Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
613655 | 2nbl RC | 25982 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HN1 NH2 0 H1 THR 1 22.522 -4.556 11.503
2 HN2 NH2 0 H2 THR 1 23.477 -4.721 12.897
3 H THR 1 HN THR 1 25.483 -6.211 8.948
4 HA THR 1 HA THR 1 22.673 -5.909 9.694
5 HB THR 1 HB THR 1 22.932 -8.203 10.554
6 HG1 THR 1 HG1 THR 1 24.823 -9.014 10.774
7 HG21 THR 1 HG21 THR 1 22.461 -7.531 8.023
8 HG22 THR 1 HG22 THR 1 22.672 -9.218 8.484
9 HG23 THR 1 HG23 THR 1 24.012 -8.330 7.768
10 H GLU 2 HN GLU 2 24.332 -2.558 6.862
11 HA GLU 2 HA GLU 2 25.693 -5.003 6.643
12 HB2 GLU 2 HB2 GLU 2 27.049 -4.896 8.727
13 HB3 GLU 2 HB1 GLU 2 27.639 -3.829 7.462
14 HG2 GLU 2 HG2 GLU 2 27.664 -2.657 9.607
15 HG3 GLU 2 HG1 GLU 2 26.468 -1.924 8.545
16 H ILE 3 HN ILE 3 27.209 -0.136 4.568
17 HA ILE 3 HA ILE 3 24.529 -0.949 5.484
18 HB ILE 3 HB ILE 3 24.823 -0.589 3.078
19 HG12 ILE 3 HG12 ILE 3 23.981 -2.772 2.298
20 HG13 ILE 3 HG11 ILE 3 24.528 -3.533 3.785
21 HG21 ILE 3 HG21 ILE 3 26.478 -1.590 1.794
22 HG22 ILE 3 HG22 ILE 3 26.645 -2.975 2.864
23 HG23 ILE 3 HG23 ILE 3 27.350 -1.422 3.310
24 HD11 ILE 3 HD11 ILE 3 22.710 -1.164 4.019
25 HD12 ILE 3 HD12 ILE 3 22.831 -2.599 5.037
26 HD13 ILE 3 HD13 ILE 3 22.016 -2.693 3.480
27 H ARG 4 HN ARG 4 26.368 3.612 5.541
28 HA ARG 4 HA ARG 4 28.317 1.410 5.797
29 HB2 ARG 4 HB2 ARG 4 26.642 2.793 7.909
30 HB3 ARG 4 HB1 ARG 4 27.752 1.470 8.214
31 HG2 ARG 4 HG2 ARG 4 28.820 3.566 8.812
32 HG3 ARG 4 HG1 ARG 4 29.625 2.903 7.403
33 HD2 ARG 4 HD2 ARG 4 29.252 5.342 7.231
34 HD3 ARG 4 HD1 ARG 4 28.445 4.475 5.952
35 HE ARG 4 HE ARG 4 26.456 5.310 6.786
36 HH11 ARG 4 HH11 ARG 4 25.093 6.193 8.365
37 HH12 ARG 4 HH12 ARG 4 25.699 6.485 9.962
38 HH21 ARG 4 HH21 ARG 4 28.884 5.319 9.258
39 HH22 ARG 4 HH22 ARG 4 27.840 5.990 10.466
40 H VAL 5 HN VAL 5 28.802 5.201 2.535
41 HA VAL 5 HA VAL 5 26.108 4.595 3.590
42 HB VAL 5 HB VAL 5 26.006 2.989 1.740
43 HG11 VAL 5 HG11 VAL 5 26.110 4.680 -0.093
44 HG12 VAL 5 HG12 VAL 5 26.987 5.756 0.995
45 HG13 VAL 5 HG13 VAL 5 25.321 5.301 1.358
46 HG21 VAL 5 HG21 VAL 5 28.042 3.399 0.021
47 HG22 VAL 5 HG22 VAL 5 28.129 2.152 1.257
48 HG23 VAL 5 HG23 VAL 5 28.921 3.706 1.519
49 H8 4FU 6 HAM 4FU 6 27.934 8.932 4.782
50 H9 4FU 6 HAI 4FU 6 29.121 10.831 3.757
51 HAI 4FU 6 HAJ 4FU 6 30.254 9.702 4.531
52 H112 4FU 6 HAE 4FU 6 31.102 10.388 2.332
53 H111 4FU 6 HAF 4FU 6 29.603 9.818 1.563
54 HAG 4FU 6 HAG 4FU 6 31.393 8.127 1.361
55 H12 4FU 6 HAH 4FU 6 31.583 8.120 3.130
56 HAL 4FU 6 HAL 4FU 6 30.193 6.230 2.373
57 HAK 4FU 6 HAK 4FU 6 29.056 7.360 1.601
58 H14 4FU 6 HAN 4FU 6 29.738 7.265 4.565
59 H GLY 7 HN GLY 7 26.336 7.503 3.359
60 HA2 GLY 7 HA2 GLY 7 25.344 9.273 1.217
61 HA3 GLY 7 HA1 GLY 7 25.554 7.566 0.866
62 H VAL 8 HN VAL 8 24.834 7.685 4.006
63 HA VAL 8 HA VAL 8 22.936 7.670 5.345
64 HB VAL 8 HB VAL 8 21.283 7.975 2.814
65 HG11 VAL 8 HG11 VAL 8 20.628 7.895 5.734
66 HG12 VAL 8 HG12 VAL 8 19.753 7.196 4.368
67 HG13 VAL 8 HG13 VAL 8 19.675 8.925 4.670
68 HG21 VAL 8 HG21 VAL 8 22.506 9.990 2.930
69 HG22 VAL 8 HG22 VAL 8 22.543 9.974 4.693
70 HG23 VAL 8 HG23 VAL 8 21.050 10.372 3.845
71 H THR 9 HN THR 9 20.806 6.196 5.397
72 HA THR 9 HA THR 9 19.926 4.125 5.513
73 HB THR 9 HB THR 9 20.305 2.495 3.712
74 HG1 THR 9 HG1 THR 9 21.516 3.341 1.889
75 HG21 THR 9 HG21 THR 9 19.348 3.947 1.910
76 HG22 THR 9 HG22 THR 9 19.673 5.340 2.941
77 HG23 THR 9 HG23 THR 9 18.549 4.088 3.476
78 H ILE 10 HN ILE 10 20.356 1.905 5.959
79 HA ILE 10 HA ILE 10 23.054 1.037 6.501
80 HB ILE 10 HB ILE 10 22.743 2.613 8.357
81 HG12 ILE 10 HG12 ILE 10 22.530 -0.275 9.279
82 HG13 ILE 10 HG11 ILE 10 24.019 0.520 8.768
83 HG21 ILE 10 HG21 ILE 10 20.940 2.470 9.889
84 HG22 ILE 10 HG22 ILE 10 20.458 0.879 9.305
85 HG23 ILE 10 HG23 ILE 10 20.187 2.305 8.304
86 HD11 ILE 10 HD11 ILE 10 22.296 1.189 11.162
87 HD12 ILE 10 HD12 ILE 10 23.566 2.259 10.568
88 HD13 ILE 10 HD13 ILE 10 23.975 0.650 11.158
89 H ARG 11 HN ARG 11 19.624 0.623 7.356
90 HA ARG 11 HA ARG 11 19.902 -2.218 7.710
91 HB2 ARG 11 HB2 ARG 11 17.483 -2.112 8.175
92 HB3 ARG 11 HB1 ARG 11 18.390 -0.935 9.126
93 HG2 ARG 11 HG2 ARG 11 17.841 0.820 7.472
94 HG3 ARG 11 HG1 ARG 11 16.908 -0.353 6.542
95 HD2 ARG 11 HD2 ARG 11 16.366 0.441 9.410
96 HD3 ARG 11 HD1 ARG 11 15.452 0.988 8.008
97 HE ARG 11 HE ARG 11 15.455 -1.816 7.982
98 HH11 ARG 11 HH11 ARG 11 13.617 -2.906 8.762
99 HH12 ARG 11 HH12 ARG 11 12.545 -2.102 9.859
100 HH21 ARG 11 HH21 ARG 11 14.407 0.833 9.902
101 HH22 ARG 11 HH22 ARG 11 12.993 0.032 10.511
102 H MET 12 HN MET 12 17.761 -3.371 6.660
103 HA MET 12 HA MET 12 16.930 -4.348 4.763
104 HB2 MET 12 HB2 MET 12 15.884 -2.141 4.444
105 HB3 MET 12 HB1 MET 12 17.328 -1.568 3.615
106 HG2 MET 12 HG2 MET 12 15.605 -2.228 1.991
107 HG3 MET 12 HG1 MET 12 17.004 -3.289 1.863
108 HE1 MET 12 HE1 MET 12 15.535 -4.504 0.454
109 HE2 MET 12 HE2 MET 12 13.829 -4.232 0.799
110 HE3 MET 12 HE3 MET 12 14.510 -5.846 0.982
111 H ARG 13 HN ARG 13 17.687 -5.522 3.013
112 HA ARG 13 HA ARG 13 19.945 -4.732 1.520
113 HB2 ARG 13 HB2 ARG 13 21.596 -6.328 2.169
114 HB3 ARG 13 HB1 ARG 13 21.145 -5.378 3.575
115 HG2 ARG 13 HG2 ARG 13 20.113 -8.131 2.900
116 HG3 ARG 13 HG1 ARG 13 21.337 -7.768 4.101
117 HD2 ARG 13 HD2 ARG 13 19.688 -6.470 5.394
118 HD3 ARG 13 HD1 ARG 13 18.471 -6.822 4.184
119 HE ARG 13 HE ARG 13 18.175 -8.827 5.126
120 HH11 ARG 13 HH11 ARG 13 18.731 -10.664 6.347
121 HH12 ARG 13 HH12 ARG 13 20.283 -10.746 7.113
122 HH21 ARG 13 HH21 ARG 13 21.312 -7.643 5.967
123 HH22 ARG 13 HH22 ARG 13 21.742 -9.040 6.896
124 H DAL 14 HN ALA 14 20.752 -6.483 0.078
125 HA DAL 14 HA ALA 14 20.248 -7.872 -1.679
126 HB1 DAL 14 HB1 ALA 14 17.374 -8.001 -0.799
127 HB2 DAL 14 HB2 ALA 14 18.042 -8.066 -2.428
128 HB3 DAL 14 HB3 ALA 14 18.017 -6.538 -1.547
129 H SER 15 HN SER 15 18.539 -10.018 -1.871
130 HA SER 15 HA SER 15 18.374 -11.668 0.379
131 HB2 SER 15 HB2 SER 15 18.543 -12.421 -2.535
132 HB3 SER 15 HB1 SER 15 18.066 -13.513 -1.238
133 HG SER 15 HG SER 15 16.793 -11.022 -1.562
134 H HIS 16 HN HIS 16 20.894 -11.354 -2.053
135 HA HIS 16 HA HIS 16 22.800 -12.611 -0.225
136 HB2 HIS 16 HB2 HIS 16 23.617 -14.182 -1.937
137 HB3 HIS 16 HB1 HIS 16 21.938 -14.509 -1.513
138 HD2 HIS 16 HD2 HIS 16 23.909 -14.166 -4.673
139 HE1 HIS 16 HE1 HIS 16 20.045 -12.813 -5.703
140 HE2 HIS 16 HE2 HIS 16 22.289 -13.555 -6.629
141 H DAL 17 HN ALA 17 22.128 -10.067 -1.954
142 HA DAL 17 HA ALA 17 24.376 -9.621 -3.637
143 HB1 DAL 17 HB1 ALA 17 25.776 -8.274 -2.255
144 HB2 DAL 17 HB2 ALA 17 25.490 -9.764 -1.357
145 HB3 DAL 17 HB3 ALA 17 24.607 -8.299 -0.936
146 H PHE 18 HN PHE 18 24.733 -6.873 -2.811
147 HA PHE 18 HA PHE 18 22.426 -5.753 -4.144
148 HB2 PHE 18 HB2 PHE 18 21.850 -4.248 -2.261
149 HB3 PHE 18 HB1 PHE 18 21.571 -5.947 -1.899
150 HD1 PHE 18 HD1 PHE 18 24.256 -3.303 -1.536
151 HD2 PHE 18 HD2 PHE 18 22.457 -6.864 0.055
152 HE1 PHE 18 HE1 PHE 18 25.765 -3.220 0.383
153 HE2 PHE 18 HE2 PHE 18 23.969 -6.753 1.999
154 HZ PHE 18 HZ PHE 18 25.628 -4.937 2.156
155 H TRP 19 HN TRP 19 22.663 -3.454 -4.596
156 HA TRP 19 HA TRP 19 25.517 -2.660 -4.776
157 HB2 TRP 19 HB2 TRP 19 23.150 -1.894 -6.497
158 HB3 TRP 19 HB1 TRP 19 24.783 -1.260 -6.686
159 HD1 TRP 19 HD1 TRP 19 23.231 -4.808 -6.384
160 HE1 TRP 19 HE1 TRP 19 24.375 -6.313 -8.139
161 HE3 TRP 19 HE3 TRP 19 26.460 -1.440 -8.458
162 HZ2 TRP 19 HZ2 TRP 19 26.393 -6.112 -10.156
163 HZ3 TRP 19 HZ3 TRP 19 27.974 -2.120 -10.290
164 HH2 TRP 19 HH2 TRP 19 27.948 -4.450 -11.143
165 H VAL 20 HN VAL 20 26.176 -0.672 -4.103
166 HA VAL 20 HA VAL 20 24.214 1.349 -3.321
167 HB VAL 20 HB VAL 20 24.379 -0.064 -1.308
168 HG11 VAL 20 HG11 VAL 20 26.751 -0.826 -1.912
169 HG12 VAL 20 HG12 VAL 20 26.454 -0.467 -0.214
170 HG13 VAL 20 HG13 VAL 20 27.304 0.699 -1.221
171 HG21 VAL 20 HG21 VAL 20 25.959 2.470 -0.833
172 HG22 VAL 20 HG22 VAL 20 24.768 1.711 0.223
173 HG23 VAL 20 HG23 VAL 20 24.248 2.513 -1.257
174 H GLN 21 HN GLN 21 25.022 3.343 -3.706
175 HA GLN 21 HA GLN 21 27.903 3.813 -3.610
176 HB2 GLN 21 HB2 GLN 21 27.988 4.706 -5.887
177 HB3 GLN 21 HB1 GLN 21 27.504 3.017 -5.904
178 HG2 GLN 21 HG2 GLN 21 25.611 5.362 -6.091
179 HG3 GLN 21 HG1 GLN 21 26.145 4.372 -7.445
180 HE21 GLN 21 HE21 GLN 21 23.700 4.705 -5.217
181 HE22 GLN 21 HE22 GLN 21 23.072 3.131 -5.263
182 H VAL 22 HN VAL 22 28.459 6.054 -3.543
183 HA VAL 22 HA VAL 22 26.309 7.688 -2.438
184 HB VAL 22 HB VAL 22 28.191 9.304 -1.928
185 HG11 VAL 22 HG11 VAL 22 29.488 7.681 -0.459
186 HG12 VAL 22 HG12 VAL 22 28.550 6.380 -1.194
187 HG13 VAL 22 HG13 VAL 22 27.737 7.632 -0.254
188 HG21 VAL 22 HG21 VAL 22 30.493 8.551 -2.424
189 HG22 VAL 22 HG22 VAL 22 29.566 8.806 -3.902
190 HG23 VAL 22 HG23 VAL 22 29.851 7.169 -3.312
191 HA DPR 23 HA PRO 23 26.735 11.134 -5.530
192 HB2 DPR 23 HB2 PRO 23 24.697 12.260 -5.378
193 HB3 DPR 23 HB1 PRO 23 23.763 10.754 -5.256
194 HG2 DPR 23 HG2 PRO 23 25.366 12.156 -3.155
195 HG3 DPR 23 HG1 PRO 23 23.761 11.411 -3.032
196 HD2 DPR 23 HD2 PRO 23 26.030 10.150 -2.170
197 HD3 DPR 23 HD1 PRO 23 24.625 9.263 -2.802
198 HAC 4G6 24 HAC 4G6 24 26.419 10.224 -10.357
199 HAB 4G6 24 HAB 4G6 24 25.209 8.923 -10.473
200 HAA 4G6 24 HAA 4G6 24 24.996 10.234 -9.289
201 HAF 4G6 24 HAF 4G6 24 25.950 7.135 -7.487
202 HAD 4G6 24 HAD 4G6 24 26.116 6.714 -9.210
203 HAE 4G6 24 HAE 4G6 24 24.690 7.620 -8.645
204 HAL 4G6 24 HAL 4G6 24 27.493 9.999 -7.297
205 HAH 4G6 24 HAH 4G6 24 28.177 9.247 -10.023
206 HAG 4G6 24 HAG 4G6 24 27.849 7.511 -9.828
207 HAI 4G6 24 HAI 4G6 24 28.795 9.010 -7.439
208 H LYS 25 HN LYS 25 32.331 6.125 -7.628
209 HA LYS 25 HA LYS 25 30.335 7.734 -6.227
210 HB2 LYS 25 HB2 LYS 25 32.627 8.653 -6.560
211 HB3 LYS 25 HB1 LYS 25 32.423 8.478 -8.283
212 HG2 LYS 25 HG2 LYS 25 32.020 10.803 -7.614
213 HG3 LYS 25 HG1 LYS 25 30.574 10.072 -8.287
214 HD2 LYS 25 HD2 LYS 25 30.052 11.451 -6.319
215 HD3 LYS 25 HD1 LYS 25 29.634 9.783 -6.023
216 HE2 LYS 25 HE2 LYS 25 32.167 11.150 -5.056
217 HE3 LYS 25 HE1 LYS 25 30.739 10.879 -4.072
218 HZ1 LYS 25 HZ1 LYS 25 32.832 9.037 -4.851
219 HZ2 LYS 25 HZ2 LYS 25 31.259 8.404 -4.917
220 HZ3 LYS 25 HZ3 LYS 25 31.852 9.056 -3.473
221 H GLU 26 HN GLU 26 30.460 2.557 -6.435
222 HA GLU 26 HA GLU 26 32.789 4.124 -5.558
223 HB2 GLU 26 HB2 GLU 26 31.695 3.664 -8.345
224 HB3 GLU 26 HB1 GLU 26 33.129 4.607 -7.951
225 HG2 GLU 26 HG2 GLU 26 33.779 2.357 -8.665
226 HG3 GLU 26 HG1 GLU 26 34.177 2.593 -6.966
227 H PHE 27 HN PHE 27 31.704 -0.144 -5.132
228 HA PHE 27 HA PHE 27 29.341 1.433 -4.764
229 HB2 PHE 27 HB2 PHE 27 29.739 1.992 -2.410
230 HB3 PHE 27 HB1 PHE 27 29.342 0.299 -2.629
231 HD1 PHE 27 HD1 PHE 27 30.350 0.744 -0.156
232 HD2 PHE 27 HD2 PHE 27 32.696 0.474 -3.753
233 HE1 PHE 27 HE1 PHE 27 32.324 0.094 1.162
234 HE2 PHE 27 HE2 PHE 27 34.650 -0.161 -2.423
235 HZ PHE 27 HZ PHE 27 34.461 -0.350 0.024
236 H LYS 28 HN LYS 28 29.622 -4.184 -5.701
237 HA LYS 28 HA LYS 28 31.640 -2.281 -5.562
238 HB2 LYS 28 HB2 LYS 28 29.270 -2.425 -7.423
239 HB3 LYS 28 HB1 LYS 28 30.690 -1.409 -7.669
240 HG2 LYS 28 HG2 LYS 28 32.129 -3.416 -7.677
241 HG3 LYS 28 HG1 LYS 28 30.708 -4.433 -7.440
242 HD2 LYS 28 HD2 LYS 28 29.764 -3.614 -9.567
243 HD3 LYS 28 HD1 LYS 28 31.186 -2.601 -9.809
244 HE2 LYS 28 HE2 LYS 28 32.619 -4.608 -9.824
245 HE3 LYS 28 HE1 LYS 28 31.198 -5.625 -9.577
246 HZ1 LYS 28 HZ1 LYS 28 32.017 -4.116 -11.954
247 HZ2 LYS 28 HZ2 LYS 28 30.357 -4.346 -11.672
248 HZ3 LYS 28 HZ3 LYS 28 31.388 -5.687 -11.837
249 H HIS 29 HN HIS 29 30.167 -5.875 -1.440
250 HA HIS 29 HA HIS 29 29.606 -5.816 -4.204
251 HB2 HIS 29 HB2 HIS 29 27.653 -4.444 -3.563
252 HB3 HIS 29 HB1 HIS 29 27.829 -5.866 -2.532
253 HD2 HIS 29 HD2 HIS 29 27.518 -5.120 0.101
254 HE1 HIS 29 HE1 HIS 29 29.108 -1.224 -0.169
255 HE2 HIS 29 HE2 HIS 29 28.122 -2.947 1.409
256 H1 ACE 30 HA2 ACE 30 32.422 -6.116 -0.575
257 H2 ACE 30 HA3 ACE 30 33.609 -6.738 -1.721
258 H3 ACE 30 HA1 ACE 30 32.210 -7.717 -1.283
Start of MODEL 2
1 HN1 NH2 0 H1 THR 1 27.027 -2.101 2.677
2 HN2 NH2 0 H2 THR 1 28.076 -2.209 1.347
3 H THR 1 HN THR 1 26.652 -3.594 4.108
4 HA THR 1 HA THR 1 28.823 -1.975 5.075
5 HB THR 1 HB THR 1 29.291 -4.090 6.224
6 HG1 THR 1 HG1 THR 1 31.154 -3.188 5.733
7 HG21 THR 1 HG21 THR 1 30.007 -6.052 4.763
8 HG22 THR 1 HG22 THR 1 29.188 -5.256 3.427
9 HG23 THR 1 HG23 THR 1 28.274 -5.765 4.846
10 H GLU 2 HN GLU 2 23.620 -1.892 5.636
11 HA GLU 2 HA GLU 2 24.812 -3.092 7.135
12 HB2 GLU 2 HB2 GLU 2 23.842 -5.007 5.964
13 HB3 GLU 2 HB1 GLU 2 25.149 -4.972 4.791
14 HG2 GLU 2 HG2 GLU 2 25.563 -6.710 6.452
15 HG3 GLU 2 HG1 GLU 2 26.771 -5.447 6.590
16 H ILE 3 HN ILE 3 24.857 -0.304 2.046
17 HA ILE 3 HA ILE 3 22.674 -1.334 3.752
18 HB ILE 3 HB ILE 3 22.350 -1.607 1.347
19 HG12 ILE 3 HG12 ILE 3 23.016 -4.236 2.721
20 HG13 ILE 3 HG11 ILE 3 21.508 -3.351 2.904
21 HG21 ILE 3 HG21 ILE 3 23.901 -2.532 -0.106
22 HG22 ILE 3 HG22 ILE 3 24.627 -3.549 1.139
23 HG23 ILE 3 HG23 ILE 3 25.006 -1.829 1.077
24 HD11 ILE 3 HD11 ILE 3 22.058 -3.734 0.084
25 HD12 ILE 3 HD12 ILE 3 20.692 -4.312 1.034
26 HD13 ILE 3 HD13 ILE 3 22.160 -5.272 0.928
27 H ARG 4 HN ARG 4 23.170 3.316 3.152
28 HA ARG 4 HA ARG 4 25.535 1.754 2.299
29 HB2 ARG 4 HB2 ARG 4 26.167 3.454 3.959
30 HB3 ARG 4 HB1 ARG 4 24.921 2.850 5.047
31 HG2 ARG 4 HG2 ARG 4 26.038 0.662 5.140
32 HG3 ARG 4 HG1 ARG 4 27.279 1.247 4.025
33 HD2 ARG 4 HD2 ARG 4 26.629 2.483 6.700
34 HD3 ARG 4 HD1 ARG 4 27.991 1.402 6.406
35 HE ARG 4 HE ARG 4 28.114 3.533 4.562
36 HH11 ARG 4 HH11 ARG 4 29.538 5.254 4.953
37 HH12 ARG 4 HH12 ARG 4 30.124 5.541 6.557
38 HH21 ARG 4 HH21 ARG 4 28.381 2.886 7.951
39 HH22 ARG 4 HH22 ARG 4 29.469 4.199 8.256
40 H VAL 5 HN VAL 5 24.676 5.904 0.146
41 HA VAL 5 HA VAL 5 22.547 5.036 1.962
42 HB VAL 5 HB VAL 5 22.773 3.987 -0.873
43 HG11 VAL 5 HG11 VAL 5 21.059 3.213 1.499
44 HG12 VAL 5 HG12 VAL 5 22.189 2.191 0.610
45 HG13 VAL 5 HG13 VAL 5 20.693 2.724 -0.156
46 HG21 VAL 5 HG21 VAL 5 21.632 6.086 -0.958
47 HG22 VAL 5 HG22 VAL 5 20.747 5.742 0.530
48 HG23 VAL 5 HG23 VAL 5 20.367 4.857 -0.946
49 H8 4FU 6 HAM 4FU 6 24.192 10.490 0.393
50 H9 4FU 6 HAI 4FU 6 21.680 9.158 -0.642
51 HAI 4FU 6 HAJ 4FU 6 21.819 10.904 -0.320
52 H112 4FU 6 HAE 4FU 6 23.234 11.270 -2.078
53 H111 4FU 6 HAF 4FU 6 22.382 9.854 -2.720
54 HAG 4FU 6 HAG 4FU 6 24.629 9.287 -3.079
55 H12 4FU 6 HAH 4FU 6 25.152 10.047 -1.553
56 HAL 4FU 6 HAL 4FU 6 25.084 7.509 -1.520
57 HAK 4FU 6 HAK 4FU 6 23.315 7.618 -1.685
58 H14 4FU 6 HAN 4FU 6 25.078 8.340 0.617
59 H GLY 7 HN GLY 7 24.636 10.019 2.680
60 HA2 GLY 7 HA2 GLY 7 23.818 10.695 4.798
61 HA3 GLY 7 HA1 GLY 7 22.186 10.260 4.311
62 H VAL 8 HN VAL 8 23.856 7.816 3.180
63 HA VAL 8 HA VAL 8 23.970 5.604 3.722
64 HB VAL 8 HB VAL 8 25.447 5.057 5.585
65 HG11 VAL 8 HG11 VAL 8 26.252 7.486 3.970
66 HG12 VAL 8 HG12 VAL 8 26.442 5.796 3.503
67 HG13 VAL 8 HG13 VAL 8 27.377 6.450 4.847
68 HG21 VAL 8 HG21 VAL 8 26.243 6.667 7.147
69 HG22 VAL 8 HG22 VAL 8 24.494 6.850 7.142
70 HG23 VAL 8 HG23 VAL 8 25.509 8.003 6.271
71 H THR 9 HN THR 9 23.333 3.853 5.123
72 HA THR 9 HA THR 9 21.430 4.435 7.248
73 HB THR 9 HB THR 9 20.670 3.003 4.692
74 HG1 THR 9 HG1 THR 9 20.406 5.078 4.264
75 HG21 THR 9 HG21 THR 9 19.321 3.326 7.360
76 HG22 THR 9 HG22 THR 9 19.510 1.872 6.380
77 HG23 THR 9 HG23 THR 9 18.372 3.123 5.890
78 H ILE 10 HN ILE 10 20.562 2.304 8.154
79 HA ILE 10 HA ILE 10 22.764 0.597 8.754
80 HB ILE 10 HB ILE 10 21.114 -0.718 10.034
81 HG12 ILE 10 HG12 ILE 10 19.111 1.227 8.846
82 HG13 ILE 10 HG11 ILE 10 19.221 -0.488 8.447
83 HG21 ILE 10 HG21 ILE 10 20.558 1.016 11.610
84 HG22 ILE 10 HG22 ILE 10 20.717 2.257 10.367
85 HG23 ILE 10 HG23 ILE 10 22.139 1.371 10.918
86 HD11 ILE 10 HD11 ILE 10 17.502 -0.302 10.102
87 HD12 ILE 10 HD12 ILE 10 18.498 0.744 11.113
88 HD13 ILE 10 HD13 ILE 10 18.912 -0.961 10.930
89 H ARG 11 HN ARG 11 21.555 -1.921 8.853
90 HA ARG 11 HA ARG 11 22.096 -2.794 6.208
91 HB2 ARG 11 HB2 ARG 11 21.666 -5.081 7.105
92 HB3 ARG 11 HB1 ARG 11 22.909 -4.169 7.933
93 HG2 ARG 11 HG2 ARG 11 21.561 -5.364 9.563
94 HG3 ARG 11 HG1 ARG 11 21.295 -3.639 9.745
95 HD2 ARG 11 HD2 ARG 11 19.151 -3.812 8.631
96 HD3 ARG 11 HD1 ARG 11 19.430 -5.503 8.243
97 HE ARG 11 HE ARG 11 19.636 -5.144 11.030
98 HH11 ARG 11 HH11 ARG 11 17.874 -5.697 12.349
99 HH12 ARG 11 HH12 ARG 11 16.285 -5.799 11.667
100 HH21 ARG 11 HH21 ARG 11 17.319 -4.960 8.464
101 HH22 ARG 11 HH22 ARG 11 15.971 -5.382 9.467
102 H MET 12 HN MET 12 20.799 -4.175 4.884
103 HA MET 12 HA MET 12 17.901 -4.058 5.207
104 HB2 MET 12 HB2 MET 12 19.252 -2.830 2.785
105 HB3 MET 12 HB1 MET 12 17.523 -3.091 2.972
106 HG2 MET 12 HG2 MET 12 17.510 -1.570 4.924
107 HG3 MET 12 HG1 MET 12 19.238 -1.291 4.709
108 HE1 MET 12 HE1 MET 12 18.848 1.644 4.139
109 HE2 MET 12 HE2 MET 12 17.615 0.820 5.090
110 HE3 MET 12 HE3 MET 12 17.137 1.860 3.750
111 H ARG 13 HN ARG 13 17.145 -6.009 4.652
112 HA ARG 13 HA ARG 13 17.283 -8.228 3.931
113 HB2 ARG 13 HB2 ARG 13 17.503 -6.636 1.369
114 HB3 ARG 13 HB1 ARG 13 17.012 -8.326 1.474
115 HG2 ARG 13 HG2 ARG 13 15.152 -7.718 2.915
116 HG3 ARG 13 HG1 ARG 13 15.613 -6.021 2.823
117 HD2 ARG 13 HD2 ARG 13 13.812 -6.500 1.215
118 HD3 ARG 13 HD1 ARG 13 15.296 -6.070 0.372
119 HE ARG 13 HE ARG 13 15.247 -8.172 -0.580
120 HH11 ARG 13 HH11 ARG 13 14.648 -10.351 -0.742
121 HH12 ARG 13 HH12 ARG 13 13.667 -11.071 0.492
122 HH21 ARG 13 HH21 ARG 13 13.444 -8.173 2.379
123 HH22 ARG 13 HH22 ARG 13 12.988 -9.839 2.256
124 H DAL 14 HN ALA 14 18.457 -9.121 1.515
125 HA DAL 14 HA ALA 14 20.390 -10.136 0.758
126 HB1 DAL 14 HB1 ALA 14 21.494 -9.687 3.526
127 HB2 DAL 14 HB2 ALA 14 21.899 -10.971 2.388
128 HB3 DAL 14 HB3 ALA 14 20.318 -10.954 3.171
129 H SER 15 HN SER 15 23.026 -9.554 1.941
130 HA SER 15 HA SER 15 23.690 -6.845 1.702
131 HB2 SER 15 HB2 SER 15 25.176 -8.462 2.774
132 HB3 SER 15 HB1 SER 15 25.416 -9.275 1.230
133 HG SER 15 HG SER 15 26.251 -6.713 2.065
134 H HIS 16 HN HIS 16 23.756 -9.462 -0.623
135 HA HIS 16 HA HIS 16 24.504 -7.651 -2.800
136 HB2 HIS 16 HB2 HIS 16 24.648 -9.706 -4.153
137 HB3 HIS 16 HB1 HIS 16 25.624 -9.826 -2.690
138 HD2 HIS 16 HD2 HIS 16 22.151 -10.367 -1.452
139 HE1 HIS 16 HE1 HIS 16 23.417 -14.210 -2.652
140 HE2 HIS 16 HE2 HIS 16 21.657 -12.927 -1.348
141 H DAL 17 HN ALA 17 21.784 -7.952 -1.308
142 HA DAL 17 HA ALA 17 19.570 -7.677 -1.847
143 HB1 DAL 17 HB1 ALA 17 19.963 -10.061 -2.603
144 HB2 DAL 17 HB2 ALA 17 20.140 -9.412 -4.232
145 HB3 DAL 17 HB3 ALA 17 18.615 -9.224 -3.369
146 H PHE 18 HN PHE 18 21.339 -5.748 -2.774
147 HA PHE 18 HA PHE 18 20.542 -5.037 -5.481
148 HB2 PHE 18 HB2 PHE 18 19.579 -2.877 -4.824
149 HB3 PHE 18 HB1 PHE 18 18.662 -4.233 -4.191
150 HD1 PHE 18 HD1 PHE 18 21.508 -1.965 -3.122
151 HD2 PHE 18 HD2 PHE 18 17.989 -4.139 -1.961
152 HE1 PHE 18 HE1 PHE 18 21.710 -1.072 -0.842
153 HE2 PHE 18 HE2 PHE 18 18.193 -3.227 0.322
154 HZ PHE 18 HZ PHE 18 20.050 -1.695 0.877
155 H TRP 19 HN TRP 19 21.346 -2.616 -5.852
156 HA TRP 19 HA TRP 19 24.233 -2.706 -5.316
157 HB2 TRP 19 HB2 TRP 19 22.550 -1.021 -7.181
158 HB3 TRP 19 HB1 TRP 19 24.299 -0.920 -7.051
159 HD1 TRP 19 HD1 TRP 19 21.813 -3.869 -7.507
160 HE1 TRP 19 HE1 TRP 19 22.746 -5.367 -9.392
161 HE3 TRP 19 HE3 TRP 19 26.014 -1.231 -8.708
162 HZ2 TRP 19 HZ2 TRP 19 24.979 -5.423 -11.186
163 HZ3 TRP 19 HZ3 TRP 19 27.516 -2.020 -10.512
164 HH2 TRP 19 HH2 TRP 19 27.005 -4.107 -11.754
165 H VAL 20 HN VAL 20 25.353 -1.119 -4.219
166 HA VAL 20 HA VAL 20 23.792 1.187 -3.177
167 HB VAL 20 HB VAL 20 24.078 -0.531 -1.398
168 HG11 VAL 20 HG11 VAL 20 26.076 -1.535 -0.920
169 HG12 VAL 20 HG12 VAL 20 26.995 -0.063 -1.153
170 HG13 VAL 20 HG13 VAL 20 26.531 -1.042 -2.543
171 HG21 VAL 20 HG21 VAL 20 25.918 1.781 -0.788
172 HG22 VAL 20 HG22 VAL 20 24.715 1.022 0.252
173 HG23 VAL 20 HG23 VAL 20 24.199 2.060 -1.075
174 H GLN 21 HN GLN 21 24.709 2.590 -4.680
175 HA GLN 21 HA GLN 21 27.661 2.831 -4.701
176 HB2 GLN 21 HB2 GLN 21 25.587 4.124 -6.506
177 HB3 GLN 21 HB1 GLN 21 27.322 4.318 -6.649
178 HG2 GLN 21 HG2 GLN 21 26.604 2.708 -8.287
179 HG3 GLN 21 HG1 GLN 21 27.505 1.854 -7.044
180 HE21 GLN 21 HE21 GLN 21 24.760 1.663 -8.916
181 HE22 GLN 21 HE22 GLN 21 23.833 0.629 -7.940
182 H VAL 22 HN VAL 22 28.675 4.794 -4.221
183 HA VAL 22 HA VAL 22 26.979 6.958 -3.132
184 HB VAL 22 HB VAL 22 28.404 7.029 -1.034
185 HG11 VAL 22 HG11 VAL 22 27.296 5.200 0.051
186 HG12 VAL 22 HG12 VAL 22 27.186 4.283 -1.452
187 HG13 VAL 22 HG13 VAL 22 26.205 5.730 -1.228
188 HG21 VAL 22 HG21 VAL 22 30.390 5.938 -1.941
189 HG22 VAL 22 HG22 VAL 22 29.479 4.454 -2.221
190 HG23 VAL 22 HG23 VAL 22 29.780 5.006 -0.574
191 HA DPR 23 HA PRO 23 30.756 9.664 -3.378
192 HB2 DPR 23 HB2 PRO 23 29.881 11.783 -3.823
193 HB3 DPR 23 HB1 PRO 23 28.646 11.146 -4.930
194 HG2 DPR 23 HG2 PRO 23 28.700 11.111 -1.940
195 HG3 DPR 23 HG1 PRO 23 27.356 11.490 -3.034
196 HD2 DPR 23 HD2 PRO 23 27.645 9.040 -1.837
197 HD3 DPR 23 HD1 PRO 23 26.860 9.254 -3.417
198 HAC 4G6 24 HAC 4G6 24 32.243 10.222 -7.729
199 HAB 4G6 24 HAB 4G6 24 33.636 9.764 -6.719
200 HAA 4G6 24 HAA 4G6 24 33.437 9.052 -8.339
201 HAF 4G6 24 HAF 4G6 24 30.215 7.324 -7.308
202 HAD 4G6 24 HAD 4G6 24 31.429 7.205 -8.605
203 HAE 4G6 24 HAE 4G6 24 30.588 8.747 -8.308
204 HAL 4G6 24 HAL 4G6 24 32.036 8.490 -4.727
205 HAH 4G6 24 HAH 4G6 24 33.682 7.259 -5.787
206 HAG 4G6 24 HAG 4G6 24 33.631 6.924 -7.532
207 HAI 4G6 24 HAI 4G6 24 31.277 5.908 -6.144
208 H LYS 25 HN LYS 25 32.479 2.114 -4.666
209 HA LYS 25 HA LYS 25 32.215 2.686 -6.838
210 HB2 LYS 25 HB2 LYS 25 29.823 2.951 -6.277
211 HB3 LYS 25 HB1 LYS 25 30.125 4.589 -5.775
212 HG2 LYS 25 HG2 LYS 25 29.175 4.570 -8.030
213 HG3 LYS 25 HG1 LYS 25 30.796 5.220 -8.043
214 HD2 LYS 25 HD2 LYS 25 30.437 3.752 -9.952
215 HD3 LYS 25 HD1 LYS 25 31.669 3.086 -8.914
216 HE2 LYS 25 HE2 LYS 25 28.770 2.215 -8.950
217 HE3 LYS 25 HE1 LYS 25 30.065 1.374 -9.777
218 HZ1 LYS 25 HZ1 LYS 25 29.344 1.369 -6.977
219 HZ2 LYS 25 HZ2 LYS 25 31.010 1.493 -7.274
220 HZ3 LYS 25 HZ3 LYS 25 30.132 0.190 -7.902
221 H GLU 26 HN GLU 26 31.731 1.195 -1.567
222 HA GLU 26 HA GLU 26 31.638 3.772 -1.641
223 HB2 GLU 26 HB2 GLU 26 33.940 2.366 -2.997
224 HB3 GLU 26 HB1 GLU 26 33.989 3.965 -2.264
225 HG2 GLU 26 HG2 GLU 26 33.429 1.375 -0.784
226 HG3 GLU 26 HG1 GLU 26 34.963 2.233 -0.781
227 H PHE 27 HN PHE 27 31.138 -1.169 -3.941
228 HA PHE 27 HA PHE 27 28.802 -0.021 -2.553
229 HB2 PHE 27 HB2 PHE 27 30.189 -1.586 -1.234
230 HB3 PHE 27 HB1 PHE 27 31.589 -0.573 -1.522
231 HD1 PHE 27 HD1 PHE 27 31.423 -0.984 1.093
232 HD2 PHE 27 HD2 PHE 27 28.814 1.671 -1.070
233 HE1 PHE 27 HE1 PHE 27 30.909 0.230 3.171
234 HE2 PHE 27 HE2 PHE 27 28.329 2.872 1.005
235 HZ PHE 27 HZ PHE 27 29.372 2.151 3.115
236 H LYS 28 HN LYS 28 30.632 -4.320 -5.135
237 HA LYS 28 HA LYS 28 30.780 -2.140 -5.879
238 HB2 LYS 28 HB2 LYS 28 27.871 -2.596 -6.589
239 HB3 LYS 28 HB1 LYS 28 28.915 -1.347 -7.256
240 HG2 LYS 28 HG2 LYS 28 29.331 -4.337 -7.582
241 HG3 LYS 28 HG1 LYS 28 28.667 -3.268 -8.806
242 HD2 LYS 28 HD2 LYS 28 30.811 -1.992 -8.819
243 HD3 LYS 28 HD1 LYS 28 31.473 -3.137 -7.657
244 HE2 LYS 28 HE2 LYS 28 31.102 -4.987 -9.225
245 HE3 LYS 28 HE1 LYS 28 30.451 -3.851 -10.408
246 HZ1 LYS 28 HZ1 LYS 28 32.945 -2.936 -9.445
247 HZ2 LYS 28 HZ2 LYS 28 32.489 -3.317 -11.036
248 HZ3 LYS 28 HZ3 LYS 28 33.104 -4.525 -10.014
249 H HIS 29 HN HIS 29 29.612 -5.924 -2.086
250 HA HIS 29 HA HIS 29 29.130 -6.425 -4.868
251 HB2 HIS 29 HB2 HIS 29 26.757 -6.224 -4.252
252 HB3 HIS 29 HB1 HIS 29 27.616 -7.249 -3.102
253 HD2 HIS 29 HD2 HIS 29 25.159 -4.452 -2.861
254 HE1 HIS 29 HE1 HIS 29 27.589 -3.926 0.527
255 HE2 HIS 29 HE2 HIS 29 25.426 -3.258 -0.579
256 H1 ACE 30 HA2 ACE 30 31.864 -5.050 -1.420
257 H2 ACE 30 HA3 ACE 30 33.142 -5.577 -2.517
258 H3 ACE 30 HA1 ACE 30 32.115 -6.769 -1.722
Start of MODEL 3
1 HN1 NH2 0 H1 THR 1 24.721 -7.536 3.087
2 HN2 NH2 0 H2 THR 1 23.557 -8.142 4.164
3 H THR 1 HN THR 1 27.220 -4.987 5.782
4 HA THR 1 HA THR 1 26.722 -6.716 3.692
5 HB THR 1 HB THR 1 27.444 -7.445 6.540
6 HG1 THR 1 HG1 THR 1 29.322 -6.697 6.033
7 HG21 THR 1 HG21 THR 1 26.781 -9.441 5.405
8 HG22 THR 1 HG22 THR 1 28.543 -9.404 5.336
9 HG23 THR 1 HG23 THR 1 27.596 -8.947 3.921
10 H GLU 2 HN GLU 2 24.239 -1.531 4.995
11 HA GLU 2 HA GLU 2 26.663 -2.760 5.385
12 HB2 GLU 2 HB2 GLU 2 25.270 -2.015 7.228
13 HB3 GLU 2 HB1 GLU 2 24.059 -3.226 6.838
14 HG2 GLU 2 HG2 GLU 2 25.427 -3.932 8.753
15 HG3 GLU 2 HG1 GLU 2 25.657 -5.019 7.396
16 H ILE 3 HN ILE 3 25.664 -0.020 1.355
17 HA ILE 3 HA ILE 3 23.432 -0.708 3.170
18 HB ILE 3 HB ILE 3 24.338 -1.939 0.562
19 HG12 ILE 3 HG12 ILE 3 21.831 -0.425 1.355
20 HG13 ILE 3 HG11 ILE 3 23.154 0.230 0.398
21 HG21 ILE 3 HG21 ILE 3 22.214 -3.318 0.855
22 HG22 ILE 3 HG22 ILE 3 22.202 -2.774 2.535
23 HG23 ILE 3 HG23 ILE 3 23.552 -3.735 1.926
24 HD11 ILE 3 HD11 ILE 3 21.167 -1.907 -0.354
25 HD12 ILE 3 HD12 ILE 3 22.710 -1.770 -1.191
26 HD13 ILE 3 HD13 ILE 3 21.573 -0.427 -1.221
27 H ARG 4 HN ARG 4 24.388 3.826 2.478
28 HA ARG 4 HA ARG 4 26.221 2.032 1.147
29 HB2 ARG 4 HB2 ARG 4 27.611 1.567 3.113
30 HB3 ARG 4 HB1 ARG 4 27.778 3.242 2.594
31 HG2 ARG 4 HG2 ARG 4 26.173 3.944 4.333
32 HG3 ARG 4 HG1 ARG 4 26.020 2.267 4.861
33 HD2 ARG 4 HD2 ARG 4 28.431 2.198 5.361
34 HD3 ARG 4 HD1 ARG 4 28.589 3.872 4.837
35 HE ARG 4 HE ARG 4 26.613 3.751 6.837
36 HH11 ARG 4 HH11 ARG 4 27.159 4.365 8.957
37 HH12 ARG 4 HH12 ARG 4 28.818 4.363 9.451
38 HH21 ARG 4 HH21 ARG 4 30.011 3.285 6.381
39 HH22 ARG 4 HH22 ARG 4 30.432 3.752 7.994
40 H VAL 5 HN VAL 5 26.666 6.952 0.527
41 HA VAL 5 HA VAL 5 24.218 5.948 1.865
42 HB VAL 5 HB VAL 5 24.755 5.755 -1.120
43 HG11 VAL 5 HG11 VAL 5 23.669 3.757 -0.296
44 HG12 VAL 5 HG12 VAL 5 22.454 4.734 -1.113
45 HG13 VAL 5 HG13 VAL 5 22.527 4.709 0.648
46 HG21 VAL 5 HG21 VAL 5 23.072 7.337 -1.489
47 HG22 VAL 5 HG22 VAL 5 23.830 8.001 -0.053
48 HG23 VAL 5 HG23 VAL 5 22.336 7.090 0.089
49 H8 4FU 6 HAM 4FU 6 26.672 11.364 1.853
50 H9 4FU 6 HAI 4FU 6 24.186 9.993 0.776
51 HAI 4FU 6 HAJ 4FU 6 24.433 11.751 0.892
52 H112 4FU 6 HAE 4FU 6 26.385 11.596 -0.598
53 H111 4FU 6 HAF 4FU 6 24.930 10.935 -1.378
54 HAG 4FU 6 HAG 4FU 6 25.644 8.646 -0.811
55 H12 4FU 6 HAH 4FU 6 26.911 9.493 -1.724
56 HAL 4FU 6 HAL 4FU 6 28.097 10.017 0.351
57 HAK 4FU 6 HAK 4FU 6 27.846 8.262 0.221
58 H14 4FU 6 HAN 4FU 6 27.336 9.066 2.495
59 H GLY 7 HN GLY 7 26.582 9.481 4.091
60 HA2 GLY 7 HA2 GLY 7 25.872 9.639 6.279
61 HA3 GLY 7 HA1 GLY 7 24.853 10.990 5.817
62 H VAL 8 HN VAL 8 23.979 8.753 3.716
63 HA VAL 8 HA VAL 8 21.603 7.986 5.211
64 HB VAL 8 HB VAL 8 22.435 7.342 2.376
65 HG11 VAL 8 HG11 VAL 8 20.805 5.753 3.157
66 HG12 VAL 8 HG12 VAL 8 19.986 6.898 2.095
67 HG13 VAL 8 HG13 VAL 8 19.814 7.041 3.846
68 HG21 VAL 8 HG21 VAL 8 22.076 9.816 3.046
69 HG22 VAL 8 HG22 VAL 8 20.375 9.377 3.217
70 HG23 VAL 8 HG23 VAL 8 21.179 9.206 1.655
71 H THR 9 HN THR 9 21.427 6.092 6.288
72 HA THR 9 HA THR 9 23.162 3.830 5.468
73 HB THR 9 HB THR 9 23.438 3.243 7.834
74 HG1 THR 9 HG1 THR 9 21.915 4.154 8.987
75 HG21 THR 9 HG21 THR 9 25.108 4.909 8.304
76 HG22 THR 9 HG22 THR 9 24.314 6.070 7.238
77 HG23 THR 9 HG23 THR 9 25.071 4.625 6.564
78 H ILE 10 HN ILE 10 22.522 1.786 6.193
79 HA ILE 10 HA ILE 10 19.822 1.324 7.114
80 HB ILE 10 HB ILE 10 19.440 1.800 4.699
81 HG12 ILE 10 HG12 ILE 10 19.134 -1.133 5.422
82 HG13 ILE 10 HG11 ILE 10 18.021 0.142 5.919
83 HG21 ILE 10 HG21 ILE 10 20.421 0.395 3.019
84 HG22 ILE 10 HG22 ILE 10 21.095 -0.688 4.239
85 HG23 ILE 10 HG23 ILE 10 21.744 0.941 4.051
86 HD11 ILE 10 HD11 ILE 10 17.748 0.688 3.445
87 HD12 ILE 10 HD12 ILE 10 17.068 -0.857 3.959
88 HD13 ILE 10 HD13 ILE 10 18.614 -0.811 3.109
89 H ARG 11 HN ARG 11 19.474 -0.906 7.597
90 HA ARG 11 HA ARG 11 21.759 -2.683 7.382
91 HB2 ARG 11 HB2 ARG 11 21.492 -3.283 9.790
92 HB3 ARG 11 HB1 ARG 11 22.104 -1.670 9.481
93 HG2 ARG 11 HG2 ARG 11 20.465 -1.603 11.290
94 HG3 ARG 11 HG1 ARG 11 19.856 -0.731 9.895
95 HD2 ARG 11 HD2 ARG 11 18.388 -2.591 9.326
96 HD3 ARG 11 HD1 ARG 11 19.078 -3.577 10.615
97 HE ARG 11 HE ARG 11 18.097 -1.174 11.711
98 HH11 ARG 11 HH11 ARG 11 16.069 -1.167 12.729
99 HH12 ARG 11 HH12 ARG 11 14.931 -2.427 12.390
100 HH21 ARG 11 HH21 ARG 11 17.014 -4.074 10.164
101 HH22 ARG 11 HH22 ARG 11 15.466 -4.072 10.939
102 H MET 12 HN MET 12 19.440 -2.861 5.864
103 HA MET 12 HA MET 12 17.795 -4.969 7.053
104 HB2 MET 12 HB2 MET 12 17.700 -3.700 4.303
105 HB3 MET 12 HB1 MET 12 16.521 -4.842 4.945
106 HG2 MET 12 HG2 MET 12 17.160 -2.127 6.141
107 HG3 MET 12 HG1 MET 12 15.736 -2.505 5.177
108 HE1 MET 12 HE1 MET 12 14.164 -2.074 8.633
109 HE2 MET 12 HE2 MET 12 14.383 -1.468 6.994
110 HE3 MET 12 HE3 MET 12 15.660 -1.244 8.186
111 H ARG 13 HN ARG 13 17.709 -7.072 6.368
112 HA ARG 13 HA ARG 13 20.128 -8.107 5.104
113 HB2 ARG 13 HB2 ARG 13 19.155 -9.079 7.183
114 HB3 ARG 13 HB1 ARG 13 17.708 -9.501 6.293
115 HG2 ARG 13 HG2 ARG 13 20.474 -10.579 5.687
116 HG3 ARG 13 HG1 ARG 13 19.281 -11.419 6.661
117 HD2 ARG 13 HD2 ARG 13 17.765 -11.422 4.636
118 HD3 ARG 13 HD1 ARG 13 19.096 -10.751 3.720
119 HE ARG 13 HE ARG 13 19.986 -12.847 3.583
120 HH11 ARG 13 HH11 ARG 13 20.344 -14.985 4.249
121 HH12 ARG 13 HH12 ARG 13 19.546 -15.596 5.659
122 HH21 ARG 13 HH21 ARG 13 17.867 -12.639 6.320
123 HH22 ARG 13 HH22 ARG 13 18.146 -14.272 6.828
124 H DAL 14 HN ALA 14 20.262 -8.487 3.022
125 HA DAL 14 HA ALA 14 19.547 -8.207 0.783
126 HB1 DAL 14 HB1 ALA 14 16.757 -9.060 1.515
127 HB2 DAL 14 HB2 ALA 14 17.301 -8.139 0.118
128 HB3 DAL 14 HB3 ALA 14 17.281 -7.385 1.709
129 H SER 15 HN SER 15 17.605 -9.961 -0.382
130 HA SER 15 HA SER 15 17.973 -12.652 0.312
131 HB2 SER 15 HB2 SER 15 17.088 -13.138 -1.928
132 HB3 SER 15 HB1 SER 15 16.143 -11.897 -1.111
133 HG SER 15 HG SER 15 16.558 -11.120 -3.126
134 H HIS 16 HN HIS 16 19.725 -10.601 -1.934
135 HA HIS 16 HA HIS 16 22.003 -12.420 -1.849
136 HB2 HIS 16 HB2 HIS 16 22.144 -12.658 -4.293
137 HB3 HIS 16 HB1 HIS 16 20.664 -13.379 -3.662
138 HD2 HIS 16 HD2 HIS 16 21.568 -11.111 -6.490
139 HE1 HIS 16 HE1 HIS 16 17.663 -9.922 -5.412
140 HE2 HIS 16 HE2 HIS 16 19.461 -9.740 -7.196
141 H DAL 17 HN ALA 17 21.713 -9.803 -0.897
142 HA DAL 17 HA ALA 17 24.014 -8.559 -1.852
143 HB1 DAL 17 HB1 ALA 17 21.654 -7.624 -0.249
144 HB2 DAL 17 HB2 ALA 17 22.902 -6.474 -0.723
145 HB3 DAL 17 HB3 ALA 17 23.319 -7.869 0.267
146 H PHE 18 HN PHE 18 23.395 -5.910 -2.329
147 HA PHE 18 HA PHE 18 22.465 -6.027 -5.121
148 HB2 PHE 18 HB2 PHE 18 21.488 -3.933 -3.153
149 HB3 PHE 18 HB1 PHE 18 21.142 -3.978 -4.880
150 HD1 PHE 18 HD1 PHE 18 20.861 -6.121 -1.819
151 HD2 PHE 18 HD2 PHE 18 19.165 -5.016 -5.600
152 HE1 PHE 18 HE1 PHE 18 18.960 -7.642 -1.413
153 HE2 PHE 18 HE2 PHE 18 17.243 -6.514 -5.178
154 HZ PHE 18 HZ PHE 18 17.147 -7.826 -3.084
155 H TRP 19 HN TRP 19 22.751 -3.595 -5.976
156 HA TRP 19 HA TRP 19 25.560 -2.907 -5.409
157 HB2 TRP 19 HB2 TRP 19 23.721 -2.131 -7.675
158 HB3 TRP 19 HB1 TRP 19 25.347 -1.490 -7.464
159 HD1 TRP 19 HD1 TRP 19 23.793 -5.057 -7.483
160 HE1 TRP 19 HE1 TRP 19 25.373 -6.554 -8.880
161 HE3 TRP 19 HE3 TRP 19 27.368 -1.624 -8.718
162 HZ2 TRP 19 HZ2 TRP 19 27.838 -6.315 -10.330
163 HZ3 TRP 19 HZ3 TRP 19 29.314 -2.284 -10.102
164 HH2 TRP 19 HH2 TRP 19 29.555 -4.620 -10.909
165 H VAL 20 HN VAL 20 26.159 -1.063 -4.522
166 HA VAL 20 HA VAL 20 24.205 1.129 -4.231
167 HB VAL 20 HB VAL 20 24.150 -0.176 -2.127
168 HG11 VAL 20 HG11 VAL 20 27.062 0.548 -1.800
169 HG12 VAL 20 HG12 VAL 20 26.553 -1.008 -2.455
170 HG13 VAL 20 HG13 VAL 20 26.097 -0.551 -0.814
171 HG21 VAL 20 HG21 VAL 20 25.647 2.452 -1.877
172 HG22 VAL 20 HG22 VAL 20 24.679 1.687 -0.619
173 HG23 VAL 20 HG23 VAL 20 23.903 2.289 -2.085
174 H GLN 21 HN GLN 21 25.115 2.997 -4.786
175 HA GLN 21 HA GLN 21 28.063 3.267 -4.648
176 HB2 GLN 21 HB2 GLN 21 26.303 3.961 -7.025
177 HB3 GLN 21 HB1 GLN 21 28.022 4.324 -6.891
178 HG2 GLN 21 HG2 GLN 21 28.514 1.913 -6.707
179 HG3 GLN 21 HG1 GLN 21 26.797 1.550 -6.839
180 HE21 GLN 21 HE21 GLN 21 29.561 1.631 -8.672
181 HE22 GLN 21 HE22 GLN 21 28.875 1.932 -10.196
182 H VAL 22 HN VAL 22 28.753 5.271 -3.971
183 HA VAL 22 HA VAL 22 26.656 7.077 -3.031
184 HB VAL 22 HB VAL 22 28.548 8.187 -1.794
185 HG11 VAL 22 HG11 VAL 22 28.650 5.171 -1.503
186 HG12 VAL 22 HG12 VAL 22 27.275 6.135 -0.965
187 HG13 VAL 22 HG13 VAL 22 28.864 6.390 -0.245
188 HG21 VAL 22 HG21 VAL 22 30.733 6.811 -1.858
189 HG22 VAL 22 HG22 VAL 22 30.412 7.889 -3.207
190 HG23 VAL 22 HG23 VAL 22 30.137 6.163 -3.386
191 HA DPR 23 HA PRO 23 28.002 10.577 -5.548
192 HB2 DPR 23 HB2 PRO 23 26.017 11.669 -5.138
193 HB3 DPR 23 HB1 PRO 23 25.615 11.150 -6.788
194 HG2 DPR 23 HG2 PRO 23 24.087 10.472 -4.718
195 HG3 DPR 23 HG1 PRO 23 24.372 9.355 -6.063
196 HD2 DPR 23 HD2 PRO 23 25.500 9.287 -3.290
197 HD3 DPR 23 HD1 PRO 23 25.102 7.946 -4.391
198 HAC 4G6 24 HAC 4G6 24 29.052 9.336 -10.994
199 HAB 4G6 24 HAB 4G6 24 27.568 9.793 -10.126
200 HAA 4G6 24 HAA 4G6 24 29.080 10.684 -9.834
201 HAF 4G6 24 HAF 4G6 24 27.310 7.625 -9.652
202 HAD 4G6 24 HAD 4G6 24 28.072 6.931 -8.199
203 HAE 4G6 24 HAE 4G6 24 28.858 6.761 -9.787
204 HAL 4G6 24 HAL 4G6 24 29.372 9.663 -7.033
205 HAH 4G6 24 HAH 4G6 24 31.026 9.334 -9.371
206 HAG 4G6 24 HAG 4G6 24 30.688 7.613 -9.655
207 HAI 4G6 24 HAI 4G6 24 30.727 8.635 -6.849
208 H LYS 25 HN LYS 25 33.870 5.335 -6.314
209 HA LYS 25 HA LYS 25 31.677 7.042 -5.404
210 HB2 LYS 25 HB2 LYS 25 34.049 7.635 -4.849
211 HB3 LYS 25 HB1 LYS 25 34.394 7.716 -6.556
212 HG2 LYS 25 HG2 LYS 25 34.035 9.972 -5.668
213 HG3 LYS 25 HG1 LYS 25 32.806 9.554 -6.848
214 HD2 LYS 25 HD2 LYS 25 31.836 10.728 -4.919
215 HD3 LYS 25 HD1 LYS 25 31.183 9.116 -5.042
216 HE2 LYS 25 HE2 LYS 25 33.395 9.976 -3.152
217 HE3 LYS 25 HE1 LYS 25 31.713 9.754 -2.702
218 HZ1 LYS 25 HZ1 LYS 25 32.364 7.717 -2.158
219 HZ2 LYS 25 HZ2 LYS 25 33.798 7.803 -3.061
220 HZ3 LYS 25 HZ3 LYS 25 32.338 7.384 -3.817
221 H GLU 26 HN GLU 26 32.898 2.002 -3.744
222 HA GLU 26 HA GLU 26 33.912 3.292 -5.341
223 HB2 GLU 26 HB2 GLU 26 31.619 2.313 -7.060
224 HB3 GLU 26 HB1 GLU 26 33.079 3.098 -7.654
225 HG2 GLU 26 HG2 GLU 26 33.283 0.663 -7.867
226 HG3 GLU 26 HG1 GLU 26 34.443 1.268 -6.688
227 H PHE 27 HN PHE 27 31.849 -0.476 -3.398
228 HA PHE 27 HA PHE 27 29.505 1.311 -3.077
229 HB2 PHE 27 HB2 PHE 27 32.325 1.557 -2.018
230 HB3 PHE 27 HB1 PHE 27 31.094 2.795 -1.857
231 HD1 PHE 27 HD1 PHE 27 32.204 2.175 0.545
232 HD2 PHE 27 HD2 PHE 27 29.245 -0.188 -1.494
233 HE1 PHE 27 HE1 PHE 27 31.449 1.240 2.695
234 HE2 PHE 27 HE2 PHE 27 28.494 -1.091 0.658
235 HZ PHE 27 HZ PHE 27 29.606 -0.388 2.738
236 H LYS 28 HN LYS 28 31.202 -3.899 -2.625
237 HA LYS 28 HA LYS 28 31.588 -2.413 -4.339
238 HB2 LYS 28 HB2 LYS 28 28.754 -3.152 -5.089
239 HB3 LYS 28 HB1 LYS 28 29.942 -2.417 -6.153
240 HG2 LYS 28 HG2 LYS 28 30.202 -5.156 -4.869
241 HG3 LYS 28 HG1 LYS 28 29.731 -4.861 -6.537
242 HD2 LYS 28 HD2 LYS 28 31.942 -3.778 -6.942
243 HD3 LYS 28 HD1 LYS 28 32.414 -4.168 -5.291
244 HE2 LYS 28 HE2 LYS 28 32.083 -6.559 -5.731
245 HE3 LYS 28 HE1 LYS 28 31.620 -6.188 -7.392
246 HZ1 LYS 28 HZ1 LYS 28 34.151 -5.093 -6.456
247 HZ2 LYS 28 HZ2 LYS 28 33.730 -5.713 -7.980
248 HZ3 LYS 28 HZ3 LYS 28 34.096 -6.771 -6.701
249 H HIS 29 HN HIS 29 30.951 -5.820 -0.660
250 HA HIS 29 HA HIS 29 28.885 -5.636 -1.622
251 HB2 HIS 29 HB2 HIS 29 28.546 -4.968 0.744
252 HB3 HIS 29 HB1 HIS 29 28.787 -3.295 0.282
253 HD2 HIS 29 HD2 HIS 29 25.923 -5.625 0.795
254 HE1 HIS 29 HE1 HIS 29 24.505 -2.885 -2.079
255 HE2 HIS 29 HE2 HIS 29 23.817 -4.714 -0.455
256 H1 ACE 30 HA2 ACE 30 32.833 -5.192 0.417
257 H2 ACE 30 HA3 ACE 30 33.213 -3.477 0.580
258 H3 ACE 30 HA1 ACE 30 33.521 -4.307 -0.945
Start of MODEL 4
1 HN1 NH2 0 H1 THR 1 26.744 -0.861 9.289
2 HN2 NH2 0 H2 THR 1 28.422 -0.756 9.057
3 H THR 1 HN THR 1 24.632 -3.177 10.521
4 HA THR 1 HA THR 1 26.241 -2.003 11.816
5 HB THR 1 HB THR 1 26.233 -4.335 12.458
6 HG1 THR 1 HG1 THR 1 28.455 -2.761 12.492
7 HG21 THR 1 HG21 THR 1 28.326 -5.639 11.364
8 HG22 THR 1 HG22 THR 1 27.882 -4.642 9.982
9 HG23 THR 1 HG23 THR 1 26.700 -5.740 10.693
10 H GLU 2 HN GLU 2 24.357 -3.928 5.957
11 HA GLU 2 HA GLU 2 23.661 -2.990 8.360
12 HB2 GLU 2 HB2 GLU 2 23.968 -5.233 9.279
13 HB3 GLU 2 HB1 GLU 2 23.319 -5.331 7.646
14 HG2 GLU 2 HG2 GLU 2 26.239 -5.696 8.410
15 HG3 GLU 2 HG1 GLU 2 25.122 -6.981 7.979
16 H ILE 3 HN ILE 3 23.869 -0.981 4.452
17 HA ILE 3 HA ILE 3 25.651 -3.214 4.254
18 HB ILE 3 HB ILE 3 27.702 -1.941 4.898
19 HG12 ILE 3 HG12 ILE 3 26.107 0.454 3.960
20 HG13 ILE 3 HG11 ILE 3 26.646 0.174 5.609
21 HG21 ILE 3 HG21 ILE 3 26.762 -1.050 2.183
22 HG22 ILE 3 HG22 ILE 3 27.148 -2.744 2.524
23 HG23 ILE 3 HG23 ILE 3 28.385 -1.501 2.693
24 HD11 ILE 3 HD11 ILE 3 29.014 0.047 4.687
25 HD12 ILE 3 HD12 ILE 3 28.258 1.640 4.641
26 HD13 ILE 3 HD13 ILE 3 28.356 0.667 3.172
27 H ARG 4 HN ARG 4 24.347 0.616 1.522
28 HA ARG 4 HA ARG 4 22.235 -1.008 2.727
29 HB2 ARG 4 HB2 ARG 4 23.465 -1.686 0.031
30 HB3 ARG 4 HB1 ARG 4 22.387 -2.729 0.952
31 HG2 ARG 4 HG2 ARG 4 20.583 -1.061 0.758
32 HG3 ARG 4 HG1 ARG 4 21.660 0.012 -0.130
33 HD2 ARG 4 HD2 ARG 4 20.243 -1.194 -1.693
34 HD3 ARG 4 HD1 ARG 4 21.921 -1.682 -1.887
35 HE ARG 4 HE ARG 4 20.658 -3.459 -0.092
36 HH11 ARG 4 HH11 ARG 4 19.958 -5.483 -0.892
37 HH12 ARG 4 HH12 ARG 4 19.747 -5.708 -2.594
38 HH21 ARG 4 HH21 ARG 4 20.668 -2.469 -3.405
39 HH22 ARG 4 HH22 ARG 4 20.146 -4.004 -4.016
40 H VAL 5 HN VAL 5 21.565 2.981 -0.002
41 HA VAL 5 HA VAL 5 24.056 2.716 1.144
42 HB VAL 5 HB VAL 5 23.521 4.504 2.632
43 HG11 VAL 5 HG11 VAL 5 21.593 4.539 4.035
44 HG12 VAL 5 HG12 VAL 5 21.224 2.856 3.680
45 HG13 VAL 5 HG13 VAL 5 21.005 4.090 2.435
46 HG21 VAL 5 HG21 VAL 5 24.604 3.436 4.320
47 HG22 VAL 5 HG22 VAL 5 24.408 1.951 3.407
48 HG23 VAL 5 HG23 VAL 5 23.220 2.387 4.631
49 H8 4FU 6 HAM 4FU 6 19.642 5.716 -1.534
50 H9 4FU 6 HAI 4FU 6 20.248 3.120 -0.072
51 HAI 4FU 6 HAJ 4FU 6 18.720 3.596 -0.828
52 H112 4FU 6 HAE 4FU 6 19.741 3.660 -3.032
53 H111 4FU 6 HAF 4FU 6 20.023 2.074 -2.278
54 HAG 4FU 6 HAG 4FU 6 22.292 2.798 -1.603
55 H12 4FU 6 HAH 4FU 6 22.065 2.935 -3.361
56 HAL 4FU 6 HAL 4FU 6 21.542 5.333 -3.109
57 HAK 4FU 6 HAK 4FU 6 23.156 4.962 -2.462
58 H14 4FU 6 HAN 4FU 6 21.882 6.439 -0.952
59 H GLY 7 HN GLY 7 21.530 6.457 0.984
60 HA2 GLY 7 HA2 GLY 7 19.736 7.802 2.480
61 HA3 GLY 7 HA1 GLY 7 19.577 6.185 3.133
62 H VAL 8 HN VAL 8 22.642 5.988 2.438
63 HA VAL 8 HA VAL 8 24.575 6.148 3.725
64 HB VAL 8 HB VAL 8 23.408 8.845 4.442
65 HG11 VAL 8 HG11 VAL 8 26.000 9.271 4.643
66 HG12 VAL 8 HG12 VAL 8 26.084 7.523 4.867
67 HG13 VAL 8 HG13 VAL 8 25.147 8.512 5.983
68 HG21 VAL 8 HG21 VAL 8 23.621 8.716 2.065
69 HG22 VAL 8 HG22 VAL 8 25.149 7.844 2.178
70 HG23 VAL 8 HG23 VAL 8 25.072 9.550 2.623
71 H THR 9 HN THR 9 23.341 4.445 4.910
72 HA THR 9 HA THR 9 23.256 5.089 7.774
73 HB THR 9 HB THR 9 21.164 3.825 8.063
74 HG1 THR 9 HG1 THR 9 20.267 2.833 6.442
75 HG21 THR 9 HG21 THR 9 21.211 6.308 7.690
76 HG22 THR 9 HG22 THR 9 19.688 5.525 7.273
77 HG23 THR 9 HG23 THR 9 20.815 5.996 6.001
78 H ILE 10 HN ILE 10 22.279 2.644 8.611
79 HA ILE 10 HA ILE 10 24.567 0.864 8.025
80 HB ILE 10 HB ILE 10 22.597 0.857 10.326
81 HG12 ILE 10 HG12 ILE 10 24.567 1.574 11.674
82 HG13 ILE 10 HG11 ILE 10 25.511 1.709 10.194
83 HG21 ILE 10 HG21 ILE 10 24.984 -0.838 9.637
84 HG22 ILE 10 HG22 ILE 10 23.336 -1.361 9.987
85 HG23 ILE 10 HG23 ILE 10 24.353 -0.727 11.280
86 HD11 ILE 10 HD11 ILE 10 24.262 3.815 11.273
87 HD12 ILE 10 HD12 ILE 10 22.920 3.206 10.309
88 HD13 ILE 10 HD13 ILE 10 24.444 3.643 9.531
89 H ARG 11 HN ARG 11 21.074 0.820 8.522
90 HA ARG 11 HA ARG 11 20.363 -1.762 8.110
91 HB2 ARG 11 HB2 ARG 11 18.970 0.619 6.865
92 HB3 ARG 11 HB1 ARG 11 18.243 -0.947 7.195
93 HG2 ARG 11 HG2 ARG 11 19.328 0.964 9.290
94 HG3 ARG 11 HG1 ARG 11 17.627 0.729 8.913
95 HD2 ARG 11 HD2 ARG 11 19.505 -1.367 10.061
96 HD3 ARG 11 HD1 ARG 11 18.225 -0.530 10.912
97 HE ARG 11 HE ARG 11 17.070 -1.763 8.679
98 HH11 ARG 11 HH11 ARG 11 15.980 -3.738 8.944
99 HH12 ARG 11 HH12 ARG 11 16.325 -4.734 10.318
100 HH21 ARG 11 HH21 ARG 11 18.684 -2.558 11.634
101 HH22 ARG 11 HH22 ARG 11 17.856 -4.066 11.842
102 H MET 12 HN MET 12 19.483 -2.882 6.242
103 HA MET 12 HA MET 12 20.365 -2.083 3.619
104 HB2 MET 12 HB2 MET 12 21.872 -4.030 3.328
105 HB3 MET 12 HB1 MET 12 22.468 -2.850 4.486
106 HG2 MET 12 HG2 MET 12 22.779 -5.100 5.385
107 HG3 MET 12 HG1 MET 12 21.589 -4.244 6.345
108 HE1 MET 12 HE1 MET 12 20.386 -7.907 6.552
109 HE2 MET 12 HE2 MET 12 20.872 -6.457 7.426
110 HE3 MET 12 HE3 MET 12 22.058 -7.333 6.462
111 H ARG 13 HN ARG 13 20.179 -4.075 2.081
112 HA ARG 13 HA ARG 13 18.102 -5.960 2.791
113 HB2 ARG 13 HB2 ARG 13 16.545 -5.242 1.039
114 HB3 ARG 13 HB1 ARG 13 16.770 -3.977 2.246
115 HG2 ARG 13 HG2 ARG 13 18.421 -2.876 0.787
116 HG3 ARG 13 HG1 ARG 13 18.183 -4.132 -0.425
117 HD2 ARG 13 HD2 ARG 13 16.044 -2.252 0.611
118 HD3 ARG 13 HD1 ARG 13 16.830 -2.143 -0.961
119 HE ARG 13 HE ARG 13 14.665 -3.863 -0.285
120 HH11 ARG 13 HH11 ARG 13 14.055 -5.470 -1.761
121 HH12 ARG 13 HH12 ARG 13 15.128 -5.914 -3.045
122 HH21 ARG 13 HH21 ARG 13 17.598 -3.666 -2.117
123 HH22 ARG 13 HH22 ARG 13 17.133 -4.895 -3.247
124 H DAL 14 HN ALA 14 17.442 -7.148 0.627
125 HA DAL 14 HA ALA 14 19.785 -7.481 -1.134
126 HB1 DAL 14 HB1 ALA 14 17.016 -8.583 -1.557
127 HB2 DAL 14 HB2 ALA 14 18.301 -8.382 -2.749
128 HB3 DAL 14 HB3 ALA 14 17.486 -6.967 -2.084
129 H SER 15 HN SER 15 18.326 -10.062 -1.854
130 HA SER 15 HA SER 15 18.617 -11.850 0.313
131 HB2 SER 15 HB2 SER 15 18.611 -12.391 -2.656
132 HB3 SER 15 HB1 SER 15 18.473 -13.623 -1.405
133 HG SER 15 HG SER 15 16.746 -11.396 -1.444
134 H HIS 16 HN HIS 16 20.705 -10.908 -2.327
135 HA HIS 16 HA HIS 16 23.078 -11.570 -0.847
136 HB2 HIS 16 HB2 HIS 16 22.426 -13.818 -1.630
137 HB3 HIS 16 HB1 HIS 16 22.418 -13.229 -3.292
138 HD2 HIS 16 HD2 HIS 16 25.399 -11.576 -1.717
139 HE1 HIS 16 HE1 HIS 16 26.872 -15.271 -3.128
140 HE2 HIS 16 HE2 HIS 16 27.531 -12.980 -2.254
141 H DAL 17 HN ALA 17 22.600 -9.163 -1.646
142 HA DAL 17 HA ALA 17 23.120 -8.326 -4.250
143 HB1 DAL 17 HB1 ALA 17 25.268 -9.362 -4.229
144 HB2 DAL 17 HB2 ALA 17 25.622 -8.750 -2.621
145 HB3 DAL 17 HB3 ALA 17 25.546 -7.644 -3.992
146 H PHE 18 HN PHE 18 25.284 -6.507 -2.751
147 HA PHE 18 HA PHE 18 23.237 -4.650 -1.674
148 HB2 PHE 18 HB2 PHE 18 26.025 -5.138 -0.616
149 HB3 PHE 18 HB1 PHE 18 24.907 -3.925 -0.005
150 HD1 PHE 18 HD1 PHE 18 25.010 -7.628 -0.726
151 HD2 PHE 18 HD2 PHE 18 23.616 -4.508 1.860
152 HE1 PHE 18 HE1 PHE 18 23.997 -9.318 0.749
153 HE2 PHE 18 HE2 PHE 18 22.617 -6.214 3.348
154 HZ PHE 18 HZ PHE 18 22.806 -8.605 2.790
155 H TRP 19 HN TRP 19 23.260 -2.678 -2.561
156 HA TRP 19 HA TRP 19 25.675 -1.797 -4.051
157 HB2 TRP 19 HB2 TRP 19 22.786 -1.456 -4.878
158 HB3 TRP 19 HB1 TRP 19 24.170 -0.737 -5.696
159 HD1 TRP 19 HD1 TRP 19 23.175 -4.318 -4.555
160 HE1 TRP 19 HE1 TRP 19 23.820 -5.941 -6.456
161 HE3 TRP 19 HE3 TRP 19 25.218 -1.015 -7.885
162 HZ2 TRP 19 HZ2 TRP 19 25.042 -5.852 -9.041
163 HZ3 TRP 19 HZ3 TRP 19 26.112 -1.815 -10.048
164 HH2 TRP 19 HH2 TRP 19 26.029 -4.225 -10.633
165 H VAL 20 HN VAL 20 26.158 0.352 -4.031
166 HA VAL 20 HA VAL 20 24.416 2.336 -2.919
167 HB VAL 20 HB VAL 20 25.195 1.286 -0.829
168 HG11 VAL 20 HG11 VAL 20 27.400 0.813 -0.367
169 HG12 VAL 20 HG12 VAL 20 27.999 2.242 -1.207
170 HG13 VAL 20 HG13 VAL 20 27.548 0.810 -2.122
171 HG21 VAL 20 HG21 VAL 20 24.732 3.696 -0.877
172 HG22 VAL 20 HG22 VAL 20 26.381 4.026 -1.395
173 HG23 VAL 20 HG23 VAL 20 26.081 3.366 0.209
174 H GLN 21 HN GLN 21 24.817 3.426 -4.796
175 HA GLN 21 HA GLN 21 27.593 4.192 -5.445
176 HB2 GLN 21 HB2 GLN 21 25.028 4.578 -7.017
177 HB3 GLN 21 HB1 GLN 21 26.623 5.064 -7.549
178 HG2 GLN 21 HG2 GLN 21 26.055 2.987 -8.637
179 HG3 GLN 21 HG1 GLN 21 27.327 2.666 -7.472
180 HE21 GLN 21 HE21 GLN 21 24.400 1.505 -8.603
181 HE22 GLN 21 HE22 GLN 21 23.946 0.570 -7.261
182 H VAL 22 HN VAL 22 28.108 5.838 -4.037
183 HA VAL 22 HA VAL 22 26.542 8.316 -4.306
184 HB VAL 22 HB VAL 22 26.394 8.564 -1.791
185 HG11 VAL 22 HG11 VAL 22 24.578 7.471 -3.242
186 HG12 VAL 22 HG12 VAL 22 24.535 7.107 -1.518
187 HG13 VAL 22 HG13 VAL 22 25.188 5.925 -2.650
188 HG21 VAL 22 HG21 VAL 22 26.740 6.319 -0.546
189 HG22 VAL 22 HG22 VAL 22 28.172 7.249 -0.976
190 HG23 VAL 22 HG23 VAL 22 27.714 5.848 -1.940
191 HA DPR 23 HA PRO 23 30.010 10.566 -2.157
192 HB2 DPR 23 HB2 PRO 23 30.060 12.644 -3.225
193 HB3 DPR 23 HB1 PRO 23 29.701 11.940 -4.818
194 HG2 DPR 23 HG2 PRO 23 27.865 12.406 -2.503
195 HG3 DPR 23 HG1 PRO 23 27.601 12.732 -4.227
196 HD2 DPR 23 HD2 PRO 23 26.635 10.489 -2.971
197 HD3 DPR 23 HD1 PRO 23 27.049 10.531 -4.697
198 HAC 4G6 24 HAC 4G6 24 34.248 6.964 -2.782
199 HAB 4G6 24 HAB 4G6 24 32.578 7.067 -2.174
200 HAA 4G6 24 HAA 4G6 24 32.897 6.394 -3.791
201 HAF 4G6 24 HAF 4G6 24 33.979 10.402 -3.089
202 HAD 4G6 24 HAD 4G6 24 35.045 9.329 -4.030
203 HAE 4G6 24 HAE 4G6 24 34.699 8.968 -2.321
204 HAL 4G6 24 HAL 4G6 24 31.614 9.063 -2.210
205 HAH 4G6 24 HAH 4G6 24 34.022 7.927 -5.498
206 HAG 4G6 24 HAG 4G6 24 33.034 9.393 -5.639
207 HAI 4G6 24 HAI 4G6 24 31.400 7.059 -5.035
208 H LYS 25 HN LYS 25 31.368 4.815 -8.106
209 HA LYS 25 HA LYS 25 30.393 6.830 -8.413
210 HB2 LYS 25 HB2 LYS 25 28.507 6.249 -6.884
211 HB3 LYS 25 HB1 LYS 25 29.499 6.737 -5.535
212 HG2 LYS 25 HG2 LYS 25 27.953 8.530 -6.149
213 HG3 LYS 25 HG1 LYS 25 29.626 9.007 -6.324
214 HD2 LYS 25 HD2 LYS 25 28.223 9.837 -8.170
215 HD3 LYS 25 HD1 LYS 25 29.487 8.788 -8.760
216 HE2 LYS 25 HE2 LYS 25 26.611 7.938 -8.296
217 HE3 LYS 25 HE1 LYS 25 27.262 8.418 -9.855
218 HZ1 LYS 25 HZ1 LYS 25 28.274 6.459 -10.127
219 HZ2 LYS 25 HZ2 LYS 25 27.168 5.903 -8.970
220 HZ3 LYS 25 HZ3 LYS 25 28.740 6.321 -8.511
221 H GLU 26 HN GLU 26 29.805 1.796 -6.030
222 HA GLU 26 HA GLU 26 32.468 3.012 -5.919
223 HB2 GLU 26 HB2 GLU 26 30.566 2.705 -8.253
224 HB3 GLU 26 HB1 GLU 26 32.197 3.363 -8.332
225 HG2 GLU 26 HG2 GLU 26 32.215 1.024 -9.038
226 HG3 GLU 26 HG1 GLU 26 33.107 1.209 -7.531
227 H PHE 27 HN PHE 27 30.937 -0.928 -4.964
228 HA PHE 27 HA PHE 27 29.017 0.982 -3.927
229 HB2 PHE 27 HB2 PHE 27 30.228 1.357 -1.828
230 HB3 PHE 27 HB1 PHE 27 29.565 -0.262 -1.914
231 HD1 PHE 27 HD1 PHE 27 31.343 -0.085 0.096
232 HD2 PHE 27 HD2 PHE 27 32.379 -0.426 -4.066
233 HE1 PHE 27 HE1 PHE 27 33.533 -1.029 0.702
234 HE2 PHE 27 HE2 PHE 27 34.554 -1.355 -3.444
235 HZ PHE 27 HZ PHE 27 35.127 -1.655 -1.069
236 H LYS 28 HN LYS 28 28.945 -4.665 -4.444
237 HA LYS 28 HA LYS 28 30.183 -2.693 -5.957
238 HB2 LYS 28 HB2 LYS 28 27.243 -3.294 -5.643
239 HB3 LYS 28 HB1 LYS 28 27.906 -2.200 -6.847
240 HG2 LYS 28 HG2 LYS 28 27.469 -4.395 -7.843
241 HG3 LYS 28 HG1 LYS 28 29.193 -4.067 -7.835
242 HD2 LYS 28 HD2 LYS 28 29.502 -5.539 -5.912
243 HD3 LYS 28 HD1 LYS 28 27.760 -5.796 -5.788
244 HE2 LYS 28 HE2 LYS 28 27.786 -6.806 -8.045
245 HE3 LYS 28 HE1 LYS 28 29.526 -6.536 -8.141
246 HZ1 LYS 28 HZ1 LYS 28 28.071 -8.308 -6.265
247 HZ2 LYS 28 HZ2 LYS 28 29.704 -7.888 -6.061
248 HZ3 LYS 28 HZ3 LYS 28 29.213 -8.752 -7.438
249 H HIS 29 HN HIS 29 32.439 -6.234 -2.215
250 HA HIS 29 HA HIS 29 29.861 -5.770 -2.873
251 HB2 HIS 29 HB2 HIS 29 30.712 -5.558 -0.592
252 HB3 HIS 29 HB1 HIS 29 31.527 -4.053 -1.024
253 HD2 HIS 29 HD2 HIS 29 28.191 -5.085 0.407
254 HE1 HIS 29 HE1 HIS 29 27.443 -1.408 -1.506
255 HE2 HIS 29 HE2 HIS 29 26.520 -3.102 0.137
256 H1 ACE 30 HA2 ACE 30 33.806 -7.093 -5.400
257 H2 ACE 30 HA3 ACE 30 33.591 -7.750 -3.777
258 H3 ACE 30 HA1 ACE 30 34.487 -6.248 -4.010
Start of MODEL 5
1 HN1 NH2 0 H1 THR 1 19.908 -7.622 11.745
2 HN2 NH2 0 H2 THR 1 19.808 -7.019 13.328
3 H THR 1 HN THR 1 22.743 -4.333 11.339
4 HA THR 1 HA THR 1 20.636 -5.644 9.999
5 HB THR 1 HB THR 1 22.432 -7.097 9.215
6 HG1 THR 1 HG1 THR 1 20.401 -8.004 9.748
7 HG21 THR 1 HG21 THR 1 23.015 -7.474 12.164
8 HG22 THR 1 HG22 THR 1 24.105 -6.839 10.931
9 HG23 THR 1 HG23 THR 1 23.631 -8.534 10.900
10 H GLU 2 HN GLU 2 23.538 -2.943 7.304
11 HA GLU 2 HA GLU 2 24.848 -3.685 9.706
12 HB2 GLU 2 HB2 GLU 2 23.265 -2.597 11.294
13 HB3 GLU 2 HB1 GLU 2 24.361 -1.495 10.478
14 HG2 GLU 2 HG2 GLU 2 22.132 -0.520 10.557
15 HG3 GLU 2 HG1 GLU 2 22.552 -0.888 8.893
16 H ILE 3 HN ILE 3 26.801 -0.036 7.064
17 HA ILE 3 HA ILE 3 24.352 -1.187 6.017
18 HB ILE 3 HB ILE 3 25.404 -3.372 5.516
19 HG12 ILE 3 HG12 ILE 3 27.853 -3.450 5.061
20 HG13 ILE 3 HG11 ILE 3 28.022 -1.854 5.772
21 HG21 ILE 3 HG21 ILE 3 24.940 -1.571 3.789
22 HG22 ILE 3 HG22 ILE 3 26.145 -2.773 3.328
23 HG23 ILE 3 HG23 ILE 3 26.658 -1.174 3.866
24 HD11 ILE 3 HD11 ILE 3 27.809 -2.652 7.917
25 HD12 ILE 3 HD12 ILE 3 28.420 -4.115 7.163
26 HD13 ILE 3 HD13 ILE 3 26.694 -3.940 7.449
27 H ARG 4 HN ARG 4 25.481 3.027 4.251
28 HA ARG 4 HA ARG 4 27.828 1.719 5.456
29 HB2 ARG 4 HB2 ARG 4 25.539 2.946 7.024
30 HB3 ARG 4 HB1 ARG 4 26.837 1.962 7.701
31 HG2 ARG 4 HG2 ARG 4 28.497 3.617 6.925
32 HG3 ARG 4 HG1 ARG 4 27.196 4.604 6.258
33 HD2 ARG 4 HD2 ARG 4 26.208 4.821 8.511
34 HD3 ARG 4 HD1 ARG 4 27.517 3.847 9.176
35 HE ARG 4 HE ARG 4 28.641 6.014 7.772
36 HH11 ARG 4 HH11 ARG 4 29.378 7.818 8.943
37 HH12 ARG 4 HH12 ARG 4 28.786 8.103 10.546
38 HH21 ARG 4 HH21 ARG 4 26.730 5.312 10.568
39 HH22 ARG 4 HH22 ARG 4 27.287 6.684 11.465
40 H VAL 5 HN VAL 5 28.660 5.472 2.463
41 HA VAL 5 HA VAL 5 25.849 4.957 3.096
42 HB VAL 5 HB VAL 5 25.819 2.897 1.747
43 HG11 VAL 5 HG11 VAL 5 26.538 5.210 -0.057
44 HG12 VAL 5 HG12 VAL 5 25.073 5.245 0.920
45 HG13 VAL 5 HG13 VAL 5 25.292 3.983 -0.283
46 HG21 VAL 5 HG21 VAL 5 28.353 3.964 0.469
47 HG22 VAL 5 HG22 VAL 5 27.551 2.430 0.139
48 HG23 VAL 5 HG23 VAL 5 28.360 2.683 1.681
49 H8 4FU 6 HAM 4FU 6 29.288 7.618 3.613
50 H9 4FU 6 HAI 4FU 6 30.404 9.979 3.297
51 HAI 4FU 6 HAJ 4FU 6 31.017 8.574 2.407
52 H112 4FU 6 HAE 4FU 6 30.282 9.351 0.385
53 H111 4FU 6 HAF 4FU 6 30.508 10.905 1.214
54 HAG 4FU 6 HAG 4FU 6 28.106 10.899 1.846
55 H12 4FU 6 HAH 4FU 6 28.342 10.851 0.085
56 HAL 4FU 6 HAL 4FU 6 27.558 8.711 -0.105
57 HAK 4FU 6 HAK 4FU 6 26.656 9.189 1.345
58 H14 4FU 6 HAN 4FU 6 29.071 7.418 1.095
59 H GLY 7 HN GLY 7 26.478 8.041 3.481
60 HA2 GLY 7 HA2 GLY 7 26.197 10.052 5.515
61 HA3 GLY 7 HA1 GLY 7 25.486 10.559 3.999
62 H VAL 8 HN VAL 8 24.658 7.799 3.343
63 HA VAL 8 HA VAL 8 22.282 7.687 5.110
64 HB VAL 8 HB VAL 8 21.783 8.065 2.752
65 HG11 VAL 8 HG11 VAL 8 23.228 5.436 2.315
66 HG12 VAL 8 HG12 VAL 8 23.770 7.021 1.762
67 HG13 VAL 8 HG13 VAL 8 22.311 6.305 1.086
68 HG21 VAL 8 HG21 VAL 8 20.128 6.364 2.515
69 HG22 VAL 8 HG22 VAL 8 20.355 6.558 4.253
70 HG23 VAL 8 HG23 VAL 8 21.095 5.196 3.414
71 H THR 9 HN THR 9 21.372 5.574 5.633
72 HA THR 9 HA THR 9 23.451 3.482 5.941
73 HB THR 9 HB THR 9 21.144 4.188 7.768
74 HG1 THR 9 HG1 THR 9 23.767 4.251 8.611
75 HG21 THR 9 HG21 THR 9 21.524 1.835 7.873
76 HG22 THR 9 HG22 THR 9 22.343 2.535 9.269
77 HG23 THR 9 HG23 THR 9 23.273 2.052 7.851
78 H ILE 10 HN ILE 10 23.006 1.548 5.073
79 HA ILE 10 HA ILE 10 20.273 1.047 4.060
80 HB ILE 10 HB ILE 10 22.898 -0.239 3.273
81 HG12 ILE 10 HG12 ILE 10 22.512 0.923 1.112
82 HG13 ILE 10 HG11 ILE 10 21.094 1.708 1.795
83 HG21 ILE 10 HG21 ILE 10 21.402 -1.121 1.379
84 HG22 ILE 10 HG22 ILE 10 20.039 -0.670 2.404
85 HG23 ILE 10 HG23 ILE 10 21.205 -1.868 2.964
86 HD11 ILE 10 HD11 ILE 10 23.491 2.888 1.757
87 HD12 ILE 10 HD12 ILE 10 23.672 2.020 3.278
88 HD13 ILE 10 HD13 ILE 10 22.346 3.165 3.060
89 H ARG 11 HN ARG 11 19.034 -0.380 5.003
90 HA ARG 11 HA ARG 11 19.846 -1.921 7.220
91 HB2 ARG 11 HB2 ARG 11 17.550 -2.821 7.100
92 HB3 ARG 11 HB1 ARG 11 17.575 -1.060 6.983
93 HG2 ARG 11 HG2 ARG 11 17.455 -1.227 4.517
94 HG3 ARG 11 HG1 ARG 11 17.394 -2.986 4.645
95 HD2 ARG 11 HD2 ARG 11 15.385 -1.070 5.848
96 HD3 ARG 11 HD1 ARG 11 15.138 -2.025 4.389
97 HE ARG 11 HE ARG 11 15.834 -3.789 6.454
98 HH11 ARG 11 HH11 ARG 11 14.168 -4.949 7.488
99 HH12 ARG 11 HH12 ARG 11 12.547 -4.341 7.444
100 HH21 ARG 11 HH21 ARG 11 13.395 -1.530 5.583
101 HH22 ARG 11 HH22 ARG 11 12.103 -2.392 6.359
102 H MET 12 HN MET 12 19.274 -4.362 7.271
103 HA MET 12 HA MET 12 20.958 -5.673 5.355
104 HB2 MET 12 HB2 MET 12 20.773 -6.380 7.729
105 HB3 MET 12 HB1 MET 12 19.101 -6.840 7.451
106 HG2 MET 12 HG2 MET 12 21.486 -8.055 6.018
107 HG3 MET 12 HG1 MET 12 20.667 -8.785 7.392
108 HE1 MET 12 HE1 MET 12 19.756 -11.016 4.328
109 HE2 MET 12 HE2 MET 12 20.236 -11.046 6.022
110 HE3 MET 12 HE3 MET 12 21.260 -10.237 4.839
111 H ARG 13 HN ARG 13 20.184 -5.617 3.319
112 HA ARG 13 HA ARG 13 18.158 -7.413 2.568
113 HB2 ARG 13 HB2 ARG 13 16.629 -5.686 3.363
114 HB3 ARG 13 HB1 ARG 13 17.453 -4.472 2.396
115 HG2 ARG 13 HG2 ARG 13 15.376 -5.138 1.294
116 HG3 ARG 13 HG1 ARG 13 16.752 -5.655 0.329
117 HD2 ARG 13 HD2 ARG 13 16.504 -7.957 1.163
118 HD3 ARG 13 HD1 ARG 13 15.189 -7.451 2.220
119 HE ARG 13 HE ARG 13 14.531 -6.760 -0.433
120 HH11 ARG 13 HH11 ARG 13 13.126 -8.101 -1.598
121 HH12 ARG 13 HH12 ARG 13 12.913 -9.751 -1.120
122 HH21 ARG 13 HH21 ARG 13 15.112 -9.534 1.554
123 HH22 ARG 13 HH22 ARG 13 14.040 -10.563 0.666
124 H DAL 14 HN ALA 14 18.817 -8.156 0.643
125 HA DAL 14 HA ALA 14 20.888 -6.923 -0.860
126 HB1 DAL 14 HB1 ALA 14 18.123 -6.771 -2.090
127 HB2 DAL 14 HB2 ALA 14 19.636 -6.336 -2.882
128 HB3 DAL 14 HB3 ALA 14 19.054 -5.389 -1.515
129 H SER 15 HN SER 15 20.218 -7.953 -3.398
130 HA SER 15 HA SER 15 19.644 -10.773 -3.041
131 HB2 SER 15 HB2 SER 15 20.545 -9.256 -5.493
132 HB3 SER 15 HB1 SER 15 20.030 -10.939 -5.450
133 HG SER 15 HG SER 15 18.479 -8.674 -4.708
134 H HIS 16 HN HIS 16 21.179 -11.867 -2.067
135 HA HIS 16 HA HIS 16 23.294 -12.434 -1.291
136 HB2 HIS 16 HB2 HIS 16 24.601 -13.548 -3.049
137 HB3 HIS 16 HB1 HIS 16 22.893 -13.962 -3.156
138 HD2 HIS 16 HD2 HIS 16 25.596 -12.883 -5.515
139 HE1 HIS 16 HE1 HIS 16 22.044 -11.412 -7.257
140 HE2 HIS 16 HE2 HIS 16 24.505 -11.881 -7.666
141 H DAL 17 HN ALA 17 23.029 -9.503 -1.852
142 HA DAL 17 HA ALA 17 25.479 -8.668 -3.090
143 HB1 DAL 17 HB1 ALA 17 26.591 -9.501 -1.180
144 HB2 DAL 17 HB2 ALA 17 25.359 -8.877 -0.088
145 HB3 DAL 17 HB3 ALA 17 26.456 -7.765 -0.914
146 H PHE 18 HN PHE 18 25.939 -6.278 -1.870
147 HA PHE 18 HA PHE 18 23.365 -4.845 -2.260
148 HB2 PHE 18 HB2 PHE 18 25.568 -4.132 -0.324
149 HB3 PHE 18 HB1 PHE 18 24.194 -3.105 -0.698
150 HD1 PHE 18 HD1 PHE 18 24.865 -6.664 0.338
151 HD2 PHE 18 HD2 PHE 18 22.391 -3.196 0.774
152 HE1 PHE 18 HE1 PHE 18 23.531 -7.838 2.052
153 HE2 PHE 18 HE2 PHE 18 21.063 -4.357 2.493
154 HZ PHE 18 HZ PHE 18 21.632 -6.679 3.129
155 H TRP 19 HN TRP 19 23.443 -2.948 -3.391
156 HA TRP 19 HA TRP 19 26.014 -2.255 -4.707
157 HB2 TRP 19 HB2 TRP 19 23.216 -2.192 -5.855
158 HB3 TRP 19 HB1 TRP 19 24.636 -1.516 -6.646
159 HD1 TRP 19 HD1 TRP 19 23.792 -4.938 -5.010
160 HE1 TRP 19 HE1 TRP 19 24.681 -6.782 -6.585
161 HE3 TRP 19 HE3 TRP 19 25.782 -2.036 -8.708
162 HZ2 TRP 19 HZ2 TRP 19 26.056 -6.991 -9.091
163 HZ3 TRP 19 HZ3 TRP 19 26.870 -3.079 -10.673
164 HH2 TRP 19 HH2 TRP 19 27.010 -5.548 -10.872
165 H VAL 20 HN VAL 20 26.580 -0.147 -4.760
166 HA VAL 20 HA VAL 20 24.661 1.810 -3.587
167 HB VAL 20 HB VAL 20 26.623 1.437 -2.134
168 HG11 VAL 20 HG11 VAL 20 28.202 0.770 -3.910
169 HG12 VAL 20 HG12 VAL 20 28.849 2.075 -2.920
170 HG13 VAL 20 HG13 VAL 20 28.200 2.420 -4.521
171 HG21 VAL 20 HG21 VAL 20 27.065 3.711 -1.751
172 HG22 VAL 20 HG22 VAL 20 25.514 3.755 -2.585
173 HG23 VAL 20 HG23 VAL 20 27.000 4.123 -3.459
174 H GLN 21 HN GLN 21 25.175 4.073 -4.336
175 HA GLN 21 HA GLN 21 26.519 4.535 -6.747
176 HB2 GLN 21 HB2 GLN 21 24.519 4.911 -8.202
177 HB3 GLN 21 HB1 GLN 21 24.891 3.234 -7.844
178 HG2 GLN 21 HG2 GLN 21 22.470 3.675 -7.739
179 HG3 GLN 21 HG1 GLN 21 23.096 3.148 -6.192
180 HE21 GLN 21 HE21 GLN 21 21.091 5.414 -7.641
181 HE22 GLN 21 HE22 GLN 21 21.071 6.577 -6.407
182 H VAL 22 HN VAL 22 26.663 5.854 -4.437
183 HA VAL 22 HA VAL 22 24.844 8.061 -4.298
184 HB VAL 22 HB VAL 22 26.500 8.965 -2.592
185 HG11 VAL 22 HG11 VAL 22 25.989 6.007 -2.189
186 HG12 VAL 22 HG12 VAL 22 24.690 7.195 -2.125
187 HG13 VAL 22 HG13 VAL 22 26.022 7.285 -0.975
188 HG21 VAL 22 HG21 VAL 22 28.533 8.102 -3.690
189 HG22 VAL 22 HG22 VAL 22 28.007 6.448 -3.380
190 HG23 VAL 22 HG23 VAL 22 28.415 7.512 -2.033
191 HA DPR 23 HA PRO 23 27.541 11.566 -5.712
192 HB2 DPR 23 HB2 PRO 23 25.996 13.174 -6.416
193 HB3 DPR 23 HB1 PRO 23 24.907 11.958 -7.118
194 HG2 DPR 23 HG2 PRO 23 25.338 12.667 -4.242
195 HG3 DPR 23 HG1 PRO 23 23.818 12.386 -5.112
196 HD2 DPR 23 HD2 PRO 23 25.010 10.465 -3.551
197 HD3 DPR 23 HD1 PRO 23 24.001 10.079 -4.964
198 HAC 4G6 24 HAC 4G6 24 29.201 10.634 -11.054
199 HAB 4G6 24 HAB 4G6 24 27.990 11.548 -10.124
200 HAA 4G6 24 HAA 4G6 24 29.723 11.764 -9.783
201 HAF 4G6 24 HAF 4G6 24 28.594 8.173 -10.273
202 HAD 4G6 24 HAD 4G6 24 27.165 9.229 -10.134
203 HAE 4G6 24 HAE 4G6 24 27.640 8.185 -8.772
204 HAL 4G6 24 HAL 4G6 24 28.995 10.620 -7.028
205 HAH 4G6 24 HAH 4G6 24 31.011 10.197 -8.768
206 HAG 4G6 24 HAG 4G6 24 30.571 8.748 -9.698
207 HAI 4G6 24 HAI 4G6 24 29.857 8.828 -6.807
208 H LYS 25 HN LYS 25 31.939 4.877 -7.006
209 HA LYS 25 HA LYS 25 30.284 6.936 -5.701
210 HB2 LYS 25 HB2 LYS 25 32.460 6.442 -4.596
211 HB3 LYS 25 HB1 LYS 25 33.280 6.765 -6.102
212 HG2 LYS 25 HG2 LYS 25 33.439 8.709 -4.625
213 HG3 LYS 25 HG1 LYS 25 32.524 9.088 -6.072
214 HD2 LYS 25 HD2 LYS 25 31.503 10.081 -4.065
215 HD3 LYS 25 HD1 LYS 25 30.411 8.944 -4.815
216 HE2 LYS 25 HE2 LYS 25 32.171 8.328 -2.422
217 HE3 LYS 25 HE1 LYS 25 30.481 8.789 -2.310
218 HZ1 LYS 25 HZ1 LYS 25 30.174 6.590 -2.315
219 HZ2 LYS 25 HZ2 LYS 25 31.675 6.252 -3.026
220 HZ3 LYS 25 HZ3 LYS 25 30.358 6.713 -3.990
221 H GLU 26 HN GLU 26 29.846 2.305 -4.783
222 HA GLU 26 HA GLU 26 31.155 2.926 -7.335
223 HB2 GLU 26 HB2 GLU 26 28.165 2.713 -6.976
224 HB3 GLU 26 HB1 GLU 26 28.978 3.302 -8.414
225 HG2 GLU 26 HG2 GLU 26 28.303 0.984 -8.748
226 HG3 GLU 26 HG1 GLU 26 30.059 1.087 -8.690
227 H PHE 27 HN PHE 27 32.222 -1.529 -4.555
228 HA PHE 27 HA PHE 27 30.516 0.642 -3.594
229 HB2 PHE 27 HB2 PHE 27 33.510 0.493 -3.981
230 HB3 PHE 27 HB1 PHE 27 32.654 1.856 -3.284
231 HD1 PHE 27 HD1 PHE 27 34.651 1.056 -1.641
232 HD2 PHE 27 HD2 PHE 27 30.870 -0.947 -2.077
233 HE1 PHE 27 HE1 PHE 27 34.894 0.084 0.609
234 HE2 PHE 27 HE2 PHE 27 31.131 -1.902 0.172
235 HZ PHE 27 HZ PHE 27 33.135 -1.388 1.498
236 H LYS 28 HN LYS 28 29.143 -4.734 -4.092
237 HA LYS 28 HA LYS 28 31.431 -3.474 -4.982
238 HB2 LYS 28 HB2 LYS 28 28.647 -3.401 -6.145
239 HB3 LYS 28 HB1 LYS 28 30.111 -2.921 -7.001
240 HG2 LYS 28 HG2 LYS 28 31.037 -5.190 -6.705
241 HG3 LYS 28 HG1 LYS 28 29.572 -5.676 -5.850
242 HD2 LYS 28 HD2 LYS 28 28.228 -5.171 -7.860
243 HD3 LYS 28 HD1 LYS 28 29.691 -4.687 -8.719
244 HE2 LYS 28 HE2 LYS 28 30.614 -6.957 -8.432
245 HE3 LYS 28 HE1 LYS 28 29.155 -7.444 -7.569
246 HZ1 LYS 28 HZ1 LYS 28 29.463 -7.771 -10.175
247 HZ2 LYS 28 HZ2 LYS 28 28.775 -6.218 -10.183
248 HZ3 LYS 28 HZ3 LYS 28 27.947 -7.512 -9.458
249 H HIS 29 HN HIS 29 30.525 -6.680 -0.720
250 HA HIS 29 HA HIS 29 28.584 -5.192 -1.929
251 HB2 HIS 29 HB2 HIS 29 29.166 -5.116 0.482
252 HB3 HIS 29 HB1 HIS 29 30.592 -4.160 0.089
253 HD2 HIS 29 HD2 HIS 29 27.134 -3.472 1.237
254 HE1 HIS 29 HE1 HIS 29 28.092 -0.117 -1.141
255 HE2 HIS 29 HE2 HIS 29 26.470 -1.028 0.589
256 H1 ACE 30 HA2 ACE 30 32.371 -7.991 -1.856
257 H2 ACE 30 HA3 ACE 30 31.907 -8.479 -3.485
258 H3 ACE 30 HA1 ACE 30 30.882 -8.899 -2.114
Start of MODEL 6
1 HN1 NH2 0 H1 THR 1 29.574 -6.170 10.533
2 HN2 NH2 0 H2 THR 1 28.950 -7.304 9.436
3 H THR 1 HN THR 1 25.691 -3.764 11.670
4 HA THR 1 HA THR 1 28.266 -4.344 11.269
5 HB THR 1 HB THR 1 27.155 -4.762 13.424
6 HG1 THR 1 HG1 THR 1 28.175 -7.100 13.490
7 HG21 THR 1 HG21 THR 1 25.284 -6.079 13.459
8 HG22 THR 1 HG22 THR 1 26.364 -7.454 13.259
9 HG23 THR 1 HG23 THR 1 25.621 -6.716 11.845
10 H GLU 2 HN GLU 2 23.767 -2.545 7.589
11 HA GLU 2 HA GLU 2 24.631 -2.301 10.184
12 HB2 GLU 2 HB2 GLU 2 23.273 -4.744 9.029
13 HB3 GLU 2 HB1 GLU 2 23.446 -4.408 10.750
14 HG2 GLU 2 HG2 GLU 2 21.235 -3.706 9.963
15 HG3 GLU 2 HG1 GLU 2 22.182 -2.305 10.459
16 H ILE 3 HN ILE 3 27.223 -0.110 6.762
17 HA ILE 3 HA ILE 3 24.637 -1.215 5.970
18 HB ILE 3 HB ILE 3 25.599 -3.369 5.279
19 HG12 ILE 3 HG12 ILE 3 28.288 -1.968 5.467
20 HG13 ILE 3 HG11 ILE 3 27.728 -3.237 6.556
21 HG21 ILE 3 HG21 ILE 3 26.391 -2.708 3.097
22 HG22 ILE 3 HG22 ILE 3 26.859 -1.118 3.698
23 HG23 ILE 3 HG23 ILE 3 25.158 -1.557 3.597
24 HD11 ILE 3 HD11 ILE 3 27.436 -4.711 4.512
25 HD12 ILE 3 HD12 ILE 3 29.105 -4.305 4.914
26 HD13 ILE 3 HD13 ILE 3 28.288 -3.468 3.594
27 H ARG 4 HN ARG 4 25.673 2.985 4.115
28 HA ARG 4 HA ARG 4 28.058 1.721 5.120
29 HB2 ARG 4 HB2 ARG 4 27.419 1.861 7.504
30 HB3 ARG 4 HB1 ARG 4 27.745 3.445 6.792
31 HG2 ARG 4 HG2 ARG 4 25.360 3.853 6.492
32 HG3 ARG 4 HG1 ARG 4 24.980 2.248 7.089
33 HD2 ARG 4 HD2 ARG 4 24.552 3.943 8.805
34 HD3 ARG 4 HD1 ARG 4 25.813 2.839 9.312
35 HE ARG 4 HE ARG 4 26.055 5.676 8.936
36 HH11 ARG 4 HH11 ARG 4 28.097 6.638 9.007
37 HH12 ARG 4 HH12 ARG 4 29.516 5.647 9.074
38 HH21 ARG 4 HH21 ARG 4 27.755 2.665 9.058
39 HH22 ARG 4 HH22 ARG 4 29.322 3.399 9.099
40 H VAL 5 HN VAL 5 28.494 6.193 3.193
41 HA VAL 5 HA VAL 5 25.788 5.236 3.355
42 HB VAL 5 HB VAL 5 26.176 4.957 0.951
43 HG11 VAL 5 HG11 VAL 5 28.716 4.741 1.300
44 HG12 VAL 5 HG12 VAL 5 27.995 3.680 0.091
45 HG13 VAL 5 HG13 VAL 5 28.405 3.048 1.684
46 HG21 VAL 5 HG21 VAL 5 26.389 2.209 2.191
47 HG22 VAL 5 HG22 VAL 5 25.402 2.731 0.828
48 HG23 VAL 5 HG23 VAL 5 24.959 3.207 2.463
49 H8 4FU 6 HAM 4FU 6 27.982 10.539 2.708
50 H9 4FU 6 HAI 4FU 6 25.823 9.403 0.922
51 HAI 4FU 6 HAJ 4FU 6 25.834 11.079 1.520
52 H112 4FU 6 HAE 4FU 6 27.605 11.693 0.219
53 H111 4FU 6 HAF 4FU 6 26.999 10.373 -0.798
54 HAG 4FU 6 HAG 4FU 6 29.301 9.903 -0.649
55 H12 4FU 6 HAH 4FU 6 29.376 10.410 1.058
56 HAL 4FU 6 HAL 4FU 6 29.421 7.900 0.685
57 HAK 4FU 6 HAK 4FU 6 27.752 8.025 0.081
58 H14 4FU 6 HAN 4FU 6 28.821 8.355 2.849
59 H GLY 7 HN GLY 7 27.439 8.103 4.392
60 HA2 GLY 7 HA2 GLY 7 26.457 7.825 6.461
61 HA3 GLY 7 HA1 GLY 7 25.736 9.410 6.274
62 H VAL 8 HN VAL 8 25.071 7.306 3.699
63 HA VAL 8 HA VAL 8 22.264 7.195 4.440
64 HB VAL 8 HB VAL 8 23.728 6.015 2.064
65 HG11 VAL 8 HG11 VAL 8 21.371 6.024 1.103
66 HG12 VAL 8 HG12 VAL 8 20.793 6.313 2.745
67 HG13 VAL 8 HG13 VAL 8 21.666 4.828 2.365
68 HG21 VAL 8 HG21 VAL 8 21.958 8.469 2.150
69 HG22 VAL 8 HG22 VAL 8 23.046 7.959 0.859
70 HG23 VAL 8 HG23 VAL 8 23.705 8.566 2.378
71 H THR 9 HN THR 9 21.494 5.649 5.776
72 HA THR 9 HA THR 9 23.033 3.271 6.319
73 HB THR 9 HB THR 9 21.674 4.386 8.083
74 HG1 THR 9 HG1 THR 9 21.674 2.442 8.858
75 HG21 THR 9 HG21 THR 9 19.288 4.297 8.015
76 HG22 THR 9 HG22 THR 9 19.312 3.214 6.623
77 HG23 THR 9 HG23 THR 9 19.791 4.902 6.435
78 H ILE 10 HN ILE 10 22.475 1.175 5.886
79 HA ILE 10 HA ILE 10 20.366 0.676 3.867
80 HB ILE 10 HB ILE 10 23.144 -0.507 3.920
81 HG12 ILE 10 HG12 ILE 10 23.144 1.812 3.100
82 HG13 ILE 10 HG11 ILE 10 23.465 0.689 1.785
83 HG21 ILE 10 HG21 ILE 10 20.711 -1.038 2.227
84 HG22 ILE 10 HG22 ILE 10 21.716 -2.194 3.101
85 HG23 ILE 10 HG23 ILE 10 22.334 -1.408 1.648
86 HD11 ILE 10 HD11 ILE 10 21.131 2.469 2.221
87 HD12 ILE 10 HD12 ILE 10 20.749 0.877 1.581
88 HD13 ILE 10 HD13 ILE 10 21.865 1.927 0.720
89 H ARG 11 HN ARG 11 18.952 -0.749 4.628
90 HA ARG 11 HA ARG 11 19.785 -3.122 5.987
91 HB2 ARG 11 HB2 ARG 11 18.465 -2.807 7.980
92 HB3 ARG 11 HB1 ARG 11 19.593 -1.477 7.825
93 HG2 ARG 11 HG2 ARG 11 16.656 -1.365 7.086
94 HG3 ARG 11 HG1 ARG 11 17.364 -0.702 8.545
95 HD2 ARG 11 HD2 ARG 11 18.741 0.834 7.126
96 HD3 ARG 11 HD1 ARG 11 17.925 0.199 5.706
97 HE ARG 11 HE ARG 11 16.177 1.589 6.175
98 HH11 ARG 11 HH11 ARG 11 14.830 2.850 7.484
99 HH12 ARG 11 HH12 ARG 11 15.161 2.996 9.178
100 HH21 ARG 11 HH21 ARG 11 17.966 0.968 9.080
101 HH22 ARG 11 HH22 ARG 11 16.930 1.933 10.079
102 H MET 12 HN MET 12 18.471 -2.417 3.506
103 HA MET 12 HA MET 12 15.823 -3.715 3.912
104 HB2 MET 12 HB2 MET 12 16.681 -1.792 1.737
105 HB3 MET 12 HB1 MET 12 15.094 -2.549 1.877
106 HG2 MET 12 HG2 MET 12 14.780 -1.474 4.084
107 HG3 MET 12 HG1 MET 12 16.355 -0.697 3.923
108 HE1 MET 12 HE1 MET 12 16.194 0.193 0.544
109 HE2 MET 12 HE2 MET 12 17.085 0.506 2.032
110 HE3 MET 12 HE3 MET 12 16.164 1.804 1.275
111 H ARG 13 HN ARG 13 15.490 -5.606 2.925
112 HA ARG 13 HA ARG 13 16.106 -7.575 1.862
113 HB2 ARG 13 HB2 ARG 13 16.279 -5.535 -0.362
114 HB3 ARG 13 HB1 ARG 13 16.178 -7.278 -0.605
115 HG2 ARG 13 HG2 ARG 13 14.071 -7.341 0.610
116 HG3 ARG 13 HG1 ARG 13 14.144 -5.599 0.863
117 HD2 ARG 13 HD2 ARG 13 12.692 -6.120 -1.056
118 HD3 ARG 13 HD1 ARG 13 14.125 -5.242 -1.582
119 HE ARG 13 HE ARG 13 14.661 -7.085 -2.863
120 HH11 ARG 13 HH11 ARG 13 14.595 -9.265 -3.471
121 HH12 ARG 13 HH12 ARG 13 13.676 -10.396 -2.535
122 HH21 ARG 13 HH21 ARG 13 12.594 -8.031 -0.246
123 HH22 ARG 13 HH22 ARG 13 12.545 -9.699 -0.713
124 H DAL 14 HN ALA 14 17.681 -8.066 -0.309
125 HA DAL 14 HA ALA 14 20.243 -8.363 0.883
126 HB1 DAL 14 HB1 ALA 14 20.316 -6.485 -1.468
127 HB2 DAL 14 HB2 ALA 14 21.567 -6.813 -0.272
128 HB3 DAL 14 HB3 ALA 14 20.152 -5.869 0.175
129 H SER 15 HN SER 15 18.366 -10.047 -0.397
130 HA SER 15 HA SER 15 18.392 -11.847 -1.854
131 HB2 SER 15 HB2 SER 15 17.807 -10.065 -3.454
132 HB3 SER 15 HB1 SER 15 19.520 -9.748 -3.706
133 HG SER 15 HG SER 15 19.719 -11.578 -4.800
134 H HIS 16 HN HIS 16 20.746 -11.042 -0.262
135 HA HIS 16 HA HIS 16 22.838 -11.846 0.216
136 HB2 HIS 16 HB2 HIS 16 21.902 -14.040 -0.560
137 HB3 HIS 16 HB1 HIS 16 22.469 -13.666 -2.183
138 HD2 HIS 16 HD2 HIS 16 23.765 -15.540 0.776
139 HE1 HIS 16 HE1 HIS 16 27.243 -14.084 -1.121
140 HE2 HIS 16 HE2 HIS 16 26.367 -15.708 0.623
141 H DAL 17 HN ALA 17 22.800 -9.498 -0.909
142 HA DAL 17 HA ALA 17 24.208 -9.265 -3.386
143 HB1 DAL 17 HB1 ALA 17 25.793 -8.945 -0.839
144 HB2 DAL 17 HB2 ALA 17 26.325 -8.365 -2.415
145 HB3 DAL 17 HB3 ALA 17 26.093 -10.087 -2.141
146 H PHE 18 HN PHE 18 25.607 -6.862 -2.013
147 HA PHE 18 HA PHE 18 23.243 -5.073 -2.179
148 HB2 PHE 18 HB2 PHE 18 25.591 -4.768 -0.293
149 HB3 PHE 18 HB1 PHE 18 24.305 -3.590 -0.511
150 HD1 PHE 18 HD1 PHE 18 24.713 -7.255 0.232
151 HD2 PHE 18 HD2 PHE 18 22.522 -3.656 1.004
152 HE1 PHE 18 HE1 PHE 18 23.340 -8.456 1.895
153 HE2 PHE 18 HE2 PHE 18 21.150 -4.853 2.675
154 HZ PHE 18 HZ PHE 18 21.563 -7.249 3.116
155 H TRP 19 HN TRP 19 23.470 -3.277 -3.396
156 HA TRP 19 HA TRP 19 26.147 -2.688 -4.538
157 HB2 TRP 19 HB2 TRP 19 23.492 -2.651 -5.988
158 HB3 TRP 19 HB1 TRP 19 25.019 -2.077 -6.652
159 HD1 TRP 19 HD1 TRP 19 23.786 -5.346 -4.949
160 HE1 TRP 19 HE1 TRP 19 24.801 -7.328 -6.250
161 HE3 TRP 19 HE3 TRP 19 26.501 -2.802 -8.452
162 HZ2 TRP 19 HZ2 TRP 19 26.539 -7.776 -8.480
163 HZ3 TRP 19 HZ3 TRP 19 27.822 -4.028 -10.145
164 HH2 TRP 19 HH2 TRP 19 27.847 -6.510 -10.166
165 H VAL 20 HN VAL 20 26.739 -0.616 -4.565
166 HA VAL 20 HA VAL 20 24.726 1.481 -4.080
167 HB VAL 20 HB VAL 20 27.308 1.209 -2.527
168 HG11 VAL 20 HG11 VAL 20 26.213 3.209 -1.308
169 HG12 VAL 20 HG12 VAL 20 25.200 3.365 -2.739
170 HG13 VAL 20 HG13 VAL 20 26.952 3.528 -2.875
171 HG21 VAL 20 HG21 VAL 20 25.817 0.933 -0.597
172 HG22 VAL 20 HG22 VAL 20 25.484 -0.316 -1.796
173 HG23 VAL 20 HG23 VAL 20 24.407 1.074 -1.646
174 H GLN 21 HN GLN 21 25.082 3.324 -5.143
175 HA GLN 21 HA GLN 21 27.626 3.998 -6.267
176 HB2 GLN 21 HB2 GLN 21 26.746 4.043 -8.632
177 HB3 GLN 21 HB1 GLN 21 27.109 2.466 -7.955
178 HG2 GLN 21 HG2 GLN 21 25.007 2.488 -9.263
179 HG3 GLN 21 HG1 GLN 21 24.754 2.007 -7.601
180 HE21 GLN 21 HE21 GLN 21 23.528 3.939 -10.044
181 HE22 GLN 21 HE22 GLN 21 22.642 5.036 -9.099
182 H VAL 22 HN VAL 22 26.777 5.564 -4.573
183 HA VAL 22 HA VAL 22 24.742 7.381 -5.366
184 HB VAL 22 HB VAL 22 25.616 8.768 -3.404
185 HG11 VAL 22 HG11 VAL 22 23.949 6.905 -3.148
186 HG12 VAL 22 HG12 VAL 22 24.981 7.103 -1.732
187 HG13 VAL 22 HG13 VAL 22 25.289 5.791 -2.871
188 HG21 VAL 22 HG21 VAL 22 28.011 7.883 -3.843
189 HG22 VAL 22 HG22 VAL 22 27.503 6.437 -2.981
190 HG23 VAL 22 HG23 VAL 22 27.488 8.002 -2.166
191 HA DPR 23 HA PRO 23 27.542 11.017 -6.450
192 HB2 DPR 23 HB2 PRO 23 25.950 12.615 -6.753
193 HB3 DPR 23 HB1 PRO 23 25.545 11.879 -8.314
194 HG2 DPR 23 HG2 PRO 23 23.827 11.976 -6.206
195 HG3 DPR 23 HG1 PRO 23 23.776 10.724 -7.456
196 HD2 DPR 23 HD2 PRO 23 24.882 10.569 -4.671
197 HD3 DPR 23 HD1 PRO 23 23.996 9.351 -5.609
198 HAC 4G6 24 HAC 4G6 24 30.916 10.511 -8.709
199 HAB 4G6 24 HAB 4G6 24 31.376 9.335 -9.964
200 HAA 4G6 24 HAA 4G6 24 30.558 10.849 -10.420
201 HAF 4G6 24 HAF 4G6 24 27.925 10.502 -10.766
202 HAD 4G6 24 HAD 4G6 24 27.801 8.735 -10.956
203 HAE 4G6 24 HAE 4G6 24 29.184 9.614 -11.655
204 HAL 4G6 24 HAL 4G6 24 29.069 10.301 -7.598
205 HAH 4G6 24 HAH 4G6 24 30.411 7.577 -9.815
206 HAG 4G6 24 HAG 4G6 24 28.656 7.330 -9.683
207 HAI 4G6 24 HAI 4G6 24 28.923 7.139 -7.356
208 H LYS 25 HN LYS 25 32.476 6.283 -5.633
209 HA LYS 25 HA LYS 25 29.873 7.592 -5.314
210 HB2 LYS 25 HB2 LYS 25 31.826 8.458 -4.013
211 HB3 LYS 25 HB1 LYS 25 32.682 8.706 -5.512
212 HG2 LYS 25 HG2 LYS 25 31.742 10.826 -4.730
213 HG3 LYS 25 HG1 LYS 25 31.019 10.341 -6.254
214 HD2 LYS 25 HD2 LYS 25 29.337 11.250 -4.713
215 HD3 LYS 25 HD1 LYS 25 28.989 9.581 -5.078
216 HE2 LYS 25 HE2 LYS 25 30.372 10.572 -2.565
217 HE3 LYS 25 HE1 LYS 25 28.674 10.141 -2.668
218 HZ1 LYS 25 HZ1 LYS 25 29.371 8.153 -2.004
219 HZ2 LYS 25 HZ2 LYS 25 30.993 8.460 -2.396
220 HZ3 LYS 25 HZ3 LYS 25 29.913 7.926 -3.591
221 H GLU 26 HN GLU 26 30.253 2.444 -5.355
222 HA GLU 26 HA GLU 26 32.438 4.161 -4.375
223 HB2 GLU 26 HB2 GLU 26 31.687 3.484 -7.223
224 HB3 GLU 26 HB1 GLU 26 32.988 4.567 -6.737
225 HG2 GLU 26 HG2 GLU 26 33.896 2.351 -7.249
226 HG3 GLU 26 HG1 GLU 26 34.078 2.690 -5.532
227 H PHE 27 HN PHE 27 31.712 -0.403 -3.705
228 HA PHE 27 HA PHE 27 29.239 1.180 -3.781
229 HB2 PHE 27 HB2 PHE 27 29.472 1.801 -1.418
230 HB3 PHE 27 HB1 PHE 27 29.160 0.090 -1.628
231 HD1 PHE 27 HD1 PHE 27 29.975 0.579 0.889
232 HD2 PHE 27 HD2 PHE 27 32.586 0.434 -2.528
233 HE1 PHE 27 HE1 PHE 27 31.889 0.055 2.349
234 HE2 PHE 27 HE2 PHE 27 34.472 -0.082 -1.060
235 HZ PHE 27 HZ PHE 27 34.121 -0.270 1.368
236 H LYS 28 HN LYS 28 31.242 -4.262 -4.001
237 HA LYS 28 HA LYS 28 31.805 -2.178 -4.965
238 HB2 LYS 28 HB2 LYS 28 29.215 -3.036 -6.267
239 HB3 LYS 28 HB1 LYS 28 30.402 -1.936 -6.972
240 HG2 LYS 28 HG2 LYS 28 32.120 -3.702 -6.845
241 HG3 LYS 28 HG1 LYS 28 30.934 -4.804 -6.149
242 HD2 LYS 28 HD2 LYS 28 29.557 -4.616 -8.186
243 HD3 LYS 28 HD1 LYS 28 30.747 -3.518 -8.888
244 HE2 LYS 28 HE2 LYS 28 31.112 -5.813 -9.703
245 HE3 LYS 28 HE1 LYS 28 32.469 -5.281 -8.709
246 HZ1 LYS 28 HZ1 LYS 28 31.634 -6.493 -6.862
247 HZ2 LYS 28 HZ2 LYS 28 31.647 -7.550 -8.192
248 HZ3 LYS 28 HZ3 LYS 28 30.186 -6.860 -7.666
249 H HIS 29 HN HIS 29 31.201 -6.223 -2.358
250 HA HIS 29 HA HIS 29 28.523 -5.411 -2.476
251 HB2 HIS 29 HB2 HIS 29 29.791 -5.593 -0.380
252 HB3 HIS 29 HB1 HIS 29 30.798 -4.235 -0.879
253 HD2 HIS 29 HD2 HIS 29 27.676 -4.777 1.134
254 HE1 HIS 29 HE1 HIS 29 27.320 -0.839 -0.340
255 HE2 HIS 29 HE2 HIS 29 26.380 -2.513 1.320
256 H1 ACE 30 HA2 ACE 30 32.288 -6.906 -4.909
257 H2 ACE 30 HA3 ACE 30 31.026 -8.037 -5.398
258 H3 ACE 30 HA1 ACE 30 31.654 -8.076 -3.751
Start of MODEL 7
1 HN1 NH2 0 H1 THR 1 28.370 -6.048 9.059
2 HN2 NH2 0 H2 THR 1 28.880 -6.444 7.489
3 H THR 1 HN THR 1 24.044 -5.991 7.802
4 HA THR 1 HA THR 1 26.230 -5.939 9.721
5 HB THR 1 HB THR 1 26.084 -8.396 9.538
6 HG1 THR 1 HG1 THR 1 23.773 -8.663 8.350
7 HG21 THR 1 HG21 THR 1 24.388 -6.749 10.926
8 HG22 THR 1 HG22 THR 1 24.375 -8.506 11.062
9 HG23 THR 1 HG23 THR 1 23.241 -7.702 9.983
10 H GLU 2 HN GLU 2 23.081 -3.069 5.909
11 HA GLU 2 HA GLU 2 23.324 -2.623 8.532
12 HB2 GLU 2 HB2 GLU 2 21.437 -3.843 7.544
13 HB3 GLU 2 HB1 GLU 2 22.458 -5.260 7.323
14 HG2 GLU 2 HG2 GLU 2 21.066 -5.484 9.343
15 HG3 GLU 2 HG1 GLU 2 22.771 -5.419 9.771
16 H ILE 3 HN ILE 3 26.949 -1.101 4.616
17 HA ILE 3 HA ILE 3 24.181 -2.078 4.352
18 HB ILE 3 HB ILE 3 25.144 -4.322 4.020
19 HG12 ILE 3 HG12 ILE 3 27.563 -4.569 3.450
20 HG13 ILE 3 HG11 ILE 3 27.867 -2.939 3.989
21 HG21 ILE 3 HG21 ILE 3 24.640 -3.295 1.983
22 HG22 ILE 3 HG22 ILE 3 26.355 -3.638 1.755
23 HG23 ILE 3 HG23 ILE 3 25.832 -2.018 2.220
24 HD11 ILE 3 HD11 ILE 3 26.529 -4.691 5.974
25 HD12 ILE 3 HD12 ILE 3 27.864 -3.549 6.186
26 HD13 ILE 3 HD13 ILE 3 28.167 -5.148 5.531
27 H ARG 4 HN ARG 4 24.592 2.536 4.242
28 HA ARG 4 HA ARG 4 26.978 1.148 3.396
29 HB2 ARG 4 HB2 ARG 4 27.795 0.632 5.644
30 HB3 ARG 4 HB1 ARG 4 27.819 2.371 5.366
31 HG2 ARG 4 HG2 ARG 4 25.680 2.591 6.575
32 HG3 ARG 4 HG1 ARG 4 25.687 0.851 6.880
33 HD2 ARG 4 HD2 ARG 4 27.847 1.065 8.055
34 HD3 ARG 4 HD1 ARG 4 27.839 2.798 7.754
35 HE ARG 4 HE ARG 4 26.459 3.008 9.577
36 HH11 ARG 4 HH11 ARG 4 24.993 2.282 11.160
37 HH12 ARG 4 HH12 ARG 4 24.418 0.650 11.111
38 HH21 ARG 4 HH21 ARG 4 26.249 -0.192 8.289
39 HH22 ARG 4 HH22 ARG 4 25.126 -0.752 9.484
40 H VAL 5 HN VAL 5 26.932 5.843 2.819
41 HA VAL 5 HA VAL 5 24.569 4.957 4.023
42 HB VAL 5 HB VAL 5 23.585 5.233 1.729
43 HG11 VAL 5 HG11 VAL 5 24.398 4.078 -0.132
44 HG12 VAL 5 HG12 VAL 5 25.342 2.962 0.852
45 HG13 VAL 5 HG13 VAL 5 25.875 4.632 0.664
46 HG21 VAL 5 HG21 VAL 5 22.420 3.187 1.768
47 HG22 VAL 5 HG22 VAL 5 22.979 3.351 3.432
48 HG23 VAL 5 HG23 VAL 5 23.832 2.285 2.315
49 H8 4FU 6 HAM 4FU 6 26.722 10.281 2.712
50 H9 4FU 6 HAI 4FU 6 23.867 9.238 2.581
51 HAI 4FU 6 HAJ 4FU 6 24.370 10.922 2.831
52 H112 4FU 6 HAE 4FU 6 25.456 10.972 0.639
53 H111 4FU 6 HAF 4FU 6 23.746 10.508 0.481
54 HAG 4FU 6 HAG 4FU 6 24.397 8.126 0.365
55 H12 4FU 6 HAH 4FU 6 25.203 9.077 -0.904
56 HAL 4FU 6 HAL 4FU 6 27.222 9.244 0.498
57 HAK 4FU 6 HAK 4FU 6 26.806 7.543 0.203
58 H14 4FU 6 HAN 4FU 6 27.390 7.927 2.566
59 H GLY 7 HN GLY 7 24.396 8.044 4.066
60 HA2 GLY 7 HA2 GLY 7 25.287 7.267 6.448
61 HA3 GLY 7 HA1 GLY 7 24.919 8.955 6.788
62 H VAL 8 HN VAL 8 22.995 7.697 4.373
63 HA VAL 8 HA VAL 8 20.550 8.115 5.613
64 HB VAL 8 HB VAL 8 19.570 6.779 3.819
65 HG11 VAL 8 HG11 VAL 8 20.834 7.888 1.871
66 HG12 VAL 8 HG12 VAL 8 21.910 8.552 3.101
67 HG13 VAL 8 HG13 VAL 8 20.194 8.960 3.117
68 HG21 VAL 8 HG21 VAL 8 22.391 5.741 3.620
69 HG22 VAL 8 HG22 VAL 8 21.357 5.745 2.189
70 HG23 VAL 8 HG23 VAL 8 20.873 4.843 3.624
71 H THR 9 HN THR 9 18.967 5.911 5.408
72 HA THR 9 HA THR 9 19.063 4.693 7.843
73 HB THR 9 HB THR 9 17.173 4.448 6.268
74 HG1 THR 9 HG1 THR 9 16.750 2.829 7.514
75 HG21 THR 9 HG21 THR 9 17.277 2.969 4.404
76 HG22 THR 9 HG22 THR 9 18.829 2.317 4.928
77 HG23 THR 9 HG23 THR 9 18.732 3.963 4.300
78 H ILE 10 HN ILE 10 19.460 2.360 8.331
79 HA ILE 10 HA ILE 10 22.180 1.615 7.463
80 HB ILE 10 HB ILE 10 20.544 0.841 9.885
81 HG12 ILE 10 HG12 ILE 10 22.990 2.618 9.586
82 HG13 ILE 10 HG11 ILE 10 21.343 3.200 9.817
83 HG21 ILE 10 HG21 ILE 10 22.830 -0.064 10.625
84 HG22 ILE 10 HG22 ILE 10 23.297 0.055 8.929
85 HG23 ILE 10 HG23 ILE 10 21.958 -0.985 9.406
86 HD11 ILE 10 HD11 ILE 10 21.214 2.110 11.993
87 HD12 ILE 10 HD12 ILE 10 22.657 3.123 11.945
88 HD13 ILE 10 HD13 ILE 10 22.799 1.376 11.755
89 H ARG 11 HN ARG 11 18.977 0.231 8.027
90 HA ARG 11 HA ARG 11 19.607 -2.403 7.283
91 HB2 ARG 11 HB2 ARG 11 17.150 -2.685 7.242
92 HB3 ARG 11 HB1 ARG 11 17.709 -1.850 8.693
93 HG2 ARG 11 HG2 ARG 11 17.193 0.326 7.628
94 HG3 ARG 11 HG1 ARG 11 16.590 -0.524 6.205
95 HD2 ARG 11 HD2 ARG 11 15.498 -0.806 9.014
96 HD3 ARG 11 HD1 ARG 11 14.749 0.113 7.713
97 HE ARG 11 HE ARG 11 15.140 -2.509 6.793
98 HH11 ARG 11 HH11 ARG 11 13.367 -3.940 6.820
99 HH12 ARG 11 HH12 ARG 11 12.035 -3.634 7.885
100 HH21 ARG 11 HH21 ARG 11 13.444 -0.746 9.210
101 HH22 ARG 11 HH22 ARG 11 12.077 -1.814 9.247
102 H MET 12 HN MET 12 20.686 -0.808 5.281
103 HA MET 12 HA MET 12 18.920 -1.216 2.935
104 HB2 MET 12 HB2 MET 12 19.876 1.059 3.281
105 HB3 MET 12 HB1 MET 12 21.492 0.378 3.209
106 HG2 MET 12 HG2 MET 12 19.463 0.261 0.956
107 HG3 MET 12 HG1 MET 12 20.779 1.421 1.058
108 HE1 MET 12 HE1 MET 12 21.292 0.808 -1.255
109 HE2 MET 12 HE2 MET 12 20.284 -0.617 -1.491
110 HE3 MET 12 HE3 MET 12 22.010 -0.702 -1.832
111 H ARG 13 HN ARG 13 19.250 -3.050 1.836
112 HA ARG 13 HA ARG 13 21.885 -4.390 1.994
113 HB2 ARG 13 HB2 ARG 13 19.906 -5.594 2.905
114 HB3 ARG 13 HB1 ARG 13 19.177 -5.534 1.309
115 HG2 ARG 13 HG2 ARG 13 21.085 -6.844 0.389
116 HG3 ARG 13 HG1 ARG 13 21.808 -6.891 1.990
117 HD2 ARG 13 HD2 ARG 13 19.080 -7.993 1.295
118 HD3 ARG 13 HD1 ARG 13 20.540 -8.962 1.440
119 HE ARG 13 HE ARG 13 20.229 -7.534 3.838
120 HH11 ARG 13 HH11 ARG 13 19.336 -8.586 5.639
121 HH12 ARG 13 HH12 ARG 13 18.351 -9.992 5.413
122 HH21 ARG 13 HH21 ARG 13 18.631 -9.958 1.957
123 HH22 ARG 13 HH22 ARG 13 17.952 -10.769 3.329
124 H DAL 14 HN ALA 14 19.911 -5.654 -0.302
125 HA DAL 14 HA ALA 14 21.588 -4.809 -2.471
126 HB1 DAL 14 HB1 ALA 14 18.688 -4.008 -2.653
127 HB2 DAL 14 HB2 ALA 14 19.999 -3.599 -3.759
128 HB3 DAL 14 HB3 ALA 14 19.952 -2.887 -2.146
129 H SER 15 HN SER 15 19.609 -5.308 -4.490
130 HA SER 15 HA SER 15 18.297 -7.766 -4.134
131 HB2 SER 15 HB2 SER 15 17.742 -6.255 -5.978
132 HB3 SER 15 HB1 SER 15 19.339 -6.512 -6.676
133 HG SER 15 HG SER 15 17.189 -8.323 -6.388
134 H HIS 16 HN HIS 16 21.443 -6.965 -5.450
135 HA HIS 16 HA HIS 16 22.212 -9.631 -6.063
136 HB2 HIS 16 HB2 HIS 16 23.899 -7.170 -5.604
137 HB3 HIS 16 HB1 HIS 16 24.490 -8.686 -6.281
138 HD2 HIS 16 HD2 HIS 16 24.435 -8.578 -9.033
139 HE1 HIS 16 HE1 HIS 16 21.182 -5.924 -9.481
140 HE2 HIS 16 HE2 HIS 16 22.931 -7.277 -10.728
141 H DAL 17 HN ALA 17 22.654 -7.540 -3.348
142 HA DAL 17 HA ALA 17 24.359 -9.334 -1.874
143 HB1 DAL 17 HB1 ALA 17 21.440 -9.068 -1.111
144 HB2 DAL 17 HB2 ALA 17 22.685 -9.724 -0.047
145 HB3 DAL 17 HB3 ALA 17 22.289 -10.549 -1.555
146 H PHE 18 HN PHE 18 25.406 -8.239 -0.255
147 HA PHE 18 HA PHE 18 24.334 -5.626 0.572
148 HB2 PHE 18 HB2 PHE 18 25.890 -5.791 2.462
149 HB3 PHE 18 HB1 PHE 18 24.732 -7.096 2.420
150 HD1 PHE 18 HD1 PHE 18 26.736 -7.612 4.158
151 HD2 PHE 18 HD2 PHE 18 27.042 -8.011 -0.109
152 HE1 PHE 18 HE1 PHE 18 28.564 -9.248 4.427
153 HE2 PHE 18 HE2 PHE 18 28.865 -9.623 0.169
154 HZ PHE 18 HZ PHE 18 29.626 -10.244 2.434
155 H TRP 19 HN TRP 19 25.081 -3.872 -0.363
156 HA TRP 19 HA TRP 19 27.966 -3.661 -0.950
157 HB2 TRP 19 HB2 TRP 19 25.823 -3.009 -2.961
158 HB3 TRP 19 HB1 TRP 19 27.567 -2.825 -3.153
159 HD1 TRP 19 HD1 TRP 19 25.105 -5.725 -2.345
160 HE1 TRP 19 HE1 TRP 19 25.974 -7.833 -3.554
161 HE3 TRP 19 HE3 TRP 19 29.305 -3.811 -4.480
162 HZ2 TRP 19 HZ2 TRP 19 28.176 -8.603 -5.214
163 HZ3 TRP 19 HZ3 TRP 19 30.776 -5.251 -5.868
164 HH2 TRP 19 HH2 TRP 19 30.217 -7.637 -6.240
165 H VAL 20 HN VAL 20 28.290 -1.326 -2.049
166 HA VAL 20 HA VAL 20 26.584 0.652 -0.632
167 HB VAL 20 HB VAL 20 28.612 0.392 0.714
168 HG11 VAL 20 HG11 VAL 20 30.237 1.286 -1.671
169 HG12 VAL 20 HG12 VAL 20 29.986 -0.420 -1.303
170 HG13 VAL 20 HG13 VAL 20 30.804 0.619 -0.141
171 HG21 VAL 20 HG21 VAL 20 29.222 2.693 0.814
172 HG22 VAL 20 HG22 VAL 20 27.564 2.678 0.218
173 HG23 VAL 20 HG23 VAL 20 28.899 2.932 -0.903
174 H GLN 21 HN GLN 21 25.630 1.803 -2.185
175 HA GLN 21 HA GLN 21 27.245 2.742 -4.482
176 HB2 GLN 21 HB2 GLN 21 25.429 2.141 -6.008
177 HB3 GLN 21 HB1 GLN 21 25.998 0.728 -5.152
178 HG2 GLN 21 HG2 GLN 21 23.509 2.295 -4.480
179 HG3 GLN 21 HG1 GLN 21 23.569 0.744 -5.295
180 HE21 GLN 21 HE21 GLN 21 23.214 2.140 -2.298
181 HE22 GLN 21 HE22 GLN 21 23.622 0.808 -1.333
182 H VAL 22 HN VAL 22 27.094 4.929 -4.702
183 HA VAL 22 HA VAL 22 24.537 6.248 -4.192
184 HB VAL 22 HB VAL 22 25.621 7.873 -2.569
185 HG11 VAL 22 HG11 VAL 22 25.911 5.022 -1.608
186 HG12 VAL 22 HG12 VAL 22 24.327 5.738 -1.913
187 HG13 VAL 22 HG13 VAL 22 25.383 6.429 -0.700
188 HG21 VAL 22 HG21 VAL 22 27.780 7.141 -1.577
189 HG22 VAL 22 HG22 VAL 22 27.942 7.507 -3.289
190 HG23 VAL 22 HG23 VAL 22 27.862 5.831 -2.749
191 HA DPR 23 HA PRO 23 26.309 10.270 -5.748
192 HB2 DPR 23 HB2 PRO 23 24.595 11.122 -7.101
193 HB3 DPR 23 HB1 PRO 23 24.106 9.502 -7.649
194 HG2 DPR 23 HG2 PRO 23 23.666 10.808 -4.992
195 HG3 DPR 23 HG1 PRO 23 22.531 9.869 -5.980
196 HD2 DPR 23 HD2 PRO 23 23.962 8.812 -3.845
197 HD3 DPR 23 HD1 PRO 23 23.323 7.848 -5.196
198 HAC 4G6 24 HAC 4G6 24 29.961 7.329 -7.315
199 HAB 4G6 24 HAB 4G6 24 31.075 8.374 -8.230
200 HAA 4G6 24 HAA 4G6 24 30.421 8.921 -6.668
201 HAF 4G6 24 HAF 4G6 24 28.718 11.035 -8.923
202 HAD 4G6 24 HAD 4G6 24 29.725 10.066 -10.028
203 HAE 4G6 24 HAE 4G6 24 30.394 10.640 -8.482
204 HAL 4G6 24 HAL 4G6 24 28.241 9.803 -6.487
205 HAH 4G6 24 HAH 4G6 24 29.341 7.835 -10.078
206 HAG 4G6 24 HAG 4G6 24 27.694 8.478 -9.908
207 HAI 4G6 24 HAI 4G6 24 27.602 6.725 -7.920
208 H LYS 25 HN LYS 25 29.345 2.832 -8.668
209 HA LYS 25 HA LYS 25 27.466 3.732 -9.545
210 HB2 LYS 25 HB2 LYS 25 26.498 3.693 -7.251
211 HB3 LYS 25 HB1 LYS 25 27.181 5.260 -6.958
212 HG2 LYS 25 HG2 LYS 25 24.824 5.480 -7.526
213 HG3 LYS 25 HG1 LYS 25 25.835 6.245 -8.728
214 HD2 LYS 25 HD2 LYS 25 23.974 5.039 -9.760
215 HD3 LYS 25 HD1 LYS 25 25.501 4.367 -10.267
216 HE2 LYS 25 HE2 LYS 25 23.733 3.199 -8.097
217 HE3 LYS 25 HE1 LYS 25 23.761 2.644 -9.763
218 HZ1 LYS 25 HZ1 LYS 25 26.381 2.687 -8.661
219 HZ2 LYS 25 HZ2 LYS 25 25.522 1.403 -9.348
220 HZ3 LYS 25 HZ3 LYS 25 25.341 1.759 -7.702
221 H GLU 26 HN GLU 26 29.959 1.373 -7.644
222 HA GLU 26 HA GLU 26 30.974 3.221 -5.583
223 HB2 GLU 26 HB2 GLU 26 31.741 3.185 -8.515
224 HB3 GLU 26 HB1 GLU 26 32.247 4.392 -7.339
225 HG2 GLU 26 HG2 GLU 26 34.027 2.742 -7.661
226 HG3 GLU 26 HG1 GLU 26 33.385 2.622 -6.027
227 H PHE 27 HN PHE 27 31.344 -2.200 -6.233
228 HA PHE 27 HA PHE 27 29.872 -0.744 -7.194
229 HB2 PHE 27 HB2 PHE 27 28.572 -0.709 -4.495
230 HB3 PHE 27 HB1 PHE 27 27.938 0.037 -5.935
231 HD1 PHE 27 HD1 PHE 27 26.143 -1.524 -4.681
232 HD2 PHE 27 HD2 PHE 27 29.314 -2.921 -7.206
233 HE1 PHE 27 HE1 PHE 27 24.879 -3.575 -5.084
234 HE2 PHE 27 HE2 PHE 27 28.033 -4.984 -7.648
235 HZ PHE 27 HZ PHE 27 25.823 -5.306 -6.592
236 H LYS 28 HN LYS 28 30.991 -4.615 -4.023
237 HA LYS 28 HA LYS 28 32.750 -2.437 -3.201
238 HB2 LYS 28 HB2 LYS 28 32.348 -3.569 -5.958
239 HB3 LYS 28 HB1 LYS 28 33.452 -2.272 -5.531
240 HG2 LYS 28 HG2 LYS 28 33.611 -5.123 -4.504
241 HG3 LYS 28 HG1 LYS 28 34.613 -4.450 -5.783
242 HD2 LYS 28 HD2 LYS 28 35.524 -2.790 -4.159
243 HD3 LYS 28 HD1 LYS 28 34.572 -3.546 -2.884
244 HE2 LYS 28 HE2 LYS 28 35.705 -5.686 -3.270
245 HE3 LYS 28 HE1 LYS 28 36.678 -4.941 -4.541
246 HZ1 LYS 28 HZ1 LYS 28 37.295 -5.027 -1.883
247 HZ2 LYS 28 HZ2 LYS 28 36.733 -3.440 -2.112
248 HZ3 LYS 28 HZ3 LYS 28 38.022 -4.030 -3.047
249 H HIS 29 HN HIS 29 31.048 -7.630 -2.739
250 HA HIS 29 HA HIS 29 29.939 -5.723 -2.048
251 HB2 HIS 29 HB2 HIS 29 30.610 -6.912 0.027
252 HB3 HIS 29 HB1 HIS 29 32.080 -5.939 0.081
253 HD2 HIS 29 HD2 HIS 29 28.649 -5.796 1.541
254 HE1 HIS 29 HE1 HIS 29 29.812 -1.744 1.199
255 HE2 HIS 29 HE2 HIS 29 28.123 -3.329 2.245
256 H1 ACE 30 HA2 ACE 30 32.768 -8.565 -3.963
257 H2 ACE 30 HA3 ACE 30 33.614 -9.018 -2.483
258 H3 ACE 30 HA1 ACE 30 34.417 -8.007 -3.684
Start of MODEL 8
1 HN1 NH2 0 H1 THR 1 25.608 -2.826 11.558
2 HN2 NH2 0 H2 THR 1 24.441 -3.999 11.180
3 H THR 1 HN THR 1 27.185 -1.127 9.541
4 HA THR 1 HA THR 1 27.911 -3.843 9.001
5 HB THR 1 HB THR 1 27.526 -2.395 11.629
6 HG1 THR 1 HG1 THR 1 29.306 -1.502 10.995
7 HG21 THR 1 HG21 THR 1 29.038 -4.262 12.447
8 HG22 THR 1 HG22 THR 1 28.732 -5.076 10.912
9 HG23 THR 1 HG23 THR 1 27.400 -4.758 12.023
10 H GLU 2 HN GLU 2 24.944 -0.158 5.826
11 HA GLU 2 HA GLU 2 27.486 0.006 7.063
12 HB2 GLU 2 HB2 GLU 2 24.759 -0.146 8.352
13 HB3 GLU 2 HB1 GLU 2 26.236 0.409 9.127
14 HG2 GLU 2 HG2 GLU 2 24.919 1.722 6.730
15 HG3 GLU 2 HG1 GLU 2 24.807 2.298 8.387
16 H ILE 3 HN ILE 3 26.752 0.411 2.355
17 HA ILE 3 HA ILE 3 24.627 -1.086 3.762
18 HB ILE 3 HB ILE 3 25.444 -2.175 1.748
19 HG12 ILE 3 HG12 ILE 3 26.176 -4.326 2.739
20 HG13 ILE 3 HG11 ILE 3 26.497 -3.516 4.266
21 HG21 ILE 3 HG21 ILE 3 27.817 -0.999 2.100
22 HG22 ILE 3 HG22 ILE 3 27.671 -2.502 1.190
23 HG23 ILE 3 HG23 ILE 3 28.202 -2.536 2.874
24 HD11 ILE 3 HD11 ILE 3 23.773 -3.260 3.014
25 HD12 ILE 3 HD12 ILE 3 24.231 -3.179 4.716
26 HD13 ILE 3 HD13 ILE 3 24.194 -4.734 3.888
27 H ARG 4 HN ARG 4 23.865 3.917 2.476
28 HA ARG 4 HA ARG 4 25.825 2.225 1.092
29 HB2 ARG 4 HB2 ARG 4 25.908 3.605 3.791
30 HB3 ARG 4 HB1 ARG 4 27.173 2.548 3.203
31 HG2 ARG 4 HG2 ARG 4 27.782 4.896 2.923
32 HG3 ARG 4 HG1 ARG 4 27.645 4.098 1.378
33 HD2 ARG 4 HD2 ARG 4 25.513 5.865 2.600
34 HD3 ARG 4 HD1 ARG 4 26.688 6.405 1.411
35 HE ARG 4 HE ARG 4 24.280 5.070 0.856
36 HH11 ARG 4 HH11 ARG 4 23.926 4.202 -1.214
37 HH12 ARG 4 HH12 ARG 4 25.269 3.935 -2.274
38 HH21 ARG 4 HH21 ARG 4 27.623 5.131 -0.039
39 HH22 ARG 4 HH22 ARG 4 27.358 4.437 -1.599
40 H VAL 5 HN VAL 5 22.834 5.267 -1.103
41 HA VAL 5 HA VAL 5 21.904 4.317 1.555
42 HB VAL 5 HB VAL 5 20.915 2.381 0.381
43 HG11 VAL 5 HG11 VAL 5 20.064 5.202 -0.273
44 HG12 VAL 5 HG12 VAL 5 19.345 4.061 0.861
45 HG13 VAL 5 HG13 VAL 5 19.130 3.830 -0.873
46 HG21 VAL 5 HG21 VAL 5 22.107 3.798 -1.997
47 HG22 VAL 5 HG22 VAL 5 20.579 2.947 -2.217
48 HG23 VAL 5 HG23 VAL 5 21.998 2.068 -1.665
49 H8 4FU 6 HAM 4FU 6 21.741 9.612 -1.059
50 H9 4FU 6 HAI 4FU 6 19.943 7.303 -0.259
51 HAI 4FU 6 HAJ 4FU 6 19.392 8.900 -0.817
52 H112 4FU 6 HAE 4FU 6 20.545 8.584 -2.960
53 H111 4FU 6 HAF 4FU 6 19.395 7.261 -2.662
54 HAG 4FU 6 HAG 4FU 6 21.227 5.811 -1.895
55 H12 4FU 6 HAH 4FU 6 21.570 6.440 -3.521
56 HAL 4FU 6 HAL 4FU 6 23.002 8.188 -2.568
57 HAK 4FU 6 HAK 4FU 6 23.563 6.583 -2.048
58 H14 4FU 6 HAN 4FU 6 23.535 8.164 -0.149
59 H GLY 7 HN GLY 7 20.420 7.664 1.517
60 HA2 GLY 7 HA2 GLY 7 21.520 9.194 3.660
61 HA3 GLY 7 HA1 GLY 7 19.882 9.700 3.310
62 H VAL 8 HN VAL 8 21.811 6.847 3.990
63 HA VAL 8 HA VAL 8 19.472 5.569 5.312
64 HB VAL 8 HB VAL 8 20.416 4.366 3.364
65 HG11 VAL 8 HG11 VAL 8 22.744 5.143 3.523
66 HG12 VAL 8 HG12 VAL 8 22.662 3.377 3.561
67 HG13 VAL 8 HG13 VAL 8 22.941 4.266 5.044
68 HG21 VAL 8 HG21 VAL 8 20.661 2.214 4.458
69 HG22 VAL 8 HG22 VAL 8 19.416 3.148 5.278
70 HG23 VAL 8 HG23 VAL 8 21.024 3.002 5.983
71 H THR 9 HN THR 9 19.729 4.780 7.444
72 HA THR 9 HA THR 9 22.233 5.592 8.800
73 HB THR 9 HB THR 9 20.363 6.913 9.556
74 HG1 THR 9 HG1 THR 9 21.265 6.728 11.411
75 HG21 THR 9 HG21 THR 9 18.700 4.978 8.956
76 HG22 THR 9 HG22 THR 9 18.324 6.054 10.303
77 HG23 THR 9 HG23 THR 9 18.998 4.458 10.615
78 H ILE 10 HN ILE 10 21.129 2.937 7.614
79 HA ILE 10 HA ILE 10 22.537 1.287 9.522
80 HB ILE 10 HB ILE 10 20.794 -0.404 9.791
81 HG12 ILE 10 HG12 ILE 10 19.467 0.048 7.772
82 HG13 ILE 10 HG11 ILE 10 18.452 0.099 9.209
83 HG21 ILE 10 HG21 ILE 10 21.147 1.454 11.426
84 HG22 ILE 10 HG22 ILE 10 19.554 0.705 11.476
85 HG23 ILE 10 HG23 ILE 10 19.766 2.271 10.699
86 HD11 ILE 10 HD11 ILE 10 17.738 2.013 8.128
87 HD12 ILE 10 HD12 ILE 10 19.314 2.324 7.416
88 HD13 ILE 10 HD13 ILE 10 19.031 2.692 9.107
89 H ARG 11 HN ARG 11 21.272 -1.154 8.376
90 HA ARG 11 HA ARG 11 22.992 -1.337 6.087
91 HB2 ARG 11 HB2 ARG 11 22.346 -3.754 6.105
92 HB3 ARG 11 HB1 ARG 11 23.156 -3.160 7.541
93 HG2 ARG 11 HG2 ARG 11 21.325 -4.663 8.155
94 HG3 ARG 11 HG1 ARG 11 20.990 -3.039 8.721
95 HD2 ARG 11 HD2 ARG 11 19.820 -4.241 6.200
96 HD3 ARG 11 HD1 ARG 11 19.005 -4.218 7.756
97 HE ARG 11 HE ARG 11 19.757 -1.589 7.100
98 HH11 ARG 11 HH11 ARG 11 18.192 -0.185 6.238
99 HH12 ARG 11 HH12 ARG 11 16.762 -0.835 5.508
100 HH21 ARG 11 HH21 ARG 11 17.655 -4.138 6.074
101 HH22 ARG 11 HH22 ARG 11 16.458 -3.074 5.415
102 H MET 12 HN MET 12 22.010 -3.047 4.366
103 HA MET 12 HA MET 12 19.467 -1.922 3.340
104 HB2 MET 12 HB2 MET 12 21.992 -2.425 1.737
105 HB3 MET 12 HB1 MET 12 20.440 -1.938 1.066
106 HG2 MET 12 HG2 MET 12 22.083 -0.337 3.052
107 HG3 MET 12 HG1 MET 12 21.944 0.003 1.330
108 HE1 MET 12 HE1 MET 12 18.516 -0.588 0.939
109 HE2 MET 12 HE2 MET 12 19.898 0.157 0.139
110 HE3 MET 12 HE3 MET 12 18.539 1.157 0.643
111 H ARG 13 HN ARG 13 18.161 -3.367 2.251
112 HA ARG 13 HA ARG 13 18.720 -6.172 2.731
113 HB2 ARG 13 HB2 ARG 13 16.460 -6.559 1.878
114 HB3 ARG 13 HB1 ARG 13 16.461 -5.292 3.103
115 HG2 ARG 13 HG2 ARG 13 16.498 -3.580 1.316
116 HG3 ARG 13 HG1 ARG 13 16.474 -4.859 0.105
117 HD2 ARG 13 HD2 ARG 13 14.211 -3.993 0.418
118 HD3 ARG 13 HD1 ARG 13 14.304 -5.652 0.992
119 HE ARG 13 HE ARG 13 14.782 -3.882 3.157
120 HH11 ARG 13 HH11 ARG 13 13.096 -3.466 4.616
121 HH12 ARG 13 HH12 ARG 13 11.460 -3.803 4.157
122 HH21 ARG 13 HH21 ARG 13 12.305 -4.966 1.002
123 HH22 ARG 13 HH22 ARG 13 11.012 -4.651 2.111
124 H DAL 14 HN ALA 14 18.120 -7.715 0.893
125 HA DAL 14 HA ALA 14 20.001 -7.434 -1.202
126 HB1 DAL 14 HB1 ALA 14 18.329 -5.815 -2.063
127 HB2 DAL 14 HB2 ALA 14 17.110 -7.087 -2.029
128 HB3 DAL 14 HB3 ALA 14 18.493 -7.220 -3.114
129 H SER 15 HN SER 15 18.652 -9.007 -3.143
130 HA SER 15 HA SER 15 17.396 -11.276 -2.074
131 HB2 SER 15 HB2 SER 15 17.299 -10.736 -4.459
132 HB3 SER 15 HB1 SER 15 19.032 -11.014 -4.598
133 HG SER 15 HG SER 15 17.209 -12.779 -4.939
134 H HIS 16 HN HIS 16 20.749 -10.703 -2.963
135 HA HIS 16 HA HIS 16 21.701 -12.471 -0.885
136 HB2 HIS 16 HB2 HIS 16 22.185 -13.191 -3.786
137 HB3 HIS 16 HB1 HIS 16 22.932 -13.978 -2.396
138 HD2 HIS 16 HD2 HIS 16 19.968 -14.611 -4.591
139 HE1 HIS 16 HE1 HIS 16 18.835 -16.171 -0.835
140 HE2 HIS 16 HE2 HIS 16 18.254 -16.105 -3.306
141 H DAL 17 HN ALA 17 21.941 -9.661 -2.067
142 HA DAL 17 HA ALA 17 24.369 -9.089 -3.203
143 HB1 DAL 17 HB1 ALA 17 25.755 -10.121 -1.652
144 HB2 DAL 17 HB2 ALA 17 24.640 -9.842 -0.317
145 HB3 DAL 17 HB3 ALA 17 25.636 -8.520 -0.926
146 H PHE 18 HN PHE 18 25.352 -6.930 -2.003
147 HA PHE 18 HA PHE 18 23.090 -5.082 -1.998
148 HB2 PHE 18 HB2 PHE 18 23.899 -3.993 0.075
149 HB3 PHE 18 HB1 PHE 18 23.329 -5.635 0.340
150 HD1 PHE 18 HD1 PHE 18 26.570 -3.809 -0.454
151 HD2 PHE 18 HD2 PHE 18 24.662 -7.082 1.582
152 HE1 PHE 18 HE1 PHE 18 28.736 -4.487 0.508
153 HE2 PHE 18 HE2 PHE 18 26.834 -7.734 2.553
154 HZ PHE 18 HZ PHE 18 28.862 -6.437 2.012
155 H TRP 19 HN TRP 19 23.733 -2.854 -2.308
156 HA TRP 19 HA TRP 19 26.369 -2.606 -3.614
157 HB2 TRP 19 HB2 TRP 19 23.756 -1.315 -4.340
158 HB3 TRP 19 HB1 TRP 19 25.302 -0.912 -5.079
159 HD1 TRP 19 HD1 TRP 19 23.397 -4.222 -4.367
160 HE1 TRP 19 HE1 TRP 19 23.589 -5.693 -6.480
161 HE3 TRP 19 HE3 TRP 19 26.149 -1.120 -7.339
162 HZ2 TRP 19 HZ2 TRP 19 24.757 -5.563 -9.092
163 HZ3 TRP 19 HZ3 TRP 19 26.785 -1.812 -9.630
164 HH2 TRP 19 HH2 TRP 19 26.093 -4.027 -10.512
165 H VAL 20 HN VAL 20 27.737 -0.843 -3.033
166 HA VAL 20 HA VAL 20 26.458 1.141 -1.176
167 HB VAL 20 HB VAL 20 28.372 -0.180 -0.221
168 HG11 VAL 20 HG11 VAL 20 29.511 -0.018 -2.645
169 HG12 VAL 20 HG12 VAL 20 30.468 -0.224 -1.181
170 HG13 VAL 20 HG13 VAL 20 30.282 1.376 -1.902
171 HG21 VAL 20 HG21 VAL 20 29.754 2.013 0.327
172 HG22 VAL 20 HG22 VAL 20 28.097 1.851 0.895
173 HG23 VAL 20 HG23 VAL 20 28.444 2.818 -0.536
174 H GLN 21 HN GLN 21 25.825 2.805 -2.441
175 HA GLN 21 HA GLN 21 27.770 3.873 -4.429
176 HB2 GLN 21 HB2 GLN 21 24.748 3.794 -4.629
177 HB3 GLN 21 HB1 GLN 21 25.821 4.600 -5.770
178 HG2 GLN 21 HG2 GLN 21 26.907 2.448 -6.278
179 HG3 GLN 21 HG1 GLN 21 25.844 1.631 -5.137
180 HE21 GLN 21 HE21 GLN 21 26.189 2.200 -8.387
181 HE22 GLN 21 HE22 GLN 21 24.560 2.109 -8.859
182 H VAL 22 HN VAL 22 28.634 5.320 -2.937
183 HA VAL 22 HA VAL 22 27.047 7.074 -1.377
184 HB VAL 22 HB VAL 22 29.212 8.352 -1.061
185 HG11 VAL 22 HG11 VAL 22 30.497 6.398 -0.132
186 HG12 VAL 22 HG12 VAL 22 29.337 5.318 -0.905
187 HG13 VAL 22 HG13 VAL 22 28.805 6.419 0.367
188 HG21 VAL 22 HG21 VAL 22 31.230 7.268 -2.155
189 HG22 VAL 22 HG22 VAL 22 30.175 8.157 -3.253
190 HG23 VAL 22 HG23 VAL 22 30.106 6.396 -3.196
191 HA DPR 23 HA PRO 23 26.978 10.973 -3.795
192 HB2 DPR 23 HB2 PRO 23 24.833 11.826 -3.441
193 HB3 DPR 23 HB1 PRO 23 24.062 10.238 -3.641
194 HG2 DPR 23 HG2 PRO 23 25.532 11.342 -1.280
195 HG3 DPR 23 HG1 PRO 23 24.024 10.408 -1.328
196 HD2 DPR 23 HD2 PRO 23 26.461 9.277 -0.738
197 HD3 DPR 23 HD1 PRO 23 25.133 8.374 -1.500
198 HAC 4G6 24 HAC 4G6 24 28.283 9.434 -9.140
199 HAB 4G6 24 HAB 4G6 24 27.639 11.027 -8.676
200 HAA 4G6 24 HAA 4G6 24 28.900 10.255 -7.686
201 HAF 4G6 24 HAF 4G6 24 25.072 10.469 -7.474
202 HAD 4G6 24 HAD 4G6 24 24.963 8.797 -8.079
203 HAE 4G6 24 HAE 4G6 24 25.700 10.066 -9.088
204 HAL 4G6 24 HAL 4G6 24 27.809 10.386 -5.767
205 HAH 4G6 24 HAH 4G6 24 27.082 7.532 -8.527
206 HAG 4G6 24 HAG 4G6 24 26.417 7.395 -6.885
207 HAI 4G6 24 HAI 4G6 24 29.065 8.249 -6.546
208 H LYS 25 HN LYS 25 31.010 4.321 -7.582
209 HA LYS 25 HA LYS 25 30.375 6.335 -5.511
210 HB2 LYS 25 HB2 LYS 25 31.325 6.693 -8.359
211 HB3 LYS 25 HB1 LYS 25 31.125 7.976 -7.184
212 HG2 LYS 25 HG2 LYS 25 33.057 5.649 -6.990
213 HG3 LYS 25 HG1 LYS 25 33.505 7.285 -7.398
214 HD2 LYS 25 HD2 LYS 25 32.446 6.267 -4.725
215 HD3 LYS 25 HD1 LYS 25 34.057 6.842 -5.061
216 HE2 LYS 25 HE2 LYS 25 31.562 8.578 -5.094
217 HE3 LYS 25 HE1 LYS 25 32.726 8.496 -3.795
218 HZ1 LYS 25 HZ1 LYS 25 34.396 9.145 -5.667
219 HZ2 LYS 25 HZ2 LYS 25 33.439 10.321 -4.912
220 HZ3 LYS 25 HZ3 LYS 25 33.003 9.740 -6.441
221 H GLU 26 HN GLU 26 31.055 1.839 -3.936
222 HA GLU 26 HA GLU 26 31.831 2.353 -6.718
223 HB2 GLU 26 HB2 GLU 26 29.040 1.620 -5.812
224 HB3 GLU 26 HB1 GLU 26 29.487 2.110 -7.439
225 HG2 GLU 26 HG2 GLU 26 30.565 -0.344 -6.023
226 HG3 GLU 26 HG1 GLU 26 29.245 -0.366 -7.183
227 H PHE 27 HN PHE 27 33.965 -1.600 -3.666
228 HA PHE 27 HA PHE 27 32.180 0.479 -2.718
229 HB2 PHE 27 HB2 PHE 27 35.046 0.606 -3.645
230 HB3 PHE 27 HB1 PHE 27 34.160 1.927 -2.903
231 HD1 PHE 27 HD1 PHE 27 36.487 1.528 -1.586
232 HD2 PHE 27 HD2 PHE 27 32.990 -0.952 -1.183
233 HE1 PHE 27 HE1 PHE 27 37.249 0.782 0.636
234 HE2 PHE 27 HE2 PHE 27 33.767 -1.678 1.020
235 HZ PHE 27 HZ PHE 27 35.888 -0.813 1.923
236 H LYS 28 HN LYS 28 30.559 -3.725 -4.593
237 HA LYS 28 HA LYS 28 32.447 -3.933 -2.517
238 HB2 LYS 28 HB2 LYS 28 34.449 -3.257 -3.816
239 HB3 LYS 28 HB1 LYS 28 33.810 -4.824 -4.303
240 HG2 LYS 28 HG2 LYS 28 32.637 -3.812 -6.193
241 HG3 LYS 28 HG1 LYS 28 33.170 -2.215 -5.703
242 HD2 LYS 28 HD2 LYS 28 34.522 -3.025 -7.575
243 HD3 LYS 28 HD1 LYS 28 35.514 -2.854 -6.136
244 HE2 LYS 28 HE2 LYS 28 34.327 -5.472 -7.095
245 HE3 LYS 28 HE1 LYS 28 35.977 -4.950 -7.424
246 HZ1 LYS 28 HZ1 LYS 28 35.683 -4.667 -4.723
247 HZ2 LYS 28 HZ2 LYS 28 36.501 -5.924 -5.522
248 HZ3 LYS 28 HZ3 LYS 28 34.875 -6.118 -5.068
249 H HIS 29 HN HIS 29 29.623 -8.194 -4.389
250 HA HIS 29 HA HIS 29 29.923 -5.722 -5.860
251 HB2 HIS 29 HB2 HIS 29 27.829 -6.123 -4.723
252 HB3 HIS 29 HB1 HIS 29 28.662 -6.329 -3.180
253 HD2 HIS 29 HD2 HIS 29 28.513 -3.997 -1.751
254 HE1 HIS 29 HE1 HIS 29 28.692 -1.279 -4.984
255 HE2 HIS 29 HE2 HIS 29 28.594 -1.488 -2.449
256 H1 ACE 30 HA2 ACE 30 30.006 -10.043 -6.609
257 H2 ACE 30 HA3 ACE 30 30.801 -10.066 -5.035
258 H3 ACE 30 HA1 ACE 30 31.767 -10.003 -6.509
Start of MODEL 9
1 HN1 NH2 0 H1 THR 1 29.396 -8.755 4.647
2 HN2 NH2 0 H2 THR 1 28.964 -10.259 5.305
3 H THR 1 HN THR 1 28.244 -6.705 8.455
4 HA THR 1 HA THR 1 29.446 -6.826 5.795
5 HB THR 1 HB THR 1 31.427 -7.627 7.025
6 HG1 THR 1 HG1 THR 1 30.975 -8.455 8.874
7 HG21 THR 1 HG21 THR 1 32.126 -5.510 7.678
8 HG22 THR 1 HG22 THR 1 30.596 -5.137 8.464
9 HG23 THR 1 HG23 THR 1 30.719 -5.087 6.704
10 H GLU 2 HN GLU 2 24.735 -3.921 7.186
11 HA GLU 2 HA GLU 2 26.718 -4.996 8.685
12 HB2 GLU 2 HB2 GLU 2 25.558 -7.185 8.471
13 HB3 GLU 2 HB1 GLU 2 24.464 -5.847 8.798
14 HG2 GLU 2 HG2 GLU 2 23.510 -7.293 7.074
15 HG3 GLU 2 HG1 GLU 2 23.911 -5.727 6.382
16 H ILE 3 HN ILE 3 27.576 -0.862 5.890
17 HA ILE 3 HA ILE 3 24.862 -1.832 6.494
18 HB ILE 3 HB ILE 3 24.843 -1.451 4.065
19 HG12 ILE 3 HG12 ILE 3 25.012 -4.388 4.810
20 HG13 ILE 3 HG11 ILE 3 23.600 -3.358 5.035
21 HG21 ILE 3 HG21 ILE 3 26.326 -2.589 2.557
22 HG22 ILE 3 HG22 ILE 3 27.032 -3.526 3.881
23 HG23 ILE 3 HG23 ILE 3 27.335 -1.795 3.775
24 HD11 ILE 3 HD11 ILE 3 23.186 -4.447 2.992
25 HD12 ILE 3 HD12 ILE 3 24.862 -4.283 2.466
26 HD13 ILE 3 HD13 ILE 3 23.810 -2.869 2.512
27 H ARG 4 HN ARG 4 26.509 2.110 4.485
28 HA ARG 4 HA ARG 4 27.997 1.222 6.803
29 HB2 ARG 4 HB2 ARG 4 25.503 2.912 7.179
30 HB3 ARG 4 HB1 ARG 4 26.300 1.999 8.445
31 HG2 ARG 4 HG2 ARG 4 27.557 4.311 6.934
32 HG3 ARG 4 HG1 ARG 4 26.830 4.420 8.521
33 HD2 ARG 4 HD2 ARG 4 29.235 2.705 7.824
34 HD3 ARG 4 HD1 ARG 4 29.266 4.213 8.709
35 HE ARG 4 HE ARG 4 28.633 1.659 9.776
36 HH11 ARG 4 HH11 ARG 4 27.796 1.532 11.876
37 HH12 ARG 4 HH12 ARG 4 27.170 2.955 12.642
38 HH21 ARG 4 HH21 ARG 4 27.840 5.026 9.946
39 HH22 ARG 4 HH22 ARG 4 27.198 4.929 11.552
40 H VAL 5 HN VAL 5 28.682 5.551 4.157
41 HA VAL 5 HA VAL 5 27.384 3.216 2.932
42 HB VAL 5 HB VAL 5 29.493 3.524 1.693
43 HG11 VAL 5 HG11 VAL 5 31.590 3.709 2.708
44 HG12 VAL 5 HG12 VAL 5 31.030 3.031 4.235
45 HG13 VAL 5 HG13 VAL 5 30.578 4.674 3.781
46 HG21 VAL 5 HG21 VAL 5 29.823 1.243 3.642
47 HG22 VAL 5 HG22 VAL 5 30.294 1.294 1.943
48 HG23 VAL 5 HG23 VAL 5 28.587 1.232 2.383
49 H8 4FU 6 HAM 4FU 6 26.140 7.488 4.003
50 H9 4FU 6 HAI 4FU 6 25.674 9.851 3.484
51 HAI 4FU 6 HAJ 4FU 6 27.393 9.607 3.868
52 H112 4FU 6 HAE 4FU 6 27.160 11.056 1.904
53 H111 4FU 6 HAF 4FU 6 26.197 9.812 1.079
54 HAG 4FU 6 HAG 4FU 6 28.537 9.733 0.319
55 H12 4FU 6 HAH 4FU 6 29.083 9.551 2.001
56 HAL 4FU 6 HAL 4FU 6 29.025 7.376 0.855
57 HAK 4FU 6 HAK 4FU 6 27.304 7.599 0.475
58 H14 4FU 6 HAN 4FU 6 28.504 7.521 3.269
59 H GLY 7 HN GLY 7 25.557 5.661 2.192
60 HA2 GLY 7 HA2 GLY 7 23.278 6.812 0.704
61 HA3 GLY 7 HA1 GLY 7 24.441 5.832 -0.169
62 H VAL 8 HN VAL 8 24.737 4.159 2.336
63 HA VAL 8 HA VAL 8 22.168 2.662 2.125
64 HB VAL 8 HB VAL 8 24.955 1.487 2.183
65 HG11 VAL 8 HG11 VAL 8 23.293 0.086 3.344
66 HG12 VAL 8 HG12 VAL 8 23.760 -0.647 1.813
67 HG13 VAL 8 HG13 VAL 8 22.220 0.196 1.953
68 HG21 VAL 8 HG21 VAL 8 24.310 0.711 -0.118
69 HG22 VAL 8 HG22 VAL 8 24.471 2.463 0.011
70 HG23 VAL 8 HG23 VAL 8 22.871 1.724 -0.007
71 H THR 9 HN THR 9 21.244 2.118 3.980
72 HA THR 9 HA THR 9 22.569 2.776 6.496
73 HB THR 9 HB THR 9 20.221 3.440 6.159
74 HG1 THR 9 HG1 THR 9 19.496 1.893 8.038
75 HG21 THR 9 HG21 THR 9 19.487 0.520 6.262
76 HG22 THR 9 HG22 THR 9 19.780 1.327 4.723
77 HG23 THR 9 HG23 THR 9 18.488 1.892 5.780
78 H ILE 10 HN ILE 10 21.379 0.937 8.194
79 HA ILE 10 HA ILE 10 23.224 -1.172 8.147
80 HB ILE 10 HB ILE 10 20.567 -0.954 9.579
81 HG12 ILE 10 HG12 ILE 10 23.418 -0.412 10.481
82 HG13 ILE 10 HG11 ILE 10 22.245 0.833 10.054
83 HG21 ILE 10 HG21 ILE 10 21.197 -3.273 9.555
84 HG22 ILE 10 HG22 ILE 10 21.677 -2.649 11.129
85 HG23 ILE 10 HG23 ILE 10 22.886 -2.883 9.868
86 HD11 ILE 10 HD11 ILE 10 22.045 -1.153 12.335
87 HD12 ILE 10 HD12 ILE 10 20.730 -0.085 11.845
88 HD13 ILE 10 HD13 ILE 10 22.235 0.596 12.463
89 H ARG 11 HN ARG 11 19.743 -1.269 7.268
90 HA ARG 11 HA ARG 11 20.231 -3.301 5.369
91 HB2 ARG 11 HB2 ARG 11 20.148 -4.577 7.435
92 HB3 ARG 11 HB1 ARG 11 18.620 -3.819 7.863
93 HG2 ARG 11 HG2 ARG 11 18.275 -6.070 6.966
94 HG3 ARG 11 HG1 ARG 11 17.547 -4.867 5.918
95 HD2 ARG 11 HD2 ARG 11 19.393 -4.960 4.379
96 HD3 ARG 11 HD1 ARG 11 20.318 -5.995 5.463
97 HE ARG 11 HE ARG 11 18.358 -6.838 3.581
98 HH11 ARG 11 HH11 ARG 11 17.632 -9.006 3.725
99 HH12 ARG 11 HH12 ARG 11 17.931 -9.912 5.171
100 HH21 ARG 11 HH21 ARG 11 19.576 -7.284 6.763
101 HH22 ARG 11 HH22 ARG 11 19.043 -8.937 6.905
102 H MET 12 HN MET 12 18.845 -3.039 3.690
103 HA MET 12 HA MET 12 16.074 -2.511 3.994
104 HB2 MET 12 HB2 MET 12 15.962 -0.266 3.022
105 HB3 MET 12 HB1 MET 12 16.860 -0.241 4.537
106 HG2 MET 12 HG2 MET 12 18.985 -0.302 3.277
107 HG3 MET 12 HG1 MET 12 18.087 -0.316 1.762
108 HE1 MET 12 HE1 MET 12 19.878 3.122 2.240
109 HE2 MET 12 HE2 MET 12 19.264 2.214 0.863
110 HE3 MET 12 HE3 MET 12 20.198 1.387 2.106
111 H ARG 13 HN ARG 13 14.986 -2.206 1.860
112 HA ARG 13 HA ARG 13 14.659 -3.014 -0.298
113 HB2 ARG 13 HB2 ARG 13 17.473 -2.005 -0.657
114 HB3 ARG 13 HB1 ARG 13 16.290 -2.267 -1.929
115 HG2 ARG 13 HG2 ARG 13 16.062 -0.239 0.302
116 HG3 ARG 13 HG1 ARG 13 16.527 0.111 -1.350
117 HD2 ARG 13 HD2 ARG 13 14.183 0.685 -1.068
118 HD3 ARG 13 HD1 ARG 13 14.305 -0.711 -2.127
119 HE ARG 13 HE ARG 13 13.021 -1.843 -0.589
120 HH11 ARG 13 HH11 ARG 13 12.187 -2.315 1.461
121 HH12 ARG 13 HH12 ARG 13 12.634 -1.338 2.820
122 HH21 ARG 13 HH21 ARG 13 14.676 0.767 0.977
123 HH22 ARG 13 HH22 ARG 13 14.040 0.403 2.547
124 H DAL 14 HN ALA 14 17.543 -3.572 -1.509
125 HA DAL 14 HA ALA 14 18.864 -5.457 -1.919
126 HB1 DAL 14 HB1 ALA 14 17.613 -7.331 -2.696
127 HB2 DAL 14 HB2 ALA 14 16.656 -5.904 -3.089
128 HB3 DAL 14 HB3 ALA 14 16.221 -6.901 -1.702
129 H SER 15 HN SER 15 18.051 -8.132 -1.130
130 HA SER 15 HA SER 15 18.775 -8.080 1.727
131 HB2 SER 15 HB2 SER 15 16.516 -8.980 1.363
132 HB3 SER 15 HB1 SER 15 17.168 -10.146 0.214
133 HG SER 15 HG SER 15 18.514 -10.153 2.576
134 H HIS 16 HN HIS 16 19.806 -8.765 -1.351
135 HA HIS 16 HA HIS 16 21.988 -10.468 -0.330
136 HB2 HIS 16 HB2 HIS 16 21.832 -11.905 -2.325
137 HB3 HIS 16 HB1 HIS 16 20.368 -11.990 -1.346
138 HD2 HIS 16 HD2 HIS 16 20.033 -8.738 -3.138
139 HE1 HIS 16 HE1 HIS 16 18.412 -11.557 -5.828
140 HE2 HIS 16 HE2 HIS 16 18.607 -9.082 -5.296
141 H DAL 17 HN ALA 17 21.521 -7.584 -1.364
142 HA DAL 17 HA ALA 17 22.867 -7.176 -3.785
143 HB1 DAL 17 HB1 ALA 17 24.815 -8.267 -2.856
144 HB2 DAL 17 HB2 ALA 17 24.728 -7.280 -1.406
145 HB3 DAL 17 HB3 ALA 17 25.138 -6.547 -2.953
146 H PHE 18 HN PHE 18 24.627 -5.140 -2.188
147 HA PHE 18 HA PHE 18 22.543 -3.047 -2.156
148 HB2 PHE 18 HB2 PHE 18 24.662 -3.344 -0.005
149 HB3 PHE 18 HB1 PHE 18 23.458 -2.066 -0.115
150 HD1 PHE 18 HD1 PHE 18 23.658 -5.810 -0.007
151 HD2 PHE 18 HD2 PHE 18 21.520 -2.296 1.173
152 HE1 PHE 18 HE1 PHE 18 22.086 -7.212 1.279
153 HE2 PHE 18 HE2 PHE 18 19.960 -3.694 2.482
154 HZ PHE 18 HZ PHE 18 20.244 -6.145 2.532
155 H TRP 19 HN TRP 19 23.197 -1.370 -3.377
156 HA TRP 19 HA TRP 19 26.059 -1.155 -4.059
157 HB2 TRP 19 HB2 TRP 19 23.634 0.150 -5.280
158 HB3 TRP 19 HB1 TRP 19 25.298 0.422 -5.797
159 HD1 TRP 19 HD1 TRP 19 23.096 -2.696 -5.108
160 HE1 TRP 19 HE1 TRP 19 23.533 -4.383 -7.020
161 HE3 TRP 19 HE3 TRP 19 26.608 -0.097 -7.799
162 HZ2 TRP 19 HZ2 TRP 19 25.146 -4.599 -9.371
163 HZ3 TRP 19 HZ3 TRP 19 27.550 -1.079 -9.875
164 HH2 TRP 19 HH2 TRP 19 26.839 -3.320 -10.652
165 H VAL 20 HN VAL 20 27.249 0.635 -3.767
166 HA VAL 20 HA VAL 20 26.050 2.978 -2.497
167 HB VAL 20 HB VAL 20 26.526 1.432 -0.625
168 HG11 VAL 20 HG11 VAL 20 28.691 0.593 -0.180
169 HG12 VAL 20 HG12 VAL 20 29.445 1.678 -1.347
170 HG13 VAL 20 HG13 VAL 20 28.461 0.327 -1.909
171 HG21 VAL 20 HG21 VAL 20 28.635 3.582 -0.506
172 HG22 VAL 20 HG22 VAL 20 27.490 3.058 0.720
173 HG23 VAL 20 HG23 VAL 20 26.932 4.037 -0.620
174 H GLN 21 HN GLN 21 27.815 4.588 -2.050
175 HA GLN 21 HA GLN 21 29.994 5.394 -2.488
176 HB2 GLN 21 HB2 GLN 21 29.717 3.985 -5.121
177 HB3 GLN 21 HB1 GLN 21 30.941 5.203 -4.794
178 HG2 GLN 21 HG2 GLN 21 31.773 3.915 -2.871
179 HG3 GLN 21 HG1 GLN 21 30.569 2.674 -3.139
180 HE21 GLN 21 HE21 GLN 21 33.767 3.336 -3.676
181 HE22 GLN 21 HE22 GLN 21 34.020 2.379 -5.055
182 H VAL 22 HN VAL 22 27.476 5.506 -5.007
183 HA VAL 22 HA VAL 22 27.283 8.372 -4.529
184 HB VAL 22 HB VAL 22 27.454 8.893 -7.013
185 HG11 VAL 22 HG11 VAL 22 29.366 9.088 -5.303
186 HG12 VAL 22 HG12 VAL 22 29.853 8.952 -6.990
187 HG13 VAL 22 HG13 VAL 22 29.954 7.549 -5.927
188 HG21 VAL 22 HG21 VAL 22 28.782 7.107 -8.297
189 HG22 VAL 22 HG22 VAL 22 27.083 6.771 -8.026
190 HG23 VAL 22 HG23 VAL 22 28.294 5.978 -7.035
191 HA DPR 23 HA PRO 23 23.034 7.744 -5.673
192 HB2 DPR 23 HB2 PRO 23 22.655 9.125 -3.830
193 HB3 DPR 23 HB1 PRO 23 21.825 7.651 -3.278
194 HG2 DPR 23 HG2 PRO 23 23.692 8.706 -1.777
195 HG3 DPR 23 HG1 PRO 23 23.645 6.952 -2.023
196 HD2 DPR 23 HD2 PRO 23 25.540 8.958 -3.174
197 HD3 DPR 23 HD1 PRO 23 25.836 7.259 -2.735
198 HAC 4G6 24 HAC 4G6 24 22.103 4.030 -8.070
199 HAB 4G6 24 HAB 4G6 24 21.422 2.535 -7.384
200 HAA 4G6 24 HAA 4G6 24 20.565 4.082 -7.174
201 HAF 4G6 24 HAF 4G6 24 20.929 4.314 -4.348
202 HAD 4G6 24 HAD 4G6 24 22.045 2.974 -3.984
203 HAE 4G6 24 HAE 4G6 24 20.681 2.722 -5.099
204 HAL 4G6 24 HAL 4G6 24 22.682 5.836 -6.657
205 HAH 4G6 24 HAH 4G6 24 23.327 1.990 -6.299
206 HAG 4G6 24 HAG 4G6 24 23.966 2.926 -4.929
207 HAI 4G6 24 HAI 4G6 24 24.760 4.567 -6.794
208 H LYS 25 HN LYS 25 27.999 2.698 -9.373
209 HA LYS 25 HA LYS 25 26.353 4.571 -8.192
210 HB2 LYS 25 HB2 LYS 25 26.400 4.173 -10.627
211 HB3 LYS 25 HB1 LYS 25 25.661 2.612 -10.377
212 HG2 LYS 25 HG2 LYS 25 23.978 4.283 -11.087
213 HG3 LYS 25 HG1 LYS 25 23.625 3.623 -9.502
214 HD2 LYS 25 HD2 LYS 25 23.235 6.034 -9.530
215 HD3 LYS 25 HD1 LYS 25 24.538 5.671 -8.435
216 HE2 LYS 25 HE2 LYS 25 24.801 6.787 -11.245
217 HE3 LYS 25 HE1 LYS 25 25.035 7.667 -9.743
218 HZ1 LYS 25 HZ1 LYS 25 27.154 7.172 -9.959
219 HZ2 LYS 25 HZ2 LYS 25 26.872 6.037 -11.188
220 HZ3 LYS 25 HZ3 LYS 25 26.766 5.576 -9.559
221 H GLU 26 HN GLU 26 30.301 1.129 -5.843
222 HA GLU 26 HA GLU 26 30.362 3.037 -7.155
223 HB2 GLU 26 HB2 GLU 26 29.281 1.429 -9.480
224 HB3 GLU 26 HB1 GLU 26 29.931 3.047 -9.524
225 HG2 GLU 26 HG2 GLU 26 31.530 0.598 -8.733
226 HG3 GLU 26 HG1 GLU 26 31.563 1.353 -10.320
227 H PHE 27 HN PHE 27 31.811 -1.608 -5.522
228 HA PHE 27 HA PHE 27 30.198 -2.177 -6.989
229 HB2 PHE 27 HB2 PHE 27 28.309 -1.151 -4.893
230 HB3 PHE 27 HB1 PHE 27 27.848 -2.052 -6.321
231 HD1 PHE 27 HD1 PHE 27 26.860 -3.287 -4.163
232 HD2 PHE 27 HD2 PHE 27 30.980 -3.476 -5.351
233 HE1 PHE 27 HE1 PHE 27 27.142 -5.348 -2.850
234 HE2 PHE 27 HE2 PHE 27 31.239 -5.553 -4.080
235 HZ PHE 27 HZ PHE 27 29.328 -6.484 -2.841
236 H LYS 28 HN LYS 28 33.142 -1.794 -2.391
237 HA LYS 28 HA LYS 28 32.151 0.600 -2.924
238 HB2 LYS 28 HB2 LYS 28 33.426 -1.242 -4.942
239 HB3 LYS 28 HB1 LYS 28 33.327 0.506 -5.107
240 HG2 LYS 28 HG2 LYS 28 34.600 0.772 -3.003
241 HG3 LYS 28 HG1 LYS 28 34.709 -0.982 -2.858
242 HD2 LYS 28 HD2 LYS 28 35.913 -1.082 -5.017
243 HD3 LYS 28 HD1 LYS 28 35.826 0.676 -5.139
244 HE2 LYS 28 HE2 LYS 28 37.187 -0.861 -2.906
245 HE3 LYS 28 HE1 LYS 28 38.011 -0.051 -4.237
246 HZ1 LYS 28 HZ1 LYS 28 38.066 1.506 -2.547
247 HZ2 LYS 28 HZ2 LYS 28 36.502 1.134 -1.999
248 HZ3 LYS 28 HZ3 LYS 28 36.715 1.999 -3.446
249 H HIS 29 HN HIS 29 32.140 -1.921 0.508
250 HA HIS 29 HA HIS 29 32.025 -3.922 -1.657
251 HB2 HIS 29 HB2 HIS 29 29.576 -4.060 -1.371
252 HB3 HIS 29 HB1 HIS 29 30.442 -4.666 0.036
253 HD2 HIS 29 HD2 HIS 29 27.498 -2.468 -0.516
254 HE1 HIS 29 HE1 HIS 29 29.336 -0.921 2.943
255 HE2 HIS 29 HE2 HIS 29 27.233 -0.873 1.530
256 H1 ACE 30 HA2 ACE 30 34.167 -3.686 2.442
257 H2 ACE 30 HA3 ACE 30 33.688 -2.046 2.004
258 H3 ACE 30 HA1 ACE 30 35.168 -2.739 1.342
Start of MODEL 10
1 HN1 NH2 0 H1 THR 1 19.900 -6.497 2.203
2 HN2 NH2 0 H2 THR 1 21.327 -7.215 1.632
3 H THR 1 HN THR 1 21.939 -2.943 4.456
4 HA THR 1 HA THR 1 20.103 -5.024 4.197
5 HB THR 1 HB THR 1 20.990 -3.042 2.093
6 HG1 THR 1 HG1 THR 1 18.704 -2.360 2.930
7 HG21 THR 1 HG21 THR 1 18.706 -5.003 2.235
8 HG22 THR 1 HG22 THR 1 19.847 -4.736 0.917
9 HG23 THR 1 HG23 THR 1 18.599 -3.538 1.259
10 H GLU 2 HN GLU 2 23.701 -2.212 4.896
11 HA GLU 2 HA GLU 2 24.249 -4.523 6.644
12 HB2 GLU 2 HB2 GLU 2 22.071 -2.457 6.905
13 HB3 GLU 2 HB1 GLU 2 22.267 -3.860 7.945
14 HG2 GLU 2 HG2 GLU 2 24.260 -1.600 7.616
15 HG3 GLU 2 HG1 GLU 2 23.209 -1.847 9.007
16 H ILE 3 HN ILE 3 26.986 -0.572 5.654
17 HA ILE 3 HA ILE 3 25.300 -1.686 3.533
18 HB ILE 3 HB ILE 3 27.109 -3.475 3.175
19 HG12 ILE 3 HG12 ILE 3 29.436 -2.664 3.414
20 HG13 ILE 3 HG11 ILE 3 28.865 -1.238 4.257
21 HG21 ILE 3 HG21 ILE 3 26.736 -2.243 1.269
22 HG22 ILE 3 HG22 ILE 3 28.365 -1.669 1.624
23 HG23 ILE 3 HG23 ILE 3 26.969 -0.696 2.085
24 HD11 ILE 3 HD11 ILE 3 28.426 -4.072 5.233
25 HD12 ILE 3 HD12 ILE 3 28.106 -2.574 6.122
26 HD13 ILE 3 HD13 ILE 3 29.758 -3.044 5.748
27 H ARG 4 HN ARG 4 25.180 3.301 4.162
28 HA ARG 4 HA ARG 4 27.570 1.862 5.154
29 HB2 ARG 4 HB2 ARG 4 26.078 2.957 6.815
30 HB3 ARG 4 HB1 ARG 4 24.731 1.991 6.229
31 HG2 ARG 4 HG2 ARG 4 25.853 -0.056 6.942
32 HG3 ARG 4 HG1 ARG 4 27.263 0.869 7.451
33 HD2 ARG 4 HD2 ARG 4 25.865 2.083 9.072
34 HD3 ARG 4 HD1 ARG 4 24.454 1.177 8.540
35 HE ARG 4 HE ARG 4 25.153 -0.529 9.914
36 HH11 ARG 4 HH11 ARG 4 26.657 -1.729 11.125
37 HH12 ARG 4 HH12 ARG 4 28.318 -1.239 11.163
38 HH21 ARG 4 HH21 ARG 4 27.833 1.500 9.095
39 HH22 ARG 4 HH22 ARG 4 28.982 0.589 10.017
40 H VAL 5 HN VAL 5 28.388 5.760 2.852
41 HA VAL 5 HA VAL 5 25.598 5.276 3.147
42 HB VAL 5 HB VAL 5 25.676 5.226 0.691
43 HG11 VAL 5 HG11 VAL 5 28.123 4.558 0.627
44 HG12 VAL 5 HG12 VAL 5 27.087 3.678 -0.498
45 HG13 VAL 5 HG13 VAL 5 27.608 2.914 1.003
46 HG21 VAL 5 HG21 VAL 5 24.528 3.166 0.414
47 HG22 VAL 5 HG22 VAL 5 24.286 3.568 2.114
48 HG23 VAL 5 HG23 VAL 5 25.492 2.365 1.656
49 H8 4FU 6 HAM 4FU 6 28.768 10.124 2.544
50 H9 4FU 6 HAI 4FU 6 25.887 9.372 1.932
51 HAI 4FU 6 HAJ 4FU 6 26.487 10.995 2.331
52 H112 4FU 6 HAE 4FU 6 27.933 10.985 0.347
53 H111 4FU 6 HAF 4FU 6 26.234 10.716 -0.105
54 HAG 4FU 6 HAG 4FU 6 26.644 8.284 -0.219
55 H12 4FU 6 HAH 4FU 6 27.750 9.171 -1.294
56 HAL 4FU 6 HAL 4FU 6 29.514 9.064 0.410
57 HAK 4FU 6 HAK 4FU 6 28.952 7.430 -0.008
58 H14 4FU 6 HAN 4FU 6 29.198 7.707 2.437
59 H GLY 7 HN GLY 7 26.049 8.113 3.487
60 HA2 GLY 7 HA2 GLY 7 26.595 7.302 5.996
61 HA3 GLY 7 HA1 GLY 7 26.200 8.997 6.252
62 H VAL 8 HN VAL 8 24.614 7.742 3.602
63 HA VAL 8 HA VAL 8 22.029 8.072 4.708
64 HB VAL 8 HB VAL 8 22.884 6.570 2.219
65 HG11 VAL 8 HG11 VAL 8 20.635 5.934 2.829
66 HG12 VAL 8 HG12 VAL 8 20.521 7.096 1.508
67 HG13 VAL 8 HG13 VAL 8 20.200 7.609 3.164
68 HG21 VAL 8 HG21 VAL 8 23.513 9.052 2.466
69 HG22 VAL 8 HG22 VAL 8 21.780 9.380 2.421
70 HG23 VAL 8 HG23 VAL 8 22.570 8.618 1.039
71 H THR 9 HN THR 9 20.657 6.649 5.694
72 HA THR 9 HA THR 9 21.725 4.240 6.749
73 HB THR 9 HB THR 9 19.450 3.830 7.602
74 HG1 THR 9 HG1 THR 9 18.170 5.962 7.100
75 HG21 THR 9 HG21 THR 9 19.361 5.849 9.005
76 HG22 THR 9 HG22 THR 9 20.470 6.658 7.897
77 HG23 THR 9 HG23 THR 9 21.008 5.247 8.812
78 H ILE 10 HN ILE 10 20.870 2.142 6.537
79 HA ILE 10 HA ILE 10 19.270 1.276 4.341
80 HB ILE 10 HB ILE 10 21.270 2.096 3.098
81 HG12 ILE 10 HG12 ILE 10 21.061 -0.934 3.089
82 HG13 ILE 10 HG11 ILE 10 19.936 0.134 2.262
83 HG21 ILE 10 HG21 ILE 10 22.635 1.087 5.311
84 HG22 ILE 10 HG22 ILE 10 23.389 1.599 3.800
85 HG23 ILE 10 HG23 ILE 10 23.006 -0.101 4.057
86 HD11 ILE 10 HD11 ILE 10 21.850 -0.837 0.860
87 HD12 ILE 10 HD12 ILE 10 22.915 0.236 1.764
88 HD13 ILE 10 HD13 ILE 10 21.623 0.908 0.776
89 H ARG 11 HN ARG 11 18.891 0.569 6.696
90 HA ARG 11 HA ARG 11 20.337 -1.459 7.951
91 HB2 ARG 11 HB2 ARG 11 18.289 -1.761 9.287
92 HB3 ARG 11 HB1 ARG 11 18.758 -0.073 9.127
93 HG2 ARG 11 HG2 ARG 11 17.137 0.220 7.295
94 HG3 ARG 11 HG1 ARG 11 16.647 -1.464 7.447
95 HD2 ARG 11 HD2 ARG 11 15.092 -0.014 8.662
96 HD3 ARG 11 HD1 ARG 11 15.967 -1.051 9.782
97 HE ARG 11 HE ARG 11 17.376 1.377 9.509
98 HH11 ARG 11 HH11 ARG 11 17.181 2.941 11.143
99 HH12 ARG 11 HH12 ARG 11 15.826 2.895 12.222
100 HH21 ARG 11 HH21 ARG 11 14.414 0.089 10.752
101 HH22 ARG 11 HH22 ARG 11 14.260 1.280 12.000
102 H MET 12 HN MET 12 17.725 -3.009 8.281
103 HA MET 12 HA MET 12 17.126 -5.157 7.747
104 HB2 MET 12 HB2 MET 12 16.065 -5.362 5.551
105 HB3 MET 12 HB1 MET 12 15.614 -3.862 6.349
106 HG2 MET 12 HG2 MET 12 17.258 -2.632 4.980
107 HG3 MET 12 HG1 MET 12 17.732 -4.132 4.188
108 HE1 MET 12 HE1 MET 12 14.904 -5.223 2.095
109 HE2 MET 12 HE2 MET 12 14.522 -5.518 3.789
110 HE3 MET 12 HE3 MET 12 16.182 -5.682 3.227
111 H ARG 13 HN ARG 13 17.287 -6.712 5.509
112 HA ARG 13 HA ARG 13 20.196 -7.134 5.108
113 HB2 ARG 13 HB2 ARG 13 19.798 -9.545 5.299
114 HB3 ARG 13 HB1 ARG 13 19.372 -8.696 6.786
115 HG2 ARG 13 HG2 ARG 13 17.007 -8.690 6.117
116 HG3 ARG 13 HG1 ARG 13 17.418 -9.531 4.625
117 HD2 ARG 13 HD2 ARG 13 17.878 -10.588 7.427
118 HD3 ARG 13 HD1 ARG 13 16.609 -11.119 6.328
119 HE ARG 13 HE ARG 13 19.322 -11.983 6.298
120 HH11 ARG 13 HH11 ARG 13 20.045 -13.225 4.542
121 HH12 ARG 13 HH12 ARG 13 19.112 -13.280 3.083
122 HH21 ARG 13 HH21 ARG 13 16.633 -11.171 4.269
123 HH22 ARG 13 HH22 ARG 13 17.185 -12.120 2.929
124 H DAL 14 HN ALA 14 20.362 -9.108 3.458
125 HA DAL 14 HA ALA 14 20.176 -8.388 0.910
126 HB1 DAL 14 HB1 ALA 14 17.894 -9.496 0.180
127 HB2 DAL 14 HB2 ALA 14 17.914 -7.826 0.739
128 HB3 DAL 14 HB3 ALA 14 17.409 -9.113 1.833
129 H SER 15 HN SER 15 19.495 -10.390 -0.638
130 HA SER 15 HA SER 15 19.634 -12.989 0.370
131 HB2 SER 15 HB2 SER 15 18.914 -12.506 -1.917
132 HB3 SER 15 HB1 SER 15 20.538 -11.953 -2.318
133 HG SER 15 HG SER 15 19.555 -14.446 -2.283
134 H HIS 16 HN HIS 16 22.192 -10.872 -0.809
135 HA HIS 16 HA HIS 16 24.120 -12.004 0.957
136 HB2 HIS 16 HB2 HIS 16 25.604 -12.995 -0.743
137 HB3 HIS 16 HB1 HIS 16 24.053 -13.831 -0.666
138 HD2 HIS 16 HD2 HIS 16 26.255 -12.476 -3.367
139 HE1 HIS 16 HE1 HIS 16 22.345 -12.076 -4.909
140 HE2 HIS 16 HE2 HIS 16 24.815 -12.026 -5.499
141 H DAL 17 HN ALA 17 22.994 -9.436 -0.382
142 HA DAL 17 HA ALA 17 25.547 -8.226 -1.257
143 HB1 DAL 17 HB1 ALA 17 25.049 -6.268 0.249
144 HB2 DAL 17 HB2 ALA 17 25.511 -7.745 1.094
145 HB3 DAL 17 HB3 ALA 17 23.816 -7.259 1.027
146 H PHE 18 HN PHE 18 25.042 -5.771 -1.767
147 HA PHE 18 HA PHE 18 22.935 -5.828 -3.788
148 HB2 PHE 18 HB2 PHE 18 21.857 -3.781 -2.982
149 HB3 PHE 18 HB1 PHE 18 21.732 -5.066 -1.790
150 HD1 PHE 18 HD1 PHE 18 23.998 -2.156 -2.661
151 HD2 PHE 18 HD2 PHE 18 22.277 -4.581 0.434
152 HE1 PHE 18 HE1 PHE 18 25.044 -0.737 -0.970
153 HE2 PHE 18 HE2 PHE 18 23.321 -3.124 2.132
154 HZ PHE 18 HZ PHE 18 24.693 -1.201 1.412
155 H TRP 19 HN TRP 19 22.972 -3.393 -4.776
156 HA TRP 19 HA TRP 19 25.839 -2.657 -5.091
157 HB2 TRP 19 HB2 TRP 19 25.340 -2.160 -7.453
158 HB3 TRP 19 HB1 TRP 19 25.037 -3.858 -7.082
159 HD1 TRP 19 HD1 TRP 19 22.317 -4.257 -6.200
160 HE1 TRP 19 HE1 TRP 19 20.204 -3.380 -7.395
161 HE3 TRP 19 HE3 TRP 19 24.362 -0.488 -8.984
162 HZ2 TRP 19 HZ2 TRP 19 19.478 -1.348 -9.273
163 HZ3 TRP 19 HZ3 TRP 19 22.943 0.897 -10.456
164 HH2 TRP 19 HH2 TRP 19 20.503 0.475 -10.607
165 H VAL 20 HN VAL 20 26.303 -0.444 -5.055
166 HA VAL 20 HA VAL 20 24.049 1.444 -5.226
167 HB VAL 20 HB VAL 20 24.134 0.824 -2.840
168 HG11 VAL 20 HG11 VAL 20 26.905 2.024 -2.866
169 HG12 VAL 20 HG12 VAL 20 26.616 0.289 -2.908
170 HG13 VAL 20 HG13 VAL 20 26.099 1.239 -1.515
171 HG21 VAL 20 HG21 VAL 20 23.655 3.195 -3.702
172 HG22 VAL 20 HG22 VAL 20 25.304 3.579 -3.213
173 HG23 VAL 20 HG23 VAL 20 24.129 3.059 -2.008
174 H GLN 21 HN GLN 21 24.638 3.575 -5.640
175 HA GLN 21 HA GLN 21 27.509 4.161 -6.076
176 HB2 GLN 21 HB2 GLN 21 25.281 4.650 -8.077
177 HB3 GLN 21 HB1 GLN 21 26.958 5.157 -8.259
178 HG2 GLN 21 HG2 GLN 21 27.681 2.790 -8.177
179 HG3 GLN 21 HG1 GLN 21 26.005 2.286 -7.999
180 HE21 GLN 21 HE21 GLN 21 28.377 2.574 -10.301
181 HE22 GLN 21 HE22 GLN 21 27.405 2.789 -11.675
182 H VAL 22 HN VAL 22 28.018 6.126 -5.143
183 HA VAL 22 HA VAL 22 26.005 8.248 -5.141
184 HB VAL 22 HB VAL 22 26.217 8.571 -2.619
185 HG11 VAL 22 HG11 VAL 22 24.338 7.280 -3.804
186 HG12 VAL 22 HG12 VAL 22 24.584 6.918 -2.096
187 HG13 VAL 22 HG13 VAL 22 25.191 5.821 -3.325
188 HG21 VAL 22 HG21 VAL 22 28.309 7.373 -2.282
189 HG22 VAL 22 HG22 VAL 22 27.596 5.882 -2.897
190 HG23 VAL 22 HG23 VAL 22 27.037 6.561 -1.371
191 HA DPR 23 HA PRO 23 29.622 10.760 -3.730
192 HB2 DPR 23 HB2 PRO 23 28.265 12.525 -3.135
193 HB3 DPR 23 HB1 PRO 23 28.785 13.170 -4.706
194 HG2 DPR 23 HG2 PRO 23 26.218 12.854 -4.166
195 HG3 DPR 23 HG1 PRO 23 26.862 12.472 -5.773
196 HD2 DPR 23 HD2 PRO 23 25.997 10.604 -3.601
197 HD3 DPR 23 HD1 PRO 23 25.895 10.419 -5.367
198 HAC 4G6 24 HAC 4G6 24 33.230 11.719 -7.936
199 HAB 4G6 24 HAB 4G6 24 31.978 12.596 -7.024
200 HAA 4G6 24 HAA 4G6 24 33.301 11.779 -6.158
201 HAF 4G6 24 HAF 4G6 24 31.503 9.546 -8.876
202 HAD 4G6 24 HAD 4G6 24 30.991 11.248 -8.778
203 HAE 4G6 24 HAE 4G6 24 29.999 9.973 -8.030
204 HAL 4G6 24 HAL 4G6 24 31.193 10.113 -4.925
205 HAH 4G6 24 HAH 4G6 24 33.328 9.369 -5.884
206 HAG 4G6 24 HAG 4G6 24 33.413 9.229 -7.653
207 HAI 4G6 24 HAI 4G6 24 31.381 7.803 -5.955
208 H LYS 25 HN LYS 25 32.207 4.294 -6.469
209 HA LYS 25 HA LYS 25 31.523 5.246 -8.383
210 HB2 LYS 25 HB2 LYS 25 29.221 5.226 -7.578
211 HB3 LYS 25 HB1 LYS 25 29.501 6.692 -6.682
212 HG2 LYS 25 HG2 LYS 25 28.310 7.168 -8.771
213 HG3 LYS 25 HG1 LYS 25 29.870 7.958 -8.713
214 HD2 LYS 25 HD2 LYS 25 29.441 7.041 -10.933
215 HD3 LYS 25 HD1 LYS 25 30.818 6.250 -10.214
216 HE2 LYS 25 HE2 LYS 25 28.012 5.113 -10.313
217 HE3 LYS 25 HE1 LYS 25 29.297 4.687 -11.426
218 HZ1 LYS 25 HZ1 LYS 25 29.486 3.011 -9.943
219 HZ2 LYS 25 HZ2 LYS 25 28.929 3.921 -8.630
220 HZ3 LYS 25 HZ3 LYS 25 30.516 4.115 -9.188
221 H GLU 26 HN GLU 26 30.969 2.858 -4.780
222 HA GLU 26 HA GLU 26 31.775 5.113 -3.069
223 HB2 GLU 26 HB2 GLU 26 33.456 3.814 -5.222
224 HB3 GLU 26 HB1 GLU 26 33.907 5.227 -4.279
225 HG2 GLU 26 HG2 GLU 26 33.387 2.467 -3.135
226 HG3 GLU 26 HG1 GLU 26 34.980 3.140 -3.450
227 H PHE 27 HN PHE 27 31.657 0.513 -3.269
228 HA PHE 27 HA PHE 27 29.047 1.702 -3.646
229 HB2 PHE 27 HB2 PHE 27 28.597 1.986 -1.255
230 HB3 PHE 27 HB1 PHE 27 28.617 0.297 -1.720
231 HD1 PHE 27 HD1 PHE 27 28.716 0.544 0.969
232 HD2 PHE 27 HD2 PHE 27 32.054 1.162 -1.674
233 HE1 PHE 27 HE1 PHE 27 30.283 0.051 2.804
234 HE2 PHE 27 HE2 PHE 27 33.593 0.677 0.166
235 HZ PHE 27 HZ PHE 27 32.707 0.123 2.394
236 H LYS 28 HN LYS 28 30.098 -3.229 -5.227
237 HA LYS 28 HA LYS 28 32.071 -1.547 -3.925
238 HB2 LYS 28 HB2 LYS 28 30.832 -1.337 -6.667
239 HB3 LYS 28 HB1 LYS 28 31.984 -0.191 -6.007
240 HG2 LYS 28 HG2 LYS 28 33.135 -1.741 -7.493
241 HG3 LYS 28 HG1 LYS 28 33.672 -2.006 -5.843
242 HD2 LYS 28 HD2 LYS 28 32.245 -3.990 -5.672
243 HD3 LYS 28 HD1 LYS 28 31.600 -3.695 -7.286
244 HE2 LYS 28 HE2 LYS 28 33.879 -3.954 -8.208
245 HE3 LYS 28 HE1 LYS 28 34.498 -4.245 -6.583
246 HZ1 LYS 28 HZ1 LYS 28 33.314 -6.072 -8.357
247 HZ2 LYS 28 HZ2 LYS 28 32.335 -5.949 -6.976
248 HZ3 LYS 28 HZ3 LYS 28 33.975 -6.365 -6.823
249 H HIS 29 HN HIS 29 31.584 -6.633 -3.007
250 HA HIS 29 HA HIS 29 29.565 -5.086 -4.456
251 HB2 HIS 29 HB2 HIS 29 28.716 -6.265 -2.572
252 HB3 HIS 29 HB1 HIS 29 29.980 -5.627 -1.521
253 HD2 HIS 29 HD2 HIS 29 28.722 -3.768 0.043
254 HE1 HIS 29 HE1 HIS 29 26.300 -1.993 -2.900
255 HE2 HIS 29 HE2 HIS 29 27.020 -1.861 -0.472
256 H1 ACE 30 HA2 ACE 30 33.474 -7.432 -4.832
257 H2 ACE 30 HA3 ACE 30 32.490 -8.230 -6.060
258 H3 ACE 30 HA1 ACE 30 32.210 -8.564 -4.351