Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
578307 | 2mlv RC | 19833 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H MET 1 1.808 -0.000 0.855
2 HA MET 1 HA MET 1 1.423 -0.276 -2.043
3 HB2 MET 1 2HB MET 1 3.378 1.326 -2.320
4 HB3 MET 1 3HB MET 1 1.846 2.039 -1.835
5 HG2 MET 1 2HG MET 1 3.621 1.250 0.369
6 HG3 MET 1 3HG MET 1 4.211 2.558 -0.654
7 HE1 MET 1 3HE MET 1 2.342 5.445 -0.208
8 HE2 MET 1 1HE MET 1 3.509 5.144 1.080
9 HE3 MET 1 2HE MET 1 3.839 4.580 -0.558
10 H LYS 2 H LYS 2 1.945 -2.518 -1.480
11 HA LYS 2 HA LYS 2 4.739 -2.996 -0.756
12 HB2 LYS 2 2HB LYS 2 2.253 -4.442 -0.432
13 HB3 LYS 2 3HB LYS 2 3.471 -5.455 -1.195
14 HG2 LYS 2 2HG LYS 2 4.949 -4.427 0.780
15 HG3 LYS 2 3HG LYS 2 3.358 -4.353 1.541
16 HD2 LYS 2 2HD LYS 2 3.643 -6.498 2.079
17 HD3 LYS 2 3HD LYS 2 3.435 -6.865 0.365
18 HE2 LYS 2 2HE LYS 2 5.913 -6.486 0.104
19 HE3 LYS 2 3HE LYS 2 6.011 -6.428 1.863
20 HZ1 LYS 2 3HZ LYS 2 4.700 -8.726 0.593
21 HZ2 LYS 2 1HZ LYS 2 5.546 -8.644 2.055
22 HZ3 LYS 2 2HZ LYS 2 6.390 -8.651 0.589
23 H THR 3 H THR 3 2.412 -3.839 -3.306
24 HA THR 3 HA THR 3 4.657 -4.641 -5.025
25 HB THR 3 HB THR 3 2.808 -6.283 -4.721
26 HG1 THR 3 HG1 THR 3 3.583 -6.806 -6.619
27 HG21 THR 3 1HG2 THR 3 1.180 -4.036 -5.128
28 HG22 THR 3 2HG2 THR 3 0.664 -5.711 -4.932
29 HG23 THR 3 3HG2 THR 3 0.949 -5.058 -6.545
30 H ILE 4 H ILE 4 4.082 -1.869 -4.504
31 HA ILE 4 HA ILE 4 2.628 -0.732 -6.670
32 HB ILE 4 HB ILE 4 3.102 0.419 -4.486
33 HG12 ILE 4 2HG1 ILE 4 3.978 1.954 -6.940
34 HG13 ILE 4 3HG1 ILE 4 2.302 1.587 -6.548
35 HG21 ILE 4 1HG2 ILE 4 5.791 1.032 -5.690
36 HG22 ILE 4 2HG2 ILE 4 5.199 1.450 -4.083
37 HG23 ILE 4 3HG2 ILE 4 5.535 -0.233 -4.487
38 HD11 ILE 4 3HD1 ILE 4 3.421 2.785 -4.265
39 HD12 ILE 4 1HD1 ILE 4 3.930 3.746 -5.653
40 HD13 ILE 4 2HD1 ILE 4 2.215 3.449 -5.367
41 H LEU 5 H LEU 5 5.650 -2.201 -6.502
42 HA LEU 5 HA LEU 5 7.292 -0.723 -8.153
43 HB2 LEU 5 2HB LEU 5 8.538 -2.666 -8.500
44 HB3 LEU 5 3HB LEU 5 7.783 -2.893 -6.924
45 HG LEU 5 HG LEU 5 5.975 -4.159 -8.415
46 HD11 LEU 5 1HD1 LEU 5 6.625 -4.835 -10.438
47 HD12 LEU 5 2HD1 LEU 5 8.253 -5.225 -9.882
48 HD13 LEU 5 3HD1 LEU 5 7.849 -3.569 -10.334
49 HD21 LEU 5 3HD2 LEU 5 7.087 -5.158 -6.540
50 HD22 LEU 5 1HD2 LEU 5 8.603 -5.263 -7.435
51 HD23 LEU 5 2HD2 LEU 5 7.225 -6.253 -7.917
52 H ARG 6 H ARG 6 4.600 -2.811 -9.006
53 HA ARG 6 HA ARG 6 5.102 -2.784 -11.815
54 HB2 ARG 6 2HB ARG 6 3.006 -3.893 -12.046
55 HB3 ARG 6 3HB ARG 6 3.754 -4.519 -10.582
56 HG2 ARG 6 2HG ARG 6 1.682 -4.175 -9.761
57 HG3 ARG 6 3HG ARG 6 2.319 -2.550 -9.501
58 HD2 ARG 6 2HD ARG 6 0.488 -1.903 -10.633
59 HD3 ARG 6 3HD ARG 6 1.431 -2.354 -12.053
60 HE ARG 6 HE ARG 6 0.206 -4.665 -11.363
61 HH11 ARG 6 1HH1 ARG 6 -0.937 -1.427 -11.937
62 HH12 ARG 6 2HH1 ARG 6 -2.489 -1.937 -12.515
63 HH21 ARG 6 1HH2 ARG 6 -1.833 -5.349 -12.122
64 HH22 ARG 6 2HH2 ARG 6 -2.998 -4.169 -12.619
65 H PHE 7 H PHE 7 3.292 -0.771 -9.599
66 HA PHE 7 HA PHE 7 1.884 0.668 -11.638
67 HB2 PHE 7 2HB PHE 7 0.880 0.559 -9.463
68 HB3 PHE 7 3HB PHE 7 2.329 1.205 -8.700
69 HD1 PHE 7 HD1 PHE 7 0.054 2.212 -11.486
70 HD2 PHE 7 HD2 PHE 7 2.129 3.353 -7.949
71 HE1 PHE 7 HE1 PHE 7 -0.861 4.488 -11.687
72 HE2 PHE 7 HE2 PHE 7 1.217 5.630 -8.144
73 HZ PHE 7 HZ PHE 7 -0.280 6.200 -10.014
74 H VAL 8 H VAL 8 4.600 1.473 -9.479
75 HA VAL 8 HA VAL 8 5.127 4.003 -10.603
76 HB VAL 8 HB VAL 8 7.011 2.149 -9.139
77 HG11 VAL 8 1HG1 VAL 8 7.232 5.104 -9.704
78 HG12 VAL 8 2HG1 VAL 8 8.326 4.167 -8.683
79 HG13 VAL 8 3HG1 VAL 8 8.226 3.831 -10.412
80 HG21 VAL 8 3HG2 VAL 8 6.240 4.335 -7.547
81 HG22 VAL 8 1HG2 VAL 8 4.763 3.696 -8.268
82 HG23 VAL 8 2HG2 VAL 8 5.816 2.637 -7.330
83 H ALA 9 H ALA 9 6.181 0.770 -11.444
84 HA ALA 9 HA ALA 9 8.365 1.279 -13.050
85 HB1 ALA 9 3HB ALA 9 7.611 -0.770 -14.341
86 HB2 ALA 9 1HB ALA 9 7.831 -0.970 -12.603
87 HB3 ALA 9 2HB ALA 9 6.208 -0.802 -13.273
88 H GLY 10 H GLY 10 4.935 1.235 -14.020
89 HA2 GLY 10 2HA GLY 10 5.478 2.016 -16.712
90 HA3 GLY 10 3HA GLY 10 3.903 2.003 -15.931
91 H TYR 11 H TYR 11 4.888 3.761 -13.751
92 HA TYR 11 HA TYR 11 4.234 6.249 -14.987
93 HB2 TYR 11 2HB TYR 11 3.713 5.492 -12.587
94 HB3 TYR 11 3HB TYR 11 5.373 5.943 -12.215
95 HD1 TYR 11 HD1 TYR 11 6.055 8.376 -12.967
96 HD2 TYR 11 HD2 TYR 11 2.050 7.081 -12.342
97 HE1 TYR 11 HE1 TYR 11 5.354 10.713 -12.651
98 HE2 TYR 11 HE2 TYR 11 1.339 9.414 -12.025
99 HH TYR 11 HH TYR 11 1.951 11.564 -12.187
100 H ASP 12 H ASP 12 7.196 4.707 -13.924
101 HA ASP 12 HA ASP 12 8.881 6.964 -14.019
102 HB2 ASP 12 2HB ASP 12 9.312 4.587 -13.053
103 HB3 ASP 12 3HB ASP 12 9.845 4.199 -14.686
104 H ILE 13 H ILE 13 7.666 4.820 -16.486
105 HA ILE 13 HA ILE 13 9.480 5.869 -18.501
106 HB ILE 13 HB ILE 13 7.192 3.916 -18.780
107 HG12 ILE 13 2HG1 ILE 13 9.863 2.878 -19.220
108 HG13 ILE 13 3HG1 ILE 13 9.709 3.565 -17.607
109 HG21 ILE 13 1HG2 ILE 13 9.360 4.691 -20.727
110 HG22 ILE 13 2HG2 ILE 13 8.187 3.397 -20.964
111 HG23 ILE 13 3HG2 ILE 13 7.644 5.072 -20.866
112 HD11 ILE 13 3HD1 ILE 13 8.607 1.114 -18.711
113 HD12 ILE 13 1HD1 ILE 13 8.891 1.580 -17.034
114 HD13 ILE 13 2HD1 ILE 13 7.415 2.091 -17.854
115 H ALA 14 H ALA 14 5.999 5.886 -17.801
116 HA ALA 14 HA ALA 14 5.214 7.437 -20.011
117 HB1 ALA 14 3HB ALA 14 3.954 6.989 -17.318
118 HB2 ALA 14 1HB ALA 14 3.191 7.952 -18.583
119 HB3 ALA 14 2HB ALA 14 3.532 6.244 -18.860
120 H SER 15 H SER 15 6.312 8.322 -16.780
121 HA SER 15 HA SER 15 5.735 11.100 -17.043
122 HB2 SER 15 2HB SER 15 5.946 10.053 -14.840
123 HB3 SER 15 3HB SER 15 7.635 9.669 -15.169
124 HG SER 15 HG SER 15 7.735 11.535 -14.064
125 H HIS 16 H HIS 16 8.404 9.062 -17.932
126 HA HIS 16 HA HIS 16 10.222 11.270 -18.368
127 HB2 HIS 16 2HB HIS 16 11.081 9.089 -17.626
128 HB3 HIS 16 3HB HIS 16 10.477 8.345 -19.104
129 HD1 HIS 16 HD1 HIS 16 12.821 7.630 -19.870
130 HD2 HIS 16 HD2 HIS 16 12.413 11.728 -19.321
131 HE1 HIS 16 HE1 HIS 16 14.868 8.655 -20.911
132 H LYS 17 H LYS 17 8.022 9.300 -20.225
133 HA LYS 17 HA LYS 17 9.018 10.138 -22.785
134 HB2 LYS 17 2HB LYS 17 7.299 8.133 -21.855
135 HB3 LYS 17 3HB LYS 17 6.283 9.187 -22.829
136 HG2 LYS 17 2HG LYS 17 7.319 8.632 -24.762
137 HG3 LYS 17 3HG LYS 17 8.890 8.414 -23.988
138 HD2 LYS 17 2HD LYS 17 7.243 6.421 -22.918
139 HD3 LYS 17 3HD LYS 17 6.883 6.453 -24.646
140 HE2 LYS 17 2HE LYS 17 9.738 6.594 -23.924
141 HE3 LYS 17 3HE LYS 17 8.929 5.072 -23.552
142 HZ1 LYS 17 3HZ LYS 17 8.907 6.383 -26.216
143 HZ2 LYS 17 1HZ LYS 17 8.260 4.867 -25.833
144 HZ3 LYS 17 2HZ LYS 17 9.933 5.111 -25.779
145 H LYS 18 H LYS 18 5.949 10.742 -21.066
146 HA LYS 18 HA LYS 18 5.303 12.942 -22.809
147 HB2 LYS 18 2HB LYS 18 3.985 11.597 -20.488
148 HB3 LYS 18 3HB LYS 18 3.446 13.206 -20.951
149 HG2 LYS 18 2HG LYS 18 3.579 10.874 -22.847
150 HG3 LYS 18 3HG LYS 18 2.134 11.337 -21.945
151 HD2 LYS 18 2HD LYS 18 2.520 13.672 -22.994
152 HD3 LYS 18 3HD LYS 18 3.545 12.807 -24.142
153 HE2 LYS 18 2HE LYS 18 1.568 11.266 -24.524
154 HE3 LYS 18 3HE LYS 18 0.604 12.437 -23.627
155 HZ1 LYS 18 3HZ LYS 18 2.053 13.844 -25.542
156 HZ2 LYS 18 1HZ LYS 18 0.382 13.586 -25.488
157 HZ3 LYS 18 2HZ LYS 18 1.377 12.508 -26.329
158 H LYS 19 H LYS 19 6.014 12.620 -19.332
159 HA LYS 19 HA LYS 19 6.776 14.109 -17.789
160 HB2 LYS 19 2HB LYS 19 8.671 14.064 -19.504
161 HB3 LYS 19 3HB LYS 19 8.034 15.595 -20.090
162 HG2 LYS 19 2HG LYS 19 8.241 16.336 -17.613
163 HG3 LYS 19 3HG LYS 19 9.344 14.965 -17.482
164 HD2 LYS 19 2HD LYS 19 10.086 16.313 -19.822
165 HD3 LYS 19 3HD LYS 19 9.792 17.572 -18.621
166 HE2 LYS 19 2HE LYS 19 11.316 16.484 -17.076
167 HE3 LYS 19 3HE LYS 19 11.563 15.163 -18.217
168 HZ1 LYS 19 3HZ LYS 19 12.303 17.069 -19.784
169 HZ2 LYS 19 1HZ LYS 19 13.377 16.488 -18.613
170 HZ3 LYS 19 2HZ LYS 19 12.539 17.933 -18.349
171 H THR 20 H THR 20 4.745 14.951 -17.242
172 HA THR 20 HA THR 20 4.472 17.750 -17.549
173 HB THR 20 HB THR 20 3.619 17.366 -19.735
174 HG1 THR 20 HG1 THR 20 1.666 18.326 -19.490
175 HG21 THR 20 1HG2 THR 20 3.174 15.046 -19.779
176 HG22 THR 20 2HG2 THR 20 1.614 15.827 -20.041
177 HG23 THR 20 3HG2 THR 20 2.014 15.164 -18.457
178 H GLY 21 H GLY 21 2.840 18.630 -16.218
179 HA2 GLY 21 2HA GLY 21 1.413 18.687 -14.419
180 HA3 GLY 21 3HA GLY 21 0.847 17.103 -14.927
181 H GLY 22 H GLY 22 3.093 18.841 -12.893
182 HA2 GLY 22 2HA GLY 22 3.183 16.614 -11.060
183 HA3 GLY 22 3HA GLY 22 4.720 16.941 -11.847
184 H TYR 23 H TYR 23 2.427 17.996 -9.485
185 HA TYR 23 HA TYR 23 3.402 20.571 -8.962
186 HB2 TYR 23 2HB TYR 23 1.846 18.553 -7.405
187 HB3 TYR 23 3HB TYR 23 2.503 19.946 -6.553
188 HD1 TYR 23 HD1 TYR 23 2.159 22.174 -8.286
189 HD2 TYR 23 HD2 TYR 23 -0.415 18.827 -7.757
190 HE1 TYR 23 HE1 TYR 23 0.248 23.534 -9.028
191 HE2 TYR 23 HE2 TYR 23 -2.332 20.177 -8.499
192 HH TYR 23 HH TYR 23 -2.726 22.992 -8.456
193 HA PRO 24 HA PRO 24 7.209 20.047 -6.847
194 HB2 PRO 24 2HB PRO 24 7.049 21.921 -4.889
195 HB3 PRO 24 3HB PRO 24 7.272 22.329 -6.594
196 HG2 PRO 24 2HG PRO 24 4.768 22.349 -4.953
197 HG3 PRO 24 3HG PRO 24 5.339 23.539 -6.137
198 HD2 PRO 24 2HD PRO 24 3.455 21.687 -6.727
199 HD3 PRO 24 3HD PRO 24 4.610 22.292 -7.932
200 H TRP 25 H TRP 25 4.279 19.930 -4.919
201 HA TRP 25 HA TRP 25 5.693 18.508 -2.781
202 HB2 TRP 25 2HB TRP 25 3.470 18.744 -1.578
203 HB3 TRP 25 3HB TRP 25 4.324 20.247 -1.917
204 HD1 TRP 25 HD1 TRP 25 3.038 22.054 -3.249
205 HE1 TRP 25 HE1 TRP 25 0.736 22.167 -4.394
206 HE3 TRP 25 HE3 TRP 25 1.726 17.124 -2.921
207 HZ2 TRP 25 HZ2 TRP 25 -1.360 20.400 -5.067
208 HZ3 TRP 25 HZ3 TRP 25 -0.445 16.418 -3.839
209 HH2 TRP 25 HH2 TRP 25 -1.955 18.024 -4.889
210 H GLU 26 H GLU 26 3.662 17.976 -5.473
211 HA GLU 26 HA GLU 26 2.744 15.384 -4.482
212 HB2 GLU 26 2HB GLU 26 1.434 17.220 -5.948
213 HB3 GLU 26 3HB GLU 26 2.114 16.250 -7.247
214 HG2 GLU 26 2HG GLU 26 0.991 14.308 -6.518
215 HG3 GLU 26 3HG GLU 26 0.553 15.051 -4.981
216 H ARG 27 H ARG 27 5.448 15.422 -4.735
217 HA ARG 27 HA ARG 27 5.910 13.820 -7.166
218 HB2 ARG 27 2HB ARG 27 7.724 15.784 -5.776
219 HB3 ARG 27 3HB ARG 27 8.343 14.561 -6.877
220 HG2 ARG 27 2HG ARG 27 6.119 16.177 -7.917
221 HG3 ARG 27 3HG ARG 27 7.623 17.050 -7.617
222 HD2 ARG 27 2HD ARG 27 8.762 15.156 -8.906
223 HD3 ARG 27 3HD ARG 27 7.140 14.712 -9.438
224 HE ARG 27 HE ARG 27 7.160 16.503 -10.860
225 HH11 ARG 27 1HH1 ARG 27 9.681 16.906 -8.494
226 HH12 ARG 27 2HH1 ARG 27 10.366 18.296 -9.270
227 HH21 ARG 27 1HH2 ARG 27 8.052 18.332 -11.891
228 HH22 ARG 27 2HH2 ARG 27 9.438 19.106 -11.201
229 H GLY 28 H GLY 28 4.974 12.830 -4.643
230 HA2 GLY 28 2HA GLY 28 5.369 11.002 -3.305
231 HA3 GLY 28 3HA GLY 28 6.791 10.680 -4.286
232 H LYS 29 H LYS 29 5.827 13.281 -2.044
233 HA LYS 29 HA LYS 29 6.931 14.274 -0.319
234 HB2 LYS 29 2HB LYS 29 8.175 11.540 0.025
235 HB3 LYS 29 3HB LYS 29 8.085 12.805 1.245
236 HG2 LYS 29 2HG LYS 29 6.049 12.178 1.862
237 HG3 LYS 29 3HG LYS 29 5.471 12.167 0.194
238 HD2 LYS 29 2HD LYS 29 5.235 9.950 0.673
239 HD3 LYS 29 3HD LYS 29 6.908 9.937 0.111
240 HE2 LYS 29 2HE LYS 29 7.348 8.918 2.058
241 HE3 LYS 29 3HE LYS 29 7.207 10.530 2.758
242 HZ1 LYS 29 3HZ LYS 29 4.872 8.737 2.462
243 HZ2 LYS 29 1HZ LYS 29 5.020 10.113 3.435
244 HZ3 LYS 29 2HZ LYS 29 5.862 8.701 3.833
245 H ALA 30 H ALA 30 8.104 14.601 -2.854
246 HA ALA 30 HA ALA 30 10.014 15.308 -3.874
247 HB1 ALA 30 3HB ALA 30 11.700 15.867 -1.666
248 HB2 ALA 30 1HB ALA 30 10.769 16.995 -2.651
249 HB3 ALA 30 2HB ALA 30 10.049 16.283 -1.207
Start of MODEL 2
1 H1 MET 1 H MET 1 2.362 0.324 0.425
2 HA MET 1 HA MET 1 3.213 -0.001 -1.679
3 HB2 MET 1 2HB MET 1 5.900 0.577 -0.418
4 HB3 MET 1 3HB MET 1 5.592 0.418 -2.142
5 HG2 MET 1 2HG MET 1 5.417 2.642 -2.091
6 HG3 MET 1 3HG MET 1 3.796 2.329 -1.474
7 HE1 MET 1 3HE MET 1 5.824 5.397 0.407
8 HE2 MET 1 1HE MET 1 6.635 4.623 -0.954
9 HE3 MET 1 2HE MET 1 4.927 5.047 -1.072
10 H LYS 2 H LYS 2 2.507 -2.164 -1.417
11 HA LYS 2 HA LYS 2 4.468 -4.123 -0.508
12 HB2 LYS 2 2HB LYS 2 1.593 -3.997 -0.643
13 HB3 LYS 2 3HB LYS 2 2.170 -5.438 -1.471
14 HG2 LYS 2 2HG LYS 2 3.116 -6.320 0.452
15 HG3 LYS 2 3HG LYS 2 3.178 -4.753 1.260
16 HD2 LYS 2 2HD LYS 2 0.464 -5.410 0.590
17 HD3 LYS 2 3HD LYS 2 1.199 -6.733 1.496
18 HE2 LYS 2 2HE LYS 2 0.385 -5.400 3.192
19 HE3 LYS 2 3HE LYS 2 2.046 -4.826 3.055
20 HZ1 LYS 2 3HZ LYS 2 -0.416 -3.437 2.546
21 HZ2 LYS 2 1HZ LYS 2 0.707 -3.267 1.293
22 HZ3 LYS 2 2HZ LYS 2 1.126 -2.821 2.870
23 H THR 3 H THR 3 2.583 -3.340 -3.410
24 HA THR 3 HA THR 3 4.648 -4.645 -5.027
25 HB THR 3 HB THR 3 2.784 -6.274 -4.722
26 HG1 THR 3 HG1 THR 3 3.927 -6.520 -6.598
27 HG21 THR 3 1HG2 THR 3 0.627 -5.781 -5.112
28 HG22 THR 3 2HG2 THR 3 1.005 -4.875 -6.577
29 HG23 THR 3 3HG2 THR 3 1.141 -4.099 -5.000
30 H ILE 4 H ILE 4 4.050 -1.867 -4.497
31 HA ILE 4 HA ILE 4 2.617 -0.726 -6.670
32 HB ILE 4 HB ILE 4 3.094 0.424 -4.484
33 HG12 ILE 4 2HG1 ILE 4 3.977 1.956 -6.938
34 HG13 ILE 4 3HG1 ILE 4 2.300 1.595 -6.547
35 HG21 ILE 4 1HG2 ILE 4 5.525 -0.238 -4.488
36 HG22 ILE 4 2HG2 ILE 4 5.784 1.028 -5.686
37 HG23 ILE 4 3HG2 ILE 4 5.194 1.445 -4.078
38 HD11 ILE 4 3HD1 ILE 4 2.241 3.498 -5.427
39 HD12 ILE 4 1HD1 ILE 4 3.343 2.778 -4.253
40 HD13 ILE 4 2HD1 ILE 4 3.981 3.718 -5.602
41 H LEU 5 H LEU 5 5.633 -2.205 -6.500
42 HA LEU 5 HA LEU 5 7.282 -0.733 -8.149
43 HB2 LEU 5 2HB LEU 5 8.522 -2.680 -8.495
44 HB3 LEU 5 3HB LEU 5 7.764 -2.904 -6.920
45 HG LEU 5 HG LEU 5 5.953 -4.164 -8.412
46 HD11 LEU 5 1HD1 LEU 5 6.634 -4.944 -10.405
47 HD12 LEU 5 2HD1 LEU 5 8.301 -5.153 -9.874
48 HD13 LEU 5 3HD1 LEU 5 7.725 -3.560 -10.364
49 HD21 LEU 5 3HD2 LEU 5 7.292 -5.031 -6.491
50 HD22 LEU 5 1HD2 LEU 5 8.562 -5.456 -7.639
51 HD23 LEU 5 2HD2 LEU 5 6.977 -6.220 -7.755
52 H ARG 6 H ARG 6 4.583 -2.811 -9.004
53 HA ARG 6 HA ARG 6 5.087 -2.786 -11.813
54 HB2 ARG 6 2HB ARG 6 2.997 -3.895 -12.046
55 HB3 ARG 6 3HB ARG 6 3.728 -4.511 -10.569
56 HG2 ARG 6 2HG ARG 6 1.645 -4.153 -9.776
57 HG3 ARG 6 3HG ARG 6 2.289 -2.531 -9.517
58 HD2 ARG 6 2HD ARG 6 0.495 -1.861 -10.684
59 HD3 ARG 6 3HD ARG 6 1.427 -2.369 -12.091
60 HE ARG 6 HE ARG 6 -0.011 -4.132 -12.370
61 HH11 ARG 6 1HH1 ARG 6 -0.481 -2.748 -9.211
62 HH12 ARG 6 2HH1 ARG 6 -1.902 -3.681 -8.871
63 HH21 ARG 6 1HH2 ARG 6 -1.879 -5.365 -11.934
64 HH22 ARG 6 2HH2 ARG 6 -2.695 -5.170 -10.420
65 H PHE 7 H PHE 7 3.283 -0.765 -9.598
66 HA PHE 7 HA PHE 7 1.883 0.679 -11.639
67 HB2 PHE 7 2HB PHE 7 0.877 0.574 -9.464
68 HB3 PHE 7 3HB PHE 7 2.328 1.214 -8.700
69 HD1 PHE 7 HD2 PHE 7 0.060 2.232 -11.489
70 HD2 PHE 7 HD1 PHE 7 2.133 3.362 -7.948
71 HE1 PHE 7 HE2 PHE 7 -0.845 4.511 -11.690
72 HE2 PHE 7 HE1 PHE 7 1.230 5.642 -8.142
73 HZ PHE 7 HZ PHE 7 -0.260 6.219 -10.016
74 H VAL 8 H VAL 8 4.597 1.477 -9.474
75 HA VAL 8 HA VAL 8 5.136 4.004 -10.597
76 HB VAL 8 HB VAL 8 7.012 2.142 -9.134
77 HG11 VAL 8 1HG1 VAL 8 8.333 4.154 -8.675
78 HG12 VAL 8 2HG1 VAL 8 8.233 3.822 -10.406
79 HG13 VAL 8 3HG1 VAL 8 7.245 5.097 -9.693
80 HG21 VAL 8 3HG2 VAL 8 6.249 4.329 -7.540
81 HG22 VAL 8 1HG2 VAL 8 4.770 3.696 -8.263
82 HG23 VAL 8 2HG2 VAL 8 5.818 2.632 -7.325
83 H ALA 9 H ALA 9 6.179 0.768 -11.440
84 HA ALA 9 HA ALA 9 8.366 1.270 -13.045
85 HB1 ALA 9 3HB ALA 9 6.201 -0.802 -13.285
86 HB2 ALA 9 1HB ALA 9 7.620 -0.777 -14.331
87 HB3 ALA 9 2HB ALA 9 7.812 -0.977 -12.589
88 H GLY 10 H GLY 10 4.936 1.239 -14.015
89 HA2 GLY 10 2HA GLY 10 5.481 2.017 -16.706
90 HA3 GLY 10 3HA GLY 10 3.906 2.011 -15.926
91 H TYR 11 H TYR 11 4.899 3.766 -13.746
92 HA TYR 11 HA TYR 11 4.256 6.256 -14.983
93 HB2 TYR 11 2HB TYR 11 3.737 5.493 -12.578
94 HB3 TYR 11 3HB TYR 11 5.394 5.956 -12.211
95 HD1 TYR 11 HD1 TYR 11 6.057 8.393 -12.981
96 HD2 TYR 11 HD2 TYR 11 2.065 7.071 -12.327
97 HE1 TYR 11 HE1 TYR 11 5.340 10.725 -12.671
98 HE2 TYR 11 HE2 TYR 11 1.338 9.400 -12.017
99 HH TYR 11 HH TYR 11 3.629 12.030 -11.825
100 H ASP 12 H ASP 12 7.209 4.697 -13.927
101 HA ASP 12 HA ASP 12 8.903 6.950 -14.021
102 HB2 ASP 12 2HB ASP 12 9.324 4.574 -13.047
103 HB3 ASP 12 3HB ASP 12 9.857 4.179 -14.679
104 H ILE 13 H ILE 13 7.667 4.819 -16.484
105 HA ILE 13 HA ILE 13 9.489 5.861 -18.499
106 HB ILE 13 HB ILE 13 7.214 3.893 -18.775
107 HG12 ILE 13 2HG1 ILE 13 9.895 2.872 -19.205
108 HG13 ILE 13 3HG1 ILE 13 9.727 3.559 -17.593
109 HG21 ILE 13 1HG2 ILE 13 7.675 5.059 -20.862
110 HG22 ILE 13 2HG2 ILE 13 9.386 4.659 -20.721
111 HG23 ILE 13 3HG2 ILE 13 8.198 3.377 -20.958
112 HD11 ILE 13 3HD1 ILE 13 8.640 1.103 -18.707
113 HD12 ILE 13 1HD1 ILE 13 8.927 1.562 -17.029
114 HD13 ILE 13 2HD1 ILE 13 7.447 2.070 -17.843
115 H ALA 14 H ALA 14 6.018 5.886 -17.772
116 HA ALA 14 HA ALA 14 5.220 7.416 -19.997
117 HB1 ALA 14 3HB ALA 14 3.890 7.253 -17.296
118 HB2 ALA 14 1HB ALA 14 3.143 7.767 -18.809
119 HB3 ALA 14 2HB ALA 14 3.672 6.095 -18.609
120 H SER 15 H SER 15 6.341 8.312 -16.780
121 HA SER 15 HA SER 15 5.740 11.085 -17.038
122 HB2 SER 15 2HB SER 15 5.945 10.212 -14.824
123 HB3 SER 15 3HB SER 15 7.544 9.550 -15.163
124 HG SER 15 HG SER 15 6.825 12.289 -14.997
125 H HIS 16 H HIS 16 8.406 9.067 -17.968
126 HA HIS 16 HA HIS 16 10.239 11.252 -18.384
127 HB2 HIS 16 2HB HIS 16 11.103 9.051 -17.774
128 HB3 HIS 16 3HB HIS 16 10.389 8.349 -19.222
129 HD1 HIS 16 HD1 HIS 16 11.618 8.709 -21.445
130 HD2 HIS 16 HD2 HIS 16 13.445 10.558 -18.204
131 HE1 HIS 16 HE1 HIS 16 13.889 9.414 -22.265
132 H LYS 17 H LYS 17 8.010 9.351 -20.306
133 HA LYS 17 HA LYS 17 8.940 10.379 -22.825
134 HB2 LYS 17 2HB LYS 17 7.027 8.400 -21.906
135 HB3 LYS 17 3HB LYS 17 6.357 9.385 -23.199
136 HG2 LYS 17 2HG LYS 17 7.341 7.842 -24.501
137 HG3 LYS 17 3HG LYS 17 8.770 8.845 -24.244
138 HD2 LYS 17 2HD LYS 17 9.795 7.265 -23.027
139 HD3 LYS 17 3HD LYS 17 8.325 6.874 -22.132
140 HE2 LYS 17 2HE LYS 17 9.017 4.944 -23.393
141 HE3 LYS 17 3HE LYS 17 7.530 5.585 -24.091
142 HZ1 LYS 17 3HZ LYS 17 10.077 6.509 -25.197
143 HZ2 LYS 17 1HZ LYS 17 8.591 6.264 -25.967
144 HZ3 LYS 17 2HZ LYS 17 9.572 4.942 -25.582
145 H LYS 18 H LYS 18 6.081 10.915 -20.781
146 HA LYS 18 HA LYS 18 5.167 13.083 -22.466
147 HB2 LYS 18 2HB LYS 18 4.145 11.890 -19.891
148 HB3 LYS 18 3HB LYS 18 3.416 13.309 -20.630
149 HG2 LYS 18 2HG LYS 18 3.768 11.010 -22.423
150 HG3 LYS 18 3HG LYS 18 2.628 10.772 -21.096
151 HD2 LYS 18 2HD LYS 18 1.835 13.193 -21.909
152 HD3 LYS 18 3HD LYS 18 2.479 12.584 -23.435
153 HE2 LYS 18 2HE LYS 18 0.506 11.584 -23.715
154 HE3 LYS 18 3HE LYS 18 1.014 10.459 -22.457
155 HZ1 LYS 18 3HZ LYS 18 0.055 12.654 -21.117
156 HZ2 LYS 18 1HZ LYS 18 -0.725 11.165 -21.302
157 HZ3 LYS 18 2HZ LYS 18 -1.040 12.425 -22.385
158 H LYS 19 H LYS 19 6.123 12.796 -19.039
159 HA LYS 19 HA LYS 19 7.072 14.274 -17.596
160 HB2 LYS 19 2HB LYS 19 8.773 14.319 -19.486
161 HB3 LYS 19 3HB LYS 19 8.002 15.805 -20.024
162 HG2 LYS 19 2HG LYS 19 8.428 16.584 -17.574
163 HG3 LYS 19 3HG LYS 19 9.630 15.292 -17.580
164 HD2 LYS 19 2HD LYS 19 10.757 16.281 -19.464
165 HD3 LYS 19 3HD LYS 19 9.489 17.498 -19.633
166 HE2 LYS 19 2HE LYS 19 10.879 18.776 -18.414
167 HE3 LYS 19 3HE LYS 19 10.222 17.872 -17.051
168 HZ1 LYS 19 3HZ LYS 19 12.230 17.072 -16.641
169 HZ2 LYS 19 1HZ LYS 19 12.868 17.984 -17.916
170 HZ3 LYS 19 2HZ LYS 19 12.328 16.405 -18.193
171 H THR 20 H THR 20 5.161 15.079 -16.745
172 HA THR 20 HA THR 20 4.730 17.853 -17.009
173 HB THR 20 HB THR 20 3.626 17.394 -19.085
174 HG1 THR 20 HG1 THR 20 1.391 17.953 -18.426
175 HG21 THR 20 1HG2 THR 20 1.657 15.849 -19.165
176 HG22 THR 20 2HG2 THR 20 2.098 15.293 -17.551
177 HG23 THR 20 3HG2 THR 20 3.202 15.040 -18.901
178 H GLY 21 H GLY 21 2.975 18.634 -15.627
179 HA2 GLY 21 2HA GLY 21 2.071 16.614 -13.675
180 HA3 GLY 21 3HA GLY 21 2.788 18.128 -13.145
181 H GLY 22 H GLY 22 0.183 16.983 -15.300
182 HA2 GLY 22 2HA GLY 22 -1.829 18.411 -13.902
183 HA3 GLY 22 3HA GLY 22 -1.329 19.314 -15.324
184 H TYR 23 H TYR 23 -3.092 16.607 -14.131
185 HA TYR 23 HA TYR 23 -3.449 15.097 -16.440
186 HB2 TYR 23 2HB TYR 23 -5.052 15.526 -13.958
187 HB3 TYR 23 3HB TYR 23 -5.799 14.668 -15.300
188 HD1 TYR 23 HD1 TYR 23 -3.781 12.985 -16.389
189 HD2 TYR 23 HD2 TYR 23 -4.414 14.041 -12.316
190 HE1 TYR 23 HE1 TYR 23 -2.668 10.908 -15.684
191 HE2 TYR 23 HE2 TYR 23 -3.301 11.967 -11.599
192 HH TYR 23 HH TYR 23 -2.071 10.211 -12.269
193 HA PRO 24 HA PRO 24 -6.031 17.397 -19.139
194 HB2 PRO 24 2HB PRO 24 -7.717 15.495 -20.094
195 HB3 PRO 24 3HB PRO 24 -6.011 15.583 -20.548
196 HG2 PRO 24 2HG PRO 24 -7.342 13.828 -18.522
197 HG3 PRO 24 3HG PRO 24 -6.096 13.414 -19.714
198 HD2 PRO 24 2HD PRO 24 -5.523 13.874 -17.107
199 HD3 PRO 24 3HD PRO 24 -4.395 14.272 -18.417
200 H TRP 25 H TRP 25 -7.613 15.453 -16.684
201 HA TRP 25 HA TRP 25 -10.054 17.057 -16.927
202 HB2 TRP 25 2HB TRP 25 -10.959 15.366 -15.262
203 HB3 TRP 25 3HB TRP 25 -10.541 14.732 -16.851
204 HD1 TRP 25 HD1 TRP 25 -8.862 12.765 -16.925
205 HE1 TRP 25 HE1 TRP 25 -7.458 11.513 -15.169
206 HE3 TRP 25 HE3 TRP 25 -9.633 15.850 -12.922
207 HZ2 TRP 25 HZ2 TRP 25 -6.769 11.795 -12.447
208 HZ3 TRP 25 HZ3 TRP 25 -8.566 15.287 -10.777
209 HH2 TRP 25 HH2 TRP 25 -7.164 13.301 -10.546
210 H GLU 26 H GLU 26 -7.234 16.732 -15.032
211 HA GLU 26 HA GLU 26 -8.421 18.084 -12.729
212 HB2 GLU 26 2HB GLU 26 -6.602 16.102 -12.804
213 HB3 GLU 26 3HB GLU 26 -5.517 17.486 -12.794
214 HG2 GLU 26 2HG GLU 26 -6.381 18.259 -10.726
215 HG3 GLU 26 3HG GLU 26 -7.711 17.103 -10.779
216 H ARG 27 H ARG 27 -8.388 19.618 -15.037
217 HA ARG 27 HA ARG 27 -6.315 21.616 -14.404
218 HB2 ARG 27 2HB ARG 27 -6.548 20.288 -16.786
219 HB3 ARG 27 3HB ARG 27 -7.485 21.743 -17.097
220 HG2 ARG 27 2HG ARG 27 -5.666 23.120 -16.932
221 HG3 ARG 27 3HG ARG 27 -4.791 22.016 -15.869
222 HD2 ARG 27 2HD ARG 27 -3.796 22.145 -18.117
223 HD3 ARG 27 3HD ARG 27 -4.359 20.521 -17.721
224 HE ARG 27 HE ARG 27 -6.439 21.753 -19.053
225 HH11 ARG 27 1HH1 ARG 27 -3.132 20.898 -19.726
226 HH12 ARG 27 2HH1 ARG 27 -3.396 20.685 -21.425
227 HH21 ARG 27 1HH2 ARG 27 -6.799 21.475 -21.289
228 HH22 ARG 27 2HH2 ARG 27 -5.481 21.014 -22.313
229 H GLY 28 H GLY 28 -8.994 21.349 -13.278
230 HA2 GLY 28 2HA GLY 28 -9.889 23.780 -12.836
231 HA3 GLY 28 3HA GLY 28 -10.453 23.581 -14.489
232 H LYS 29 H LYS 29 -11.947 21.817 -14.929
233 HA LYS 29 HA LYS 29 -13.898 21.586 -12.812
234 HB2 LYS 29 2HB LYS 29 -13.844 20.728 -15.699
235 HB3 LYS 29 3HB LYS 29 -15.158 20.279 -14.620
236 HG2 LYS 29 2HG LYS 29 -16.132 22.179 -15.219
237 HG3 LYS 29 3HG LYS 29 -14.913 23.003 -14.245
238 HD2 LYS 29 2HD LYS 29 -14.664 24.075 -16.266
239 HD3 LYS 29 3HD LYS 29 -13.467 22.787 -16.419
240 HE2 LYS 29 2HE LYS 29 -15.397 21.444 -17.492
241 HE3 LYS 29 3HE LYS 29 -16.174 23.015 -17.686
242 HZ1 LYS 29 3HZ LYS 29 -13.429 22.482 -18.658
243 HZ2 LYS 29 1HZ LYS 29 -14.456 23.761 -19.073
244 HZ3 LYS 29 2HZ LYS 29 -14.796 22.195 -19.613
245 H ALA 30 H ALA 30 -13.509 20.122 -11.272
246 HA ALA 30 HA ALA 30 -11.938 17.821 -11.529
247 HB1 ALA 30 3HB ALA 30 -12.214 18.485 -9.342
248 HB2 ALA 30 1HB ALA 30 -13.947 18.755 -9.529
249 HB3 ALA 30 2HB ALA 30 -13.316 17.111 -9.428
Start of MODEL 3
1 H1 MET 1 H MET 1 1.581 0.773 -0.482
2 HA MET 1 HA MET 1 0.283 -1.597 -0.884
3 HB2 MET 1 2HB MET 1 0.771 -0.138 -3.468
4 HB3 MET 1 3HB MET 1 0.720 -1.894 -3.409
5 HG2 MET 1 2HG MET 1 -1.505 -0.119 -2.442
6 HG3 MET 1 3HG MET 1 -1.419 -0.804 -4.063
7 HE1 MET 1 3HE MET 1 -1.411 -4.305 -3.847
8 HE2 MET 1 1HE MET 1 -3.043 -3.695 -4.123
9 HE3 MET 1 2HE MET 1 -1.654 -2.820 -4.766
10 H LYS 2 H LYS 2 1.693 -3.356 -1.338
11 HA LYS 2 HA LYS 2 4.492 -2.686 -0.883
12 HB2 LYS 2 2HB LYS 2 2.996 -5.310 -0.814
13 HB3 LYS 2 3HB LYS 2 4.727 -5.165 -0.539
14 HG2 LYS 2 2HG LYS 2 3.033 -3.416 1.111
15 HG3 LYS 2 3HG LYS 2 2.879 -5.148 1.417
16 HD2 LYS 2 2HD LYS 2 4.788 -5.133 2.555
17 HD3 LYS 2 3HD LYS 2 5.645 -4.513 1.142
18 HE2 LYS 2 2HE LYS 2 4.857 -2.219 1.806
19 HE3 LYS 2 3HE LYS 2 4.273 -2.931 3.309
20 HZ1 LYS 2 3HZ LYS 2 6.820 -3.824 3.167
21 HZ2 LYS 2 1HZ LYS 2 6.308 -2.484 4.065
22 HZ3 LYS 2 2HZ LYS 2 6.957 -2.268 2.518
23 H THR 3 H THR 3 2.414 -3.962 -3.358
24 HA THR 3 HA THR 3 4.728 -4.647 -5.029
25 HB THR 3 HB THR 3 2.938 -6.352 -4.809
26 HG1 THR 3 HG1 THR 3 3.520 -6.889 -6.764
27 HG21 THR 3 1HG2 THR 3 1.095 -4.582 -4.712
28 HG22 THR 3 2HG2 THR 3 0.764 -6.036 -5.653
29 HG23 THR 3 3HG2 THR 3 1.210 -4.538 -6.470
30 H ILE 4 H ILE 4 4.107 -1.904 -4.508
31 HA ILE 4 HA ILE 4 2.652 -0.757 -6.662
32 HB ILE 4 HB ILE 4 3.136 0.379 -4.472
33 HG12 ILE 4 2HG1 ILE 4 3.992 1.935 -6.921
34 HG13 ILE 4 3HG1 ILE 4 2.320 1.559 -6.520
35 HG21 ILE 4 1HG2 ILE 4 5.815 1.010 -5.688
36 HG22 ILE 4 2HG2 ILE 4 5.232 1.415 -4.075
37 HG23 ILE 4 3HG2 ILE 4 5.571 -0.264 -4.493
38 HD11 ILE 4 3HD1 ILE 4 3.111 2.718 -4.225
39 HD12 ILE 4 1HD1 ILE 4 4.135 3.567 -5.382
40 HD13 ILE 4 2HD1 ILE 4 2.382 3.591 -5.574
41 H LEU 5 H LEU 5 5.679 -2.218 -6.522
42 HA LEU 5 HA LEU 5 7.306 -0.723 -8.173
43 HB2 LEU 5 2HB LEU 5 8.556 -2.659 -8.542
44 HB3 LEU 5 3HB LEU 5 7.811 -2.900 -6.962
45 HG LEU 5 HG LEU 5 5.998 -4.162 -8.452
46 HD11 LEU 5 1HD1 LEU 5 6.666 -4.914 -10.457
47 HD12 LEU 5 2HD1 LEU 5 8.337 -5.133 -9.936
48 HD13 LEU 5 3HD1 LEU 5 7.762 -3.533 -10.408
49 HD21 LEU 5 3HD2 LEU 5 8.636 -5.360 -7.613
50 HD22 LEU 5 1HD2 LEU 5 7.132 -6.238 -7.893
51 HD23 LEU 5 2HD2 LEU 5 7.247 -5.090 -6.558
52 H ARG 6 H ARG 6 4.615 -2.813 -9.025
53 HA ARG 6 HA ARG 6 5.100 -2.764 -11.837
54 HB2 ARG 6 2HB ARG 6 2.996 -3.869 -12.061
55 HB3 ARG 6 3HB ARG 6 3.768 -4.516 -10.619
56 HG2 ARG 6 2HG ARG 6 1.727 -4.183 -9.733
57 HG3 ARG 6 3HG ARG 6 2.337 -2.543 -9.507
58 HD2 ARG 6 2HD ARG 6 0.517 -1.899 -10.637
59 HD3 ARG 6 3HD ARG 6 1.375 -2.467 -12.069
60 HE ARG 6 HE ARG 6 -0.083 -4.229 -12.206
61 HH11 ARG 6 1HH1 ARG 6 -0.363 -2.746 -9.069
62 HH12 ARG 6 2HH1 ARG 6 -1.757 -3.668 -8.614
63 HH21 ARG 6 1HH2 ARG 6 -1.918 -5.448 -11.619
64 HH22 ARG 6 2HH2 ARG 6 -2.641 -5.205 -10.064
65 H PHE 7 H PHE 7 3.298 -0.773 -9.594
66 HA PHE 7 HA PHE 7 1.873 0.677 -11.615
67 HB2 PHE 7 2HB PHE 7 0.883 0.549 -9.435
68 HB3 PHE 7 3HB PHE 7 2.335 1.194 -8.676
69 HD1 PHE 7 HD2 PHE 7 0.039 2.215 -11.439
70 HD2 PHE 7 HD1 PHE 7 2.133 3.335 -7.908
71 HE1 PHE 7 HE2 PHE 7 -0.883 4.489 -11.619
72 HE2 PHE 7 HE1 PHE 7 1.214 5.611 -8.080
73 HZ PHE 7 HZ PHE 7 -0.295 6.191 -9.938
74 H VAL 8 H VAL 8 4.599 1.475 -9.465
75 HA VAL 8 HA VAL 8 5.112 4.015 -10.575
76 HB VAL 8 HB VAL 8 7.011 2.155 -9.137
77 HG11 VAL 8 1HG1 VAL 8 8.212 3.850 -10.405
78 HG12 VAL 8 2HG1 VAL 8 7.221 5.116 -9.677
79 HG13 VAL 8 3HG1 VAL 8 8.323 4.171 -8.674
80 HG21 VAL 8 3HG2 VAL 8 6.244 4.327 -7.523
81 HG22 VAL 8 1HG2 VAL 8 4.764 3.689 -8.239
82 HG23 VAL 8 2HG2 VAL 8 5.826 2.626 -7.316
83 H ALA 9 H ALA 9 6.170 0.791 -11.447
84 HA ALA 9 HA ALA 9 8.344 1.318 -13.061
85 HB1 ALA 9 3HB ALA 9 7.805 -0.936 -12.618
86 HB2 ALA 9 1HB ALA 9 6.188 -0.764 -13.303
87 HB3 ALA 9 2HB ALA 9 7.602 -0.726 -14.357
88 H GLY 10 H GLY 10 4.907 1.273 -14.009
89 HA2 GLY 10 2HA GLY 10 5.428 2.074 -16.699
90 HA3 GLY 10 3HA GLY 10 3.861 2.052 -15.908
91 H TYR 11 H TYR 11 4.857 3.798 -13.723
92 HA TYR 11 HA TYR 11 4.189 6.292 -14.937
93 HB2 TYR 11 2HB TYR 11 3.691 5.515 -12.537
94 HB3 TYR 11 3HB TYR 11 5.351 5.973 -12.176
95 HD1 TYR 11 HD1 TYR 11 6.012 8.415 -12.927
96 HD2 TYR 11 HD2 TYR 11 2.023 7.093 -12.261
97 HE1 TYR 11 HE1 TYR 11 5.301 10.746 -12.591
98 HE2 TYR 11 HE2 TYR 11 1.301 9.420 -11.926
99 HH TYR 11 HH TYR 11 3.553 12.013 -11.603
100 H ASP 12 H ASP 12 7.162 4.746 -13.913
101 HA ASP 12 HA ASP 12 8.841 7.009 -14.008
102 HB2 ASP 12 2HB ASP 12 9.288 4.635 -13.048
103 HB3 ASP 12 3HB ASP 12 9.802 4.246 -14.688
104 H ILE 13 H ILE 13 7.749 4.754 -16.467
105 HA ILE 13 HA ILE 13 9.501 5.853 -18.488
106 HB ILE 13 HB ILE 13 7.221 3.892 -18.761
107 HG12 ILE 13 2HG1 ILE 13 9.891 2.857 -19.203
108 HG13 ILE 13 3HG1 ILE 13 9.744 3.554 -17.593
109 HG21 ILE 13 1HG2 ILE 13 7.682 5.062 -20.847
110 HG22 ILE 13 2HG2 ILE 13 9.390 4.648 -20.713
111 HG23 ILE 13 3HG2 ILE 13 8.191 3.376 -20.947
112 HD11 ILE 13 3HD1 ILE 13 8.918 1.582 -16.994
113 HD12 ILE 13 1HD1 ILE 13 7.447 2.071 -17.835
114 HD13 ILE 13 2HD1 ILE 13 8.654 1.089 -18.667
115 H ALA 14 H ALA 14 6.008 5.822 -17.832
116 HA ALA 14 HA ALA 14 5.205 7.360 -20.027
117 HB1 ALA 14 3HB ALA 14 3.206 7.910 -18.575
118 HB2 ALA 14 1HB ALA 14 3.536 6.197 -18.835
119 HB3 ALA 14 2HB ALA 14 3.984 6.961 -17.309
120 H SER 15 H SER 15 6.282 8.316 -16.801
121 HA SER 15 HA SER 15 5.746 11.093 -17.162
122 HB2 SER 15 2HB SER 15 5.978 9.891 -14.940
123 HB3 SER 15 3HB SER 15 7.719 9.887 -15.216
124 HG SER 15 HG SER 15 6.185 11.856 -14.263
125 H HIS 16 H HIS 16 8.439 8.997 -17.863
126 HA HIS 16 HA HIS 16 10.320 11.130 -18.291
127 HB2 HIS 16 2HB HIS 16 11.180 8.989 -17.600
128 HB3 HIS 16 3HB HIS 16 10.405 8.183 -18.960
129 HD1 HIS 16 HD1 HIS 16 11.566 8.340 -21.249
130 HD2 HIS 16 HD2 HIS 16 13.557 10.361 -18.213
131 HE1 HIS 16 HE1 HIS 16 13.831 8.900 -22.186
132 H LYS 17 H LYS 17 8.127 9.227 -20.251
133 HA LYS 17 HA LYS 17 9.181 10.161 -22.757
134 HB2 LYS 17 2HB LYS 17 7.328 8.174 -21.890
135 HB3 LYS 17 3HB LYS 17 6.511 9.210 -23.054
136 HG2 LYS 17 2HG LYS 17 7.567 8.238 -24.737
137 HG3 LYS 17 3HG LYS 17 9.137 8.565 -24.002
138 HD2 LYS 17 2HD LYS 17 9.333 6.471 -23.198
139 HD3 LYS 17 3HD LYS 17 7.628 6.380 -22.748
140 HE2 LYS 17 2HE LYS 17 8.282 6.365 -25.641
141 HE3 LYS 17 3HE LYS 17 8.680 4.919 -24.715
142 HZ1 LYS 17 3HZ LYS 17 6.067 6.043 -25.371
143 HZ2 LYS 17 1HZ LYS 17 6.227 5.294 -23.863
144 HZ3 LYS 17 2HZ LYS 17 6.556 4.426 -25.277
145 H LYS 18 H LYS 18 6.080 10.684 -21.067
146 HA LYS 18 HA LYS 18 5.365 12.872 -22.772
147 HB2 LYS 18 2HB LYS 18 4.182 11.822 -20.200
148 HB3 LYS 18 3HB LYS 18 3.499 13.171 -21.097
149 HG2 LYS 18 2HG LYS 18 3.984 10.716 -22.649
150 HG3 LYS 18 3HG LYS 18 2.729 10.618 -21.411
151 HD2 LYS 18 2HD LYS 18 2.225 13.035 -22.641
152 HD3 LYS 18 3HD LYS 18 2.719 11.994 -23.978
153 HE2 LYS 18 2HE LYS 18 1.057 10.331 -22.660
154 HE3 LYS 18 3HE LYS 18 0.321 11.883 -22.264
155 HZ1 LYS 18 3HZ LYS 18 1.036 11.295 -25.054
156 HZ2 LYS 18 1HZ LYS 18 -0.179 12.306 -24.447
157 HZ3 LYS 18 2HZ LYS 18 -0.376 10.626 -24.405
158 H LYS 19 H LYS 19 6.092 12.684 -19.283
159 HA LYS 19 HA LYS 19 6.887 14.227 -17.811
160 HB2 LYS 19 2HB LYS 19 8.841 13.991 -19.383
161 HB3 LYS 19 3HB LYS 19 8.265 15.428 -20.216
162 HG2 LYS 19 2HG LYS 19 8.733 16.815 -18.398
163 HG3 LYS 19 3HG LYS 19 8.843 15.457 -17.277
164 HD2 LYS 19 2HD LYS 19 10.741 15.495 -19.554
165 HD3 LYS 19 3HD LYS 19 10.995 16.681 -18.272
166 HE2 LYS 19 2HE LYS 19 10.522 14.376 -16.867
167 HE3 LYS 19 3HE LYS 19 11.409 13.786 -18.272
168 HZ1 LYS 19 3HZ LYS 19 13.293 14.710 -17.554
169 HZ2 LYS 19 1HZ LYS 19 12.529 14.835 -16.049
170 HZ3 LYS 19 2HZ LYS 19 12.543 16.158 -17.103
171 H THR 20 H THR 20 4.794 15.128 -17.471
172 HA THR 20 HA THR 20 4.647 17.925 -18.279
173 HB THR 20 HB THR 20 3.283 17.002 -19.988
174 HG1 THR 20 HG1 THR 20 1.684 18.329 -19.572
175 HG21 THR 20 1HG2 THR 20 1.404 15.465 -19.502
176 HG22 THR 20 2HG2 THR 20 1.939 15.380 -17.825
177 HG23 THR 20 3HG2 THR 20 2.974 14.765 -19.112
178 H GLY 21 H GLY 21 3.379 19.224 -16.894
179 HA2 GLY 21 2HA GLY 21 2.200 17.929 -14.548
180 HA3 GLY 21 3HA GLY 21 3.518 19.060 -14.276
181 H GLY 22 H GLY 22 0.837 19.225 -16.600
182 HA2 GLY 22 2HA GLY 22 -1.124 20.575 -16.260
183 HA3 GLY 22 3HA GLY 22 -0.204 21.552 -15.125
184 H TYR 23 H TYR 23 -1.369 21.337 -18.259
185 HA TYR 23 HA TYR 23 0.557 22.622 -19.799
186 HB2 TYR 23 2HB TYR 23 -2.418 22.400 -19.938
187 HB3 TYR 23 3HB TYR 23 -1.613 23.551 -20.998
188 HD1 TYR 23 HD1 TYR 23 0.763 22.275 -21.900
189 HD2 TYR 23 HD2 TYR 23 -3.033 20.519 -21.120
190 HE1 TYR 23 HE1 TYR 23 1.284 20.462 -23.478
191 HE2 TYR 23 HE2 TYR 23 -2.522 18.701 -22.695
192 HH TYR 23 HH TYR 23 -0.894 17.718 -23.908
193 HA PRO 24 HA PRO 24 0.712 26.812 -18.510
194 HB2 PRO 24 2HB PRO 24 0.886 28.141 -20.872
195 HB3 PRO 24 3HB PRO 24 2.214 27.178 -20.211
196 HG2 PRO 24 2HG PRO 24 0.210 26.451 -22.312
197 HG3 PRO 24 3HG PRO 24 1.957 26.149 -22.280
198 HD2 PRO 24 2HD PRO 24 0.137 24.244 -21.652
199 HD3 PRO 24 3HD PRO 24 1.741 24.318 -20.896
200 H TRP 25 H TRP 25 -1.736 25.953 -20.870
201 HA TRP 25 HA TRP 25 -3.289 28.344 -20.192
202 HB2 TRP 25 2HB TRP 25 -4.777 27.535 -22.084
203 HB3 TRP 25 3HB TRP 25 -3.151 28.032 -22.543
204 HD1 TRP 25 HD1 TRP 25 -1.711 26.302 -23.822
205 HE1 TRP 25 HE1 TRP 25 -2.024 23.844 -24.517
206 HE3 TRP 25 HE3 TRP 25 -5.955 25.244 -21.174
207 HZ2 TRP 25 HZ2 TRP 25 -3.831 21.735 -24.010
208 HZ3 TRP 25 HZ3 TRP 25 -6.911 22.983 -21.334
209 HH2 TRP 25 HH2 TRP 25 -5.870 21.266 -22.724
210 H GLU 26 H GLU 26 -3.085 25.001 -19.535
211 HA GLU 26 HA GLU 26 -5.869 24.821 -18.670
212 HB2 GLU 26 2HB GLU 26 -4.355 22.985 -19.898
213 HB3 GLU 26 3HB GLU 26 -3.972 22.575 -18.232
214 HG2 GLU 26 2HG GLU 26 -6.300 22.207 -17.739
215 HG3 GLU 26 3HG GLU 26 -6.760 22.748 -19.352
216 H ARG 27 H ARG 27 -4.553 26.666 -17.191
217 HA ARG 27 HA ARG 27 -3.790 25.322 -14.696
218 HB2 ARG 27 2HB ARG 27 -3.288 28.074 -15.792
219 HB3 ARG 27 3HB ARG 27 -3.125 27.749 -14.071
220 HG2 ARG 27 2HG ARG 27 -1.726 25.781 -15.661
221 HG3 ARG 27 3HG ARG 27 -1.184 27.423 -16.017
222 HD2 ARG 27 2HD ARG 27 -1.405 26.264 -13.244
223 HD3 ARG 27 3HD ARG 27 0.084 26.307 -14.187
224 HE ARG 27 HE ARG 27 -0.749 28.895 -14.156
225 HH11 ARG 27 1HH1 ARG 27 -0.118 26.512 -11.698
226 HH12 ARG 27 2HH1 ARG 27 0.363 27.676 -10.509
227 HH21 ARG 27 1HH2 ARG 27 -0.116 30.438 -12.599
228 HH22 ARG 27 2HH2 ARG 27 0.363 29.909 -11.022
229 H GLY 28 H GLY 28 -6.541 25.453 -15.553
230 HA2 GLY 28 2HA GLY 28 -7.681 27.373 -13.630
231 HA3 GLY 28 3HA GLY 28 -8.551 26.651 -14.976
232 H LYS 29 H LYS 29 -6.499 24.622 -13.087
233 HA LYS 29 HA LYS 29 -6.951 22.784 -11.818
234 HB2 LYS 29 2HB LYS 29 -7.586 24.821 -10.328
235 HB3 LYS 29 3HB LYS 29 -9.242 24.297 -10.604
236 HG2 LYS 29 2HG LYS 29 -8.913 23.070 -8.763
237 HG3 LYS 29 3HG LYS 29 -8.086 21.963 -9.863
238 HD2 LYS 29 2HD LYS 29 -6.365 22.186 -8.433
239 HD3 LYS 29 3HD LYS 29 -6.093 23.715 -9.271
240 HE2 LYS 29 2HE LYS 29 -7.771 24.666 -7.534
241 HE3 LYS 29 3HE LYS 29 -7.389 23.208 -6.621
242 HZ1 LYS 29 3HZ LYS 29 -6.020 25.337 -6.223
243 HZ2 LYS 29 1HZ LYS 29 -5.220 24.912 -7.651
244 HZ3 LYS 29 2HZ LYS 29 -5.211 23.856 -6.331
245 H ALA 30 H ALA 30 -7.718 21.764 -13.843
246 HA ALA 30 HA ALA 30 -10.349 20.638 -13.422
247 HB1 ALA 30 3HB ALA 30 -11.392 22.026 -14.823
248 HB2 ALA 30 1HB ALA 30 -9.873 22.678 -15.440
249 HB3 ALA 30 2HB ALA 30 -10.532 21.187 -16.114
Start of MODEL 4
1 H1 MET 1 H MET 1 1.773 1.287 -1.793
2 HA MET 1 HA MET 1 0.744 -1.380 -1.150
3 HB2 MET 1 2HB MET 1 1.200 0.070 -3.752
4 HB3 MET 1 3HB MET 1 0.849 -1.652 -3.689
5 HG2 MET 1 2HG MET 1 -1.315 -1.249 -3.526
6 HG3 MET 1 3HG MET 1 -1.058 -0.247 -2.100
7 HE1 MET 1 3HE MET 1 -1.485 0.998 -6.445
8 HE2 MET 1 1HE MET 1 0.201 0.788 -5.974
9 HE3 MET 1 2HE MET 1 -0.934 -0.552 -5.807
10 H LYS 2 H LYS 2 2.091 -3.013 -0.823
11 HA LYS 2 HA LYS 2 4.890 -2.752 -0.955
12 HB2 LYS 2 2HB LYS 2 4.986 -5.075 -0.352
13 HB3 LYS 2 3HB LYS 2 3.653 -4.336 0.526
14 HG2 LYS 2 2HG LYS 2 2.192 -5.206 -1.414
15 HG3 LYS 2 3HG LYS 2 3.569 -6.252 -1.768
16 HD2 LYS 2 2HD LYS 2 3.480 -7.031 0.609
17 HD3 LYS 2 3HD LYS 2 1.979 -6.120 0.790
18 HE2 LYS 2 2HE LYS 2 1.023 -8.068 0.187
19 HE3 LYS 2 3HE LYS 2 1.428 -7.534 -1.443
20 HZ1 LYS 2 3HZ LYS 2 3.588 -8.760 -1.121
21 HZ2 LYS 2 1HZ LYS 2 2.206 -9.728 -1.259
22 HZ3 LYS 2 2HZ LYS 2 2.901 -9.458 0.259
23 H THR 3 H THR 3 2.530 -3.799 -3.275
24 HA THR 3 HA THR 3 4.657 -4.701 -5.093
25 HB THR 3 HB THR 3 2.760 -6.270 -4.687
26 HG1 THR 3 HG1 THR 3 3.883 -6.421 -6.647
27 HG21 THR 3 1HG2 THR 3 0.573 -5.817 -5.484
28 HG22 THR 3 2HG2 THR 3 1.094 -4.336 -6.287
29 HG23 THR 3 3HG2 THR 3 1.042 -4.413 -4.527
30 H ILE 4 H ILE 4 4.076 -1.890 -4.509
31 HA ILE 4 HA ILE 4 2.627 -0.748 -6.672
32 HB ILE 4 HB ILE 4 3.101 0.395 -4.484
33 HG12 ILE 4 2HG1 ILE 4 3.971 1.942 -6.933
34 HG13 ILE 4 3HG1 ILE 4 2.296 1.570 -6.540
35 HG21 ILE 4 1HG2 ILE 4 5.536 -0.253 -4.493
36 HG22 ILE 4 2HG2 ILE 4 5.786 1.018 -5.688
37 HG23 ILE 4 3HG2 ILE 4 5.196 1.426 -4.077
38 HD11 ILE 4 3HD1 ILE 4 3.235 2.739 -4.237
39 HD12 ILE 4 1HD1 ILE 4 4.035 3.653 -5.517
40 HD13 ILE 4 2HD1 ILE 4 2.275 3.525 -5.490
41 H LEU 5 H LEU 5 5.651 -2.211 -6.512
42 HA LEU 5 HA LEU 5 7.288 -0.725 -8.160
43 HB2 LEU 5 2HB LEU 5 8.538 -2.664 -8.516
44 HB3 LEU 5 3HB LEU 5 7.785 -2.898 -6.939
45 HG LEU 5 HG LEU 5 5.978 -4.162 -8.433
46 HD11 LEU 5 1HD1 LEU 5 8.080 -5.364 -9.929
47 HD12 LEU 5 2HD1 LEU 5 8.051 -3.636 -10.278
48 HD13 LEU 5 3HD1 LEU 5 6.598 -4.606 -10.512
49 HD21 LEU 5 3HD2 LEU 5 8.607 -5.251 -7.443
50 HD22 LEU 5 1HD2 LEU 5 7.251 -6.255 -7.955
51 HD23 LEU 5 2HD2 LEU 5 7.076 -5.179 -6.569
52 H ARG 6 H ARG 6 4.600 -2.814 -9.017
53 HA ARG 6 HA ARG 6 5.099 -2.776 -11.827
54 HB2 ARG 6 2HB ARG 6 2.998 -3.882 -12.059
55 HB3 ARG 6 3HB ARG 6 3.757 -4.521 -10.607
56 HG2 ARG 6 2HG ARG 6 1.718 -4.178 -9.730
57 HG3 ARG 6 3HG ARG 6 2.317 -2.530 -9.527
58 HD2 ARG 6 2HD ARG 6 0.305 -2.137 -10.560
59 HD3 ARG 6 3HD ARG 6 1.384 -2.215 -11.951
60 HE ARG 6 HE ARG 6 0.404 -4.785 -11.467
61 HH11 ARG 6 1HH1 ARG 6 -0.755 -1.663 -12.483
62 HH12 ARG 6 2HH1 ARG 6 -2.050 -2.309 -13.437
63 HH21 ARG 6 1HH2 ARG 6 -1.296 -5.647 -12.719
64 HH22 ARG 6 2HH2 ARG 6 -2.357 -4.575 -13.570
65 H PHE 7 H PHE 7 3.287 -0.775 -9.601
66 HA PHE 7 HA PHE 7 1.874 0.670 -11.634
67 HB2 PHE 7 2HB PHE 7 0.874 0.551 -9.458
68 HB3 PHE 7 3HB PHE 7 2.323 1.196 -8.694
69 HD1 PHE 7 HD2 PHE 7 0.042 2.210 -11.475
70 HD2 PHE 7 HD1 PHE 7 2.117 3.340 -7.934
71 HE1 PHE 7 HE2 PHE 7 -0.878 4.484 -11.665
72 HE2 PHE 7 HE1 PHE 7 1.202 5.616 -8.120
73 HZ PHE 7 HZ PHE 7 -0.297 6.191 -9.988
74 H VAL 8 H VAL 8 4.590 1.473 -9.472
75 HA VAL 8 HA VAL 8 5.112 4.008 -10.588
76 HB VAL 8 HB VAL 8 7.001 2.150 -9.134
77 HG11 VAL 8 1HG1 VAL 8 7.216 5.109 -9.686
78 HG12 VAL 8 2HG1 VAL 8 8.312 4.169 -8.671
79 HG13 VAL 8 3HG1 VAL 8 8.211 3.841 -10.402
80 HG21 VAL 8 3HG2 VAL 8 4.752 3.693 -8.253
81 HG22 VAL 8 1HG2 VAL 8 5.807 2.629 -7.323
82 HG23 VAL 8 2HG2 VAL 8 6.229 4.328 -7.531
83 H ALA 9 H ALA 9 6.171 0.780 -11.444
84 HA ALA 9 HA ALA 9 8.352 1.299 -13.050
85 HB1 ALA 9 3HB ALA 9 6.197 -0.783 -13.294
86 HB2 ALA 9 1HB ALA 9 7.615 -0.747 -14.343
87 HB3 ALA 9 2HB ALA 9 7.810 -0.954 -12.602
88 H GLY 10 H GLY 10 4.921 1.255 -14.016
89 HA2 GLY 10 2HA GLY 10 5.459 2.046 -16.704
90 HA3 GLY 10 3HA GLY 10 3.886 2.030 -15.922
91 H TYR 11 H TYR 11 4.873 3.781 -13.736
92 HA TYR 11 HA TYR 11 4.216 6.272 -14.963
93 HB2 TYR 11 2HB TYR 11 3.701 5.503 -12.563
94 HB3 TYR 11 3HB TYR 11 5.361 5.961 -12.194
95 HD1 TYR 11 HD1 TYR 11 6.025 8.401 -12.956
96 HD2 TYR 11 HD2 TYR 11 2.035 7.082 -12.295
97 HE1 TYR 11 HE1 TYR 11 5.314 10.734 -12.633
98 HE2 TYR 11 HE2 TYR 11 1.312 9.410 -11.972
99 HH TYR 11 HH TYR 11 3.268 12.071 -12.774
100 H ASP 12 H ASP 12 7.179 4.728 -13.913
101 HA ASP 12 HA ASP 12 8.862 6.987 -14.004
102 HB2 ASP 12 2HB ASP 12 9.299 4.612 -13.040
103 HB3 ASP 12 3HB ASP 12 9.826 4.222 -14.676
104 H ILE 13 H ILE 13 7.705 4.792 -16.471
105 HA ILE 13 HA ILE 13 9.495 5.866 -18.485
106 HB ILE 13 HB ILE 13 7.215 3.905 -18.765
107 HG12 ILE 13 2HG1 ILE 13 9.891 2.876 -19.200
108 HG13 ILE 13 3HG1 ILE 13 9.732 3.565 -17.588
109 HG21 ILE 13 1HG2 ILE 13 8.267 3.376 -20.943
110 HG22 ILE 13 2HG2 ILE 13 7.629 5.018 -20.859
111 HG23 ILE 13 3HG2 ILE 13 9.364 4.737 -20.707
112 HD11 ILE 13 3HD1 ILE 13 7.438 2.077 -17.858
113 HD12 ILE 13 1HD1 ILE 13 8.657 1.102 -18.678
114 HD13 ILE 13 2HD1 ILE 13 8.901 1.592 -17.001
115 H ALA 14 H ALA 14 6.007 5.854 -17.811
116 HA ALA 14 HA ALA 14 5.214 7.396 -20.016
117 HB1 ALA 14 3HB ALA 14 3.416 6.401 -19.025
118 HB2 ALA 14 1HB ALA 14 4.009 6.700 -17.391
119 HB3 ALA 14 2HB ALA 14 3.283 8.012 -18.320
120 H SER 15 H SER 15 6.307 8.318 -16.791
121 HA SER 15 HA SER 15 5.741 11.095 -17.101
122 HB2 SER 15 2HB SER 15 6.832 11.396 -15.011
123 HB3 SER 15 3HB SER 15 6.035 9.827 -14.905
124 HG SER 15 HG SER 15 8.406 10.117 -14.274
125 H HIS 16 H HIS 16 8.416 9.032 -17.917
126 HA HIS 16 HA HIS 16 10.266 11.206 -18.346
127 HB2 HIS 16 2HB HIS 16 10.355 8.262 -18.441
128 HB3 HIS 16 3HB HIS 16 11.392 9.068 -19.614
129 HD1 HIS 16 HD1 HIS 16 13.680 9.203 -18.714
130 HD2 HIS 16 HD2 HIS 16 10.829 9.778 -15.748
131 HE1 HIS 16 HE1 HIS 16 14.981 9.648 -16.608
132 H LYS 17 H LYS 17 8.042 9.297 -20.241
133 HA LYS 17 HA LYS 17 9.065 10.164 -22.782
134 HB2 LYS 17 2HB LYS 17 7.203 8.222 -21.848
135 HB3 LYS 17 3HB LYS 17 6.369 9.257 -22.999
136 HG2 LYS 17 2HG LYS 17 7.211 7.605 -24.357
137 HG3 LYS 17 3HG LYS 17 8.454 8.850 -24.487
138 HD2 LYS 17 2HD LYS 17 9.948 7.678 -23.157
139 HD3 LYS 17 3HD LYS 17 8.675 6.722 -22.396
140 HE2 LYS 17 2HE LYS 17 8.430 5.349 -24.286
141 HE3 LYS 17 3HE LYS 17 9.308 6.474 -25.322
142 HZ1 LYS 17 3HZ LYS 17 10.327 4.466 -23.476
143 HZ2 LYS 17 1HZ LYS 17 11.189 5.921 -23.551
144 HZ3 LYS 17 2HZ LYS 17 10.958 5.002 -24.952
145 H LYS 18 H LYS 18 5.966 10.741 -21.106
146 HA LYS 18 HA LYS 18 5.347 12.974 -22.809
147 HB2 LYS 18 2HB LYS 18 4.018 11.584 -20.529
148 HB3 LYS 18 3HB LYS 18 3.503 13.221 -20.916
149 HG2 LYS 18 2HG LYS 18 3.196 12.398 -23.300
150 HG3 LYS 18 3HG LYS 18 3.366 10.769 -22.639
151 HD2 LYS 18 2HD LYS 18 1.529 12.130 -20.989
152 HD3 LYS 18 3HD LYS 18 1.071 12.484 -22.657
153 HE2 LYS 18 2HE LYS 18 1.511 9.862 -22.892
154 HE3 LYS 18 3HE LYS 18 1.080 9.911 -21.183
155 HZ1 LYS 18 3HZ LYS 18 -0.649 11.361 -23.031
156 HZ2 LYS 18 1HZ LYS 18 -1.045 10.485 -21.640
157 HZ3 LYS 18 2HZ LYS 18 -0.719 9.672 -23.086
158 H LYS 19 H LYS 19 5.960 12.640 -19.311
159 HA LYS 19 HA LYS 19 6.791 14.088 -17.765
160 HB2 LYS 19 2HB LYS 19 8.603 14.142 -19.641
161 HB3 LYS 19 3HB LYS 19 7.972 15.751 -19.965
162 HG2 LYS 19 2HG LYS 19 8.445 15.414 -17.152
163 HG3 LYS 19 3HG LYS 19 9.895 15.020 -18.077
164 HD2 LYS 19 2HD LYS 19 9.569 17.194 -19.305
165 HD3 LYS 19 3HD LYS 19 8.311 17.584 -18.129
166 HE2 LYS 19 2HE LYS 19 9.883 18.366 -16.770
167 HE3 LYS 19 3HE LYS 19 10.552 16.740 -16.653
168 HZ1 LYS 19 3HZ LYS 19 11.901 17.217 -18.619
169 HZ2 LYS 19 1HZ LYS 19 12.236 18.294 -17.359
170 HZ3 LYS 19 2HZ LYS 19 11.289 18.793 -18.668
171 H THR 20 H THR 20 4.630 14.791 -17.312
172 HA THR 20 HA THR 20 4.310 17.642 -17.717
173 HB THR 20 HB THR 20 3.122 16.947 -19.658
174 HG1 THR 20 HG1 THR 20 1.888 18.472 -18.692
175 HG21 THR 20 1HG2 THR 20 2.894 14.563 -19.032
176 HG22 THR 20 2HG2 THR 20 1.395 15.247 -19.659
177 HG23 THR 20 3HG2 THR 20 1.594 15.003 -17.925
178 H GLY 21 H GLY 21 2.674 18.580 -16.330
179 HA2 GLY 21 2HA GLY 21 1.799 16.794 -14.151
180 HA3 GLY 21 3HA GLY 21 2.622 18.305 -13.790
181 H GLY 22 H GLY 22 1.561 20.298 -14.263
182 HA2 GLY 22 2HA GLY 22 -1.224 20.206 -15.085
183 HA3 GLY 22 3HA GLY 22 -0.953 20.655 -13.408
184 H TYR 23 H TYR 23 -0.352 22.703 -12.921
185 HA TYR 23 HA TYR 23 -0.679 24.706 -14.905
186 HB2 TYR 23 2HB TYR 23 0.028 24.680 -12.004
187 HB3 TYR 23 3HB TYR 23 0.323 26.149 -12.926
188 HD1 TYR 23 HD1 TYR 23 -1.898 26.448 -14.678
189 HD2 TYR 23 HD2 TYR 23 -1.863 24.915 -10.709
190 HE1 TYR 23 HE1 TYR 23 -4.257 27.090 -14.416
191 HE2 TYR 23 HE2 TYR 23 -4.223 25.552 -10.437
192 HH TYR 23 HH TYR 23 -6.265 26.004 -12.572
193 HA PRO 24 HA PRO 24 3.381 25.367 -16.429
194 HB2 PRO 24 2HB PRO 24 3.504 28.073 -16.602
195 HB3 PRO 24 3HB PRO 24 2.523 27.085 -17.691
196 HG2 PRO 24 2HG PRO 24 1.689 28.626 -15.264
197 HG3 PRO 24 3HG PRO 24 0.884 28.497 -16.839
198 HD2 PRO 24 2HD PRO 24 0.092 27.072 -14.676
199 HD3 PRO 24 3HD PRO 24 -0.051 26.451 -16.334
200 H TRP 25 H TRP 25 2.473 27.080 -13.506
201 HA TRP 25 HA TRP 25 5.293 27.474 -12.810
202 HB2 TRP 25 2HB TRP 25 4.309 28.805 -10.884
203 HB3 TRP 25 3HB TRP 25 4.029 29.462 -12.495
204 HD1 TRP 25 HD1 TRP 25 1.570 29.893 -13.175
205 HE1 TRP 25 HE1 TRP 25 -0.717 29.451 -12.081
206 HE3 TRP 25 HE3 TRP 25 3.091 26.974 -9.263
207 HZ2 TRP 25 HZ2 TRP 25 -1.741 28.051 -9.853
208 HZ3 TRP 25 HZ3 TRP 25 1.395 26.124 -7.696
209 HH2 TRP 25 HH2 TRP 25 -0.970 26.654 -7.986
210 H GLU 26 H GLU 26 2.628 25.440 -12.166
211 HA GLU 26 HA GLU 26 3.723 24.530 -9.614
212 HB2 GLU 26 2HB GLU 26 1.160 24.882 -10.352
213 HB3 GLU 26 3HB GLU 26 1.358 23.193 -10.801
214 HG2 GLU 26 2HG GLU 26 2.299 23.995 -8.114
215 HG3 GLU 26 3HG GLU 26 0.557 23.960 -8.387
216 H ARG 27 H ARG 27 5.444 24.011 -11.654
217 HA ARG 27 HA ARG 27 5.100 21.127 -12.152
218 HB2 ARG 27 2HB ARG 27 6.536 21.386 -14.102
219 HB3 ARG 27 3HB ARG 27 5.162 22.477 -14.208
220 HG2 ARG 27 2HG ARG 27 6.592 24.319 -13.426
221 HG3 ARG 27 3HG ARG 27 7.967 23.213 -13.402
222 HD2 ARG 27 2HD ARG 27 6.418 23.356 -15.917
223 HD3 ARG 27 3HD ARG 27 7.370 24.778 -15.495
224 HE ARG 27 HE ARG 27 8.871 22.356 -15.276
225 HH11 ARG 27 1HH1 ARG 27 7.709 24.762 -17.510
226 HH12 ARG 27 2HH1 ARG 27 8.972 24.487 -18.665
227 HH21 ARG 27 1HH2 ARG 27 10.538 21.986 -16.788
228 HH22 ARG 27 2HH2 ARG 27 10.579 22.908 -18.253
229 H GLY 28 H GLY 28 6.166 22.306 -9.728
230 HA2 GLY 28 2HA GLY 28 9.039 21.776 -9.906
231 HA3 GLY 28 3HA GLY 28 8.200 22.483 -8.534
232 H LYS 29 H LYS 29 6.946 21.081 -7.162
233 HA LYS 29 HA LYS 29 7.338 18.218 -7.458
234 HB2 LYS 29 2HB LYS 29 8.337 17.966 -5.223
235 HB3 LYS 29 3HB LYS 29 9.373 18.891 -6.302
236 HG2 LYS 29 2HG LYS 29 8.825 20.929 -5.228
237 HG3 LYS 29 3HG LYS 29 7.510 20.174 -4.324
238 HD2 LYS 29 2HD LYS 29 9.099 20.160 -2.695
239 HD3 LYS 29 3HD LYS 29 9.512 18.633 -3.479
240 HE2 LYS 29 2HE LYS 29 11.574 19.457 -3.686
241 HE3 LYS 29 3HE LYS 29 10.915 20.505 -4.941
242 HZ1 LYS 29 3HZ LYS 29 11.648 22.152 -3.651
243 HZ2 LYS 29 1HZ LYS 29 11.817 21.162 -2.289
244 HZ3 LYS 29 2HZ LYS 29 10.310 21.832 -2.666
245 H ALA 30 H ALA 30 5.962 16.966 -6.127
246 HA ALA 30 HA ALA 30 3.412 17.973 -5.711
247 HB1 ALA 30 3HB ALA 30 3.768 15.613 -5.931
248 HB2 ALA 30 1HB ALA 30 4.750 15.578 -4.465
249 HB3 ALA 30 2HB ALA 30 3.022 15.918 -4.362
Start of MODEL 5
1 H1 MET 1 H MET 1 1.646 1.671 -1.821
2 HA MET 1 HA MET 1 1.161 -0.881 -0.793
3 HB2 MET 1 2HB MET 1 1.085 0.403 -3.438
4 HB3 MET 1 3HB MET 1 1.358 -1.334 -3.481
5 HG2 MET 1 2HG MET 1 -0.704 -1.024 -1.664
6 HG3 MET 1 3HG MET 1 -1.059 0.151 -2.928
7 HE1 MET 1 3HE MET 1 -3.392 -2.918 -3.706
8 HE2 MET 1 1HE MET 1 -2.692 -2.850 -2.089
9 HE3 MET 1 2HE MET 1 -3.257 -1.371 -2.866
10 H LYS 2 H LYS 2 2.236 -2.829 -0.936
11 HA LYS 2 HA LYS 2 5.093 -2.686 -1.014
12 HB2 LYS 2 2HB LYS 2 3.561 -4.227 0.415
13 HB3 LYS 2 3HB LYS 2 3.538 -5.257 -1.011
14 HG2 LYS 2 2HG LYS 2 6.232 -4.591 -0.536
15 HG3 LYS 2 3HG LYS 2 5.527 -5.034 1.021
16 HD2 LYS 2 2HD LYS 2 5.066 -6.724 -1.412
17 HD3 LYS 2 3HD LYS 2 6.546 -6.890 -0.463
18 HE2 LYS 2 2HE LYS 2 5.481 -8.110 1.057
19 HE3 LYS 2 3HE LYS 2 4.286 -6.835 1.292
20 HZ1 LYS 2 3HZ LYS 2 3.541 -9.158 0.474
21 HZ2 LYS 2 1HZ LYS 2 4.070 -8.614 -1.039
22 HZ3 LYS 2 2HZ LYS 2 2.853 -7.776 -0.216
23 H THR 3 H THR 3 2.581 -3.755 -3.202
24 HA THR 3 HA THR 3 4.597 -4.714 -5.106
25 HB THR 3 HB THR 3 2.688 -6.217 -4.627
26 HG1 THR 3 HG1 THR 3 2.034 -6.293 -7.002
27 HG21 THR 3 1HG2 THR 3 1.070 -3.991 -5.869
28 HG22 THR 3 2HG2 THR 3 0.939 -4.602 -4.220
29 HG23 THR 3 3HG2 THR 3 0.470 -5.623 -5.579
30 H ILE 4 H ILE 4 4.028 -1.858 -4.494
31 HA ILE 4 HA ILE 4 2.600 -0.724 -6.673
32 HB ILE 4 HB ILE 4 3.070 0.430 -4.489
33 HG12 ILE 4 2HG1 ILE 4 3.957 1.959 -6.944
34 HG13 ILE 4 3HG1 ILE 4 2.278 1.596 -6.557
35 HG21 ILE 4 1HG2 ILE 4 5.501 -0.227 -4.484
36 HG22 ILE 4 2HG2 ILE 4 5.762 1.036 -5.685
37 HG23 ILE 4 3HG2 ILE 4 5.166 1.456 -4.079
38 HD11 ILE 4 3HD1 ILE 4 2.195 3.470 -5.397
39 HD12 ILE 4 1HD1 ILE 4 3.369 2.794 -4.270
40 HD13 ILE 4 2HD1 ILE 4 3.918 3.747 -5.649
41 H LEU 5 H LEU 5 5.617 -2.199 -6.491
42 HA LEU 5 HA LEU 5 7.269 -0.728 -8.140
43 HB2 LEU 5 2HB LEU 5 8.511 -2.674 -8.479
44 HB3 LEU 5 3HB LEU 5 7.750 -2.897 -6.905
45 HG LEU 5 HG LEU 5 5.944 -4.162 -8.401
46 HD11 LEU 5 1HD1 LEU 5 6.583 -4.755 -10.443
47 HD12 LEU 5 2HD1 LEU 5 8.158 -5.298 -9.865
48 HD13 LEU 5 3HD1 LEU 5 7.910 -3.603 -10.284
49 HD21 LEU 5 3HD2 LEU 5 7.296 -6.260 -7.953
50 HD22 LEU 5 1HD2 LEU 5 6.955 -5.231 -6.560
51 HD23 LEU 5 2HD2 LEU 5 8.549 -5.196 -7.313
52 H ARG 6 H ARG 6 4.574 -2.811 -8.998
53 HA ARG 6 HA ARG 6 5.085 -2.789 -11.807
54 HB2 ARG 6 2HB ARG 6 2.986 -3.892 -12.041
55 HB3 ARG 6 3HB ARG 6 3.730 -4.521 -10.578
56 HG2 ARG 6 2HG ARG 6 1.650 -4.174 -9.769
57 HG3 ARG 6 3HG ARG 6 2.301 -2.558 -9.488
58 HD2 ARG 6 2HD ARG 6 0.427 -1.937 -10.591
59 HD3 ARG 6 3HD ARG 6 1.435 -2.251 -12.003
60 HE ARG 6 HE ARG 6 0.169 -4.636 -11.312
61 HH11 ARG 6 1HH1 ARG 6 -0.665 -1.461 -12.473
62 HH12 ARG 6 2HH1 ARG 6 -2.075 -2.000 -13.324
63 HH21 ARG 6 1HH2 ARG 6 -1.685 -5.358 -12.429
64 HH22 ARG 6 2HH2 ARG 6 -2.655 -4.217 -13.297
65 H PHE 7 H PHE 7 3.272 -0.770 -9.599
66 HA PHE 7 HA PHE 7 1.874 0.669 -11.645
67 HB2 PHE 7 2HB PHE 7 0.863 0.567 -9.473
68 HB3 PHE 7 3HB PHE 7 2.311 1.210 -8.706
69 HD1 PHE 7 HD2 PHE 7 0.043 2.218 -11.498
70 HD2 PHE 7 HD1 PHE 7 2.117 3.360 -7.960
71 HE1 PHE 7 HE2 PHE 7 -0.865 4.495 -11.705
72 HE2 PHE 7 HE1 PHE 7 1.211 5.639 -8.161
73 HZ PHE 7 HZ PHE 7 -0.280 6.210 -10.036
74 H VAL 8 H VAL 8 4.589 1.466 -9.482
75 HA VAL 8 HA VAL 8 5.125 3.996 -10.607
76 HB VAL 8 HB VAL 8 6.998 2.140 -9.133
77 HG11 VAL 8 1HG1 VAL 8 8.223 3.815 -10.405
78 HG12 VAL 8 2HG1 VAL 8 7.231 5.094 -9.701
79 HG13 VAL 8 3HG1 VAL 8 8.318 4.153 -8.676
80 HG21 VAL 8 3HG2 VAL 8 5.799 2.636 -7.329
81 HG22 VAL 8 1HG2 VAL 8 6.229 4.331 -7.549
82 HG23 VAL 8 2HG2 VAL 8 4.751 3.696 -8.272
83 H ALA 9 H ALA 9 6.173 0.758 -11.439
84 HA ALA 9 HA ALA 9 8.365 1.257 -13.037
85 HB1 ALA 9 3HB ALA 9 7.577 -0.788 -14.341
86 HB2 ALA 9 1HB ALA 9 7.850 -0.989 -12.610
87 HB3 ALA 9 2HB ALA 9 6.208 -0.821 -13.231
88 H GLY 10 H GLY 10 4.938 1.219 -14.022
89 HA2 GLY 10 2HA GLY 10 5.494 1.996 -16.712
90 HA3 GLY 10 3HA GLY 10 3.916 1.987 -15.938
91 H TYR 11 H TYR 11 4.895 3.746 -13.756
92 HA TYR 11 HA TYR 11 4.248 6.233 -14.996
93 HB2 TYR 11 2HB TYR 11 3.728 5.472 -12.592
94 HB3 TYR 11 3HB TYR 11 5.384 5.940 -12.222
95 HD1 TYR 11 HD1 TYR 11 6.039 8.377 -13.002
96 HD2 TYR 11 HD2 TYR 11 2.054 7.044 -12.335
97 HE1 TYR 11 HE1 TYR 11 5.317 10.708 -12.697
98 HE2 TYR 11 HE2 TYR 11 1.320 9.372 -12.029
99 HH TYR 11 HH TYR 11 2.621 11.857 -13.022
100 H ASP 12 H ASP 12 7.205 4.687 -13.929
101 HA ASP 12 HA ASP 12 8.894 6.941 -14.019
102 HB2 ASP 12 2HB ASP 12 9.328 4.573 -13.047
103 HB3 ASP 12 3HB ASP 12 9.842 4.167 -14.682
104 H ILE 13 H ILE 13 7.651 4.829 -16.492
105 HA ILE 13 HA ILE 13 9.478 5.866 -18.503
106 HB ILE 13 HB ILE 13 7.184 3.924 -18.787
107 HG12 ILE 13 2HG1 ILE 13 9.844 2.870 -19.235
108 HG13 ILE 13 3HG1 ILE 13 9.707 3.562 -17.623
109 HG21 ILE 13 1HG2 ILE 13 8.869 5.284 -20.728
110 HG22 ILE 13 2HG2 ILE 13 8.920 3.529 -20.887
111 HG23 ILE 13 3HG2 ILE 13 7.376 4.375 -20.964
112 HD11 ILE 13 3HD1 ILE 13 8.876 1.588 -17.036
113 HD12 ILE 13 1HD1 ILE 13 7.399 2.104 -17.851
114 HD13 ILE 13 2HD1 ILE 13 8.581 1.115 -18.710
115 H ALA 14 H ALA 14 5.992 5.881 -17.821
116 HA ALA 14 HA ALA 14 5.219 7.449 -20.020
117 HB1 ALA 14 3HB ALA 14 3.877 7.268 -17.326
118 HB2 ALA 14 1HB ALA 14 3.139 7.803 -18.837
119 HB3 ALA 14 2HB ALA 14 3.657 6.126 -18.653
120 H SER 15 H SER 15 6.348 8.307 -16.798
121 HA SER 15 HA SER 15 5.756 11.087 -17.023
122 HB2 SER 15 2HB SER 15 6.033 9.923 -14.845
123 HB3 SER 15 3HB SER 15 7.749 9.721 -15.198
124 HG SER 15 HG SER 15 6.536 11.813 -14.112
125 H HIS 16 H HIS 16 8.414 9.066 -17.975
126 HA HIS 16 HA HIS 16 10.261 11.243 -18.367
127 HB2 HIS 16 2HB HIS 16 11.165 9.074 -17.812
128 HB3 HIS 16 3HB HIS 16 10.355 8.335 -19.189
129 HD1 HIS 16 HD1 HIS 16 11.732 8.106 -21.235
130 HD2 HIS 16 HD2 HIS 16 13.204 11.044 -18.693
131 HE1 HIS 16 HE1 HIS 16 13.882 8.885 -22.282
132 H LYS 17 H LYS 17 7.983 9.427 -20.303
133 HA LYS 17 HA LYS 17 8.917 10.466 -22.814
134 HB2 LYS 17 2HB LYS 17 7.089 8.450 -21.941
135 HB3 LYS 17 3HB LYS 17 6.243 9.531 -23.040
136 HG2 LYS 17 2HG LYS 17 7.090 8.223 -24.639
137 HG3 LYS 17 3HG LYS 17 8.579 9.133 -24.373
138 HD2 LYS 17 2HD LYS 17 9.496 7.446 -23.019
139 HD3 LYS 17 3HD LYS 17 7.931 6.658 -22.797
140 HE2 LYS 17 2HE LYS 17 8.497 6.779 -25.583
141 HE3 LYS 17 3HE LYS 17 9.914 6.135 -24.755
142 HZ1 LYS 17 3HZ LYS 17 8.707 4.356 -23.912
143 HZ2 LYS 17 1HZ LYS 17 8.115 4.507 -25.491
144 HZ3 LYS 17 2HZ LYS 17 7.209 5.095 -24.188
145 H LYS 18 H LYS 18 5.919 10.925 -20.936
146 HA LYS 18 HA LYS 18 5.149 13.202 -22.512
147 HB2 LYS 18 2HB LYS 18 3.995 11.642 -20.275
148 HB3 LYS 18 3HB LYS 18 3.498 13.326 -20.380
149 HG2 LYS 18 2HG LYS 18 3.007 12.780 -22.858
150 HG3 LYS 18 3HG LYS 18 3.041 11.099 -22.318
151 HD2 LYS 18 2HD LYS 18 1.006 11.275 -21.430
152 HD3 LYS 18 3HD LYS 18 1.467 12.721 -20.527
153 HE2 LYS 18 2HE LYS 18 -0.273 13.445 -21.904
154 HE3 LYS 18 3HE LYS 18 1.184 13.964 -22.750
155 HZ1 LYS 18 3HZ LYS 18 0.631 12.735 -24.493
156 HZ2 LYS 18 1HZ LYS 18 -0.859 12.415 -23.758
157 HZ3 LYS 18 2HZ LYS 18 0.435 11.347 -23.547
158 H LYS 19 H LYS 19 5.983 12.776 -19.069
159 HA LYS 19 HA LYS 19 6.870 14.197 -17.530
160 HB2 LYS 19 2HB LYS 19 8.698 14.202 -19.276
161 HB3 LYS 19 3HB LYS 19 8.010 15.701 -19.887
162 HG2 LYS 19 2HG LYS 19 9.528 16.622 -18.507
163 HG3 LYS 19 3HG LYS 19 8.269 16.353 -17.300
164 HD2 LYS 19 2HD LYS 19 9.791 15.187 -16.157
165 HD3 LYS 19 3HD LYS 19 9.622 13.940 -17.394
166 HE2 LYS 19 2HE LYS 19 11.838 14.232 -17.646
167 HE3 LYS 19 3HE LYS 19 11.354 15.625 -18.610
168 HZ1 LYS 19 3HZ LYS 19 11.725 17.068 -16.802
169 HZ2 LYS 19 1HZ LYS 19 13.078 16.054 -16.860
170 HZ3 LYS 19 2HZ LYS 19 11.875 15.795 -15.699
171 H THR 20 H THR 20 4.702 14.919 -17.044
172 HA THR 20 HA THR 20 4.419 17.787 -17.485
173 HB THR 20 HB THR 20 3.036 17.023 -19.256
174 HG1 THR 20 HG1 THR 20 1.159 17.957 -18.630
175 HG21 THR 20 1HG2 THR 20 1.301 15.331 -18.990
176 HG22 THR 20 2HG2 THR 20 1.736 15.129 -17.292
177 HG23 THR 20 3HG2 THR 20 2.877 14.669 -18.556
178 H GLY 21 H GLY 21 2.925 18.805 -15.992
179 HA2 GLY 21 2HA GLY 21 2.972 17.473 -13.409
180 HA3 GLY 21 3HA GLY 21 2.539 19.148 -13.713
181 H GLY 22 H GLY 22 0.520 18.889 -15.564
182 HA2 GLY 22 2HA GLY 22 -1.589 17.747 -15.873
183 HA3 GLY 22 3HA GLY 22 -1.475 17.192 -14.210
184 H TYR 23 H TYR 23 -2.721 19.547 -16.294
185 HA TYR 23 HA TYR 23 -3.007 21.709 -14.485
186 HB2 TYR 23 2HB TYR 23 -4.217 20.960 -17.110
187 HB3 TYR 23 3HB TYR 23 -4.986 22.230 -16.164
188 HD1 TYR 23 HD1 TYR 23 -2.877 23.771 -15.039
189 HD2 TYR 23 HD2 TYR 23 -3.011 21.877 -18.847
190 HE1 TYR 23 HE1 TYR 23 -1.251 25.403 -15.901
191 HE2 TYR 23 HE2 TYR 23 -1.385 23.503 -19.720
192 HH TYR 23 HH TYR 23 0.341 25.007 -18.887
193 HA PRO 24 HA PRO 24 -6.434 20.590 -11.986
194 HB2 PRO 24 2HB PRO 24 -7.822 22.918 -11.826
195 HB3 PRO 24 3HB PRO 24 -6.275 22.664 -11.009
196 HG2 PRO 24 2HG PRO 24 -6.845 24.069 -13.590
197 HG3 PRO 24 3HG PRO 24 -5.762 24.548 -12.271
198 HD2 PRO 24 2HD PRO 24 -4.863 23.381 -14.543
199 HD3 PRO 24 3HD PRO 24 -4.081 23.134 -12.969
200 H TRP 25 H TRP 25 -7.133 22.114 -15.068
201 HA TRP 25 HA TRP 25 -9.859 21.040 -15.028
202 HB2 TRP 25 2HB TRP 25 -10.095 22.402 -17.158
203 HB3 TRP 25 3HB TRP 25 -9.830 23.325 -15.681
204 HD1 TRP 25 HD1 TRP 25 -7.816 24.948 -15.657
205 HE1 TRP 25 HE1 TRP 25 -5.903 25.487 -17.293
206 HE3 TRP 25 HE3 TRP 25 -8.519 21.152 -19.010
207 HZ2 TRP 25 HZ2 TRP 25 -4.834 24.443 -19.687
208 HZ3 TRP 25 HZ3 TRP 25 -7.009 20.993 -20.946
209 HH2 TRP 25 HH2 TRP 25 -5.205 22.606 -21.276
210 H GLU 26 H GLU 26 -6.753 20.426 -16.299
211 HA GLU 26 HA GLU 26 -7.786 18.770 -18.475
212 HB2 GLU 26 2HB GLU 26 -5.634 20.385 -18.424
213 HB3 GLU 26 3HB GLU 26 -4.875 18.882 -17.916
214 HG2 GLU 26 2HG GLU 26 -5.501 17.784 -19.917
215 HG3 GLU 26 3HG GLU 26 -6.573 19.102 -20.384
216 H ARG 27 H ARG 27 -8.386 17.925 -15.850
217 HA ARG 27 HA ARG 27 -6.788 15.454 -15.699
218 HB2 ARG 27 2HB ARG 27 -6.525 17.162 -13.786
219 HB3 ARG 27 3HB ARG 27 -8.150 16.682 -13.315
220 HG2 ARG 27 2HG ARG 27 -7.479 14.486 -12.829
221 HG3 ARG 27 3HG ARG 27 -5.944 14.683 -13.676
222 HD2 ARG 27 2HD ARG 27 -5.635 16.611 -11.882
223 HD3 ARG 27 3HD ARG 27 -6.761 15.603 -10.973
224 HE ARG 27 HE ARG 27 -4.676 14.012 -12.004
225 HH11 ARG 27 1HH1 ARG 27 -5.297 16.431 -9.578
226 HH12 ARG 27 2HH1 ARG 27 -4.043 15.877 -8.518
227 HH21 ARG 27 1HH2 ARG 27 -3.022 13.273 -10.617
228 HH22 ARG 27 2HH2 ARG 27 -2.749 14.082 -9.111
229 H GLY 28 H GLY 28 -9.300 16.074 -17.143
230 HA2 GLY 28 2HA GLY 28 -10.879 14.280 -17.597
231 HA3 GLY 28 3HA GLY 28 -10.971 14.003 -15.864
232 H LYS 29 H LYS 29 -11.818 16.251 -18.445
233 HA LYS 29 HA LYS 29 -13.298 18.094 -16.982
234 HB2 LYS 29 2HB LYS 29 -13.558 17.110 -19.816
235 HB3 LYS 29 3HB LYS 29 -14.597 18.375 -19.173
236 HG2 LYS 29 2HG LYS 29 -11.912 19.050 -18.555
237 HG3 LYS 29 3HG LYS 29 -11.993 18.605 -20.262
238 HD2 LYS 29 2HD LYS 29 -14.029 20.456 -19.080
239 HD3 LYS 29 3HD LYS 29 -12.445 21.064 -19.567
240 HE2 LYS 29 2HE LYS 29 -14.342 19.544 -21.353
241 HE3 LYS 29 3HE LYS 29 -14.165 21.297 -21.330
242 HZ1 LYS 29 3HZ LYS 29 -11.617 20.296 -21.625
243 HZ2 LYS 29 1HZ LYS 29 -12.560 21.041 -22.815
244 HZ3 LYS 29 2HZ LYS 29 -12.575 19.358 -22.657
245 H ALA 30 H ALA 30 -14.064 14.843 -17.905
246 HA ALA 30 HA ALA 30 -16.772 15.181 -16.787
247 HB1 ALA 30 3HB ALA 30 -16.311 14.427 -19.298
248 HB2 ALA 30 1HB ALA 30 -16.193 12.849 -18.520
249 HB3 ALA 30 2HB ALA 30 -17.666 13.806 -18.357
Start of MODEL 6
1 H1 MET 1 H MET 1 2.282 1.441 -0.657
2 HA MET 1 HA MET 1 0.603 -0.925 -0.978
3 HB2 MET 1 2HB MET 1 1.374 0.955 -3.154
4 HB3 MET 1 3HB MET 1 1.410 -0.766 -3.514
5 HG2 MET 1 2HG MET 1 -0.836 -0.973 -3.440
6 HG3 MET 1 3HG MET 1 -1.018 0.247 -2.182
7 HE1 MET 1 3HE MET 1 -3.175 0.947 -3.385
8 HE2 MET 1 1HE MET 1 -3.259 1.755 -4.950
9 HE3 MET 1 2HE MET 1 -3.006 0.012 -4.871
10 H LYS 2 H LYS 2 1.740 -2.811 -1.388
11 HA LYS 2 HA LYS 2 4.598 -2.649 -0.848
12 HB2 LYS 2 2HB LYS 2 2.490 -4.698 -0.554
13 HB3 LYS 2 3HB LYS 2 4.078 -5.309 -1.001
14 HG2 LYS 2 2HG LYS 2 4.323 -5.377 1.242
15 HG3 LYS 2 3HG LYS 2 4.811 -3.699 0.991
16 HD2 LYS 2 2HD LYS 2 2.501 -2.982 1.467
17 HD3 LYS 2 3HD LYS 2 2.060 -4.663 1.775
18 HE2 LYS 2 2HE LYS 2 2.453 -3.677 3.890
19 HE3 LYS 2 3HE LYS 2 3.857 -4.686 3.544
20 HZ1 LYS 2 3HZ LYS 2 4.941 -2.599 2.700
21 HZ2 LYS 2 1HZ LYS 2 4.678 -2.658 4.370
22 HZ3 LYS 2 2HZ LYS 2 3.658 -1.735 3.385
23 H THR 3 H THR 3 2.393 -3.975 -3.286
24 HA THR 3 HA THR 3 4.660 -4.628 -5.012
25 HB THR 3 HB THR 3 2.848 -6.299 -4.751
26 HG1 THR 3 HG1 THR 3 4.125 -6.038 -6.745
27 HG21 THR 3 1HG2 THR 3 0.717 -5.653 -4.797
28 HG22 THR 3 2HG2 THR 3 0.899 -5.234 -6.500
29 HG23 THR 3 3HG2 THR 3 1.196 -4.020 -5.255
30 H ILE 4 H ILE 4 4.075 -1.864 -4.500
31 HA ILE 4 HA ILE 4 2.628 -0.727 -6.669
32 HB ILE 4 HB ILE 4 3.104 0.425 -4.484
33 HG12 ILE 4 2HG1 ILE 4 3.981 1.957 -6.940
34 HG13 ILE 4 3HG1 ILE 4 2.305 1.593 -6.546
35 HG21 ILE 4 1HG2 ILE 4 5.537 -0.232 -4.490
36 HG22 ILE 4 2HG2 ILE 4 5.791 1.035 -5.690
37 HG23 ILE 4 3HG2 ILE 4 5.202 1.450 -4.081
38 HD11 ILE 4 3HD1 ILE 4 4.016 3.699 -5.572
39 HD12 ILE 4 1HD1 ILE 4 2.265 3.525 -5.467
40 HD13 ILE 4 2HD1 ILE 4 3.301 2.775 -4.251
41 H LEU 5 H LEU 5 5.646 -2.200 -6.501
42 HA LEU 5 HA LEU 5 7.291 -0.724 -8.154
43 HB2 LEU 5 2HB LEU 5 8.533 -2.669 -8.500
44 HB3 LEU 5 3HB LEU 5 7.778 -2.895 -6.923
45 HG LEU 5 HG LEU 5 5.968 -4.160 -8.414
46 HD11 LEU 5 1HD1 LEU 5 6.616 -4.827 -10.440
47 HD12 LEU 5 2HD1 LEU 5 8.238 -5.235 -9.882
48 HD13 LEU 5 3HD1 LEU 5 7.852 -3.573 -10.331
49 HD21 LEU 5 3HD2 LEU 5 7.351 -5.003 -6.491
50 HD22 LEU 5 1HD2 LEU 5 8.573 -5.475 -7.673
51 HD23 LEU 5 2HD2 LEU 5 6.967 -6.202 -7.728
52 H ARG 6 H ARG 6 4.595 -2.809 -9.004
53 HA ARG 6 HA ARG 6 5.096 -2.784 -11.814
54 HB2 ARG 6 2HB ARG 6 3.003 -3.894 -12.043
55 HB3 ARG 6 3HB ARG 6 3.743 -4.514 -10.573
56 HG2 ARG 6 2HG ARG 6 1.668 -4.162 -9.763
57 HG3 ARG 6 3HG ARG 6 2.306 -2.537 -9.508
58 HD2 ARG 6 2HD ARG 6 0.518 -1.859 -10.675
59 HD3 ARG 6 3HD ARG 6 1.422 -2.403 -12.088
60 HE ARG 6 HE ARG 6 -0.005 -4.571 -11.012
61 HH11 ARG 6 1HH1 ARG 6 -0.537 -1.577 -12.706
62 HH12 ARG 6 2HH1 ARG 6 -1.991 -2.119 -13.475
63 HH21 ARG 6 1HH2 ARG 6 -1.918 -5.298 -12.019
64 HH22 ARG 6 2HH2 ARG 6 -2.776 -4.236 -13.083
65 H PHE 7 H PHE 7 3.289 -0.767 -9.597
66 HA PHE 7 HA PHE 7 1.884 0.674 -11.637
67 HB2 PHE 7 2HB PHE 7 0.880 0.568 -9.462
68 HB3 PHE 7 3HB PHE 7 2.331 1.211 -8.699
69 HD1 PHE 7 HD2 PHE 7 0.056 2.223 -11.484
70 HD2 PHE 7 HD1 PHE 7 2.134 3.358 -7.948
71 HE1 PHE 7 HE2 PHE 7 -0.855 4.499 -11.686
72 HE2 PHE 7 HE1 PHE 7 1.226 5.637 -8.143
73 HZ PHE 7 HZ PHE 7 -0.269 6.210 -10.014
74 H VAL 8 H VAL 8 4.601 1.476 -9.477
75 HA VAL 8 HA VAL 8 5.132 4.005 -10.603
76 HB VAL 8 HB VAL 8 7.013 2.147 -9.140
77 HG11 VAL 8 1HG1 VAL 8 8.230 3.828 -10.413
78 HG12 VAL 8 2HG1 VAL 8 7.240 5.103 -9.701
79 HG13 VAL 8 3HG1 VAL 8 8.333 4.161 -8.684
80 HG21 VAL 8 3HG2 VAL 8 5.820 2.637 -7.330
81 HG22 VAL 8 1HG2 VAL 8 6.248 4.335 -7.547
82 HG23 VAL 8 2HG2 VAL 8 4.768 3.700 -8.267
83 H ALA 9 H ALA 9 6.181 0.769 -11.444
84 HA ALA 9 HA ALA 9 8.365 1.276 -13.050
85 HB1 ALA 9 3HB ALA 9 7.814 -0.973 -12.593
86 HB2 ALA 9 1HB ALA 9 6.203 -0.800 -13.288
87 HB3 ALA 9 2HB ALA 9 7.623 -0.775 -14.335
88 H GLY 10 H GLY 10 4.934 1.239 -14.018
89 HA2 GLY 10 2HA GLY 10 5.476 2.016 -16.710
90 HA3 GLY 10 3HA GLY 10 3.903 2.009 -15.928
91 H TYR 11 H TYR 11 4.895 3.765 -13.750
92 HA TYR 11 HA TYR 11 4.246 6.254 -14.987
93 HB2 TYR 11 2HB TYR 11 3.731 5.495 -12.583
94 HB3 TYR 11 3HB TYR 11 5.390 5.953 -12.217
95 HD1 TYR 11 HD1 TYR 11 6.059 8.389 -12.976
96 HD2 TYR 11 HD2 TYR 11 2.062 7.077 -12.339
97 HE1 TYR 11 HE1 TYR 11 5.349 10.722 -12.664
98 HE2 TYR 11 HE2 TYR 11 1.340 9.407 -12.027
99 HH TYR 11 HH TYR 11 3.644 12.036 -11.847
100 H ASP 12 H ASP 12 7.205 4.705 -13.926
101 HA ASP 12 HA ASP 12 8.896 6.957 -14.026
102 HB2 ASP 12 2HB ASP 12 9.325 4.585 -13.056
103 HB3 ASP 12 3HB ASP 12 9.847 4.186 -14.691
104 H ILE 13 H ILE 13 7.668 4.818 -16.490
105 HA ILE 13 HA ILE 13 9.482 5.865 -18.508
106 HB ILE 13 HB ILE 13 7.201 3.902 -18.781
107 HG12 ILE 13 2HG1 ILE 13 9.877 2.876 -19.224
108 HG13 ILE 13 3HG1 ILE 13 9.721 3.564 -17.612
109 HG21 ILE 13 1HG2 ILE 13 7.662 5.076 -20.866
110 HG22 ILE 13 2HG2 ILE 13 9.369 4.662 -20.734
111 HG23 ILE 13 3HG2 ILE 13 8.170 3.391 -20.969
112 HD11 ILE 13 3HD1 ILE 13 7.431 2.078 -17.862
113 HD12 ILE 13 1HD1 ILE 13 8.633 1.105 -18.707
114 HD13 ILE 13 2HD1 ILE 13 8.905 1.582 -17.031
115 H ALA 14 H ALA 14 6.006 5.883 -17.789
116 HA ALA 14 HA ALA 14 5.210 7.424 -20.005
117 HB1 ALA 14 3HB ALA 14 3.907 7.176 -17.296
118 HB2 ALA 14 1HB ALA 14 3.146 7.828 -18.747
119 HB3 ALA 14 2HB ALA 14 3.625 6.131 -18.688
120 H SER 15 H SER 15 6.318 8.315 -16.780
121 HA SER 15 HA SER 15 5.731 11.092 -17.047
122 HB2 SER 15 2HB SER 15 5.967 9.976 -14.849
123 HB3 SER 15 3HB SER 15 7.682 9.728 -15.175
124 HG SER 15 HG SER 15 6.365 11.979 -14.347
125 H HIS 16 H HIS 16 8.403 9.057 -17.930
126 HA HIS 16 HA HIS 16 10.238 11.247 -18.346
127 HB2 HIS 16 2HB HIS 16 10.378 8.355 -18.291
128 HB3 HIS 16 3HB HIS 16 11.212 8.998 -19.703
129 HD1 HIS 16 HD1 HIS 16 11.978 7.989 -16.460
130 HD2 HIS 16 HD2 HIS 16 12.924 11.380 -18.665
131 HE1 HIS 16 HE1 HIS 16 14.018 8.961 -15.356
132 H LYS 17 H LYS 17 8.035 9.315 -20.258
133 HA LYS 17 HA LYS 17 9.013 10.263 -22.788
134 HB2 LYS 17 2HB LYS 17 7.564 8.101 -22.075
135 HB3 LYS 17 3HB LYS 17 6.266 9.167 -22.597
136 HG2 LYS 17 2HG LYS 17 6.734 8.819 -24.736
137 HG3 LYS 17 3HG LYS 17 8.444 9.177 -24.489
138 HD2 LYS 17 2HD LYS 17 7.517 6.576 -23.456
139 HD3 LYS 17 3HD LYS 17 7.501 6.752 -25.212
140 HE2 LYS 17 2HE LYS 17 9.630 5.934 -24.804
141 HE3 LYS 17 3HE LYS 17 9.899 7.673 -24.898
142 HZ1 LYS 17 3HZ LYS 17 9.293 7.063 -22.250
143 HZ2 LYS 17 1HZ LYS 17 10.774 7.585 -22.883
144 HZ3 LYS 17 2HZ LYS 17 10.442 5.931 -22.760
145 H LYS 18 H LYS 18 6.039 10.826 -20.905
146 HA LYS 18 HA LYS 18 5.242 13.000 -22.624
147 HB2 LYS 18 2HB LYS 18 4.087 11.549 -20.313
148 HB3 LYS 18 3HB LYS 18 3.579 13.222 -20.511
149 HG2 LYS 18 2HG LYS 18 2.514 12.806 -22.506
150 HG3 LYS 18 3HG LYS 18 3.491 11.378 -22.853
151 HD2 LYS 18 2HD LYS 18 2.345 10.178 -21.034
152 HD3 LYS 18 3HD LYS 18 1.344 11.603 -20.742
153 HE2 LYS 18 2HE LYS 18 0.031 11.198 -22.524
154 HE3 LYS 18 3HE LYS 18 1.381 10.669 -23.526
155 HZ1 LYS 18 3HZ LYS 18 1.273 8.517 -22.647
156 HZ2 LYS 18 1HZ LYS 18 -0.342 8.940 -22.920
157 HZ3 LYS 18 2HZ LYS 18 0.290 8.986 -21.351
158 H LYS 19 H LYS 19 6.120 12.732 -19.177
159 HA LYS 19 HA LYS 19 7.001 14.229 -17.710
160 HB2 LYS 19 2HB LYS 19 8.724 14.226 -19.656
161 HB3 LYS 19 3HB LYS 19 8.065 15.813 -20.029
162 HG2 LYS 19 2HG LYS 19 8.526 16.097 -17.391
163 HG3 LYS 19 3HG LYS 19 9.800 14.954 -17.817
164 HD2 LYS 19 2HD LYS 19 10.781 16.435 -19.338
165 HD3 LYS 19 3HD LYS 19 9.328 17.434 -19.439
166 HE2 LYS 19 2HE LYS 19 9.788 18.539 -17.494
167 HE3 LYS 19 3HE LYS 19 10.648 17.170 -16.793
168 HZ1 LYS 19 3HZ LYS 19 12.592 17.790 -17.735
169 HZ2 LYS 19 1HZ LYS 19 11.883 19.324 -17.672
170 HZ3 LYS 19 2HZ LYS 19 11.866 18.443 -19.116
171 H THR 20 H THR 20 5.016 15.049 -17.005
172 HA THR 20 HA THR 20 4.652 17.847 -17.422
173 HB THR 20 HB THR 20 3.487 17.234 -19.417
174 HG1 THR 20 HG1 THR 20 1.730 18.367 -18.952
175 HG21 THR 20 1HG2 THR 20 1.519 15.668 -19.301
176 HG22 THR 20 2HG2 THR 20 2.069 15.209 -17.689
177 HG23 THR 20 3HG2 THR 20 3.094 14.904 -19.091
178 H GLY 21 H GLY 21 3.280 18.793 -15.885
179 HA2 GLY 21 2HA GLY 21 1.542 18.553 -14.198
180 HA3 GLY 21 3HA GLY 21 2.154 16.934 -13.888
181 H GLY 22 H GLY 22 3.563 20.213 -14.037
182 HA2 GLY 22 2HA GLY 22 4.264 21.300 -11.969
183 HA3 GLY 22 3HA GLY 22 4.691 19.710 -11.355
184 H TYR 23 H TYR 23 5.908 22.507 -12.624
185 HA TYR 23 HA TYR 23 7.960 21.656 -14.327
186 HB2 TYR 23 2HB TYR 23 7.501 24.070 -12.631
187 HB3 TYR 23 3HB TYR 23 9.100 23.822 -13.322
188 HD1 TYR 23 HD1 TYR 23 8.684 22.835 -15.957
189 HD2 TYR 23 HD2 TYR 23 6.361 25.685 -13.815
190 HE1 TYR 23 HE1 TYR 23 7.918 23.801 -18.085
191 HE2 TYR 23 HE2 TYR 23 5.587 26.658 -15.938
192 HH TYR 23 HH TYR 23 7.001 26.302 -18.746
193 HA PRO 24 HA PRO 24 11.008 19.794 -11.781
194 HB2 PRO 24 2HB PRO 24 13.315 20.767 -12.830
195 HB3 PRO 24 3HB PRO 24 12.308 19.577 -13.663
196 HG2 PRO 24 2HG PRO 24 12.459 22.541 -14.060
197 HG3 PRO 24 3HG PRO 24 12.374 21.251 -15.275
198 HD2 PRO 24 2HD PRO 24 10.213 22.712 -14.547
199 HD3 PRO 24 3HD PRO 24 10.094 21.012 -15.045
200 H TRP 25 H TRP 25 11.124 23.284 -12.123
201 HA TRP 25 HA TRP 25 12.705 23.514 -9.664
202 HB2 TRP 25 2HB TRP 25 12.749 25.974 -10.292
203 HB3 TRP 25 3HB TRP 25 13.580 24.883 -11.398
204 HD1 TRP 25 HD1 TRP 25 12.852 24.950 -13.880
205 HE1 TRP 25 HE1 TRP 25 11.015 26.179 -15.198
206 HE3 TRP 25 HE3 TRP 25 10.186 26.865 -9.961
207 HZ2 TRP 25 HZ2 TRP 25 8.737 27.752 -14.649
208 HZ3 TRP 25 HZ3 TRP 25 8.191 28.222 -10.444
209 HH2 TRP 25 HH2 TRP 25 7.483 28.655 -12.739
210 H GLU 26 H GLU 26 9.504 23.739 -10.827
211 HA GLU 26 HA GLU 26 8.626 25.393 -8.584
212 HB2 GLU 26 2HB GLU 26 7.798 25.398 -11.143
213 HB3 GLU 26 3HB GLU 26 6.651 24.246 -10.475
214 HG2 GLU 26 2HG GLU 26 7.091 26.865 -9.116
215 HG3 GLU 26 3HG GLU 26 6.066 26.771 -10.546
216 H ARG 27 H ARG 27 9.662 22.979 -7.776
217 HA ARG 27 HA ARG 27 7.250 21.495 -6.962
218 HB2 ARG 27 2HB ARG 27 10.009 20.489 -7.632
219 HB3 ARG 27 3HB ARG 27 8.879 19.537 -6.678
220 HG2 ARG 27 2HG ARG 27 7.631 20.524 -9.084
221 HG3 ARG 27 3HG ARG 27 9.098 19.611 -9.446
222 HD2 ARG 27 2HD ARG 27 7.162 18.142 -9.409
223 HD3 ARG 27 3HD ARG 27 8.264 17.749 -8.089
224 HE ARG 27 HE ARG 27 6.222 19.569 -7.277
225 HH11 ARG 27 1HH1 ARG 27 6.904 16.211 -7.896
226 HH12 ARG 27 2HH1 ARG 27 5.678 15.628 -6.820
227 HH21 ARG 27 1HH2 ARG 27 4.603 18.814 -5.858
228 HH22 ARG 27 2HH2 ARG 27 4.369 17.111 -5.662
229 H GLY 28 H GLY 28 8.653 23.795 -5.698
230 HA2 GLY 28 2HA GLY 28 9.547 22.498 -3.203
231 HA3 GLY 28 3HA GLY 28 10.019 24.111 -3.716
232 H LYS 29 H LYS 29 6.732 23.225 -4.184
233 HA LYS 29 HA LYS 29 4.789 23.992 -3.284
234 HB2 LYS 29 2HB LYS 29 5.652 22.583 -1.380
235 HB3 LYS 29 3HB LYS 29 6.299 24.056 -0.669
236 HG2 LYS 29 2HG LYS 29 4.296 23.839 0.433
237 HG3 LYS 29 3HG LYS 29 3.859 24.922 -0.892
238 HD2 LYS 29 2HD LYS 29 2.157 23.411 -1.066
239 HD3 LYS 29 3HD LYS 29 3.344 22.626 -2.109
240 HE2 LYS 29 2HE LYS 29 3.822 21.819 0.580
241 HE3 LYS 29 3HE LYS 29 2.106 21.617 0.234
242 HZ1 LYS 29 3HZ LYS 29 2.862 19.655 -0.563
243 HZ2 LYS 29 1HZ LYS 29 4.408 20.244 -0.916
244 HZ3 LYS 29 2HZ LYS 29 3.118 20.572 -1.961
245 H ALA 30 H ALA 30 5.667 25.965 -4.578
246 HA ALA 30 HA ALA 30 6.277 28.257 -2.891
247 HB1 ALA 30 3HB ALA 30 6.797 27.545 -5.590
248 HB2 ALA 30 1HB ALA 30 5.859 29.039 -5.585
249 HB3 ALA 30 2HB ALA 30 7.376 28.946 -4.689
Start of MODEL 7
1 H1 MET 1 H MET 1 2.030 1.391 -1.131
2 HA MET 1 HA MET 1 1.023 -0.678 -1.138
3 HB2 MET 1 2HB MET 1 0.576 0.183 -3.789
4 HB3 MET 1 3HB MET 1 1.233 -1.444 -3.900
5 HG2 MET 1 2HG MET 1 -0.641 -1.625 -1.879
6 HG3 MET 1 3HG MET 1 -1.387 -0.550 -3.059
7 HE1 MET 1 3HE MET 1 -1.620 -2.318 -6.214
8 HE2 MET 1 1HE MET 1 -0.667 -1.007 -5.517
9 HE3 MET 1 2HE MET 1 0.118 -2.515 -5.985
10 H LYS 2 H LYS 2 1.897 -2.689 -0.837
11 HA LYS 2 HA LYS 2 4.642 -2.999 -0.753
12 HB2 LYS 2 2HB LYS 2 4.238 -5.369 -0.382
13 HB3 LYS 2 3HB LYS 2 3.053 -4.408 0.494
14 HG2 LYS 2 2HG LYS 2 1.408 -4.840 -1.269
15 HG3 LYS 2 3HG LYS 2 2.598 -5.824 -2.125
16 HD2 LYS 2 2HD LYS 2 1.760 -7.552 -0.979
17 HD3 LYS 2 3HD LYS 2 2.619 -6.890 0.413
18 HE2 LYS 2 2HE LYS 2 0.338 -5.405 0.424
19 HE3 LYS 2 3HE LYS 2 -0.255 -6.948 -0.190
20 HZ1 LYS 2 3HZ LYS 2 -0.003 -7.910 1.792
21 HZ2 LYS 2 1HZ LYS 2 0.093 -6.341 2.417
22 HZ3 LYS 2 2HZ LYS 2 1.508 -7.201 2.071
23 H THR 3 H THR 3 2.400 -3.743 -3.349
24 HA THR 3 HA THR 3 4.665 -4.630 -5.012
25 HB THR 3 HB THR 3 2.868 -6.305 -4.764
26 HG1 THR 3 HG1 THR 3 2.959 -5.200 -7.392
27 HG21 THR 3 1HG2 THR 3 0.681 -5.914 -5.784
28 HG22 THR 3 2HG2 THR 3 1.146 -4.256 -6.166
29 HG23 THR 3 3HG2 THR 3 0.981 -4.761 -4.485
30 H ILE 4 H ILE 4 4.051 -1.860 -4.494
31 HA ILE 4 HA ILE 4 2.619 -0.725 -6.668
32 HB ILE 4 HB ILE 4 3.092 0.426 -4.484
33 HG12 ILE 4 2HG1 ILE 4 3.974 1.960 -6.938
34 HG13 ILE 4 3HG1 ILE 4 2.297 1.594 -6.549
35 HG21 ILE 4 1HG2 ILE 4 5.525 -0.229 -4.484
36 HG22 ILE 4 2HG2 ILE 4 5.782 1.037 -5.684
37 HG23 ILE 4 3HG2 ILE 4 5.189 1.454 -4.077
38 HD11 ILE 4 3HD1 ILE 4 4.003 3.702 -5.571
39 HD12 ILE 4 1HD1 ILE 4 2.252 3.525 -5.469
40 HD13 ILE 4 2HD1 ILE 4 3.286 2.777 -4.252
41 H LEU 5 H LEU 5 5.639 -2.198 -6.495
42 HA LEU 5 HA LEU 5 7.285 -0.724 -8.145
43 HB2 LEU 5 2HB LEU 5 8.528 -2.668 -8.490
44 HB3 LEU 5 3HB LEU 5 7.770 -2.893 -6.915
45 HG LEU 5 HG LEU 5 5.962 -4.157 -8.408
46 HD11 LEU 5 1HD1 LEU 5 7.918 -3.593 -10.297
47 HD12 LEU 5 2HD1 LEU 5 6.598 -4.752 -10.452
48 HD13 LEU 5 3HD1 LEU 5 8.178 -5.287 -9.879
49 HD21 LEU 5 3HD2 LEU 5 7.073 -5.157 -6.531
50 HD22 LEU 5 1HD2 LEU 5 8.588 -5.268 -7.428
51 HD23 LEU 5 2HD2 LEU 5 7.206 -6.253 -7.908
52 H ARG 6 H ARG 6 4.590 -2.806 -9.001
53 HA ARG 6 HA ARG 6 5.096 -2.780 -11.809
54 HB2 ARG 6 2HB ARG 6 2.995 -3.882 -12.043
55 HB3 ARG 6 3HB ARG 6 3.747 -4.516 -10.585
56 HG2 ARG 6 2HG ARG 6 1.702 -4.164 -9.721
57 HG3 ARG 6 3HG ARG 6 2.308 -2.520 -9.517
58 HD2 ARG 6 2HD ARG 6 0.426 -1.968 -10.628
59 HD3 ARG 6 3HD ARG 6 1.387 -2.383 -12.046
60 HE ARG 6 HE ARG 6 0.240 -4.739 -11.297
61 HH11 ARG 6 1HH1 ARG 6 -0.958 -1.564 -12.077
62 HH12 ARG 6 2HH1 ARG 6 -2.466 -2.144 -12.701
63 HH21 ARG 6 1HH2 ARG 6 -1.743 -5.515 -12.114
64 HH22 ARG 6 2HH2 ARG 6 -2.913 -4.392 -12.721
65 H PHE 7 H PHE 7 3.285 -0.767 -9.596
66 HA PHE 7 HA PHE 7 1.882 0.675 -11.637
67 HB2 PHE 7 2HB PHE 7 0.875 0.567 -9.462
68 HB3 PHE 7 3HB PHE 7 2.324 1.210 -8.698
69 HD1 PHE 7 HD1 PHE 7 0.049 2.221 -11.483
70 HD2 PHE 7 HD2 PHE 7 2.129 3.360 -7.950
71 HE1 PHE 7 HE1 PHE 7 -0.862 4.497 -11.686
72 HE2 PHE 7 HE2 PHE 7 1.222 5.638 -8.146
73 HZ PHE 7 HZ PHE 7 -0.276 6.209 -10.015
74 H VAL 8 H VAL 8 4.602 1.468 -9.480
75 HA VAL 8 HA VAL 8 5.132 4.000 -10.603
76 HB VAL 8 HB VAL 8 7.010 2.144 -9.135
77 HG11 VAL 8 1HG1 VAL 8 8.328 4.160 -8.678
78 HG12 VAL 8 2HG1 VAL 8 8.230 3.824 -10.407
79 HG13 VAL 8 3HG1 VAL 8 7.239 5.099 -9.698
80 HG21 VAL 8 3HG2 VAL 8 5.813 2.637 -7.328
81 HG22 VAL 8 1HG2 VAL 8 6.243 4.333 -7.546
82 HG23 VAL 8 2HG2 VAL 8 4.764 3.698 -8.267
83 H ALA 9 H ALA 9 6.182 0.765 -11.440
84 HA ALA 9 HA ALA 9 8.370 1.269 -13.042
85 HB1 ALA 9 3HB ALA 9 7.875 -0.978 -12.631
86 HB2 ALA 9 1HB ALA 9 6.217 -0.814 -13.212
87 HB3 ALA 9 2HB ALA 9 7.559 -0.774 -14.355
88 H GLY 10 H GLY 10 4.941 1.227 -14.020
89 HA2 GLY 10 2HA GLY 10 5.491 2.009 -16.711
90 HA3 GLY 10 3HA GLY 10 3.915 1.996 -15.934
91 H TYR 11 H TYR 11 4.895 3.754 -13.751
92 HA TYR 11 HA TYR 11 4.242 6.241 -14.986
93 HB2 TYR 11 2HB TYR 11 3.738 5.467 -12.577
94 HB3 TYR 11 3HB TYR 11 5.390 5.958 -12.217
95 HD1 TYR 11 HD2 TYR 11 6.014 8.400 -12.960
96 HD2 TYR 11 HD1 TYR 11 2.034 7.020 -12.365
97 HE1 TYR 11 HE2 TYR 11 5.261 10.722 -12.654
98 HE2 TYR 11 HE1 TYR 11 1.269 9.336 -12.058
99 HH TYR 11 HH TYR 11 3.545 12.022 -11.944
100 H ASP 12 H ASP 12 7.203 4.690 -13.951
101 HA ASP 12 HA ASP 12 8.889 6.950 -14.038
102 HB2 ASP 12 2HB ASP 12 9.338 4.597 -13.058
103 HB3 ASP 12 3HB ASP 12 9.825 4.169 -14.695
104 H ILE 13 H ILE 13 7.658 4.819 -16.504
105 HA ILE 13 HA ILE 13 9.471 5.865 -18.523
106 HB ILE 13 HB ILE 13 7.181 3.914 -18.798
107 HG12 ILE 13 2HG1 ILE 13 9.839 2.862 -19.254
108 HG13 ILE 13 3HG1 ILE 13 9.715 3.567 -17.646
109 HG21 ILE 13 1HG2 ILE 13 8.160 3.399 -20.987
110 HG22 ILE 13 2HG2 ILE 13 7.632 5.078 -20.882
111 HG23 ILE 13 3HG2 ILE 13 9.345 4.683 -20.752
112 HD11 ILE 13 3HD1 ILE 13 7.407 2.110 -17.836
113 HD12 ILE 13 1HD1 ILE 13 8.573 1.113 -18.707
114 HD13 ILE 13 2HD1 ILE 13 8.893 1.592 -17.040
115 H ALA 14 H ALA 14 5.994 5.887 -17.809
116 HA ALA 14 HA ALA 14 5.204 7.442 -20.016
117 HB1 ALA 14 3HB ALA 14 3.744 6.079 -18.432
118 HB2 ALA 14 1HB ALA 14 3.804 7.478 -17.360
119 HB3 ALA 14 2HB ALA 14 3.112 7.633 -18.975
120 H SER 15 H SER 15 6.311 8.318 -16.786
121 HA SER 15 HA SER 15 5.735 11.099 -17.045
122 HB2 SER 15 2HB SER 15 6.011 9.877 -14.862
123 HB3 SER 15 3HB SER 15 7.743 9.808 -15.186
124 HG SER 15 HG SER 15 7.537 11.628 -14.037
125 H HIS 16 H HIS 16 8.401 9.057 -17.934
126 HA HIS 16 HA HIS 16 10.247 11.238 -18.337
127 HB2 HIS 16 2HB HIS 16 11.057 9.008 -17.680
128 HB3 HIS 16 3HB HIS 16 10.434 8.339 -19.184
129 HD1 HIS 16 HD1 HIS 16 12.848 7.592 -19.825
130 HD2 HIS 16 HD2 HIS 16 12.355 11.698 -19.432
131 HE1 HIS 16 HE1 HIS 16 14.892 8.618 -20.870
132 H LYS 17 H LYS 17 8.024 9.342 -20.259
133 HA LYS 17 HA LYS 17 9.008 10.294 -22.786
134 HB2 LYS 17 2HB LYS 17 7.344 8.219 -21.953
135 HB3 LYS 17 3HB LYS 17 6.273 9.308 -22.824
136 HG2 LYS 17 2HG LYS 17 7.398 9.032 -24.822
137 HG3 LYS 17 3HG LYS 17 8.882 8.496 -24.030
138 HD2 LYS 17 2HD LYS 17 7.141 6.570 -23.237
139 HD3 LYS 17 3HD LYS 17 6.502 6.965 -24.834
140 HE2 LYS 17 2HE LYS 17 9.287 6.828 -25.127
141 HE3 LYS 17 3HE LYS 17 8.839 5.448 -24.124
142 HZ1 LYS 17 3HZ LYS 17 7.924 4.429 -25.856
143 HZ2 LYS 17 1HZ LYS 17 8.663 5.587 -26.841
144 HZ3 LYS 17 2HZ LYS 17 7.064 5.804 -26.336
145 H LYS 18 H LYS 18 5.972 10.822 -20.986
146 HA LYS 18 HA LYS 18 5.245 13.048 -22.656
147 HB2 LYS 18 2HB LYS 18 4.033 11.991 -20.098
148 HB3 LYS 18 3HB LYS 18 3.336 13.278 -21.073
149 HG2 LYS 18 2HG LYS 18 3.686 11.290 -22.913
150 HG3 LYS 18 3HG LYS 18 3.272 10.387 -21.454
151 HD2 LYS 18 2HD LYS 18 1.349 12.067 -21.197
152 HD3 LYS 18 3HD LYS 18 1.675 12.494 -22.879
153 HE2 LYS 18 2HE LYS 18 -0.053 10.854 -22.881
154 HE3 LYS 18 3HE LYS 18 1.419 10.069 -23.450
155 HZ1 LYS 18 3HZ LYS 18 -0.013 8.868 -21.723
156 HZ2 LYS 18 1HZ LYS 18 0.649 9.952 -20.604
157 HZ3 LYS 18 2HZ LYS 18 1.660 8.911 -21.474
158 H LYS 19 H LYS 19 6.035 12.706 -19.196
159 HA LYS 19 HA LYS 19 6.847 14.183 -17.666
160 HB2 LYS 19 2HB LYS 19 8.661 14.133 -19.548
161 HB3 LYS 19 3HB LYS 19 8.092 15.761 -19.891
162 HG2 LYS 19 2HG LYS 19 8.779 16.566 -17.806
163 HG3 LYS 19 3HG LYS 19 8.931 14.942 -17.132
164 HD2 LYS 19 2HD LYS 19 11.138 15.584 -17.521
165 HD3 LYS 19 3HD LYS 19 10.742 14.595 -18.928
166 HE2 LYS 19 2HE LYS 19 9.979 17.224 -19.566
167 HE3 LYS 19 3HE LYS 19 11.566 17.341 -18.808
168 HZ1 LYS 19 3HZ LYS 19 12.287 16.874 -20.863
169 HZ2 LYS 19 1HZ LYS 19 10.817 16.196 -21.357
170 HZ3 LYS 19 2HZ LYS 19 11.917 15.272 -20.466
171 H THR 20 H THR 20 4.826 15.048 -17.100
172 HA THR 20 HA THR 20 4.582 17.867 -17.559
173 HB THR 20 HB THR 20 3.449 17.279 -19.562
174 HG1 THR 20 HG1 THR 20 1.171 17.789 -18.889
175 HG21 THR 20 1HG2 THR 20 3.052 14.949 -19.277
176 HG22 THR 20 2HG2 THR 20 1.475 15.708 -19.498
177 HG23 THR 20 3HG2 THR 20 2.007 15.232 -17.886
178 H GLY 21 H GLY 21 3.014 18.870 -16.180
179 HA2 GLY 21 2HA GLY 21 1.256 18.671 -14.525
180 HA3 GLY 21 3HA GLY 21 1.896 17.087 -14.113
181 H GLY 22 H GLY 22 2.359 20.547 -13.803
182 HA2 GLY 22 2HA GLY 22 3.419 21.776 -12.177
183 HA3 GLY 22 3HA GLY 22 3.462 20.310 -11.209
184 H TYR 23 H TYR 23 5.217 22.401 -13.322
185 HA TYR 23 HA TYR 23 7.441 20.750 -13.849
186 HB2 TYR 23 2HB TYR 23 6.917 23.689 -13.935
187 HB3 TYR 23 3HB TYR 23 8.585 23.131 -14.024
188 HD1 TYR 23 HD1 TYR 23 8.560 20.811 -15.670
189 HD2 TYR 23 HD2 TYR 23 6.175 24.316 -16.025
190 HE1 TYR 23 HE1 TYR 23 8.291 20.378 -18.076
191 HE2 TYR 23 HE2 TYR 23 5.897 23.891 -18.431
192 HH TYR 23 HH TYR 23 7.752 21.542 -20.108
193 HA PRO 24 HA PRO 24 9.780 20.742 -10.138
194 HB2 PRO 24 2HB PRO 24 12.323 21.003 -11.052
195 HB3 PRO 24 3HB PRO 24 11.374 19.526 -11.259
196 HG2 PRO 24 2HG PRO 24 11.881 21.741 -13.209
197 HG3 PRO 24 3HG PRO 24 11.895 19.988 -13.478
198 HD2 PRO 24 2HD PRO 24 9.789 21.550 -14.156
199 HD3 PRO 24 3HD PRO 24 9.598 19.865 -13.626
200 H TRP 25 H TRP 25 10.293 23.420 -12.345
201 HA TRP 25 HA TRP 25 11.414 25.046 -10.178
202 HB2 TRP 25 2HB TRP 25 11.809 26.713 -12.052
203 HB3 TRP 25 3HB TRP 25 12.719 25.208 -12.158
204 HD1 TRP 25 HD1 TRP 25 12.465 23.833 -14.334
205 HE1 TRP 25 HE1 TRP 25 11.027 24.049 -16.456
206 HE3 TRP 25 HE3 TRP 25 9.330 27.573 -12.812
207 HZ2 TRP 25 HZ2 TRP 25 8.850 25.599 -17.367
208 HZ3 TRP 25 HZ3 TRP 25 7.597 28.366 -14.370
209 HH2 TRP 25 HH2 TRP 25 7.364 27.398 -16.599
210 H GLU 26 H GLU 26 8.517 24.492 -11.896
211 HA GLU 26 HA GLU 26 7.408 27.106 -11.202
212 HB2 GLU 26 2HB GLU 26 7.065 25.635 -13.428
213 HB3 GLU 26 3HB GLU 26 5.709 25.040 -12.481
214 HG2 GLU 26 2HG GLU 26 6.038 27.966 -12.575
215 HG3 GLU 26 3HG GLU 26 5.581 27.181 -14.085
216 H ARG 27 H ARG 27 8.021 25.686 -8.967
217 HA ARG 27 HA ARG 27 5.406 24.717 -8.015
218 HB2 ARG 27 2HB ARG 27 7.808 23.361 -8.000
219 HB3 ARG 27 3HB ARG 27 7.715 24.009 -6.367
220 HG2 ARG 27 2HG ARG 27 5.366 23.024 -6.290
221 HG3 ARG 27 3HG ARG 27 5.825 22.132 -7.743
222 HD2 ARG 27 2HD ARG 27 7.945 21.804 -5.942
223 HD3 ARG 27 3HD ARG 27 6.474 21.606 -4.990
224 HE ARG 27 HE ARG 27 5.992 20.062 -7.142
225 HH11 ARG 27 1HH1 ARG 27 8.692 20.285 -4.956
226 HH12 ARG 27 2HH1 ARG 27 9.126 18.616 -5.115
227 HH21 ARG 27 1HH2 ARG 27 6.553 17.862 -7.360
228 HH22 ARG 27 2HH2 ARG 27 7.910 17.239 -6.484
229 H GLY 28 H GLY 28 6.263 27.485 -8.114
230 HA2 GLY 28 2HA GLY 28 5.655 29.202 -6.611
231 HA3 GLY 28 3HA GLY 28 5.917 28.093 -5.273
232 H LYS 29 H LYS 29 8.493 27.197 -5.917
233 HA LYS 29 HA LYS 29 10.681 27.721 -5.584
234 HB2 LYS 29 2HB LYS 29 9.795 29.404 -7.614
235 HB3 LYS 29 3HB LYS 29 10.610 30.486 -6.493
236 HG2 LYS 29 2HG LYS 29 12.324 28.317 -6.719
237 HG3 LYS 29 3HG LYS 29 11.717 28.578 -8.356
238 HD2 LYS 29 2HD LYS 29 13.382 30.094 -8.456
239 HD3 LYS 29 3HD LYS 29 12.227 31.124 -7.607
240 HE2 LYS 29 2HE LYS 29 14.231 31.303 -6.390
241 HE3 LYS 29 3HE LYS 29 13.218 30.203 -5.457
242 HZ1 LYS 29 3HZ LYS 29 14.443 28.383 -6.752
243 HZ2 LYS 29 1HZ LYS 29 15.268 29.159 -5.495
244 HZ3 LYS 29 2HZ LYS 29 15.585 29.581 -7.102
245 H ALA 30 H ALA 30 8.710 28.304 -3.524
246 HA ALA 30 HA ALA 30 10.324 30.183 -1.960
247 HB1 ALA 30 3HB ALA 30 7.377 30.366 -1.632
248 HB2 ALA 30 1HB ALA 30 8.623 31.593 -1.395
249 HB3 ALA 30 2HB ALA 30 8.110 31.157 -3.026
Start of MODEL 8
1 H1 MET 1 H MET 1 1.977 1.771 -2.251
2 HA MET 1 HA MET 1 1.131 -0.425 -0.719
3 HB2 MET 1 2HB MET 1 0.994 0.417 -3.462
4 HB3 MET 1 3HB MET 1 1.421 -1.288 -3.394
5 HG2 MET 1 2HG MET 1 -0.727 -0.626 -1.566
6 HG3 MET 1 3HG MET 1 -1.114 -0.215 -3.235
7 HE1 MET 1 3HE MET 1 -2.177 -3.180 -4.821
8 HE2 MET 1 1HE MET 1 -1.740 -1.472 -4.862
9 HE3 MET 1 2HE MET 1 -0.548 -2.696 -5.299
10 H LYS 2 H LYS 2 1.782 -2.735 -1.261
11 HA LYS 2 HA LYS 2 4.607 -2.996 -0.743
12 HB2 LYS 2 2HB LYS 2 2.222 -4.697 -0.545
13 HB3 LYS 2 3HB LYS 2 3.671 -5.556 -1.052
14 HG2 LYS 2 2HG LYS 2 4.087 -5.751 1.128
15 HG3 LYS 2 3HG LYS 2 4.602 -4.066 1.035
16 HD2 LYS 2 2HD LYS 2 1.970 -3.697 1.362
17 HD3 LYS 2 3HD LYS 2 2.143 -5.247 2.190
18 HE2 LYS 2 2HE LYS 2 4.264 -3.449 2.940
19 HE3 LYS 2 3HE LYS 2 2.693 -2.696 3.206
20 HZ1 LYS 2 3HZ LYS 2 3.952 -4.822 4.645
21 HZ2 LYS 2 1HZ LYS 2 2.385 -5.232 4.156
22 HZ3 LYS 2 2HZ LYS 2 2.644 -3.847 5.091
23 H THR 3 H THR 3 2.371 -3.820 -3.351
24 HA THR 3 HA THR 3 4.663 -4.631 -5.009
25 HB THR 3 HB THR 3 2.837 -6.302 -4.759
26 HG1 THR 3 HG1 THR 3 2.784 -6.772 -6.969
27 HG21 THR 3 1HG2 THR 3 1.023 -4.964 -6.605
28 HG22 THR 3 2HG2 THR 3 1.155 -4.137 -5.054
29 HG23 THR 3 3HG2 THR 3 0.676 -5.833 -5.111
30 H ILE 4 H ILE 4 4.061 -1.872 -4.496
31 HA ILE 4 HA ILE 4 2.624 -0.728 -6.664
32 HB ILE 4 HB ILE 4 3.105 0.418 -4.479
33 HG12 ILE 4 2HG1 ILE 4 3.984 1.954 -6.932
34 HG13 ILE 4 3HG1 ILE 4 2.306 1.591 -6.538
35 HG21 ILE 4 1HG2 ILE 4 5.536 -0.244 -4.488
36 HG22 ILE 4 2HG2 ILE 4 5.794 1.023 -5.685
37 HG23 ILE 4 3HG2 ILE 4 5.206 1.439 -4.075
38 HD11 ILE 4 3HD1 ILE 4 2.404 3.648 -5.634
39 HD12 ILE 4 1HD1 ILE 4 3.048 2.760 -4.253
40 HD13 ILE 4 2HD1 ILE 4 4.146 3.572 -5.370
41 H LEU 5 H LEU 5 5.640 -2.208 -6.502
42 HA LEU 5 HA LEU 5 7.286 -0.735 -8.153
43 HB2 LEU 5 2HB LEU 5 8.525 -2.682 -8.504
44 HB3 LEU 5 3HB LEU 5 7.770 -2.908 -6.927
45 HG LEU 5 HG LEU 5 5.956 -4.166 -8.418
46 HD11 LEU 5 1HD1 LEU 5 7.910 -3.604 -10.310
47 HD12 LEU 5 2HD1 LEU 5 6.583 -4.756 -10.464
48 HD13 LEU 5 3HD1 LEU 5 8.162 -5.301 -9.896
49 HD21 LEU 5 3HD2 LEU 5 8.580 -5.274 -7.433
50 HD22 LEU 5 1HD2 LEU 5 7.207 -6.265 -7.929
51 HD23 LEU 5 2HD2 LEU 5 7.056 -5.178 -6.549
52 H ARG 6 H ARG 6 4.585 -2.811 -9.005
53 HA ARG 6 HA ARG 6 5.084 -2.782 -11.815
54 HB2 ARG 6 2HB ARG 6 2.942 -3.844 -12.040
55 HB3 ARG 6 3HB ARG 6 3.746 -4.531 -10.636
56 HG2 ARG 6 2HG ARG 6 1.715 -4.209 -9.711
57 HG3 ARG 6 3HG ARG 6 2.369 -2.596 -9.420
58 HD2 ARG 6 2HD ARG 6 0.491 -1.908 -10.446
59 HD3 ARG 6 3HD ARG 6 1.375 -2.298 -11.920
60 HE ARG 6 HE ARG 6 0.060 -4.604 -11.025
61 HH11 ARG 6 1HH1 ARG 6 -0.665 -1.470 -12.355
62 HH12 ARG 6 2HH1 ARG 6 -2.135 -1.988 -13.113
63 HH21 ARG 6 1HH2 ARG 6 -1.873 -5.297 -12.018
64 HH22 ARG 6 2HH2 ARG 6 -2.821 -4.165 -12.919
65 H PHE 7 H PHE 7 3.284 -0.765 -9.595
66 HA PHE 7 HA PHE 7 1.880 0.682 -11.630
67 HB2 PHE 7 2HB PHE 7 0.878 0.575 -9.454
68 HB3 PHE 7 3HB PHE 7 2.330 1.213 -8.691
69 HD1 PHE 7 HD2 PHE 7 0.054 2.233 -11.473
70 HD2 PHE 7 HD1 PHE 7 2.139 3.360 -7.937
71 HE1 PHE 7 HE2 PHE 7 -0.851 4.513 -11.669
72 HE2 PHE 7 HE1 PHE 7 1.236 5.641 -8.128
73 HZ PHE 7 HZ PHE 7 -0.260 6.220 -9.996
74 H VAL 8 H VAL 8 4.601 1.474 -9.472
75 HA VAL 8 HA VAL 8 5.137 4.003 -10.593
76 HB VAL 8 HB VAL 8 7.015 2.138 -9.134
77 HG11 VAL 8 1HG1 VAL 8 8.236 3.818 -10.406
78 HG12 VAL 8 2HG1 VAL 8 7.249 5.095 -9.691
79 HG13 VAL 8 3HG1 VAL 8 8.339 4.149 -8.677
80 HG21 VAL 8 3HG2 VAL 8 5.825 2.629 -7.323
81 HG22 VAL 8 1HG2 VAL 8 6.256 4.325 -7.539
82 HG23 VAL 8 2HG2 VAL 8 4.774 3.695 -8.257
83 H ALA 9 H ALA 9 6.177 0.767 -11.441
84 HA ALA 9 HA ALA 9 8.362 1.270 -13.048
85 HB1 ALA 9 3HB ALA 9 7.810 -0.978 -12.598
86 HB2 ALA 9 1HB ALA 9 6.194 -0.800 -13.282
87 HB3 ALA 9 2HB ALA 9 7.608 -0.775 -14.338
88 H GLY 10 H GLY 10 4.930 1.243 -14.013
89 HA2 GLY 10 2HA GLY 10 5.472 2.024 -16.704
90 HA3 GLY 10 3HA GLY 10 3.899 2.018 -15.921
91 H TYR 11 H TYR 11 4.897 3.770 -13.741
92 HA TYR 11 HA TYR 11 4.253 6.261 -14.972
93 HB2 TYR 11 2HB TYR 11 3.732 5.504 -12.573
94 HB3 TYR 11 3HB TYR 11 5.394 5.947 -12.204
95 HD1 TYR 11 HD2 TYR 11 6.081 8.380 -12.969
96 HD2 TYR 11 HD1 TYR 11 2.078 7.097 -12.311
97 HE1 TYR 11 HE2 TYR 11 5.389 10.719 -12.650
98 HE2 TYR 11 HE1 TYR 11 1.375 9.432 -11.991
99 HH TYR 11 HH TYR 11 2.577 11.861 -12.941
100 H ASP 12 H ASP 12 7.208 4.704 -13.917
101 HA ASP 12 HA ASP 12 8.903 6.953 -14.015
102 HB2 ASP 12 2HB ASP 12 9.324 4.574 -13.046
103 HB3 ASP 12 3HB ASP 12 9.856 4.184 -14.680
104 H ILE 13 H ILE 13 7.683 4.806 -16.477
105 HA ILE 13 HA ILE 13 9.494 5.857 -18.495
106 HB ILE 13 HB ILE 13 7.220 3.887 -18.769
107 HG12 ILE 13 2HG1 ILE 13 9.897 2.865 -19.204
108 HG13 ILE 13 3HG1 ILE 13 9.739 3.558 -17.594
109 HG21 ILE 13 1HG2 ILE 13 7.669 5.045 -20.857
110 HG22 ILE 13 2HG2 ILE 13 9.385 4.666 -20.716
111 HG23 ILE 13 3HG2 ILE 13 8.212 3.370 -20.952
112 HD11 ILE 13 3HD1 ILE 13 8.604 1.112 -18.713
113 HD12 ILE 13 1HD1 ILE 13 8.973 1.537 -17.043
114 HD13 ILE 13 2HD1 ILE 13 7.466 2.083 -17.779
115 H ALA 14 H ALA 14 6.020 5.872 -17.771
116 HA ALA 14 HA ALA 14 5.215 7.399 -19.994
117 HB1 ALA 14 3HB ALA 14 3.791 7.537 -17.365
118 HB2 ALA 14 1HB ALA 14 3.125 7.517 -18.999
119 HB3 ALA 14 2HB ALA 14 3.802 6.044 -18.303
120 H SER 15 H SER 15 6.343 8.312 -16.782
121 HA SER 15 HA SER 15 5.748 11.086 -17.055
122 HB2 SER 15 2HB SER 15 7.049 11.377 -15.025
123 HB3 SER 15 3HB SER 15 6.040 9.940 -14.861
124 HG SER 15 HG SER 15 7.998 8.785 -15.632
125 H HIS 16 H HIS 16 8.418 9.058 -17.967
126 HA HIS 16 HA HIS 16 10.276 11.208 -18.379
127 HB2 HIS 16 2HB HIS 16 10.636 8.581 -18.004
128 HB3 HIS 16 3HB HIS 16 10.658 8.605 -19.765
129 HD1 HIS 16 HD1 HIS 16 13.154 7.949 -17.964
130 HD2 HIS 16 HD2 HIS 16 12.333 11.622 -19.723
131 HE1 HIS 16 HE1 HIS 16 15.373 9.117 -18.147
132 H LYS 17 H LYS 17 7.993 9.407 -20.341
133 HA LYS 17 HA LYS 17 8.905 10.519 -22.830
134 HB2 LYS 17 2HB LYS 17 6.952 8.542 -21.959
135 HB3 LYS 17 3HB LYS 17 6.326 9.568 -23.243
136 HG2 LYS 17 2HG LYS 17 7.305 8.064 -24.583
137 HG3 LYS 17 3HG LYS 17 8.769 8.983 -24.230
138 HD2 LYS 17 2HD LYS 17 8.958 7.381 -22.187
139 HD3 LYS 17 3HD LYS 17 7.863 6.357 -23.120
140 HE2 LYS 17 2HE LYS 17 9.515 5.690 -24.454
141 HE3 LYS 17 3HE LYS 17 10.008 7.353 -24.771
142 HZ1 LYS 17 3HZ LYS 17 10.904 6.939 -22.261
143 HZ2 LYS 17 1HZ LYS 17 11.842 6.787 -23.659
144 HZ3 LYS 17 2HZ LYS 17 11.136 5.417 -22.963
145 H LYS 18 H LYS 18 5.857 10.850 -21.001
146 HA LYS 18 HA LYS 18 5.015 13.122 -22.510
147 HB2 LYS 18 2HB LYS 18 3.998 11.581 -20.190
148 HB3 LYS 18 3HB LYS 18 3.449 13.246 -20.322
149 HG2 LYS 18 2HG LYS 18 2.549 12.826 -22.516
150 HG3 LYS 18 3HG LYS 18 3.207 11.187 -22.506
151 HD2 LYS 18 2HD LYS 18 1.732 11.302 -20.176
152 HD3 LYS 18 3HD LYS 18 0.758 12.227 -21.320
153 HE2 LYS 18 2HE LYS 18 1.177 10.240 -22.920
154 HE3 LYS 18 3HE LYS 18 1.628 9.363 -21.459
155 HZ1 LYS 18 3HZ LYS 18 -0.723 10.561 -20.799
156 HZ2 LYS 18 1HZ LYS 18 -0.533 8.943 -21.256
157 HZ3 LYS 18 2HZ LYS 18 -0.971 10.102 -22.408
158 H LYS 19 H LYS 19 6.012 12.761 -19.102
159 HA LYS 19 HA LYS 19 6.968 14.211 -17.634
160 HB2 LYS 19 2HB LYS 19 8.679 14.297 -19.480
161 HB3 LYS 19 3HB LYS 19 7.875 15.744 -20.074
162 HG2 LYS 19 2HG LYS 19 8.350 16.172 -17.339
163 HG3 LYS 19 3HG LYS 19 9.829 15.477 -18.005
164 HD2 LYS 19 2HD LYS 19 9.193 17.274 -19.933
165 HD3 LYS 19 3HD LYS 19 8.572 18.094 -18.498
166 HE2 LYS 19 2HE LYS 19 10.645 18.765 -18.066
167 HE3 LYS 19 3HE LYS 19 11.076 17.083 -17.766
168 HZ1 LYS 19 3HZ LYS 19 12.562 17.964 -19.386
169 HZ2 LYS 19 1HZ LYS 19 11.290 18.550 -20.336
170 HZ3 LYS 19 2HZ LYS 19 11.531 16.883 -20.181
171 H THR 20 H THR 20 5.069 14.997 -16.744
172 HA THR 20 HA THR 20 4.595 17.791 -17.107
173 HB THR 20 HB THR 20 3.260 17.124 -18.982
174 HG1 THR 20 HG1 THR 20 1.663 18.356 -18.335
175 HG21 THR 20 1HG2 THR 20 1.912 15.170 -17.113
176 HG22 THR 20 2HG2 THR 20 2.989 14.760 -18.448
177 HG23 THR 20 3HG2 THR 20 1.423 15.502 -18.773
178 H GLY 21 H GLY 21 3.335 18.695 -15.447
179 HA2 GLY 21 2HA GLY 21 2.259 18.787 -13.407
180 HA3 GLY 21 3HA GLY 21 1.930 17.068 -13.555
181 H GLY 22 H GLY 22 4.247 19.470 -12.479
182 HA2 GLY 22 2HA GLY 22 5.781 17.356 -11.118
183 HA3 GLY 22 3HA GLY 22 6.367 18.978 -11.456
184 H TYR 23 H TYR 23 6.212 20.485 -9.909
185 HA TYR 23 HA TYR 23 5.485 19.756 -7.285
186 HB2 TYR 23 2HB TYR 23 6.293 22.297 -8.629
187 HB3 TYR 23 3HB TYR 23 5.592 22.388 -7.017
188 HD1 TYR 23 HD1 TYR 23 6.667 20.197 -5.558
189 HD2 TYR 23 HD2 TYR 23 8.578 22.575 -8.524
190 HE1 TYR 23 HE1 TYR 23 8.856 19.658 -4.572
191 HE2 TYR 23 HE2 TYR 23 10.771 22.041 -7.548
192 HH TYR 23 HH TYR 23 11.820 20.419 -6.153
193 HA PRO 24 HA PRO 24 1.204 20.662 -6.974
194 HB2 PRO 24 2HB PRO 24 1.031 21.823 -4.525
195 HB3 PRO 24 3HB PRO 24 1.345 20.097 -4.752
196 HG2 PRO 24 2HG PRO 24 3.274 22.313 -4.175
197 HG3 PRO 24 3HG PRO 24 3.201 20.684 -3.480
198 HD2 PRO 24 2HD PRO 24 4.942 21.355 -5.442
199 HD3 PRO 24 3HD PRO 24 4.250 19.727 -5.295
200 H TRP 25 H TRP 25 3.443 23.308 -6.432
201 HA TRP 25 HA TRP 25 1.329 25.264 -6.975
202 HB2 TRP 25 2HB TRP 25 3.142 26.930 -6.356
203 HB3 TRP 25 3HB TRP 25 2.604 25.864 -5.061
204 HD1 TRP 25 HD1 TRP 25 4.416 24.457 -3.868
205 HE1 TRP 25 HE1 TRP 25 6.943 24.095 -4.204
206 HE3 TRP 25 HE3 TRP 25 4.982 26.808 -8.372
207 HZ2 TRP 25 HZ2 TRP 25 8.914 24.723 -6.124
208 HZ3 TRP 25 HZ3 TRP 25 7.221 26.884 -9.390
209 HH2 TRP 25 HH2 TRP 25 9.145 25.863 -8.287
210 H GLU 26 H GLU 26 3.950 23.661 -8.463
211 HA GLU 26 HA GLU 26 4.246 25.696 -10.536
212 HB2 GLU 26 2HB GLU 26 6.118 24.167 -9.381
213 HB3 GLU 26 3HB GLU 26 5.687 23.105 -10.714
214 HG2 GLU 26 2HG GLU 26 6.050 25.813 -11.628
215 HG3 GLU 26 3HG GLU 26 7.473 25.233 -10.763
216 H ARG 27 H ARG 27 1.729 24.629 -10.524
217 HA ARG 27 HA ARG 27 1.683 22.609 -12.646
218 HB2 ARG 27 2HB ARG 27 0.257 22.599 -10.423
219 HB3 ARG 27 3HB ARG 27 -0.798 23.656 -11.353
220 HG2 ARG 27 2HG ARG 27 -0.308 21.586 -13.093
221 HG3 ARG 27 3HG ARG 27 -0.410 20.782 -11.525
222 HD2 ARG 27 2HD ARG 27 -2.463 22.654 -12.700
223 HD3 ARG 27 3HD ARG 27 -2.596 20.899 -12.605
224 HE ARG 27 HE ARG 27 -3.059 22.788 -10.495
225 HH11 ARG 27 1HH1 ARG 27 -2.154 19.509 -11.238
226 HH12 ARG 27 2HH1 ARG 27 -2.677 18.881 -9.711
227 HH21 ARG 27 1HH2 ARG 27 -3.749 21.972 -8.480
228 HH22 ARG 27 2HH2 ARG 27 -3.585 20.282 -8.142
229 H GLY 28 H GLY 28 2.525 25.243 -13.309
230 HA2 GLY 28 2HA GLY 28 2.156 26.395 -15.339
231 HA3 GLY 28 3HA GLY 28 0.482 25.863 -15.309
232 H LYS 29 H LYS 29 2.114 27.327 -12.572
233 HA LYS 29 HA LYS 29 0.341 29.663 -12.861
234 HB2 LYS 29 2HB LYS 29 0.945 27.920 -10.605
235 HB3 LYS 29 3HB LYS 29 1.192 29.618 -10.220
236 HG2 LYS 29 2HG LYS 29 -0.985 29.890 -9.957
237 HG3 LYS 29 3HG LYS 29 -1.265 29.378 -11.624
238 HD2 LYS 29 2HD LYS 29 -2.481 27.783 -10.532
239 HD3 LYS 29 3HD LYS 29 -0.911 26.979 -10.558
240 HE2 LYS 29 2HE LYS 29 -0.791 28.513 -8.276
241 HE3 LYS 29 3HE LYS 29 -2.470 27.978 -8.307
242 HZ1 LYS 29 3HZ LYS 29 -0.019 26.346 -8.174
243 HZ2 LYS 29 1HZ LYS 29 -1.465 25.680 -8.744
244 HZ3 LYS 29 2HZ LYS 29 -1.381 26.298 -7.173
245 H ALA 30 H ALA 30 3.593 28.557 -12.203
246 HA ALA 30 HA ALA 30 5.600 29.627 -12.097
247 HB1 ALA 30 3HB ALA 30 4.776 30.313 -14.378
248 HB2 ALA 30 1HB ALA 30 4.278 31.841 -13.649
249 HB3 ALA 30 2HB ALA 30 5.981 31.376 -13.650
Start of MODEL 9
1 H1 MET 1 H MET 1 1.212 -0.437 0.659
2 HA MET 1 HA MET 1 0.415 -1.585 -1.493
3 HB2 MET 1 2HB MET 1 1.530 1.029 -2.523
4 HB3 MET 1 3HB MET 1 1.100 -0.347 -3.528
5 HG2 MET 1 2HG MET 1 -1.221 -0.147 -2.852
6 HG3 MET 1 3HG MET 1 -0.808 1.189 -1.781
7 HE1 MET 1 3HE MET 1 -2.906 2.349 -3.093
8 HE2 MET 1 1HE MET 1 -2.870 2.744 -4.811
9 HE3 MET 1 2HE MET 1 -3.026 1.064 -4.295
10 H LYS 2 H LYS 2 1.861 -3.163 -1.173
11 HA LYS 2 HA LYS 2 4.696 -2.558 -0.960
12 HB2 LYS 2 2HB LYS 2 3.793 -4.187 0.586
13 HB3 LYS 2 3HB LYS 2 3.160 -5.152 -0.741
14 HG2 LYS 2 2HG LYS 2 5.185 -6.047 -1.243
15 HG3 LYS 2 3HG LYS 2 6.074 -4.617 -0.714
16 HD2 LYS 2 2HD LYS 2 6.618 -5.989 1.010
17 HD3 LYS 2 3HD LYS 2 5.083 -5.393 1.644
18 HE2 LYS 2 2HE LYS 2 3.942 -7.350 1.003
19 HE3 LYS 2 3HE LYS 2 5.258 -7.869 -0.048
20 HZ1 LYS 2 3HZ LYS 2 5.543 -7.630 2.893
21 HZ2 LYS 2 1HZ LYS 2 6.596 -8.391 1.809
22 HZ3 LYS 2 2HZ LYS 2 5.078 -9.064 2.128
23 H THR 3 H THR 3 2.429 -3.849 -3.258
24 HA THR 3 HA THR 3 4.601 -4.665 -5.051
25 HB THR 3 HB THR 3 2.711 -6.247 -4.684
26 HG1 THR 3 HG1 THR 3 3.332 -6.844 -6.609
27 HG21 THR 3 1HG2 THR 3 0.966 -4.430 -4.539
28 HG22 THR 3 2HG2 THR 3 0.536 -5.809 -5.551
29 HG23 THR 3 3HG2 THR 3 1.067 -4.300 -6.294
30 H ILE 4 H ILE 4 4.039 -1.862 -4.502
31 HA ILE 4 HA ILE 4 2.604 -0.722 -6.677
32 HB ILE 4 HB ILE 4 3.074 0.430 -4.491
33 HG12 ILE 4 2HG1 ILE 4 3.969 1.959 -6.942
34 HG13 ILE 4 3HG1 ILE 4 2.289 1.598 -6.559
35 HG21 ILE 4 1HG2 ILE 4 5.504 -0.234 -4.482
36 HG22 ILE 4 2HG2 ILE 4 5.770 1.029 -5.683
37 HG23 ILE 4 3HG2 ILE 4 5.173 1.450 -4.077
38 HD11 ILE 4 3HD1 ILE 4 3.413 2.797 -4.272
39 HD12 ILE 4 1HD1 ILE 4 3.910 3.758 -5.665
40 HD13 ILE 4 2HD1 ILE 4 2.198 3.455 -5.369
41 H LEU 5 H LEU 5 5.618 -2.203 -6.494
42 HA LEU 5 HA LEU 5 7.275 -0.735 -8.138
43 HB2 LEU 5 2HB LEU 5 8.513 -2.684 -8.479
44 HB3 LEU 5 3HB LEU 5 7.749 -2.908 -6.906
45 HG LEU 5 HG LEU 5 5.942 -4.164 -8.406
46 HD11 LEU 5 1HD1 LEU 5 6.579 -4.741 -10.453
47 HD12 LEU 5 2HD1 LEU 5 8.143 -5.314 -9.871
48 HD13 LEU 5 3HD1 LEU 5 7.924 -3.613 -10.281
49 HD21 LEU 5 3HD2 LEU 5 8.562 -5.324 -7.464
50 HD22 LEU 5 1HD2 LEU 5 7.123 -6.258 -7.868
51 HD23 LEU 5 2HD2 LEU 5 7.091 -5.133 -6.509
52 H ARG 6 H ARG 6 4.576 -2.809 -9.003
53 HA ARG 6 HA ARG 6 5.091 -2.784 -11.810
54 HB2 ARG 6 2HB ARG 6 2.966 -3.859 -12.048
55 HB3 ARG 6 3HB ARG 6 3.740 -4.524 -10.615
56 HG2 ARG 6 2HG ARG 6 1.682 -4.190 -9.749
57 HG3 ARG 6 3HG ARG 6 2.339 -2.578 -9.455
58 HD2 ARG 6 2HD ARG 6 0.527 -1.852 -10.553
59 HD3 ARG 6 3HD ARG 6 1.399 -2.345 -12.004
60 HE ARG 6 HE ARG 6 -0.157 -3.980 -12.303
61 HH11 ARG 6 1HH1 ARG 6 -0.183 -3.032 -8.954
62 HH12 ARG 6 2HH1 ARG 6 -1.530 -4.041 -8.543
63 HH21 ARG 6 1HH2 ARG 6 -1.932 -5.312 -11.776
64 HH22 ARG 6 2HH2 ARG 6 -2.524 -5.338 -10.149
65 H PHE 7 H PHE 7 3.278 -0.764 -9.602
66 HA PHE 7 HA PHE 7 1.886 0.682 -11.647
67 HB2 PHE 7 2HB PHE 7 0.873 0.577 -9.476
68 HB3 PHE 7 3HB PHE 7 2.322 1.216 -8.706
69 HD1 PHE 7 HD2 PHE 7 0.054 2.233 -11.496
70 HD2 PHE 7 HD1 PHE 7 2.134 3.366 -7.960
71 HE1 PHE 7 HE2 PHE 7 -0.848 4.512 -11.700
72 HE2 PHE 7 HE1 PHE 7 1.234 5.647 -8.157
73 HZ PHE 7 HZ PHE 7 -0.259 6.223 -10.030
74 H VAL 8 H VAL 8 4.606 1.462 -9.485
75 HA VAL 8 HA VAL 8 5.147 3.994 -10.604
76 HB VAL 8 HB VAL 8 7.013 2.132 -9.128
77 HG11 VAL 8 1HG1 VAL 8 8.336 4.143 -8.668
78 HG12 VAL 8 2HG1 VAL 8 8.244 3.806 -10.398
79 HG13 VAL 8 3HG1 VAL 8 7.255 5.085 -9.694
80 HG21 VAL 8 3HG2 VAL 8 4.770 3.695 -8.270
81 HG22 VAL 8 1HG2 VAL 8 5.813 2.629 -7.327
82 HG23 VAL 8 2HG2 VAL 8 6.249 4.324 -7.542
83 H ALA 9 H ALA 9 6.187 0.755 -11.438
84 HA ALA 9 HA ALA 9 8.384 1.250 -13.032
85 HB1 ALA 9 3HB ALA 9 7.524 -0.785 -14.362
86 HB2 ALA 9 1HB ALA 9 7.914 -0.994 -12.655
87 HB3 ALA 9 2HB ALA 9 6.233 -0.830 -13.162
88 H GLY 10 H GLY 10 4.959 1.217 -14.027
89 HA2 GLY 10 2HA GLY 10 5.523 2.001 -16.712
90 HA3 GLY 10 3HA GLY 10 3.944 1.990 -15.944
91 H TYR 11 H TYR 11 4.914 3.743 -13.753
92 HA TYR 11 HA TYR 11 4.266 6.233 -14.983
93 HB2 TYR 11 2HB TYR 11 3.756 5.468 -12.581
94 HB3 TYR 11 3HB TYR 11 5.415 5.928 -12.216
95 HD1 TYR 11 HD1 TYR 11 6.081 8.365 -12.968
96 HD2 TYR 11 HD2 TYR 11 2.085 7.048 -12.333
97 HE1 TYR 11 HE1 TYR 11 5.369 10.698 -12.648
98 HE2 TYR 11 HE2 TYR 11 1.362 9.377 -12.014
99 HH TYR 11 HH TYR 11 2.594 11.596 -11.237
100 H ASP 12 H ASP 12 7.230 4.683 -13.946
101 HA ASP 12 HA ASP 12 8.917 6.941 -14.037
102 HB2 ASP 12 2HB ASP 12 9.380 4.605 -13.049
103 HB3 ASP 12 3HB ASP 12 9.828 4.147 -14.689
104 H ILE 13 H ILE 13 7.661 4.834 -16.506
105 HA ILE 13 HA ILE 13 9.476 5.883 -18.526
106 HB ILE 13 HB ILE 13 7.194 3.922 -18.800
107 HG12 ILE 13 2HG1 ILE 13 9.847 2.874 -19.268
108 HG13 ILE 13 3HG1 ILE 13 9.741 3.587 -17.663
109 HG21 ILE 13 1HG2 ILE 13 8.190 3.413 -20.992
110 HG22 ILE 13 2HG2 ILE 13 7.619 5.078 -20.886
111 HG23 ILE 13 3HG2 ILE 13 9.343 4.726 -20.756
112 HD11 ILE 13 3HD1 ILE 13 8.576 1.132 -18.707
113 HD12 ILE 13 1HD1 ILE 13 8.941 1.605 -17.048
114 HD13 ILE 13 2HD1 ILE 13 7.436 2.131 -17.804
115 H ALA 14 H ALA 14 6.005 5.901 -17.787
116 HA ALA 14 HA ALA 14 5.202 7.455 -19.994
117 HB1 ALA 14 3HB ALA 14 3.945 7.018 -17.294
118 HB2 ALA 14 1HB ALA 14 3.172 7.934 -18.588
119 HB3 ALA 14 2HB ALA 14 3.546 6.225 -18.819
120 H SER 15 H SER 15 6.329 8.318 -16.770
121 HA SER 15 HA SER 15 5.725 11.093 -16.991
122 HB2 SER 15 2HB SER 15 7.011 11.354 -14.957
123 HB3 SER 15 3HB SER 15 6.037 9.891 -14.821
124 HG SER 15 HG SER 15 8.281 9.675 -14.167
125 H HIS 16 H HIS 16 8.395 9.090 -17.953
126 HA HIS 16 HA HIS 16 10.174 11.330 -18.410
127 HB2 HIS 16 2HB HIS 16 10.981 9.068 -17.675
128 HB3 HIS 16 3HB HIS 16 10.531 8.451 -19.262
129 HD1 HIS 16 HD1 HIS 16 12.347 8.473 -20.936
130 HD2 HIS 16 HD2 HIS 16 12.972 11.285 -17.941
131 HE1 HIS 16 HE1 HIS 16 14.594 9.492 -21.427
132 H LYS 17 H LYS 17 7.962 9.338 -20.219
133 HA LYS 17 HA LYS 17 8.913 10.176 -22.800
134 HB2 LYS 17 2HB LYS 17 7.516 8.033 -22.030
135 HB3 LYS 17 3HB LYS 17 6.168 9.076 -22.461
136 HG2 LYS 17 2HG LYS 17 6.540 8.848 -24.650
137 HG3 LYS 17 3HG LYS 17 8.288 9.018 -24.466
138 HD2 LYS 17 2HD LYS 17 7.329 6.521 -23.353
139 HD3 LYS 17 3HD LYS 17 6.890 6.688 -25.055
140 HE2 LYS 17 2HE LYS 17 9.055 5.590 -24.809
141 HE3 LYS 17 3HE LYS 17 9.222 7.148 -25.616
142 HZ1 LYS 17 3HZ LYS 17 9.873 8.101 -23.452
143 HZ2 LYS 17 1HZ LYS 17 10.947 6.912 -23.995
144 HZ3 LYS 17 2HZ LYS 17 9.834 6.551 -22.774
145 H LYS 18 H LYS 18 5.882 10.754 -21.007
146 HA LYS 18 HA LYS 18 5.187 12.948 -22.752
147 HB2 LYS 18 2HB LYS 18 3.884 11.637 -20.385
148 HB3 LYS 18 3HB LYS 18 3.284 13.172 -20.998
149 HG2 LYS 18 2HG LYS 18 2.955 12.134 -23.205
150 HG3 LYS 18 3HG LYS 18 3.489 10.590 -22.536
151 HD2 LYS 18 2HD LYS 18 1.443 11.720 -20.871
152 HD3 LYS 18 3HD LYS 18 0.888 11.664 -22.546
153 HE2 LYS 18 2HE LYS 18 1.298 9.318 -22.680
154 HE3 LYS 18 3HE LYS 18 2.140 9.317 -21.132
155 HZ1 LYS 18 3HZ LYS 18 -0.754 9.639 -21.642
156 HZ2 LYS 18 1HZ LYS 18 -0.057 10.104 -20.172
157 HZ3 LYS 18 2HZ LYS 18 0.022 8.491 -20.673
158 H LYS 19 H LYS 19 5.875 12.598 -19.272
159 HA LYS 19 HA LYS 19 6.556 14.097 -17.698
160 HB2 LYS 19 2HB LYS 19 8.526 13.997 -19.321
161 HB3 LYS 19 3HB LYS 19 7.947 15.532 -19.955
162 HG2 LYS 19 2HG LYS 19 8.164 15.580 -17.070
163 HG3 LYS 19 3HG LYS 19 9.695 15.162 -17.843
164 HD2 LYS 19 2HD LYS 19 8.961 17.196 -19.420
165 HD3 LYS 19 3HD LYS 19 8.139 17.681 -17.935
166 HE2 LYS 19 2HE LYS 19 10.266 18.694 -17.849
167 HE3 LYS 19 3HE LYS 19 10.352 17.313 -16.757
168 HZ1 LYS 19 3HZ LYS 19 11.669 16.131 -18.222
169 HZ2 LYS 19 1HZ LYS 19 12.262 17.705 -18.402
170 HZ3 LYS 19 2HZ LYS 19 11.217 17.057 -19.563
171 H THR 20 H THR 20 4.465 14.946 -17.318
172 HA THR 20 HA THR 20 4.280 17.765 -17.676
173 HB THR 20 HB THR 20 3.472 17.270 -19.874
174 HG1 THR 20 HG1 THR 20 2.168 18.839 -19.184
175 HG21 THR 20 1HG2 THR 20 1.668 15.739 -20.338
176 HG22 THR 20 2HG2 THR 20 1.445 15.418 -18.618
177 HG23 THR 20 3HG2 THR 20 2.915 14.885 -19.431
178 H GLY 21 H GLY 21 2.648 18.714 -16.399
179 HA2 GLY 21 2HA GLY 21 0.532 17.423 -15.150
180 HA3 GLY 21 3HA GLY 21 1.926 17.212 -14.099
181 H GLY 22 H GLY 22 -0.509 19.365 -15.208
182 HA2 GLY 22 2HA GLY 22 -1.184 21.144 -13.703
183 HA3 GLY 22 3HA GLY 22 0.515 21.406 -13.339
184 H TYR 23 H TYR 23 -2.095 22.109 -15.480
185 HA TYR 23 HA TYR 23 -0.593 23.292 -17.577
186 HB2 TYR 23 2HB TYR 23 -3.460 23.312 -16.739
187 HB3 TYR 23 3HB TYR 23 -2.916 24.518 -17.900
188 HD1 TYR 23 HD1 TYR 23 -1.112 23.183 -19.648
189 HD2 TYR 23 HD2 TYR 23 -4.627 21.639 -17.812
190 HE1 TYR 23 HE1 TYR 23 -1.331 21.539 -21.463
191 HE2 TYR 23 HE2 TYR 23 -4.854 19.989 -19.622
192 HH TYR 23 HH TYR 23 -2.937 18.884 -21.356
193 HA PRO 24 HA PRO 24 0.430 27.272 -16.043
194 HB2 PRO 24 2HB PRO 24 -0.020 28.860 -18.199
195 HB3 PRO 24 3HB PRO 24 1.335 27.728 -18.106
196 HG2 PRO 24 2HG PRO 24 -1.305 27.412 -19.480
197 HG3 PRO 24 3HG PRO 24 0.315 26.978 -20.055
198 HD2 PRO 24 2HD PRO 24 -1.405 25.153 -19.033
199 HD3 PRO 24 3HD PRO 24 0.355 25.014 -18.848
200 H TRP 25 H TRP 25 -2.726 26.895 -17.529
201 HA TRP 25 HA TRP 25 -3.705 29.293 -16.159
202 HB2 TRP 25 2HB TRP 25 -5.799 28.839 -17.520
203 HB3 TRP 25 3HB TRP 25 -4.360 29.263 -18.443
204 HD1 TRP 25 HD1 TRP 25 -3.610 27.602 -20.279
205 HE1 TRP 25 HE1 TRP 25 -4.400 25.278 -21.054
206 HE3 TRP 25 HE3 TRP 25 -6.869 26.546 -16.484
207 HZ2 TRP 25 HZ2 TRP 25 -6.173 23.264 -20.173
208 HZ3 TRP 25 HZ3 TRP 25 -8.073 24.401 -16.526
209 HH2 TRP 25 HH2 TRP 25 -7.731 22.796 -18.334
210 H GLU 26 H GLU 26 -3.671 25.889 -15.916
211 HA GLU 26 HA GLU 26 -6.029 25.820 -14.190
212 HB2 GLU 26 2HB GLU 26 -5.200 24.043 -16.031
213 HB3 GLU 26 3HB GLU 26 -4.400 23.380 -14.614
214 HG2 GLU 26 2HG GLU 26 -7.215 24.079 -14.211
215 HG3 GLU 26 3HG GLU 26 -6.929 22.794 -15.384
216 H ARG 27 H ARG 27 -3.959 27.323 -13.150
217 HA ARG 27 HA ARG 27 -2.715 25.591 -11.130
218 HB2 ARG 27 2HB ARG 27 -1.420 27.315 -12.620
219 HB3 ARG 27 3HB ARG 27 -2.040 28.489 -11.467
220 HG2 ARG 27 2HG ARG 27 -0.486 27.950 -9.985
221 HG3 ARG 27 3HG ARG 27 -0.900 26.238 -10.092
222 HD2 ARG 27 2HD ARG 27 0.562 25.925 -11.951
223 HD3 ARG 27 3HD ARG 27 0.825 27.661 -12.107
224 HE ARG 27 HE ARG 27 2.437 27.510 -10.501
225 HH11 ARG 27 1HH1 ARG 27 0.389 24.703 -10.296
226 HH12 ARG 27 2HH1 ARG 27 1.364 23.917 -9.098
227 HH21 ARG 27 1HH2 ARG 27 3.729 26.486 -8.925
228 HH22 ARG 27 2HH2 ARG 27 3.264 24.933 -8.319
229 H GLY 28 H GLY 28 -5.500 26.252 -10.981
230 HA2 GLY 28 2HA GLY 28 -5.467 27.795 -8.465
231 HA3 GLY 28 3HA GLY 28 -6.706 28.074 -9.681
232 H LYS 29 H LYS 29 -5.418 24.911 -8.877
233 HA LYS 29 HA LYS 29 -7.903 24.267 -7.448
234 HB2 LYS 29 2HB LYS 29 -6.744 22.872 -9.841
235 HB3 LYS 29 3HB LYS 29 -7.719 21.984 -8.678
236 HG2 LYS 29 2HG LYS 29 -9.493 23.771 -9.046
237 HG3 LYS 29 3HG LYS 29 -8.539 24.261 -10.447
238 HD2 LYS 29 2HD LYS 29 -9.850 22.759 -11.512
239 HD3 LYS 29 3HD LYS 29 -8.671 21.608 -10.880
240 HE2 LYS 29 2HE LYS 29 -10.770 20.701 -10.336
241 HE3 LYS 29 3HE LYS 29 -10.178 21.423 -8.840
242 HZ1 LYS 29 3HZ LYS 29 -11.686 23.138 -8.968
243 HZ2 LYS 29 1HZ LYS 29 -12.595 21.855 -9.594
244 HZ3 LYS 29 2HZ LYS 29 -11.902 22.990 -10.639
245 H ALA 30 H ALA 30 -5.333 24.829 -6.371
246 HA ALA 30 HA ALA 30 -3.816 22.525 -5.822
247 HB1 ALA 30 3HB ALA 30 -3.829 24.492 -3.672
248 HB2 ALA 30 1HB ALA 30 -2.502 23.932 -4.691
249 HB3 ALA 30 2HB ALA 30 -3.581 25.203 -5.267
Start of MODEL 10
1 H1 MET 1 H MET 1 2.154 1.170 -0.643
2 HA MET 1 HA MET 1 0.702 -0.850 -1.121
3 HB2 MET 1 2HB MET 1 0.920 0.496 -3.727
4 HB3 MET 1 3HB MET 1 1.164 -1.245 -3.786
5 HG2 MET 1 2HG MET 1 -1.032 -1.194 -2.283
6 HG3 MET 1 3HG MET 1 -1.267 0.314 -3.164
7 HE1 MET 1 3HE MET 1 -2.878 -2.178 -2.848
8 HE2 MET 1 1HE MET 1 -3.739 -1.849 -4.351
9 HE3 MET 1 2HE MET 1 -2.879 -3.374 -4.144
10 H LYS 2 H LYS 2 1.782 -2.763 -1.045
11 HA LYS 2 HA LYS 2 4.606 -2.709 -0.841
12 HB2 LYS 2 2HB LYS 2 2.498 -4.815 -0.690
13 HB3 LYS 2 3HB LYS 2 4.168 -5.327 -0.903
14 HG2 LYS 2 2HG LYS 2 3.308 -3.468 1.295
15 HG3 LYS 2 3HG LYS 2 3.318 -5.224 1.469
16 HD2 LYS 2 2HD LYS 2 5.756 -5.115 0.726
17 HD3 LYS 2 3HD LYS 2 5.644 -3.376 1.005
18 HE2 LYS 2 2HE LYS 2 5.734 -3.620 3.228
19 HE3 LYS 2 3HE LYS 2 4.601 -4.970 3.214
20 HZ1 LYS 2 3HZ LYS 2 6.775 -5.641 4.026
21 HZ2 LYS 2 1HZ LYS 2 7.497 -5.143 2.579
22 HZ3 LYS 2 2HZ LYS 2 6.409 -6.438 2.580
23 H THR 3 H THR 3 2.391 -3.958 -3.304
24 HA THR 3 HA THR 3 4.663 -4.640 -5.019
25 HB THR 3 HB THR 3 2.832 -6.301 -4.750
26 HG1 THR 3 HG1 THR 3 3.345 -6.895 -6.712
27 HG21 THR 3 1HG2 THR 3 1.188 -4.055 -5.188
28 HG22 THR 3 2HG2 THR 3 0.688 -5.728 -4.938
29 HG23 THR 3 3HG2 THR 3 0.960 -5.122 -6.572
30 H ILE 4 H ILE 4 4.058 -1.875 -4.500
31 HA ILE 4 HA ILE 4 2.620 -0.736 -6.671
32 HB ILE 4 HB ILE 4 3.093 0.413 -4.485
33 HG12 ILE 4 2HG1 ILE 4 3.972 1.951 -6.937
34 HG13 ILE 4 3HG1 ILE 4 2.295 1.583 -6.547
35 HG21 ILE 4 1HG2 ILE 4 5.189 1.442 -4.078
36 HG22 ILE 4 2HG2 ILE 4 5.525 -0.240 -4.485
37 HG23 ILE 4 3HG2 ILE 4 5.782 1.026 -5.685
38 HD11 ILE 4 3HD1 ILE 4 3.821 3.789 -5.732
39 HD12 ILE 4 1HD1 ILE 4 2.176 3.369 -5.256
40 HD13 ILE 4 2HD1 ILE 4 3.542 2.808 -4.292
41 H LEU 5 H LEU 5 5.640 -2.206 -6.501
42 HA LEU 5 HA LEU 5 7.286 -0.728 -8.149
43 HB2 LEU 5 2HB LEU 5 8.531 -2.671 -8.497
44 HB3 LEU 5 3HB LEU 5 7.774 -2.899 -6.921
45 HG LEU 5 HG LEU 5 5.967 -4.163 -8.416
46 HD11 LEU 5 1HD1 LEU 5 8.132 -5.329 -9.896
47 HD12 LEU 5 2HD1 LEU 5 7.980 -3.616 -10.283
48 HD13 LEU 5 3HD1 LEU 5 6.594 -4.690 -10.476
49 HD21 LEU 5 3HD2 LEU 5 8.562 -5.160 -7.288
50 HD22 LEU 5 1HD2 LEU 5 7.381 -6.256 -8.002
51 HD23 LEU 5 2HD2 LEU 5 6.939 -5.275 -6.605
52 H ARG 6 H ARG 6 4.593 -2.813 -9.007
53 HA ARG 6 HA ARG 6 5.098 -2.783 -11.816
54 HB2 ARG 6 2HB ARG 6 2.986 -3.875 -12.049
55 HB3 ARG 6 3HB ARG 6 3.754 -4.525 -10.606
56 HG2 ARG 6 2HG ARG 6 1.704 -4.188 -9.736
57 HG3 ARG 6 3HG ARG 6 2.334 -2.559 -9.484
58 HD2 ARG 6 2HD ARG 6 0.421 -1.983 -10.546
59 HD3 ARG 6 3HD ARG 6 1.408 -2.280 -11.977
60 HE ARG 6 HE ARG 6 0.055 -4.048 -12.473
61 HH11 ARG 6 1HH1 ARG 6 -0.311 -3.281 -9.097
62 HH12 ARG 6 2HH1 ARG 6 -1.592 -4.418 -8.844
63 HH21 ARG 6 1HH2 ARG 6 -1.631 -5.550 -12.152
64 HH22 ARG 6 2HH2 ARG 6 -2.343 -5.709 -10.582
65 H PHE 7 H PHE 7 3.288 -0.771 -9.599
66 HA PHE 7 HA PHE 7 1.884 0.672 -11.639
67 HB2 PHE 7 2HB PHE 7 0.877 0.561 -9.465
68 HB3 PHE 7 3HB PHE 7 2.326 1.204 -8.699
69 HD1 PHE 7 HD2 PHE 7 0.054 2.219 -11.487
70 HD2 PHE 7 HD1 PHE 7 2.126 3.351 -7.945
71 HE1 PHE 7 HE2 PHE 7 -0.857 4.495 -11.687
72 HE2 PHE 7 HE1 PHE 7 1.216 5.629 -8.138
73 HZ PHE 7 HZ PHE 7 -0.276 6.204 -10.012
74 H VAL 8 H VAL 8 4.597 1.473 -9.473
75 HA VAL 8 HA VAL 8 5.127 4.004 -10.595
76 HB VAL 8 HB VAL 8 7.008 2.145 -9.131
77 HG11 VAL 8 1HG1 VAL 8 8.226 3.829 -10.400
78 HG12 VAL 8 2HG1 VAL 8 7.233 5.103 -9.687
79 HG13 VAL 8 3HG1 VAL 8 8.325 4.159 -8.671
80 HG21 VAL 8 3HG2 VAL 8 6.239 4.329 -7.536
81 HG22 VAL 8 1HG2 VAL 8 4.761 3.694 -8.261
82 HG23 VAL 8 2HG2 VAL 8 5.812 2.632 -7.322
83 H ALA 9 H ALA 9 6.180 0.771 -11.439
84 HA ALA 9 HA ALA 9 8.367 1.280 -13.041
85 HB1 ALA 9 3HB ALA 9 7.623 -0.767 -14.332
86 HB2 ALA 9 1HB ALA 9 7.821 -0.968 -12.591
87 HB3 ALA 9 2HB ALA 9 6.207 -0.797 -13.281
88 H GLY 10 H GLY 10 4.938 1.241 -14.015
89 HA2 GLY 10 2HA GLY 10 5.483 2.024 -16.705
90 HA3 GLY 10 3HA GLY 10 3.908 2.013 -15.926
91 H TYR 11 H TYR 11 4.893 3.767 -13.743
92 HA TYR 11 HA TYR 11 4.242 6.257 -14.976
93 HB2 TYR 11 2HB TYR 11 3.726 5.492 -12.574
94 HB3 TYR 11 3HB TYR 11 5.384 5.953 -12.205
95 HD1 TYR 11 HD1 TYR 11 6.048 8.391 -12.967
96 HD2 TYR 11 HD2 TYR 11 2.055 7.070 -12.319
97 HE1 TYR 11 HE1 TYR 11 5.334 10.723 -12.652
98 HE2 TYR 11 HE2 TYR 11 1.330 9.399 -12.003
99 HH TYR 11 HH TYR 11 3.654 12.081 -12.134
100 H ASP 12 H ASP 12 7.202 4.707 -13.925
101 HA ASP 12 HA ASP 12 8.889 6.965 -14.018
102 HB2 ASP 12 2HB ASP 12 9.327 4.600 -13.042
103 HB3 ASP 12 3HB ASP 12 9.838 4.191 -14.678
104 H ILE 13 H ILE 13 7.671 4.821 -16.482
105 HA ILE 13 HA ILE 13 9.483 5.871 -18.499
106 HB ILE 13 HB ILE 13 7.203 3.909 -18.776
107 HG12 ILE 13 2HG1 ILE 13 9.876 2.878 -19.214
108 HG13 ILE 13 3HG1 ILE 13 9.724 3.570 -17.604
109 HG21 ILE 13 1HG2 ILE 13 8.257 3.380 -20.955
110 HG22 ILE 13 2HG2 ILE 13 7.612 5.019 -20.871
111 HG23 ILE 13 3HG2 ILE 13 9.348 4.747 -20.721
112 HD11 ILE 13 3HD1 ILE 13 8.636 1.109 -18.691
113 HD12 ILE 13 1HD1 ILE 13 8.902 1.593 -17.016
114 HD13 ILE 13 2HD1 ILE 13 7.430 2.087 -17.853
115 H ALA 14 H ALA 14 6.006 5.884 -17.788
116 HA ALA 14 HA ALA 14 5.210 7.424 -20.003
117 HB1 ALA 14 3HB ALA 14 3.118 7.626 -18.953
118 HB2 ALA 14 1HB ALA 14 3.750 6.066 -18.424
119 HB3 ALA 14 2HB ALA 14 3.816 7.458 -17.342
120 H SER 15 H SER 15 6.330 8.320 -16.784
121 HA SER 15 HA SER 15 5.740 11.097 -17.050
122 HB2 SER 15 2HB SER 15 6.936 11.382 -14.989
123 HB3 SER 15 3HB SER 15 6.042 9.868 -14.866
124 HG SER 15 HG SER 15 7.917 9.050 -14.396
125 H HIS 16 H HIS 16 8.406 9.062 -17.952
126 HA HIS 16 HA HIS 16 10.223 11.268 -18.394
127 HB2 HIS 16 2HB HIS 16 10.401 8.379 -18.280
128 HB3 HIS 16 3HB HIS 16 11.232 9.005 -19.701
129 HD1 HIS 16 HD1 HIS 16 13.634 9.019 -19.104
130 HD2 HIS 16 HD2 HIS 16 11.264 10.480 -16.021
131 HE1 HIS 16 HE1 HIS 16 15.240 9.800 -17.334
132 H LYS 17 H LYS 17 8.017 9.301 -20.250
133 HA LYS 17 HA LYS 17 8.992 10.156 -22.811
134 HB2 LYS 17 2HB LYS 17 6.635 8.577 -21.851
135 HB3 LYS 17 3HB LYS 17 6.654 9.186 -23.501
136 HG2 LYS 17 2HG LYS 17 8.837 8.030 -23.827
137 HG3 LYS 17 3HG LYS 17 8.631 7.306 -22.231
138 HD2 LYS 17 2HD LYS 17 6.924 5.942 -22.921
139 HD3 LYS 17 3HD LYS 17 6.407 7.052 -24.192
140 HE2 LYS 17 2HE LYS 17 8.543 6.471 -25.401
141 HE3 LYS 17 3HE LYS 17 8.778 5.196 -24.207
142 HZ1 LYS 17 3HZ LYS 17 7.126 3.948 -25.078
143 HZ2 LYS 17 1HZ LYS 17 7.517 4.799 -26.487
144 HZ3 LYS 17 2HZ LYS 17 6.194 5.278 -25.550
145 H LYS 18 H LYS 18 5.985 10.798 -21.001
146 HA LYS 18 HA LYS 18 5.324 13.004 -22.750
147 HB2 LYS 18 2HB LYS 18 3.979 11.461 -20.639
148 HB3 LYS 18 3HB LYS 18 3.563 13.170 -20.659
149 HG2 LYS 18 2HG LYS 18 3.410 12.454 -23.314
150 HG3 LYS 18 3HG LYS 18 2.781 11.038 -22.467
151 HD2 LYS 18 2HD LYS 18 1.438 12.846 -21.113
152 HD3 LYS 18 3HD LYS 18 1.734 13.830 -22.548
153 HE2 LYS 18 2HE LYS 18 -0.358 12.768 -22.876
154 HE3 LYS 18 3HE LYS 18 0.799 11.928 -23.908
155 HZ1 LYS 18 3HZ LYS 18 0.069 10.959 -21.205
156 HZ2 LYS 18 1HZ LYS 18 0.885 10.119 -22.425
157 HZ3 LYS 18 2HZ LYS 18 -0.757 10.480 -22.600
158 H LYS 19 H LYS 19 5.899 12.673 -19.243
159 HA LYS 19 HA LYS 19 6.617 14.159 -17.675
160 HB2 LYS 19 2HB LYS 19 8.631 13.953 -19.223
161 HB3 LYS 19 3HB LYS 19 8.129 15.489 -19.919
162 HG2 LYS 19 2HG LYS 19 8.141 16.035 -17.236
163 HG3 LYS 19 3HG LYS 19 9.502 14.925 -17.412
164 HD2 LYS 19 2HD LYS 19 10.135 16.430 -19.432
165 HD3 LYS 19 3HD LYS 19 9.071 17.611 -18.663
166 HE2 LYS 19 2HE LYS 19 10.853 18.212 -17.459
167 HE3 LYS 19 3HE LYS 19 10.621 16.706 -16.574
168 HZ1 LYS 19 3HZ LYS 19 12.435 15.808 -17.484
169 HZ2 LYS 19 1HZ LYS 19 12.868 17.393 -17.890
170 HZ3 LYS 19 2HZ LYS 19 12.098 16.408 -19.030
171 H THR 20 H THR 20 4.561 15.103 -17.356
172 HA THR 20 HA THR 20 4.500 17.927 -17.906
173 HB THR 20 HB THR 20 3.488 17.286 -19.963
174 HG1 THR 20 HG1 THR 20 1.181 17.927 -19.449
175 HG21 THR 20 1HG2 THR 20 1.729 15.460 -18.323
176 HG22 THR 20 2HG2 THR 20 2.958 14.976 -19.491
177 HG23 THR 20 3HG2 THR 20 1.498 15.800 -20.037
178 H GLY 21 H GLY 21 2.922 19.054 -16.661
179 HA2 GLY 21 2HA GLY 21 2.360 17.791 -14.155
180 HA3 GLY 21 3HA GLY 21 1.904 19.422 -14.624
181 H GLY 22 H GLY 22 -0.147 19.830 -15.318
182 HA2 GLY 22 2HA GLY 22 -2.065 18.564 -16.536
183 HA3 GLY 22 3HA GLY 22 -2.023 17.582 -15.079
184 H TYR 23 H TYR 23 -3.282 20.356 -16.541
185 HA TYR 23 HA TYR 23 -3.749 22.062 -14.390
186 HB2 TYR 23 2HB TYR 23 -5.098 21.587 -17.012
187 HB3 TYR 23 3HB TYR 23 -5.907 22.602 -15.823
188 HD1 TYR 23 HD1 TYR 23 -3.877 24.184 -14.614
189 HD2 TYR 23 HD2 TYR 23 -4.146 22.888 -18.657
190 HE1 TYR 23 HE1 TYR 23 -2.506 26.103 -15.313
191 HE2 TYR 23 HE2 TYR 23 -2.774 24.802 -19.368
192 HH TYR 23 HH TYR 23 -1.085 26.780 -17.144
193 HA PRO 24 HA PRO 24 -6.817 20.193 -11.872
194 HB2 PRO 24 2HB PRO 24 -8.415 22.296 -11.246
195 HB3 PRO 24 3HB PRO 24 -6.787 22.098 -10.589
196 HG2 PRO 24 2HG PRO 24 -7.716 23.805 -12.866
197 HG3 PRO 24 3HG PRO 24 -6.578 24.199 -11.565
198 HD2 PRO 24 2HD PRO 24 -5.764 23.501 -14.051
199 HD3 PRO 24 3HD PRO 24 -4.828 23.108 -12.594
200 H TRP 25 H TRP 25 -7.929 22.078 -14.615
201 HA TRP 25 HA TRP 25 -10.519 20.707 -14.560
202 HB2 TRP 25 2HB TRP 25 -11.074 22.340 -16.422
203 HB3 TRP 25 3HB TRP 25 -10.778 23.052 -14.839
204 HD1 TRP 25 HD1 TRP 25 -8.945 24.872 -14.693
205 HE1 TRP 25 HE1 TRP 25 -7.244 25.868 -16.350
206 HE3 TRP 25 HE3 TRP 25 -9.544 21.574 -18.555
207 HZ2 TRP 25 HZ2 TRP 25 -6.284 25.327 -18.949
208 HZ3 TRP 25 HZ3 TRP 25 -8.198 21.885 -20.590
209 HH2 TRP 25 HH2 TRP 25 -6.602 23.723 -20.782
210 H GLU 26 H GLU 26 -7.487 20.652 -16.125
211 HA GLU 26 HA GLU 26 -8.529 19.239 -18.461
212 HB2 GLU 26 2HB GLU 26 -6.556 21.060 -18.300
213 HB3 GLU 26 3HB GLU 26 -5.608 19.594 -18.093
214 HG2 GLU 26 2HG GLU 26 -7.546 19.568 -20.310
215 HG3 GLU 26 3HG GLU 26 -6.190 20.683 -20.476
216 H ARG 27 H ARG 27 -8.969 17.821 -16.181
217 HA ARG 27 HA ARG 27 -6.944 15.684 -16.316
218 HB2 ARG 27 2HB ARG 27 -7.630 17.120 -14.081
219 HB3 ARG 27 3HB ARG 27 -8.669 15.708 -13.942
220 HG2 ARG 27 2HG ARG 27 -6.715 14.251 -14.111
221 HG3 ARG 27 3HG ARG 27 -5.674 15.671 -14.244
222 HD2 ARG 27 2HD ARG 27 -5.613 14.899 -11.977
223 HD3 ARG 27 3HD ARG 27 -6.513 16.415 -12.024
224 HE ARG 27 HE ARG 27 -8.307 14.262 -12.251
225 HH11 ARG 27 1HH1 ARG 27 -6.205 15.782 -9.928
226 HH12 ARG 27 2HH1 ARG 27 -7.157 15.305 -8.561
227 HH21 ARG 27 1HH2 ARG 27 -9.568 13.628 -10.459
228 HH22 ARG 27 2HH2 ARG 27 -9.069 14.079 -8.864
229 H GLY 28 H GLY 28 -9.295 16.038 -18.008
230 HA2 GLY 28 2HA GLY 28 -10.203 13.485 -18.295
231 HA3 GLY 28 3HA GLY 28 -11.297 14.177 -17.107
232 H LYS 29 H LYS 29 -9.788 15.657 -19.960
233 HA LYS 29 HA LYS 29 -12.485 16.053 -21.075
234 HB2 LYS 29 2HB LYS 29 -10.662 18.041 -20.189
235 HB3 LYS 29 3HB LYS 29 -10.719 18.132 -21.944
236 HG2 LYS 29 2HG LYS 29 -13.108 18.427 -21.899
237 HG3 LYS 29 3HG LYS 29 -13.138 18.185 -20.151
238 HD2 LYS 29 2HD LYS 29 -11.264 20.254 -20.833
239 HD3 LYS 29 3HD LYS 29 -12.840 20.604 -21.545
240 HE2 LYS 29 2HE LYS 29 -13.639 19.869 -19.108
241 HE3 LYS 29 3HE LYS 29 -12.023 20.446 -18.700
242 HZ1 LYS 29 3HZ LYS 29 -13.862 22.134 -18.590
243 HZ2 LYS 29 1HZ LYS 29 -13.942 22.059 -20.278
244 HZ3 LYS 29 2HZ LYS 29 -12.521 22.578 -19.522
245 H ALA 30 H ALA 30 -12.733 15.283 -23.064
246 HA ALA 30 HA ALA 30 -12.267 14.297 -25.066
247 HB1 ALA 30 3HB ALA 30 -9.879 15.772 -25.726
248 HB2 ALA 30 1HB ALA 30 -11.482 15.841 -26.456
249 HB3 ALA 30 2HB ALA 30 -11.112 16.830 -25.043
Start of MODEL 11
1 H1 MET 1 H MET 1 1.426 -0.546 0.754
2 HA MET 1 HA MET 1 0.912 -0.633 -1.950
3 HB2 MET 1 2HB MET 1 2.315 1.871 -1.093
4 HB3 MET 1 3HB MET 1 2.712 1.140 -2.642
5 HG2 MET 1 2HG MET 1 0.907 2.003 -3.582
6 HG3 MET 1 3HG MET 1 -0.133 1.313 -2.339
7 HE1 MET 1 3HE MET 1 -0.850 3.701 -3.841
8 HE2 MET 1 1HE MET 1 -1.865 3.710 -2.398
9 HE3 MET 1 2HE MET 1 -0.992 5.167 -2.870
10 H LYS 2 H LYS 2 1.833 -2.665 -1.466
11 HA LYS 2 HA LYS 2 4.692 -2.723 -0.852
12 HB2 LYS 2 2HB LYS 2 2.481 -4.421 -0.254
13 HB3 LYS 2 3HB LYS 2 3.627 -5.341 -1.222
14 HG2 LYS 2 2HG LYS 2 5.056 -5.525 0.471
15 HG3 LYS 2 3HG LYS 2 4.935 -3.809 0.865
16 HD2 LYS 2 2HD LYS 2 2.524 -5.278 1.557
17 HD3 LYS 2 3HD LYS 2 3.955 -5.914 2.371
18 HE2 LYS 2 2HE LYS 2 3.039 -4.241 3.786
19 HE3 LYS 2 3HE LYS 2 4.489 -3.556 3.055
20 HZ1 LYS 2 3HZ LYS 2 1.710 -2.795 2.720
21 HZ2 LYS 2 1HZ LYS 2 2.636 -2.793 1.303
22 HZ3 LYS 2 2HZ LYS 2 3.112 -1.852 2.626
23 H THR 3 H THR 3 2.410 -3.958 -3.280
24 HA THR 3 HA THR 3 4.644 -4.652 -5.034
25 HB THR 3 HB THR 3 2.799 -6.287 -4.740
26 HG1 THR 3 HG1 THR 3 3.326 -6.868 -6.698
27 HG21 THR 3 1HG2 THR 3 0.658 -5.686 -4.886
28 HG22 THR 3 2HG2 THR 3 0.905 -5.073 -6.520
29 HG23 THR 3 3HG2 THR 3 1.175 -4.019 -5.132
30 H ILE 4 H ILE 4 4.046 -1.870 -4.497
31 HA ILE 4 HA ILE 4 2.617 -0.725 -6.668
32 HB ILE 4 HB ILE 4 3.097 0.420 -4.482
33 HG12 ILE 4 2HG1 ILE 4 3.980 1.955 -6.934
34 HG13 ILE 4 3HG1 ILE 4 2.303 1.595 -6.542
35 HG21 ILE 4 1HG2 ILE 4 5.788 1.021 -5.685
36 HG22 ILE 4 2HG2 ILE 4 5.198 1.441 -4.078
37 HG23 ILE 4 3HG2 ILE 4 5.527 -0.243 -4.484
38 HD11 ILE 4 3HD1 ILE 4 4.017 3.697 -5.569
39 HD12 ILE 4 1HD1 ILE 4 2.266 3.522 -5.452
40 HD13 ILE 4 2HD1 ILE 4 3.311 2.772 -4.245
41 H LEU 5 H LEU 5 5.631 -2.209 -6.501
42 HA LEU 5 HA LEU 5 7.280 -0.737 -8.151
43 HB2 LEU 5 2HB LEU 5 8.516 -2.687 -8.500
44 HB3 LEU 5 3HB LEU 5 7.760 -2.911 -6.924
45 HG LEU 5 HG LEU 5 5.945 -4.167 -8.416
46 HD11 LEU 5 1HD1 LEU 5 8.065 -3.683 -10.244
47 HD12 LEU 5 2HD1 LEU 5 6.566 -4.573 -10.503
48 HD13 LEU 5 3HD1 LEU 5 8.000 -5.414 -9.915
49 HD21 LEU 5 3HD2 LEU 5 8.567 -5.284 -7.437
50 HD22 LEU 5 1HD2 LEU 5 7.186 -6.267 -7.922
51 HD23 LEU 5 2HD2 LEU 5 7.050 -5.175 -6.544
52 H ARG 6 H ARG 6 4.577 -2.811 -9.006
53 HA ARG 6 HA ARG 6 5.079 -2.782 -11.815
54 HB2 ARG 6 2HB ARG 6 2.992 -3.893 -12.048
55 HB3 ARG 6 3HB ARG 6 3.717 -4.506 -10.568
56 HG2 ARG 6 2HG ARG 6 1.637 -4.142 -9.776
57 HG3 ARG 6 3HG ARG 6 2.276 -2.516 -9.530
58 HD2 ARG 6 2HD ARG 6 0.443 -1.898 -10.683
59 HD3 ARG 6 3HD ARG 6 1.424 -2.327 -12.084
60 HE ARG 6 HE ARG 6 0.105 -4.630 -11.228
61 HH11 ARG 6 1HH1 ARG 6 -0.659 -1.515 -12.581
62 HH12 ARG 6 2HH1 ARG 6 -2.092 -2.069 -13.381
63 HH21 ARG 6 1HH2 ARG 6 -1.779 -5.372 -12.276
64 HH22 ARG 6 2HH2 ARG 6 -2.728 -4.264 -13.207
65 H PHE 7 H PHE 7 3.279 -0.763 -9.596
66 HA PHE 7 HA PHE 7 1.880 0.685 -11.634
67 HB2 PHE 7 2HB PHE 7 0.875 0.579 -9.460
68 HB3 PHE 7 3HB PHE 7 2.328 1.217 -8.695
69 HD1 PHE 7 HD2 PHE 7 0.056 2.240 -11.479
70 HD2 PHE 7 HD1 PHE 7 2.139 3.364 -7.942
71 HE1 PHE 7 HE2 PHE 7 -0.847 4.519 -11.677
72 HE2 PHE 7 HE1 PHE 7 1.238 5.646 -8.133
73 HZ PHE 7 HZ PHE 7 -0.255 6.227 -10.003
74 H VAL 8 H VAL 8 4.600 1.474 -9.474
75 HA VAL 8 HA VAL 8 5.140 4.003 -10.594
76 HB VAL 8 HB VAL 8 7.014 2.136 -9.133
77 HG11 VAL 8 1HG1 VAL 8 7.251 5.091 -9.693
78 HG12 VAL 8 2HG1 VAL 8 8.340 4.146 -8.674
79 HG13 VAL 8 3HG1 VAL 8 8.238 3.814 -10.403
80 HG21 VAL 8 3HG2 VAL 8 5.821 2.628 -7.323
81 HG22 VAL 8 1HG2 VAL 8 6.256 4.325 -7.538
82 HG23 VAL 8 2HG2 VAL 8 4.774 3.696 -8.259
83 H ALA 9 H ALA 9 6.178 0.765 -11.440
84 HA ALA 9 HA ALA 9 8.364 1.264 -13.045
85 HB1 ALA 9 3HB ALA 9 7.601 -0.778 -14.339
86 HB2 ALA 9 1HB ALA 9 7.818 -0.982 -12.600
87 HB3 ALA 9 2HB ALA 9 6.196 -0.804 -13.273
88 H GLY 10 H GLY 10 4.934 1.240 -14.015
89 HA2 GLY 10 2HA GLY 10 5.481 2.021 -16.706
90 HA3 GLY 10 3HA GLY 10 3.907 2.017 -15.925
91 H TYR 11 H TYR 11 4.901 3.766 -13.743
92 HA TYR 11 HA TYR 11 4.260 6.259 -14.974
93 HB2 TYR 11 2HB TYR 11 3.738 5.500 -12.573
94 HB3 TYR 11 3HB TYR 11 5.401 5.944 -12.204
95 HD1 TYR 11 HD2 TYR 11 6.087 8.378 -12.965
96 HD2 TYR 11 HD1 TYR 11 2.082 7.093 -12.318
97 HE1 TYR 11 HE2 TYR 11 5.395 10.717 -12.646
98 HE2 TYR 11 HE1 TYR 11 1.379 9.429 -11.997
99 HH TYR 11 HH TYR 11 3.549 11.951 -11.504
100 H ASP 12 H ASP 12 7.214 4.699 -13.920
101 HA ASP 12 HA ASP 12 8.910 6.949 -14.017
102 HB2 ASP 12 2HB ASP 12 9.333 4.576 -13.044
103 HB3 ASP 12 3HB ASP 12 9.857 4.176 -14.677
104 H ILE 13 H ILE 13 7.679 4.812 -16.479
105 HA ILE 13 HA ILE 13 9.493 5.860 -18.497
106 HB ILE 13 HB ILE 13 7.223 3.888 -18.771
107 HG12 ILE 13 2HG1 ILE 13 9.900 2.866 -19.205
108 HG13 ILE 13 3HG1 ILE 13 9.742 3.561 -17.596
109 HG21 ILE 13 1HG2 ILE 13 7.686 5.061 -20.857
110 HG22 ILE 13 2HG2 ILE 13 9.394 4.649 -20.719
111 HG23 ILE 13 3HG2 ILE 13 8.198 3.376 -20.956
112 HD11 ILE 13 3HD1 ILE 13 8.970 1.547 -17.036
113 HD12 ILE 13 1HD1 ILE 13 7.467 2.084 -17.783
114 HD13 ILE 13 2HD1 ILE 13 8.612 1.112 -18.707
115 H ALA 14 H ALA 14 6.023 5.876 -17.766
116 HA ALA 14 HA ALA 14 5.214 7.400 -19.991
117 HB1 ALA 14 3HB ALA 14 3.124 7.548 -18.974
118 HB2 ALA 14 1HB ALA 14 3.788 6.041 -18.342
119 HB3 ALA 14 2HB ALA 14 3.804 7.498 -17.347
120 H SER 15 H SER 15 6.345 8.311 -16.780
121 HA SER 15 HA SER 15 5.742 11.084 -17.046
122 HB2 SER 15 2HB SER 15 6.998 11.378 -15.008
123 HB3 SER 15 3HB SER 15 6.062 9.891 -14.860
124 HG SER 15 HG SER 15 8.073 9.346 -14.210
125 H HIS 16 H HIS 16 8.420 9.063 -17.959
126 HA HIS 16 HA HIS 16 10.261 11.230 -18.383
127 HB2 HIS 16 2HB HIS 16 10.351 8.348 -18.419
128 HB3 HIS 16 3HB HIS 16 11.116 8.997 -19.867
129 HD1 HIS 16 HD1 HIS 16 11.939 8.033 -16.568
130 HD2 HIS 16 HD2 HIS 16 13.047 11.203 -19.015
131 HE1 HIS 16 HE1 HIS 16 14.089 8.910 -15.601
132 H LYS 17 H LYS 17 8.008 9.375 -20.331
133 HA LYS 17 HA LYS 17 8.914 10.469 -22.830
134 HB2 LYS 17 2HB LYS 17 7.125 8.403 -21.973
135 HB3 LYS 17 3HB LYS 17 6.275 9.465 -23.088
136 HG2 LYS 17 2HG LYS 17 7.188 8.242 -24.704
137 HG3 LYS 17 3HG LYS 17 8.694 9.085 -24.332
138 HD2 LYS 17 2HD LYS 17 9.546 7.311 -23.132
139 HD3 LYS 17 3HD LYS 17 7.948 6.664 -22.752
140 HE2 LYS 17 2HE LYS 17 8.218 5.217 -24.417
141 HE3 LYS 17 3HE LYS 17 8.141 6.576 -25.538
142 HZ1 LYS 17 3HZ LYS 17 10.704 6.628 -24.638
143 HZ2 LYS 17 1HZ LYS 17 10.191 5.980 -26.114
144 HZ3 LYS 17 2HZ LYS 17 10.388 4.971 -24.771
145 H LYS 18 H LYS 18 5.879 10.807 -20.983
146 HA LYS 18 HA LYS 18 5.022 13.056 -22.531
147 HB2 LYS 18 2HB LYS 18 4.001 11.605 -20.127
148 HB3 LYS 18 3HB LYS 18 3.363 13.205 -20.482
149 HG2 LYS 18 2HG LYS 18 2.650 12.456 -22.680
150 HG3 LYS 18 3HG LYS 18 3.333 10.858 -22.370
151 HD2 LYS 18 2HD LYS 18 1.769 10.483 -20.577
152 HD3 LYS 18 3HD LYS 18 1.155 12.133 -20.717
153 HE2 LYS 18 2HE LYS 18 0.187 11.685 -22.834
154 HE3 LYS 18 3HE LYS 18 1.037 10.147 -22.974
155 HZ1 LYS 18 3HZ LYS 18 -1.497 10.481 -22.056
156 HZ2 LYS 18 1HZ LYS 18 -0.605 10.306 -20.629
157 HZ3 LYS 18 2HZ LYS 18 -0.539 9.108 -21.821
158 H LYS 19 H LYS 19 5.937 12.721 -19.097
159 HA LYS 19 HA LYS 19 6.743 14.222 -17.588
160 HB2 LYS 19 2HB LYS 19 8.642 14.079 -19.240
161 HB3 LYS 19 3HB LYS 19 8.017 15.545 -19.985
162 HG2 LYS 19 2HG LYS 19 8.467 16.830 -18.051
163 HG3 LYS 19 3HG LYS 19 8.785 15.388 -17.083
164 HD2 LYS 19 2HD LYS 19 10.894 16.353 -17.619
165 HD3 LYS 19 3HD LYS 19 10.717 14.909 -18.621
166 HE2 LYS 19 2HE LYS 19 9.606 17.113 -20.029
167 HE3 LYS 19 3HE LYS 19 11.195 17.590 -19.434
168 HZ1 LYS 19 3HZ LYS 19 12.083 16.437 -21.083
169 HZ2 LYS 19 1HZ LYS 19 10.563 15.900 -21.593
170 HZ3 LYS 19 2HZ LYS 19 11.432 15.012 -20.446
171 H THR 20 H THR 20 4.656 15.078 -17.132
172 HA THR 20 HA THR 20 4.492 17.902 -17.475
173 HB THR 20 HB THR 20 3.581 17.466 -19.628
174 HG1 THR 20 HG1 THR 20 1.315 17.760 -17.930
175 HG21 THR 20 1HG2 THR 20 1.696 15.933 -19.997
176 HG22 THR 20 2HG2 THR 20 1.748 15.466 -18.297
177 HG23 THR 20 3HG2 THR 20 3.104 15.087 -19.358
178 H GLY 21 H GLY 21 2.714 18.853 -16.278
179 HA2 GLY 21 2HA GLY 21 0.794 17.411 -14.846
180 HA3 GLY 21 3HA GLY 21 2.225 17.534 -13.832
181 H GLY 22 H GLY 22 -0.344 19.313 -15.414
182 HA2 GLY 22 2HA GLY 22 -0.333 21.300 -13.359
183 HA3 GLY 22 3HA GLY 22 0.321 21.925 -14.866
184 H TYR 23 H TYR 23 -2.501 21.125 -13.118
185 HA TYR 23 HA TYR 23 -4.380 20.820 -15.161
186 HB2 TYR 23 2HB TYR 23 -4.504 21.708 -12.312
187 HB3 TYR 23 3HB TYR 23 -5.922 21.944 -13.328
188 HD1 TYR 23 HD1 TYR 23 -6.138 19.620 -14.949
189 HD2 TYR 23 HD2 TYR 23 -4.813 19.902 -10.916
190 HE1 TYR 23 HE1 TYR 23 -6.799 17.280 -14.575
191 HE2 TYR 23 HE2 TYR 23 -5.469 17.563 -10.531
192 HH TYR 23 HH TYR 23 -5.909 15.552 -11.730
193 HA PRO 24 HA PRO 24 -4.952 24.774 -16.972
194 HB2 PRO 24 2HB PRO 24 -7.647 24.882 -17.294
195 HB3 PRO 24 3HB PRO 24 -6.604 23.835 -18.265
196 HG2 PRO 24 2HG PRO 24 -8.272 23.155 -15.873
197 HG3 PRO 24 3HG PRO 24 -8.061 22.252 -17.385
198 HD2 PRO 24 2HD PRO 24 -6.753 21.600 -15.105
199 HD3 PRO 24 3HD PRO 24 -6.048 21.352 -16.716
200 H TRP 25 H TRP 25 -6.812 24.050 -14.087
201 HA TRP 25 HA TRP 25 -7.241 26.907 -13.595
202 HB2 TRP 25 2HB TRP 25 -8.666 26.045 -11.679
203 HB3 TRP 25 3HB TRP 25 -9.242 25.659 -13.298
204 HD1 TRP 25 HD1 TRP 25 -9.637 23.160 -13.840
205 HE1 TRP 25 HE1 TRP 25 -9.250 20.950 -12.582
206 HE3 TRP 25 HE3 TRP 25 -6.917 24.939 -9.894
207 HZ2 TRP 25 HZ2 TRP 25 -7.963 20.075 -10.226
208 HZ3 TRP 25 HZ3 TRP 25 -6.147 23.350 -8.181
209 HH2 TRP 25 HH2 TRP 25 -6.660 20.969 -8.345
210 H GLU 26 H GLU 26 -5.241 24.297 -12.680
211 HA GLU 26 HA GLU 26 -4.467 25.544 -10.155
212 HB2 GLU 26 2HB GLU 26 -4.765 22.951 -10.734
213 HB3 GLU 26 3HB GLU 26 -3.074 23.125 -11.179
214 HG2 GLU 26 2HG GLU 26 -3.513 24.377 -8.652
215 HG3 GLU 26 3HG GLU 26 -4.167 22.740 -8.619
216 H ARG 27 H ARG 27 -3.862 27.180 -12.226
217 HA ARG 27 HA ARG 27 -0.954 26.846 -12.575
218 HB2 ARG 27 2HB ARG 27 -2.663 26.964 -14.602
219 HB3 ARG 27 3HB ARG 27 -2.516 28.694 -14.318
220 HG2 ARG 27 2HG ARG 27 -0.284 28.736 -14.907
221 HG3 ARG 27 3HG ARG 27 -0.065 27.013 -14.599
222 HD2 ARG 27 2HD ARG 27 -0.962 26.398 -16.617
223 HD3 ARG 27 3HD ARG 27 -1.960 27.847 -16.735
224 HE ARG 27 HE ARG 27 0.693 27.504 -17.732
225 HH11 ARG 27 1HH1 ARG 27 -1.551 29.838 -16.452
226 HH12 ARG 27 2HH1 ARG 27 -0.803 31.185 -17.245
227 HH21 ARG 27 1HH2 ARG 27 1.686 29.269 -18.782
228 HH22 ARG 27 2HH2 ARG 27 1.037 30.861 -18.571
229 H GLY 28 H GLY 28 -2.131 27.967 -10.234
230 HA2 GLY 28 2HA GLY 28 -2.110 30.821 -10.372
231 HA3 GLY 28 3HA GLY 28 -2.091 29.851 -8.907
232 H LYS 29 H LYS 29 -0.266 29.768 -7.754
233 HA LYS 29 HA LYS 29 2.085 31.124 -8.843
234 HB2 LYS 29 2HB LYS 29 1.262 30.368 -6.041
235 HB3 LYS 29 3HB LYS 29 2.867 30.976 -6.421
236 HG2 LYS 29 2HG LYS 29 1.874 33.038 -7.292
237 HG3 LYS 29 3HG LYS 29 0.269 32.427 -6.883
238 HD2 LYS 29 2HD LYS 29 1.826 32.163 -4.558
239 HD3 LYS 29 3HD LYS 29 2.188 33.762 -5.213
240 HE2 LYS 29 2HE LYS 29 -0.221 34.243 -5.319
241 HE3 LYS 29 3HE LYS 29 -0.558 32.658 -4.624
242 HZ1 LYS 29 3HZ LYS 29 0.745 34.981 -3.339
243 HZ2 LYS 29 1HZ LYS 29 0.891 33.419 -2.706
244 HZ3 LYS 29 2HZ LYS 29 -0.634 34.139 -2.838
245 H ALA 30 H ALA 30 1.928 28.824 -10.103
246 HA ALA 30 HA ALA 30 3.047 26.909 -10.615
247 HB1 ALA 30 3HB ALA 30 4.915 28.503 -9.056
248 HB2 ALA 30 1HB ALA 30 5.245 26.773 -8.963
249 HB3 ALA 30 2HB ALA 30 5.174 27.574 -10.533
Start of MODEL 12
1 H1 MET 1 H MET 1 0.922 0.557 -0.444
2 HA MET 1 HA MET 1 -0.157 -1.598 -1.479
3 HB2 MET 1 2HB MET 1 0.085 0.313 -3.643
4 HB3 MET 1 3HB MET 1 0.954 -1.172 -4.009
5 HG2 MET 1 2HG MET 1 -0.922 -2.334 -4.309
6 HG3 MET 1 3HG MET 1 -1.696 -1.630 -2.892
7 HE1 MET 1 3HE MET 1 -4.545 -0.357 -4.913
8 HE2 MET 1 1HE MET 1 -3.923 -1.848 -4.206
9 HE3 MET 1 2HE MET 1 -3.925 -0.358 -3.261
10 H LYS 2 H LYS 2 1.252 -3.249 -1.349
11 HA LYS 2 HA LYS 2 4.002 -2.664 -0.774
12 HB2 LYS 2 2HB LYS 2 4.214 -5.069 -0.373
13 HB3 LYS 2 3HB LYS 2 2.802 -4.415 0.449
14 HG2 LYS 2 2HG LYS 2 1.528 -5.189 -1.677
15 HG3 LYS 2 3HG LYS 2 2.943 -6.214 -1.929
16 HD2 LYS 2 2HD LYS 2 2.448 -6.703 0.679
17 HD3 LYS 2 3HD LYS 2 0.811 -6.382 0.103
18 HE2 LYS 2 2HE LYS 2 1.931 -8.027 -1.839
19 HE3 LYS 2 3HE LYS 2 2.502 -8.696 -0.310
20 HZ1 LYS 2 3HZ LYS 2 0.065 -9.139 -1.445
21 HZ2 LYS 2 1HZ LYS 2 -0.274 -8.008 -0.233
22 HZ3 LYS 2 2HZ LYS 2 0.485 -9.468 0.160
23 H THR 3 H THR 3 2.214 -4.093 -3.445
24 HA THR 3 HA THR 3 4.704 -4.554 -4.916
25 HB THR 3 HB THR 3 3.075 -6.389 -4.910
26 HG1 THR 3 HG1 THR 3 3.236 -6.769 -7.089
27 HG21 THR 3 1HG2 THR 3 0.899 -5.901 -4.985
28 HG22 THR 3 2HG2 THR 3 1.105 -5.524 -6.695
29 HG23 THR 3 3HG2 THR 3 1.232 -4.244 -5.489
30 H ILE 4 H ILE 4 4.081 -1.876 -4.496
31 HA ILE 4 HA ILE 4 2.642 -0.728 -6.659
32 HB ILE 4 HB ILE 4 3.129 0.414 -4.473
33 HG12 ILE 4 2HG1 ILE 4 4.003 1.953 -6.927
34 HG13 ILE 4 3HG1 ILE 4 2.326 1.592 -6.527
35 HG21 ILE 4 1HG2 ILE 4 5.815 1.019 -5.686
36 HG22 ILE 4 2HG2 ILE 4 5.231 1.436 -4.075
37 HG23 ILE 4 3HG2 ILE 4 5.559 -0.248 -4.486
38 HD11 ILE 4 3HD1 ILE 4 4.190 3.544 -5.324
39 HD12 ILE 4 1HD1 ILE 4 2.461 3.670 -5.651
40 HD13 ILE 4 2HD1 ILE 4 3.030 2.760 -4.251
41 H LEU 5 H LEU 5 5.658 -2.210 -6.506
42 HA LEU 5 HA LEU 5 7.300 -0.735 -8.159
43 HB2 LEU 5 2HB LEU 5 8.537 -2.683 -8.516
44 HB3 LEU 5 3HB LEU 5 7.786 -2.910 -6.937
45 HG LEU 5 HG LEU 5 5.967 -4.165 -8.425
46 HD11 LEU 5 1HD1 LEU 5 7.969 -5.434 -9.941
47 HD12 LEU 5 2HD1 LEU 5 8.126 -3.704 -10.241
48 HD13 LEU 5 3HD1 LEU 5 6.583 -4.512 -10.525
49 HD21 LEU 5 3HD2 LEU 5 7.132 -6.256 -7.887
50 HD22 LEU 5 1HD2 LEU 5 7.158 -5.122 -6.535
51 HD23 LEU 5 2HD2 LEU 5 8.598 -5.341 -7.530
52 H ARG 6 H ARG 6 4.596 -2.809 -9.008
53 HA ARG 6 HA ARG 6 5.088 -2.777 -11.819
54 HB2 ARG 6 2HB ARG 6 2.969 -3.858 -12.043
55 HB3 ARG 6 3HB ARG 6 3.743 -4.517 -10.608
56 HG2 ARG 6 2HG ARG 6 1.712 -4.170 -9.707
57 HG3 ARG 6 3HG ARG 6 2.333 -2.534 -9.483
58 HD2 ARG 6 2HD ARG 6 0.335 -2.071 -10.497
59 HD3 ARG 6 3HD ARG 6 1.379 -2.197 -11.912
60 HE ARG 6 HE ARG 6 0.441 -4.722 -11.575
61 HH11 ARG 6 1HH1 ARG 6 -1.065 -1.597 -11.865
62 HH12 ARG 6 2HH1 ARG 6 -2.504 -2.214 -12.607
63 HH21 ARG 6 1HH2 ARG 6 -1.448 -5.547 -12.551
64 HH22 ARG 6 2HH2 ARG 6 -2.721 -4.462 -12.997
65 H PHE 7 H PHE 7 3.294 -0.761 -9.591
66 HA PHE 7 HA PHE 7 1.886 0.689 -11.621
67 HB2 PHE 7 2HB PHE 7 0.890 0.579 -9.443
68 HB3 PHE 7 3HB PHE 7 2.344 1.216 -8.683
69 HD1 PHE 7 HD2 PHE 7 0.064 2.242 -11.458
70 HD2 PHE 7 HD1 PHE 7 2.155 3.363 -7.924
71 HE1 PHE 7 HE2 PHE 7 -0.841 4.521 -11.651
72 HE2 PHE 7 HE1 PHE 7 1.252 5.644 -8.111
73 HZ PHE 7 HZ PHE 7 -0.247 6.227 -9.976
74 H VAL 8 H VAL 8 4.610 1.480 -9.467
75 HA VAL 8 HA VAL 8 5.146 4.009 -10.586
76 HB VAL 8 HB VAL 8 7.028 2.141 -9.136
77 HG11 VAL 8 1HG1 VAL 8 8.352 4.152 -8.677
78 HG12 VAL 8 2HG1 VAL 8 8.245 3.824 -10.408
79 HG13 VAL 8 3HG1 VAL 8 7.260 5.098 -9.687
80 HG21 VAL 8 3HG2 VAL 8 4.791 3.698 -8.249
81 HG22 VAL 8 1HG2 VAL 8 5.842 2.628 -7.322
82 HG23 VAL 8 2HG2 VAL 8 6.275 4.325 -7.531
83 H ALA 9 H ALA 9 6.185 0.774 -11.441
84 HA ALA 9 HA ALA 9 8.364 1.279 -13.053
85 HB1 ALA 9 3HB ALA 9 6.196 -0.791 -13.290
86 HB2 ALA 9 1HB ALA 9 7.611 -0.764 -14.344
87 HB3 ALA 9 2HB ALA 9 7.810 -0.970 -12.603
88 H GLY 10 H GLY 10 4.930 1.254 -14.009
89 HA2 GLY 10 2HA GLY 10 5.464 2.038 -16.701
90 HA3 GLY 10 3HA GLY 10 3.893 2.032 -15.913
91 H TYR 11 H TYR 11 4.897 3.779 -13.733
92 HA TYR 11 HA TYR 11 4.249 6.274 -14.960
93 HB2 TYR 11 2HB TYR 11 3.744 5.504 -12.555
94 HB3 TYR 11 3HB TYR 11 5.403 5.967 -12.196
95 HD1 TYR 11 HD1 TYR 11 6.061 8.405 -12.965
96 HD2 TYR 11 HD2 TYR 11 2.074 7.082 -12.290
97 HE1 TYR 11 HE1 TYR 11 5.346 10.737 -12.646
98 HE2 TYR 11 HE2 TYR 11 1.349 9.409 -11.971
99 HH TYR 11 HH TYR 11 1.985 11.609 -12.383
100 H ASP 12 H ASP 12 7.208 4.714 -13.915
101 HA ASP 12 HA ASP 12 8.903 6.964 -14.015
102 HB2 ASP 12 2HB ASP 12 9.326 4.583 -13.051
103 HB3 ASP 12 3HB ASP 12 9.855 4.197 -14.686
104 H ILE 13 H ILE 13 7.697 4.799 -16.475
105 HA ILE 13 HA ILE 13 9.494 5.862 -18.496
106 HB ILE 13 HB ILE 13 7.230 3.883 -18.765
107 HG12 ILE 13 2HG1 ILE 13 9.908 2.871 -19.207
108 HG13 ILE 13 3HG1 ILE 13 9.754 3.566 -17.598
109 HG21 ILE 13 1HG2 ILE 13 7.659 5.031 -20.857
110 HG22 ILE 13 2HG2 ILE 13 9.381 4.686 -20.717
111 HG23 ILE 13 3HG2 ILE 13 8.235 3.367 -20.950
112 HD11 ILE 13 3HD1 ILE 13 8.624 1.114 -18.705
113 HD12 ILE 13 1HD1 ILE 13 8.995 1.547 -17.036
114 HD13 ILE 13 2HD1 ILE 13 7.484 2.083 -17.772
115 H ALA 14 H ALA 14 6.022 5.863 -17.768
116 HA ALA 14 HA ALA 14 5.205 7.384 -19.989
117 HB1 ALA 14 3HB ALA 14 3.860 7.354 -17.296
118 HB2 ALA 14 1HB ALA 14 3.125 7.653 -18.871
119 HB3 ALA 14 2HB ALA 14 3.725 6.044 -18.468
120 H SER 15 H SER 15 6.339 8.308 -16.783
121 HA SER 15 HA SER 15 5.738 11.081 -17.068
122 HB2 SER 15 2HB SER 15 6.102 9.798 -14.886
123 HB3 SER 15 3HB SER 15 7.829 9.921 -15.225
124 HG SER 15 HG SER 15 7.785 11.956 -14.686
125 H HIS 16 H HIS 16 8.418 9.050 -17.951
126 HA HIS 16 HA HIS 16 10.257 11.220 -18.386
127 HB2 HIS 16 2HB HIS 16 10.315 8.290 -18.559
128 HB3 HIS 16 3HB HIS 16 11.284 9.095 -19.789
129 HD1 HIS 16 HD1 HIS 16 13.601 9.566 -19.087
130 HD2 HIS 16 HD2 HIS 16 11.015 9.391 -15.839
131 HE1 HIS 16 HE1 HIS 16 15.051 9.874 -17.056
132 H LYS 17 H LYS 17 8.000 9.355 -20.307
133 HA LYS 17 HA LYS 17 8.936 10.382 -22.825
134 HB2 LYS 17 2HB LYS 17 6.993 8.425 -21.908
135 HB3 LYS 17 3HB LYS 17 6.350 9.416 -23.210
136 HG2 LYS 17 2HG LYS 17 7.310 7.767 -24.437
137 HG3 LYS 17 3HG LYS 17 8.691 8.860 -24.305
138 HD2 LYS 17 2HD LYS 17 9.092 7.444 -22.087
139 HD3 LYS 17 3HD LYS 17 8.208 6.229 -23.014
140 HE2 LYS 17 2HE LYS 17 10.070 7.343 -24.788
141 HE3 LYS 17 3HE LYS 17 10.939 7.102 -23.272
142 HZ1 LYS 17 3HZ LYS 17 9.313 4.854 -23.900
143 HZ2 LYS 17 1HZ LYS 17 10.977 4.925 -23.605
144 HZ3 LYS 17 2HZ LYS 17 10.383 5.195 -25.166
145 H LYS 18 H LYS 18 5.923 10.812 -20.961
146 HA LYS 18 HA LYS 18 5.112 13.050 -22.570
147 HB2 LYS 18 2HB LYS 18 3.965 11.414 -20.432
148 HB3 LYS 18 3HB LYS 18 3.538 13.116 -20.305
149 HG2 LYS 18 2HG LYS 18 3.254 11.733 -22.930
150 HG3 LYS 18 3HG LYS 18 2.046 11.470 -21.670
151 HD2 LYS 18 2HD LYS 18 1.768 13.938 -21.508
152 HD3 LYS 18 3HD LYS 18 2.863 14.110 -22.881
153 HE2 LYS 18 2HE LYS 18 0.629 12.238 -23.279
154 HE3 LYS 18 3HE LYS 18 0.167 13.928 -23.081
155 HZ1 LYS 18 3HZ LYS 18 0.519 13.452 -25.393
156 HZ2 LYS 18 1HZ LYS 18 2.066 12.841 -25.089
157 HZ3 LYS 18 2HZ LYS 18 1.747 14.486 -24.862
158 H LYS 19 H LYS 19 5.919 12.710 -19.110
159 HA LYS 19 HA LYS 19 6.711 14.200 -17.581
160 HB2 LYS 19 2HB LYS 19 8.646 14.042 -19.190
161 HB3 LYS 19 3HB LYS 19 8.053 15.514 -19.946
162 HG2 LYS 19 2HG LYS 19 8.899 16.815 -18.343
163 HG3 LYS 19 3HG LYS 19 8.361 15.736 -17.054
164 HD2 LYS 19 2HD LYS 19 10.588 15.411 -16.805
165 HD3 LYS 19 3HD LYS 19 10.328 14.238 -18.099
166 HE2 LYS 19 2HE LYS 19 11.138 17.108 -18.542
167 HE3 LYS 19 3HE LYS 19 12.272 15.760 -18.464
168 HZ1 LYS 19 3HZ LYS 19 10.380 14.973 -20.277
169 HZ2 LYS 19 1HZ LYS 19 11.934 15.540 -20.632
170 HZ3 LYS 19 2HZ LYS 19 10.624 16.610 -20.630
171 H THR 20 H THR 20 4.650 15.093 -17.139
172 HA THR 20 HA THR 20 4.494 17.920 -17.712
173 HB THR 20 HB THR 20 3.287 17.217 -19.634
174 HG1 THR 20 HG1 THR 20 1.059 17.840 -18.963
175 HG21 THR 20 1HG2 THR 20 2.900 14.895 -19.056
176 HG22 THR 20 2HG2 THR 20 1.372 15.656 -19.499
177 HG23 THR 20 3HG2 THR 20 1.756 15.370 -17.802
178 H GLY 21 H GLY 21 2.854 19.013 -16.420
179 HA2 GLY 21 2HA GLY 21 2.806 18.175 -13.764
180 HA3 GLY 21 3HA GLY 21 1.745 19.397 -14.448
181 H GLY 22 H GLY 22 0.042 18.211 -16.028
182 HA2 GLY 22 2HA GLY 22 -1.495 16.412 -16.259
183 HA3 GLY 22 3HA GLY 22 -0.985 15.811 -14.689
184 H TYR 23 H TYR 23 -3.050 18.041 -16.382
185 HA TYR 23 HA TYR 23 -4.061 19.552 -14.291
186 HB2 TYR 23 2HB TYR 23 -5.152 18.652 -16.922
187 HB3 TYR 23 3HB TYR 23 -6.248 19.415 -15.777
188 HD1 TYR 23 HD2 TYR 23 -4.789 21.542 -14.576
189 HD2 TYR 23 HD1 TYR 23 -4.574 20.137 -18.586
190 HE1 TYR 23 HE2 TYR 23 -4.012 23.758 -15.306
191 HE2 TYR 23 HE1 TYR 23 -3.795 22.349 -19.326
192 HH TYR 23 HH TYR 23 -4.117 25.073 -17.630
193 HA PRO 24 HA PRO 24 -6.522 16.930 -11.778
194 HB2 PRO 24 2HB PRO 24 -8.675 18.495 -11.237
195 HB3 PRO 24 3HB PRO 24 -7.074 18.790 -10.547
196 HG2 PRO 24 2HG PRO 24 -8.400 20.107 -12.886
197 HG3 PRO 24 3HG PRO 24 -7.456 20.841 -11.575
198 HD2 PRO 24 2HD PRO 24 -6.413 20.355 -14.028
199 HD3 PRO 24 3HD PRO 24 -5.441 20.279 -12.543
200 H TRP 25 H TRP 25 -8.062 18.355 -14.590
201 HA TRP 25 HA TRP 25 -10.148 16.296 -14.543
202 HB2 TRP 25 2HB TRP 25 -11.103 17.659 -16.459
203 HB3 TRP 25 3HB TRP 25 -11.064 18.461 -14.891
204 HD1 TRP 25 HD1 TRP 25 -9.836 20.734 -14.764
205 HE1 TRP 25 HE1 TRP 25 -8.455 22.143 -16.416
206 HE3 TRP 25 HE3 TRP 25 -9.366 17.324 -18.543
207 HZ2 TRP 25 HZ2 TRP 25 -7.316 21.848 -18.982
208 HZ3 TRP 25 HZ3 TRP 25 -8.115 17.965 -20.561
209 HH2 TRP 25 HH2 TRP 25 -7.113 20.181 -20.775
210 H GLU 26 H GLU 26 -7.190 17.085 -16.052
211 HA GLU 26 HA GLU 26 -7.723 15.382 -18.367
212 HB2 GLU 26 2HB GLU 26 -6.363 17.698 -18.221
213 HB3 GLU 26 3HB GLU 26 -5.038 16.573 -17.954
214 HG2 GLU 26 2HG GLU 26 -5.416 15.504 -20.043
215 HG3 GLU 26 3HG GLU 26 -6.926 16.381 -20.284
216 H ARG 27 H ARG 27 -7.802 13.934 -16.076
217 HA ARG 27 HA ARG 27 -5.210 12.538 -16.010
218 HB2 ARG 27 2HB ARG 27 -6.515 13.606 -13.887
219 HB3 ARG 27 3HB ARG 27 -7.178 11.978 -13.880
220 HG2 ARG 27 2HG ARG 27 -4.928 11.049 -13.772
221 HG3 ARG 27 3HG ARG 27 -4.250 12.678 -13.804
222 HD2 ARG 27 2HD ARG 27 -5.355 13.200 -11.702
223 HD3 ARG 27 3HD ARG 27 -6.104 11.604 -11.681
224 HE ARG 27 HE ARG 27 -4.151 10.748 -10.865
225 HH11 ARG 27 1HH1 ARG 27 -3.508 13.863 -12.281
226 HH12 ARG 27 2HH1 ARG 27 -1.863 13.914 -11.741
227 HH21 ARG 27 1HH2 ARG 27 -1.986 10.804 -10.149
228 HH22 ARG 27 2HH2 ARG 27 -0.998 12.173 -10.528
229 H GLY 28 H GLY 28 -7.173 12.105 -18.045
230 HA2 GLY 28 2HA GLY 28 -7.435 9.886 -19.025
231 HA3 GLY 28 3HA GLY 28 -7.875 9.303 -17.427
232 H LYS 29 H LYS 29 -9.857 10.436 -16.475
233 HA LYS 29 HA LYS 29 -11.789 11.369 -18.416
234 HB2 LYS 29 2HB LYS 29 -13.404 9.629 -18.085
235 HB3 LYS 29 3HB LYS 29 -11.890 8.873 -18.566
236 HG2 LYS 29 2HG LYS 29 -12.325 7.500 -16.850
237 HG3 LYS 29 3HG LYS 29 -11.635 8.805 -15.881
238 HD2 LYS 29 2HD LYS 29 -13.615 9.316 -14.949
239 HD3 LYS 29 3HD LYS 29 -14.488 9.124 -16.472
240 HE2 LYS 29 2HE LYS 29 -15.339 7.429 -15.110
241 HE3 LYS 29 3HE LYS 29 -14.153 6.607 -16.123
242 HZ1 LYS 29 3HZ LYS 29 -12.981 7.615 -13.728
243 HZ2 LYS 29 1HZ LYS 29 -12.972 6.042 -14.348
244 HZ3 LYS 29 2HZ LYS 29 -14.263 6.565 -13.389
245 H ALA 30 H ALA 30 -13.186 12.760 -17.508
246 HA ALA 30 HA ALA 30 -14.111 12.561 -14.827
247 HB1 ALA 30 3HB ALA 30 -12.894 15.058 -14.615
248 HB2 ALA 30 1HB ALA 30 -12.459 13.584 -13.749
249 HB3 ALA 30 2HB ALA 30 -11.645 13.993 -15.260
Start of MODEL 13
1 H1 MET 1 H MET 1 0.555 -1.349 0.701
2 HA MET 1 HA MET 1 0.228 -1.651 -1.815
3 HB2 MET 1 2HB MET 1 0.908 1.245 -1.500
4 HB3 MET 1 3HB MET 1 1.424 0.397 -2.952
5 HG2 MET 1 2HG MET 1 -1.058 -0.344 -3.088
6 HG3 MET 1 3HG MET 1 -1.336 1.015 -2.002
7 HE1 MET 1 3HE MET 1 0.151 0.938 -6.257
8 HE2 MET 1 1HE MET 1 -0.240 -0.384 -5.157
9 HE3 MET 1 2HE MET 1 -1.533 0.482 -5.989
10 H LYS 2 H LYS 2 1.713 -3.259 -1.365
11 HA LYS 2 HA LYS 2 4.501 -2.479 -0.932
12 HB2 LYS 2 2HB LYS 2 2.928 -4.553 0.082
13 HB3 LYS 2 3HB LYS 2 4.018 -5.337 -1.054
14 HG2 LYS 2 2HG LYS 2 5.675 -5.228 0.408
15 HG3 LYS 2 3HG LYS 2 5.495 -3.477 0.533
16 HD2 LYS 2 2HD LYS 2 5.109 -4.116 2.709
17 HD3 LYS 2 3HD LYS 2 3.464 -4.104 2.069
18 HE2 LYS 2 2HE LYS 2 5.149 -6.589 2.046
19 HE3 LYS 2 3HE LYS 2 4.206 -6.128 3.463
20 HZ1 LYS 2 3HZ LYS 2 2.779 -7.502 2.309
21 HZ2 LYS 2 1HZ LYS 2 3.257 -6.928 0.791
22 HZ3 LYS 2 2HZ LYS 2 2.279 -5.973 1.787
23 H THR 3 H THR 3 2.391 -3.958 -3.282
24 HA THR 3 HA THR 3 4.650 -4.636 -5.011
25 HB THR 3 HB THR 3 2.806 -6.286 -4.724
26 HG1 THR 3 HG1 THR 3 3.990 -6.444 -6.613
27 HG21 THR 3 1HG2 THR 3 1.115 -4.514 -6.459
28 HG22 THR 3 2HG2 THR 3 1.037 -4.403 -4.700
29 HG23 THR 3 3HG2 THR 3 0.638 -5.919 -5.507
30 H ILE 4 H ILE 4 4.060 -1.866 -4.496
31 HA ILE 4 HA ILE 4 2.619 -0.731 -6.668
32 HB ILE 4 HB ILE 4 3.091 0.422 -4.484
33 HG12 ILE 4 2HG1 ILE 4 3.971 1.955 -6.938
34 HG13 ILE 4 3HG1 ILE 4 2.294 1.589 -6.547
35 HG21 ILE 4 1HG2 ILE 4 5.524 -0.233 -4.485
36 HG22 ILE 4 2HG2 ILE 4 5.780 1.031 -5.684
37 HG23 ILE 4 3HG2 ILE 4 5.188 1.449 -4.077
38 HD11 ILE 4 3HD1 ILE 4 3.822 3.796 -5.738
39 HD12 ILE 4 1HD1 ILE 4 2.177 3.377 -5.259
40 HD13 ILE 4 2HD1 ILE 4 3.546 2.819 -4.296
41 H LEU 5 H LEU 5 5.637 -2.202 -6.495
42 HA LEU 5 HA LEU 5 7.284 -0.728 -8.145
43 HB2 LEU 5 2HB LEU 5 8.528 -2.673 -8.488
44 HB3 LEU 5 3HB LEU 5 7.771 -2.897 -6.913
45 HG LEU 5 HG LEU 5 5.962 -4.163 -8.405
46 HD11 LEU 5 1HD1 LEU 5 8.343 -5.108 -9.864
47 HD12 LEU 5 2HD1 LEU 5 7.686 -3.553 -10.372
48 HD13 LEU 5 3HD1 LEU 5 6.663 -4.989 -10.382
49 HD21 LEU 5 3HD2 LEU 5 7.007 -5.211 -6.554
50 HD22 LEU 5 1HD2 LEU 5 8.578 -5.217 -7.354
51 HD23 LEU 5 2HD2 LEU 5 7.284 -6.260 -7.944
52 H ARG 6 H ARG 6 4.589 -2.813 -8.999
53 HA ARG 6 HA ARG 6 5.095 -2.790 -11.808
54 HB2 ARG 6 2HB ARG 6 2.995 -3.892 -12.040
55 HB3 ARG 6 3HB ARG 6 3.745 -4.523 -10.579
56 HG2 ARG 6 2HG ARG 6 1.668 -4.180 -9.763
57 HG3 ARG 6 3HG ARG 6 2.318 -2.564 -9.481
58 HD2 ARG 6 2HD ARG 6 0.443 -1.939 -10.578
59 HD3 ARG 6 3HD ARG 6 1.442 -2.259 -11.996
60 HE ARG 6 HE ARG 6 0.073 -4.601 -11.161
61 HH11 ARG 6 1HH1 ARG 6 -0.381 -1.569 -12.813
62 HH12 ARG 6 2HH1 ARG 6 -1.707 -2.141 -13.771
63 HH21 ARG 6 1HH2 ARG 6 -1.671 -5.365 -12.417
64 HH22 ARG 6 2HH2 ARG 6 -2.441 -4.300 -13.544
65 H PHE 7 H PHE 7 3.285 -0.772 -9.596
66 HA PHE 7 HA PHE 7 1.883 0.667 -11.639
67 HB2 PHE 7 2HB PHE 7 0.876 0.562 -9.465
68 HB3 PHE 7 3HB PHE 7 2.325 1.206 -8.701
69 HD1 PHE 7 HD2 PHE 7 0.054 2.214 -11.490
70 HD2 PHE 7 HD1 PHE 7 2.126 3.355 -7.951
71 HE1 PHE 7 HE2 PHE 7 -0.857 4.491 -11.694
72 HE2 PHE 7 HE1 PHE 7 1.217 5.632 -8.149
73 HZ PHE 7 HZ PHE 7 -0.275 6.204 -10.023
74 H VAL 8 H VAL 8 4.596 1.470 -9.475
75 HA VAL 8 HA VAL 8 5.128 3.999 -10.601
76 HB VAL 8 HB VAL 8 7.008 2.143 -9.133
77 HG11 VAL 8 1HG1 VAL 8 7.234 5.097 -9.700
78 HG12 VAL 8 2HG1 VAL 8 8.325 4.159 -8.677
79 HG13 VAL 8 3HG1 VAL 8 8.227 3.823 -10.406
80 HG21 VAL 8 3HG2 VAL 8 4.762 3.696 -8.265
81 HG22 VAL 8 1HG2 VAL 8 5.811 2.634 -7.328
82 HG23 VAL 8 2HG2 VAL 8 6.240 4.330 -7.541
83 H ALA 9 H ALA 9 6.179 0.764 -11.438
84 HA ALA 9 HA ALA 9 8.367 1.268 -13.041
85 HB1 ALA 9 3HB ALA 9 7.814 -0.980 -12.584
86 HB2 ALA 9 1HB ALA 9 6.204 -0.807 -13.283
87 HB3 ALA 9 2HB ALA 9 7.627 -0.782 -14.326
88 H GLY 10 H GLY 10 4.937 1.231 -14.015
89 HA2 GLY 10 2HA GLY 10 5.484 2.008 -16.707
90 HA3 GLY 10 3HA GLY 10 3.909 2.000 -15.927
91 H TYR 11 H TYR 11 4.897 3.759 -13.749
92 HA TYR 11 HA TYR 11 4.251 6.246 -14.988
93 HB2 TYR 11 2HB TYR 11 3.725 5.493 -12.588
94 HB3 TYR 11 3HB TYR 11 5.386 5.941 -12.215
95 HD1 TYR 11 HD1 TYR 11 6.070 8.374 -12.991
96 HD2 TYR 11 HD2 TYR 11 2.070 7.084 -12.326
97 HE1 TYR 11 HE1 TYR 11 5.373 10.712 -12.680
98 HE2 TYR 11 HE2 TYR 11 1.362 9.419 -12.013
99 HH TYR 11 HH TYR 11 3.490 11.930 -11.491
100 H ASP 12 H ASP 12 7.207 4.697 -13.920
101 HA ASP 12 HA ASP 12 8.898 6.949 -14.016
102 HB2 ASP 12 2HB ASP 12 9.324 4.574 -13.046
103 HB3 ASP 12 3HB ASP 12 9.853 4.179 -14.679
104 H ILE 13 H ILE 13 7.652 4.835 -16.484
105 HA ILE 13 HA ILE 13 9.479 5.870 -18.498
106 HB ILE 13 HB ILE 13 7.188 3.920 -18.778
107 HG12 ILE 13 2HG1 ILE 13 9.858 2.879 -19.218
108 HG13 ILE 13 3HG1 ILE 13 9.704 3.564 -17.604
109 HG21 ILE 13 1HG2 ILE 13 7.380 4.370 -20.955
110 HG22 ILE 13 2HG2 ILE 13 8.872 5.279 -20.720
111 HG23 ILE 13 3HG2 ILE 13 8.925 3.523 -20.876
112 HD11 ILE 13 3HD1 ILE 13 7.405 2.091 -17.864
113 HD12 ILE 13 1HD1 ILE 13 8.605 1.113 -18.709
114 HD13 ILE 13 2HD1 ILE 13 8.875 1.585 -17.031
115 H ALA 14 H ALA 14 5.996 5.884 -17.807
116 HA ALA 14 HA ALA 14 5.217 7.443 -20.013
117 HB1 ALA 14 3HB ALA 14 3.834 7.398 -17.340
118 HB2 ALA 14 1HB ALA 14 3.124 7.700 -18.926
119 HB3 ALA 14 2HB ALA 14 3.714 6.089 -18.516
120 H SER 15 H SER 15 6.353 8.311 -16.797
121 HA SER 15 HA SER 15 5.755 11.090 -17.028
122 HB2 SER 15 2HB SER 15 6.023 9.976 -14.843
123 HB3 SER 15 3HB SER 15 7.727 9.694 -15.200
124 HG SER 15 HG SER 15 6.494 11.943 -14.291
125 H HIS 16 H HIS 16 8.414 9.070 -17.982
126 HA HIS 16 HA HIS 16 10.238 11.268 -18.405
127 HB2 HIS 16 2HB HIS 16 10.359 8.349 -18.483
128 HB3 HIS 16 3HB HIS 16 11.269 9.107 -19.786
129 HD1 HIS 16 HD1 HIS 16 13.633 9.333 -19.142
130 HD2 HIS 16 HD2 HIS 16 11.103 9.913 -15.899
131 HE1 HIS 16 HE1 HIS 16 15.142 9.845 -17.196
132 H LYS 17 H LYS 17 8.013 9.343 -20.302
133 HA LYS 17 HA LYS 17 8.942 10.320 -22.838
134 HB2 LYS 17 2HB LYS 17 7.014 8.380 -21.880
135 HB3 LYS 17 3HB LYS 17 6.335 9.363 -23.171
136 HG2 LYS 17 2HG LYS 17 7.268 7.709 -24.412
137 HG3 LYS 17 3HG LYS 17 8.647 8.808 -24.324
138 HD2 LYS 17 2HD LYS 17 9.507 7.531 -22.397
139 HD3 LYS 17 3HD LYS 17 8.154 6.409 -22.558
140 HE2 LYS 17 2HE LYS 17 9.828 6.915 -24.957
141 HE3 LYS 17 3HE LYS 17 10.527 5.944 -23.661
142 HZ1 LYS 17 3HZ LYS 17 8.480 4.548 -23.789
143 HZ2 LYS 17 1HZ LYS 17 9.465 4.474 -25.162
144 HZ3 LYS 17 2HZ LYS 17 8.045 5.393 -25.189
145 H LYS 18 H LYS 18 5.931 10.808 -20.986
146 HA LYS 18 HA LYS 18 5.139 13.021 -22.640
147 HB2 LYS 18 2HB LYS 18 4.006 11.553 -20.323
148 HB3 LYS 18 3HB LYS 18 3.471 13.214 -20.545
149 HG2 LYS 18 2HG LYS 18 2.891 12.595 -22.913
150 HG3 LYS 18 3HG LYS 18 3.191 10.916 -22.462
151 HD2 LYS 18 2HD LYS 18 1.528 11.333 -20.556
152 HD3 LYS 18 3HD LYS 18 1.069 12.783 -21.450
153 HE2 LYS 18 2HE LYS 18 -0.285 11.535 -22.692
154 HE3 LYS 18 3HE LYS 18 1.127 10.689 -23.321
155 HZ1 LYS 18 3HZ LYS 18 -0.357 9.084 -22.425
156 HZ2 LYS 18 1HZ LYS 18 -0.512 9.932 -20.969
157 HZ3 LYS 18 2HZ LYS 18 0.956 9.191 -21.364
158 H LYS 19 H LYS 19 6.038 12.708 -19.203
159 HA LYS 19 HA LYS 19 6.903 14.193 -17.715
160 HB2 LYS 19 2HB LYS 19 8.791 14.204 -19.258
161 HB3 LYS 19 3HB LYS 19 8.009 15.435 -20.240
162 HG2 LYS 19 2HG LYS 19 8.085 16.532 -17.692
163 HG3 LYS 19 3HG LYS 19 9.641 15.720 -17.878
164 HD2 LYS 19 2HD LYS 19 8.567 17.481 -20.051
165 HD3 LYS 19 3HD LYS 19 9.405 18.175 -18.661
166 HE2 LYS 19 2HE LYS 19 10.768 15.894 -19.910
167 HE3 LYS 19 3HE LYS 19 10.616 17.316 -20.942
168 HZ1 LYS 19 3HZ LYS 19 12.530 16.919 -19.054
169 HZ2 LYS 19 1HZ LYS 19 11.447 17.962 -18.277
170 HZ3 LYS 19 2HZ LYS 19 12.134 18.405 -19.758
171 H THR 20 H THR 20 4.888 14.991 -17.042
172 HA THR 20 HA THR 20 4.558 17.767 -17.181
173 HB THR 20 HB THR 20 3.777 17.534 -19.430
174 HG1 THR 20 HG1 THR 20 2.512 18.879 -17.971
175 HG21 THR 20 1HG2 THR 20 3.277 15.133 -19.387
176 HG22 THR 20 2HG2 THR 20 1.928 16.056 -20.049
177 HG23 THR 20 3HG2 THR 20 1.853 15.448 -18.396
178 H GLY 21 H GLY 21 2.918 18.528 -15.802
179 HA2 GLY 21 2HA GLY 21 2.153 16.693 -13.753
180 HA3 GLY 21 3HA GLY 21 1.703 18.389 -13.849
181 H GLY 22 H GLY 22 0.177 18.701 -15.949
182 HA2 GLY 22 2HA GLY 22 -1.587 16.845 -16.860
183 HA3 GLY 22 3HA GLY 22 -2.206 17.233 -15.262
184 H TYR 23 H TYR 23 -2.334 18.026 -18.488
185 HA TYR 23 HA TYR 23 -2.599 20.790 -18.546
186 HB2 TYR 23 2HB TYR 23 -3.686 18.559 -20.207
187 HB3 TYR 23 3HB TYR 23 -4.325 20.180 -20.457
188 HD1 TYR 23 HD2 TYR 23 -2.104 21.947 -20.274
189 HD2 TYR 23 HD1 TYR 23 -2.211 18.013 -21.892
190 HE1 TYR 23 HE2 TYR 23 -0.180 22.489 -21.706
191 HE2 TYR 23 HE1 TYR 23 -0.286 18.544 -23.327
192 HH TYR 23 HH TYR 23 1.454 21.577 -23.018
193 HA PRO 24 HA PRO 24 -6.355 21.822 -16.531
194 HB2 PRO 24 2HB PRO 24 -7.377 23.745 -18.153
195 HB3 PRO 24 3HB PRO 24 -5.962 24.006 -17.125
196 HG2 PRO 24 2HG PRO 24 -6.089 23.371 -20.048
197 HG3 PRO 24 3HG PRO 24 -5.060 24.540 -19.202
198 HD2 PRO 24 2HD PRO 24 -4.163 22.107 -19.982
199 HD3 PRO 24 3HD PRO 24 -3.565 22.923 -18.523
200 H TRP 25 H TRP 25 -6.549 20.950 -19.923
201 HA TRP 25 HA TRP 25 -9.402 20.340 -19.646
202 HB2 TRP 25 2HB TRP 25 -9.245 19.951 -22.150
203 HB3 TRP 25 3HB TRP 25 -8.966 21.604 -21.610
204 HD1 TRP 25 HD1 TRP 25 -6.735 22.708 -22.313
205 HE1 TRP 25 HE1 TRP 25 -4.631 21.908 -23.562
206 HE3 TRP 25 HE3 TRP 25 -7.731 17.696 -22.454
207 HZ2 TRP 25 HZ2 TRP 25 -3.538 19.474 -24.484
208 HZ3 TRP 25 HZ3 TRP 25 -6.106 16.201 -23.538
209 HH2 TRP 25 HH2 TRP 25 -4.053 17.073 -24.532
210 H GLU 26 H GLU 26 -6.331 18.851 -19.680
211 HA GLU 26 HA GLU 26 -7.421 16.234 -20.389
212 HB2 GLU 26 2HB GLU 26 -5.058 17.341 -21.043
213 HB3 GLU 26 3HB GLU 26 -4.586 16.514 -19.565
214 HG2 GLU 26 2HG GLU 26 -5.123 14.408 -20.436
215 HG3 GLU 26 3HG GLU 26 -6.054 15.102 -21.763
216 H ARG 27 H ARG 27 -8.522 17.153 -18.081
217 HA ARG 27 HA ARG 27 -7.082 15.742 -15.937
218 HB2 ARG 27 2HB ARG 27 -7.931 18.258 -15.823
219 HB3 ARG 27 3HB ARG 27 -9.437 17.476 -15.363
220 HG2 ARG 27 2HG ARG 27 -8.178 16.286 -13.564
221 HG3 ARG 27 3HG ARG 27 -6.781 17.285 -13.968
222 HD2 ARG 27 2HD ARG 27 -8.848 19.105 -13.706
223 HD3 ARG 27 3HD ARG 27 -9.152 17.936 -12.422
224 HE ARG 27 HE ARG 27 -7.298 18.713 -11.326
225 HH11 ARG 27 1HH1 ARG 27 -7.218 19.816 -14.627
226 HH12 ARG 27 2HH1 ARG 27 -5.860 20.863 -14.380
227 HH21 ARG 27 1HH2 ARG 27 -5.510 20.088 -10.989
228 HH22 ARG 27 2HH2 ARG 27 -4.889 21.017 -12.311
229 H GLY 28 H GLY 28 -8.563 14.328 -17.934
230 HA2 GLY 28 2HA GLY 28 -11.127 13.612 -16.832
231 HA3 GLY 28 3HA GLY 28 -10.330 12.854 -18.202
232 H LYS 29 H LYS 29 -9.124 11.025 -17.903
233 HA LYS 29 HA LYS 29 -9.465 9.709 -15.327
234 HB2 LYS 29 2HB LYS 29 -8.762 7.678 -16.494
235 HB3 LYS 29 3HB LYS 29 -10.067 8.478 -17.359
236 HG2 LYS 29 2HG LYS 29 -7.688 9.514 -18.420
237 HG3 LYS 29 3HG LYS 29 -7.449 7.772 -18.272
238 HD2 LYS 29 2HD LYS 29 -9.835 9.066 -19.588
239 HD3 LYS 29 3HD LYS 29 -8.418 8.466 -20.453
240 HE2 LYS 29 2HE LYS 29 -8.930 6.250 -19.176
241 HE3 LYS 29 3HE LYS 29 -10.538 6.947 -18.994
242 HZ1 LYS 29 3HZ LYS 29 -9.273 5.837 -21.328
243 HZ2 LYS 29 1HZ LYS 29 -10.016 7.330 -21.614
244 HZ3 LYS 29 2HZ LYS 29 -10.917 6.044 -20.984
245 H ALA 30 H ALA 30 -7.749 8.757 -14.166
246 HA ALA 30 HA ALA 30 -5.703 8.777 -13.165
247 HB1 ALA 30 3HB ALA 30 -3.778 8.484 -14.606
248 HB2 ALA 30 1HB ALA 30 -5.136 7.536 -15.213
249 HB3 ALA 30 2HB ALA 30 -4.700 9.056 -15.996
Start of MODEL 14
1 H1 MET 1 H MET 1 0.893 0.113 0.013
2 HA MET 1 HA MET 1 1.761 -0.379 -2.034
3 HB2 MET 1 2HB MET 1 3.936 0.853 -2.561
4 HB3 MET 1 3HB MET 1 2.556 1.836 -2.091
5 HG2 MET 1 2HG MET 1 4.352 0.980 0.084
6 HG3 MET 1 3HG MET 1 5.009 2.137 -1.070
7 HE1 MET 1 3HE MET 1 4.144 2.601 2.349
8 HE2 MET 1 1HE MET 1 2.419 2.961 2.438
9 HE3 MET 1 2HE MET 1 2.961 1.386 1.859
10 H LYS 2 H LYS 2 1.975 -2.625 -1.352
11 HA LYS 2 HA LYS 2 4.647 -3.523 -0.631
12 HB2 LYS 2 2HB LYS 2 1.947 -4.599 -0.462
13 HB3 LYS 2 3HB LYS 2 3.090 -5.776 -1.093
14 HG2 LYS 2 2HG LYS 2 3.423 -6.223 1.080
15 HG3 LYS 2 3HG LYS 2 4.496 -4.825 0.996
16 HD2 LYS 2 2HD LYS 2 1.595 -4.441 1.607
17 HD3 LYS 2 3HD LYS 2 2.698 -4.974 2.878
18 HE2 LYS 2 2HE LYS 2 4.115 -3.013 2.444
19 HE3 LYS 2 3HE LYS 2 2.982 -2.479 1.204
20 HZ1 LYS 2 3HZ LYS 2 2.145 -1.312 2.922
21 HZ2 LYS 2 1HZ LYS 2 2.756 -2.362 4.100
22 HZ3 LYS 2 2HZ LYS 2 1.339 -2.759 3.267
23 H THR 3 H THR 3 2.494 -3.470 -3.380
24 HA THR 3 HA THR 3 4.647 -4.634 -5.017
25 HB THR 3 HB THR 3 2.800 -6.274 -4.715
26 HG1 THR 3 HG1 THR 3 4.097 -6.049 -6.713
27 HG21 THR 3 1HG2 THR 3 0.926 -5.064 -6.526
28 HG22 THR 3 2HG2 THR 3 1.173 -4.018 -5.128
29 HG23 THR 3 3HG2 THR 3 0.657 -5.689 -4.900
30 H ILE 4 H ILE 4 4.062 -1.858 -4.496
31 HA ILE 4 HA ILE 4 2.619 -0.723 -6.668
32 HB ILE 4 HB ILE 4 3.093 0.431 -4.486
33 HG12 ILE 4 2HG1 ILE 4 3.977 1.962 -6.940
34 HG13 ILE 4 3HG1 ILE 4 2.299 1.596 -6.552
35 HG21 ILE 4 1HG2 ILE 4 5.784 1.037 -5.687
36 HG22 ILE 4 2HG2 ILE 4 5.190 1.460 -4.081
37 HG23 ILE 4 3HG2 ILE 4 5.525 -0.225 -4.482
38 HD11 ILE 4 3HD1 ILE 4 3.444 2.802 -4.273
39 HD12 ILE 4 1HD1 ILE 4 3.904 3.767 -5.676
40 HD13 ILE 4 2HD1 ILE 4 2.201 3.442 -5.348
41 H LEU 5 H LEU 5 5.638 -2.197 -6.494
42 HA LEU 5 HA LEU 5 7.286 -0.725 -8.145
43 HB2 LEU 5 2HB LEU 5 8.528 -2.671 -8.488
44 HB3 LEU 5 3HB LEU 5 7.770 -2.894 -6.913
45 HG LEU 5 HG LEU 5 5.960 -4.158 -8.407
46 HD11 LEU 5 1HD1 LEU 5 6.661 -4.985 -10.384
47 HD12 LEU 5 2HD1 LEU 5 8.342 -5.106 -9.865
48 HD13 LEU 5 3HD1 LEU 5 7.687 -3.549 -10.373
49 HD21 LEU 5 3HD2 LEU 5 6.990 -5.218 -6.562
50 HD22 LEU 5 1HD2 LEU 5 8.572 -5.206 -7.342
51 HD23 LEU 5 2HD2 LEU 5 7.295 -6.257 -7.954
52 H ARG 6 H ARG 6 4.589 -2.807 -9.000
53 HA ARG 6 HA ARG 6 5.095 -2.783 -11.809
54 HB2 ARG 6 2HB ARG 6 2.984 -3.875 -12.040
55 HB3 ARG 6 3HB ARG 6 3.748 -4.521 -10.594
56 HG2 ARG 6 2HG ARG 6 1.687 -4.181 -9.742
57 HG3 ARG 6 3HG ARG 6 2.332 -2.562 -9.469
58 HD2 ARG 6 2HD ARG 6 0.484 -1.900 -10.566
59 HD3 ARG 6 3HD ARG 6 1.414 -2.322 -12.004
60 HE ARG 6 HE ARG 6 0.013 -4.102 -12.351
61 HH11 ARG 6 1HH1 ARG 6 -0.445 -2.889 -9.119
62 HH12 ARG 6 2HH1 ARG 6 -1.834 -3.876 -8.807
63 HH21 ARG 6 1HH2 ARG 6 -1.816 -5.406 -11.951
64 HH22 ARG 6 2HH2 ARG 6 -2.613 -5.307 -10.417
65 H PHE 7 H PHE 7 3.285 -0.766 -9.596
66 HA PHE 7 HA PHE 7 1.883 0.675 -11.638
67 HB2 PHE 7 2HB PHE 7 0.877 0.570 -9.464
68 HB3 PHE 7 3HB PHE 7 2.326 1.212 -8.698
69 HD1 PHE 7 HD2 PHE 7 0.049 2.222 -11.483
70 HD2 PHE 7 HD1 PHE 7 2.135 3.362 -7.953
71 HE1 PHE 7 HE2 PHE 7 -0.860 4.500 -11.685
72 HE2 PHE 7 HE1 PHE 7 1.230 5.641 -8.149
73 HZ PHE 7 HZ PHE 7 -0.269 6.213 -10.018
74 H VAL 8 H VAL 8 4.606 1.465 -9.483
75 HA VAL 8 HA VAL 8 5.137 3.998 -10.607
76 HB VAL 8 HB VAL 8 7.013 2.141 -9.136
77 HG11 VAL 8 1HG1 VAL 8 8.236 3.817 -10.411
78 HG12 VAL 8 2HG1 VAL 8 7.246 5.095 -9.704
79 HG13 VAL 8 3HG1 VAL 8 8.334 4.155 -8.683
80 HG21 VAL 8 3HG2 VAL 8 6.247 4.333 -7.550
81 HG22 VAL 8 1HG2 VAL 8 4.770 3.697 -8.273
82 HG23 VAL 8 2HG2 VAL 8 5.818 2.637 -7.330
83 H ALA 9 H ALA 9 6.184 0.761 -11.442
84 HA ALA 9 HA ALA 9 8.373 1.260 -13.044
85 HB1 ALA 9 3HB ALA 9 7.539 -0.781 -14.362
86 HB2 ALA 9 1HB ALA 9 7.893 -0.985 -12.646
87 HB3 ALA 9 2HB ALA 9 6.222 -0.822 -13.191
88 H GLY 10 H GLY 10 4.945 1.219 -14.026
89 HA2 GLY 10 2HA GLY 10 5.498 2.001 -16.714
90 HA3 GLY 10 3HA GLY 10 3.921 1.989 -15.940
91 H TYR 11 H TYR 11 4.898 3.746 -13.756
92 HA TYR 11 HA TYR 11 4.244 6.234 -14.989
93 HB2 TYR 11 2HB TYR 11 3.745 5.459 -12.580
94 HB3 TYR 11 3HB TYR 11 5.396 5.950 -12.222
95 HD1 TYR 11 HD2 TYR 11 6.019 8.394 -12.970
96 HD2 TYR 11 HD1 TYR 11 2.042 7.010 -12.359
97 HE1 TYR 11 HE2 TYR 11 5.265 10.715 -12.663
98 HE2 TYR 11 HE1 TYR 11 1.277 9.328 -12.051
99 HH TYR 11 HH TYR 11 1.881 11.533 -12.435
100 H ASP 12 H ASP 12 7.209 4.689 -13.945
101 HA ASP 12 HA ASP 12 8.893 6.948 -14.039
102 HB2 ASP 12 2HB ASP 12 9.344 4.596 -13.058
103 HB3 ASP 12 3HB ASP 12 9.830 4.167 -14.697
104 H ILE 13 H ILE 13 7.656 4.821 -16.505
105 HA ILE 13 HA ILE 13 9.469 5.867 -18.524
106 HB ILE 13 HB ILE 13 7.177 3.917 -18.798
107 HG12 ILE 13 2HG1 ILE 13 9.834 2.864 -19.257
108 HG13 ILE 13 3HG1 ILE 13 9.710 3.567 -17.648
109 HG21 ILE 13 1HG2 ILE 13 7.601 5.056 -20.887
110 HG22 ILE 13 2HG2 ILE 13 9.327 4.723 -20.751
111 HG23 ILE 13 3HG2 ILE 13 8.189 3.396 -20.986
112 HD11 ILE 13 3HD1 ILE 13 8.881 1.599 -17.039
113 HD12 ILE 13 1HD1 ILE 13 7.400 2.106 -17.851
114 HD13 ILE 13 2HD1 ILE 13 8.579 1.112 -18.707
115 H ALA 14 H ALA 14 5.992 5.891 -17.808
116 HA ALA 14 HA ALA 14 5.202 7.449 -20.013
117 HB1 ALA 14 3HB ALA 14 3.900 7.191 -17.305
118 HB2 ALA 14 1HB ALA 14 3.141 7.856 -18.752
119 HB3 ALA 14 2HB ALA 14 3.612 6.157 -18.704
120 H SER 15 H SER 15 6.314 8.318 -16.783
121 HA SER 15 HA SER 15 5.737 11.098 -17.031
122 HB2 SER 15 2HB SER 15 6.085 9.768 -14.869
123 HB3 SER 15 3HB SER 15 7.812 9.910 -15.193
124 HG SER 15 HG SER 15 7.623 11.766 -14.233
125 H HIS 16 H HIS 16 8.404 9.063 -17.934
126 HA HIS 16 HA HIS 16 10.247 11.245 -18.339
127 HB2 HIS 16 2HB HIS 16 11.111 9.056 -17.707
128 HB3 HIS 16 3HB HIS 16 10.398 8.333 -19.146
129 HD1 HIS 16 HD1 HIS 16 11.636 8.648 -21.368
130 HD2 HIS 16 HD2 HIS 16 13.451 10.562 -18.157
131 HE1 HIS 16 HE1 HIS 16 13.908 9.341 -22.195
132 H LYS 17 H LYS 17 8.006 9.371 -20.261
133 HA LYS 17 HA LYS 17 8.976 10.333 -22.786
134 HB2 LYS 17 2HB LYS 17 7.668 8.149 -22.272
135 HB3 LYS 17 3HB LYS 17 6.240 9.173 -22.353
136 HG2 LYS 17 2HG LYS 17 6.601 9.680 -24.619
137 HG3 LYS 17 3HG LYS 17 8.255 9.063 -24.575
138 HD2 LYS 17 2HD LYS 17 6.419 7.009 -23.767
139 HD3 LYS 17 3HD LYS 17 5.921 7.685 -25.320
140 HE2 LYS 17 2HE LYS 17 8.420 7.425 -25.953
141 HE3 LYS 17 3HE LYS 17 8.483 6.320 -24.581
142 HZ1 LYS 17 3HZ LYS 17 6.473 6.028 -26.733
143 HZ2 LYS 17 1HZ LYS 17 6.958 4.882 -25.587
144 HZ3 LYS 17 2HZ LYS 17 8.005 5.320 -26.840
145 H LYS 18 H LYS 18 5.931 10.855 -20.999
146 HA LYS 18 HA LYS 18 5.244 13.121 -22.634
147 HB2 LYS 18 2HB LYS 18 3.986 12.010 -20.120
148 HB3 LYS 18 3HB LYS 18 3.313 13.330 -21.069
149 HG2 LYS 18 2HG LYS 18 3.346 11.690 -23.032
150 HG3 LYS 18 3HG LYS 18 3.584 10.439 -21.809
151 HD2 LYS 18 2HD LYS 18 1.525 11.601 -20.670
152 HD3 LYS 18 3HD LYS 18 1.218 12.192 -22.306
153 HE2 LYS 18 2HE LYS 18 1.849 9.401 -22.395
154 HE3 LYS 18 3HE LYS 18 0.573 9.674 -21.210
155 HZ1 LYS 18 3HZ LYS 18 -0.647 9.460 -23.107
156 HZ2 LYS 18 1HZ LYS 18 0.547 10.121 -24.106
157 HZ3 LYS 18 2HZ LYS 18 -0.397 11.133 -23.134
158 H LYS 19 H LYS 19 5.894 12.726 -19.148
159 HA LYS 19 HA LYS 19 6.719 14.156 -17.582
160 HB2 LYS 19 2HB LYS 19 8.568 14.141 -19.424
161 HB3 LYS 19 3HB LYS 19 8.003 15.773 -19.758
162 HG2 LYS 19 2HG LYS 19 8.523 16.468 -17.516
163 HG3 LYS 19 3HG LYS 19 8.946 14.815 -17.063
164 HD2 LYS 19 2HD LYS 19 10.454 15.527 -19.369
165 HD3 LYS 19 3HD LYS 19 10.610 16.824 -18.182
166 HE2 LYS 19 2HE LYS 19 11.422 15.323 -16.529
167 HE3 LYS 19 3HE LYS 19 10.995 13.916 -17.502
168 HZ1 LYS 19 3HZ LYS 19 12.868 14.076 -18.693
169 HZ2 LYS 19 1HZ LYS 19 13.440 15.011 -17.404
170 HZ3 LYS 19 2HZ LYS 19 12.810 15.764 -18.782
171 H THR 20 H THR 20 4.722 15.033 -16.997
172 HA THR 20 HA THR 20 4.452 17.855 -17.569
173 HB THR 20 HB THR 20 3.125 17.097 -19.390
174 HG1 THR 20 HG1 THR 20 1.327 18.174 -18.870
175 HG21 THR 20 1HG2 THR 20 2.314 15.020 -19.373
176 HG22 THR 20 2HG2 THR 20 1.046 15.578 -18.282
177 HG23 THR 20 3HG2 THR 20 2.535 14.897 -17.628
178 H GLY 21 H GLY 21 2.974 18.936 -16.130
179 HA2 GLY 21 2HA GLY 21 1.266 18.256 -14.284
180 HA3 GLY 21 3HA GLY 21 2.683 17.468 -13.603
181 H GLY 22 H GLY 22 1.097 20.499 -14.228
182 HA2 GLY 22 2HA GLY 22 3.247 21.923 -12.801
183 HA3 GLY 22 3HA GLY 22 2.056 22.680 -13.849
184 H TYR 23 H TYR 23 0.185 23.420 -12.994
185 HA TYR 23 HA TYR 23 0.009 23.794 -10.207
186 HB2 TYR 23 2HB TYR 23 -1.783 24.337 -12.533
187 HB3 TYR 23 3HB TYR 23 -2.462 24.431 -10.911
188 HD1 TYR 23 HD2 TYR 23 -0.478 25.664 -9.289
189 HD2 TYR 23 HD1 TYR 23 -1.405 26.451 -13.366
190 HE1 TYR 23 HE2 TYR 23 0.411 27.944 -9.045
191 HE2 TYR 23 HE1 TYR 23 -0.516 28.733 -13.133
192 HH TYR 23 HH TYR 23 1.393 29.784 -11.292
193 HA PRO 24 HA PRO 24 -2.141 20.283 -8.693
194 HB2 PRO 24 2HB PRO 24 -3.862 21.381 -6.903
195 HB3 PRO 24 3HB PRO 24 -2.119 21.281 -6.624
196 HG2 PRO 24 2HG PRO 24 -3.755 23.599 -7.580
197 HG3 PRO 24 3HG PRO 24 -2.436 23.574 -6.395
198 HD2 PRO 24 2HD PRO 24 -2.077 24.373 -8.957
199 HD3 PRO 24 3HD PRO 24 -0.805 23.559 -8.024
200 H TRP 25 H TRP 25 -4.077 22.931 -9.937
201 HA TRP 25 HA TRP 25 -6.366 21.138 -10.310
202 HB2 TRP 25 2HB TRP 25 -7.538 23.283 -10.997
203 HB3 TRP 25 3HB TRP 25 -7.020 23.195 -9.316
204 HD1 TRP 25 HD1 TRP 25 -5.486 25.093 -8.459
205 HE1 TRP 25 HE1 TRP 25 -4.341 27.127 -9.542
206 HE3 TRP 25 HE3 TRP 25 -6.400 24.017 -13.372
207 HZ2 TRP 25 HZ2 TRP 25 -3.886 28.143 -12.136
208 HZ3 TRP 25 HZ3 TRP 25 -5.576 25.571 -15.093
209 HH2 TRP 25 HH2 TRP 25 -4.346 27.590 -14.486
210 H GLU 26 H GLU 26 -3.762 22.552 -12.002
211 HA GLU 26 HA GLU 26 -5.057 22.244 -14.603
212 HB2 GLU 26 2HB GLU 26 -3.366 24.151 -13.743
213 HB3 GLU 26 3HB GLU 26 -2.202 23.023 -14.421
214 HG2 GLU 26 2HG GLU 26 -4.550 23.692 -16.087
215 HG3 GLU 26 3HG GLU 26 -3.344 24.955 -15.845
216 H ARG 27 H ARG 27 -4.778 19.850 -13.295
217 HA ARG 27 HA ARG 27 -2.588 18.553 -14.782
218 HB2 ARG 27 2HB ARG 27 -2.846 18.588 -12.065
219 HB3 ARG 27 3HB ARG 27 -3.686 17.099 -12.472
220 HG2 ARG 27 2HG ARG 27 -1.716 16.282 -13.636
221 HG3 ARG 27 3HG ARG 27 -0.872 17.792 -13.288
222 HD2 ARG 27 2HD ARG 27 -0.121 16.247 -11.672
223 HD3 ARG 27 3HD ARG 27 -1.270 17.292 -10.840
224 HE ARG 27 HE ARG 27 -2.642 15.484 -10.531
225 HH11 ARG 27 1HH1 ARG 27 -0.235 14.704 -12.922
226 HH12 ARG 27 2HH1 ARG 27 -0.658 13.025 -12.989
227 HH21 ARG 27 1HH2 ARG 27 -3.207 13.276 -10.610
228 HH22 ARG 27 2HH2 ARG 27 -2.349 12.215 -11.674
229 H GLY 28 H GLY 28 -5.394 19.115 -15.574
230 HA2 GLY 28 2HA GLY 28 -6.535 16.416 -15.677
231 HA3 GLY 28 3HA GLY 28 -7.368 17.904 -16.100
232 H LYS 29 H LYS 29 -7.413 18.551 -18.183
233 HA LYS 29 HA LYS 29 -5.498 17.620 -20.113
234 HB2 LYS 29 2HB LYS 29 -6.998 16.360 -21.506
235 HB3 LYS 29 3HB LYS 29 -7.044 15.674 -19.888
236 HG2 LYS 29 2HG LYS 29 -9.098 17.254 -19.585
237 HG3 LYS 29 3HG LYS 29 -9.129 17.222 -21.350
238 HD2 LYS 29 2HD LYS 29 -10.222 15.288 -21.238
239 HD3 LYS 29 3HD LYS 29 -8.776 14.560 -20.535
240 HE2 LYS 29 2HE LYS 29 -9.687 15.584 -18.315
241 HE3 LYS 29 3HE LYS 29 -11.222 15.620 -19.182
242 HZ1 LYS 29 3HZ LYS 29 -9.874 13.410 -18.001
243 HZ2 LYS 29 1HZ LYS 29 -10.198 13.114 -19.636
244 HZ3 LYS 29 2HZ LYS 29 -11.460 13.511 -18.581
245 H ALA 30 H ALA 30 -5.637 18.717 -22.103
246 HA ALA 30 HA ALA 30 -7.757 20.418 -22.843
247 HB1 ALA 30 3HB ALA 30 -6.425 22.591 -22.471
248 HB2 ALA 30 1HB ALA 30 -7.284 21.886 -21.103
249 HB3 ALA 30 2HB ALA 30 -5.541 21.664 -21.259
Start of MODEL 15
1 H1 MET 1 H MET 1 1.173 -0.273 0.536
2 HA MET 1 HA MET 1 0.345 -1.626 -1.488
3 HB2 MET 1 2HB MET 1 1.174 1.025 -2.636
4 HB3 MET 1 3HB MET 1 1.238 -0.437 -3.611
5 HG2 MET 1 2HG MET 1 -1.232 -0.724 -2.817
6 HG3 MET 1 3HG MET 1 -1.122 1.009 -2.516
7 HE1 MET 1 3HE MET 1 -2.711 2.018 -5.574
8 HE2 MET 1 1HE MET 1 -2.565 2.005 -3.817
9 HE3 MET 1 2HE MET 1 -1.373 2.862 -4.793
10 H LYS 2 H LYS 2 1.807 -3.176 -1.195
11 HA LYS 2 HA LYS 2 4.626 -2.545 -0.938
12 HB2 LYS 2 2HB LYS 2 3.222 -4.341 0.366
13 HB3 LYS 2 3HB LYS 2 3.560 -5.342 -1.041
14 HG2 LYS 2 2HG LYS 2 5.387 -5.925 0.114
15 HG3 LYS 2 3HG LYS 2 6.034 -4.398 -0.489
16 HD2 LYS 2 2HD LYS 2 4.440 -4.333 2.017
17 HD3 LYS 2 3HD LYS 2 6.062 -5.026 2.093
18 HE2 LYS 2 2HE LYS 2 6.390 -2.708 0.612
19 HE3 LYS 2 3HE LYS 2 5.227 -2.254 1.858
20 HZ1 LYS 2 3HZ LYS 2 6.974 -2.010 3.185
21 HZ2 LYS 2 1HZ LYS 2 8.024 -2.764 2.094
22 HZ3 LYS 2 2HZ LYS 2 7.131 -3.695 3.188
23 H THR 3 H THR 3 2.439 -3.933 -3.280
24 HA THR 3 HA THR 3 4.666 -4.654 -5.038
25 HB THR 3 HB THR 3 2.850 -6.305 -4.751
26 HG1 THR 3 HG1 THR 3 4.064 -6.004 -6.794
27 HG21 THR 3 1HG2 THR 3 0.664 -5.846 -5.850
28 HG22 THR 3 2HG2 THR 3 1.156 -4.164 -6.041
29 HG23 THR 3 3HG2 THR 3 0.956 -4.847 -4.428
30 H ILE 4 H ILE 4 4.071 -1.873 -4.502
31 HA ILE 4 HA ILE 4 2.627 -0.735 -6.669
32 HB ILE 4 HB ILE 4 3.102 0.413 -4.484
33 HG12 ILE 4 2HG1 ILE 4 3.975 1.951 -6.938
34 HG13 ILE 4 3HG1 ILE 4 2.300 1.583 -6.543
35 HG21 ILE 4 1HG2 ILE 4 5.789 1.029 -5.688
36 HG22 ILE 4 2HG2 ILE 4 5.198 1.445 -4.081
37 HG23 ILE 4 3HG2 ILE 4 5.535 -0.237 -4.488
38 HD11 ILE 4 3HD1 ILE 4 4.160 3.531 -5.315
39 HD12 ILE 4 1HD1 ILE 4 2.442 3.677 -5.688
40 HD13 ILE 4 2HD1 ILE 4 2.963 2.762 -4.273
41 H LEU 5 H LEU 5 5.649 -2.203 -6.503
42 HA LEU 5 HA LEU 5 7.290 -0.723 -8.154
43 HB2 LEU 5 2HB LEU 5 8.537 -2.665 -8.503
44 HB3 LEU 5 3HB LEU 5 7.782 -2.893 -6.926
45 HG LEU 5 HG LEU 5 5.975 -4.160 -8.418
46 HD11 LEU 5 1HD1 LEU 5 8.230 -5.245 -9.889
47 HD12 LEU 5 2HD1 LEU 5 7.875 -3.574 -10.327
48 HD13 LEU 5 3HD1 LEU 5 6.617 -4.804 -10.449
49 HD21 LEU 5 3HD2 LEU 5 8.605 -5.273 -7.453
50 HD22 LEU 5 1HD2 LEU 5 7.211 -6.251 -7.912
51 HD23 LEU 5 2HD2 LEU 5 7.101 -5.149 -6.539
52 H ARG 6 H ARG 6 4.598 -2.811 -9.007
53 HA ARG 6 HA ARG 6 5.099 -2.782 -11.817
54 HB2 ARG 6 2HB ARG 6 2.998 -3.886 -12.047
55 HB3 ARG 6 3HB ARG 6 3.756 -4.522 -10.593
56 HG2 ARG 6 2HG ARG 6 1.707 -4.178 -9.730
57 HG3 ARG 6 3HG ARG 6 2.320 -2.537 -9.509
58 HD2 ARG 6 2HD ARG 6 0.308 -2.127 -10.545
59 HD3 ARG 6 3HD ARG 6 1.400 -2.183 -11.928
60 HE ARG 6 HE ARG 6 0.451 -4.758 -11.551
61 HH11 ARG 6 1HH1 ARG 6 -0.841 -1.619 -12.323
62 HH12 ARG 6 2HH1 ARG 6 -2.162 -2.247 -13.251
63 HH21 ARG 6 1HH2 ARG 6 -1.285 -5.597 -12.770
64 HH22 ARG 6 2HH2 ARG 6 -2.415 -4.510 -13.504
65 H PHE 7 H PHE 7 3.290 -0.772 -9.599
66 HA PHE 7 HA PHE 7 1.880 0.668 -11.636
67 HB2 PHE 7 2HB PHE 7 0.878 0.557 -9.460
68 HB3 PHE 7 3HB PHE 7 2.326 1.203 -8.697
69 HD1 PHE 7 HD1 PHE 7 0.049 2.210 -11.482
70 HD2 PHE 7 HD2 PHE 7 2.124 3.350 -7.945
71 HE1 PHE 7 HE1 PHE 7 -0.867 4.485 -11.683
72 HE2 PHE 7 HE2 PHE 7 1.210 5.627 -8.138
73 HZ PHE 7 HZ PHE 7 -0.287 6.196 -10.009
74 H VAL 8 H VAL 8 4.595 1.474 -9.476
75 HA VAL 8 HA VAL 8 5.120 4.006 -10.598
76 HB VAL 8 HB VAL 8 7.006 2.151 -9.137
77 HG11 VAL 8 1HG1 VAL 8 8.219 3.835 -10.410
78 HG12 VAL 8 2HG1 VAL 8 7.226 5.108 -9.696
79 HG13 VAL 8 3HG1 VAL 8 8.321 4.168 -8.680
80 HG21 VAL 8 3HG2 VAL 8 4.758 3.698 -8.263
81 HG22 VAL 8 1HG2 VAL 8 5.812 2.637 -7.328
82 HG23 VAL 8 2HG2 VAL 8 6.237 4.335 -7.541
83 H ALA 9 H ALA 9 6.177 0.774 -11.443
84 HA ALA 9 HA ALA 9 8.359 1.285 -13.050
85 HB1 ALA 9 3HB ALA 9 7.622 -0.765 -14.336
86 HB2 ALA 9 1HB ALA 9 7.814 -0.965 -12.594
87 HB3 ALA 9 2HB ALA 9 6.202 -0.795 -13.291
88 H GLY 10 H GLY 10 4.928 1.242 -14.017
89 HA2 GLY 10 2HA GLY 10 5.469 2.024 -16.709
90 HA3 GLY 10 3HA GLY 10 3.896 2.011 -15.927
91 H TYR 11 H TYR 11 4.883 3.768 -13.746
92 HA TYR 11 HA TYR 11 4.228 6.256 -14.980
93 HB2 TYR 11 2HB TYR 11 3.719 5.487 -12.575
94 HB3 TYR 11 3HB TYR 11 5.373 5.963 -12.211
95 HD1 TYR 11 HD1 TYR 11 6.018 8.404 -12.979
96 HD2 TYR 11 HD2 TYR 11 2.036 7.053 -12.325
97 HE1 TYR 11 HE1 TYR 11 5.285 10.731 -12.667
98 HE2 TYR 11 HE2 TYR 11 1.292 9.377 -12.015
99 HH TYR 11 HH TYR 11 2.911 11.971 -12.978
100 H ASP 12 H ASP 12 7.190 4.713 -13.921
101 HA ASP 12 HA ASP 12 8.876 6.969 -14.016
102 HB2 ASP 12 2HB ASP 12 9.309 4.595 -13.049
103 HB3 ASP 12 3HB ASP 12 9.836 4.203 -14.683
104 H ILE 13 H ILE 13 7.678 4.809 -16.481
105 HA ILE 13 HA ILE 13 9.484 5.867 -18.497
106 HB ILE 13 HB ILE 13 7.201 3.909 -18.775
107 HG12 ILE 13 2HG1 ILE 13 9.873 2.876 -19.216
108 HG13 ILE 13 3HG1 ILE 13 9.719 3.565 -17.604
109 HG21 ILE 13 1HG2 ILE 13 9.371 4.673 -20.723
110 HG22 ILE 13 2HG2 ILE 13 8.182 3.395 -20.961
111 HG23 ILE 13 3HG2 ILE 13 7.660 5.076 -20.861
112 HD11 ILE 13 3HD1 ILE 13 8.903 1.583 -17.024
113 HD12 ILE 13 1HD1 ILE 13 7.427 2.087 -17.847
114 HD13 ILE 13 2HD1 ILE 13 8.623 1.109 -18.699
115 H ALA 14 H ALA 14 6.003 5.877 -17.798
116 HA ALA 14 HA ALA 14 5.210 7.421 -20.008
117 HB1 ALA 14 3HB ALA 14 3.471 6.319 -18.940
118 HB2 ALA 14 1HB ALA 14 3.987 6.848 -17.338
119 HB3 ALA 14 2HB ALA 14 3.232 7.995 -18.446
120 H SER 15 H SER 15 6.313 8.324 -16.783
121 HA SER 15 HA SER 15 5.742 11.103 -17.072
122 HB2 SER 15 2HB SER 15 5.992 9.932 -14.872
123 HB3 SER 15 3HB SER 15 7.721 9.800 -15.189
124 HG SER 15 HG SER 15 6.186 12.151 -14.830
125 H HIS 16 H HIS 16 8.411 9.048 -17.926
126 HA HIS 16 HA HIS 16 10.254 11.229 -18.353
127 HB2 HIS 16 2HB HIS 16 10.776 8.744 -17.716
128 HB3 HIS 16 3HB HIS 16 10.667 8.471 -19.453
129 HD1 HIS 16 HD1 HIS 16 12.611 9.247 -20.887
130 HD2 HIS 16 HD2 HIS 16 12.948 10.405 -16.911
131 HE1 HIS 16 HE1 HIS 16 14.951 10.136 -20.641
132 H LYS 17 H LYS 17 8.065 9.273 -20.256
133 HA LYS 17 HA LYS 17 9.059 10.200 -22.790
134 HB2 LYS 17 2HB LYS 17 7.236 8.199 -21.867
135 HB3 LYS 17 3HB LYS 17 6.412 9.202 -23.053
136 HG2 LYS 17 2HG LYS 17 7.335 7.822 -24.545
137 HG3 LYS 17 3HG LYS 17 8.797 8.775 -24.281
138 HD2 LYS 17 2HD LYS 17 9.529 7.182 -22.575
139 HD3 LYS 17 3HD LYS 17 8.059 6.235 -22.823
140 HE2 LYS 17 2HE LYS 17 8.727 5.859 -25.163
141 HE3 LYS 17 3HE LYS 17 10.214 6.760 -24.869
142 HZ1 LYS 17 3HZ LYS 17 10.884 5.115 -23.263
143 HZ2 LYS 17 1HZ LYS 17 10.528 4.349 -24.729
144 HZ3 LYS 17 2HZ LYS 17 9.427 4.274 -23.448
145 H LYS 18 H LYS 18 5.984 10.686 -21.046
146 HA LYS 18 HA LYS 18 5.217 12.860 -22.757
147 HB2 LYS 18 2HB LYS 18 4.051 11.776 -20.191
148 HB3 LYS 18 3HB LYS 18 3.343 13.115 -21.085
149 HG2 LYS 18 2HG LYS 18 3.881 10.656 -22.626
150 HG3 LYS 18 3HG LYS 18 2.604 10.563 -21.409
151 HD2 LYS 18 2HD LYS 18 2.272 13.004 -22.806
152 HD3 LYS 18 3HD LYS 18 2.521 11.737 -24.009
153 HE2 LYS 18 2HE LYS 18 0.618 11.308 -21.742
154 HE3 LYS 18 3HE LYS 18 0.120 12.248 -23.148
155 HZ1 LYS 18 3HZ LYS 18 1.226 10.067 -24.274
156 HZ2 LYS 18 1HZ LYS 18 -0.430 10.267 -23.988
157 HZ3 LYS 18 2HZ LYS 18 0.520 9.405 -22.885
158 H LYS 19 H LYS 19 6.061 12.629 -19.300
159 HA LYS 19 HA LYS 19 6.870 14.161 -17.825
160 HB2 LYS 19 2HB LYS 19 8.753 14.118 -19.455
161 HB3 LYS 19 3HB LYS 19 8.015 15.474 -20.297
162 HG2 LYS 19 2HG LYS 19 8.754 16.964 -18.800
163 HG3 LYS 19 3HG LYS 19 8.415 15.907 -17.428
164 HD2 LYS 19 2HD LYS 19 10.525 15.162 -17.349
165 HD3 LYS 19 3HD LYS 19 10.605 14.949 -19.100
166 HE2 LYS 19 2HE LYS 19 10.586 17.743 -18.213
167 HE3 LYS 19 3HE LYS 19 11.991 16.820 -17.682
168 HZ1 LYS 19 3HZ LYS 19 11.932 16.082 -20.202
169 HZ2 LYS 19 1HZ LYS 19 12.728 17.488 -19.701
170 HZ3 LYS 19 2HZ LYS 19 11.183 17.588 -20.380
171 H THR 20 H THR 20 4.866 14.990 -17.194
172 HA THR 20 HA THR 20 4.486 17.779 -17.804
173 HB THR 20 HB THR 20 3.201 16.963 -19.639
174 HG1 THR 20 HG1 THR 20 1.526 18.172 -19.144
175 HG21 THR 20 1HG2 THR 20 2.982 14.631 -18.816
176 HG22 THR 20 2HG2 THR 20 1.471 15.288 -19.447
177 HG23 THR 20 3HG2 THR 20 1.725 15.174 -17.706
178 H GLY 21 H GLY 21 3.212 18.859 -16.276
179 HA2 GLY 21 2HA GLY 21 1.604 18.784 -14.455
180 HA3 GLY 21 3HA GLY 21 2.239 17.200 -14.037
181 H GLY 22 H GLY 22 2.768 20.649 -13.876
182 HA2 GLY 22 2HA GLY 22 3.834 21.808 -12.159
183 HA3 GLY 22 3HA GLY 22 4.420 20.278 -11.524
184 H TYR 23 H TYR 23 5.105 22.989 -13.532
185 HA TYR 23 HA TYR 23 7.344 21.973 -14.920
186 HB2 TYR 23 2HB TYR 23 6.297 24.698 -14.291
187 HB3 TYR 23 3HB TYR 23 7.944 24.550 -14.898
188 HD1 TYR 23 HD2 TYR 23 7.869 22.543 -16.912
189 HD2 TYR 23 HD1 TYR 23 4.891 25.430 -15.964
190 HE1 TYR 23 HE2 TYR 23 7.012 22.406 -19.214
191 HE2 TYR 23 HE1 TYR 23 4.025 25.300 -18.261
192 HH TYR 23 HH TYR 23 4.652 24.629 -20.431
193 HA PRO 24 HA PRO 24 10.600 21.967 -11.981
194 HB2 PRO 24 2HB PRO 24 12.689 22.925 -13.426
195 HB3 PRO 24 3HB PRO 24 12.003 21.316 -13.680
196 HG2 PRO 24 2HG PRO 24 11.529 23.842 -15.216
197 HG3 PRO 24 3HG PRO 24 11.781 22.195 -15.822
198 HD2 PRO 24 2HD PRO 24 9.325 23.318 -15.635
199 HD3 PRO 24 3HD PRO 24 9.598 21.578 -15.418
200 H TRP 25 H TRP 25 9.977 24.979 -13.671
201 HA TRP 25 HA TRP 25 11.355 26.490 -11.571
202 HB2 TRP 25 2HB TRP 25 10.897 28.453 -13.117
203 HB3 TRP 25 3HB TRP 25 11.994 27.224 -13.740
204 HD1 TRP 25 HD1 TRP 25 11.385 26.151 -16.013
205 HE1 TRP 25 HE1 TRP 25 9.389 26.335 -17.628
206 HE3 TRP 25 HE3 TRP 25 8.190 28.827 -13.053
207 HZ2 TRP 25 HZ2 TRP 25 6.803 27.464 -17.645
208 HZ3 TRP 25 HZ3 TRP 25 5.974 29.419 -13.943
209 HH2 TRP 25 HH2 TRP 25 5.297 28.751 -16.193
210 H GLU 26 H GLU 26 8.238 25.544 -12.592
211 HA GLU 26 HA GLU 26 6.920 27.713 -11.143
212 HB2 GLU 26 2HB GLU 26 6.231 26.533 -13.461
213 HB3 GLU 26 3HB GLU 26 5.329 25.518 -12.344
214 HG2 GLU 26 2HG GLU 26 5.106 28.452 -12.006
215 HG3 GLU 26 3HG GLU 26 4.315 27.724 -13.404
216 H ARG 27 H ARG 27 8.400 26.132 -9.477
217 HA ARG 27 HA ARG 27 6.436 24.374 -8.170
218 HB2 ARG 27 2HB ARG 27 8.826 23.592 -8.878
219 HB3 ARG 27 3HB ARG 27 9.341 24.454 -7.435
220 HG2 ARG 27 2HG ARG 27 7.658 23.068 -6.160
221 HG3 ARG 27 3HG ARG 27 7.501 22.089 -7.620
222 HD2 ARG 27 2HD ARG 27 9.315 20.944 -7.054
223 HD3 ARG 27 3HD ARG 27 10.267 22.428 -7.086
224 HE ARG 27 HE ARG 27 10.258 22.427 -4.803
225 HH11 ARG 27 1HH1 ARG 27 7.708 20.346 -5.936
226 HH12 ARG 27 2HH1 ARG 27 7.307 19.758 -4.357
227 HH21 ARG 27 1HH2 ARG 27 9.741 21.660 -2.717
228 HH22 ARG 27 2HH2 ARG 27 8.464 20.508 -2.526
229 H GLY 28 H GLY 28 6.554 27.333 -7.999
230 HA2 GLY 28 2HA GLY 28 5.695 27.943 -5.577
231 HA3 GLY 28 3HA GLY 28 7.414 27.789 -5.243
232 H LYS 29 H LYS 29 8.858 29.119 -6.699
233 HA LYS 29 HA LYS 29 8.154 31.834 -6.471
234 HB2 LYS 29 2HB LYS 29 10.379 30.392 -7.892
235 HB3 LYS 29 3HB LYS 29 10.211 32.139 -8.002
236 HG2 LYS 29 2HG LYS 29 10.033 31.462 -5.269
237 HG3 LYS 29 3HG LYS 29 11.404 30.578 -5.942
238 HD2 LYS 29 2HD LYS 29 10.981 33.516 -6.430
239 HD3 LYS 29 3HD LYS 29 11.874 32.908 -5.035
240 HE2 LYS 29 2HE LYS 29 13.420 31.748 -6.539
241 HE3 LYS 29 3HE LYS 29 12.527 32.361 -7.930
242 HZ1 LYS 29 3HZ LYS 29 14.118 33.913 -5.972
243 HZ2 LYS 29 1HZ LYS 29 13.043 34.640 -7.056
244 HZ3 LYS 29 2HZ LYS 29 14.372 33.773 -7.638
245 H ALA 30 H ALA 30 7.787 33.410 -8.095
246 HA ALA 30 HA ALA 30 6.565 32.308 -10.539
247 HB1 ALA 30 3HB ALA 30 5.160 34.338 -10.565
248 HB2 ALA 30 1HB ALA 30 4.923 33.361 -9.116
249 HB3 ALA 30 2HB ALA 30 5.889 34.834 -9.038
Start of MODEL 16
1 H1 MET 1 H MET 1 2.371 1.252 -0.543
2 HA MET 1 HA MET 1 1.164 -0.767 -0.829
3 HB2 MET 1 2HB MET 1 0.723 0.345 -3.317
4 HB3 MET 1 3HB MET 1 1.674 -1.086 -3.690
5 HG2 MET 1 2HG MET 1 0.081 -2.511 -2.641
6 HG3 MET 1 3HG MET 1 -0.800 -1.134 -1.985
7 HE1 MET 1 3HE MET 1 -2.661 0.363 -4.928
8 HE2 MET 1 1HE MET 1 -2.052 0.547 -3.284
9 HE3 MET 1 2HE MET 1 -0.998 0.886 -4.657
10 H LYS 2 H LYS 2 1.981 -2.919 -1.080
11 HA LYS 2 HA LYS 2 4.830 -3.051 -0.826
12 HB2 LYS 2 2HB LYS 2 2.563 -4.760 -0.272
13 HB3 LYS 2 3HB LYS 2 3.845 -5.665 -1.066
14 HG2 LYS 2 2HG LYS 2 4.136 -4.023 1.442
15 HG3 LYS 2 3HG LYS 2 4.045 -5.784 1.353
16 HD2 LYS 2 2HD LYS 2 6.074 -5.528 -0.263
17 HD3 LYS 2 3HD LYS 2 6.251 -3.950 0.508
18 HE2 LYS 2 2HE LYS 2 7.241 -4.896 2.255
19 HE3 LYS 2 3HE LYS 2 5.825 -5.909 2.530
20 HZ1 LYS 2 3HZ LYS 2 7.900 -7.176 2.194
21 HZ2 LYS 2 1HZ LYS 2 8.001 -6.564 0.620
22 HZ3 LYS 2 2HZ LYS 2 6.705 -7.557 1.059
23 H THR 3 H THR 3 2.506 -3.734 -3.337
24 HA THR 3 HA THR 3 4.688 -4.686 -5.075
25 HB THR 3 HB THR 3 2.811 -6.296 -4.728
26 HG1 THR 3 HG1 THR 3 4.101 -5.894 -6.817
27 HG21 THR 3 1HG2 THR 3 1.045 -4.768 -6.533
28 HG22 THR 3 2HG2 THR 3 1.165 -4.161 -4.882
29 HG23 THR 3 3HG2 THR 3 0.644 -5.820 -5.176
30 H ILE 4 H ILE 4 4.080 -1.898 -4.505
31 HA ILE 4 HA ILE 4 2.636 -0.750 -6.664
32 HB ILE 4 HB ILE 4 3.119 0.387 -4.475
33 HG12 ILE 4 2HG1 ILE 4 3.984 1.938 -6.924
34 HG13 ILE 4 3HG1 ILE 4 2.310 1.568 -6.526
35 HG21 ILE 4 1HG2 ILE 4 5.801 1.010 -5.686
36 HG22 ILE 4 2HG2 ILE 4 5.217 1.417 -4.075
37 HG23 ILE 4 3HG2 ILE 4 5.553 -0.263 -4.491
38 HD11 ILE 4 3HD1 ILE 4 2.189 3.197 -5.006
39 HD12 ILE 4 1HD1 ILE 4 3.799 2.863 -4.370
40 HD13 ILE 4 2HD1 ILE 4 3.610 3.839 -5.827
41 H LEU 5 H LEU 5 5.659 -2.218 -6.518
42 HA LEU 5 HA LEU 5 7.293 -0.729 -8.167
43 HB2 LEU 5 2HB LEU 5 8.539 -2.670 -8.530
44 HB3 LEU 5 3HB LEU 5 7.791 -2.906 -6.953
45 HG LEU 5 HG LEU 5 5.977 -4.165 -8.443
46 HD11 LEU 5 1HD1 LEU 5 7.879 -3.572 -10.354
47 HD12 LEU 5 2HD1 LEU 5 6.610 -4.790 -10.484
48 HD13 LEU 5 3HD1 LEU 5 8.219 -5.250 -9.930
49 HD21 LEU 5 3HD2 LEU 5 7.101 -5.172 -6.578
50 HD22 LEU 5 1HD2 LEU 5 8.610 -5.275 -7.485
51 HD23 LEU 5 2HD2 LEU 5 7.226 -6.261 -7.961
52 H ARG 6 H ARG 6 4.598 -2.814 -9.021
53 HA ARG 6 HA ARG 6 5.088 -2.770 -11.832
54 HB2 ARG 6 2HB ARG 6 2.998 -3.883 -12.060
55 HB3 ARG 6 3HB ARG 6 3.745 -4.511 -10.598
56 HG2 ARG 6 2HG ARG 6 1.671 -4.171 -9.778
57 HG3 ARG 6 3HG ARG 6 2.308 -2.547 -9.511
58 HD2 ARG 6 2HD ARG 6 0.407 -1.970 -10.604
59 HD3 ARG 6 3HD ARG 6 1.432 -2.242 -12.012
60 HE ARG 6 HE ARG 6 0.256 -4.672 -11.413
61 HH11 ARG 6 1HH1 ARG 6 -0.779 -1.481 -12.340
62 HH12 ARG 6 2HH1 ARG 6 -2.201 -2.038 -13.160
63 HH21 ARG 6 1HH2 ARG 6 -1.611 -5.419 -12.489
64 HH22 ARG 6 2HH2 ARG 6 -2.674 -4.278 -13.243
65 H PHE 7 H PHE 7 3.287 -0.771 -9.596
66 HA PHE 7 HA PHE 7 1.870 0.680 -11.621
67 HB2 PHE 7 2HB PHE 7 0.876 0.558 -9.442
68 HB3 PHE 7 3HB PHE 7 2.328 1.199 -8.681
69 HD1 PHE 7 HD2 PHE 7 0.038 2.222 -11.451
70 HD2 PHE 7 HD1 PHE 7 2.129 3.342 -7.917
71 HE1 PHE 7 HE2 PHE 7 -0.878 4.498 -11.634
72 HE2 PHE 7 HE1 PHE 7 1.216 5.620 -8.094
73 HZ PHE 7 HZ PHE 7 -0.289 6.201 -9.955
74 H VAL 8 H VAL 8 4.594 1.474 -9.468
75 HA VAL 8 HA VAL 8 5.116 4.010 -10.579
76 HB VAL 8 HB VAL 8 7.007 2.147 -9.135
77 HG11 VAL 8 1HG1 VAL 8 8.216 3.838 -10.402
78 HG12 VAL 8 2HG1 VAL 8 7.226 5.107 -9.678
79 HG13 VAL 8 3HG1 VAL 8 8.323 4.161 -8.672
80 HG21 VAL 8 3HG2 VAL 8 6.242 4.324 -7.526
81 HG22 VAL 8 1HG2 VAL 8 4.762 3.688 -8.244
82 HG23 VAL 8 2HG2 VAL 8 5.820 2.625 -7.317
83 H ALA 9 H ALA 9 6.167 0.783 -11.444
84 HA ALA 9 HA ALA 9 8.345 1.303 -13.056
85 HB1 ALA 9 3HB ALA 9 6.186 -0.777 -13.292
86 HB2 ALA 9 1HB ALA 9 7.594 -0.739 -14.355
87 HB3 ALA 9 2HB ALA 9 7.807 -0.950 -12.616
88 H GLY 10 H GLY 10 4.910 1.264 -14.011
89 HA2 GLY 10 2HA GLY 10 5.442 2.061 -16.701
90 HA3 GLY 10 3HA GLY 10 3.870 2.044 -15.913
91 H TYR 11 H TYR 11 4.866 3.790 -13.728
92 HA TYR 11 HA TYR 11 4.206 6.285 -14.944
93 HB2 TYR 11 2HB TYR 11 3.700 5.511 -12.545
94 HB3 TYR 11 3HB TYR 11 5.361 5.964 -12.181
95 HD1 TYR 11 HD1 TYR 11 6.029 8.404 -12.935
96 HD2 TYR 11 HD2 TYR 11 2.037 7.093 -12.272
97 HE1 TYR 11 HE1 TYR 11 5.325 10.737 -12.602
98 HE2 TYR 11 HE2 TYR 11 1.320 9.422 -11.939
99 HH TYR 11 HH TYR 11 1.955 11.613 -12.298
100 H ASP 12 H ASP 12 7.173 4.735 -13.908
101 HA ASP 12 HA ASP 12 8.857 6.995 -14.003
102 HB2 ASP 12 2HB ASP 12 9.297 4.620 -13.042
103 HB3 ASP 12 3HB ASP 12 9.814 4.228 -14.679
104 H ILE 13 H ILE 13 7.735 4.764 -16.465
105 HA ILE 13 HA ILE 13 9.504 5.853 -18.484
106 HB ILE 13 HB ILE 13 7.227 3.887 -18.759
107 HG12 ILE 13 2HG1 ILE 13 9.901 2.859 -19.195
108 HG13 ILE 13 3HG1 ILE 13 9.748 3.555 -17.585
109 HG21 ILE 13 1HG2 ILE 13 9.395 4.665 -20.705
110 HG22 ILE 13 2HG2 ILE 13 8.224 3.368 -20.941
111 HG23 ILE 13 3HG2 ILE 13 7.678 5.042 -20.848
112 HD11 ILE 13 3HD1 ILE 13 8.693 1.080 -18.650
113 HD12 ILE 13 1HD1 ILE 13 8.904 1.596 -16.977
114 HD13 ILE 13 2HD1 ILE 13 7.452 2.056 -17.866
115 H ALA 14 H ALA 14 6.014 5.830 -17.813
116 HA ALA 14 HA ALA 14 5.208 7.360 -20.015
117 HB1 ALA 14 3HB ALA 14 3.998 6.902 -17.307
118 HB2 ALA 14 1HB ALA 14 3.224 7.934 -18.511
119 HB3 ALA 14 2HB ALA 14 3.512 6.230 -18.864
120 H SER 15 H SER 15 6.304 8.316 -16.797
121 HA SER 15 HA SER 15 5.753 11.091 -17.145
122 HB2 SER 15 2HB SER 15 6.897 11.415 -15.066
123 HB3 SER 15 3HB SER 15 6.004 9.901 -14.927
124 HG SER 15 HG SER 15 7.858 9.053 -14.449
125 H HIS 16 H HIS 16 8.437 9.007 -17.899
126 HA HIS 16 HA HIS 16 10.332 11.122 -18.311
127 HB2 HIS 16 2HB HIS 16 10.866 8.690 -17.744
128 HB3 HIS 16 3HB HIS 16 10.517 8.328 -19.431
129 HD1 HIS 16 HD1 HIS 16 13.265 9.026 -17.315
130 HD2 HIS 16 HD2 HIS 16 12.227 10.150 -21.177
131 HE1 HIS 16 HE1 HIS 16 15.411 9.763 -18.400
132 H LYS 17 H LYS 17 8.104 9.291 -20.315
133 HA LYS 17 HA LYS 17 9.106 10.350 -22.791
134 HB2 LYS 17 2HB LYS 17 7.091 8.417 -21.947
135 HB3 LYS 17 3HB LYS 17 6.542 9.413 -23.289
136 HG2 LYS 17 2HG LYS 17 8.131 8.597 -24.727
137 HG3 LYS 17 3HG LYS 17 9.245 8.169 -23.425
138 HD2 LYS 17 2HD LYS 17 8.386 6.135 -24.318
139 HD3 LYS 17 3HD LYS 17 7.616 6.382 -22.749
140 HE2 LYS 17 2HE LYS 17 5.686 6.037 -23.820
141 HE3 LYS 17 3HE LYS 17 5.905 7.657 -24.481
142 HZ1 LYS 17 3HZ LYS 17 5.541 6.315 -26.328
143 HZ2 LYS 17 1HZ LYS 17 6.518 5.060 -25.748
144 HZ3 LYS 17 2HZ LYS 17 7.222 6.495 -26.303
145 H LYS 18 H LYS 18 6.002 10.746 -21.071
146 HA LYS 18 HA LYS 18 5.217 12.981 -22.656
147 HB2 LYS 18 2HB LYS 18 4.138 11.504 -20.328
148 HB3 LYS 18 3HB LYS 18 3.626 13.180 -20.479
149 HG2 LYS 18 2HG LYS 18 3.466 11.458 -22.890
150 HG3 LYS 18 3HG LYS 18 2.290 11.200 -21.600
151 HD2 LYS 18 2HD LYS 18 2.206 13.889 -21.794
152 HD3 LYS 18 3HD LYS 18 2.598 13.466 -23.463
153 HE2 LYS 18 2HE LYS 18 0.477 12.920 -23.825
154 HE3 LYS 18 3HE LYS 18 0.573 11.693 -22.562
155 HZ1 LYS 18 3HZ LYS 18 -1.195 13.428 -22.271
156 HZ2 LYS 18 1HZ LYS 18 0.039 14.550 -21.985
157 HZ3 LYS 18 2HZ LYS 18 -0.158 13.227 -20.949
158 H LYS 19 H LYS 19 6.164 12.716 -19.226
159 HA LYS 19 HA LYS 19 7.059 14.220 -17.774
160 HB2 LYS 19 2HB LYS 19 8.781 14.165 -19.712
161 HB3 LYS 19 3HB LYS 19 8.139 15.750 -20.123
162 HG2 LYS 19 2HG LYS 19 8.695 16.527 -17.845
163 HG3 LYS 19 3HG LYS 19 9.430 14.954 -17.522
164 HD2 LYS 19 2HD LYS 19 10.945 15.350 -19.471
165 HD3 LYS 19 3HD LYS 19 10.287 16.985 -19.582
166 HE2 LYS 19 2HE LYS 19 11.955 17.543 -18.197
167 HE3 LYS 19 3HE LYS 19 10.953 16.820 -16.940
168 HZ1 LYS 19 3HZ LYS 19 12.131 14.768 -17.162
169 HZ2 LYS 19 1HZ LYS 19 13.267 16.003 -16.956
170 HZ3 LYS 19 2HZ LYS 19 13.007 15.342 -18.490
171 H THR 20 H THR 20 5.087 15.077 -17.074
172 HA THR 20 HA THR 20 4.750 17.878 -17.598
173 HB THR 20 HB THR 20 3.468 17.147 -19.480
174 HG1 THR 20 HG1 THR 20 1.252 17.719 -18.617
175 HG21 THR 20 1HG2 THR 20 3.110 14.828 -18.893
176 HG22 THR 20 2HG2 THR 20 1.552 15.589 -19.219
177 HG23 THR 20 3HG2 THR 20 2.059 15.294 -17.557
178 H GLY 21 H GLY 21 3.482 18.923 -16.039
179 HA2 GLY 21 2HA GLY 21 1.700 18.473 -14.282
180 HA3 GLY 21 3HA GLY 21 2.796 17.214 -13.732
181 H GLY 22 H GLY 22 1.887 20.436 -13.398
182 HA2 GLY 22 2HA GLY 22 4.219 20.912 -11.667
183 HA3 GLY 22 3HA GLY 22 3.756 22.131 -12.845
184 H TYR 23 H TYR 23 2.318 23.631 -12.258
185 HA TYR 23 HA TYR 23 1.453 23.827 -9.583
186 HB2 TYR 23 2HB TYR 23 0.920 25.348 -12.097
187 HB3 TYR 23 3HB TYR 23 -0.122 25.634 -10.708
188 HD1 TYR 23 HD2 TYR 23 1.572 25.623 -8.426
189 HD2 TYR 23 HD1 TYR 23 2.433 27.070 -12.332
190 HE1 TYR 23 HE2 TYR 23 3.245 27.159 -7.481
191 HE2 TYR 23 HE1 TYR 23 4.109 28.610 -11.400
192 HH TYR 23 HH TYR 23 5.580 28.418 -8.876
193 HA PRO 24 HA PRO 24 -2.377 21.694 -9.433
194 HB2 PRO 24 2HB PRO 24 -3.905 23.348 -7.917
195 HB3 PRO 24 3HB PRO 24 -2.571 22.396 -7.254
196 HG2 PRO 24 2HG PRO 24 -2.625 25.282 -8.049
197 HG3 PRO 24 3HG PRO 24 -1.901 24.529 -6.615
198 HD2 PRO 24 2HD PRO 24 -0.440 25.247 -8.779
199 HD3 PRO 24 3HD PRO 24 -0.022 23.850 -7.765
200 H TRP 25 H TRP 25 -2.446 25.035 -10.502
201 HA TRP 25 HA TRP 25 -5.043 24.612 -11.795
202 HB2 TRP 25 2HB TRP 25 -4.866 27.101 -12.263
203 HB3 TRP 25 3HB TRP 25 -4.999 26.646 -10.567
204 HD1 TRP 25 HD1 TRP 25 -3.146 27.494 -8.975
205 HE1 TRP 25 HE1 TRP 25 -0.945 28.793 -9.284
206 HE3 TRP 25 HE3 TRP 25 -2.836 27.363 -14.077
207 HZ2 TRP 25 HZ2 TRP 25 0.704 29.648 -11.409
208 HZ3 TRP 25 HZ3 TRP 25 -0.916 28.446 -15.170
209 HH2 TRP 25 HH2 TRP 25 0.816 29.565 -13.862
210 H GLU 26 H GLU 26 -1.699 24.701 -12.462
211 HA GLU 26 HA GLU 26 -2.099 25.266 -15.300
212 HB2 GLU 26 2HB GLU 26 -0.112 26.042 -13.675
213 HB3 GLU 26 3HB GLU 26 0.580 24.532 -14.252
214 HG2 GLU 26 2HG GLU 26 -0.536 26.176 -16.382
215 HG3 GLU 26 3HG GLU 26 0.768 26.963 -15.493
216 H ARG 27 H ARG 27 -3.296 22.910 -14.383
217 HA ARG 27 HA ARG 27 -1.608 20.858 -15.659
218 HB2 ARG 27 2HB ARG 27 -2.732 19.185 -14.261
219 HB3 ARG 27 3HB ARG 27 -1.906 20.389 -13.281
220 HG2 ARG 27 2HG ARG 27 -3.789 20.731 -12.173
221 HG3 ARG 27 3HG ARG 27 -4.531 21.326 -13.659
222 HD2 ARG 27 2HD ARG 27 -5.970 19.624 -13.234
223 HD3 ARG 27 3HD ARG 27 -4.747 18.710 -14.114
224 HE ARG 27 HE ARG 27 -4.032 18.660 -11.432
225 HH11 ARG 27 1HH1 ARG 27 -6.651 17.552 -13.440
226 HH12 ARG 27 2HH1 ARG 27 -7.023 16.194 -12.430
227 HH21 ARG 27 1HH2 ARG 27 -4.512 16.876 -10.095
228 HH22 ARG 27 2HH2 ARG 27 -5.807 15.811 -10.527
229 H GLY 28 H GLY 28 -3.373 22.623 -17.047
230 HA2 GLY 28 2HA GLY 28 -4.680 22.202 -18.952
231 HA3 GLY 28 3HA GLY 28 -5.071 20.615 -18.305
232 H LYS 29 H LYS 29 -6.107 23.825 -18.706
233 HA LYS 29 HA LYS 29 -8.636 23.185 -17.412
234 HB2 LYS 29 2HB LYS 29 -6.770 24.684 -16.035
235 HB3 LYS 29 3HB LYS 29 -7.787 25.911 -16.776
236 HG2 LYS 29 2HG LYS 29 -9.757 24.934 -15.757
237 HG3 LYS 29 3HG LYS 29 -8.777 23.640 -15.064
238 HD2 LYS 29 2HD LYS 29 -8.828 25.031 -13.264
239 HD3 LYS 29 3HD LYS 29 -7.432 25.725 -14.093
240 HE2 LYS 29 2HE LYS 29 -8.585 27.585 -14.762
241 HE3 LYS 29 3HE LYS 29 -10.135 26.747 -14.797
242 HZ1 LYS 29 3HZ LYS 29 -9.080 28.351 -12.762
243 HZ2 LYS 29 1HZ LYS 29 -9.211 26.776 -12.157
244 HZ3 LYS 29 2HZ LYS 29 -10.570 27.552 -12.799
245 H ALA 30 H ALA 30 -10.164 23.614 -18.849
246 HA ALA 30 HA ALA 30 -9.652 25.416 -21.057
247 HB1 ALA 30 3HB ALA 30 -11.571 24.523 -22.068
248 HB2 ALA 30 1HB ALA 30 -10.834 23.163 -21.221
249 HB3 ALA 30 2HB ALA 30 -12.235 23.979 -20.528
Start of MODEL 17
1 H1 MET 1 H MET 1 2.590 -0.336 1.020
2 HA MET 1 HA MET 1 2.994 -0.313 -1.340
3 HB2 MET 1 2HB MET 1 5.409 -0.307 -2.096
4 HB3 MET 1 3HB MET 1 4.830 1.191 -1.378
5 HG2 MET 1 2HG MET 1 6.366 1.118 0.215
6 HG3 MET 1 3HG MET 1 5.965 -0.549 0.619
7 HE1 MET 1 3HE MET 1 8.938 1.575 -0.380
8 HE2 MET 1 1HE MET 1 9.359 0.993 -1.991
9 HE3 MET 1 2HE MET 1 7.821 1.815 -1.724
10 H LYS 2 H LYS 2 2.172 -2.355 -1.388
11 HA LYS 2 HA LYS 2 3.758 -4.598 -0.445
12 HB2 LYS 2 2HB LYS 2 0.974 -4.322 -1.554
13 HB3 LYS 2 3HB LYS 2 1.719 -5.900 -1.334
14 HG2 LYS 2 2HG LYS 2 2.033 -4.383 1.061
15 HG3 LYS 2 3HG LYS 2 0.341 -4.342 0.562
16 HD2 LYS 2 2HD LYS 2 0.879 -6.950 0.169
17 HD3 LYS 2 3HD LYS 2 1.998 -6.606 1.489
18 HE2 LYS 2 2HE LYS 2 0.134 -5.689 2.804
19 HE3 LYS 2 3HE LYS 2 -0.973 -6.074 1.487
20 HZ1 LYS 2 3HZ LYS 2 -1.244 -7.966 2.635
21 HZ2 LYS 2 1HZ LYS 2 0.222 -7.816 3.467
22 HZ3 LYS 2 2HZ LYS 2 0.202 -8.438 1.895
23 H THR 3 H THR 3 2.571 -3.274 -3.494
24 HA THR 3 HA THR 3 4.698 -4.576 -4.934
25 HB THR 3 HB THR 3 3.028 -6.382 -4.877
26 HG1 THR 3 HG1 THR 3 4.322 -6.183 -6.745
27 HG21 THR 3 1HG2 THR 3 0.860 -5.866 -4.952
28 HG22 THR 3 2HG2 THR 3 1.065 -5.473 -6.660
29 HG23 THR 3 3HG2 THR 3 1.223 -4.211 -5.440
30 H ILE 4 H ILE 4 4.080 -1.882 -4.496
31 HA ILE 4 HA ILE 4 2.636 -0.739 -6.661
32 HB ILE 4 HB ILE 4 3.115 0.405 -4.474
33 HG12 ILE 4 2HG1 ILE 4 3.989 1.947 -6.925
34 HG13 ILE 4 3HG1 ILE 4 2.313 1.579 -6.532
35 HG21 ILE 4 1HG2 ILE 4 5.547 -0.250 -4.483
36 HG22 ILE 4 2HG2 ILE 4 5.801 1.019 -5.680
37 HG23 ILE 4 3HG2 ILE 4 5.213 1.431 -4.069
38 HD11 ILE 4 3HD1 ILE 4 2.184 3.264 -5.092
39 HD12 ILE 4 1HD1 ILE 4 3.723 2.849 -4.336
40 HD13 ILE 4 2HD1 ILE 4 3.695 3.832 -5.801
41 H LEU 5 H LEU 5 5.656 -2.212 -6.500
42 HA LEU 5 HA LEU 5 7.299 -0.731 -8.149
43 HB2 LEU 5 2HB LEU 5 8.542 -2.674 -8.503
44 HB3 LEU 5 3HB LEU 5 7.787 -2.905 -6.927
45 HG LEU 5 HG LEU 5 5.977 -4.165 -8.421
46 HD11 LEU 5 1HD1 LEU 5 7.639 -3.545 -10.406
47 HD12 LEU 5 2HD1 LEU 5 6.698 -5.036 -10.385
48 HD13 LEU 5 3HD1 LEU 5 8.389 -5.055 -9.888
49 HD21 LEU 5 3HD2 LEU 5 7.517 -6.246 -8.059
50 HD22 LEU 5 1HD2 LEU 5 6.870 -5.367 -6.674
51 HD23 LEU 5 2HD2 LEU 5 8.533 -5.094 -7.192
52 H ARG 6 H ARG 6 4.602 -2.814 -9.004
53 HA ARG 6 HA ARG 6 5.101 -2.780 -11.814
54 HB2 ARG 6 2HB ARG 6 2.980 -3.862 -12.043
55 HB3 ARG 6 3HB ARG 6 3.761 -4.526 -10.615
56 HG2 ARG 6 2HG ARG 6 1.725 -4.193 -9.715
57 HG3 ARG 6 3HG ARG 6 2.354 -2.563 -9.464
58 HD2 ARG 6 2HD ARG 6 0.370 -2.058 -10.472
59 HD3 ARG 6 3HD ARG 6 1.398 -2.200 -11.897
60 HE ARG 6 HE ARG 6 0.125 -3.968 -12.554
61 HH11 ARG 6 1HH1 ARG 6 -0.227 -3.577 -9.113
62 HH12 ARG 6 2HH1 ARG 6 -1.420 -4.825 -8.961
63 HH21 ARG 6 1HH2 ARG 6 -1.444 -5.613 -12.367
64 HH22 ARG 6 2HH2 ARG 6 -2.110 -5.983 -10.813
65 H PHE 7 H PHE 7 3.297 -0.770 -9.592
66 HA PHE 7 HA PHE 7 1.889 0.677 -11.626
67 HB2 PHE 7 2HB PHE 7 0.887 0.564 -9.450
68 HB3 PHE 7 3HB PHE 7 2.338 1.205 -8.686
69 HD1 PHE 7 HD2 PHE 7 0.063 2.225 -11.468
70 HD2 PHE 7 HD1 PHE 7 2.141 3.350 -7.928
71 HE1 PHE 7 HE2 PHE 7 -0.847 4.503 -11.662
72 HE2 PHE 7 HE1 PHE 7 1.232 5.629 -8.114
73 HZ PHE 7 HZ PHE 7 -0.262 6.209 -9.984
74 H VAL 8 H VAL 8 4.606 1.475 -9.464
75 HA VAL 8 HA VAL 8 5.136 4.006 -10.581
76 HB VAL 8 HB VAL 8 7.020 2.144 -9.127
77 HG11 VAL 8 1HG1 VAL 8 8.338 4.158 -8.665
78 HG12 VAL 8 2HG1 VAL 8 8.235 3.831 -10.396
79 HG13 VAL 8 3HG1 VAL 8 7.246 5.102 -9.677
80 HG21 VAL 8 3HG2 VAL 8 6.255 4.325 -7.525
81 HG22 VAL 8 1HG2 VAL 8 4.776 3.692 -8.247
82 HG23 VAL 8 2HG2 VAL 8 5.828 2.627 -7.314
83 H ALA 9 H ALA 9 6.187 0.774 -11.434
84 HA ALA 9 HA ALA 9 8.369 1.286 -13.042
85 HB1 ALA 9 3HB ALA 9 7.623 -0.760 -14.333
86 HB2 ALA 9 1HB ALA 9 7.823 -0.964 -12.592
87 HB3 ALA 9 2HB ALA 9 6.208 -0.790 -13.281
88 H GLY 10 H GLY 10 4.937 1.249 -14.006
89 HA2 GLY 10 2HA GLY 10 5.475 2.037 -16.696
90 HA3 GLY 10 3HA GLY 10 3.902 2.023 -15.913
91 H TYR 11 H TYR 11 4.895 3.775 -13.730
92 HA TYR 11 HA TYR 11 4.237 6.266 -14.953
93 HB2 TYR 11 2HB TYR 11 3.743 5.494 -12.547
94 HB3 TYR 11 3HB TYR 11 5.402 5.964 -12.194
95 HD1 TYR 11 HD2 TYR 11 6.045 8.405 -12.959
96 HD2 TYR 11 HD1 TYR 11 2.065 7.062 -12.282
97 HE1 TYR 11 HE2 TYR 11 5.321 10.734 -12.636
98 HE2 TYR 11 HE1 TYR 11 1.329 9.387 -11.959
99 HH TYR 11 HH TYR 11 2.044 11.513 -11.614
100 H ASP 12 H ASP 12 7.205 4.713 -13.935
101 HA ASP 12 HA ASP 12 8.891 6.973 -14.034
102 HB2 ASP 12 2HB ASP 12 9.357 4.634 -13.048
103 HB3 ASP 12 3HB ASP 12 9.805 4.181 -14.691
104 H ILE 13 H ILE 13 7.692 4.798 -16.493
105 HA ILE 13 HA ILE 13 9.475 5.866 -18.521
106 HB ILE 13 HB ILE 13 7.193 3.903 -18.783
107 HG12 ILE 13 2HG1 ILE 13 9.851 2.859 -19.250
108 HG13 ILE 13 3HG1 ILE 13 9.737 3.571 -17.644
109 HG21 ILE 13 1HG2 ILE 13 7.641 5.078 -20.869
110 HG22 ILE 13 2HG2 ILE 13 9.350 4.667 -20.747
111 HG23 ILE 13 3HG2 ILE 13 8.152 3.394 -20.976
112 HD11 ILE 13 3HD1 ILE 13 8.628 1.099 -18.669
113 HD12 ILE 13 1HD1 ILE 13 8.901 1.618 -17.005
114 HD13 ILE 13 2HD1 ILE 13 7.426 2.094 -17.847
115 H ALA 14 H ALA 14 5.998 5.869 -17.797
116 HA ALA 14 HA ALA 14 5.182 7.406 -20.001
117 HB1 ALA 14 3HB ALA 14 3.276 8.028 -18.269
118 HB2 ALA 14 1HB ALA 14 3.387 6.425 -18.999
119 HB3 ALA 14 2HB ALA 14 4.005 6.698 -17.369
120 H SER 15 H SER 15 6.313 8.327 -16.788
121 HA SER 15 HA SER 15 5.747 11.104 -17.092
122 HB2 SER 15 2HB SER 15 5.934 10.157 -14.869
123 HB3 SER 15 3HB SER 15 7.590 9.642 -15.187
124 HG SER 15 HG SER 15 7.839 11.525 -14.143
125 H HIS 16 H HIS 16 8.408 9.038 -17.942
126 HA HIS 16 HA HIS 16 10.287 11.175 -18.357
127 HB2 HIS 16 2HB HIS 16 10.932 8.817 -17.767
128 HB3 HIS 16 3HB HIS 16 10.444 8.340 -19.391
129 HD1 HIS 16 HD1 HIS 16 11.853 9.489 -21.380
130 HD2 HIS 16 HD2 HIS 16 13.483 9.762 -17.568
131 HE1 HIS 16 HE1 HIS 16 14.270 10.092 -21.724
132 H LYS 17 H LYS 17 8.013 9.359 -20.305
133 HA LYS 17 HA LYS 17 8.987 10.381 -22.810
134 HB2 LYS 17 2HB LYS 17 6.813 8.583 -21.916
135 HB3 LYS 17 3HB LYS 17 6.517 9.460 -23.412
136 HG2 LYS 17 2HG LYS 17 8.682 8.583 -24.275
137 HG3 LYS 17 3HG LYS 17 8.798 7.589 -22.821
138 HD2 LYS 17 2HD LYS 17 6.786 6.411 -23.396
139 HD3 LYS 17 3HD LYS 17 6.483 7.501 -24.751
140 HE2 LYS 17 2HE LYS 17 9.035 5.951 -24.630
141 HE3 LYS 17 3HE LYS 17 7.554 5.156 -25.162
142 HZ1 LYS 17 3HZ LYS 17 7.320 6.746 -26.918
143 HZ2 LYS 17 1HZ LYS 17 8.882 6.099 -26.995
144 HZ3 LYS 17 2HZ LYS 17 8.637 7.648 -26.359
145 H LYS 18 H LYS 18 5.947 10.840 -20.998
146 HA LYS 18 HA LYS 18 5.172 13.087 -22.597
147 HB2 LYS 18 2HB LYS 18 4.052 11.570 -20.323
148 HB3 LYS 18 3HB LYS 18 3.575 13.260 -20.410
149 HG2 LYS 18 2HG LYS 18 3.317 12.223 -23.011
150 HG3 LYS 18 3HG LYS 18 2.613 11.032 -21.914
151 HD2 LYS 18 2HD LYS 18 0.936 12.425 -21.263
152 HD3 LYS 18 3HD LYS 18 1.929 13.875 -21.432
153 HE2 LYS 18 2HE LYS 18 1.766 13.600 -23.910
154 HE3 LYS 18 3HE LYS 18 0.621 12.288 -23.637
155 HZ1 LYS 18 3HZ LYS 18 -0.913 13.884 -23.697
156 HZ2 LYS 18 1HZ LYS 18 0.215 15.128 -23.493
157 HZ3 LYS 18 2HZ LYS 18 -0.391 14.306 -22.144
158 H LYS 19 H LYS 19 6.105 12.752 -19.170
159 HA LYS 19 HA LYS 19 6.956 14.242 -17.674
160 HB2 LYS 19 2HB LYS 19 8.695 14.155 -19.665
161 HB3 LYS 19 3HB LYS 19 8.186 15.822 -19.890
162 HG2 LYS 19 2HG LYS 19 9.179 16.533 -17.981
163 HG3 LYS 19 3HG LYS 19 8.922 14.999 -17.145
164 HD2 LYS 19 2HD LYS 19 10.720 14.742 -19.416
165 HD3 LYS 19 3HD LYS 19 11.305 15.901 -18.219
166 HE2 LYS 19 2HE LYS 19 10.314 13.179 -17.429
167 HE3 LYS 19 3HE LYS 19 11.978 13.441 -17.947
168 HZ1 LYS 19 3HZ LYS 19 11.350 13.587 -15.446
169 HZ2 LYS 19 1HZ LYS 19 10.846 15.152 -15.845
170 HZ3 LYS 19 2HZ LYS 19 12.453 14.690 -16.103
171 H THR 20 H THR 20 4.989 15.165 -17.051
172 HA THR 20 HA THR 20 4.792 17.952 -17.309
173 HB THR 20 HB THR 20 3.993 17.609 -19.551
174 HG1 THR 20 HG1 THR 20 2.782 19.209 -18.744
175 HG21 THR 20 1HG2 THR 20 1.900 15.772 -18.380
176 HG22 THR 20 2HG2 THR 20 3.314 15.248 -19.294
177 HG23 THR 20 3HG2 THR 20 2.069 16.221 -20.076
178 H GLY 21 H GLY 21 3.088 18.854 -16.044
179 HA2 GLY 21 2HA GLY 21 1.384 16.966 -14.593
180 HA3 GLY 21 3HA GLY 21 2.511 17.933 -13.652
181 H GLY 22 H GLY 22 -0.239 18.110 -15.868
182 HA2 GLY 22 2HA GLY 22 -1.538 20.110 -14.359
183 HA3 GLY 22 3HA GLY 22 -0.717 20.859 -15.720
184 H TYR 23 H TYR 23 -3.335 18.817 -14.716
185 HA TYR 23 HA TYR 23 -4.208 17.906 -17.221
186 HB2 TYR 23 2HB TYR 23 -5.491 18.281 -14.551
187 HB3 TYR 23 3HB TYR 23 -6.524 17.964 -15.940
188 HD1 TYR 23 HD1 TYR 23 -5.170 16.017 -17.510
189 HD2 TYR 23 HD2 TYR 23 -5.267 16.377 -13.272
190 HE1 TYR 23 HE1 TYR 23 -4.717 13.609 -17.301
191 HE2 TYR 23 HE2 TYR 23 -4.814 13.969 -13.052
192 HH TYR 23 HH TYR 23 -4.603 12.029 -14.128
193 HA PRO 24 HA PRO 24 -6.077 21.350 -19.192
194 HB2 PRO 24 2HB PRO 24 -8.305 20.253 -20.290
195 HB3 PRO 24 3HB PRO 24 -6.677 19.928 -20.894
196 HG2 PRO 24 2HG PRO 24 -8.391 18.271 -19.084
197 HG3 PRO 24 3HG PRO 24 -7.386 17.758 -20.451
198 HD2 PRO 24 2HD PRO 24 -6.585 17.501 -17.877
199 HD3 PRO 24 3HD PRO 24 -5.447 17.804 -19.206
200 H TRP 25 H TRP 25 -8.067 19.505 -16.969
201 HA TRP 25 HA TRP 25 -9.909 21.767 -16.674
202 HB2 TRP 25 2HB TRP 25 -11.212 20.119 -15.249
203 HB3 TRP 25 3HB TRP 25 -11.080 19.718 -16.959
204 HD1 TRP 25 HD1 TRP 25 -10.088 17.403 -17.550
205 HE1 TRP 25 HE1 TRP 25 -9.057 15.473 -16.194
206 HE3 TRP 25 HE3 TRP 25 -9.699 19.718 -13.008
207 HZ2 TRP 25 HZ2 TRP 25 -8.193 14.995 -13.550
208 HZ3 TRP 25 HZ3 TRP 25 -8.760 18.455 -11.117
209 HH2 TRP 25 HH2 TRP 25 -8.024 16.142 -11.384
210 H GLU 26 H GLU 26 -7.241 20.263 -15.165
211 HA GLU 26 HA GLU 26 -7.853 21.412 -12.550
212 HB2 GLU 26 2HB GLU 26 -6.731 19.048 -13.154
213 HB3 GLU 26 3HB GLU 26 -5.275 20.025 -13.036
214 HG2 GLU 26 2HG GLU 26 -5.777 20.627 -10.782
215 HG3 GLU 26 3HG GLU 26 -7.366 19.872 -10.882
216 H ARG 27 H ARG 27 -7.499 23.335 -14.474
217 HA ARG 27 HA ARG 27 -4.799 24.382 -13.943
218 HB2 ARG 27 2HB ARG 27 -5.633 23.990 -16.357
219 HB3 ARG 27 3HB ARG 27 -6.633 25.412 -16.090
220 HG2 ARG 27 2HG ARG 27 -4.730 26.798 -15.783
221 HG3 ARG 27 3HG ARG 27 -3.650 25.403 -15.724
222 HD2 ARG 27 2HD ARG 27 -3.306 25.886 -17.894
223 HD3 ARG 27 3HD ARG 27 -4.826 25.024 -18.129
224 HE ARG 27 HE ARG 27 -5.548 27.624 -17.652
225 HH11 ARG 27 1HH1 ARG 27 -3.527 25.981 -19.963
226 HH12 ARG 27 2HH1 ARG 27 -3.811 27.133 -21.225
227 HH21 ARG 27 1HH2 ARG 27 -5.928 29.147 -19.307
228 HH22 ARG 27 2HH2 ARG 27 -5.176 28.934 -20.851
229 H GLY 28 H GLY 28 -7.172 24.535 -12.177
230 HA2 GLY 28 2HA GLY 28 -7.083 26.639 -10.733
231 HA3 GLY 28 3HA GLY 28 -7.629 27.448 -12.194
232 H LYS 29 H LYS 29 -9.561 25.888 -13.182
233 HA LYS 29 HA LYS 29 -11.468 25.479 -10.981
234 HB2 LYS 29 2HB LYS 29 -11.692 27.267 -13.336
235 HB3 LYS 29 3HB LYS 29 -13.130 26.350 -12.909
236 HG2 LYS 29 2HG LYS 29 -12.735 27.254 -10.531
237 HG3 LYS 29 3HG LYS 29 -11.681 28.429 -11.320
238 HD2 LYS 29 2HD LYS 29 -14.550 27.951 -12.112
239 HD3 LYS 29 3HD LYS 29 -14.042 29.196 -10.968
240 HE2 LYS 29 2HE LYS 29 -12.461 29.316 -13.371
241 HE3 LYS 29 3HE LYS 29 -14.179 29.392 -13.758
242 HZ1 LYS 29 3HZ LYS 29 -13.170 31.065 -11.574
243 HZ2 LYS 29 1HZ LYS 29 -14.436 31.355 -12.658
244 HZ3 LYS 29 2HZ LYS 29 -12.833 31.538 -13.162
245 H ALA 30 H ALA 30 -12.232 23.479 -11.007
246 HA ALA 30 HA ALA 30 -11.747 21.634 -13.067
247 HB1 ALA 30 3HB ALA 30 -13.966 21.279 -11.086
248 HB2 ALA 30 1HB ALA 30 -12.876 20.072 -11.769
249 HB3 ALA 30 2HB ALA 30 -12.278 21.228 -10.577
Start of MODEL 18
1 H1 MET 1 H MET 1 2.888 1.434 -2.266
2 HA MET 1 HA MET 1 1.270 -0.597 -0.880
3 HB2 MET 1 2HB MET 1 0.902 0.476 -3.384
4 HB3 MET 1 3HB MET 1 1.768 -1.013 -3.739
5 HG2 MET 1 2HG MET 1 0.093 -2.345 -2.780
6 HG3 MET 1 3HG MET 1 -0.653 -0.967 -1.972
7 HE1 MET 1 3HE MET 1 -0.708 -3.125 -5.349
8 HE2 MET 1 1HE MET 1 -0.769 -1.783 -6.492
9 HE3 MET 1 2HE MET 1 0.623 -1.969 -5.424
10 H LYS 2 H LYS 2 1.907 -2.814 -1.054
11 HA LYS 2 HA LYS 2 4.716 -3.192 -0.743
12 HB2 LYS 2 2HB LYS 2 3.016 -4.490 0.509
13 HB3 LYS 2 3HB LYS 2 2.527 -5.264 -0.992
14 HG2 LYS 2 2HG LYS 2 4.740 -6.257 -1.214
15 HG3 LYS 2 3HG LYS 2 5.254 -5.458 0.273
16 HD2 LYS 2 2HD LYS 2 4.127 -6.908 1.600
17 HD3 LYS 2 3HD LYS 2 2.802 -7.097 0.449
18 HE2 LYS 2 2HE LYS 2 4.115 -8.588 -0.901
19 HE3 LYS 2 3HE LYS 2 5.545 -8.293 0.086
20 HZ1 LYS 2 3HZ LYS 2 4.905 -9.823 1.543
21 HZ2 LYS 2 1HZ LYS 2 3.725 -10.303 0.429
22 HZ3 LYS 2 2HZ LYS 2 3.336 -9.200 1.649
23 H THR 3 H THR 3 2.460 -3.599 -3.360
24 HA THR 3 HA THR 3 4.645 -4.652 -5.037
25 HB THR 3 HB THR 3 2.770 -6.267 -4.711
26 HG1 THR 3 HG1 THR 3 3.173 -5.232 -7.338
27 HG21 THR 3 1HG2 THR 3 0.607 -5.802 -5.194
28 HG22 THR 3 2HG2 THR 3 1.025 -4.754 -6.549
29 HG23 THR 3 3HG2 THR 3 1.118 -4.140 -4.900
30 H ILE 4 H ILE 4 4.042 -1.866 -4.497
31 HA ILE 4 HA ILE 4 2.614 -0.726 -6.672
32 HB ILE 4 HB ILE 4 3.087 0.423 -4.486
33 HG12 ILE 4 2HG1 ILE 4 3.971 1.955 -6.939
34 HG13 ILE 4 3HG1 ILE 4 2.294 1.593 -6.548
35 HG21 ILE 4 1HG2 ILE 4 5.519 -0.237 -4.487
36 HG22 ILE 4 2HG2 ILE 4 5.779 1.030 -5.685
37 HG23 ILE 4 3HG2 ILE 4 5.186 1.447 -4.077
38 HD11 ILE 4 3HD1 ILE 4 2.218 3.473 -5.394
39 HD12 ILE 4 1HD1 ILE 4 3.382 2.785 -4.261
40 HD13 ILE 4 2HD1 ILE 4 3.945 3.737 -5.635
41 H LEU 5 H LEU 5 5.630 -2.203 -6.498
42 HA LEU 5 HA LEU 5 7.280 -0.730 -8.146
43 HB2 LEU 5 2HB LEU 5 8.521 -2.676 -8.491
44 HB3 LEU 5 3HB LEU 5 7.763 -2.901 -6.915
45 HG LEU 5 HG LEU 5 5.954 -4.163 -8.410
46 HD11 LEU 5 1HD1 LEU 5 6.578 -4.583 -10.492
47 HD12 LEU 5 2HD1 LEU 5 8.025 -5.401 -9.901
48 HD13 LEU 5 3HD1 LEU 5 8.066 -3.671 -10.237
49 HD21 LEU 5 3HD2 LEU 5 8.576 -5.262 -7.410
50 HD22 LEU 5 1HD2 LEU 5 7.214 -6.260 -7.919
51 HD23 LEU 5 2HD2 LEU 5 7.044 -5.176 -6.538
52 H ARG 6 H ARG 6 4.583 -2.811 -9.004
53 HA ARG 6 HA ARG 6 5.091 -2.786 -11.812
54 HB2 ARG 6 2HB ARG 6 2.968 -3.868 -12.044
55 HB3 ARG 6 3HB ARG 6 3.745 -4.527 -10.611
56 HG2 ARG 6 2HG ARG 6 1.689 -4.194 -9.741
57 HG3 ARG 6 3HG ARG 6 2.342 -2.580 -9.453
58 HD2 ARG 6 2HD ARG 6 0.500 -1.888 -10.535
59 HD3 ARG 6 3HD ARG 6 1.403 -2.322 -11.986
60 HE ARG 6 HE ARG 6 0.046 -4.592 -11.061
61 HH11 ARG 6 1HH1 ARG 6 -0.620 -1.479 -12.472
62 HH12 ARG 6 2HH1 ARG 6 -2.083 -1.997 -13.242
63 HH21 ARG 6 1HH2 ARG 6 -1.879 -5.284 -12.070
64 HH22 ARG 6 2HH2 ARG 6 -2.799 -4.161 -13.012
65 H PHE 7 H PHE 7 3.282 -0.768 -9.599
66 HA PHE 7 HA PHE 7 1.882 0.675 -11.642
67 HB2 PHE 7 2HB PHE 7 0.874 0.569 -9.468
68 HB3 PHE 7 3HB PHE 7 2.323 1.211 -8.702
69 HD1 PHE 7 HD1 PHE 7 0.056 2.224 -11.493
70 HD2 PHE 7 HD2 PHE 7 2.126 3.359 -7.952
71 HE1 PHE 7 HE1 PHE 7 -0.852 4.502 -11.697
72 HE2 PHE 7 HE2 PHE 7 1.221 5.639 -8.149
73 HZ PHE 7 HZ PHE 7 -0.271 6.212 -10.024
74 H VAL 8 H VAL 8 4.594 1.475 -9.476
75 HA VAL 8 HA VAL 8 5.130 4.002 -10.600
76 HB VAL 8 HB VAL 8 7.008 2.143 -9.133
77 HG11 VAL 8 1HG1 VAL 8 8.229 3.822 -10.404
78 HG12 VAL 8 2HG1 VAL 8 7.238 5.098 -9.694
79 HG13 VAL 8 3HG1 VAL 8 8.327 4.156 -8.675
80 HG21 VAL 8 3HG2 VAL 8 5.811 2.635 -7.325
81 HG22 VAL 8 1HG2 VAL 8 6.241 4.332 -7.543
82 HG23 VAL 8 2HG2 VAL 8 4.762 3.697 -8.265
83 H ALA 9 H ALA 9 6.178 0.767 -11.440
84 HA ALA 9 HA ALA 9 8.366 1.270 -13.041
85 HB1 ALA 9 3HB ALA 9 7.622 -0.778 -14.328
86 HB2 ALA 9 1HB ALA 9 7.814 -0.978 -12.586
87 HB3 ALA 9 2HB ALA 9 6.203 -0.803 -13.284
88 H GLY 10 H GLY 10 4.937 1.236 -14.017
89 HA2 GLY 10 2HA GLY 10 5.486 2.014 -16.708
90 HA3 GLY 10 3HA GLY 10 3.910 2.007 -15.929
91 H TYR 11 H TYR 11 4.899 3.763 -13.748
92 HA TYR 11 HA TYR 11 4.254 6.252 -14.986
93 HB2 TYR 11 2HB TYR 11 3.727 5.497 -12.586
94 HB3 TYR 11 3HB TYR 11 5.388 5.943 -12.212
95 HD1 TYR 11 HD1 TYR 11 6.076 8.375 -12.972
96 HD2 TYR 11 HD2 TYR 11 2.070 7.091 -12.336
97 HE1 TYR 11 HE1 TYR 11 5.382 10.714 -12.658
98 HE2 TYR 11 HE2 TYR 11 1.364 9.426 -12.022
99 HH TYR 11 HH TYR 11 3.562 12.100 -12.586
100 H ASP 12 H ASP 12 7.208 4.699 -13.923
101 HA ASP 12 HA ASP 12 8.901 6.951 -14.016
102 HB2 ASP 12 2HB ASP 12 9.325 4.577 -13.044
103 HB3 ASP 12 3HB ASP 12 9.856 4.181 -14.676
104 H ILE 13 H ILE 13 7.663 4.828 -16.482
105 HA ILE 13 HA ILE 13 9.488 5.870 -18.496
106 HB ILE 13 HB ILE 13 7.213 3.902 -18.774
107 HG12 ILE 13 2HG1 ILE 13 9.891 2.881 -19.209
108 HG13 ILE 13 3HG1 ILE 13 9.730 3.569 -17.597
109 HG21 ILE 13 1HG2 ILE 13 7.668 5.068 -20.860
110 HG22 ILE 13 2HG2 ILE 13 9.381 4.675 -20.721
111 HG23 ILE 13 3HG2 ILE 13 8.198 3.389 -20.958
112 HD11 ILE 13 3HD1 ILE 13 8.951 1.557 -17.044
113 HD12 ILE 13 1HD1 ILE 13 7.453 2.091 -17.804
114 HD13 ILE 13 2HD1 ILE 13 8.609 1.122 -18.718
115 H ALA 14 H ALA 14 6.015 5.891 -17.773
116 HA ALA 14 HA ALA 14 5.217 7.425 -19.996
117 HB1 ALA 14 3HB ALA 14 3.833 7.419 -17.326
118 HB2 ALA 14 1HB ALA 14 3.125 7.653 -18.924
119 HB3 ALA 14 2HB ALA 14 3.739 6.068 -18.456
120 H SER 15 H SER 15 6.339 8.319 -16.779
121 HA SER 15 HA SER 15 5.739 11.093 -17.036
122 HB2 SER 15 2HB SER 15 6.048 9.881 -14.854
123 HB3 SER 15 3HB SER 15 7.777 9.820 -15.197
124 HG SER 15 HG SER 15 6.177 12.144 -14.881
125 H HIS 16 H HIS 16 8.401 9.071 -17.968
126 HA HIS 16 HA HIS 16 10.222 11.274 -18.399
127 HB2 HIS 16 2HB HIS 16 10.683 8.696 -17.857
128 HB3 HIS 16 3HB HIS 16 10.730 8.605 -19.616
129 HD1 HIS 16 HD1 HIS 16 13.172 8.380 -20.066
130 HD2 HIS 16 HD2 HIS 16 12.338 11.471 -17.419
131 HE1 HIS 16 HE1 HIS 16 15.360 9.568 -19.708
132 H LYS 17 H LYS 17 8.017 9.315 -20.283
133 HA LYS 17 HA LYS 17 8.960 10.264 -22.826
134 HB2 LYS 17 2HB LYS 17 6.549 8.679 -21.958
135 HB3 LYS 17 3HB LYS 17 6.768 9.199 -23.623
136 HG2 LYS 17 2HG LYS 17 9.150 8.048 -23.204
137 HG3 LYS 17 3HG LYS 17 8.160 7.101 -22.090
138 HD2 LYS 17 2HD LYS 17 6.696 6.425 -23.846
139 HD3 LYS 17 3HD LYS 17 7.427 7.568 -24.975
140 HE2 LYS 17 2HE LYS 17 9.057 6.139 -25.509
141 HE3 LYS 17 3HE LYS 17 9.380 5.756 -23.819
142 HZ1 LYS 17 3HZ LYS 17 7.714 4.365 -25.749
143 HZ2 LYS 17 1HZ LYS 17 7.090 4.462 -24.180
144 HZ3 LYS 17 2HZ LYS 17 8.603 3.754 -24.447
145 H LYS 18 H LYS 18 5.943 10.761 -20.986
146 HA LYS 18 HA LYS 18 5.150 12.951 -22.678
147 HB2 LYS 18 2HB LYS 18 3.999 11.815 -20.129
148 HB3 LYS 18 3HB LYS 18 3.289 13.178 -20.984
149 HG2 LYS 18 2HG LYS 18 3.724 11.045 -22.828
150 HG3 LYS 18 3HG LYS 18 2.858 10.432 -21.418
151 HD2 LYS 18 2HD LYS 18 1.906 13.019 -22.446
152 HD3 LYS 18 3HD LYS 18 1.676 11.649 -23.534
153 HE2 LYS 18 2HE LYS 18 -0.276 11.910 -22.139
154 HE3 LYS 18 3HE LYS 18 0.565 10.423 -21.702
155 HZ1 LYS 18 3HZ LYS 18 1.374 11.375 -19.746
156 HZ2 LYS 18 1HZ LYS 18 -0.232 11.905 -19.823
157 HZ3 LYS 18 2HZ LYS 18 1.026 12.953 -20.244
158 H LYS 19 H LYS 19 5.984 12.666 -19.222
159 HA LYS 19 HA LYS 19 6.775 14.180 -17.717
160 HB2 LYS 19 2HB LYS 19 8.703 14.096 -19.277
161 HB3 LYS 19 3HB LYS 19 8.013 15.446 -20.170
162 HG2 LYS 19 2HG LYS 19 8.085 16.391 -17.591
163 HG3 LYS 19 3HG LYS 19 9.560 15.427 -17.707
164 HD2 LYS 19 2HD LYS 19 10.329 16.682 -19.578
165 HD3 LYS 19 3HD LYS 19 8.769 17.490 -19.756
166 HE2 LYS 19 2HE LYS 19 9.099 18.786 -17.827
167 HE3 LYS 19 3HE LYS 19 10.405 17.752 -17.251
168 HZ1 LYS 19 3HZ LYS 19 11.723 18.514 -19.183
169 HZ2 LYS 19 1HZ LYS 19 11.334 19.759 -18.105
170 HZ3 LYS 19 2HZ LYS 19 10.492 19.610 -19.564
171 H THR 20 H THR 20 4.709 15.009 -17.205
172 HA THR 20 HA THR 20 4.454 17.795 -17.402
173 HB THR 20 HB THR 20 3.802 17.550 -19.684
174 HG1 THR 20 HG1 THR 20 1.266 17.685 -18.484
175 HG21 THR 20 1HG2 THR 20 1.850 15.454 -18.728
176 HG22 THR 20 2HG2 THR 20 3.287 15.177 -19.712
177 HG23 THR 20 3HG2 THR 20 1.930 16.093 -20.369
178 H GLY 21 H GLY 21 2.798 18.606 -16.095
179 HA2 GLY 21 2HA GLY 21 0.511 17.726 -15.151
180 HA3 GLY 21 3HA GLY 21 1.587 16.592 -14.348
181 H GLY 22 H GLY 22 0.676 19.978 -14.628
182 HA2 GLY 22 2HA GLY 22 0.720 21.661 -13.061
183 HA3 GLY 22 3HA GLY 22 1.089 20.437 -11.856
184 H TYR 23 H TYR 23 2.276 23.056 -13.621
185 HA TYR 23 HA TYR 23 5.045 22.417 -13.630
186 HB2 TYR 23 2HB TYR 23 3.429 24.894 -14.046
187 HB3 TYR 23 3HB TYR 23 5.157 25.058 -13.755
188 HD1 TYR 23 HD2 TYR 23 6.409 22.945 -15.188
189 HD2 TYR 23 HD1 TYR 23 2.964 25.188 -16.284
190 HE1 TYR 23 HE2 TYR 23 6.858 22.465 -17.559
191 HE2 TYR 23 HE1 TYR 23 3.402 24.714 -18.658
192 HH TYR 23 HH TYR 23 6.345 23.149 -19.705
193 HA PRO 24 HA PRO 24 6.339 23.316 -9.536
194 HB2 PRO 24 2HB PRO 24 8.700 24.592 -9.940
195 HB3 PRO 24 3HB PRO 24 8.485 22.860 -10.218
196 HG2 PRO 24 2HG PRO 24 8.476 25.111 -12.191
197 HG3 PRO 24 3HG PRO 24 9.242 23.516 -12.317
198 HD2 PRO 24 2HD PRO 24 6.888 24.101 -13.521
199 HD3 PRO 24 3HD PRO 24 7.273 22.478 -12.912
200 H TRP 25 H TRP 25 6.207 25.996 -11.795
201 HA TRP 25 HA TRP 25 6.097 27.913 -9.580
202 HB2 TRP 25 2HB TRP 25 6.189 29.618 -11.459
203 HB3 TRP 25 3HB TRP 25 7.622 28.610 -11.265
204 HD1 TRP 25 HD1 TRP 25 8.407 27.274 -13.336
205 HE1 TRP 25 HE1 TRP 25 7.491 26.912 -15.714
206 HE3 TRP 25 HE3 TRP 25 3.796 29.407 -12.764
207 HZ2 TRP 25 HZ2 TRP 25 5.128 27.458 -17.157
208 HZ3 TRP 25 HZ3 TRP 25 2.268 29.447 -14.692
209 HH2 TRP 25 HH2 TRP 25 2.921 28.492 -16.842
210 H GLU 26 H GLU 26 4.098 26.252 -11.793
211 HA GLU 26 HA GLU 26 1.923 28.188 -11.541
212 HB2 GLU 26 2HB GLU 26 2.675 26.726 -13.669
213 HB3 GLU 26 3HB GLU 26 1.505 25.619 -12.965
214 HG2 GLU 26 2HG GLU 26 0.560 28.375 -13.133
215 HG3 GLU 26 3HG GLU 26 0.933 27.648 -14.695
216 H ARG 27 H ARG 27 2.546 27.132 -9.123
217 HA ARG 27 HA ARG 27 0.573 25.012 -8.634
218 HB2 ARG 27 2HB ARG 27 2.825 26.051 -6.903
219 HB3 ARG 27 3HB ARG 27 1.689 24.798 -6.419
220 HG2 ARG 27 2HG ARG 27 2.477 23.365 -8.222
221 HG3 ARG 27 3HG ARG 27 3.594 24.628 -8.746
222 HD2 ARG 27 2HD ARG 27 3.624 23.145 -6.121
223 HD3 ARG 27 3HD ARG 27 4.793 23.004 -7.433
224 HE ARG 27 HE ARG 27 4.859 25.643 -6.752
225 HH11 ARG 27 1HH1 ARG 27 5.276 22.650 -5.022
226 HH12 ARG 27 2HH1 ARG 27 6.378 23.322 -3.865
227 HH21 ARG 27 1HH2 ARG 27 6.308 26.539 -5.235
228 HH22 ARG 27 2HH2 ARG 27 6.962 25.534 -3.987
229 H GLY 28 H GLY 28 -0.031 27.890 -9.091
230 HA2 GLY 28 2HA GLY 28 -2.047 28.860 -8.161
231 HA3 GLY 28 3HA GLY 28 -1.507 28.331 -6.575
232 H LYS 29 H LYS 29 0.745 29.761 -8.797
233 HA LYS 29 HA LYS 29 0.616 32.298 -7.311
234 HB2 LYS 29 2HB LYS 29 2.952 30.493 -7.755
235 HB3 LYS 29 3HB LYS 29 3.229 32.229 -7.752
236 HG2 LYS 29 2HG LYS 29 1.598 31.475 -5.510
237 HG3 LYS 29 3HG LYS 29 3.084 30.523 -5.547
238 HD2 LYS 29 2HD LYS 29 3.036 33.523 -5.823
239 HD3 LYS 29 3HD LYS 29 3.209 32.697 -4.273
240 HE2 LYS 29 2HE LYS 29 5.029 31.770 -6.386
241 HE3 LYS 29 3HE LYS 29 5.276 33.440 -5.875
242 HZ1 LYS 29 3HZ LYS 29 6.199 31.186 -4.612
243 HZ2 LYS 29 1HZ LYS 29 4.914 31.711 -3.644
244 HZ3 LYS 29 2HZ LYS 29 6.195 32.759 -3.990
245 H ALA 30 H ALA 30 -0.646 32.872 -9.260
246 HA ALA 30 HA ALA 30 1.154 33.682 -11.448
247 HB1 ALA 30 3HB ALA 30 -1.381 32.199 -11.560
248 HB2 ALA 30 1HB ALA 30 -1.233 33.526 -12.713
249 HB3 ALA 30 2HB ALA 30 -0.031 32.234 -12.695
Start of MODEL 19
1 H1 MET 1 H MET 1 2.040 1.248 -0.730
2 HA MET 1 HA MET 1 0.688 -0.878 -0.936
3 HB2 MET 1 2HB MET 1 0.393 0.296 -3.521
4 HB3 MET 1 3HB MET 1 1.188 -1.261 -3.710
5 HG2 MET 1 2HG MET 1 -0.646 -2.419 -3.131
6 HG3 MET 1 3HG MET 1 -1.126 -1.250 -1.904
7 HE1 MET 1 3HE MET 1 -4.172 0.123 -3.421
8 HE2 MET 1 1HE MET 1 -3.605 -1.118 -2.302
9 HE3 MET 1 2HE MET 1 -2.944 0.515 -2.217
10 H LYS 2 H LYS 2 1.800 -2.850 -1.072
11 HA LYS 2 HA LYS 2 4.639 -2.629 -0.878
12 HB2 LYS 2 2HB LYS 2 2.638 -4.530 -0.168
13 HB3 LYS 2 3HB LYS 2 3.850 -5.356 -1.138
14 HG2 LYS 2 2HG LYS 2 5.199 -3.708 0.737
15 HG3 LYS 2 3HG LYS 2 3.966 -4.634 1.596
16 HD2 LYS 2 2HD LYS 2 4.851 -6.680 0.408
17 HD3 LYS 2 3HD LYS 2 6.205 -5.681 -0.127
18 HE2 LYS 2 2HE LYS 2 5.691 -5.460 2.730
19 HE3 LYS 2 3HE LYS 2 6.060 -7.109 2.229
20 HZ1 LYS 2 3HZ LYS 2 8.170 -6.572 1.700
21 HZ2 LYS 2 1HZ LYS 2 7.923 -5.321 2.813
22 HZ3 LYS 2 2HZ LYS 2 7.776 -5.020 1.155
23 H THR 3 H THR 3 2.407 -3.956 -3.274
24 HA THR 3 HA THR 3 4.647 -4.643 -5.025
25 HB THR 3 HB THR 3 2.801 -6.286 -4.724
26 HG1 THR 3 HG1 THR 3 3.080 -5.232 -7.360
27 HG21 THR 3 1HG2 THR 3 1.184 -4.004 -5.215
28 HG22 THR 3 2HG2 THR 3 0.671 -5.651 -4.845
29 HG23 THR 3 3HG2 THR 3 0.904 -5.155 -6.522
30 H ILE 4 H ILE 4 4.078 -1.871 -4.505
31 HA ILE 4 HA ILE 4 2.624 -0.734 -6.672
32 HB ILE 4 HB ILE 4 3.097 0.417 -4.487
33 HG12 ILE 4 2HG1 ILE 4 3.975 1.953 -6.940
34 HG13 ILE 4 3HG1 ILE 4 2.299 1.585 -6.550
35 HG21 ILE 4 1HG2 ILE 4 5.192 1.447 -4.080
36 HG22 ILE 4 2HG2 ILE 4 5.528 -0.236 -4.486
37 HG23 ILE 4 3HG2 ILE 4 5.786 1.030 -5.686
38 HD11 ILE 4 3HD1 ILE 4 4.127 3.576 -5.384
39 HD12 ILE 4 1HD1 ILE 4 2.384 3.641 -5.644
40 HD13 ILE 4 2HD1 ILE 4 3.038 2.760 -4.263
41 H LEU 5 H LEU 5 5.645 -2.203 -6.500
42 HA LEU 5 HA LEU 5 7.290 -0.726 -8.149
43 HB2 LEU 5 2HB LEU 5 8.535 -2.670 -8.496
44 HB3 LEU 5 3HB LEU 5 7.778 -2.897 -6.920
45 HG LEU 5 HG LEU 5 5.971 -4.162 -8.414
46 HD11 LEU 5 1HD1 LEU 5 8.278 -5.195 -9.878
47 HD12 LEU 5 2HD1 LEU 5 7.806 -3.562 -10.345
48 HD13 LEU 5 3HD1 LEU 5 6.633 -4.877 -10.426
49 HD21 LEU 5 3HD2 LEU 5 8.589 -5.225 -7.376
50 HD22 LEU 5 1HD2 LEU 5 7.280 -6.258 -7.951
51 HD23 LEU 5 2HD2 LEU 5 7.024 -5.203 -6.560
52 H ARG 6 H ARG 6 4.598 -2.812 -9.006
53 HA ARG 6 HA ARG 6 5.103 -2.783 -11.815
54 HB2 ARG 6 2HB ARG 6 3.005 -3.889 -12.049
55 HB3 ARG 6 3HB ARG 6 3.754 -4.520 -10.588
56 HG2 ARG 6 2HG ARG 6 1.707 -4.167 -9.727
57 HG3 ARG 6 3HG ARG 6 2.311 -2.520 -9.528
58 HD2 ARG 6 2HD ARG 6 0.278 -2.166 -10.566
59 HD3 ARG 6 3HD ARG 6 1.392 -2.174 -11.934
60 HE ARG 6 HE ARG 6 0.578 -4.765 -11.716
61 HH11 ARG 6 1HH1 ARG 6 -1.050 -1.706 -12.044
62 HH12 ARG 6 2HH1 ARG 6 -2.402 -2.369 -12.900
63 HH21 ARG 6 1HH2 ARG 6 -1.197 -5.651 -12.841
64 HH22 ARG 6 2HH2 ARG 6 -2.487 -4.613 -13.352
65 H PHE 7 H PHE 7 3.291 -0.771 -9.600
66 HA PHE 7 HA PHE 7 1.886 0.670 -11.640
67 HB2 PHE 7 2HB PHE 7 0.880 0.560 -9.466
68 HB3 PHE 7 3HB PHE 7 2.328 1.204 -8.700
69 HD1 PHE 7 HD1 PHE 7 0.055 2.215 -11.487
70 HD2 PHE 7 HD2 PHE 7 2.130 3.353 -7.949
71 HE1 PHE 7 HE1 PHE 7 -0.858 4.491 -11.687
72 HE2 PHE 7 HE2 PHE 7 1.220 5.630 -8.144
73 HZ PHE 7 HZ PHE 7 -0.277 6.202 -10.015
74 H VAL 8 H VAL 8 4.602 1.470 -9.479
75 HA VAL 8 HA VAL 8 5.130 4.001 -10.600
76 HB VAL 8 HB VAL 8 7.011 2.145 -9.135
77 HG11 VAL 8 1HG1 VAL 8 8.230 3.827 -10.406
78 HG12 VAL 8 2HG1 VAL 8 7.237 5.101 -9.696
79 HG13 VAL 8 3HG1 VAL 8 8.328 4.160 -8.677
80 HG21 VAL 8 3HG2 VAL 8 6.241 4.332 -7.542
81 HG22 VAL 8 1HG2 VAL 8 4.764 3.695 -8.266
82 HG23 VAL 8 2HG2 VAL 8 5.815 2.634 -7.327
83 H ALA 9 H ALA 9 6.183 0.768 -11.442
84 HA ALA 9 HA ALA 9 8.371 1.276 -13.045
85 HB1 ALA 9 3HB ALA 9 6.214 -0.805 -13.256
86 HB2 ALA 9 1HB ALA 9 7.601 -0.770 -14.346
87 HB3 ALA 9 2HB ALA 9 7.846 -0.973 -12.610
88 H GLY 10 H GLY 10 4.941 1.235 -14.020
89 HA2 GLY 10 2HA GLY 10 5.489 2.016 -16.710
90 HA3 GLY 10 3HA GLY 10 3.912 2.004 -15.932
91 H TYR 11 H TYR 11 4.895 3.760 -13.750
92 HA TYR 11 HA TYR 11 4.242 6.249 -14.982
93 HB2 TYR 11 2HB TYR 11 3.731 5.483 -12.579
94 HB3 TYR 11 3HB TYR 11 5.388 5.951 -12.213
95 HD1 TYR 11 HD1 TYR 11 6.044 8.389 -12.971
96 HD2 TYR 11 HD2 TYR 11 2.054 7.056 -12.333
97 HE1 TYR 11 HE1 TYR 11 5.322 10.719 -12.657
98 HE2 TYR 11 HE2 TYR 11 1.321 9.384 -12.018
99 HH TYR 11 HH TYR 11 2.729 11.904 -12.998
100 H ASP 12 H ASP 12 7.205 4.704 -13.930
101 HA ASP 12 HA ASP 12 8.890 6.962 -14.025
102 HB2 ASP 12 2HB ASP 12 9.333 4.600 -13.050
103 HB3 ASP 12 3HB ASP 12 9.835 4.185 -14.687
104 H ILE 13 H ILE 13 7.667 4.823 -16.492
105 HA ILE 13 HA ILE 13 9.477 5.876 -18.509
106 HB ILE 13 HB ILE 13 7.193 3.918 -18.785
107 HG12 ILE 13 2HG1 ILE 13 9.859 2.878 -19.236
108 HG13 ILE 13 3HG1 ILE 13 9.721 3.576 -17.625
109 HG21 ILE 13 1HG2 ILE 13 8.170 3.407 -20.973
110 HG22 ILE 13 2HG2 ILE 13 7.645 5.086 -20.869
111 HG23 ILE 13 3HG2 ILE 13 9.358 4.688 -20.738
112 HD11 ILE 13 3HD1 ILE 13 7.419 2.101 -17.856
113 HD12 ILE 13 1HD1 ILE 13 8.616 1.115 -18.697
114 HD13 ILE 13 2HD1 ILE 13 8.894 1.604 -17.025
115 H ALA 14 H ALA 14 6.000 5.889 -17.794
116 HA ALA 14 HA ALA 14 5.204 7.438 -20.004
117 HB1 ALA 14 3HB ALA 14 3.116 7.681 -18.917
118 HB2 ALA 14 1HB ALA 14 3.721 6.084 -18.477
119 HB3 ALA 14 2HB ALA 14 3.832 7.417 -17.327
120 H SER 15 H SER 15 6.314 8.325 -16.777
121 HA SER 15 HA SER 15 5.733 11.103 -17.041
122 HB2 SER 15 2HB SER 15 6.895 11.382 -14.972
123 HB3 SER 15 3HB SER 15 6.046 9.841 -14.863
124 HG SER 15 HG SER 15 8.210 9.031 -15.750
125 H HIS 16 H HIS 16 8.410 9.067 -17.922
126 HA HIS 16 HA HIS 16 10.215 11.283 -18.377
127 HB2 HIS 16 2HB HIS 16 10.389 8.349 -18.373
128 HB3 HIS 16 3HB HIS 16 11.372 9.126 -19.610
129 HD1 HIS 16 HD1 HIS 16 13.646 8.814 -18.588
130 HD2 HIS 16 HD2 HIS 16 10.933 10.545 -15.960
131 HE1 HIS 16 HE1 HIS 16 15.001 9.524 -16.593
132 H LYS 17 H LYS 17 8.040 9.265 -20.219
133 HA LYS 17 HA LYS 17 9.029 10.082 -22.786
134 HB2 LYS 17 2HB LYS 17 7.160 8.169 -21.776
135 HB3 LYS 17 3HB LYS 17 6.352 9.151 -22.992
136 HG2 LYS 17 2HG LYS 17 7.798 8.480 -24.678
137 HG3 LYS 17 3HG LYS 17 9.037 7.953 -23.538
138 HD2 LYS 17 2HD LYS 17 7.351 6.194 -22.780
139 HD3 LYS 17 3HD LYS 17 6.440 6.607 -24.234
140 HE2 LYS 17 2HE LYS 17 8.415 6.075 -25.598
141 HE3 LYS 17 3HE LYS 17 9.291 5.625 -24.136
142 HZ1 LYS 17 3HZ LYS 17 7.516 4.068 -25.681
143 HZ2 LYS 17 1HZ LYS 17 6.912 4.206 -24.107
144 HZ3 LYS 17 2HZ LYS 17 8.469 3.597 -24.365
145 H LYS 18 H LYS 18 5.976 10.718 -21.051
146 HA LYS 18 HA LYS 18 5.342 12.906 -22.827
147 HB2 LYS 18 2HB LYS 18 3.980 11.646 -20.463
148 HB3 LYS 18 3HB LYS 18 3.409 13.174 -21.119
149 HG2 LYS 18 2HG LYS 18 3.212 12.035 -23.345
150 HG3 LYS 18 3HG LYS 18 3.545 10.514 -22.512
151 HD2 LYS 18 2HD LYS 18 1.565 10.669 -21.233
152 HD3 LYS 18 3HD LYS 18 1.324 12.362 -21.671
153 HE2 LYS 18 2HE LYS 18 1.095 11.553 -24.066
154 HE3 LYS 18 3HE LYS 18 0.999 9.924 -23.403
155 HZ1 LYS 18 3HZ LYS 18 -1.168 11.165 -23.833
156 HZ2 LYS 18 1HZ LYS 18 -0.794 12.070 -22.453
157 HZ3 LYS 18 2HZ LYS 18 -0.998 10.395 -22.337
158 H LYS 19 H LYS 19 5.896 12.601 -19.316
159 HA LYS 19 HA LYS 19 6.566 14.110 -17.748
160 HB2 LYS 19 2HB LYS 19 8.614 13.916 -19.209
161 HB3 LYS 19 3HB LYS 19 8.093 15.387 -20.019
162 HG2 LYS 19 2HG LYS 19 8.075 16.408 -17.646
163 HG3 LYS 19 3HG LYS 19 9.081 15.021 -17.222
164 HD2 LYS 19 2HD LYS 19 10.852 16.110 -18.008
165 HD3 LYS 19 3HD LYS 19 10.125 16.082 -19.617
166 HE2 LYS 19 2HE LYS 19 8.987 18.174 -19.167
167 HE3 LYS 19 3HE LYS 19 9.611 18.188 -17.519
168 HZ1 LYS 19 3HZ LYS 19 10.790 19.542 -19.379
169 HZ2 LYS 19 1HZ LYS 19 11.503 18.057 -19.762
170 HZ3 LYS 19 2HZ LYS 19 11.710 18.722 -18.221
171 H THR 20 H THR 20 4.492 15.029 -17.464
172 HA THR 20 HA THR 20 4.379 17.835 -18.244
173 HB THR 20 HB THR 20 3.082 16.928 -20.017
174 HG1 THR 20 HG1 THR 20 1.080 17.574 -18.126
175 HG21 THR 20 1HG2 THR 20 1.766 15.245 -17.892
176 HG22 THR 20 2HG2 THR 20 2.675 14.699 -19.299
177 HG23 THR 20 3HG2 THR 20 1.094 15.450 -19.508
178 H GLY 21 H GLY 21 2.898 19.090 -16.961
179 HA2 GLY 21 2HA GLY 21 1.123 18.678 -15.115
180 HA3 GLY 21 3HA GLY 21 2.468 17.872 -14.321
181 H GLY 22 H GLY 22 1.897 20.968 -16.011
182 HA2 GLY 22 2HA GLY 22 3.841 22.381 -14.515
183 HA3 GLY 22 3HA GLY 22 2.569 23.102 -15.490
184 H TYR 23 H TYR 23 0.816 23.970 -14.508
185 HA TYR 23 HA TYR 23 0.957 24.582 -11.762
186 HB2 TYR 23 2HB TYR 23 -1.068 24.984 -13.919
187 HB3 TYR 23 3HB TYR 23 -1.562 25.236 -12.248
188 HD1 TYR 23 HD1 TYR 23 0.614 26.537 -10.962
189 HD2 TYR 23 HD2 TYR 23 -0.737 27.009 -14.969
190 HE1 TYR 23 HE1 TYR 23 1.578 28.799 -11.015
191 HE2 TYR 23 HE2 TYR 23 0.224 29.272 -15.033
192 HH TYR 23 HH TYR 23 1.920 30.628 -12.219
193 HA PRO 24 HA PRO 24 -1.092 21.283 -9.722
194 HB2 PRO 24 2HB PRO 24 -2.578 22.585 -7.860
195 HB3 PRO 24 3HB PRO 24 -0.817 22.453 -7.763
196 HG2 PRO 24 2HG PRO 24 -2.496 24.732 -8.736
197 HG3 PRO 24 3HG PRO 24 -1.055 24.765 -7.704
198 HD2 PRO 24 2HD PRO 24 -0.964 25.332 -10.350
199 HD3 PRO 24 3HD PRO 24 0.385 24.560 -9.492
200 H TRP 25 H TRP 25 -3.095 23.879 -10.971
201 HA TRP 25 HA TRP 25 -5.449 22.133 -10.939
202 HB2 TRP 25 2HB TRP 25 -6.644 24.249 -11.673
203 HB3 TRP 25 3HB TRP 25 -5.943 24.284 -10.058
204 HD1 TRP 25 HD1 TRP 25 -4.288 26.203 -9.540
205 HE1 TRP 25 HE1 TRP 25 -3.226 28.103 -10.913
206 HE3 TRP 25 HE3 TRP 25 -5.758 24.744 -14.214
207 HZ2 TRP 25 HZ2 TRP 25 -3.038 28.881 -13.621
208 HZ3 TRP 25 HZ3 TRP 25 -5.095 26.122 -16.142
209 HH2 TRP 25 HH2 TRP 25 -3.765 28.147 -15.849
210 H GLU 26 H GLU 26 -3.016 23.312 -13.017
211 HA GLU 26 HA GLU 26 -4.600 22.825 -15.425
212 HB2 GLU 26 2HB GLU 26 -2.800 24.760 -14.923
213 HB3 GLU 26 3HB GLU 26 -1.733 23.554 -15.628
214 HG2 GLU 26 2HG GLU 26 -4.165 23.911 -17.168
215 HG3 GLU 26 3HG GLU 26 -3.246 25.405 -16.995
216 H ARG 27 H ARG 27 -3.717 20.683 -13.568
217 HA ARG 27 HA ARG 27 -2.102 19.111 -15.466
218 HB2 ARG 27 2HB ARG 27 -1.281 17.817 -13.552
219 HB3 ARG 27 3HB ARG 27 -0.890 19.524 -13.386
220 HG2 ARG 27 2HG ARG 27 -1.807 19.489 -11.375
221 HG3 ARG 27 3HG ARG 27 -3.371 19.169 -12.127
222 HD2 ARG 27 2HD ARG 27 -3.139 16.845 -11.871
223 HD3 ARG 27 3HD ARG 27 -1.409 16.970 -11.552
224 HE ARG 27 HE ARG 27 -3.534 17.226 -9.654
225 HH11 ARG 27 1HH1 ARG 27 -0.283 18.215 -10.407
226 HH12 ARG 27 2HH1 ARG 27 0.148 18.517 -8.756
227 HH21 ARG 27 1HH2 ARG 27 -2.981 17.620 -7.476
228 HH22 ARG 27 2HH2 ARG 27 -1.387 18.178 -7.090
229 H GLY 28 H GLY 28 -5.041 19.466 -15.314
230 HA2 GLY 28 2HA GLY 28 -5.825 16.697 -14.654
231 HA3 GLY 28 3HA GLY 28 -6.920 18.071 -14.641
232 H LYS 29 H LYS 29 -4.614 17.779 -17.205
233 HA LYS 29 HA LYS 29 -4.881 17.572 -19.458
234 HB2 LYS 29 2HB LYS 29 -6.495 15.324 -18.321
235 HB3 LYS 29 3HB LYS 29 -6.541 15.618 -20.055
236 HG2 LYS 29 2HG LYS 29 -4.077 15.423 -20.113
237 HG3 LYS 29 3HG LYS 29 -4.101 15.017 -18.395
238 HD2 LYS 29 2HD LYS 29 -4.365 12.888 -18.985
239 HD3 LYS 29 3HD LYS 29 -5.973 13.314 -19.574
240 HE2 LYS 29 2HE LYS 29 -5.025 13.827 -21.772
241 HE3 LYS 29 3HE LYS 29 -3.420 13.402 -21.182
242 HZ1 LYS 29 3HZ LYS 29 -5.696 11.654 -21.796
243 HZ2 LYS 29 1HZ LYS 29 -4.600 11.170 -20.602
244 HZ3 LYS 29 2HZ LYS 29 -4.060 11.462 -22.177
245 H ALA 30 H ALA 30 -5.959 19.740 -19.264
246 HA ALA 30 HA ALA 30 -8.764 19.566 -20.154
247 HB1 ALA 30 3HB ALA 30 -7.981 22.179 -19.168
248 HB2 ALA 30 1HB ALA 30 -9.358 21.168 -18.726
249 HB3 ALA 30 2HB ALA 30 -7.794 20.919 -17.948
Start of MODEL 20
1 H1 MET 1 H MET 1 0.322 0.407 0.083
2 HA MET 1 HA MET 1 0.580 -1.432 -1.315
3 HB2 MET 1 2HB MET 1 1.794 0.827 -2.918
4 HB3 MET 1 3HB MET 1 1.120 -0.657 -3.582
5 HG2 MET 1 2HG MET 1 -0.893 0.419 -1.974
6 HG3 MET 1 3HG MET 1 -0.198 1.784 -2.845
7 HE1 MET 1 3HE MET 1 -3.157 -0.196 -2.967
8 HE2 MET 1 1HE MET 1 -3.039 1.509 -3.404
9 HE3 MET 1 2HE MET 1 -3.610 0.332 -4.588
10 H LYS 2 H LYS 2 1.910 -3.105 -1.194
11 HA LYS 2 HA LYS 2 4.772 -2.691 -0.926
12 HB2 LYS 2 2HB LYS 2 3.013 -5.133 -0.715
13 HB3 LYS 2 3HB LYS 2 4.768 -5.214 -0.624
14 HG2 LYS 2 2HG LYS 2 4.465 -3.420 1.248
15 HG3 LYS 2 3HG LYS 2 2.820 -4.057 1.311
16 HD2 LYS 2 2HD LYS 2 5.154 -5.928 1.365
17 HD3 LYS 2 3HD LYS 2 4.667 -5.083 2.836
18 HE2 LYS 2 2HE LYS 2 2.460 -6.323 1.354
19 HE3 LYS 2 3HE LYS 2 3.648 -7.465 1.984
20 HZ1 LYS 2 3HZ LYS 2 2.674 -7.269 3.947
21 HZ2 LYS 2 1HZ LYS 2 1.627 -6.070 3.374
22 HZ3 LYS 2 2HZ LYS 2 3.135 -5.643 4.010
23 H THR 3 H THR 3 2.475 -3.826 -3.282
24 HA THR 3 HA THR 3 4.652 -4.676 -5.060
25 HB THR 3 HB THR 3 2.771 -6.269 -4.695
26 HG1 THR 3 HG1 THR 3 3.822 -6.562 -6.607
27 HG21 THR 3 1HG2 THR 3 0.651 -5.594 -4.796
28 HG22 THR 3 2HG2 THR 3 0.873 -5.085 -6.470
29 HG23 THR 3 3HG2 THR 3 1.202 -3.958 -5.154
30 H ILE 4 H ILE 4 4.050 -1.874 -4.499
31 HA ILE 4 HA ILE 4 2.615 -0.738 -6.671
32 HB ILE 4 HB ILE 4 3.087 0.411 -4.485
33 HG12 ILE 4 2HG1 ILE 4 3.965 1.949 -6.938
34 HG13 ILE 4 3HG1 ILE 4 2.289 1.581 -6.547
35 HG21 ILE 4 1HG2 ILE 4 5.520 -0.241 -4.487
36 HG22 ILE 4 2HG2 ILE 4 5.776 1.027 -5.686
37 HG23 ILE 4 3HG2 ILE 4 5.183 1.441 -4.076
38 HD11 ILE 4 3HD1 ILE 4 3.861 3.767 -5.696
39 HD12 ILE 4 1HD1 ILE 4 2.181 3.403 -5.308
40 HD13 ILE 4 2HD1 ILE 4 3.476 2.793 -4.277
41 H LEU 5 H LEU 5 5.637 -2.206 -6.500
42 HA LEU 5 HA LEU 5 7.281 -0.726 -8.148
43 HB2 LEU 5 2HB LEU 5 8.528 -2.669 -8.496
44 HB3 LEU 5 3HB LEU 5 7.771 -2.898 -6.921
45 HG LEU 5 HG LEU 5 5.964 -4.163 -8.415
46 HD11 LEU 5 1HD1 LEU 5 6.590 -4.549 -10.504
47 HD12 LEU 5 2HD1 LEU 5 8.013 -5.408 -9.913
48 HD13 LEU 5 3HD1 LEU 5 8.099 -3.676 -10.234
49 HD21 LEU 5 3HD2 LEU 5 7.173 -6.253 -7.892
50 HD22 LEU 5 1HD2 LEU 5 7.112 -5.136 -6.528
51 HD23 LEU 5 2HD2 LEU 5 8.595 -5.297 -7.470
52 H ARG 6 H ARG 6 4.589 -2.814 -9.006
53 HA ARG 6 HA ARG 6 5.094 -2.784 -11.815
54 HB2 ARG 6 2HB ARG 6 2.974 -3.870 -12.046
55 HB3 ARG 6 3HB ARG 6 3.756 -4.532 -10.616
56 HG2 ARG 6 2HG ARG 6 1.708 -4.205 -9.733
57 HG3 ARG 6 3HG ARG 6 2.347 -2.582 -9.459
58 HD2 ARG 6 2HD ARG 6 0.478 -1.929 -10.527
59 HD3 ARG 6 3HD ARG 6 1.396 -2.330 -11.978
60 HE ARG 6 HE ARG 6 0.133 -4.657 -11.157
61 HH11 ARG 6 1HH1 ARG 6 -0.769 -1.478 -12.254
62 HH12 ARG 6 2HH1 ARG 6 -2.259 -2.003 -12.965
63 HH21 ARG 6 1HH2 ARG 6 -1.825 -5.361 -12.091
64 HH22 ARG 6 2HH2 ARG 6 -2.859 -4.212 -12.871
65 H PHE 7 H PHE 7 3.282 -0.774 -9.599
66 HA PHE 7 HA PHE 7 1.876 0.667 -11.638
67 HB2 PHE 7 2HB PHE 7 0.870 0.556 -9.465
68 HB3 PHE 7 3HB PHE 7 2.318 1.201 -8.699
69 HD1 PHE 7 HD1 PHE 7 0.046 2.212 -11.486
70 HD2 PHE 7 HD2 PHE 7 2.117 3.348 -7.946
71 HE1 PHE 7 HE1 PHE 7 -0.868 4.487 -11.687
72 HE2 PHE 7 HE2 PHE 7 1.206 5.625 -8.140
73 HZ PHE 7 HZ PHE 7 -0.290 6.197 -10.011
74 H VAL 8 H VAL 8 4.591 1.470 -9.476
75 HA VAL 8 HA VAL 8 5.118 4.001 -10.597
76 HB VAL 8 HB VAL 8 7.001 2.146 -9.133
77 HG11 VAL 8 1HG1 VAL 8 7.223 5.101 -9.694
78 HG12 VAL 8 2HG1 VAL 8 8.315 4.163 -8.673
79 HG13 VAL 8 3HG1 VAL 8 8.217 3.829 -10.402
80 HG21 VAL 8 3HG2 VAL 8 6.229 4.330 -7.539
81 HG22 VAL 8 1HG2 VAL 8 4.752 3.692 -8.263
82 HG23 VAL 8 2HG2 VAL 8 5.804 2.632 -7.324
83 H ALA 9 H ALA 9 6.173 0.769 -11.440
84 HA ALA 9 HA ALA 9 8.360 1.279 -13.042
85 HB1 ALA 9 3HB ALA 9 7.821 -0.971 -12.595
86 HB2 ALA 9 1HB ALA 9 6.201 -0.800 -13.275
87 HB3 ALA 9 2HB ALA 9 7.612 -0.769 -14.335
88 H GLY 10 H GLY 10 4.931 1.238 -14.016
89 HA2 GLY 10 2HA GLY 10 5.475 2.020 -16.706
90 HA3 GLY 10 3HA GLY 10 3.901 2.008 -15.927
91 H TYR 11 H TYR 11 4.886 3.764 -13.746
92 HA TYR 11 HA TYR 11 4.235 6.252 -14.981
93 HB2 TYR 11 2HB TYR 11 3.711 5.492 -12.581
94 HB3 TYR 11 3HB TYR 11 5.371 5.947 -12.208
95 HD1 TYR 11 HD1 TYR 11 6.043 8.384 -12.983
96 HD2 TYR 11 HD2 TYR 11 2.049 7.076 -12.314
97 HE1 TYR 11 HE1 TYR 11 5.337 10.719 -12.669
98 HE2 TYR 11 HE2 TYR 11 1.332 9.407 -11.999
99 HH TYR 11 HH TYR 11 3.666 12.065 -12.013
100 H ASP 12 H ASP 12 7.194 4.709 -13.911
101 HA ASP 12 HA ASP 12 8.880 6.963 -14.003
102 HB2 ASP 12 2HB ASP 12 9.309 4.584 -13.041
103 HB3 ASP 12 3HB ASP 12 9.843 4.198 -14.674
104 H ILE 13 H ILE 13 7.671 4.821 -16.475
105 HA ILE 13 HA ILE 13 9.487 5.872 -18.486
106 HB ILE 13 HB ILE 13 7.196 3.923 -18.770
107 HG12 ILE 13 2HG1 ILE 13 9.866 2.882 -19.211
108 HG13 ILE 13 3HG1 ILE 13 9.713 3.568 -17.598
109 HG21 ILE 13 1HG2 ILE 13 8.857 3.486 -20.880
110 HG22 ILE 13 2HG2 ILE 13 7.392 4.465 -20.938
111 HG23 ILE 13 3HG2 ILE 13 8.960 5.237 -20.706
112 HD11 ILE 13 3HD1 ILE 13 8.603 1.121 -18.705
113 HD12 ILE 13 1HD1 ILE 13 8.894 1.582 -17.028
114 HD13 ILE 13 2HD1 ILE 13 7.417 2.099 -17.842
115 H ALA 14 H ALA 14 5.996 5.869 -17.821
116 HA ALA 14 HA ALA 14 5.220 7.432 -20.018
117 HB1 ALA 14 3HB ALA 14 3.892 7.238 -17.318
118 HB2 ALA 14 1HB ALA 14 3.146 7.810 -18.809
119 HB3 ALA 14 2HB ALA 14 3.648 6.126 -18.665
120 H SER 15 H SER 15 6.343 8.312 -16.799
121 HA SER 15 HA SER 15 5.756 11.091 -17.050
122 HB2 SER 15 2HB SER 15 6.067 9.846 -14.874
123 HB3 SER 15 3HB SER 15 7.797 9.827 -15.212
124 HG SER 15 HG SER 15 6.206 12.172 -15.043
125 H HIS 16 H HIS 16 8.420 9.058 -17.962
126 HA HIS 16 HA HIS 16 10.238 11.263 -18.402
127 HB2 HIS 16 2HB HIS 16 11.091 9.066 -17.690
128 HB3 HIS 16 3HB HIS 16 10.478 8.347 -19.175
129 HD1 HIS 16 HD1 HIS 16 11.829 8.728 -21.320
130 HD2 HIS 16 HD2 HIS 16 13.417 10.631 -17.987
131 HE1 HIS 16 HE1 HIS 16 14.125 9.485 -22.010
132 H LYS 17 H LYS 17 8.048 9.278 -20.271
133 HA LYS 17 HA LYS 17 9.011 10.166 -22.825
134 HB2 LYS 17 2HB LYS 17 7.837 7.977 -22.403
135 HB3 LYS 17 3HB LYS 17 6.347 8.889 -22.197
136 HG2 LYS 17 2HG LYS 17 6.195 9.413 -24.423
137 HG3 LYS 17 3HG LYS 17 7.933 9.266 -24.689
138 HD2 LYS 17 2HD LYS 17 6.315 6.860 -23.951
139 HD3 LYS 17 3HD LYS 17 6.333 7.439 -25.618
140 HE2 LYS 17 2HE LYS 17 8.900 7.019 -24.141
141 HE3 LYS 17 3HE LYS 17 8.055 5.646 -24.854
142 HZ1 LYS 17 3HZ LYS 17 9.798 6.782 -26.268
143 HZ2 LYS 17 1HZ LYS 17 8.708 8.066 -26.424
144 HZ3 LYS 17 2HZ LYS 17 8.290 6.529 -26.992
145 H LYS 18 H LYS 18 5.937 10.704 -21.093
146 HA LYS 18 HA LYS 18 5.239 12.906 -22.804
147 HB2 LYS 18 2HB LYS 18 3.992 11.676 -20.358
148 HB3 LYS 18 3HB LYS 18 3.364 13.165 -21.054
149 HG2 LYS 18 2HG LYS 18 3.746 11.052 -23.022
150 HG3 LYS 18 3HG LYS 18 2.606 10.626 -21.743
151 HD2 LYS 18 2HD LYS 18 1.722 13.082 -22.255
152 HD3 LYS 18 3HD LYS 18 2.431 12.730 -23.832
153 HE2 LYS 18 2HE LYS 18 0.344 11.891 -24.182
154 HE3 LYS 18 3HE LYS 18 1.106 10.456 -23.497
155 HZ1 LYS 18 3HZ LYS 18 -0.951 10.755 -22.399
156 HZ2 LYS 18 1HZ LYS 18 -0.656 12.397 -22.113
157 HZ3 LYS 18 2HZ LYS 18 0.245 11.221 -21.296
158 H LYS 19 H LYS 19 5.910 12.631 -19.310
159 HA LYS 19 HA LYS 19 6.766 14.105 -17.805
160 HB2 LYS 19 2HB LYS 19 8.498 14.199 -19.790
161 HB3 LYS 19 3HB LYS 19 7.854 15.822 -20.000
162 HG2 LYS 19 2HG LYS 19 8.720 16.575 -18.019
163 HG3 LYS 19 3HG LYS 19 8.727 14.970 -17.286
164 HD2 LYS 19 2HD LYS 19 10.989 15.456 -17.673
165 HD3 LYS 19 3HD LYS 19 10.531 14.388 -19.000
166 HE2 LYS 19 2HE LYS 19 10.021 17.128 -19.703
167 HE3 LYS 19 3HE LYS 19 11.690 16.937 -19.167
168 HZ1 LYS 19 3HZ LYS 19 12.112 16.173 -21.192
169 HZ2 LYS 19 1HZ LYS 19 10.471 16.088 -21.595
170 HZ3 LYS 19 2HZ LYS 19 11.217 14.790 -20.808
171 H THR 20 H THR 20 4.795 14.900 -17.088
172 HA THR 20 HA THR 20 4.365 17.685 -17.475
173 HB THR 20 HB THR 20 3.252 17.140 -19.500
174 HG1 THR 20 HG1 THR 20 2.049 18.576 -18.218
175 HG21 THR 20 1HG2 THR 20 2.460 14.745 -18.029
176 HG22 THR 20 2HG2 THR 20 2.643 14.997 -19.765
177 HG23 THR 20 3HG2 THR 20 1.142 15.455 -18.961
178 H GLY 21 H GLY 21 2.811 18.559 -16.020
179 HA2 GLY 21 2HA GLY 21 1.338 16.794 -14.269
180 HA3 GLY 21 3HA GLY 21 2.714 17.574 -13.501
181 H GLY 22 H GLY 22 2.707 19.842 -13.224
182 HA2 GLY 22 2HA GLY 22 0.265 21.283 -13.918
183 HA3 GLY 22 3HA GLY 22 0.599 21.085 -12.204
184 H TYR 23 H TYR 23 1.594 22.738 -11.286
185 HA TYR 23 HA TYR 23 2.534 24.967 -12.679
186 HB2 TYR 23 2HB TYR 23 2.767 24.004 -9.862
187 HB3 TYR 23 3HB TYR 23 3.775 25.353 -10.373
188 HD1 TYR 23 HD1 TYR 23 2.147 26.975 -12.048
189 HD2 TYR 23 HD2 TYR 23 0.994 24.764 -8.600
190 HE1 TYR 23 HE1 TYR 23 0.267 28.520 -11.694
191 HE2 TYR 23 HE2 TYR 23 -0.891 26.302 -8.238
192 HH TYR 23 HH TYR 23 -1.239 29.013 -9.076
193 HA PRO 24 HA PRO 24 6.659 24.085 -13.880
194 HB2 PRO 24 2HB PRO 24 7.932 26.425 -13.356
195 HB3 PRO 24 3HB PRO 24 6.782 26.232 -14.685
196 HG2 PRO 24 2HG PRO 24 6.356 27.416 -11.969
197 HG3 PRO 24 3HG PRO 24 5.791 28.000 -13.546
198 HD2 PRO 24 2HD PRO 24 4.190 26.640 -11.837
199 HD3 PRO 24 3HD PRO 24 4.023 26.522 -13.601
200 H TRP 25 H TRP 25 6.168 25.335 -10.641
201 HA TRP 25 HA TRP 25 8.773 24.292 -9.795
202 HB2 TRP 25 2HB TRP 25 8.186 25.459 -7.618
203 HB3 TRP 25 3HB TRP 25 8.425 26.507 -9.013
204 HD1 TRP 25 HD1 TRP 25 6.489 28.110 -9.626
205 HE1 TRP 25 HE1 TRP 25 4.101 28.489 -8.741
206 HE3 TRP 25 HE3 TRP 25 6.107 24.042 -6.552
207 HZ2 TRP 25 HZ2 TRP 25 2.296 27.231 -6.974
208 HZ3 TRP 25 HZ3 TRP 25 4.017 23.703 -5.299
209 HH2 TRP 25 HH2 TRP 25 2.152 25.266 -5.507
210 H GLU 26 H GLU 26 5.441 23.546 -9.759
211 HA GLU 26 HA GLU 26 5.691 21.722 -7.493
212 HB2 GLU 26 2HB GLU 26 3.638 23.293 -8.177
213 HB3 GLU 26 3HB GLU 26 3.192 21.864 -9.099
214 HG2 GLU 26 2HG GLU 26 3.205 20.521 -7.087
215 HG3 GLU 26 3HG GLU 26 3.743 21.908 -6.141
216 H ARG 27 H ARG 27 7.292 21.040 -9.653
217 HA ARG 27 HA ARG 27 5.909 18.679 -10.747
218 HB2 ARG 27 2HB ARG 27 7.550 18.773 -12.610
219 HB3 ARG 27 3HB ARG 27 6.506 20.186 -12.534
220 HG2 ARG 27 2HG ARG 27 8.284 21.497 -12.492
221 HG3 ARG 27 3HG ARG 27 8.812 20.740 -10.989
222 HD2 ARG 27 2HD ARG 27 10.611 20.152 -12.207
223 HD3 ARG 27 3HD ARG 27 9.557 18.859 -12.780
224 HE ARG 27 HE ARG 27 9.341 21.247 -14.344
225 HH11 ARG 27 1HH1 ARG 27 11.191 18.340 -13.848
226 HH12 ARG 27 2HH1 ARG 27 11.792 18.291 -15.472
227 HH21 ARG 27 1HH2 ARG 27 10.125 21.193 -16.486
228 HH22 ARG 27 2HH2 ARG 27 11.186 19.914 -16.971
229 H GLY 28 H GLY 28 7.306 18.932 -8.175
230 HA2 GLY 28 2HA GLY 28 9.764 17.409 -8.557
231 HA3 GLY 28 3HA GLY 28 9.158 18.046 -7.034
232 H LYS 29 H LYS 29 7.404 16.920 -5.987
233 HA LYS 29 HA LYS 29 7.679 14.056 -6.273
234 HB2 LYS 29 2HB LYS 29 7.264 15.722 -4.127
235 HB3 LYS 29 3HB LYS 29 5.664 15.038 -4.382
236 HG2 LYS 29 2HG LYS 29 6.396 13.372 -3.090
237 HG3 LYS 29 3HG LYS 29 7.232 12.820 -4.544
238 HD2 LYS 29 2HD LYS 29 9.085 12.923 -3.287
239 HD3 LYS 29 3HD LYS 29 8.982 14.668 -3.540
240 HE2 LYS 29 2HE LYS 29 7.525 13.346 -1.279
241 HE3 LYS 29 3HE LYS 29 9.231 13.766 -1.132
242 HZ1 LYS 29 3HZ LYS 29 8.188 16.043 -2.084
243 HZ2 LYS 29 1HZ LYS 29 8.422 15.720 -0.439
244 HZ3 LYS 29 2HZ LYS 29 6.902 15.479 -1.141
245 H ALA 30 H ALA 30 5.393 16.523 -7.108
246 HA ALA 30 HA ALA 30 3.399 14.491 -7.841
247 HB1 ALA 30 3HB ALA 30 1.792 16.317 -7.951
248 HB2 ALA 30 1HB ALA 30 2.596 16.282 -6.382
249 HB3 ALA 30 2HB ALA 30 3.069 17.478 -7.588