.534 1.582
318 HD1 PHE 24 HD2 PHE 24 8.803 0.879 -0.840
319 HD2 PHE 24 HD1 PHE 24 6.448 -0.696 2.393
320 HE1 PHE 24 HE2 PHE 24 10.039 -1.267 -0.984
321 HE2 PHE 24 HE1 PHE 24 7.684 -2.843 2.246
322 HZ PHE 24 HZ PHE 24 9.479 -3.128 0.558
323 HB2 PHE 24 2HB PHE 24 5.817 1.357 1.314
324 HB3 PHE 24 1HB PHE 24 6.654 1.929 -0.123
325 H PHE 25 H PHE 25 5.455 2.397 3.177
326 HA PHE 25 HA PHE 25 6.995 1.903 5.670
327 HD1 PHE 25 HD2 PHE 25 6.161 1.368 7.866
328 HD2 PHE 25 HD1 PHE 25 5.011 5.320 6.624
329 HE1 PHE 25 HE2 PHE 25 7.034 2.291 9.995
330 HE2 PHE 25 HE1 PHE 25 5.886 6.240 8.752
331 HZ PHE 25 HZ PHE 25 6.896 4.728 10.438
332 HB2 PHE 25 2HB PHE 25 4.783 3.529 5.120
333 HB3 PHE 25 1HB PHE 25 4.102 2.157 5.992
334 H TYR 26 H TYR 26 3.819 0.710 4.433
335 HA TYR 26 HA TYR 26 2.876 -1.440 4.668
336 HD1 TYR 26 HD1 TYR 26 2.508 -3.556 4.910
337 HD2 TYR 26 HD2 TYR 26 6.642 -4.285 3.969
338 HE1 TYR 26 HE1 TYR 26 2.222 -5.944 5.501
339 HE2 TYR 26 HE2 TYR 26 6.348 -6.671 4.558
340 HH TYR 26 HH TYR 26 4.487 -8.317 4.684
341 HB2 TYR 26 2HB TYR 26 4.469 -2.143 3.025
342 HB3 TYR 26 1HB TYR 26 5.803 -2.023 4.158
343 H THR 27 H THR 27 2.751 -0.391 7.038
344 HA THR 27 HA THR 27 4.513 -1.608 9.012
345 HB THR 27 HB THR 27 3.612 0.537 9.556
346 HG1 THR 27 HG1 THR 27 1.866 -0.520 11.224
347 HG21 THR 27 3HG2 THR 27 0.937 0.498 9.836
348 HG22 THR 27 1HG2 THR 27 1.094 -0.686 8.537
349 HG23 THR 27 2HG2 THR 27 1.719 0.949 8.321
350 H LYS 28 H LYS 28 3.745 -3.017 10.741
351 HA LYS 28 HA LYS 28 1.242 -4.476 10.455
352 HB2 LYS 28 2HB LYS 28 3.535 -5.407 9.008
353 HB3 LYS 28 1HB LYS 28 3.218 -6.536 10.324
354 HG2 LYS 28 2HG LYS 28 0.718 -6.311 9.529
355 HG3 LYS 28 1HG LYS 28 1.454 -5.776 8.017
356 HD2 LYS 28 2HD LYS 28 2.103 -7.871 7.488
357 HD3 LYS 28 1HD LYS 28 2.783 -8.136 9.094
358 HE2 LYS 28 2HE LYS 28 0.898 -9.153 9.870
359 HE3 LYS 28 1HE LYS 28 -0.172 -8.073 8.977
360 HZ1 LYS 28 3HZ LYS 28 0.606 -9.296 6.929
361 HZ2 LYS 28 1HZ LYS 28 -0.405 -10.163 7.978
362 HZ3 LYS 28 2HZ LYS 28 1.268 -10.457 7.977
363 HA PRO 29 HA PRO 29 3.056 -4.379 14.642
364 HB2 PRO 29 2HB PRO 29 0.677 -3.758 15.876
365 HB3 PRO 29 1HB PRO 29 1.795 -2.548 15.223
366 HG2 PRO 29 2HG PRO 29 -0.801 -3.507 14.100
367 HG3 PRO 29 1HG PRO 29 -0.005 -1.936 13.904
368 HD2 PRO 29 2HD PRO 29 -0.017 -4.009 11.998
369 HD3 PRO 29 1HD PRO 29 1.078 -2.613 11.996
370 H THR 30 H THR 30 3.334 -6.410 15.460
371 HA THR 30 HA THR 30 1.032 -8.306 15.381
372 HB THR 30 HB THR 30 2.882 -9.311 14.301
373 HG1 THR 30 HG1 THR 30 1.989 -10.320 16.426
374 HG21 THR 30 3HG2 THR 30 4.739 -7.988 14.645
375 HG22 THR 30 1HG2 THR 30 5.132 -9.320 15.731
376 HG23 THR 30 2HG2 THR 30 4.439 -7.833 16.376
Start of MODEL 14
1 H1 GLY 1 1H GLY 1 -0.695 -0.044 10.694
2 H2 GLY 1 2H GLY 1 -0.876 -1.666 10.225
3 H3 GLY 1 3H GLY 1 -1.067 -1.225 11.854
4 HA2 GLY 1 1HA GLY 1 -3.210 -1.525 10.659
5 HA3 GLY 1 2HA GLY 1 -3.060 0.086 11.427
6 H ILE 2 H ILE 2 -1.585 -1.480 8.504
7 HA ILE 2 HA ILE 2 -3.750 -0.346 6.802
8 HB ILE 2 HB ILE 2 -1.282 0.287 6.468
9 HG12 ILE 2 2HG1 ILE 2 -3.132 -0.776 4.340
10 HG13 ILE 2 1HG1 ILE 2 -2.817 0.902 4.776
11 HG21 ILE 2 1HG2 ILE 2 -0.399 -2.029 6.683
12 HG22 ILE 2 2HG2 ILE 2 0.059 -1.275 5.156
13 HG23 ILE 2 3HG2 ILE 2 -1.243 -2.464 5.196
14 HD11 ILE 2 3HD1 ILE 2 -1.576 0.691 2.810
15 HD12 ILE 2 1HD1 ILE 2 -1.136 -0.980 3.152
16 HD13 ILE 2 2HD1 ILE 2 -0.358 0.332 4.034
17 H THR 3 H THR 3 -1.738 -3.286 7.123
18 HA THR 3 HA THR 3 -2.880 -4.867 5.148
19 HB THR 3 HB THR 3 -2.135 -5.714 7.964
20 HG1 THR 3 HG1 THR 3 -0.753 -5.140 5.647
21 HG21 THR 3 3HG2 THR 3 -2.645 -7.310 5.444
22 HG22 THR 3 1HG2 THR 3 -3.510 -7.431 6.976
23 HG23 THR 3 2HG2 THR 3 -1.832 -7.963 6.866
24 H GLU 4 H GLU 4 -4.392 -3.696 8.046
25 HA GLU 4 HA GLU 4 -6.665 -5.577 7.742
26 HB2 GLU 4 2HB GLU 4 -5.707 -5.060 10.011
27 HB3 GLU 4 1HB GLU 4 -6.272 -3.401 9.812
28 HG2 GLU 4 2HG GLU 4 -8.478 -3.974 10.075
29 HG3 GLU 4 1HG GLU 4 -8.264 -5.554 9.319
30 H GLN 5 H GLN 5 -6.140 -3.512 5.718
31 HA GLN 5 HA GLN 5 -8.843 -2.456 5.523
32 HB2 GLN 5 2HB GLN 5 -7.407 -0.829 7.063
33 HB3 GLN 5 1HB GLN 5 -6.760 -0.294 5.510
34 HG2 GLN 5 2HG GLN 5 -8.577 1.053 5.411
35 HG3 GLN 5 1HG GLN 5 -9.475 -0.414 5.018
36 HE21 GLN 5 1HE2 GLN 5 -9.126 2.093 7.362
37 HE22 GLN 5 2HE2 GLN 5 -10.139 1.425 8.550
38 H CYS 6 H CYS 6 -5.481 -2.055 4.412
39 HA CYS 6 HA CYS 6 -6.309 -1.549 1.664
40 HB2 CYS 6 2HB CYS 6 -3.664 -2.067 3.016
41 HB3 CYS 6 1HB CYS 6 -3.786 -1.994 1.265
42 H CYS 7 H CYS 7 -6.241 -4.283 3.567
43 HA CYS 7 HA CYS 7 -5.962 -6.003 1.143
44 HB2 CYS 7 2HB CYS 7 -4.133 -6.414 2.729
45 HB3 CYS 7 1HB CYS 7 -5.292 -6.694 4.017
46 H THR 8 H THR 8 -7.524 -5.860 4.381
47 HA THR 8 HA THR 8 -9.509 -7.823 3.862
48 HB THR 8 HB THR 8 -10.805 -6.770 5.632
49 HG1 THR 8 HG1 THR 8 -9.099 -4.558 5.161
50 HG21 THR 8 3HG2 THR 8 -8.489 -7.842 6.104
51 HG22 THR 8 1HG2 THR 8 -9.233 -6.875 7.375
52 HG23 THR 8 2HG2 THR 8 -7.949 -6.185 6.382
53 H SER 9 H SER 9 -9.048 -4.631 2.654
54 HA SER 9 HA SER 9 -11.486 -4.910 0.981
55 HG SER 9 HG SER 9 -12.686 -3.156 3.589
56 HB2 SER 9 2HB SER 9 -10.796 -2.212 2.097
57 HB3 SER 9 1HB SER 9 -12.352 -2.818 1.538
58 H ILE 10 H ILE 10 -11.022 -2.210 -0.140
59 HA ILE 10 HA ILE 10 -8.440 -2.776 -1.542
60 HB ILE 10 HB ILE 10 -11.032 -1.619 -2.582
61 HG12 ILE 10 2HG1 ILE 10 -9.435 -3.789 -3.880
62 HG13 ILE 10 1HG1 ILE 10 -10.326 -4.188 -2.411
63 HG21 ILE 10 1HG2 ILE 10 -9.552 -0.240 -3.716
64 HG22 ILE 10 2HG2 ILE 10 -9.516 -1.651 -4.774
65 HG23 ILE 10 3HG2 ILE 10 -8.225 -1.395 -3.599
66 HD11 ILE 10 3HD1 ILE 10 -12.179 -4.391 -3.666
67 HD12 ILE 10 1HD1 ILE 10 -11.334 -3.782 -5.089
68 HD13 ILE 10 2HD1 ILE 10 -12.097 -2.654 -3.968
69 H CYS 11 H CYS 11 -6.985 -1.080 -1.730
70 HA CYS 11 HA CYS 11 -7.739 1.412 -0.275
71 HB2 CYS 11 2HB CYS 11 -5.247 -0.168 -0.548
72 HB3 CYS 11 1HB CYS 11 -5.039 1.584 -0.573
73 H SER 12 H SER 12 -6.385 3.375 -1.151
74 HA SER 12 HA SER 12 -6.658 3.385 -4.132
75 HG SER 12 HG SER 12 -8.407 5.774 -1.629
76 HB2 SER 12 2HB SER 12 -6.750 6.014 -3.455
77 HB3 SER 12 1HB SER 12 -8.182 5.003 -3.627
78 H LEU 13 H LEU 13 -4.655 3.122 -4.893
79 HA LEU 13 HA LEU 13 -2.137 3.431 -4.002
80 HG LEU 13 HG LEU 13 -3.670 2.346 -6.261
81 HB2 LEU 13 2HB LEU 13 -2.413 5.083 -6.418
82 HB3 LEU 13 1HB LEU 13 -1.453 3.639 -6.152
83 HD11 LEU 13 1HD1 LEU 13 -4.608 5.045 -6.525
84 HD12 LEU 13 2HD1 LEU 13 -5.556 3.557 -6.505
85 HD13 LEU 13 3HD1 LEU 13 -4.942 4.192 -8.032
86 HD21 LEU 13 3HD2 LEU 13 -2.922 3.791 -8.796
87 HD22 LEU 13 1HD2 LEU 13 -3.446 2.118 -8.605
88 HD23 LEU 13 2HD2 LEU 13 -1.846 2.611 -8.048
89 H TYR 14 H TYR 14 -4.121 6.150 -5.052
90 HA TYR 14 HA TYR 14 -2.346 8.267 -4.571
91 HD1 TYR 14 HD1 TYR 14 -2.997 10.901 -4.855
92 HD2 TYR 14 HD2 TYR 14 -6.193 9.201 -2.543
93 HE1 TYR 14 HE1 TYR 14 -3.210 13.024 -3.587
94 HE2 TYR 14 HE2 TYR 14 -6.410 11.321 -1.274
95 HH TYR 14 HH TYR 14 -5.084 14.200 -2.277
96 HB2 TYR 14 2HB TYR 14 -4.375 8.843 -5.599
97 HB3 TYR 14 1HB TYR 14 -5.332 8.012 -4.375
98 H GLN 15 H GLN 15 -4.747 6.990 -2.271
99 HA GLN 15 HA GLN 15 -3.474 8.351 -0.021
100 HB2 GLN 15 2HB GLN 15 -5.810 6.573 -0.419
101 HB3 GLN 15 1HB GLN 15 -4.992 6.382 1.128
102 HG2 GLN 15 2HG GLN 15 -6.059 8.981 -0.013
103 HG3 GLN 15 1HG GLN 15 -6.731 8.083 1.349
104 HE21 GLN 15 1HE2 GLN 15 -5.900 10.743 1.782
105 HE22 GLN 15 2HE2 GLN 15 -4.494 10.746 2.734
106 H LEU 16 H LEU 16 -3.429 5.237 -1.552
107 HA LEU 16 HA LEU 16 -2.040 3.681 0.366
108 HG LEU 16 HG LEU 16 -3.041 1.776 -0.380
109 HB2 LEU 16 2HB LEU 16 -2.913 3.414 -2.299
110 HB3 LEU 16 1HB LEU 16 -1.176 3.125 -2.349
111 HD11 LEU 16 1HD1 LEU 16 -1.834 0.629 -2.917
112 HD12 LEU 16 2HD1 LEU 16 -3.506 1.173 -2.786
113 HD13 LEU 16 3HD1 LEU 16 -2.940 -0.181 -1.808
114 HD21 LEU 16 3HD2 LEU 16 -1.179 0.786 0.443
115 HD22 LEU 16 1HD2 LEU 16 -0.313 2.106 -0.343
116 HD23 LEU 16 2HD2 LEU 16 -0.487 0.555 -1.162
117 H GLU 17 H GLU 17 -0.966 6.164 -1.841
118 HA GLU 17 HA GLU 17 1.865 5.560 -1.672
119 HB2 GLU 17 2HB GLU 17 1.111 6.834 -3.557
120 HB3 GLU 17 1HB GLU 17 0.314 8.015 -2.519
121 HG2 GLU 17 2HG GLU 17 2.440 8.811 -1.683
122 HG3 GLU 17 1HG GLU 17 3.305 7.519 -2.518
123 H ASN 18 H ASN 18 -0.378 7.130 0.410
124 HA ASN 18 HA ASN 18 1.404 8.944 1.742
125 HB2 ASN 18 2HB ASN 18 -1.203 8.733 1.864
126 HB3 ASN 18 1HB ASN 18 -0.873 7.578 3.156
127 HD21 ASN 18 1HD2 ASN 18 -1.857 9.173 4.690
128 HD22 ASN 18 2HD2 ASN 18 -0.945 10.508 5.207
129 H TYR 19 H TYR 19 1.447 5.573 1.650
130 HA TYR 19 HA TYR 19 2.531 5.348 4.401
131 HD1 TYR 19 HD2 TYR 19 0.984 3.995 5.843
132 HD2 TYR 19 HD1 TYR 19 -0.268 3.412 1.778
133 HE1 TYR 19 HE2 TYR 19 -1.385 4.191 6.546
134 HE2 TYR 19 HE1 TYR 19 -2.638 3.607 2.475
135 HH TYR 19 HH TYR 19 -3.507 4.411 5.826
136 HB2 TYR 19 2HB TYR 19 2.001 3.185 2.336
137 HB3 TYR 19 1HB TYR 19 2.474 2.923 4.013
138 H CYS 20 H CYS 20 4.021 6.810 2.334
139 HA CYS 20 HA CYS 20 6.329 4.971 1.897
140 HB2 CYS 20 2HB CYS 20 5.225 6.609 0.100
141 HB3 CYS 20 1HB CYS 20 6.355 7.744 0.802
142 H ASN 21 H ASN 21 8.423 6.594 1.853
143 HA ASN 21 HA ASN 21 8.765 7.321 4.678
144 HB2 ASN 21 2HB ASN 21 10.601 6.152 3.632
145 HB3 ASN 21 1HB ASN 21 10.654 7.316 2.307
146 HD21 ASN 21 1HD2 ASN 21 10.600 7.610 5.915
147 HD22 ASN 21 2HD2 ASN 21 11.917 8.680 5.986
148 HA PHE 1 HA PHE 1 -10.136 1.884 -12.521
149 HD1 PHE 1 HD1 PHE 1 -8.828 0.357 -12.889
150 HD2 PHE 1 HD2 PHE 1 -5.885 3.114 -11.402
151 HE1 PHE 1 HE1 PHE 1 -7.405 -1.546 -12.176
152 HE2 PHE 1 HE2 PHE 1 -4.462 1.210 -10.689
153 HZ PHE 1 HZ PHE 1 -5.222 -1.119 -11.075
154 H1 PHE 1 1H PHE 1 -10.013 4.785 -12.714
155 H2 PHE 1 2H PHE 1 -11.311 4.148 -11.823
156 H3 PHE 1 3H PHE 1 -11.085 3.692 -13.444
157 HB2 PHE 1 2HB PHE 1 -8.322 3.078 -13.704
158 HB3 PHE 1 1HB PHE 1 -7.919 3.937 -12.217
159 H VAL 2 H VAL 2 -11.175 1.358 -10.575
160 HA VAL 2 HA VAL 2 -9.645 2.030 -8.134
161 HB VAL 2 HB VAL 2 -11.440 3.757 -8.336
162 HG11 VAL 2 1HG1 VAL 2 -13.559 1.829 -7.647
163 HG12 VAL 2 2HG1 VAL 2 -12.965 1.692 -9.302
164 HG13 VAL 2 3HG1 VAL 2 -13.612 3.226 -8.722
165 HG21 VAL 2 3HG2 VAL 2 -11.591 3.750 -6.080
166 HG22 VAL 2 1HG2 VAL 2 -10.703 2.227 -6.134
167 HG23 VAL 2 2HG2 VAL 2 -12.466 2.219 -6.071
168 H ASN 3 H ASN 3 -9.122 -0.042 -7.603
169 HA ASN 3 HA ASN 3 -10.859 -1.805 -6.343
170 HB2 ASN 3 2HB ASN 3 -11.363 -1.794 -9.136
171 HB3 ASN 3 1HB ASN 3 -10.560 -3.319 -8.771
172 HD21 ASN 3 1HD2 ASN 3 -13.465 -1.397 -8.135
173 HD22 ASN 3 2HD2 ASN 3 -14.334 -2.639 -7.371
174 H GLN 4 H GLN 4 -8.238 -1.021 -6.053
175 HA GLN 4 HA GLN 4 -6.564 -3.267 -6.985
176 HB2 GLN 4 2HB GLN 4 -5.984 -0.673 -6.956
177 HB3 GLN 4 1HB GLN 4 -5.528 -1.012 -5.291
178 HG2 GLN 4 2HG GLN 4 -4.280 -1.969 -7.838
179 HG3 GLN 4 1HG GLN 4 -3.510 -1.391 -6.363
180 HE21 GLN 4 1HE2 GLN 4 -4.721 -4.243 -8.004
181 HE22 GLN 4 2HE2 GLN 4 -4.282 -5.361 -6.803
182 H HIS 5 H HIS 5 -6.781 -5.036 -5.680
183 HA HIS 5 HA HIS 5 -7.187 -4.781 -2.794
184 HD2 HIS 5 HD2 HIS 5 -9.304 -6.373 -1.716
185 HE1 HIS 5 HE1 HIS 5 -11.417 -6.962 -5.331
186 HE2 HIS 5 HE2 HIS 5 -11.651 -6.558 -2.823
187 HB2 HIS 5 2HB HIS 5 -6.731 -7.115 -4.665
188 HB3 HIS 5 1HB HIS 5 -6.759 -7.331 -2.916
189 H LEU 6 H LEU 6 -5.566 -4.781 -1.260
190 HA LEU 6 HA LEU 6 -2.787 -5.330 -2.212
191 HG LEU 6 HG LEU 6 -2.887 -2.194 -2.684
192 HB2 LEU 6 2HB LEU 6 -3.950 -3.005 -0.819
193 HB3 LEU 6 1HB LEU 6 -2.477 -3.613 -0.108
194 HD11 LEU 6 1HD1 LEU 6 -1.111 -1.002 -1.939
195 HD12 LEU 6 2HD1 LEU 6 -0.234 -2.435 -1.406
196 HD13 LEU 6 3HD1 LEU 6 -1.502 -1.746 -0.391
197 HD21 LEU 6 3HD2 LEU 6 -2.172 -4.180 -3.761
198 HD22 LEU 6 1HD2 LEU 6 -1.103 -4.625 -2.431
199 HD23 LEU 6 2HD2 LEU 6 -0.671 -3.296 -3.502
200 H CYS 7 H CYS 7 -1.673 -6.778 -1.091
201 HA CYS 7 HA CYS 7 -2.200 -7.197 1.771
202 HB2 CYS 7 2HB CYS 7 -2.570 -9.498 -0.184
203 HB3 CYS 7 1HB CYS 7 -2.737 -9.571 1.568
204 H GLY 8 H GLY 8 -0.127 -7.270 2.534
205 HA2 GLY 8 2HA GLY 8 2.210 -7.626 2.559
206 HA3 GLY 8 1HA GLY 8 1.711 -9.272 2.190
207 H SER 9 H SER 9 2.656 -10.109 0.437
208 HA SER 9 HA SER 9 4.495 -8.981 -1.240
209 HG SER 9 HG SER 9 4.831 -10.450 -3.265
210 HB2 SER 9 2HB SER 9 3.950 -11.341 -1.414
211 HB3 SER 9 1HB SER 9 2.337 -10.966 -2.012
212 H ASP 10 H ASP 10 1.011 -9.092 -2.031
213 HA ASP 10 HA ASP 10 1.277 -7.347 -4.315
214 HB2 ASP 10 2HB ASP 10 -1.082 -8.168 -2.601
215 HB3 ASP 10 1HB ASP 10 -1.239 -7.146 -4.026
216 H LEU 11 H LEU 11 0.747 -6.906 -0.904
217 HA LEU 11 HA LEU 11 -0.160 -4.211 -0.893
218 HG LEU 11 HG LEU 11 1.843 -3.598 1.783
219 HB2 LEU 11 2HB LEU 11 -0.317 -5.584 1.088
220 HB3 LEU 11 1HB LEU 11 1.423 -5.830 1.121
221 HD11 LEU 11 1HD1 LEU 11 -0.452 -2.172 1.944
222 HD12 LEU 11 2HD1 LEU 11 -0.796 -3.163 0.531
223 HD13 LEU 11 3HD1 LEU 11 0.623 -2.116 0.548
224 HD21 LEU 11 3HD2 LEU 11 0.601 -3.392 3.806
225 HD22 LEU 11 1HD2 LEU 11 0.657 -5.123 3.470
226 HD23 LEU 11 2HD2 LEU 11 -0.803 -4.201 3.108
227 H VAL 12 H VAL 12 3.161 -5.551 -0.845
228 HA VAL 12 HA VAL 12 4.345 -2.895 -0.676
229 HB VAL 12 HB VAL 12 6.465 -4.192 -1.368
230 HG11 VAL 12 1HG1 VAL 12 5.440 -3.624 1.014
231 HG12 VAL 12 2HG1 VAL 12 6.848 -4.674 0.861
232 HG13 VAL 12 3HG1 VAL 12 5.247 -5.376 1.094
233 HG21 VAL 12 3HG2 VAL 12 5.008 -6.080 -2.330
234 HG22 VAL 12 1HG2 VAL 12 4.745 -6.569 -0.656
235 HG23 VAL 12 2HG2 VAL 12 6.377 -6.563 -1.326
236 H GLU 13 H GLU 13 3.443 -5.097 -3.273
237 HA GLU 13 HA GLU 13 4.914 -3.913 -5.388
238 HB2 GLU 13 2HB GLU 13 3.544 -5.978 -5.640
239 HB3 GLU 13 1HB GLU 13 2.081 -5.002 -5.503
240 HG2 GLU 13 2HG GLU 13 3.128 -3.613 -7.457
241 HG3 GLU 13 1HG GLU 13 4.115 -5.051 -7.720
242 H ALA 14 H ALA 14 1.473 -3.265 -4.630
243 HA ALA 14 HA ALA 14 1.125 -0.958 -6.153
244 HB1 ALA 14 3HB ALA 14 -0.711 -1.994 -4.900
245 HB2 ALA 14 1HB ALA 14 -0.585 -0.291 -4.459
246 HB3 ALA 14 2HB ALA 14 0.043 -1.532 -3.374
247 H LEU 15 H LEU 15 2.747 -1.301 -3.041
248 HA LEU 15 HA LEU 15 3.110 1.584 -2.687
249 HG LEU 15 HG LEU 15 1.977 -0.644 -0.934
250 HB2 LEU 15 2HB LEU 15 4.461 -0.776 -1.319
251 HB3 LEU 15 1HB LEU 15 4.603 0.904 -0.814
252 HD11 LEU 15 1HD1 LEU 15 3.867 0.019 1.327
253 HD12 LEU 15 2HD1 LEU 15 3.269 -1.567 0.836
254 HD13 LEU 15 3HD1 LEU 15 2.175 -0.405 1.586
255 HD21 LEU 15 3HD2 LEU 15 1.649 1.765 -1.218
256 HD22 LEU 15 1HD2 LEU 15 2.761 2.110 0.107
257 HD23 LEU 15 2HD2 LEU 15 1.209 1.341 0.436
258 H TYR 16 H TYR 16 5.073 -1.130 -3.873
259 HA TYR 16 HA TYR 16 7.538 0.261 -4.107
260 HD1 TYR 16 HD2 TYR 16 9.768 -0.665 -5.335
261 HD2 TYR 16 HD1 TYR 16 7.203 -3.486 -3.352
262 HE1 TYR 16 HE2 TYR 16 11.696 -1.481 -4.007
263 HE2 TYR 16 HE1 TYR 16 9.134 -4.304 -2.023
264 HH TYR 16 HH TYR 16 11.766 -4.320 -2.430
265 HB2 TYR 16 2HB TYR 16 6.364 -2.212 -5.140
266 HB3 TYR 16 1HB TYR 16 7.480 -1.467 -6.285
267 H LEU 17 H LEU 17 4.597 0.664 -5.835
268 HA LEU 17 HA LEU 17 5.968 1.940 -8.138
269 HG LEU 17 HG LEU 17 3.424 -0.218 -7.048
270 HB2 LEU 17 2HB LEU 17 2.997 2.019 -7.878
271 HB3 LEU 17 1HB LEU 17 3.992 1.720 -9.303
272 HD11 LEU 17 1HD1 LEU 17 1.596 -0.091 -8.617
273 HD12 LEU 17 2HD1 LEU 17 2.491 -1.572 -8.955
274 HD13 LEU 17 3HD1 LEU 17 2.706 -0.156 -9.985
275 HD21 LEU 17 3HD2 LEU 17 4.709 -1.718 -8.864
276 HD22 LEU 17 1HD2 LEU 17 5.572 -0.877 -7.577
277 HD23 LEU 17 2HD2 LEU 17 5.499 -0.176 -9.194
278 H VAL 18 H VAL 18 3.737 2.746 -5.486
279 HA VAL 18 HA VAL 18 3.632 5.568 -6.133
280 HB VAL 18 HB VAL 18 2.639 5.805 -3.892
281 HG11 VAL 18 1HG1 VAL 18 1.050 3.593 -4.275
282 HG12 VAL 18 2HG1 VAL 18 1.755 3.825 -5.875
283 HG13 VAL 18 3HG1 VAL 18 0.846 5.132 -5.114
284 HG21 VAL 18 3HG2 VAL 18 3.699 3.012 -3.611
285 HG22 VAL 18 1HG2 VAL 18 2.346 3.561 -2.628
286 HG23 VAL 18 2HG2 VAL 18 3.905 4.378 -2.517
287 H CYS 19 H CYS 19 5.428 3.606 -3.852
288 HA CYS 19 HA CYS 19 6.876 5.769 -2.639
289 HB2 CYS 19 2HB CYS 19 6.981 2.802 -2.620
290 HB3 CYS 19 1HB CYS 19 8.490 3.621 -2.234
291 H GLY 20 H GLY 20 8.013 3.196 -4.841
292 HA2 GLY 20 2HA GLY 20 9.554 3.376 -6.641
293 HA3 GLY 20 1HA GLY 20 9.648 5.116 -6.346
294 H GLU 21 H GLU 21 12.034 4.878 -6.481
295 HA GLU 21 HA GLU 21 13.403 3.228 -4.522
296 HB2 GLU 21 2HB GLU 21 14.310 4.097 -6.796
297 HB3 GLU 21 1HB GLU 21 14.660 5.587 -5.916
298 HG2 GLU 21 2HG GLU 21 16.360 4.640 -4.732
299 HG3 GLU 21 1HG GLU 21 15.504 3.109 -4.545
300 H ARG 22 H ARG 22 11.554 4.751 -3.126
301 HA ARG 22 HA ARG 22 13.313 6.643 -1.643
302 HE ARG 22 HE ARG 22 11.648 10.641 -4.566
303 HB2 ARG 22 2HB ARG 22 10.431 6.839 -2.451
304 HB3 ARG 22 1HB ARG 22 10.923 7.552 -0.914
305 HG2 ARG 22 2HG ARG 22 12.462 9.025 -1.959
306 HG3 ARG 22 1HG ARG 22 12.431 8.114 -3.469
307 HD2 ARG 22 2HD ARG 22 9.794 8.743 -3.217
308 HD3 ARG 22 1HD ARG 22 10.536 10.150 -2.457
309 HH11 ARG 22 1HH2 ARG 22 10.507 7.478 -4.783
310 HH12 ARG 22 2HH2 ARG 22 9.922 7.619 -6.408
311 HH21 ARG 22 1HH1 ARG 22 10.464 11.040 -6.588
312 HH22 ARG 22 2HH1 ARG 22 9.900 9.636 -7.430
313 H GLY 23 H GLY 23 11.595 3.724 -1.607
314 HA2 GLY 23 2HA GLY 23 11.619 2.163 0.202
315 HA3 GLY 23 1HA GLY 23 12.067 3.472 1.295
316 H PHE 24 H PHE 24 9.841 1.373 1.317
317 HA PHE 24 HA PHE 24 7.536 3.260 1.625
318 HD1 PHE 24 HD2 PHE 24 8.752 1.133 -1.172
319 HD2 PHE 24 HD1 PHE 24 7.387 -1.183 2.182
320 HE1 PHE 24 HE2 PHE 24 10.198 -0.754 -1.885
321 HE2 PHE 24 HE1 PHE 24 8.832 -3.068 1.469
322 HZ PHE 24 HZ PHE 24 10.239 -2.853 -0.563
323 HB2 PHE 24 2HB PHE 24 6.305 0.872 1.621
324 HB3 PHE 24 1HB PHE 24 6.673 1.722 0.124
325 H PHE 25 H PHE 25 5.882 1.808 3.255
326 HA PHE 25 HA PHE 25 7.556 1.416 5.704
327 HD1 PHE 25 HD2 PHE 25 7.456 1.627 7.834
328 HD2 PHE 25 HD1 PHE 25 5.647 5.144 6.147
329 HE1 PHE 25 HE2 PHE 25 8.787 3.045 9.370
330 HE2 PHE 25 HE1 PHE 25 6.978 6.560 7.687
331 HZ PHE 25 HZ PHE 25 8.547 5.513 9.299
332 HB2 PHE 25 2HB PHE 25 5.190 3.041 5.201
333 HB3 PHE 25 1HB PHE 25 4.902 1.896 6.509
334 H TYR 26 H TYR 26 4.295 0.490 4.480
335 HA TYR 26 HA TYR 26 3.110 -1.522 4.829
336 HD1 TYR 26 HD1 TYR 26 2.326 -3.439 4.651
337 HD2 TYR 26 HD2 TYR 26 6.366 -4.860 4.257
338 HE1 TYR 26 HE1 TYR 26 1.561 -5.750 5.112
339 HE2 TYR 26 HE2 TYR 26 5.596 -7.169 4.719
340 HH TYR 26 HH TYR 26 2.442 -7.856 5.902
341 HB2 TYR 26 2HB TYR 26 4.654 -2.326 3.128
342 HB3 TYR 26 1HB TYR 26 5.929 -2.519 4.318
343 H THR 27 H THR 27 3.588 -0.279 7.215
344 HA THR 27 HA THR 27 5.012 -2.043 9.058
345 HB THR 27 HB THR 27 4.687 -0.388 10.625
346 HG1 THR 27 HG1 THR 27 2.212 0.290 9.428
347 HG21 THR 27 3HG2 THR 27 3.715 1.520 8.598
348 HG22 THR 27 1HG2 THR 27 5.126 0.587 8.101
349 HG23 THR 27 2HG2 THR 27 5.187 1.561 9.570
350 H LYS 28 H LYS 28 3.980 -3.242 10.789
351 HA LYS 28 HA LYS 28 1.087 -3.795 10.346
352 HB2 LYS 28 2HB LYS 28 2.697 -5.531 9.313
353 HB3 LYS 28 1HB LYS 28 3.048 -5.996 10.976
354 HG2 LYS 28 2HG LYS 28 0.559 -6.272 11.329
355 HG3 LYS 28 1HG LYS 28 0.356 -6.050 9.592
356 HD2 LYS 28 2HD LYS 28 2.243 -8.123 10.717
357 HD3 LYS 28 1HD LYS 28 0.537 -8.476 10.437
358 HE2 LYS 28 2HE LYS 28 0.995 -8.855 8.267
359 HE3 LYS 28 1HE LYS 28 1.512 -7.178 8.102
360 HZ1 LYS 28 3HZ LYS 28 3.611 -8.330 9.346
361 HZ2 LYS 28 1HZ LYS 28 3.503 -8.055 7.676
362 HZ3 LYS 28 2HZ LYS 28 3.092 -9.575 8.313
363 HA PRO 29 HA PRO 29 2.474 -3.560 14.892
364 HB2 PRO 29 2HB PRO 29 1.912 -0.939 15.471
365 HB3 PRO 29 1HB PRO 29 3.519 -1.503 14.979
366 HG2 PRO 29 2HG PRO 29 1.471 -0.023 13.378
367 HG3 PRO 29 1HG PRO 29 3.238 0.013 13.247
368 HD2 PRO 29 2HD PRO 29 1.534 -1.417 11.540
369 HD3 PRO 29 1HD PRO 29 3.272 -1.711 11.747
370 H THR 30 H THR 30 0.729 -4.408 16.001
371 HA THR 30 HA THR 30 -1.820 -2.906 16.018
372 HB THR 30 HB THR 30 -3.083 -5.044 15.532
373 HG1 THR 30 HG1 THR 30 -1.811 -6.715 15.587
374 HG21 THR 30 3HG2 THR 30 -3.211 -4.419 13.353
375 HG22 THR 30 1HG2 THR 30 -1.481 -4.638 13.093
376 HG23 THR 30 2HG2 THR 30 -2.082 -3.150 13.822
Start of MODEL 15
1 H1 GLY 1 1H GLY 1 -4.087 1.093 11.497
2 H2 GLY 1 2H GLY 1 -3.603 -0.168 12.526
3 H3 GLY 1 3H GLY 1 -4.960 -0.363 11.522
4 HA2 GLY 1 1HA GLY 1 -2.546 0.200 10.112
5 HA3 GLY 1 2HA GLY 1 -2.507 -1.376 10.963
6 H ILE 2 H ILE 2 -1.867 -1.141 8.388
7 HA ILE 2 HA ILE 2 -4.207 -0.553 6.641
8 HB ILE 2 HB ILE 2 -1.900 0.466 6.201
9 HG12 ILE 2 2HG1 ILE 2 -3.346 -1.202 4.126
10 HG13 ILE 2 1HG1 ILE 2 -3.556 0.517 4.459
11 HG21 ILE 2 1HG2 ILE 2 -0.676 -1.680 6.703
12 HG22 ILE 2 2HG2 ILE 2 -0.229 -0.941 5.166
13 HG23 ILE 2 3HG2 ILE 2 -1.314 -2.331 5.193
14 HD11 ILE 2 3HD1 ILE 2 -1.330 1.008 3.637
15 HD12 ILE 2 1HD1 ILE 2 -2.164 0.046 2.417
16 HD13 ILE 2 2HD1 ILE 2 -0.968 -0.708 3.469
17 H THR 3 H THR 3 -1.787 -3.080 7.316
18 HA THR 3 HA THR 3 -2.527 -5.046 5.505
19 HB THR 3 HB THR 3 -1.909 -5.435 8.450
20 HG1 THR 3 HG1 THR 3 -0.402 -5.025 6.136
21 HG21 THR 3 3HG2 THR 3 -0.967 -7.596 6.915
22 HG22 THR 3 1HG2 THR 3 -2.612 -7.303 6.353
23 HG23 THR 3 2HG2 THR 3 -2.307 -7.615 8.062
24 H GLU 4 H GLU 4 -4.296 -3.914 8.291
25 HA GLU 4 HA GLU 4 -6.370 -6.007 7.884
26 HB2 GLU 4 2HB GLU 4 -5.624 -5.588 10.204
27 HB3 GLU 4 1HB GLU 4 -6.107 -3.899 10.053
28 HG2 GLU 4 2HG GLU 4 -8.106 -4.590 10.869
29 HG3 GLU 4 1HG GLU 4 -8.384 -5.228 9.248
30 H GLN 5 H GLN 5 -6.406 -4.490 5.740
31 HA GLN 5 HA GLN 5 -8.987 -3.246 5.719
32 HB2 GLN 5 2HB GLN 5 -7.526 -1.499 6.937
33 HB3 GLN 5 1HB GLN 5 -6.729 -1.259 5.382
34 HG2 GLN 5 2HG GLN 5 -9.060 -0.904 4.397
35 HG3 GLN 5 1HG GLN 5 -9.640 -0.807 6.061
36 HE21 GLN 5 1HE2 GLN 5 -8.140 0.779 7.467
37 HE22 GLN 5 2HE2 GLN 5 -7.767 2.254 6.715
38 H CYS 6 H CYS 6 -5.799 -2.763 4.178
39 HA CYS 6 HA CYS 6 -6.908 -2.734 1.505
40 HB2 CYS 6 2HB CYS 6 -4.263 -2.522 2.765
41 HB3 CYS 6 1HB CYS 6 -4.240 -3.328 1.206
42 H CYS 7 H CYS 7 -5.836 -5.173 3.670
43 HA CYS 7 HA CYS 7 -5.724 -7.163 1.487
44 HB2 CYS 7 2HB CYS 7 -3.968 -7.189 3.164
45 HB3 CYS 7 1HB CYS 7 -5.152 -7.360 4.448
46 H THR 8 H THR 8 -7.849 -5.981 3.928
47 HA THR 8 HA THR 8 -9.611 -8.368 3.665
48 HB THR 8 HB THR 8 -9.617 -5.999 5.554
49 HG1 THR 8 HG1 THR 8 -9.521 -8.803 5.967
50 HG21 THR 8 3HG2 THR 8 -11.794 -7.880 4.790
51 HG22 THR 8 1HG2 THR 8 -11.897 -6.222 5.381
52 HG23 THR 8 2HG2 THR 8 -11.600 -7.543 6.510
53 H SER 9 H SER 9 -9.119 -5.189 2.524
54 HA SER 9 HA SER 9 -11.572 -5.337 0.898
55 HG SER 9 HG SER 9 -13.394 -3.203 1.408
56 HB2 SER 9 2HB SER 9 -12.297 -4.122 2.936
57 HB3 SER 9 1HB SER 9 -10.982 -2.973 2.713
58 H ILE 10 H ILE 10 -11.505 -3.086 -0.498
59 HA ILE 10 HA ILE 10 -8.712 -2.981 -1.533
60 HB ILE 10 HB ILE 10 -11.357 -2.226 -2.792
61 HG12 ILE 10 2HG1 ILE 10 -9.351 -4.327 -3.636
62 HG13 ILE 10 1HG1 ILE 10 -10.672 -4.682 -2.521
63 HG21 ILE 10 1HG2 ILE 10 -10.230 -1.039 -4.338
64 HG22 ILE 10 2HG2 ILE 10 -9.115 -2.378 -4.606
65 HG23 ILE 10 3HG2 ILE 10 -8.783 -1.196 -3.342
66 HD11 ILE 10 3HD1 ILE 10 -11.550 -3.207 -4.890
67 HD12 ILE 10 1HD1 ILE 10 -12.210 -4.678 -4.174
68 HD13 ILE 10 2HD1 ILE 10 -10.839 -4.774 -5.280
69 H CYS 11 H CYS 11 -7.573 -1.052 -1.520
70 HA CYS 11 HA CYS 11 -8.985 1.283 -0.294
71 HB2 CYS 11 2HB CYS 11 -5.992 1.078 -0.525
72 HB3 CYS 11 1HB CYS 11 -6.954 1.961 0.657
73 H SER 12 H SER 12 -7.660 3.421 -1.051
74 HA SER 12 HA SER 12 -7.727 3.325 -4.035
75 HG SER 12 HG SER 12 -8.854 6.314 -1.595
76 HB2 SER 12 2HB SER 12 -8.059 5.817 -3.841
77 HB3 SER 12 1HB SER 12 -9.365 4.864 -3.142
78 H LEU 13 H LEU 13 -5.818 3.574 -5.070
79 HA LEU 13 HA LEU 13 -3.303 3.670 -3.944
80 HG LEU 13 HG LEU 13 -5.371 5.473 -6.074
81 HB2 LEU 13 2HB LEU 13 -2.544 4.755 -6.070
82 HB3 LEU 13 1HB LEU 13 -3.588 3.358 -6.305
83 HD11 LEU 13 1HD1 LEU 13 -3.058 6.257 -7.864
84 HD12 LEU 13 2HD1 LEU 13 -3.479 7.048 -6.345
85 HD13 LEU 13 3HD1 LEU 13 -4.589 7.119 -7.713
86 HD21 LEU 13 3HD2 LEU 13 -5.817 5.011 -8.409
87 HD22 LEU 13 1HD2 LEU 13 -5.466 3.501 -7.568
88 HD23 LEU 13 2HD2 LEU 13 -4.235 4.251 -8.585
89 H TYR 14 H TYR 14 -5.511 6.279 -4.526
90 HA TYR 14 HA TYR 14 -4.058 8.589 -4.272
91 HD1 TYR 14 HD2 TYR 14 -5.698 10.535 -1.633
92 HD2 TYR 14 HD1 TYR 14 -6.379 9.858 -5.823
93 HE1 TYR 14 HE2 TYR 14 -5.692 12.985 -2.032
94 HE2 TYR 14 HE1 TYR 14 -6.373 12.307 -6.220
95 HH TYR 14 HH TYR 14 -6.439 14.328 -5.227
96 HB2 TYR 14 2HB TYR 14 -6.671 8.069 -4.204
97 HB3 TYR 14 1HB TYR 14 -6.430 8.334 -2.483
98 H GLN 15 H GLN 15 -5.425 7.020 -1.390
99 HA GLN 15 HA GLN 15 -3.537 8.345 0.378
100 HB2 GLN 15 2HB GLN 15 -4.596 7.139 2.133
101 HB3 GLN 15 1HB GLN 15 -5.865 7.507 0.974
102 HG2 GLN 15 2HG GLN 15 -5.698 5.264 0.018
103 HG3 GLN 15 1HG GLN 15 -4.357 4.885 1.100
104 HE21 GLN 15 1HE2 GLN 15 -7.849 5.715 1.108
105 HE22 GLN 15 2HE2 GLN 15 -8.174 4.988 2.607
106 H LEU 16 H LEU 16 -3.898 5.164 -1.015
107 HA LEU 16 HA LEU 16 -1.940 3.625 0.185
108 HG LEU 16 HG LEU 16 -2.067 1.325 -2.571
109 HB2 LEU 16 2HB LEU 16 -3.419 3.290 -2.015
110 HB3 LEU 16 1HB LEU 16 -1.919 3.778 -2.803
111 HD11 LEU 16 1HD1 LEU 16 0.023 2.305 -0.640
112 HD12 LEU 16 2HD1 LEU 16 0.109 2.725 -2.352
113 HD13 LEU 16 3HD1 LEU 16 0.154 1.035 -1.853
114 HD21 LEU 16 3HD2 LEU 16 -3.034 2.044 0.001
115 HD22 LEU 16 1HD2 LEU 16 -1.545 1.128 0.234
116 HD23 LEU 16 2HD2 LEU 16 -2.877 0.427 -0.687
117 H GLU 17 H GLU 17 -1.548 6.464 -1.801
118 HA GLU 17 HA GLU 17 1.271 6.038 -2.322
119 HB2 GLU 17 2HB GLU 17 0.180 7.375 -3.910
120 HB3 GLU 17 1HB GLU 17 -0.631 8.337 -2.678
121 HG2 GLU 17 2HG GLU 17 2.284 8.437 -2.442
122 HG3 GLU 17 1HG GLU 17 1.715 9.025 -4.003
123 H ASN 18 H ASN 18 -0.542 7.484 0.277
124 HA ASN 18 HA ASN 18 1.754 8.950 1.336
125 HB2 ASN 18 2HB ASN 18 -0.997 9.008 1.801
126 HB3 ASN 18 1HB ASN 18 -0.327 8.335 3.287
127 HD21 ASN 18 1HD2 ASN 18 1.846 9.624 3.957
128 HD22 ASN 18 2HD2 ASN 18 1.699 11.314 3.906
129 H TYR 19 H TYR 19 0.895 5.702 1.242
130 HA TYR 19 HA TYR 19 2.169 5.060 3.841
131 HD1 TYR 19 HD2 TYR 19 0.764 4.909 5.081
132 HD2 TYR 19 HD1 TYR 19 -1.412 2.892 1.977
133 HE1 TYR 19 HE2 TYR 19 -1.361 5.438 6.229
134 HE2 TYR 19 HE1 TYR 19 -3.539 3.417 3.120
135 HH TYR 19 HH TYR 19 -3.707 5.646 5.759
136 HB2 TYR 19 2HB TYR 19 0.899 3.291 1.730
137 HB3 TYR 19 1HB TYR 19 1.576 2.708 3.250
138 H CYS 20 H CYS 20 3.283 5.874 0.879
139 HA CYS 20 HA CYS 20 5.075 3.759 0.216
140 HB2 CYS 20 2HB CYS 20 6.060 5.226 -1.274
141 HB3 CYS 20 1HB CYS 20 4.497 5.953 -1.112
142 H ASN 21 H ASN 21 7.585 5.047 0.228
143 HA ASN 21 HA ASN 21 8.746 4.137 2.581
144 HB2 ASN 21 2HB ASN 21 10.691 5.075 1.796
145 HB3 ASN 21 1HB ASN 21 9.730 5.210 0.330
146 HD21 ASN 21 1HD2 ASN 21 11.925 6.982 1.821
147 HD22 ASN 21 2HD2 ASN 21 11.280 8.544 1.667
148 HA PHE 1 HA PHE 1 -11.361 3.723 -13.641
149 HD1 PHE 1 HD2 PHE 1 -10.557 6.942 -12.757
150 HD2 PHE 1 HD1 PHE 1 -8.063 4.159 -10.635
151 HE1 PHE 1 HE2 PHE 1 -10.338 8.562 -10.892
152 HE2 PHE 1 HE1 PHE 1 -7.843 5.780 -8.769
153 HZ PHE 1 HZ PHE 1 -8.981 7.981 -8.897
154 H1 PHE 1 1H PHE 1 -11.792 4.990 -11.654
155 H2 PHE 1 2H PHE 1 -10.844 3.931 -10.724
156 H3 PHE 1 3H PHE 1 -12.293 3.386 -11.425
157 HB2 PHE 1 2HB PHE 1 -8.591 3.816 -12.972
158 HB3 PHE 1 1HB PHE 1 -9.523 4.997 -13.888
159 H VAL 2 H VAL 2 -9.239 2.478 -11.029
160 HA VAL 2 HA VAL 2 -9.877 -0.276 -11.894
161 HB VAL 2 HB VAL 2 -7.110 0.946 -12.022
162 HG11 VAL 2 1HG1 VAL 2 -6.347 -1.420 -12.459
163 HG12 VAL 2 2HG1 VAL 2 -7.933 -1.970 -11.914
164 HG13 VAL 2 3HG1 VAL 2 -6.861 -1.124 -10.798
165 HG21 VAL 2 3HG2 VAL 2 -7.149 -0.047 -14.287
166 HG22 VAL 2 1HG2 VAL 2 -8.497 1.067 -14.061
167 HG23 VAL 2 2HG2 VAL 2 -8.770 -0.674 -13.982
168 H ASN 3 H ASN 3 -10.665 -0.840 -9.876
169 HA ASN 3 HA ASN 3 -9.862 0.012 -7.356
170 HB2 ASN 3 2HB ASN 3 -10.728 -2.759 -8.228
171 HB3 ASN 3 1HB ASN 3 -10.589 -2.263 -6.541
172 HD21 ASN 3 1HD2 ASN 3 -12.946 -2.506 -6.261
173 HD22 ASN 3 2HD2 ASN 3 -14.015 -1.354 -6.901
174 H GLN 4 H GLN 4 -8.405 -0.988 -5.746
175 HA GLN 4 HA GLN 4 -6.185 -2.562 -6.955
176 HB2 GLN 4 2HB GLN 4 -5.306 -0.351 -6.966
177 HB3 GLN 4 1HB GLN 4 -5.987 0.010 -5.380
178 HG2 GLN 4 2HG GLN 4 -3.621 -0.391 -5.100
179 HG3 GLN 4 1HG GLN 4 -4.488 -1.764 -4.413
180 HE21 GLN 4 1HE2 GLN 4 -1.704 -1.580 -5.694
181 HE22 GLN 4 2HE2 GLN 4 -1.713 -2.787 -6.887
182 H HIS 5 H HIS 5 -5.912 -4.376 -5.774
183 HA HIS 5 HA HIS 5 -6.864 -4.412 -2.956
184 HD2 HIS 5 HD2 HIS 5 -9.663 -6.797 -4.417
185 HE1 HIS 5 HE1 HIS 5 -8.413 -5.552 -8.259
186 HE2 HIS 5 HE2 HIS 5 -10.396 -6.338 -6.864
187 HB2 HIS 5 2HB HIS 5 -5.847 -6.857 -4.356
188 HB3 HIS 5 1HB HIS 5 -7.145 -6.705 -3.176
189 H LEU 6 H LEU 6 -5.390 -4.319 -1.336
190 HA LEU 6 HA LEU 6 -2.544 -4.948 -1.999
191 HG LEU 6 HG LEU 6 -2.547 -1.832 -2.257
192 HB2 LEU 6 2HB LEU 6 -3.827 -2.713 -0.546
193 HB3 LEU 6 1HB LEU 6 -2.452 -3.404 0.287
194 HD11 LEU 6 1HD1 LEU 6 -1.446 -1.596 0.308
195 HD12 LEU 6 2HD1 LEU 6 -1.129 -0.550 -1.076
196 HD13 LEU 6 3HD1 LEU 6 -0.069 -1.918 -0.746
197 HD21 LEU 6 3HD2 LEU 6 -0.128 -2.875 -2.621
198 HD22 LEU 6 1HD2 LEU 6 -1.544 -3.659 -3.319
199 HD23 LEU 6 2HD2 LEU 6 -0.841 -4.274 -1.824
200 H CYS 7 H CYS 7 -1.445 -6.349 -0.657
201 HA CYS 7 HA CYS 7 -2.236 -7.003 2.011
202 HB2 CYS 7 2HB CYS 7 -4.207 -7.976 0.862
203 HB3 CYS 7 1HB CYS 7 -3.139 -8.976 -0.118
204 H GLY 8 H GLY 8 -0.286 -7.647 2.804
205 HA2 GLY 8 2HA GLY 8 1.838 -8.636 2.921
206 HA3 GLY 8 1HA GLY 8 1.134 -9.929 1.954
207 H SER 9 H SER 9 2.608 -10.313 0.374
208 HA SER 9 HA SER 9 4.545 -8.716 -0.732
209 HG SER 9 HG SER 9 4.524 -11.810 -1.066
210 HB2 SER 9 2HB SER 9 2.937 -10.294 -2.689
211 HB3 SER 9 1HB SER 9 4.682 -10.239 -2.458
212 H ASP 10 H ASP 10 1.185 -8.884 -1.978
213 HA ASP 10 HA ASP 10 1.470 -6.882 -3.960
214 HB2 ASP 10 2HB ASP 10 -0.976 -7.469 -2.267
215 HB3 ASP 10 1HB ASP 10 -0.959 -6.687 -3.844
216 H LEU 11 H LEU 11 0.859 -6.673 -0.500
217 HA LEU 11 HA LEU 11 0.118 -3.980 -0.239
218 HG LEU 11 HG LEU 11 1.889 -3.424 2.645
219 HB2 LEU 11 2HB LEU 11 0.303 -5.709 1.603
220 HB3 LEU 11 1HB LEU 11 2.044 -5.453 1.584
221 HD11 LEU 11 1HD1 LEU 11 0.757 -2.246 0.865
222 HD12 LEU 11 2HD1 LEU 11 -0.081 -1.892 2.373
223 HD13 LEU 11 3HD1 LEU 11 -0.765 -3.054 1.237
224 HD21 LEU 11 3HD2 LEU 11 -0.904 -4.377 3.296
225 HD22 LEU 11 1HD2 LEU 11 0.194 -3.464 4.330
226 HD23 LEU 11 2HD2 LEU 11 0.541 -5.151 3.947
227 H VAL 12 H VAL 12 3.457 -5.280 -0.128
228 HA VAL 12 HA VAL 12 4.682 -2.689 -0.137
229 HB VAL 12 HB VAL 12 6.736 -3.939 -0.830
230 HG11 VAL 12 1HG1 VAL 12 5.338 -5.522 1.315
231 HG12 VAL 12 2HG1 VAL 12 5.696 -3.814 1.573
232 HG13 VAL 12 3HG1 VAL 12 7.008 -4.953 1.268
233 HG21 VAL 12 3HG2 VAL 12 5.375 -5.599 -2.218
234 HG22 VAL 12 1HG2 VAL 12 4.959 -6.382 -0.694
235 HG23 VAL 12 2HG2 VAL 12 6.643 -6.300 -1.211
236 H GLU 13 H GLU 13 3.557 -4.830 -2.698
237 HA GLU 13 HA GLU 13 4.878 -3.698 -4.918
238 HB2 GLU 13 2HB GLU 13 3.262 -5.694 -4.883
239 HB3 GLU 13 1HB GLU 13 1.960 -4.505 -4.960
240 HG2 GLU 13 2HG GLU 13 3.729 -3.662 -6.933
241 HG3 GLU 13 1HG GLU 13 3.759 -5.420 -7.073
242 H ALA 14 H ALA 14 1.725 -2.738 -3.520
243 HA ALA 14 HA ALA 14 1.358 -0.438 -5.174
244 HB1 ALA 14 3HB ALA 14 -0.290 0.258 -3.513
245 HB2 ALA 14 1HB ALA 14 0.383 -0.877 -2.346
246 HB3 ALA 14 2HB ALA 14 -0.432 -1.478 -3.790
247 H LEU 15 H LEU 15 2.657 -0.742 -1.880
248 HA LEU 15 HA LEU 15 3.359 1.992 -1.516
249 HG LEU 15 HG LEU 15 2.460 -0.424 0.597
250 HB2 LEU 15 2HB LEU 15 4.555 -0.541 -0.381
251 HB3 LEU 15 1HB LEU 15 5.013 1.069 0.153
252 HD11 LEU 15 1HD1 LEU 15 2.775 0.947 2.775
253 HD12 LEU 15 2HD1 LEU 15 4.374 1.310 2.130
254 HD13 LEU 15 3HD1 LEU 15 3.911 -0.362 2.443
255 HD21 LEU 15 3HD2 LEU 15 1.215 1.608 1.055
256 HD22 LEU 15 1HD2 LEU 15 1.808 1.716 -0.600
257 HD23 LEU 15 2HD2 LEU 15 2.616 2.612 0.686
258 H TYR 16 H TYR 16 4.928 -0.651 -3.177
259 HA TYR 16 HA TYR 16 7.547 0.492 -3.377
260 HD1 TYR 16 HD2 TYR 16 9.605 -0.500 -4.890
261 HD2 TYR 16 HD1 TYR 16 7.012 -3.226 -2.812
262 HE1 TYR 16 HE2 TYR 16 11.573 -1.526 -3.781
263 HE2 TYR 16 HE1 TYR 16 8.981 -4.252 -1.703
264 HH TYR 16 HH TYR 16 11.286 -4.444 -1.863
265 HB2 TYR 16 2HB TYR 16 6.119 -1.805 -4.458
266 HB3 TYR 16 1HB TYR 16 7.182 -1.077 -5.660
267 H LEU 17 H LEU 17 5.009 0.281 -5.918
268 HA LEU 17 HA LEU 17 6.354 2.023 -7.703
269 HG LEU 17 HG LEU 17 3.374 1.021 -6.160
270 HB2 LEU 17 2HB LEU 17 4.018 2.438 -8.663
271 HB3 LEU 17 1HB LEU 17 4.579 0.768 -8.625
272 HD11 LEU 17 1HD1 LEU 17 1.317 2.196 -7.955
273 HD12 LEU 17 2HD1 LEU 17 2.554 3.298 -7.349
274 HD13 LEU 17 3HD1 LEU 17 1.544 2.397 -6.218
275 HD21 LEU 17 3HD2 LEU 17 1.351 -0.005 -7.600
276 HD22 LEU 17 1HD2 LEU 17 2.832 -0.913 -7.297
277 HD23 LEU 17 2HD2 LEU 17 2.612 -0.071 -8.831
278 H VAL 18 H VAL 18 3.961 2.836 -5.149
279 HA VAL 18 HA VAL 18 3.651 5.543 -5.808
280 HB VAL 18 HB VAL 18 3.401 5.939 -3.279
281 HG11 VAL 18 1HG1 VAL 18 1.423 5.699 -4.500
282 HG12 VAL 18 2HG1 VAL 18 1.306 4.385 -3.328
283 HG13 VAL 18 3HG1 VAL 18 1.810 4.048 -4.985
284 HG21 VAL 18 3HG2 VAL 18 4.208 3.093 -3.403
285 HG22 VAL 18 1HG2 VAL 18 2.838 3.468 -2.368
286 HG23 VAL 18 2HG2 VAL 18 4.389 4.252 -2.090
287 H CYS 19 H CYS 19 5.838 4.765 -3.056
288 HA CYS 19 HA CYS 19 7.327 7.161 -3.763
289 HB2 CYS 19 2HB CYS 19 7.575 5.195 -1.592
290 HB3 CYS 19 1HB CYS 19 9.103 5.837 -2.159
291 H GLY 20 H GLY 20 7.618 3.768 -4.474
292 HA2 GLY 20 2HA GLY 20 8.816 2.997 -6.448
293 HA3 GLY 20 1HA GLY 20 9.886 4.395 -6.301
294 H GLU 21 H GLU 21 11.536 2.511 -6.463
295 HA GLU 21 HA GLU 21 11.851 0.668 -4.313
296 HB2 GLU 21 2HB GLU 21 13.847 0.091 -5.310
297 HB3 GLU 21 1HB GLU 21 13.133 0.974 -6.655
298 HG2 GLU 21 2HG GLU 21 15.283 1.914 -6.497
299 HG3 GLU 21 1HG GLU 21 14.295 3.060 -5.589
300 H ARG 22 H ARG 22 12.210 4.055 -4.406
301 HA ARG 22 HA ARG 22 14.259 4.683 -2.662
302 HE ARG 22 HE ARG 22 14.558 9.575 -3.968
303 HB2 ARG 22 2HB ARG 22 11.783 5.909 -3.479
304 HB3 ARG 22 1HB ARG 22 12.056 6.207 -1.762
305 HG2 ARG 22 2HG ARG 22 14.210 7.169 -2.181
306 HG3 ARG 22 1HG ARG 22 14.194 6.629 -3.860
307 HD2 ARG 22 2HD ARG 22 12.596 8.227 -4.493
308 HD3 ARG 22 1HD ARG 22 12.037 8.461 -2.836
309 HH11 ARG 22 1HH2 ARG 22 14.694 8.970 -1.015
310 HH12 ARG 22 2HH2 ARG 22 14.172 10.470 -0.324
311 HH21 ARG 22 1HH1 ARG 22 12.808 11.663 -3.281
312 HH22 ARG 22 2HH1 ARG 22 13.110 11.997 -1.608
313 H GLY 23 H GLY 23 11.314 2.982 -1.907
314 HA2 GLY 23 2HA GLY 23 11.856 1.548 0.233
315 HA3 GLY 23 1HA GLY 23 11.945 3.133 1.000
316 H PHE 24 H PHE 24 10.103 1.478 2.044
317 HA PHE 24 HA PHE 24 7.580 2.835 1.397
318 HD1 PHE 24 HD2 PHE 24 9.559 0.600 -0.818
319 HD2 PHE 24 HD1 PHE 24 7.384 -1.588 2.173
320 HE1 PHE 24 HE2 PHE 24 11.151 -1.290 -1.043
321 HE2 PHE 24 HE1 PHE 24 8.975 -3.478 1.949
322 HZ PHE 24 HZ PHE 24 10.859 -3.330 0.341
323 HB2 PHE 24 2HB PHE 24 6.491 0.423 1.304
324 HB3 PHE 24 1HB PHE 24 7.157 1.156 -0.155
325 H PHE 25 H PHE 25 5.828 1.990 2.985
326 HA PHE 25 HA PHE 25 7.149 1.595 5.615
327 HD1 PHE 25 HD2 PHE 25 6.682 2.249 7.788
328 HD2 PHE 25 HD1 PHE 25 5.177 5.190 5.035
329 HE1 PHE 25 HE2 PHE 25 7.765 4.044 9.111
330 HE2 PHE 25 HE1 PHE 25 6.262 6.982 6.360
331 HZ PHE 25 HZ PHE 25 7.554 6.410 8.398
332 HB2 PHE 25 2HB PHE 25 4.708 2.939 4.656
333 HB3 PHE 25 1HB PHE 25 4.465 2.000 6.126
334 H TYR 26 H TYR 26 3.932 0.532 4.425
335 HA TYR 26 HA TYR 26 2.840 -1.524 4.785
336 HD1 TYR 26 HD1 TYR 26 2.273 -3.559 5.047
337 HD2 TYR 26 HD2 TYR 26 6.267 -4.705 3.938
338 HE1 TYR 26 HE1 TYR 26 1.771 -5.907 5.659
339 HE2 TYR 26 HE2 TYR 26 5.760 -7.051 4.549
340 HH TYR 26 HH TYR 26 4.280 -8.379 5.687
341 HB2 TYR 26 2HB TYR 26 4.300 -2.356 3.068
342 HB3 TYR 26 1HB TYR 26 5.680 -2.374 4.155
343 H THR 27 H THR 27 3.325 -0.201 7.118
344 HA THR 27 HA THR 27 4.785 -1.931 8.989
345 HB THR 27 HB THR 27 4.918 0.395 9.468
346 HG1 THR 27 HG1 THR 27 3.731 0.523 11.463
347 HG21 THR 27 3HG2 THR 27 2.413 1.401 9.967
348 HG22 THR 27 1HG2 THR 27 2.105 0.335 8.596
349 HG23 THR 27 2HG2 THR 27 3.299 1.626 8.459
350 H LYS 28 H LYS 28 3.746 -2.929 10.854
351 HA LYS 28 HA LYS 28 0.917 -3.723 10.288
352 HB2 LYS 28 2HB LYS 28 2.858 -5.264 12.019
353 HB3 LYS 28 1HB LYS 28 1.379 -5.844 11.252
354 HG2 LYS 28 2HG LYS 28 2.660 -6.564 9.545
355 HG3 LYS 28 1HG LYS 28 2.925 -4.868 9.136
356 HD2 LYS 28 2HD LYS 28 4.802 -4.928 10.909
357 HD3 LYS 28 1HD LYS 28 4.665 -6.685 10.805
358 HE2 LYS 28 2HE LYS 28 5.807 -6.719 8.865
359 HE3 LYS 28 1HE LYS 28 4.724 -5.523 8.155
360 HZ1 LYS 28 3HZ LYS 28 6.095 -3.945 9.734
361 HZ2 LYS 28 1HZ LYS 28 6.637 -4.332 8.174
362 HZ3 LYS 28 2HZ LYS 28 7.278 -5.144 9.523
363 HA PRO 29 HA PRO 29 -0.224 -1.976 14.136
364 HB2 PRO 29 2HB PRO 29 -2.375 -3.570 14.756
365 HB3 PRO 29 1HB PRO 29 -2.415 -2.304 13.517
366 HG2 PRO 29 2HG PRO 29 -2.282 -5.264 13.173
367 HG3 PRO 29 1HG PRO 29 -2.944 -4.036 12.081
368 HD2 PRO 29 2HD PRO 29 -0.435 -5.303 11.809
369 HD3 PRO 29 1HD PRO 29 -0.962 -3.845 10.947
370 H THR 30 H THR 30 0.785 -5.260 13.924
371 HA THR 30 HA THR 30 0.438 -6.203 16.560
372 HB THR 30 HB THR 30 1.403 -7.469 14.562
373 HG1 THR 30 HG1 THR 30 3.009 -7.666 16.873
374 HG21 THR 30 3HG2 THR 30 3.645 -7.221 13.968
375 HG22 THR 30 1HG2 THR 30 4.073 -6.474 15.508
376 HG23 THR 30 2HG2 THR 30 3.178 -5.553 14.300